#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b39 s PRO 31 N 0.00 1.46 0.00 -0.78 0.04 -1.26 -2.24 135.00 132.23 2b39 s PRO 31 Ca 0.00 1.34 -0.02 0.00 0.04 0.00 0.00 61.00 62.36 2b39 s PRO 31 Cb 0.00 -1.79 -0.01 0.00 0.04 0.00 0.00 34.50 32.73 2b39 s PRO 31 CO 0.00 -2.25 1.03 -0.97 0.04 0.00 0.00 177.00 174.85 2b39 h ASN 32 N -1.59 -0.07 -3.34 6.66 -0.73 0.42 -3.43 115.58 113.51 2b39 h ASN 32 Ca -0.44 0.00 -0.66 0.00 1.87 0.00 0.00 56.30 57.08 2b39 h ASN 32 Cb 1.26 0.02 -0.26 0.00 0.27 0.00 0.00 38.32 39.60 2b39 h ASN 32 CO 0.46 -0.05 -0.76 -0.63 -0.37 0.00 0.00 177.43 176.08 2b39 s ILE 33 N -3.18 3.10 0.49 2.57 1.09 -1.26 -3.33 121.20 120.68 2b39 s ILE 33 Ca -0.01 -0.65 0.07 0.00 -1.10 0.00 0.00 60.65 58.96 2b39 s ILE 33 Cb 0.00 -2.30 0.04 0.00 -1.06 0.00 0.00 42.46 39.14 2b39 s ILE 33 CO 0.04 0.52 0.68 -0.76 -0.10 0.00 0.00 174.94 175.32 2b39 s LEU 34 N 0.32 3.44 0.10 2.97 1.43 0.43 -4.92 118.68 122.45 2b39 s LEU 34 Ca -0.10 -0.46 0.09 0.00 -1.03 0.00 0.00 54.13 52.63 2b39 s LEU 34 Cb -0.16 -2.41 -0.04 0.00 0.03 0.00 0.00 46.19 43.62 2b39 s LEU 34 CO 0.05 -1.01 -0.24 -0.60 0.23 0.00 0.00 176.35 174.78 2b39 s ARG 35 N -4.53 1.30 0.28 1.70 3.52 -1.26 -1.15 118.95 118.81 2b39 s ARG 35 Ca 0.58 -1.21 -0.17 0.00 -0.13 0.00 0.00 55.73 54.79 2b39 s ARG 35 Cb -0.09 -1.64 -0.09 0.00 -1.56 0.00 0.00 34.95 31.57 2b39 s ARG 35 CO 0.36 0.39 0.74 -0.51 -0.81 0.00 0.00 175.30 175.47 2b39 s LEU 36 N -1.85 4.19 -1.58 -0.88 1.43 -1.26 -3.76 118.68 114.96 2b39 s LEU 36 Ca 0.10 1.36 0.00 0.00 -1.03 0.00 0.00 54.13 54.56 2b39 s LEU 36 Cb -0.10 -3.86 0.00 0.00 0.03 0.00 0.00 46.19 42.26 2b39 s LEU 36 CO 0.05 -0.10 0.00 -0.62 0.23 0.00 0.00 176.35 175.91 2b39 n GLU 37 N 0.14 -1.54 -4.82 1.70 -0.58 0.11 -4.26 120.64 111.39 2b39 n GLU 37 Ca 0.01 0.88 -0.27 0.00 -0.42 0.00 0.00 57.16 57.36 2b39 n GLU 37 Cb 0.52 -5.27 -0.15 0.00 -0.57 0.00 0.00 31.44 25.97 2b39 n GLU 37 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2b39 s SER 38 N -2.25 2.65 -0.45 1.62 1.04 -1.25 -4.94 113.70 110.11 2b39 s SER 38 Ca 0.00 -0.50 -0.28 0.00 0.48 0.00 0.00 55.95 55.65 2b39 s SER 38 Cb 0.00 -0.25 0.00 0.00 0.10 0.00 0.00 66.02 65.87 2b39 s SER 38 CO 0.00 0.21 1.55 -1.61 0.98 0.00 0.00 173.24 174.38 2b39 s GLU 39 N -1.00 3.34 0.08 4.02 2.02 -1.26 -4.28 118.70 121.63 2b39 s GLU 39 Ca 0.09 0.89 0.04 0.00 0.02 0.00 0.00 54.97 56.01 2b39 s GLU 39 Cb -0.09 -4.13 -0.04 0.00 0.10 0.00 0.00 34.13 29.97 2b39 s GLU 39 CO 0.01 -1.86 0.05 -1.21 0.02 0.00 0.00 175.26 172.27 2b39 s GLU 40 N 5.49 2.75 -0.07 1.61 0.41 -0.59 -4.90 118.70 123.40 2b39 s GLU 40 Ca 0.64 -0.75 0.04 0.00 -0.41 0.00 0.00 54.97 54.49 2b39 s GLU 40 Cb -0.15 -2.65 -0.02 0.00 -1.78 0.00 0.00 34.13 29.53 2b39 s GLU 40 CO 0.30 0.56 -0.17 0.95 -0.49 0.00 0.00 175.26 176.40 2b39 s THR 41 N -1.36 2.74 -0.06 3.63 -4.23 -1.26 0.20 115.64 115.30 2b39 s THR 41 Ca 0.28 -0.82 0.04 0.00 -1.18 0.00 0.00 61.69 60.01 2b39 s THR 41 Cb -0.12 -2.07 -0.02 0.00 1.34 0.00 0.00 72.50 71.63 2b39 s THR 41 CO 0.21 0.57 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.99 2b39 s VAL 42 N -0.30 2.78 -0.30 2.29 1.01 0.90 -4.65 120.40 122.14 2b39 s VAL 42 Ca 0.02 -0.82 -0.16 0.00 0.00 0.00 0.00 61.98 61.02 2b39 s VAL 42 Cb -0.13 -2.08 -0.02 0.00 0.00 0.00 0.00 36.38 34.15 2b39 s VAL 42 CO 0.03 0.58 0.43 -0.69 0.00 0.00 0.00 175.10 175.44 2b39 s VAL 43 N -0.44 5.12 -0.03 2.92 1.01 -1.26 0.03 120.40 127.74 2b39 s VAL 43 Ca 0.05 0.51 -0.02 0.00 0.00 0.00 0.00 61.98 62.52 2b39 s VAL 43 Cb -0.12 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 2b39 s VAL 43 CO 0.02 0.03 0.09 -0.76 0.00 0.00 0.00 175.10 174.48 2b39 s LEU 44 N 2.18 3.99 -0.10 3.92 1.43 0.53 -4.78 118.68 125.85 2b39 s LEU 44 Ca 0.16 0.22 -0.30 0.00 -1.03 0.00 0.00 54.13 53.19 2b39 s LEU 44 Cb -0.16 -2.23 0.07 0.00 0.03 0.00 0.00 46.19 43.91 2b39 s LEU 44 CO 0.11 0.30 0.70 -1.61 0.23 0.00 0.00 176.35 176.08 2b39 s GLU 45 N -1.55 1.00 -0.40 1.70 2.02 -1.26 -2.82 118.70 117.39 2b39 s GLU 45 Ca 0.21 0.41 0.01 0.00 0.02 0.00 0.00 54.97 55.62 2b39 s GLU 45 Cb -0.12 0.48 0.14 0.00 0.10 0.00 0.00 34.13 34.73 2b39 s GLU 45 CO 0.12 -0.28 0.23 0.00 0.02 0.00 0.00 175.26 175.35 2b39 s ALA 46 N -0.87 1.54 -0.14 5.21 0.00 -1.04 -5.03 121.76 121.42 2b39 s ALA 46 Ca -0.09 -2.25 -0.29 0.00 0.00 0.00 0.00 51.96 49.34 2b39 s ALA 46 Cb -0.01 -1.74 -0.06 0.00 0.00 0.00 0.00 23.12 21.31 2b39 s ALA 46 CO 0.08 -2.08 2.11 -1.01 0.00 0.00 0.00 175.76 174.85 2b39 s HIS 47 N 0.66 1.25 -0.35 0.00 0.09 -1.26 -0.87 115.29 114.81 2b39 s HIS 47 Ca 0.19 0.22 -0.00 0.00 -0.00 0.00 0.00 55.06 55.47 2b39 s HIS 47 Cb -0.22 -4.04 -0.00 0.00 -0.00 0.00 0.00 32.58 28.32 2b39 s HIS 47 CO -0.01 -4.49 0.29 0.41 -0.00 0.00 0.00 174.74 170.94 2b39 n GLY 48 N 5.32 0.21 3.85 -2.22 0.00 -1.26 -5.03 105.19 106.06 2b39 n GLY 48 Ca 0.26 -0.31 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 2b39 n GLY 48 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b39 s GLY 49 N -3.39 1.61 0.00 -0.02 0.00 -0.05 -5.09 107.32 100.38 2b39 s GLY 49 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 44.72 44.30 2b39 s GLY 49 CO 0.21 0.03 0.00 0.61 0.00 0.00 0.00 173.10 173.95 2b39 n GLN 50 N -3.36 0.00 0.04 2.90 10.64 -1.26 -5.02 117.38 121.32 2b39 n GLN 50 Ca 0.07 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.24 2b39 n GLN 50 Cb 0.58 -0.02 0.00 0.00 -0.86 0.00 0.00 30.24 29.95 2b39 n GLN 50 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2b39 n GLY 51 N 3.29 -0.05 2.88 2.61 0.00 -1.26 -4.99 105.19 107.66 2b39 n GLY 51 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 2b39 n GLY 51 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2b39 s THR 52 N -2.00 -0.11 -0.23 2.61 -4.23 -1.26 -3.39 115.64 107.03 2b39 s THR 52 Ca 0.00 0.24 0.00 0.00 -1.18 0.00 0.00 61.69 60.76 2b39 s THR 52 Cb 0.00 -0.24 0.06 0.00 1.34 0.00 0.00 72.50 73.66 2b39 s THR 52 CO 0.00 0.10 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.50 2b39 s ILE 53 N 1.52 1.45 0.28 2.99 1.09 -0.91 -5.04 121.20 122.57 2b39 s ILE 53 Ca -0.05 -1.15 -0.29 0.00 -1.10 0.00 0.00 60.65 58.06 2b39 s ILE 53 Cb -0.12 -1.72 -0.09 0.00 -1.06 0.00 0.00 42.46 39.46 2b39 s ILE 53 CO -0.06 -0.10 1.00 -1.58 -0.10 0.00 0.00 174.94 174.11 2b39 s GLN 54 N 1.44 4.70 0.43 2.79 0.74 -1.26 -0.03 119.66 128.46 2b39 s GLN 54 Ca -0.05 1.58 0.06 0.00 0.05 0.00 0.00 55.36 57.00 2b39 s GLN 54 Cb -0.19 -3.14 -0.06 0.00 1.10 0.00 0.00 33.01 30.73 2b39 s GLN 54 CO -0.06 0.33 0.03 0.08 -0.55 0.00 0.00 175.29 175.12 2b39 s VAL 55 N -1.26 1.84 -0.22 1.34 1.01 -0.09 -2.74 120.40 120.29 2b39 s VAL 55 Ca 0.45 -1.97 -0.30 0.00 0.00 0.00 0.00 61.98 60.15 2b39 s VAL 55 Cb -0.27 -2.81 0.16 0.00 0.00 0.00 0.00 36.38 33.45 2b39 s VAL 55 CO 0.34 0.00 1.18 -0.94 0.00 0.00 0.00 175.10 175.68 2b39 s SER 56 N -3.77 -0.20 0.09 3.32 1.04 -0.16 -3.73 113.70 110.29 2b39 s SER 56 Ca 0.29 0.19 0.05 0.00 0.48 0.00 0.00 55.95 56.96 2b39 s SER 56 Cb 0.08 0.17 -0.03 0.00 0.10 0.00 0.00 66.02 66.33 2b39 s SER 56 CO 0.15 -0.20 -0.13 -0.69 0.98 0.00 0.00 173.24 173.36 2b39 s VAL 57 N -1.26 1.08 -0.25 5.02 1.01 -0.38 -1.09 120.40 124.52 2b39 s VAL 57 Ca 0.04 -1.49 -0.02 0.00 0.00 0.00 0.00 61.98 60.51 2b39 s VAL 57 Cb -0.01 -1.23 0.12 0.00 0.00 0.00 0.00 36.38 35.25 2b39 s VAL 57 CO -0.04 -0.38 0.25 0.42 0.00 0.00 0.00 175.10 175.36 2b39 s THR 58 N -1.82 -0.35 0.60 3.92 -4.23 -1.20 -3.55 115.64 109.01 2b39 s THR 58 Ca 0.02 -0.35 -0.17 0.00 -1.18 0.00 0.00 61.69 60.01 2b39 s THR 58 Cb -0.07 -0.86 -0.03 0.00 1.34 0.00 0.00 72.50 72.88 2b39 s THR 58 CO 0.02 -0.38 1.09 -0.69 -0.54 0.00 0.00 174.62 174.12 2b39 s VAL 59 N 2.33 3.47 0.10 2.29 1.01 -1.04 -0.28 120.40 128.28 2b39 s VAL 59 Ca 0.09 0.75 -0.02 0.00 0.00 0.00 0.00 61.98 62.80 2b39 s VAL 59 Cb -0.15 -3.27 0.01 0.00 0.00 0.00 0.00 36.38 32.97 2b39 s VAL 59 CO -0.25 -0.35 0.15 1.41 0.00 0.00 0.00 175.10 176.06 2b39 n HIS 60 N -1.92 -0.91 -2.10 5.22 8.25 0.03 -1.95 115.22 121.84 2b39 n HIS 60 Ca 0.10 -0.58 -0.27 0.00 -0.26 0.00 0.00 57.72 56.70 2b39 n HIS 60 Cb 0.52 0.18 0.07 0.00 1.12 0.00 0.00 29.99 31.87 2b39 n HIS 60 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2b39 s ASP 61 N -1.56 4.94 0.35 0.41 1.01 -1.26 -2.64 116.67 117.91 2b39 s ASP 61 Ca 0.07 0.68 0.18 0.00 0.71 0.00 0.00 52.55 54.19 2b39 s ASP 61 Cb -0.01 -1.37 0.38 0.00 1.01 0.00 0.00 42.92 42.94 2b39 s ASP 61 CO 0.05 -1.56 1.59 2.19 0.21 0.00 0.00 175.17 177.64 2b39 h PHE 62 N -0.67 0.00 0.00 4.23 -5.15 -1.87 -3.33 116.94 110.15 2b39 h PHE 62 Ca -0.45 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.32 2b39 h PHE 62 Cb 1.30 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.47 2b39 h PHE 62 CO 0.37 0.38 0.00 -0.35 -2.00 0.00 0.00 178.31 176.71 2b39 n PRO 63 N -3.29 0.00 -3.97 6.09 -0.04 -1.26 -4.97 135.00 127.55 2b39 n PRO 63 Ca 0.01 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.16 2b39 n PRO 63 Cb 0.61 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 34.02 2b39 n PRO 63 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b39 s ALA 64 N -4.00 3.83 -0.46 0.55 0.00 -1.26 -5.06 121.76 115.36 2b39 s ALA 64 Ca 0.00 -0.89 -0.19 0.00 0.00 0.00 0.00 51.96 50.89 2b39 s ALA 64 Cb 0.00 -1.69 0.04 0.00 0.00 0.00 0.00 23.12 21.47 2b39 s ALA 64 CO 0.00 0.78 0.54 -1.59 0.00 0.00 0.00 175.76 175.49 2b39 s LYS 65 N -2.32 3.14 0.00 0.00 -2.85 -1.26 -4.52 119.74 111.92 2b39 s LYS 65 Ca 0.31 -0.75 0.00 0.00 -1.00 0.00 0.00 55.97 54.53 2b39 s LYS 65 Cb -0.13 -4.02 0.00 0.00 -2.06 0.00 0.00 37.83 31.63 2b39 s LYS 65 CO 0.24 -1.02 0.09 1.63 0.10 0.00 0.00 175.35 176.39 2b39 n LYS 66 N 5.91 -0.00 -4.45 1.78 5.02 -1.26 -5.00 118.16 120.17 2b39 n LYS 66 Ca -0.06 -0.09 -0.31 0.00 -2.02 0.00 0.00 58.31 55.83 2b39 n LYS 66 Cb 0.47 -0.55 -0.16 0.00 -0.02 0.00 0.00 35.03 34.76 2b39 n LYS 66 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 2b39 s GLN 67 N -0.03 2.66 -0.11 1.97 0.74 -1.26 -5.10 119.66 118.53 2b39 s GLN 67 Ca 0.00 -0.72 -0.24 0.00 0.05 0.00 0.00 55.36 54.46 2b39 s GLN 67 Cb 0.00 -2.23 -0.03 0.00 1.10 0.00 0.00 33.01 31.85 2b39 s GLN 67 CO 0.00 -0.08 0.73 0.54 -0.55 0.00 0.00 175.29 175.93 2b39 s VAL 68 N 1.02 4.99 -0.43 1.34 0.11 -1.26 -4.13 120.40 122.05 2b39 s VAL 68 Ca -0.04 1.48 0.06 0.00 -2.93 0.00 0.00 61.98 60.56 2b39 s VAL 68 Cb -0.15 -4.06 -0.04 0.00 -1.53 0.00 0.00 36.38 30.60 2b39 s VAL 68 CO -0.04 0.17 0.37 0.18 -3.33 0.00 0.00 175.10 172.45 2b39 n LEU 69 N 4.33 0.58 -3.35 2.54 4.77 -0.82 -5.01 117.00 120.04 2b39 n LEU 69 Ca 0.00 -0.61 0.03 0.00 -0.03 0.00 0.00 56.01 55.40 2b39 n LEU 69 Cb 0.50 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.55 2b39 n LEU 69 CO 0.47 0.13 0.93 -0.94 -1.33 0.00 0.00 177.39 176.66 2b39 s SER 70 N -1.36 -0.09 -0.28 -1.43 1.04 -1.26 -4.66 113.70 105.66 2b39 s SER 70 Ca 0.04 0.12 0.11 0.00 0.48 0.00 0.00 55.95 56.70 2b39 s SER 70 Cb 0.05 1.08 0.56 0.00 0.10 0.00 0.00 66.02 67.81 2b39 s SER 70 CO 0.22 -0.02 1.54 0.59 0.98 0.00 0.00 173.24 176.55 2b39 n ASN 71 N 4.07 3.27 -4.56 7.02 5.03 -1.25 -2.50 115.26 126.35 2b39 n ASN 71 Ca -0.10 -3.48 -0.37 0.00 0.87 0.00 0.00 54.58 51.50 2b39 n ASN 71 Cb 0.56 -0.64 0.06 0.00 -1.02 0.00 0.00 39.78 38.73 2b39 n ASN 71 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.26 176.64 2b39 n GLU 72 N -0.85 0.61 -3.59 3.52 4.07 -1.23 -4.64 120.64 118.52 2b39 n GLU 72 Ca 0.34 0.25 -0.13 0.00 -0.06 0.00 0.00 57.16 57.56 2b39 n GLU 72 Cb 1.10 -2.03 -0.06 0.00 -0.06 0.00 0.00 31.44 30.39 2b39 n GLU 72 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 2b39 s ASN 73 N -1.37 -0.58 0.00 4.31 4.22 -1.26 -1.25 114.94 119.01 2b39 s ASN 73 Ca 0.72 0.91 0.00 0.00 -2.14 0.00 0.00 52.86 52.36 2b39 s ASN 73 Cb -0.39 0.86 0.00 0.00 1.28 0.00 0.00 41.25 43.00 2b39 s ASN 73 CO 0.51 -0.33 0.00 1.07 -2.04 0.00 0.00 177.10 176.30 2b39 n THR 74 N 1.74 0.00 -3.57 0.54 5.66 -1.24 -4.96 114.28 112.44 2b39 n THR 74 Ca -0.14 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.73 2b39 n THR 74 Cb 0.56 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.30 2b39 n THR 74 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2b39 s GLN 75 N 1.45 1.08 -0.80 1.09 -2.07 -1.26 -0.91 119.66 118.25 2b39 s GLN 75 Ca 0.00 -0.43 -0.16 0.00 -1.82 0.00 0.00 55.36 52.95 2b39 s GLN 75 Cb 0.00 0.49 0.17 0.00 -1.09 0.00 0.00 33.01 32.58 2b39 s GLN 75 CO 0.00 -0.42 0.85 -0.51 -1.32 0.00 0.00 175.29 173.89 2b39 s LEU 76 N -2.37 5.95 0.34 2.60 1.43 0.95 -4.50 118.68 123.08 2b39 s LEU 76 Ca -0.02 -2.20 0.09 0.00 -1.03 0.00 0.00 54.13 50.98 2b39 s LEU 76 Cb 0.00 -2.28 -0.06 0.00 0.03 0.00 0.00 46.19 43.88 2b39 s LEU 76 CO -0.07 -0.84 -0.06 0.20 0.23 0.00 0.00 176.35 175.81 2b39 s ASN 77 N 2.97 3.92 0.05 2.29 0.01 -1.26 -2.14 114.94 120.79 2b39 s ASN 77 Ca 0.20 -1.09 0.01 0.00 -0.71 0.00 0.00 52.86 51.27 2b39 s ASN 77 Cb -0.12 -0.43 0.15 0.00 0.41 0.00 0.00 41.25 41.26 2b39 s ASN 77 CO -0.05 -0.20 0.25 -1.54 -1.51 0.00 0.00 177.10 174.05 2b39 n SER 78 N -0.85 0.00 0.06 -1.22 3.41 -1.22 -2.29 113.62 111.52 2b39 n SER 78 Ca -0.05 0.27 -0.16 0.00 -0.26 0.00 0.00 58.87 58.67 2b39 n SER 78 Cb 0.63 -0.11 -0.14 0.00 -0.26 0.00 0.00 64.21 64.33 2b39 n SER 78 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 2b39 h ASN 79 N 0.00 0.37 1.19 4.04 -0.73 -1.97 -3.38 115.58 115.10 2b39 h ASN 79 Ca 0.11 -0.51 -0.11 0.00 1.87 0.00 0.00 56.30 57.66 2b39 h ASN 79 Cb 0.25 -0.12 -0.02 0.00 0.27 0.00 0.00 38.32 38.70 2b39 h ASN 79 CO -0.14 1.43 -0.52 -0.55 -0.37 0.00 0.00 177.43 177.28 2b39 h ASN 80 N 0.06 0.00 -0.25 1.15 -1.07 -1.79 -3.47 115.58 110.22 2b39 h ASN 80 Ca -0.24 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.13 2b39 h ASN 80 Cb 2.01 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 38.26 2b39 h ASN 80 CO 0.16 0.52 0.00 0.61 0.07 0.00 0.00 177.43 178.79 2b39 n GLY 81 N 0.88 1.06 3.62 9.14 0.00 -1.19 -4.56 105.19 114.14 2b39 n GLY 81 Ca 0.01 -0.20 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 2b39 n GLY 81 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2b39 n TYR 82 N -0.86 -2.12 -3.67 1.61 4.01 -1.14 -4.71 117.16 110.29 2b39 n TYR 82 Ca 0.00 0.67 -0.11 0.00 -0.16 0.00 0.00 57.90 58.29 2b39 n TYR 82 Cb 0.14 -3.33 -0.12 0.00 -0.31 0.00 0.00 39.34 35.73 2b39 n TYR 82 CO 0.00 0.00 0.00 -0.48 -0.46 0.00 0.00 176.86 175.92 2b39 s LEU 83 N -5.62 -0.39 0.29 7.72 0.05 -1.26 -2.50 118.68 116.97 2b39 s LEU 83 Ca 0.25 0.76 -0.14 0.00 0.05 0.00 0.00 54.13 55.04 2b39 s LEU 83 Cb -0.10 0.99 0.01 0.00 -2.05 0.00 0.00 46.19 45.04 2b39 s LEU 83 CO 0.86 -0.23 0.59 -0.55 -0.55 0.00 0.00 176.35 176.47 2b39 s SER 84 N 2.38 -0.00 -0.04 1.48 0.15 -1.13 -4.78 113.70 111.76 2b39 s SER 84 Ca -0.01 -0.94 -0.01 0.00 0.70 0.00 0.00 55.95 55.68 2b39 s SER 84 Cb -0.12 0.67 0.03 0.00 -1.71 0.00 0.00 66.02 64.90 2b39 s SER 84 CO -0.10 -1.30 0.08 0.42 1.20 0.00 0.00 173.24 173.54 2b39 s THR 85 N -3.63 -0.08 -0.47 6.45 -4.23 -1.26 -0.35 115.64 112.07 2b39 s THR 85 Ca 0.19 0.26 -0.19 0.00 -1.18 0.00 0.00 61.69 60.77 2b39 s THR 85 Cb -0.03 -0.15 0.04 0.00 1.34 0.00 0.00 72.50 73.70 2b39 s THR 85 CO 0.10 0.11 0.60 -0.69 -0.54 0.00 0.00 174.62 174.20 2b39 s VAL 86 N 1.41 4.90 0.05 2.29 1.01 0.10 -4.81 120.40 125.35 2b39 s VAL 86 Ca -0.06 -0.28 -0.25 0.00 0.00 0.00 0.00 61.98 61.39 2b39 s VAL 86 Cb -0.12 -4.22 -0.06 0.00 0.00 0.00 0.00 36.38 31.98 2b39 s VAL 86 CO -0.04 -0.68 0.78 0.42 0.00 0.00 0.00 175.10 175.58 2b39 s THR 87 N 2.61 4.71 -0.05 3.92 -4.23 -1.26 -0.07 115.64 121.27 2b39 s THR 87 Ca 0.17 1.65 -0.04 0.00 -1.18 0.00 0.00 61.69 62.29 2b39 s THR 87 Cb -0.17 -4.13 0.02 0.00 1.34 0.00 0.00 72.50 69.56 2b39 s THR 87 CO 0.14 0.37 0.12 -0.63 -0.54 0.00 0.00 174.62 174.09 2b39 s ILE 88 N -0.09 -0.01 -0.21 2.99 1.01 0.54 -4.94 121.20 120.50 2b39 s ILE 88 Ca 0.39 0.04 -0.06 0.00 0.00 0.00 0.00 60.65 61.02 2b39 s ILE 88 Cb -0.21 -0.19 -0.03 0.00 0.01 0.00 0.00 42.46 42.04 2b39 s ILE 88 CO 0.23 0.02 0.04 -0.75 0.00 0.00 0.00 174.94 174.48 2b39 s LYS 89 N 0.32 3.73 -0.41 2.79 2.20 -1.26 -1.54 119.74 125.56 2b39 s LYS 89 Ca -0.02 -0.46 -0.08 0.00 -0.36 0.00 0.00 55.97 55.05 2b39 s LYS 89 Cb -0.03 -3.18 0.08 0.00 -1.51 0.00 0.00 37.83 33.18 2b39 s LYS 89 CO -0.01 0.04 0.24 0.42 -0.36 0.00 0.00 175.35 175.67 2b39 s ILE 90 N 0.98 4.08 0.00 5.43 1.01 -1.26 -4.88 121.20 126.56 2b39 s ILE 90 Ca 0.03 -1.44 0.00 0.00 0.00 0.00 0.00 60.65 59.24 2b39 s ILE 90 Cb -0.14 -3.51 0.00 0.00 0.01 0.00 0.00 42.46 38.82 2b39 s ILE 90 CO 0.02 -0.49 0.00 -2.65 0.00 0.00 0.00 174.94 171.82 2b39 n PRO 91 N 4.87 0.00 -3.75 2.79 -0.01 -1.26 -0.71 135.00 136.93 2b39 n PRO 91 Ca -0.10 0.00 -0.33 0.00 -0.01 0.00 0.00 63.50 63.06 2b39 n PRO 91 Cb 0.43 0.00 -0.09 0.00 -0.01 0.00 0.00 33.50 33.83 2b39 n PRO 91 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 2b39 s ALA 92 N -1.91 3.98 -0.94 3.55 0.00 -1.26 -3.97 121.76 121.21 2b39 s ALA 92 Ca 0.00 -3.74 -0.31 0.00 0.00 0.00 0.00 51.96 47.91 2b39 s ALA 92 Cb 0.00 -2.57 -0.21 0.00 0.00 0.00 0.00 23.12 20.34 2b39 s ALA 92 CO 0.00 -2.12 2.65 -1.13 0.00 0.00 0.00 175.76 175.16 2b39 n SER 93 N 2.41 0.48 0.00 0.00 3.41 -1.26 -4.64 113.62 114.01 2b39 n SER 93 Ca 0.18 0.15 0.13 0.00 -0.26 0.00 0.00 58.87 59.07 2b39 n SER 93 Cb 0.36 -0.97 0.72 0.00 -0.26 0.00 0.00 64.21 64.06 2b39 n SER 93 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2b39 n LYS 94 N 8.50 0.53 -0.99 4.33 5.02 -1.26 -1.80 118.16 132.49 2b39 n LYS 94 Ca 0.63 0.02 -0.13 0.00 -2.02 0.00 0.00 58.31 56.82 2b39 n LYS 94 Cb 0.07 -1.50 0.19 0.00 -0.02 0.00 0.00 35.03 33.77 2b39 n LYS 94 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2b39 n GLU 95 N -1.20 2.00 -1.42 1.97 1.02 -1.26 -5.04 120.64 116.71 2b39 n GLU 95 Ca 0.15 -3.13 -0.60 0.00 -0.02 0.00 0.00 57.16 53.57 2b39 n GLU 95 Cb 0.18 -1.97 -0.10 0.00 -0.02 0.00 0.00 31.44 29.53 2b39 n GLU 95 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2b39 n LEU 96 N -1.14 1.21 -4.61 -4.62 7.94 -0.74 -4.72 117.00 110.32 2b39 n LEU 96 Ca 0.44 0.78 -0.61 0.00 -1.11 0.00 0.00 56.01 55.51 2b39 n LEU 96 Cb 1.30 -0.97 -0.08 0.00 0.53 0.00 0.00 43.42 44.19 2b39 n LEU 96 CO 0.36 -0.75 0.86 2.29 -1.11 0.00 0.00 177.39 179.04 2b39 n LYS 97 N 6.71 0.23 -1.54 1.96 2.85 -1.26 -4.89 118.16 122.22 2b39 n LYS 97 Ca 0.45 0.08 -0.29 0.00 -1.05 0.00 0.00 58.31 57.51 2b39 n LYS 97 Cb 0.01 -1.62 0.15 0.00 -0.65 0.00 0.00 35.03 32.93 2b39 n LYS 97 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2b39 s SER 98 N 1.30 3.19 0.13 -5.58 0.15 -1.26 -4.95 113.70 106.68 2b39 s SER 98 Ca 0.95 0.83 -0.31 0.00 0.70 0.00 0.00 55.95 58.12 2b39 s SER 98 Cb -1.29 -1.30 -0.10 0.00 -1.71 0.00 0.00 66.02 61.62 2b39 s SER 98 CO 0.64 -2.74 1.52 0.44 1.20 0.00 0.00 173.24 174.30 2b39 h ASP 99 N -1.63 -1.80 -0.29 5.45 3.32 -2.04 -2.76 116.42 116.67 2b39 h ASP 99 Ca -0.49 0.24 0.00 0.00 0.02 0.00 0.00 57.03 56.80 2b39 h ASP 99 Cb 1.32 0.75 0.00 0.00 0.22 0.00 0.00 39.33 41.61 2b39 h ASP 99 CO 0.56 -0.36 0.00 2.29 -1.72 0.00 0.00 179.24 180.01 2b39 n LYS 100 N -5.21 1.74 -4.25 3.56 0.00 -1.26 -4.92 118.16 107.82 2b39 n LYS 100 Ca -0.03 -1.14 -0.18 0.00 -0.00 0.00 0.00 58.31 56.96 2b39 n LYS 100 Cb 0.31 -1.28 -0.11 0.00 -0.00 0.00 0.00 35.03 33.95 2b39 n LYS 100 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2b39 s GLY 101 N -1.11 1.09 -0.07 2.58 0.00 -1.04 -5.12 107.32 103.66 2b39 s GLY 101 Ca 0.24 -1.30 0.02 0.00 0.00 0.00 0.00 44.72 43.68 2b39 s GLY 101 CO 0.17 -1.35 -0.12 -2.38 0.00 0.00 0.00 173.10 169.42 2b39 s HIS 102 N -2.10 1.43 0.21 1.90 -3.43 -1.26 -4.05 115.29 107.99 2b39 s HIS 102 Ca 0.09 -0.53 0.08 0.00 -0.80 0.00 0.00 55.06 53.90 2b39 s HIS 102 Cb -0.05 -1.06 -0.04 0.00 -1.43 0.00 0.00 32.58 30.00 2b39 s HIS 102 CO 0.03 -0.28 0.04 0.15 -2.00 0.00 0.00 174.74 172.68 2b39 s LYS 103 N 0.70 2.49 0.45 -0.38 1.02 -1.26 -5.08 119.74 117.68 2b39 s LYS 103 Ca -0.14 -1.17 0.06 0.00 0.02 0.00 0.00 55.97 54.74 2b39 s LYS 103 Cb -0.16 -2.35 -0.02 0.00 -0.52 0.00 0.00 37.83 34.78 2b39 s LYS 103 CO 0.03 0.42 0.26 -0.06 -0.92 0.00 0.00 175.35 175.09 2b39 s PHE 104 N -1.98 2.33 0.13 3.18 0.08 -1.26 -4.33 117.98 116.14 2b39 s PHE 104 Ca 0.30 -0.66 0.07 0.00 0.12 0.00 0.00 56.93 56.76 2b39 s PHE 104 Cb -0.08 -1.97 -0.04 0.00 -0.57 0.00 0.00 43.02 40.36 2b39 s PHE 104 CO 0.20 -0.04 -0.16 0.54 -0.10 0.00 0.00 175.22 175.67 2b39 s VAL 105 N -2.64 1.47 -0.17 -0.44 0.11 -1.25 -3.07 120.40 114.41 2b39 s VAL 105 Ca 0.38 -1.74 -0.02 0.00 -2.93 0.00 0.00 61.98 57.67 2b39 s VAL 105 Cb 0.01 -1.59 0.05 0.00 -1.53 0.00 0.00 36.38 33.32 2b39 s VAL 105 CO 0.22 -0.36 0.01 0.42 -3.33 0.00 0.00 175.10 172.07 2b39 s THR 106 N -2.01 0.64 -0.14 5.04 -4.23 -1.08 -1.91 115.64 111.95 2b39 s THR 106 Ca 0.10 -0.51 -0.18 0.00 -1.18 0.00 0.00 61.69 59.92 2b39 s THR 106 Cb -0.06 -1.04 -0.04 0.00 1.34 0.00 0.00 72.50 72.70 2b39 s THR 106 CO 0.04 -0.09 0.46 0.68 -0.54 0.00 0.00 174.62 175.17 2b39 s VAL 107 N 1.82 5.19 -0.97 2.29 -7.23 -0.01 -0.78 120.40 120.69 2b39 s VAL 107 Ca -0.00 0.89 -0.01 0.00 -1.81 0.00 0.00 61.98 61.05 2b39 s VAL 107 Cb -0.16 -3.79 0.31 0.00 0.56 0.00 0.00 36.38 33.29 2b39 s VAL 107 CO -0.07 0.30 1.51 0.52 -0.31 0.00 0.00 175.10 177.04 2b39 n VAL 108 N 3.88 5.19 -2.21 1.32 0.31 0.62 -2.06 118.33 125.37 2b39 n VAL 108 Ca -0.07 -5.87 -0.43 0.00 -0.01 0.00 0.00 64.34 57.96 2b39 n VAL 108 Cb 0.51 -1.81 -0.02 0.00 -0.91 0.00 0.00 33.84 31.61 2b39 n VAL 108 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2b39 s ALA 109 N -3.46 3.39 -0.21 3.52 0.00 -0.84 -3.43 121.76 120.73 2b39 s ALA 109 Ca 0.37 0.44 0.01 0.00 0.00 0.00 0.00 51.96 52.78 2b39 s ALA 109 Cb 0.14 -3.79 0.05 0.00 0.00 0.00 0.00 23.12 19.52 2b39 s ALA 109 CO -0.02 -1.74 -0.08 0.95 0.00 0.00 0.00 175.76 174.88 2b39 s THR 110 N 4.64 1.54 0.06 0.00 -4.23 -0.25 0.85 115.64 118.25 2b39 s THR 110 Ca 0.66 -1.07 0.00 0.00 -1.18 0.00 0.00 61.69 60.10 2b39 s THR 110 Cb -0.24 -1.71 -0.04 0.00 1.34 0.00 0.00 72.50 71.85 2b39 s THR 110 CO 0.26 0.04 -0.04 0.72 -0.54 0.00 0.00 174.62 175.06 2b39 s PHE 111 N 1.42 0.61 -1.52 3.99 -0.12 -1.19 -0.99 117.98 120.18 2b39 s PHE 111 Ca -0.03 -0.91 -0.12 0.00 -0.05 0.00 0.00 56.93 55.81 2b39 s PHE 111 Cb -0.17 -0.40 0.12 0.00 -0.63 0.00 0.00 43.02 41.93 2b39 s PHE 111 CO -0.07 -0.27 0.30 0.41 -0.05 0.00 0.00 175.22 175.54 2b39 n GLY 112 N 0.35 -0.24 4.42 1.99 0.00 -1.11 -1.26 105.19 109.34 2b39 n GLY 112 Ca -0.15 0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 2b39 n GLY 112 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2b39 n ASN 113 N -2.22 -1.86 -3.76 1.61 5.15 -1.26 -4.94 115.26 107.98 2b39 n ASN 113 Ca -0.06 -1.18 -0.21 0.00 -0.60 0.00 0.00 54.58 52.52 2b39 n ASN 113 Cb 0.48 -1.94 -0.17 0.00 -0.53 0.00 0.00 39.78 37.62 2b39 n ASN 113 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2b39 s VAL 114 N -3.41 0.23 -0.14 3.44 -7.23 -0.39 -5.13 120.40 107.78 2b39 s VAL 114 Ca 0.70 0.18 -0.04 0.00 -1.81 0.00 0.00 61.98 61.01 2b39 s VAL 114 Cb -0.40 -0.40 -0.03 0.00 0.56 0.00 0.00 36.38 36.11 2b39 s VAL 114 CO 1.00 0.22 -0.01 0.00 -0.31 0.00 0.00 175.10 175.99 2b39 s GLN 115 N 1.82 3.53 0.07 4.82 -2.07 -1.26 -3.18 119.66 123.39 2b39 s GLN 115 Ca 0.02 -0.47 0.00 0.00 -1.82 0.00 0.00 55.36 53.09 2b39 s GLN 115 Cb -0.12 -2.92 -0.04 0.00 -1.09 0.00 0.00 33.01 28.83 2b39 s GLN 115 CO -0.04 0.37 0.21 0.08 -1.32 0.00 0.00 175.29 174.59 2b39 s VAL 116 N 0.04 5.37 0.02 3.63 1.01 0.25 -4.96 120.40 125.76 2b39 s VAL 116 Ca 0.02 -0.42 0.04 0.00 0.00 0.00 0.00 61.98 61.61 2b39 s VAL 116 Cb -0.13 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 2b39 s VAL 116 CO 0.02 0.12 -0.11 -1.61 0.00 0.00 0.00 175.10 173.52 2b39 s GLU 117 N -2.57 0.76 0.01 2.72 2.02 -1.26 -1.99 118.70 118.39 2b39 s GLU 117 Ca 0.35 -0.59 0.00 0.00 0.02 0.00 0.00 54.97 54.75 2b39 s GLU 117 Cb -0.13 -0.72 -0.01 0.00 0.10 0.00 0.00 34.13 33.38 2b39 s GLU 117 CO 0.28 0.18 -0.02 0.21 0.02 0.00 0.00 175.26 175.93 2b39 s LYS 118 N -0.87 0.15 -0.42 1.61 2.47 -0.88 -4.98 119.74 116.82 2b39 s LYS 118 Ca 0.00 -0.20 0.01 0.00 -1.56 0.00 0.00 55.97 54.23 2b39 s LYS 118 Cb -0.07 -0.04 0.11 0.00 -1.46 0.00 0.00 37.83 36.38 2b39 s LYS 118 CO 0.01 0.01 0.17 0.08 0.16 0.00 0.00 175.35 175.77 2b39 s VAL 119 N -0.41 2.75 0.00 4.02 1.01 -1.26 -0.83 120.40 125.68 2b39 s VAL 119 Ca -0.04 -2.50 0.00 0.00 0.00 0.00 0.00 61.98 59.44 2b39 s VAL 119 Cb -0.03 -2.94 0.00 0.00 0.00 0.00 0.00 36.38 33.41 2b39 s VAL 119 CO -0.00 -0.69 0.00 0.52 0.00 0.00 0.00 175.10 174.93 2b39 n VAL 120 N 4.07 0.00 -4.23 2.92 0.31 -0.80 -4.66 118.33 115.94 2b39 n VAL 120 Ca 0.03 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.23 2b39 n VAL 120 Cb 0.40 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 33.23 2b39 n VAL 120 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2b39 s LEU 121 N 0.00 1.30 0.00 7.52 1.02 -1.21 -3.87 118.68 123.44 2b39 s LEU 121 Ca 0.00 -1.38 -0.02 0.00 0.02 0.00 0.00 54.13 52.74 2b39 s LEU 121 Cb 0.00 0.29 -0.01 0.00 0.02 0.00 0.00 46.19 46.49 2b39 s LEU 121 CO 0.00 -0.81 0.04 -0.63 0.02 0.00 0.00 176.35 174.97 2b39 s ILE 122 N -4.05 0.07 -0.38 -0.59 1.01 -1.26 -0.43 121.20 115.57 2b39 s ILE 122 Ca 0.38 -0.57 0.06 0.00 0.00 0.00 0.00 60.65 60.52 2b39 s ILE 122 Cb 0.07 -0.25 0.17 0.00 0.01 0.00 0.00 42.46 42.46 2b39 s ILE 122 CO 0.12 -0.31 0.54 -0.94 0.00 0.00 0.00 174.94 174.34 2b39 s SER 123 N -0.98 -0.62 0.83 3.58 1.04 -0.30 -4.83 113.70 112.42 2b39 s SER 123 Ca -0.11 -0.93 -0.12 0.00 0.48 0.00 0.00 55.95 55.27 2b39 s SER 123 Cb -0.06 1.50 0.10 0.00 0.10 0.00 0.00 66.02 67.66 2b39 s SER 123 CO -0.00 -0.22 1.16 -1.48 0.98 0.00 0.00 173.24 173.69 2b39 s LEU 124 N 1.83 3.03 0.00 2.42 2.34 -1.26 -4.22 118.68 122.82 2b39 s LEU 124 Ca 0.16 2.21 0.00 0.00 0.06 0.00 0.00 54.13 56.55 2b39 s LEU 124 Cb -0.08 -4.57 0.00 0.00 -0.56 0.00 0.00 46.19 40.98 2b39 s LEU 124 CO -0.08 -2.70 0.00 0.00 -1.06 0.00 0.00 176.35 172.51 2b39 n GLN 125 N -3.64 0.00 -2.21 1.48 10.64 -1.26 -4.79 117.38 117.59 2b39 n GLN 125 Ca 0.12 0.00 -0.38 0.00 -1.83 0.00 0.00 57.00 54.91 2b39 n GLN 125 Cb 0.52 0.00 -0.03 0.00 -0.86 0.00 0.00 30.24 29.86 2b39 n GLN 125 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2b39 s SER 126 N -0.46 5.58 1.26 2.61 0.15 -1.26 -4.96 113.70 116.62 2b39 s SER 126 Ca 0.00 -0.04 -0.20 0.00 0.70 0.00 0.00 55.95 56.40 2b39 s SER 126 Cb 0.00 -2.54 0.30 0.00 -1.71 0.00 0.00 66.02 62.07 2b39 s SER 126 CO 0.00 -2.21 1.03 0.61 1.20 0.00 0.00 173.24 173.87 2b39 n GLY 127 N 5.73 -2.87 3.35 9.45 0.00 -1.26 -3.47 105.19 116.12 2b39 n GLY 127 Ca 0.17 -1.47 -0.14 0.00 0.00 0.00 0.00 46.02 44.58 2b39 n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2b39 s TYR 128 N -2.82 -0.47 -0.16 1.61 4.12 -0.52 -4.80 117.35 114.31 2b39 s TYR 128 Ca 0.68 1.08 -0.05 0.00 0.02 0.00 0.00 57.07 58.80 2b39 s TYR 128 Cb -0.07 0.18 0.08 0.00 -1.52 0.00 0.00 41.96 40.63 2b39 s TYR 128 CO 0.52 -0.29 0.30 -0.51 0.02 0.00 0.00 175.55 175.59 2b39 s LEU 129 N -0.10 -0.39 -0.23 -1.29 1.43 -1.26 -2.60 118.68 114.23 2b39 s LEU 129 Ca -0.03 0.58 -0.04 0.00 -1.03 0.00 0.00 54.13 53.60 2b39 s LEU 129 Cb -0.03 0.86 -0.01 0.00 0.03 0.00 0.00 46.19 47.04 2b39 s LEU 129 CO 0.02 -0.25 -0.02 -0.36 0.23 0.00 0.00 176.35 175.97 2b39 s PHE 130 N 2.47 3.00 -0.26 0.29 0.08 -1.24 -4.87 117.98 117.44 2b39 s PHE 130 Ca 0.02 -0.93 -0.11 0.00 0.12 0.00 0.00 56.93 56.04 2b39 s PHE 130 Cb -0.13 -2.13 -0.05 0.00 -0.57 0.00 0.00 43.02 40.14 2b39 s PHE 130 CO -0.10 -0.54 0.17 0.42 -0.10 0.00 0.00 175.22 175.06 2b39 s ILE 131 N 1.49 5.31 -0.13 0.64 1.01 -1.26 -2.37 121.20 125.89 2b39 s ILE 131 Ca 0.05 0.17 -0.03 0.00 0.00 0.00 0.00 60.65 60.84 2b39 s ILE 131 Cb -0.15 -3.50 -0.03 0.00 0.01 0.00 0.00 42.46 38.79 2b39 s ILE 131 CO -0.02 0.30 -0.01 -1.58 0.00 0.00 0.00 174.94 173.63 2b39 s GLN 132 N 1.37 3.40 0.08 2.79 0.74 0.12 -4.93 119.66 123.23 2b39 s GLN 132 Ca 0.07 -0.45 0.04 0.00 0.05 0.00 0.00 55.36 55.08 2b39 s GLN 132 Cb -0.15 -2.90 -0.04 0.00 1.10 0.00 0.00 33.01 31.03 2b39 s GLN 132 CO 0.07 0.45 0.00 0.95 -0.55 0.00 0.00 175.29 176.22 2b39 s THR 133 N -0.20 4.06 0.11 -0.34 -4.23 -1.26 -1.06 115.64 112.71 2b39 s THR 133 Ca 0.05 -0.93 -0.25 0.00 -1.18 0.00 0.00 61.69 59.38 2b39 s THR 133 Cb -0.13 -2.92 -0.09 0.00 1.34 0.00 0.00 72.50 70.71 2b39 s THR 133 CO 0.02 0.15 1.67 -0.78 -0.54 0.00 0.00 174.62 175.15 2b39 h ASP 134 N 3.55 -0.45 -0.51 3.99 1.82 0.11 -3.47 116.42 121.46 2b39 h ASP 134 Ca -0.48 0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.22 2b39 h ASP 134 Cb 1.17 0.18 0.00 0.00 0.68 0.00 0.00 39.33 41.35 2b39 h ASP 134 CO 0.60 -0.23 0.00 2.29 -1.61 0.00 0.00 179.24 180.29 2b39 n LYS 135 N -5.29 0.00 0.00 0.28 2.85 -1.26 -4.98 118.16 109.75 2b39 n LYS 135 Ca -0.06 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.20 2b39 n LYS 135 Cb 0.21 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.59 2b39 n LYS 135 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2b39 n THR 136 N 0.00 0.00 -3.60 0.58 -2.24 -1.26 -4.97 114.28 102.79 2b39 n THR 136 Ca 0.00 -0.23 -0.23 0.00 -2.27 0.00 0.00 64.05 61.32 2b39 n THR 136 Cb 0.00 1.44 -0.16 0.00 -2.10 0.00 0.00 70.33 69.51 2b39 n THR 136 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2b39 s ILE 137 N -0.08 -0.15 0.19 2.28 1.01 -1.25 -0.91 121.20 122.29 2b39 s ILE 137 Ca 0.00 -0.03 0.10 0.00 0.00 0.00 0.00 60.65 60.73 2b39 s ILE 137 Cb 0.00 -0.51 -0.04 0.00 0.01 0.00 0.00 42.46 41.92 2b39 s ILE 137 CO 0.00 -0.17 -0.17 -0.31 0.00 0.00 0.00 174.94 174.29 2b39 s TYR 138 N 2.19 2.45 -0.12 3.97 2.02 0.17 -4.98 117.35 123.06 2b39 s TYR 138 Ca 0.03 -0.30 -0.01 0.00 -0.37 0.00 0.00 57.07 56.43 2b39 s TYR 138 Cb -0.15 -1.20 -0.03 0.00 -0.40 0.00 0.00 41.96 40.18 2b39 s TYR 138 CO -0.08 0.52 -0.06 0.95 -1.57 0.00 0.00 175.55 175.30 2b39 s THR 139 N -1.73 3.71 0.00 -0.71 -4.23 -1.26 -0.56 115.64 110.86 2b39 s THR 139 Ca 0.23 -0.45 0.00 0.00 -1.18 0.00 0.00 61.69 60.29 2b39 s THR 139 Cb -0.08 -2.57 0.00 0.00 1.34 0.00 0.00 72.50 71.19 2b39 s THR 139 CO 0.13 0.54 0.00 -2.65 -0.54 0.00 0.00 174.62 172.10 2b39 n PRO 140 N 2.99 0.00 0.14 3.99 -0.02 -1.25 -0.06 135.00 140.79 2b39 n PRO 140 Ca -0.18 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.32 2b39 n PRO 140 Cb 0.53 0.00 0.34 0.00 -0.02 0.00 0.00 33.50 34.35 2b39 n PRO 140 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2b39 h GLY 141 N 0.00 0.15 -1.68 -1.23 0.00 -1.80 -3.34 103.07 95.17 2b39 h GLY 141 Ca 0.00 -0.11 -0.51 0.00 0.00 0.00 0.00 47.33 46.70 2b39 h GLY 141 CO 0.00 0.11 0.37 -1.35 0.00 0.00 0.00 176.54 175.66 2b39 s SER 142 N -6.91 4.80 -0.23 0.19 1.04 0.92 -4.60 113.70 108.91 2b39 s SER 142 Ca -0.04 2.07 -0.11 0.00 0.48 0.00 0.00 55.95 58.35 2b39 s SER 142 Cb 0.14 -2.56 -0.05 0.00 0.10 0.00 0.00 66.02 63.66 2b39 s SER 142 CO 0.74 -1.84 0.16 0.28 0.98 0.00 0.00 173.24 173.56 2b39 s THR 143 N -2.31 5.36 0.14 2.02 -1.32 -1.26 -1.29 115.64 116.98 2b39 s THR 143 Ca 0.68 0.20 -0.30 0.00 -1.21 0.00 0.00 61.69 61.06 2b39 s THR 143 Cb -0.22 -3.50 -0.07 0.00 -1.51 0.00 0.00 72.50 67.20 2b39 s THR 143 CO 0.44 0.36 1.01 -0.69 -2.21 0.00 0.00 174.62 173.53 2b39 s VAL 144 N 0.94 4.24 -0.24 5.08 1.01 0.73 -4.89 120.40 127.27 2b39 s VAL 144 Ca 0.08 1.90 -0.02 0.00 0.00 0.00 0.00 61.98 63.94 2b39 s VAL 144 Cb -0.13 -4.21 0.02 0.00 0.00 0.00 0.00 36.38 32.06 2b39 s VAL 144 CO 0.03 0.31 -0.06 -0.76 0.00 0.00 0.00 175.10 174.62 2b39 s LEU 145 N -0.17 3.11 0.08 3.92 1.43 -1.26 -1.35 118.68 124.45 2b39 s LEU 145 Ca 0.48 -0.80 0.02 0.00 -1.03 0.00 0.00 54.13 52.81 2b39 s LEU 145 Cb -0.26 -1.67 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 2b39 s LEU 145 CO 0.32 -0.11 -0.08 -0.72 0.23 0.00 0.00 176.35 175.99 2b39 s TYR 146 N 1.35 0.88 0.08 0.29 -0.00 -0.80 0.88 117.35 120.03 2b39 s TYR 146 Ca 0.01 -0.75 0.04 0.00 -0.00 0.00 0.00 57.07 56.37 2b39 s TYR 146 Cb -0.16 -0.51 -0.03 0.00 -0.00 0.00 0.00 41.96 41.26 2b39 s TYR 146 CO -0.05 -0.09 -0.10 1.03 -0.00 0.00 0.00 175.55 176.34 2b39 s ARG 147 N -3.03 0.75 -0.24 -3.49 0.52 -0.22 -0.87 118.95 112.37 2b39 s ARG 147 Ca 0.05 -1.01 -0.04 0.00 -0.52 0.00 0.00 55.73 54.21 2b39 s ARG 147 Cb -0.00 -0.53 0.08 0.00 0.52 0.00 0.00 34.95 35.02 2b39 s ARG 147 CO -0.02 0.09 0.11 0.08 0.02 0.00 0.00 175.30 175.58 2b39 s VAL 148 N -1.92 -0.04 -0.43 3.52 1.01 -0.52 0.12 120.40 122.15 2b39 s VAL 148 Ca -0.00 -0.55 -0.29 0.00 0.00 0.00 0.00 61.98 61.13 2b39 s VAL 148 Cb -0.06 -0.85 0.02 0.00 0.00 0.00 0.00 36.38 35.49 2b39 s VAL 148 CO 0.00 -0.55 1.18 -0.36 0.00 0.00 0.00 175.10 175.38 2b39 s PHE 149 N 2.09 2.80 0.11 5.22 0.08 -1.00 -2.00 117.98 125.28 2b39 s PHE 149 Ca 0.06 0.81 -0.31 0.00 0.12 0.00 0.00 56.93 57.61 2b39 s PHE 149 Cb -0.16 -4.25 -0.07 0.00 -0.57 0.00 0.00 43.02 37.97 2b39 s PHE 149 CO -0.26 -1.32 1.24 0.95 -0.10 0.00 0.00 175.22 175.73 2b39 s THR 150 N 4.45 3.75 -0.15 0.64 -4.23 -1.26 -3.60 115.64 115.24 2b39 s THR 150 Ca 0.50 1.31 -0.27 0.00 -1.18 0.00 0.00 61.69 62.05 2b39 s THR 150 Cb -0.10 -3.84 0.07 0.00 1.34 0.00 0.00 72.50 69.97 2b39 s THR 150 CO 0.28 0.13 0.67 -0.69 -0.54 0.00 0.00 174.62 174.48 2b39 s VAL 151 N 0.74 0.00 0.00 2.29 1.01 -1.07 -3.75 120.40 119.62 2b39 s VAL 151 Ca 0.58 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.54 2b39 s VAL 151 Cb -0.32 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.09 2b39 s VAL 151 CO 0.32 -0.01 0.00 -0.90 0.00 0.00 0.00 175.10 174.51 2b39 n ASP 152 N 1.79 0.00 -0.32 3.32 5.75 0.57 -1.44 116.55 126.21 2b39 n ASP 152 Ca -0.17 -0.83 0.01 0.00 -0.01 0.00 0.00 54.79 53.79 2b39 n ASP 152 Cb 0.56 0.00 0.19 0.00 -1.03 0.00 0.00 41.12 40.84 2b39 n ASP 152 CO 0.00 0.00 0.00 -0.74 -0.11 0.00 0.00 177.20 176.35 2b39 h HIS 153 N -0.67 1.12 -0.59 2.11 -0.00 -1.87 -2.70 115.15 112.55 2b39 h HIS 153 Ca 0.00 0.03 -0.35 0.00 -0.00 0.00 0.00 60.37 60.05 2b39 h HIS 153 Cb 0.00 -0.38 -0.18 0.00 -0.00 0.00 0.00 27.41 26.86 2b39 h HIS 153 CO 0.00 0.65 0.45 1.63 -0.00 0.00 0.00 177.93 180.66 2b39 n LYS 154 N -4.44 1.85 -3.31 5.26 5.02 -1.26 -4.84 118.16 116.44 2b39 n LYS 154 Ca 0.12 -1.84 -0.23 0.00 -2.02 0.00 0.00 58.31 54.34 2b39 n LYS 154 Cb 0.10 -1.72 -0.00 0.00 -0.02 0.00 0.00 35.03 33.39 2b39 n LYS 154 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2b39 n LEU 155 N -0.23 -1.61 -4.61 -0.35 4.77 -1.02 -4.73 117.00 109.22 2b39 n LEU 155 Ca 0.36 -0.36 -0.34 0.00 -0.03 0.00 0.00 56.01 55.63 2b39 n LEU 155 Cb 0.93 -2.18 -0.10 0.00 -2.33 0.00 0.00 43.42 39.73 2b39 n LEU 155 CO 0.41 0.15 -0.30 -0.76 -1.33 0.00 0.00 177.39 175.57 2b39 s LEU 156 N -6.47 3.58 -0.46 2.23 1.43 -1.26 -3.27 118.68 114.47 2b39 s LEU 156 Ca 0.38 0.04 -0.28 0.00 -1.03 0.00 0.00 54.13 53.24 2b39 s LEU 156 Cb -0.20 -1.87 -0.09 0.00 0.03 0.00 0.00 46.19 44.07 2b39 s LEU 156 CO 0.47 0.24 2.38 -0.81 0.23 0.00 0.00 176.35 178.85 2b39 n PRO 157 N 3.10 1.15 -4.97 1.29 -0.04 -1.26 -0.32 135.00 133.96 2b39 n PRO 157 Ca -0.17 0.15 -0.32 0.00 -0.04 0.00 0.00 63.50 63.11 2b39 n PRO 157 Cb 0.53 -3.11 -0.16 0.00 -0.04 0.00 0.00 33.50 30.72 2b39 n PRO 157 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2b39 s VAL 158 N 10.51 2.35 -1.36 0.52 1.01 -1.25 -4.86 120.40 127.32 2b39 s VAL 158 Ca 1.04 -0.91 -0.11 0.00 0.00 0.00 0.00 61.98 62.00 2b39 s VAL 158 Cb -0.39 -1.94 0.11 0.00 0.00 0.00 0.00 36.38 34.16 2b39 s VAL 158 CO 0.33 0.55 2.07 0.61 0.00 0.00 0.00 175.10 178.66 2b39 n GLY 159 N 3.66 4.67 3.75 4.51 0.00 -1.26 -4.37 105.19 116.15 2b39 n GLY 159 Ca -0.19 -1.90 -0.31 0.00 0.00 0.00 0.00 46.02 43.61 2b39 n GLY 159 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2b39 s GLN 160 N 1.29 2.88 0.27 1.61 -0.21 -1.26 -4.37 119.66 119.87 2b39 s GLN 160 Ca 0.44 -0.64 -0.31 0.00 0.02 0.00 0.00 55.36 54.87 2b39 s GLN 160 Cb 0.12 -2.73 -0.12 0.00 1.00 0.00 0.00 33.01 31.28 2b39 s GLN 160 CO -0.04 0.59 1.60 0.25 -2.12 0.00 0.00 175.29 175.58 2b39 n THR 161 N 0.79 0.82 -4.27 -0.19 -2.24 -1.26 -4.24 114.28 103.69 2b39 n THR 161 Ca -0.11 -0.20 -0.21 0.00 -2.27 0.00 0.00 64.05 61.26 2b39 n THR 161 Cb 0.52 -1.92 -0.13 0.00 -2.10 0.00 0.00 70.33 66.71 2b39 n THR 161 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2b39 s VAL 162 N 0.21 1.29 -0.31 2.28 1.01 -1.16 -0.30 120.40 123.42 2b39 s VAL 162 Ca 0.67 -1.28 0.01 0.00 0.00 0.00 0.00 61.98 61.37 2b39 s VAL 162 Cb -0.51 -1.20 0.07 0.00 0.00 0.00 0.00 36.38 34.74 2b39 s VAL 162 CO 0.46 -0.10 0.00 -0.36 0.00 0.00 0.00 175.10 175.09 2b39 s PHE 163 N -1.12 3.45 -0.16 5.22 0.08 -0.37 -2.91 117.98 122.16 2b39 s PHE 163 Ca 0.01 -2.41 -0.08 0.00 0.12 0.00 0.00 56.93 54.58 2b39 s PHE 163 Cb -0.09 -2.42 -0.04 0.00 -0.57 0.00 0.00 43.02 39.89 2b39 s PHE 163 CO 0.02 -0.89 0.10 0.42 -0.10 0.00 0.00 175.22 174.77 2b39 s ILE 164 N 1.09 5.14 -0.01 0.64 1.09 -0.35 -2.82 121.20 125.98 2b39 s ILE 164 Ca -0.00 0.08 0.02 0.00 -1.10 0.00 0.00 60.65 59.65 2b39 s ILE 164 Cb -0.20 -3.29 -0.00 0.00 -1.06 0.00 0.00 42.46 37.91 2b39 s ILE 164 CO -0.05 0.51 -0.05 0.42 -0.10 0.00 0.00 174.94 175.67 2b39 s THR 165 N -0.13 0.41 -0.18 2.92 -4.23 0.68 -0.47 115.64 114.63 2b39 s THR 165 Ca 0.09 -0.21 -0.14 0.00 -1.18 0.00 0.00 61.69 60.25 2b39 s THR 165 Cb -0.12 -0.35 -0.04 0.00 1.34 0.00 0.00 72.50 73.33 2b39 s THR 165 CO 0.01 0.12 0.31 -0.63 -0.54 0.00 0.00 174.62 173.89 2b39 s ILE 166 N -0.05 5.28 0.26 2.99 1.01 -0.98 -1.29 121.20 128.42 2b39 s ILE 166 Ca 0.01 0.56 0.08 0.00 0.00 0.00 0.00 60.65 61.30 2b39 s ILE 166 Cb -0.03 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.76 2b39 s ILE 166 CO -0.00 0.35 0.11 -1.61 0.00 0.00 0.00 174.94 173.78 2b39 s GLU 167 N 0.75 2.63 0.44 2.79 2.02 -0.34 -0.38 118.70 126.60 2b39 s GLU 167 Ca 0.16 -1.23 -0.01 0.00 0.02 0.00 0.00 54.97 53.92 2b39 s GLU 167 Cb -0.13 -2.38 -0.02 0.00 0.10 0.00 0.00 34.13 31.70 2b39 s GLU 167 CO 0.05 0.38 0.67 0.95 0.02 0.00 0.00 175.26 177.33 2b39 s THR 168 N -2.23 4.40 0.00 3.63 -4.23 -0.90 -3.21 115.64 113.10 2b39 s THR 168 Ca 0.32 -0.35 0.00 0.00 -1.18 0.00 0.00 61.69 60.48 2b39 s THR 168 Cb -0.07 -3.64 0.00 0.00 1.34 0.00 0.00 72.50 70.13 2b39 s THR 168 CO 0.23 -0.48 0.14 -0.81 -0.54 0.00 0.00 174.62 173.16 2b39 n PRO 169 N -2.07 0.09 -0.16 3.99 -0.04 -1.26 0.10 135.00 135.66 2b39 n PRO 169 Ca -0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2b39 n PRO 169 Cb 0.57 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 2b39 n PRO 169 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2b39 n ASP 170 N 1.50 0.00 0.00 3.54 8.00 -1.26 -4.85 116.55 123.47 2b39 n ASP 170 Ca 0.00 -1.15 0.00 0.00 0.71 0.00 0.00 54.79 54.35 2b39 n ASP 170 Cb 0.05 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.12 2b39 n ASP 170 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b39 n GLY 171 N 0.00 -1.44 1.77 0.44 0.00 0.12 -5.06 105.19 101.02 2b39 n GLY 171 Ca 0.00 -1.48 -0.01 0.00 0.00 0.00 0.00 46.02 44.54 2b39 n GLY 171 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2b39 n ILE 172 N 0.00 -4.99 -0.56 -0.61 5.41 -1.26 -2.37 119.36 114.98 2b39 n ILE 172 Ca 0.00 0.58 -0.30 0.00 1.00 0.00 0.00 62.75 64.03 2b39 n ILE 172 Cb 0.00 -4.44 0.22 0.00 -0.71 0.00 0.00 39.64 34.71 2b39 n ILE 172 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2b39 n PRO 173 N 0.31 -2.19 0.00 0.38 -0.04 -1.26 -2.11 135.00 130.09 2b39 n PRO 173 Ca -0.06 -0.62 0.00 0.00 -0.04 0.00 0.00 63.50 62.78 2b39 n PRO 173 Cb 0.09 -1.91 0.00 0.00 -0.04 0.00 0.00 33.50 31.64 2b39 n PRO 173 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2b39 n VAL 174 N -4.77 0.00 -3.64 0.52 3.14 0.49 -4.73 118.33 109.34 2b39 n VAL 174 Ca 0.01 0.00 -0.06 0.00 -2.96 0.00 0.00 64.34 61.34 2b39 n VAL 174 Cb 0.58 0.54 -0.06 0.00 -1.06 0.00 0.00 33.84 33.84 2b39 n VAL 174 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 2b39 s LYS 175 N 0.00 0.68 -0.19 1.45 2.20 -1.24 -4.90 119.74 117.74 2b39 s LYS 175 Ca 0.00 1.26 0.01 0.00 -0.36 0.00 0.00 55.97 56.88 2b39 s LYS 175 Cb 0.00 0.28 0.03 0.00 -1.51 0.00 0.00 37.83 36.63 2b39 s LYS 175 CO 0.00 -0.16 -0.16 1.03 -0.36 0.00 0.00 175.35 175.71 2b39 s ARG 176 N 1.88 2.58 -0.03 4.03 0.52 -1.26 -2.31 118.95 124.35 2b39 s ARG 176 Ca -0.09 -0.89 0.05 0.00 -0.52 0.00 0.00 55.73 54.28 2b39 s ARG 176 Cb -0.06 -2.53 -0.03 0.00 0.52 0.00 0.00 34.95 32.85 2b39 s ARG 176 CO -0.20 -0.32 -0.16 -0.51 0.02 0.00 0.00 175.30 174.13 2b39 s ASP 177 N 1.30 3.86 -0.49 0.23 1.01 0.37 -5.02 116.67 117.94 2b39 s ASP 177 Ca 0.01 -0.27 0.04 0.00 0.71 0.00 0.00 52.55 53.04 2b39 s ASP 177 Cb -0.15 -0.74 0.17 0.00 1.01 0.00 0.00 42.92 43.21 2b39 s ASP 177 CO -0.10 0.33 0.38 -0.55 0.21 0.00 0.00 175.17 175.43 2b39 s SER 178 N -0.85 2.47 0.07 0.27 0.15 -1.26 -1.22 113.70 113.32 2b39 s SER 178 Ca 0.12 -3.26 0.06 0.00 0.70 0.00 0.00 55.95 53.57 2b39 s SER 178 Cb -0.10 -0.79 -0.04 0.00 -1.71 0.00 0.00 66.02 63.38 2b39 s SER 178 CO 0.01 -0.15 -0.12 -0.54 1.20 0.00 0.00 173.24 173.64 2b39 s LYS 179 N -0.34 2.16 0.10 5.44 1.02 -1.15 -4.96 119.74 122.01 2b39 s LYS 179 Ca 0.30 -0.97 0.07 0.00 0.02 0.00 0.00 55.97 55.40 2b39 s LYS 179 Cb 0.00 -2.29 -0.04 0.00 -0.52 0.00 0.00 37.83 34.98 2b39 s LYS 179 CO -0.18 0.53 -0.11 0.45 -0.92 0.00 0.00 175.35 175.12 2b39 s SER 180 N -1.82 4.30 -0.05 2.83 0.15 -1.26 -2.97 113.70 114.87 2b39 s SER 180 Ca 0.18 -0.40 0.05 0.00 0.70 0.00 0.00 55.95 56.47 2b39 s SER 180 Cb -0.11 -0.79 0.23 0.00 -1.71 0.00 0.00 66.02 63.64 2b39 s SER 180 CO 0.10 0.19 0.94 -1.54 1.20 0.00 0.00 173.24 174.12 2b39 n SER 181 N 0.80 2.10 -0.59 5.45 3.41 -1.26 -4.21 113.62 119.32 2b39 n SER 181 Ca -0.14 -2.21 0.11 0.00 -0.26 0.00 0.00 58.87 56.37 2b39 n SER 181 Cb 0.52 -0.46 0.02 0.00 -0.26 0.00 0.00 64.21 64.04 2b39 n SER 181 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b39 n GLN 182 N 0.17 1.51 -0.00 4.33 6.02 -1.26 -1.17 117.38 126.98 2b39 n GLN 182 Ca 0.08 -1.20 0.04 0.00 -0.01 0.00 0.00 57.00 55.90 2b39 n GLN 182 Cb 0.45 -1.45 -0.05 0.00 1.02 0.00 0.00 30.24 30.21 2b39 n GLN 182 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2b39 n ASN 183 N 0.30 1.36 -0.07 1.08 4.05 -1.26 -4.43 115.26 116.29 2b39 n ASN 183 Ca 0.10 -0.44 -0.04 0.00 0.45 0.00 0.00 54.58 54.65 2b39 n ASN 183 Cb 0.48 1.12 -0.14 0.00 1.23 0.00 0.00 39.78 42.47 2b39 n ASN 183 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 177.26 175.88 2b39 n GLN 184 N -1.38 0.98 -2.84 1.20 -0.06 -1.26 -5.08 117.38 108.94 2b39 n GLN 184 Ca 0.00 -0.05 -0.07 0.00 -2.00 0.00 0.00 57.00 54.89 2b39 n GLN 184 Cb 0.15 -1.46 0.01 0.00 -4.06 0.00 0.00 30.24 24.88 2b39 n GLN 184 CO 0.00 0.00 0.00 1.19 -0.20 0.00 0.00 177.06 178.05 2b39 n PHE 185 N -2.54 -3.57 0.00 3.69 3.72 -0.32 -4.69 117.46 113.75 2b39 n PHE 185 Ca -0.23 1.49 0.00 0.00 -0.05 0.00 0.00 57.45 58.66 2b39 n PHE 185 Cb 0.94 -3.96 0.00 0.00 -0.94 0.00 0.00 39.48 35.53 2b39 n PHE 185 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2b39 n GLY 186 N 0.01 0.74 0.94 1.37 0.00 -1.10 -4.96 105.19 102.18 2b39 n GLY 186 Ca 0.08 -1.08 -0.13 0.00 0.00 0.00 0.00 46.02 44.89 2b39 n GLY 186 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2b39 n ILE 187 N 0.00 0.38 -4.66 -0.61 5.41 -1.26 -4.24 119.36 114.38 2b39 n ILE 187 Ca 0.00 -0.14 -0.31 0.00 1.00 0.00 0.00 62.75 63.30 2b39 n ILE 187 Cb 0.00 0.00 -0.17 0.00 -0.71 0.00 0.00 39.64 38.76 2b39 n ILE 187 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2b39 s LEU 188 N 1.02 1.94 -0.16 1.39 1.43 -0.85 -4.85 118.68 118.59 2b39 s LEU 188 Ca 0.17 -0.52 -0.06 0.00 -1.03 0.00 0.00 54.13 52.69 2b39 s LEU 188 Cb -0.22 -1.27 -0.04 0.00 0.03 0.00 0.00 46.19 44.69 2b39 s LEU 188 CO 0.17 0.06 0.05 0.42 0.23 0.00 0.00 176.35 177.28 2b39 s THR 189 N 0.81 4.69 0.15 5.49 -4.23 -1.26 -1.44 115.64 119.85 2b39 s THR 189 Ca -0.09 -0.07 -0.03 0.00 -1.18 0.00 0.00 61.69 60.31 2b39 s THR 189 Cb -0.16 -3.09 -0.03 0.00 1.34 0.00 0.00 72.50 70.57 2b39 s THR 189 CO -0.00 0.50 0.13 -0.76 -0.54 0.00 0.00 174.62 173.95 2b39 s LEU 190 N 0.09 1.47 0.16 4.79 1.43 -0.05 -5.01 118.68 121.56 2b39 s LEU 190 Ca 0.05 -1.13 -0.22 0.00 -1.03 0.00 0.00 54.13 51.79 2b39 s LEU 190 Cb -0.12 0.57 0.06 0.00 0.03 0.00 0.00 46.19 46.73 2b39 s LEU 190 CO 0.01 -0.79 0.59 -0.94 0.23 0.00 0.00 176.35 175.45 2b39 s SER 191 N -3.04 -0.52 -0.26 2.29 1.04 -1.26 -1.91 113.70 110.04 2b39 s SER 191 Ca 0.24 -0.06 -0.04 0.00 0.48 0.00 0.00 55.95 56.57 2b39 s SER 191 Cb 0.06 0.60 0.15 0.00 0.10 0.00 0.00 66.02 66.93 2b39 s SER 191 CO 0.03 -0.98 0.50 0.86 0.98 0.00 0.00 173.24 174.62 2b39 s TRP 192 N -3.77 -1.18 -0.25 5.02 -0.00 -0.45 -4.99 118.94 113.33 2b39 s TRP 192 Ca 0.02 1.47 -0.29 0.00 -0.00 0.00 0.00 56.10 57.29 2b39 s TRP 192 Cb -0.01 0.37 -0.00 0.00 -0.00 0.00 0.00 33.47 33.83 2b39 s TRP 192 CO -0.12 -0.73 1.28 -0.80 -0.00 0.00 0.00 176.95 176.58 2b39 s ASN 193 N 2.72 6.79 0.04 5.86 0.02 -1.26 -0.19 114.94 128.91 2b39 s ASN 193 Ca 0.11 1.38 -0.31 0.00 -1.02 0.00 0.00 52.86 53.03 2b39 s ASN 193 Cb -0.14 -2.54 -0.06 0.00 0.02 0.00 0.00 41.25 38.52 2b39 s ASN 193 CO -0.18 -0.95 1.40 -0.63 0.02 0.00 0.00 177.10 176.76 2b39 s ILE 194 N 4.02 3.57 0.67 0.60 1.01 -0.41 -4.93 121.20 125.73 2b39 s ILE 194 Ca 0.55 1.03 -0.16 0.00 0.00 0.00 0.00 60.65 62.07 2b39 s ILE 194 Cb -0.18 -3.66 0.00 0.00 0.01 0.00 0.00 42.46 38.63 2b39 s ILE 194 CO 0.19 0.03 1.20 -2.16 0.00 0.00 0.00 174.94 174.20 2b39 s PRO 195 N 1.97 2.55 0.13 2.79 0.04 -1.25 -4.36 135.00 136.87 2b39 s PRO 195 Ca 0.64 1.74 -0.20 0.00 0.04 0.00 0.00 61.00 63.23 2b39 s PRO 195 Cb -0.33 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.29 2b39 s PRO 195 CO 0.28 -1.51 1.71 1.05 0.04 0.00 0.00 177.00 178.57 2b39 h GLU 196 N 0.21 0.03 -6.31 4.56 4.11 -1.91 -3.40 114.58 111.88 2b39 h GLU 196 Ca -0.49 -0.00 -0.56 0.00 0.07 0.00 0.00 59.36 58.38 2b39 h GLU 196 Cb 1.29 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.50 2b39 h GLU 196 CO 0.52 0.02 -0.09 -1.17 0.07 0.00 0.00 179.01 178.37 2b39 s LEU 197 N -10.36 4.35 -0.22 3.06 2.96 -1.26 -4.67 118.68 112.53 2b39 s LEU 197 Ca -0.13 1.08 -0.34 0.00 -0.22 0.00 0.00 54.13 54.51 2b39 s LEU 197 Cb 0.10 -3.23 0.15 0.00 0.50 0.00 0.00 46.19 43.71 2b39 s LEU 197 CO 0.68 0.12 1.25 0.54 -1.32 0.00 0.00 176.35 177.62 2b39 s VAL 198 N -1.44 0.00 0.32 1.68 0.11 -1.26 -4.47 120.40 115.33 2b39 s VAL 198 Ca 0.37 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 59.13 2b39 s VAL 198 Cb -0.15 -1.00 -0.12 0.00 -1.53 0.00 0.00 36.38 33.58 2b39 s VAL 198 CO 0.19 0.00 1.44 0.59 -3.33 0.00 0.00 175.10 173.99 2b39 n ASN 199 N 0.10 3.28 -4.90 3.54 3.02 -1.26 -4.86 115.26 114.18 2b39 n ASN 199 Ca 0.00 1.18 -0.33 0.00 -0.03 0.00 0.00 54.58 55.40 2b39 n ASN 199 Cb 0.58 -1.53 -0.05 0.00 -0.61 0.00 0.00 39.78 38.17 2b39 n ASN 199 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 2b39 s MET 200 N -1.26 3.53 0.00 3.52 1.75 -1.26 -4.93 119.30 120.65 2b39 s MET 200 Ca 0.60 -0.19 0.00 0.00 -1.25 0.00 0.00 55.69 54.85 2b39 s MET 200 Cb -0.55 -3.04 0.00 0.00 2.84 0.00 0.00 34.83 34.08 2b39 s MET 200 CO 0.56 0.62 0.00 0.41 -0.65 0.00 0.00 175.02 175.97 2b39 n GLY 201 N 0.80 0.08 3.33 2.11 0.00 -0.28 -4.85 105.19 106.39 2b39 n GLY 201 Ca -0.09 -1.64 -0.46 0.00 0.00 0.00 0.00 46.02 43.83 2b39 n GLY 201 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b39 s VAL 202 N -0.17 5.83 0.57 1.61 1.01 -1.26 -0.24 120.40 127.74 2b39 s VAL 202 Ca 0.00 -3.09 -0.17 0.00 0.00 0.00 0.00 61.98 58.72 2b39 s VAL 202 Cb 0.00 -4.53 -0.04 0.00 0.00 0.00 0.00 36.38 31.80 2b39 s VAL 202 CO 0.00 -1.13 1.06 0.26 0.00 0.00 0.00 175.10 175.30 2b39 s TRP 203 N -0.75 2.94 -0.04 5.22 0.52 0.90 -4.17 118.94 123.55 2b39 s TRP 203 Ca 0.26 1.53 0.02 0.00 0.02 0.00 0.00 56.10 57.93 2b39 s TRP 203 Cb -0.10 -3.05 0.01 0.00 -1.15 0.00 0.00 33.47 29.18 2b39 s TRP 203 CO -0.08 -1.14 -0.09 0.15 0.02 0.00 0.00 176.95 175.81 2b39 s LYS 204 N -3.85 1.17 0.71 4.98 1.02 -1.20 0.52 119.74 123.10 2b39 s LYS 204 Ca 0.65 -0.28 -0.05 0.00 0.02 0.00 0.00 55.97 56.31 2b39 s LYS 204 Cb -0.17 -1.05 0.09 0.00 -0.52 0.00 0.00 37.83 36.18 2b39 s LYS 204 CO 0.33 0.03 1.01 0.42 -0.92 0.00 0.00 175.35 176.21 2b39 s ILE 205 N 0.57 2.27 -0.30 2.17 1.01 0.32 -1.20 121.20 126.04 2b39 s ILE 205 Ca -0.10 -0.39 -0.16 0.00 0.00 0.00 0.00 60.65 60.01 2b39 s ILE 205 Cb -0.13 -2.88 0.18 0.00 0.01 0.00 0.00 42.46 39.63 2b39 s ILE 205 CO 0.02 0.00 1.13 -0.75 0.00 0.00 0.00 174.94 175.34 2b39 s LYS 206 N -5.22 0.14 0.23 2.79 2.20 -0.42 -3.43 119.74 116.03 2b39 s LYS 206 Ca 0.63 0.28 0.05 0.00 -0.36 0.00 0.00 55.97 56.57 2b39 s LYS 206 Cb -0.08 0.16 -0.05 0.00 -1.51 0.00 0.00 37.83 36.35 2b39 s LYS 206 CO 0.45 -0.11 -0.05 0.00 -0.36 0.00 0.00 175.35 175.28 2b39 s ALA 207 N 2.67 1.95 0.14 3.13 0.00 -1.04 -0.23 121.76 128.38 2b39 s ALA 207 Ca -0.03 -1.76 -0.24 0.00 0.00 0.00 0.00 51.96 49.94 2b39 s ALA 207 Cb -0.07 0.27 0.07 0.00 0.00 0.00 0.00 23.12 23.40 2b39 s ALA 207 CO -0.12 -0.14 0.65 1.52 0.00 0.00 0.00 175.76 177.67 2b39 s TYR 208 N -3.23 -0.50 0.19 0.00 1.13 -1.13 -1.42 117.35 112.40 2b39 s TYR 208 Ca 0.26 0.29 -0.30 0.00 -1.41 0.00 0.00 57.07 55.91 2b39 s TYR 208 Cb 0.04 0.56 -0.08 0.00 -1.10 0.00 0.00 41.96 41.38 2b39 s TYR 208 CO 0.08 -0.82 1.02 0.71 -2.51 0.00 0.00 175.55 174.03 2b39 s TYR 209 N -3.66 3.77 0.27 -3.49 1.51 -1.26 -1.24 117.35 113.25 2b39 s TYR 209 Ca 0.02 1.76 -0.00 0.00 -1.01 0.00 0.00 57.07 57.84 2b39 s TYR 209 Cb -0.01 -3.13 0.54 0.00 -0.11 0.00 0.00 41.96 39.25 2b39 s TYR 209 CO -0.12 -0.06 1.79 1.49 -1.11 0.00 0.00 175.55 177.54 2b39 h GLU 210 N 4.79 0.73 -1.69 -0.62 4.81 -1.01 -2.77 114.58 118.82 2b39 h GLU 210 Ca -0.44 -0.04 -0.61 0.00 -0.13 0.00 0.00 59.36 58.13 2b39 h GLU 210 Cb 1.21 -0.16 -0.23 0.00 0.63 0.00 0.00 28.75 30.19 2b39 h GLU 210 CO 0.70 0.48 0.75 -0.25 -0.73 0.00 0.00 179.01 179.97 2b39 n ASP 211 N -4.78 7.15 0.00 1.04 8.00 -1.26 -4.25 116.55 122.45 2b39 n ASP 211 Ca 0.18 -3.55 0.00 0.00 0.71 0.00 0.00 54.79 52.12 2b39 n ASP 211 Cb 0.41 -1.09 0.00 0.00 -0.02 0.00 0.00 41.12 40.42 2b39 n ASP 211 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2b39 n SER 212 N -0.14 0.00 0.22 -2.24 3.41 -1.05 -5.09 113.62 108.73 2b39 n SER 212 Ca 0.51 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 59.26 2b39 n SER 212 Cb 0.47 0.00 0.30 0.00 -0.26 0.00 0.00 64.21 64.72 2b39 n SER 212 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2b39 h PRO 213 N 0.00 0.00 0.00 4.33 0.13 -1.73 -3.38 132.00 131.35 2b39 h PRO 213 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2b39 h PRO 213 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2b39 h PRO 213 CO 0.00 0.00 0.00 1.96 -0.23 0.00 0.00 178.00 179.73 2b39 h GLN 214 N 0.00 0.00 -5.94 0.86 4.20 -1.97 -3.40 115.11 108.86 2b39 h GLN 214 Ca 0.00 0.00 -0.68 0.00 0.06 0.00 0.00 58.65 58.03 2b39 h GLN 214 Cb 0.86 0.00 -0.27 0.00 0.30 0.00 0.00 27.48 28.38 2b39 h GLN 214 CO 0.00 0.00 -0.80 1.14 -0.67 0.00 0.00 178.83 178.50 2b39 s GLN 215 N -3.70 2.78 -0.05 1.46 0.00 -1.26 -5.11 119.66 113.78 2b39 s GLN 215 Ca -0.02 -0.75 0.00 0.00 -0.00 0.00 0.00 55.36 54.59 2b39 s GLN 215 Cb 0.09 -2.39 0.03 0.00 0.00 0.00 0.00 33.01 30.73 2b39 s GLN 215 CO 0.32 0.43 -0.01 0.08 0.00 0.00 0.00 175.29 176.11 2b39 s VAL 216 N -0.25 0.36 -0.01 3.63 1.01 -1.26 -4.70 120.40 119.17 2b39 s VAL 216 Ca 0.01 0.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.71 2b39 s VAL 216 Cb -0.13 -0.45 -0.04 0.00 0.00 0.00 0.00 36.38 35.76 2b39 s VAL 216 CO 0.03 0.21 1.11 -0.36 0.00 0.00 0.00 175.10 176.09 2b39 s PHE 217 N 1.29 3.43 0.58 5.22 0.08 -0.50 -4.92 117.98 123.16 2b39 s PHE 217 Ca -0.06 1.42 0.05 0.00 0.12 0.00 0.00 56.93 58.46 2b39 s PHE 217 Cb -0.13 -3.31 0.11 0.00 -0.57 0.00 0.00 43.02 39.11 2b39 s PHE 217 CO -0.02 -0.80 0.80 -1.13 -0.10 0.00 0.00 175.22 173.96 2b39 n SER 218 N 4.47 1.59 0.00 1.36 3.41 -1.26 -2.51 113.62 120.68 2b39 n SER 218 Ca 0.09 -2.22 0.00 0.00 -0.26 0.00 0.00 58.87 56.47 2b39 n SER 218 Cb 0.48 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 2b39 n SER 218 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b39 n ALA 219 N -2.63 0.00 -2.90 7.33 0.00 -1.22 -4.72 120.51 116.37 2b39 n ALA 219 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.07 2b39 n ALA 219 Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.95 2b39 n ALA 219 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2b39 s GLU 220 N 0.00 3.24 0.02 0.00 -1.05 -1.26 0.12 118.70 119.77 2b39 s GLU 220 Ca 0.00 -0.77 -0.14 0.00 -0.15 0.00 0.00 54.97 53.91 2b39 s GLU 220 Cb 0.00 -2.81 0.02 0.00 -0.44 0.00 0.00 34.13 30.90 2b39 s GLU 220 CO 0.00 0.47 0.30 -0.59 0.95 0.00 0.00 175.26 176.39 2b39 s PHE 221 N -1.87 -0.13 -0.11 4.83 -0.12 0.18 -4.84 117.98 115.92 2b39 s PHE 221 Ca 0.33 0.07 -0.03 0.00 -0.05 0.00 0.00 56.93 57.26 2b39 s PHE 221 Cb -0.10 0.09 -0.03 0.00 -0.63 0.00 0.00 43.02 42.35 2b39 s PHE 221 CO 0.27 -0.46 -0.02 -2.00 -0.05 0.00 0.00 175.22 172.97 2b39 s GLU 222 N -2.09 3.27 -0.25 1.99 2.12 -0.09 -0.07 118.70 123.59 2b39 s GLU 222 Ca -0.08 -0.46 -0.04 0.00 0.36 0.00 0.00 54.97 54.74 2b39 s GLU 222 Cb -0.03 -2.84 0.00 0.00 0.26 0.00 0.00 34.13 31.53 2b39 s GLU 222 CO -0.00 0.50 -0.01 0.08 -0.54 0.00 0.00 175.26 175.29 2b39 s VAL 223 N -0.34 3.51 0.34 3.70 1.01 0.66 0.42 120.40 129.70 2b39 s VAL 223 Ca 0.06 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.44 2b39 s VAL 223 Cb -0.12 -2.69 -0.00 0.00 0.00 0.00 0.00 36.38 33.57 2b39 s VAL 223 CO 0.02 0.29 0.03 0.29 0.00 0.00 0.00 175.10 175.73 2b39 n LYS 224 N 4.80 1.02 -4.04 2.72 5.02 0.28 -1.12 118.16 126.84 2b39 n LYS 224 Ca -0.17 -2.54 -0.27 0.00 -2.02 0.00 0.00 58.31 53.31 2b39 n LYS 224 Cb 0.49 0.86 -0.05 0.00 -0.02 0.00 0.00 35.03 36.32 2b39 n LYS 224 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2b39 s GLU 225 N -3.23 3.07 -0.40 1.97 -1.05 -1.26 -3.97 118.70 113.83 2b39 s GLU 225 Ca 0.04 -0.76 -0.42 0.00 -0.15 0.00 0.00 54.97 53.68 2b39 s GLU 225 Cb 0.00 -2.75 -0.17 0.00 -0.44 0.00 0.00 34.13 30.77 2b39 s GLU 225 CO 0.03 0.51 1.91 0.98 0.95 0.00 0.00 175.26 179.64 2b39 n TYR 226 N -0.31 1.66 -4.11 4.83 9.36 -1.26 -4.73 117.16 122.60 2b39 n TYR 226 Ca -0.08 0.67 -0.33 0.00 3.32 0.00 0.00 57.90 61.49 2b39 n TYR 226 Cb 0.54 -2.38 -0.16 0.00 -0.63 0.00 0.00 39.34 36.71 2b39 n TYR 226 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2b39 s VAL 227 N 4.88 2.01 -0.54 2.97 1.01 -1.26 -5.00 120.40 124.47 2b39 s VAL 227 Ca 1.08 -0.92 0.04 0.00 0.00 0.00 0.00 61.98 62.18 2b39 s VAL 227 Cb -1.23 -1.83 0.16 0.00 0.00 0.00 0.00 36.38 33.48 2b39 s VAL 227 CO 0.66 0.52 0.37 -0.22 0.00 0.00 0.00 175.10 176.43 2b39 s LEU 228 N 1.31 3.24 0.08 3.92 2.96 -1.26 -4.03 118.68 124.89 2b39 s LEU 228 Ca 0.05 -3.27 -0.24 0.00 -0.22 0.00 0.00 54.13 50.45 2b39 s LEU 228 Cb -0.13 -1.12 -0.06 0.00 0.50 0.00 0.00 46.19 45.37 2b39 s LEU 228 CO -0.13 -0.16 0.73 -2.16 -1.32 0.00 0.00 176.35 173.31 2b39 s PRO 229 N -0.49 4.47 0.11 0.98 0.04 -1.26 -4.92 135.00 133.93 2b39 s PRO 229 Ca 0.25 1.03 -0.06 0.00 0.04 0.00 0.00 61.00 62.25 2b39 s PRO 229 Cb -0.08 -3.32 -0.17 0.00 0.04 0.00 0.00 34.50 30.98 2b39 s PRO 229 CO -0.12 0.41 1.24 0.66 0.04 0.00 0.00 177.00 179.23 2b39 h SER 230 N 5.14 0.58 -3.57 6.66 4.64 -1.97 -3.43 113.55 121.60 2b39 h SER 230 Ca -0.46 -0.50 -0.54 0.00 -0.47 0.00 0.00 61.79 59.82 2b39 h SER 230 Cb 1.21 -0.18 -0.33 0.00 -0.31 0.00 0.00 62.40 62.79 2b39 h SER 230 CO 0.69 1.32 -0.83 0.72 -0.87 0.00 0.00 176.83 177.86 2b39 s PHE 231 N -3.11 1.63 0.81 4.77 -0.12 -1.26 -1.96 117.98 118.73 2b39 s PHE 231 Ca -0.06 -0.56 -0.12 0.00 -0.05 0.00 0.00 56.93 56.14 2b39 s PHE 231 Cb 0.08 -1.14 0.08 0.00 -0.63 0.00 0.00 43.02 41.40 2b39 s PHE 231 CO 0.88 -0.25 1.13 -2.00 -0.05 0.00 0.00 175.22 174.93 2b39 s GLU 232 N 0.42 2.01 -0.33 1.99 2.12 0.19 -4.91 118.70 120.18 2b39 s GLU 232 Ca -0.11 0.39 0.03 0.00 0.36 0.00 0.00 54.97 55.64 2b39 s GLU 232 Cb -0.14 -1.93 0.16 0.00 0.26 0.00 0.00 34.13 32.48 2b39 s GLU 232 CO 0.04 -1.62 0.44 0.08 -0.54 0.00 0.00 175.26 173.66 2b39 s VAL 233 N -3.33 -0.61 0.08 3.70 1.01 -1.26 -2.84 120.40 117.15 2b39 s VAL 233 Ca 0.61 -0.46 -0.12 0.00 0.00 0.00 0.00 61.98 62.01 2b39 s VAL 233 Cb -0.13 -0.74 -0.06 0.00 0.00 0.00 0.00 36.38 35.45 2b39 s VAL 233 CO 0.52 -0.33 0.45 -1.10 0.00 0.00 0.00 175.10 174.64 2b39 s GLN 234 N 2.10 3.87 -0.11 2.72 -0.21 0.26 -4.74 119.66 123.55 2b39 s GLN 234 Ca 0.13 0.33 0.00 0.00 0.02 0.00 0.00 55.36 55.85 2b39 s GLN 234 Cb -0.12 -3.04 0.02 0.00 1.00 0.00 0.00 33.01 30.87 2b39 s GLN 234 CO -0.18 0.57 -0.10 -0.51 -2.12 0.00 0.00 175.29 172.95 2b39 s LEU 235 N -1.70 1.40 -0.00 2.90 1.43 -1.26 -1.76 118.68 119.69 2b39 s LEU 235 Ca 0.32 -0.34 -0.03 0.00 -1.03 0.00 0.00 54.13 53.05 2b39 s LEU 235 Cb -0.15 -0.90 -0.00 0.00 0.03 0.00 0.00 46.19 45.16 2b39 s LEU 235 CO 0.17 -0.07 0.06 -1.61 0.23 0.00 0.00 176.35 175.13 2b39 s GLU 236 N 1.38 0.27 0.51 1.70 0.41 -1.22 -4.83 118.70 116.93 2b39 s GLU 236 Ca -0.00 -0.27 -0.10 0.00 -0.41 0.00 0.00 54.97 54.19 2b39 s GLU 236 Cb -0.13 0.11 -0.05 0.00 -1.78 0.00 0.00 34.13 32.27 2b39 s GLU 236 CO -0.05 -0.05 0.89 -1.25 -0.49 0.00 0.00 175.26 174.30 2b39 s PRO 237 N -0.84 3.67 0.30 0.39 0.04 -1.26 -1.33 135.00 135.96 2b39 s PRO 237 Ca -0.09 0.54 0.23 0.00 0.04 0.00 0.00 61.00 61.71 2b39 s PRO 237 Cb -0.06 -2.25 1.09 0.00 0.04 0.00 0.00 34.50 33.32 2b39 s PRO 237 CO 0.00 -0.29 1.70 -0.85 0.04 0.00 0.00 177.00 177.60 2b39 n GLU 238 N -2.10 0.17 -3.52 4.56 0.28 -1.25 -4.67 120.64 114.12 2b39 n GLU 238 Ca 0.03 0.53 -0.17 0.00 -0.16 0.00 0.00 57.16 57.40 2b39 n GLU 238 Cb 0.54 -1.93 -0.05 0.00 1.43 0.00 0.00 31.44 31.43 2b39 n GLU 238 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2b39 s GLU 239 N -3.44 1.03 0.00 3.44 2.02 -1.26 -5.07 118.70 115.42 2b39 s GLU 239 Ca 0.01 0.18 -0.03 0.00 0.02 0.00 0.00 54.97 55.14 2b39 s GLU 239 Cb 0.08 0.48 -0.15 0.00 0.10 0.00 0.00 34.13 34.64 2b39 s GLU 239 CO 0.30 -0.34 2.53 1.17 0.02 0.00 0.00 175.26 178.95 2b39 n LYS 240 N 0.76 1.32 -3.24 1.61 3.00 -1.26 -4.83 118.16 115.53 2b39 n LYS 240 Ca -0.18 -0.57 0.00 0.00 -0.00 0.00 0.00 58.31 57.56 2b39 n LYS 240 Cb 0.58 -1.69 0.00 0.00 0.00 0.00 0.00 35.03 33.92 2b39 n LYS 240 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.40 179.37 2b39 n PHE 241 N 2.38 0.00 -3.25 5.64 1.16 -1.26 -4.52 117.46 117.61 2b39 n PHE 241 Ca 0.25 0.00 -0.03 0.00 -1.87 0.00 0.00 57.45 55.80 2b39 n PHE 241 Cb 0.62 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 38.45 2b39 n PHE 241 CO 0.00 0.00 0.00 -0.47 -1.87 0.00 0.00 176.76 174.42 2b39 s TYR 242 N -2.21 -1.27 -0.28 2.97 5.04 0.22 -4.87 117.35 116.95 2b39 s TYR 242 Ca 0.00 1.04 -0.29 0.00 -2.44 0.00 0.00 57.07 55.38 2b39 s TYR 242 Cb 0.00 0.20 -0.02 0.00 0.35 0.00 0.00 41.96 42.49 2b39 s TYR 242 CO 0.00 -0.88 1.71 -0.47 -1.34 0.00 0.00 175.55 174.56 2b39 s TYR 243 N 2.69 1.95 0.00 4.97 5.04 -1.24 -3.07 117.35 127.69 2b39 s TYR 243 Ca 0.14 0.57 0.00 0.00 -2.44 0.00 0.00 57.07 55.34 2b39 s TYR 243 Cb -0.14 -4.08 0.00 0.00 0.35 0.00 0.00 41.96 38.09 2b39 s TYR 243 CO -0.22 -2.96 0.00 -0.89 -1.34 0.00 0.00 175.55 170.13 2b39 n ILE 244 N 6.95 0.00 -0.13 3.14 5.41 -1.26 -3.29 119.36 130.18 2b39 n ILE 244 Ca 0.21 0.00 -0.25 0.00 1.00 0.00 0.00 62.75 63.70 2b39 n ILE 244 Cb 0.46 0.00 -0.09 0.00 -0.71 0.00 0.00 39.64 39.30 2b39 n ILE 244 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 2b39 n ASP 245 N -2.96 1.94 -4.38 4.38 5.68 -1.26 -5.03 116.55 114.91 2b39 n ASP 245 Ca 0.00 0.36 -0.62 0.00 -0.50 0.00 0.00 54.79 54.03 2b39 n ASP 245 Cb 0.00 -0.84 -0.09 0.00 -1.14 0.00 0.00 41.12 39.05 2b39 n ASP 245 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2b39 n ASP 246 N -4.32 0.96 0.30 -1.12 5.75 -1.21 -4.82 116.55 112.09 2b39 n ASP 246 Ca -0.45 1.10 0.17 0.00 -0.01 0.00 0.00 54.79 55.60 2b39 n ASP 246 Cb 0.79 -0.82 0.89 0.00 -1.03 0.00 0.00 41.12 40.95 2b39 n ASP 246 CO 0.00 0.00 0.00 -0.65 -0.11 0.00 0.00 177.20 176.44 2b39 h PRO 247 N 4.37 0.00 -3.62 0.11 0.11 -1.95 -3.34 132.00 127.68 2b39 h PRO 247 Ca -0.42 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.42 2b39 h PRO 247 Cb 1.28 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.40 2b39 h PRO 247 CO 0.86 0.00 2.13 -0.25 -0.21 0.00 0.00 178.00 180.54 2b39 n ASP 248 N -2.81 3.45 -4.45 -2.05 8.00 -1.26 -4.89 116.55 112.55 2b39 n ASP 248 Ca -0.02 -2.23 -0.52 0.00 0.71 0.00 0.00 54.79 52.73 2b39 n ASP 248 Cb 0.24 -0.92 -0.05 0.00 -0.02 0.00 0.00 41.12 40.37 2b39 n ASP 248 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b39 n GLY 249 N 3.84 -1.10 3.51 0.44 0.00 -1.26 -4.61 105.19 106.02 2b39 n GLY 249 Ca 0.31 0.51 -0.39 0.00 0.00 0.00 0.00 46.02 46.45 2b39 n GLY 249 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2b39 n LEU 250 N 1.80 0.83 -3.67 0.99 4.32 -1.26 -4.64 117.00 115.36 2b39 n LEU 250 Ca 0.19 -0.04 -0.42 0.00 -0.02 0.00 0.00 56.01 55.72 2b39 n LEU 250 Cb 0.18 -1.10 -0.00 0.00 -1.62 0.00 0.00 43.42 40.88 2b39 n LEU 250 CO 0.58 -0.99 2.76 0.29 -1.22 0.00 0.00 177.39 178.81 2b39 n LYS 251 N 8.58 3.04 -1.55 3.23 4.76 -1.26 -4.29 118.16 130.67 2b39 n LYS 251 Ca 0.58 -2.59 -0.35 0.00 -2.87 0.00 0.00 58.31 53.07 2b39 n LYS 251 Cb 0.18 -3.19 -0.04 0.00 -1.84 0.00 0.00 35.03 30.14 2b39 n LYS 251 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 2b39 n VAL 252 N 4.75 -0.08 -1.95 -0.18 0.24 -1.26 -3.76 118.33 116.08 2b39 n VAL 252 Ca 0.56 -0.75 -0.42 0.00 -2.04 0.00 0.00 64.34 61.69 2b39 n VAL 252 Cb 0.36 -2.64 -0.03 0.00 -1.47 0.00 0.00 33.84 30.07 2b39 n VAL 252 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 2b39 s ASN 253 N 12.01 6.63 0.02 -1.34 2.47 -0.44 -3.89 114.94 130.40 2b39 s ASN 253 Ca 1.00 2.35 -0.20 0.00 0.42 0.00 0.00 52.86 56.43 2b39 s ASN 253 Cb -0.23 -2.54 -0.06 0.00 -1.45 0.00 0.00 41.25 36.97 2b39 s ASN 253 CO 0.27 -0.92 0.59 -0.63 -3.72 0.00 0.00 177.10 172.68 2b39 s ILE 254 N 3.66 4.85 -0.27 -5.21 1.01 -0.82 -3.38 121.20 121.04 2b39 s ILE 254 Ca 0.75 1.24 0.00 0.00 0.00 0.00 0.00 60.65 62.64 2b39 s ILE 254 Cb -0.36 -3.92 0.08 0.00 0.01 0.00 0.00 42.46 38.26 2b39 s ILE 254 CO 0.32 0.46 0.03 -0.63 0.00 0.00 0.00 174.94 175.12 2b39 s ILE 255 N -0.48 1.25 -0.50 2.92 1.01 -0.72 -2.94 121.20 121.74 2b39 s ILE 255 Ca 0.30 -1.34 0.03 0.00 0.00 0.00 0.00 60.65 59.65 2b39 s ILE 255 Cb -0.19 -1.76 0.14 0.00 0.01 0.00 0.00 42.46 40.67 2b39 s ILE 255 CO 0.18 -0.39 0.30 0.00 0.00 0.00 0.00 174.94 175.03 2b39 s ALA 256 N 1.47 2.56 0.31 9.38 0.00 -1.24 0.92 121.76 135.16 2b39 s ALA 256 Ca 0.03 -2.91 0.10 0.00 0.00 0.00 0.00 51.96 49.18 2b39 s ALA 256 Cb -0.18 -1.95 -0.05 0.00 0.00 0.00 0.00 23.12 20.93 2b39 s ALA 256 CO -0.13 -2.05 -0.08 -0.98 0.00 0.00 0.00 175.76 172.52 2b39 s ARG 257 N -0.09 1.94 0.50 0.00 1.70 -1.13 -3.35 118.95 118.52 2b39 s ARG 257 Ca 0.20 -1.74 -0.21 0.00 -0.47 0.00 0.00 55.73 53.52 2b39 s ARG 257 Cb -0.18 -1.87 -0.07 0.00 -0.57 0.00 0.00 34.95 32.25 2b39 s ARG 257 CO -0.05 0.23 1.12 -0.06 -1.08 0.00 0.00 175.30 175.47 2b39 s PHE 258 N -2.50 2.81 -1.59 5.89 0.08 -0.97 -0.64 117.98 121.06 2b39 s PHE 258 Ca 0.32 1.55 0.00 0.00 0.12 0.00 0.00 56.93 58.93 2b39 s PHE 258 Cb -0.02 -3.27 0.00 0.00 -0.57 0.00 0.00 43.02 39.16 2b39 s PHE 258 CO 0.18 -1.38 0.64 1.28 -0.10 0.00 0.00 175.22 175.84 2b39 n LEU 259 N -0.97 0.00 -0.05 -0.37 4.77 -0.83 -2.74 117.00 116.81 2b39 n LEU 259 Ca 0.10 0.16 -0.09 0.00 -0.03 0.00 0.00 56.01 56.14 2b39 n LEU 259 Cb 0.50 -0.16 -0.04 0.00 -2.33 0.00 0.00 43.42 41.40 2b39 n LEU 259 CO 0.43 -0.16 -0.83 -1.22 -1.33 0.00 0.00 177.39 174.28 2b39 n TYR 260 N -1.14 0.00 0.00 -1.77 4.01 -1.26 -5.08 117.16 111.91 2b39 n TYR 260 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2b39 n TYR 260 Cb 0.01 -0.35 0.00 0.00 -0.31 0.00 0.00 39.34 38.68 2b39 n TYR 260 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2b39 n GLY 261 N 2.56 1.02 3.69 2.72 0.00 -1.11 -5.04 105.19 109.03 2b39 n GLY 261 Ca -0.19 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.33 2b39 n GLY 261 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2b39 n GLU 262 N 0.00 2.68 -2.06 1.61 1.02 -1.26 -4.68 120.64 117.94 2b39 n GLU 262 Ca 0.00 0.97 -0.42 0.00 -0.02 0.00 0.00 57.16 57.69 2b39 n GLU 262 Cb 0.00 -2.86 -0.03 0.00 -0.02 0.00 0.00 31.44 28.53 2b39 n GLU 262 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2b39 s GLN 263 N 2.75 4.26 0.37 3.49 -1.52 -1.26 -2.28 119.66 125.47 2b39 s GLN 263 Ca 0.83 2.19 -0.26 0.00 -1.95 0.00 0.00 55.36 56.17 2b39 s GLN 263 Cb -0.52 -3.31 -0.09 0.00 -0.22 0.00 0.00 33.01 28.87 2b39 s GLN 263 CO 0.39 -0.55 1.13 0.08 -0.25 0.00 0.00 175.29 176.09 2b39 s VAL 264 N 1.50 3.34 -0.34 1.09 1.01 -1.21 -4.85 120.40 120.93 2b39 s VAL 264 Ca 0.68 1.17 -0.01 0.00 0.00 0.00 0.00 61.98 63.82 2b39 s VAL 264 Cb -0.39 -3.67 0.12 0.00 0.00 0.00 0.00 36.38 32.44 2b39 s VAL 264 CO 0.30 0.14 0.16 -0.62 0.00 0.00 0.00 175.10 175.09 2b39 s ASP 265 N -1.14 3.61 0.00 3.32 -1.08 -1.26 -1.13 116.67 119.00 2b39 s ASP 265 Ca 0.54 -1.91 0.00 0.00 -0.52 0.00 0.00 52.55 50.66 2b39 s ASP 265 Cb -0.29 -0.70 0.00 0.00 -1.46 0.00 0.00 42.92 40.47 2b39 s ASP 265 CO 0.37 -0.36 0.00 0.61 0.52 0.00 0.00 175.17 176.31 2b39 n GLY 266 N 4.46 3.64 3.32 2.66 0.00 -0.64 -3.50 105.19 115.13 2b39 n GLY 266 Ca 0.03 -0.18 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 2b39 n GLY 266 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2b39 s THR 267 N 1.53 -0.00 -0.02 2.61 -1.32 -1.16 -2.02 115.64 115.26 2b39 s THR 267 Ca 0.00 0.02 0.05 0.00 -1.21 0.00 0.00 61.69 60.55 2b39 s THR 267 Cb 0.00 -0.60 -0.01 0.00 -1.51 0.00 0.00 72.50 70.37 2b39 s THR 267 CO 0.00 0.01 -0.18 0.00 -2.21 0.00 0.00 174.62 172.24 2b39 s ALA 268 N 0.43 1.50 -0.33 11.08 0.00 -1.24 -1.56 121.76 131.64 2b39 s ALA 268 Ca -0.02 -0.77 -0.10 0.00 0.00 0.00 0.00 51.96 51.08 2b39 s ALA 268 Cb -0.04 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.69 2b39 s ALA 268 CO -0.02 0.36 0.17 -0.06 0.00 0.00 0.00 175.76 176.21 2b39 s PHE 269 N -0.37 3.19 0.01 0.00 0.08 -0.62 -3.06 117.98 117.21 2b39 s PHE 269 Ca 0.06 -0.64 -0.01 0.00 0.12 0.00 0.00 56.93 56.46 2b39 s PHE 269 Cb -0.07 -2.38 -0.04 0.00 -0.57 0.00 0.00 43.02 39.96 2b39 s PHE 269 CO -0.00 -0.49 0.12 0.08 -0.10 0.00 0.00 175.22 174.82 2b39 s VAL 270 N 1.60 4.95 -0.27 -0.44 1.01 -1.19 -2.38 120.40 123.68 2b39 s VAL 270 Ca 0.04 -0.39 -0.01 0.00 0.00 0.00 0.00 61.98 61.62 2b39 s VAL 270 Cb -0.18 -3.30 0.13 0.00 0.00 0.00 0.00 36.38 33.03 2b39 s VAL 270 CO 0.07 0.30 0.32 -0.63 0.00 0.00 0.00 175.10 175.15 2b39 s ILE 271 N -1.28 -0.48 0.99 2.22 1.01 -1.13 -2.73 121.20 119.81 2b39 s ILE 271 Ca 0.26 -0.31 -0.15 0.00 0.00 0.00 0.00 60.65 60.45 2b39 s ILE 271 Cb -0.12 -0.91 0.19 0.00 0.01 0.00 0.00 42.46 41.63 2b39 s ILE 271 CO 0.17 -0.32 1.19 -0.36 0.00 0.00 0.00 174.94 175.63 2b39 s PHE 272 N 2.43 1.74 0.00 3.97 0.08 -1.26 -3.96 117.98 120.98 2b39 s PHE 272 Ca 0.10 0.59 0.00 0.00 0.12 0.00 0.00 56.93 57.73 2b39 s PHE 272 Cb -0.14 -3.65 0.00 0.00 -0.57 0.00 0.00 43.02 38.66 2b39 s PHE 272 CO -0.26 -2.80 0.00 0.41 -0.10 0.00 0.00 175.22 172.47 2b39 n GLY 273 N -2.46 0.79 3.76 4.36 0.00 -1.18 -3.13 105.19 107.33 2b39 n GLY 273 Ca 0.11 0.52 -0.39 0.00 0.00 0.00 0.00 46.02 46.27 2b39 n GLY 273 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b39 s VAL 274 N 0.00 2.35 -0.01 1.61 1.01 -1.16 -3.24 120.40 120.95 2b39 s VAL 274 Ca 0.00 0.28 0.01 0.00 0.00 0.00 0.00 61.98 62.26 2b39 s VAL 274 Cb 0.00 -3.15 0.01 0.00 0.00 0.00 0.00 36.38 33.24 2b39 s VAL 274 CO 0.00 0.01 -0.01 -1.58 0.00 0.00 0.00 175.10 173.52 2b39 s GLN 275 N -2.69 0.24 0.00 2.72 0.74 -1.14 -1.38 119.66 118.16 2b39 s GLN 275 Ca 0.66 -0.02 0.17 0.00 0.05 0.00 0.00 55.36 56.22 2b39 s GLN 275 Cb -0.38 -0.31 0.42 0.00 1.10 0.00 0.00 33.01 33.83 2b39 s GLN 275 CO 0.47 -0.02 1.34 -0.25 -0.55 0.00 0.00 175.29 176.27 2b39 n ASP 276 N 3.48 3.27 0.00 6.67 8.00 -1.18 -2.33 116.55 134.46 2b39 n ASP 276 Ca -0.19 -1.95 0.00 0.00 0.71 0.00 0.00 54.79 53.36 2b39 n ASP 276 Cb 0.55 -0.30 0.00 0.00 -0.02 0.00 0.00 41.12 41.35 2b39 n ASP 276 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b39 n GLY 277 N 1.06 2.14 1.92 0.44 0.00 -1.26 -4.85 105.19 104.64 2b39 n GLY 277 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2b39 n GLY 277 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2b39 n ASP 278 N 0.00 -0.03 -4.79 1.61 -0.08 -1.26 -5.14 116.55 106.86 2b39 n ASP 278 Ca 0.00 0.16 -0.35 0.00 -1.51 0.00 0.00 54.79 53.09 2b39 n ASP 278 Cb 0.00 0.12 -0.03 0.00 2.34 0.00 0.00 41.12 43.55 2b39 n ASP 278 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2b39 s ARG 279 N -1.34 3.90 -0.18 -0.67 1.70 -1.26 -5.08 118.95 116.02 2b39 s ARG 279 Ca 0.00 1.43 -0.01 0.00 -0.47 0.00 0.00 55.73 56.68 2b39 s ARG 279 Cb 0.00 -2.24 0.00 0.00 -0.57 0.00 0.00 34.95 32.14 2b39 s ARG 279 CO 0.00 -0.36 -0.14 1.03 -1.08 0.00 0.00 175.30 174.76 2b39 s ARG 280 N -2.99 3.20 -0.85 3.89 0.52 -1.26 -3.13 118.95 118.33 2b39 s ARG 280 Ca 0.64 -0.74 -0.03 0.00 -0.52 0.00 0.00 55.73 55.08 2b39 s ARG 280 Cb -0.19 -2.71 0.21 0.00 0.52 0.00 0.00 34.95 32.78 2b39 s ARG 280 CO 0.23 -0.10 0.73 -1.50 0.02 0.00 0.00 175.30 174.68 2b39 s ILE 281 N 1.12 4.42 -0.80 1.52 2.07 -0.48 -5.02 121.20 124.03 2b39 s ILE 281 Ca 0.01 -3.55 -0.24 0.00 -1.41 0.00 0.00 60.65 55.45 2b39 s ILE 281 Cb -0.14 -3.76 -0.16 0.00 0.13 0.00 0.00 42.46 38.53 2b39 s ILE 281 CO -0.04 -1.05 2.40 -1.54 -1.91 0.00 0.00 174.94 172.80 2b39 n SER 282 N 2.72 1.53 -4.56 4.50 3.41 -1.26 -2.97 113.62 116.98 2b39 n SER 282 Ca 0.18 -1.39 -0.21 0.00 -0.26 0.00 0.00 58.87 57.19 2b39 n SER 282 Cb 0.38 -1.56 -0.06 0.00 -0.26 0.00 0.00 64.21 62.71 2b39 n SER 282 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2b39 n LEU 283 N 17.55 1.94 -0.27 1.04 4.77 -1.18 -4.82 117.00 136.02 2b39 n LEU 283 Ca 0.49 -1.16 0.08 0.00 -0.03 0.00 0.00 56.01 55.38 2b39 n LEU 283 Cb 0.41 -1.63 0.20 0.00 -2.33 0.00 0.00 43.42 40.07 2b39 n LEU 283 CO 0.59 -2.28 0.86 0.71 -1.33 0.00 0.00 177.39 175.94 2b39 h THR 284 N 7.70 0.32 -0.10 -5.08 1.35 -1.87 -1.61 112.91 113.62 2b39 h THR 284 Ca -0.08 -0.05 -0.05 0.00 -0.55 0.00 0.00 66.41 65.68 2b39 h THR 284 Cb 1.09 0.17 -0.01 0.00 -1.73 0.00 0.00 68.15 67.67 2b39 h THR 284 CO 1.06 0.02 -0.19 0.45 -0.25 0.00 0.00 175.52 176.62 2b39 h HIS 285 N 0.13 0.18 -0.56 4.73 3.86 -1.96 -3.30 115.15 118.23 2b39 h HIS 285 Ca 0.46 -0.02 0.09 0.00 -1.16 0.00 0.00 60.37 59.74 2b39 h HIS 285 Cb 0.86 -0.05 -0.10 0.00 1.06 0.00 0.00 27.41 29.18 2b39 h HIS 285 CO -0.38 0.36 -0.20 0.43 0.86 0.00 0.00 177.93 179.00 2b39 n SER 286 N -4.25 -0.32 -4.66 2.45 7.64 -0.60 -4.68 113.62 109.20 2b39 n SER 286 Ca -0.01 0.98 -0.45 0.00 1.01 0.00 0.00 58.87 60.39 2b39 n SER 286 Cb 0.29 -0.24 -0.03 0.00 -1.01 0.00 0.00 64.21 63.22 2b39 n SER 286 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b39 n LEU 287 N -4.85 2.89 -3.78 -3.43 -0.00 -1.21 -4.74 117.00 101.89 2b39 n LEU 287 Ca 0.07 1.14 -0.13 0.00 -0.00 0.00 0.00 56.01 57.09 2b39 n LEU 287 Cb 0.24 -1.40 -0.13 0.00 -0.00 0.00 0.00 43.42 42.13 2b39 n LEU 287 CO -0.07 -0.59 -0.19 0.42 -0.00 0.00 0.00 177.39 176.95 2b39 s THR 288 N -0.05 -0.02 -1.08 1.47 -4.23 -1.10 -4.99 115.64 105.63 2b39 s THR 288 Ca 0.69 0.09 -0.19 0.00 -1.18 0.00 0.00 61.69 61.10 2b39 s THR 288 Cb -0.68 -0.25 0.11 0.00 1.34 0.00 0.00 72.50 73.02 2b39 s THR 288 CO 0.50 0.03 1.38 -0.60 -0.54 0.00 0.00 174.62 175.39 2b39 s ARG 289 N 0.64 3.78 -0.36 3.99 3.52 -1.26 -3.19 118.95 126.06 2b39 s ARG 289 Ca -0.05 -1.83 -0.26 0.00 -0.13 0.00 0.00 55.73 53.46 2b39 s ARG 289 Cb -0.06 -5.17 0.02 0.00 -1.56 0.00 0.00 34.95 28.18 2b39 s ARG 289 CO -0.03 -1.96 0.94 0.08 -0.81 0.00 0.00 175.30 173.52 2b39 s VAL 290 N 3.27 4.57 0.27 7.11 1.01 -1.17 -4.94 120.40 130.51 2b39 s VAL 290 Ca 0.42 1.24 -0.30 0.00 0.00 0.00 0.00 61.98 63.34 2b39 s VAL 290 Cb -0.02 -4.34 -0.11 0.00 0.00 0.00 0.00 36.38 31.91 2b39 s VAL 290 CO -0.04 -0.54 1.61 -2.16 0.00 0.00 0.00 175.10 173.97 2b39 s PRO 291 N 3.50 4.13 -0.52 2.72 0.04 -1.26 -3.59 135.00 140.02 2b39 s PRO 291 Ca 0.39 2.57 -0.16 0.00 0.04 0.00 0.00 61.00 63.84 2b39 s PRO 291 Cb -0.12 -3.04 0.11 0.00 0.04 0.00 0.00 34.50 31.50 2b39 s PRO 291 CO 0.19 -0.65 0.48 0.42 0.04 0.00 0.00 177.00 177.48 2b39 s ILE 292 N 0.24 5.20 -0.32 0.56 1.01 -0.86 -4.51 121.20 122.53 2b39 s ILE 292 Ca 0.65 -1.36 -0.12 0.00 0.00 0.00 0.00 60.65 59.82 2b39 s ILE 292 Cb -0.48 -4.29 -0.03 0.00 0.01 0.00 0.00 42.46 37.68 2b39 s ILE 292 CO 0.44 -0.80 0.22 0.20 0.00 0.00 0.00 174.94 175.00 2b39 s ASN 293 N 3.33 6.02 -1.45 3.58 0.01 -1.21 -1.62 114.94 123.61 2b39 s ASN 293 Ca 0.04 -0.29 0.00 0.00 -0.71 0.00 0.00 52.86 51.90 2b39 s ASN 293 Cb -0.28 -2.12 0.00 0.00 0.41 0.00 0.00 41.25 39.25 2b39 s ASN 293 CO 0.04 -0.17 0.00 0.47 -1.51 0.00 0.00 177.10 175.93 2b39 n ASP 294 N 5.08 -4.64 0.00 -1.22 8.00 -1.22 -1.92 116.55 120.64 2b39 n ASP 294 Ca -0.13 0.33 0.00 0.00 0.71 0.00 0.00 54.79 55.70 2b39 n ASP 294 Cb 0.50 -3.36 0.00 0.00 -0.02 0.00 0.00 41.12 38.25 2b39 n ASP 294 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b39 n GLY 295 N -1.29 0.63 2.63 0.44 0.00 -0.28 -4.69 105.19 102.62 2b39 n GLY 295 Ca -0.14 -0.77 -0.29 0.00 0.00 0.00 0.00 46.02 44.82 2b39 n GLY 295 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2b39 s ASN 296 N -2.82 3.51 0.42 1.61 0.02 -0.81 -3.71 114.94 113.16 2b39 s ASN 296 Ca 0.00 -2.20 0.07 0.00 -1.02 0.00 0.00 52.86 49.72 2b39 s ASN 296 Cb 0.00 -0.76 -0.04 0.00 0.02 0.00 0.00 41.25 40.47 2b39 s ASN 296 CO 0.00 -0.32 0.21 -0.83 0.02 0.00 0.00 177.10 176.18 2b39 s GLY 297 N 0.95 2.33 -0.14 0.66 0.00 -1.15 -3.31 107.32 106.66 2b39 s GLY 297 Ca 0.16 -2.02 -0.05 0.00 0.00 0.00 0.00 44.72 42.81 2b39 s GLY 297 CO -0.07 -1.89 0.26 -0.54 0.00 0.00 0.00 173.10 170.86 2b39 s GLU 298 N -3.95 0.15 -0.72 2.90 2.02 -1.26 -1.95 118.70 115.90 2b39 s GLU 298 Ca 0.41 0.68 -0.02 0.00 0.02 0.00 0.00 54.97 56.06 2b39 s GLU 298 Cb 0.03 -0.19 0.18 0.00 0.10 0.00 0.00 34.13 34.25 2b39 s GLU 298 CO 0.23 -0.34 0.55 0.00 0.02 0.00 0.00 175.26 175.72 2b39 s ALA 299 N 2.41 3.81 0.63 5.21 0.00 -1.25 -4.76 121.76 127.81 2b39 s ALA 299 Ca 0.02 -3.49 -0.15 0.00 0.00 0.00 0.00 51.96 48.34 2b39 s ALA 299 Cb -0.13 -2.70 -0.02 0.00 0.00 0.00 0.00 23.12 20.28 2b39 s ALA 299 CO -0.09 -2.13 1.07 0.42 0.00 0.00 0.00 175.76 175.04 2b39 s ILE 300 N -0.57 3.65 -0.36 0.00 1.01 -1.26 -4.22 121.20 119.45 2b39 s ILE 300 Ca 0.21 0.74 0.01 0.00 0.00 0.00 0.00 60.65 61.60 2b39 s ILE 300 Cb -0.15 -3.28 0.15 0.00 0.01 0.00 0.00 42.46 39.18 2b39 s ILE 300 CO -0.07 -0.51 0.24 -0.22 0.00 0.00 0.00 174.94 174.38 2b39 s LEU 301 N -4.79 0.99 1.22 2.97 1.98 -1.26 -5.00 118.68 114.79 2b39 s LEU 301 Ca 0.64 -2.32 -0.16 0.00 -2.89 0.00 0.00 54.13 49.40 2b39 s LEU 301 Cb -0.17 -0.36 0.27 0.00 0.66 0.00 0.00 46.19 46.59 2b39 s LEU 301 CO 0.41 -0.28 0.73 0.29 -1.89 0.00 0.00 176.35 175.61 2b39 n LYS 302 N 3.83 -2.76 -0.34 1.98 5.02 -1.26 -4.61 118.16 120.02 2b39 n LYS 302 Ca 0.15 -0.79 0.03 0.00 -2.02 0.00 0.00 58.31 55.68 2b39 n LYS 302 Cb 0.39 -1.99 0.15 0.00 -0.02 0.00 0.00 35.03 33.57 2b39 n LYS 302 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2b39 n ARG 303 N -4.36 2.49 0.06 1.97 1.74 -1.26 -3.80 116.66 113.49 2b39 n ARG 303 Ca 0.03 -1.20 -0.17 0.00 -0.77 0.00 0.00 57.85 55.75 2b39 n ARG 303 Cb 0.56 -1.79 -0.07 0.00 -1.02 0.00 0.00 32.46 30.14 2b39 n ARG 303 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2b39 h GLN 304 N 1.53 0.54 -0.01 5.56 4.20 -1.99 -1.48 115.11 123.46 2b39 h GLN 304 Ca 0.00 -0.59 0.00 0.00 0.06 0.00 0.00 58.65 58.12 2b39 h GLN 304 Cb 1.06 0.17 0.00 0.00 0.30 0.00 0.00 27.48 29.01 2b39 h GLN 304 CO 0.19 1.21 -0.18 0.28 -0.67 0.00 0.00 178.83 179.66 2b39 n VAL 305 N -3.79 0.00 -0.05 -0.54 0.31 -1.25 -4.00 118.33 109.00 2b39 n VAL 305 Ca -0.09 -0.23 -0.16 0.00 -0.01 0.00 0.00 64.34 63.85 2b39 n VAL 305 Cb 0.86 0.69 -0.14 0.00 -0.91 0.00 0.00 33.84 34.34 2b39 n VAL 305 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2b39 n LEU 306 N -0.07 1.95 0.00 7.52 4.77 -1.17 -1.08 117.00 128.92 2b39 n LEU 306 Ca 0.14 0.14 0.05 0.00 -0.03 0.00 0.00 56.01 56.31 2b39 n LEU 306 Cb 0.40 -0.54 0.30 0.00 -2.33 0.00 0.00 43.42 41.24 2b39 n LEU 306 CO 0.22 0.72 0.51 0.18 -1.33 0.00 0.00 177.39 177.69 2b39 n LEU 307 N -3.22 0.00 0.00 2.23 4.77 -0.57 -0.49 117.00 119.72 2b39 n LEU 307 Ca -0.32 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.66 2b39 n LEU 307 Cb 1.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.14 2b39 n LEU 307 CO 0.39 0.00 -0.41 0.59 -1.33 0.00 0.00 177.39 176.63 2b39 n ASN 308 N -0.94 4.15 0.00 -1.43 5.03 -1.24 -5.01 115.26 115.83 2b39 n ASN 308 Ca 0.07 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.52 2b39 n ASN 308 Cb 0.03 0.67 0.00 0.00 -1.02 0.00 0.00 39.78 39.47 2b39 n ASN 308 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2b39 n GLY 309 N 2.26 0.00 3.31 7.41 0.00 0.36 -4.74 105.19 113.80 2b39 n GLY 309 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 2b39 n GLY 309 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b39 s VAL 310 N -0.09 1.14 0.00 1.61 1.01 -1.26 -5.01 120.40 117.80 2b39 s VAL 310 Ca 0.00 -2.05 0.00 0.00 0.00 0.00 0.00 61.98 59.93 2b39 s VAL 310 Cb 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 36.38 34.17 2b39 s VAL 310 CO 0.00 -0.45 0.69 1.67 0.00 0.00 0.00 175.10 177.01 2b39 n GLN 311 N -0.37 0.00 -0.73 2.72 7.27 -1.26 -3.43 117.38 121.59 2b39 n GLN 311 Ca -0.07 0.26 -0.08 0.00 0.07 0.00 0.00 57.00 57.18 2b39 n GLN 311 Cb 0.63 -1.19 -0.12 0.00 2.41 0.00 0.00 30.24 31.97 2b39 n GLN 311 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 2b39 n PRO 312 N -1.17 1.46 0.00 3.69 -0.04 -1.26 -4.83 135.00 132.85 2b39 n PRO 312 Ca 0.00 -0.70 0.00 0.00 -0.04 0.00 0.00 63.50 62.76 2b39 n PRO 312 Cb 0.00 -1.82 0.00 0.00 -0.04 0.00 0.00 33.50 31.64 2b39 n PRO 312 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2b39 n SER 313 N 2.55 0.00 -0.68 3.54 7.64 -1.22 -4.44 113.62 121.00 2b39 n SER 313 Ca 0.30 0.00 0.09 0.00 1.01 0.00 0.00 58.87 60.27 2b39 n SER 313 Cb 0.67 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.84 2b39 n SER 313 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2b39 n ARG 314 N 0.00 -1.45 0.00 1.43 5.12 -1.26 -3.12 116.66 117.39 2b39 n ARG 314 Ca 0.00 1.04 0.07 0.00 -1.93 0.00 0.00 57.85 57.04 2b39 n ARG 314 Cb 0.00 -1.74 0.32 0.00 -1.16 0.00 0.00 32.46 29.89 2b39 n ARG 314 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2b39 n ALA 315 N -2.51 1.69 0.15 7.54 0.00 -1.26 -0.03 120.51 126.10 2b39 n ALA 315 Ca -0.01 -0.05 0.04 0.00 0.00 0.00 0.00 53.44 53.41 2b39 n ALA 315 Cb 0.32 -1.24 0.06 0.00 0.00 0.00 0.00 19.45 18.59 2b39 n ALA 315 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2b39 h ASP 316 N 0.00 0.00 0.00 0.00 1.82 -1.93 -3.34 116.42 112.97 2b39 h ASP 316 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2b39 h ASP 316 Cb 0.25 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.26 2b39 h ASP 316 CO 0.00 0.44 0.00 0.00 -1.61 0.00 0.00 179.24 178.07 2b39 n ALA 317 N -2.22 1.51 0.14 -0.78 0.00 -1.04 -4.72 120.51 113.41 2b39 n ALA 317 Ca 0.02 -0.09 0.05 0.00 0.00 0.00 0.00 53.44 53.42 2b39 n ALA 317 Cb 0.70 0.00 0.22 0.00 0.00 0.00 0.00 19.45 20.37 2b39 n ALA 317 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2b39 n LEU 318 N -0.53 3.26 -4.64 0.00 -0.00 0.96 -4.87 117.00 111.18 2b39 n LEU 318 Ca 0.00 -1.65 -0.23 0.00 -0.00 0.00 0.00 56.01 54.13 2b39 n LEU 318 Cb 0.02 -0.51 -0.08 0.00 -0.00 0.00 0.00 43.42 42.85 2b39 n LEU 318 CO 0.00 0.49 -0.31 -0.69 -0.00 0.00 0.00 177.39 176.88 2b39 s VAL 319 N -1.84 3.13 0.00 1.96 1.01 -1.26 -4.41 120.40 118.99 2b39 s VAL 319 Ca 0.30 -1.92 0.00 0.00 0.00 0.00 0.00 61.98 60.36 2b39 s VAL 319 Cb 0.21 -2.82 0.00 0.00 0.00 0.00 0.00 36.38 33.77 2b39 s VAL 319 CO 0.12 -0.31 0.00 0.61 0.00 0.00 0.00 175.10 175.52 2b39 n GLY 320 N -0.93 0.75 3.65 4.51 0.00 -1.26 -4.95 105.19 106.96 2b39 n GLY 320 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 2b39 n GLY 320 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2b39 s LYS 321 N -0.22 4.08 -0.77 1.61 2.47 -1.26 -4.87 119.74 120.78 2b39 s LYS 321 Ca 0.00 1.82 -0.09 0.00 -1.56 0.00 0.00 55.97 56.14 2b39 s LYS 321 Cb 0.00 -3.92 0.20 0.00 -1.46 0.00 0.00 37.83 32.65 2b39 s LYS 321 CO 0.00 -0.94 0.66 -1.12 0.16 0.00 0.00 175.35 174.11 2b39 s SER 322 N 3.11 6.15 -0.38 1.43 0.01 -0.98 0.37 113.70 123.40 2b39 s SER 322 Ca 0.66 -2.87 -0.29 0.00 1.31 0.00 0.00 55.95 54.76 2b39 s SER 322 Cb -0.26 -2.05 0.02 0.00 0.21 0.00 0.00 66.02 63.93 2b39 s SER 322 CO 0.24 -0.45 1.16 -0.63 0.41 0.00 0.00 173.24 173.96 2b39 s ILE 323 N -0.10 4.30 0.22 1.44 1.01 0.74 -2.86 121.20 125.94 2b39 s ILE 323 Ca 0.19 1.42 -0.06 0.00 0.00 0.00 0.00 60.65 62.20 2b39 s ILE 323 Cb -0.14 -4.44 -0.06 0.00 0.01 0.00 0.00 42.46 37.83 2b39 s ILE 323 CO -0.07 -0.70 0.49 -0.72 0.00 0.00 0.00 174.94 173.93 2b39 s TYR 324 N 4.19 3.46 -0.15 3.97 -0.85 -1.20 -3.92 117.35 122.85 2b39 s TYR 324 Ca 0.49 0.68 -0.04 0.00 -0.52 0.00 0.00 57.07 57.68 2b39 s TYR 324 Cb -0.11 -2.12 0.07 0.00 0.38 0.00 0.00 41.96 40.19 2b39 s TYR 324 CO 0.24 0.30 0.22 0.08 -1.52 0.00 0.00 175.55 174.87 2b39 s VAL 325 N -1.84 -0.34 0.08 -3.49 1.01 -0.25 -3.13 120.40 112.45 2b39 s VAL 325 Ca 0.44 0.11 0.09 0.00 0.00 0.00 0.00 61.98 62.63 2b39 s VAL 325 Cb -0.11 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.71 2b39 s VAL 325 CO 0.25 -0.03 -0.24 -0.94 0.00 0.00 0.00 175.10 174.15 2b39 s SER 326 N 2.35 3.44 0.08 3.32 1.04 -1.25 0.01 113.70 122.69 2b39 s SER 326 Ca 0.04 -0.59 -0.01 0.00 0.48 0.00 0.00 55.95 55.88 2b39 s SER 326 Cb -0.14 -0.38 0.00 0.00 0.10 0.00 0.00 66.02 65.61 2b39 s SER 326 CO -0.10 0.23 0.11 0.00 0.98 0.00 0.00 173.24 174.47 2b39 n ALA 327 N 1.37 -0.10 -3.72 5.32 0.00 -0.76 -2.84 120.51 119.78 2b39 n ALA 327 Ca -0.17 -0.35 -0.13 0.00 0.00 0.00 0.00 53.44 52.79 2b39 n ALA 327 Cb 0.52 0.28 -0.14 0.00 0.00 0.00 0.00 19.45 20.12 2b39 n ALA 327 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2b39 s THR 328 N -2.54 -0.11 -0.26 0.00 -4.23 -1.00 -1.07 115.64 106.43 2b39 s THR 328 Ca 0.06 0.19 -0.06 0.00 -1.18 0.00 0.00 61.69 60.70 2b39 s THR 328 Cb -0.00 -0.35 -0.00 0.00 1.34 0.00 0.00 72.50 73.48 2b39 s THR 328 CO 0.04 0.08 0.04 -0.69 -0.54 0.00 0.00 174.62 173.55 2b39 s VAL 329 N 1.46 3.86 -0.31 2.29 1.01 0.33 -1.59 120.40 127.45 2b39 s VAL 329 Ca -0.07 -0.52 -0.11 0.00 0.00 0.00 0.00 61.98 61.28 2b39 s VAL 329 Cb -0.11 -2.88 -0.02 0.00 0.00 0.00 0.00 36.38 33.37 2b39 s VAL 329 CO -0.08 0.24 0.18 0.27 0.00 0.00 0.00 175.10 175.71 2b39 s ILE 330 N 1.52 4.89 0.20 2.22 -4.36 -0.60 -1.99 121.20 123.08 2b39 s ILE 330 Ca 0.04 -0.25 -0.32 0.00 -0.26 0.00 0.00 60.65 59.85 2b39 s ILE 330 Cb -0.16 -3.46 -0.14 0.00 1.25 0.00 0.00 42.46 39.95 2b39 s ILE 330 CO 0.01 0.09 1.44 0.18 0.24 0.00 0.00 174.94 176.90 2b39 n LEU 331 N 5.03 2.91 -0.03 0.37 4.77 -1.22 -3.00 117.00 125.83 2b39 n LEU 331 Ca -0.14 1.12 -0.06 0.00 -0.03 0.00 0.00 56.01 56.91 2b39 n LEU 331 Cb 0.50 -1.40 0.14 0.00 -2.33 0.00 0.00 43.42 40.33 2b39 n LEU 331 CO 0.34 -0.51 0.70 1.56 -1.33 0.00 0.00 177.39 178.15 2b39 h GLN 332 N 4.69 0.62 -0.89 3.23 4.20 -1.89 0.39 115.11 125.46 2b39 h GLN 332 Ca -0.45 -0.25 0.21 0.00 0.06 0.00 0.00 58.65 58.21 2b39 h GLN 332 Cb 1.28 -0.03 -0.16 0.00 0.30 0.00 0.00 27.48 28.86 2b39 h GLN 332 CO 0.79 0.82 -0.09 0.66 -0.67 0.00 0.00 178.83 180.35 2b39 h SER 333 N 0.54 -0.60 0.00 1.46 4.64 -1.90 -3.36 113.55 114.33 2b39 h SER 333 Ca 0.07 0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 2b39 h SER 333 Cb 0.73 0.48 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2b39 h SER 333 CO 0.06 -0.28 0.00 0.61 -0.87 0.00 0.00 176.83 176.34 2b39 n GLY 334 N -1.51 0.58 0.91 -0.77 0.00 -1.21 -4.68 105.19 98.51 2b39 n GLY 334 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2b39 n GLY 334 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2b39 n SER 335 N 0.00 -0.46 -4.60 1.61 7.64 0.14 -2.81 113.62 115.14 2b39 n SER 335 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.51 2b39 n SER 335 Cb 0.00 -0.23 -0.10 0.00 -1.01 0.00 0.00 64.21 62.87 2b39 n SER 335 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2b39 s ASP 336 N -2.46 5.84 0.82 6.43 1.47 -1.26 -4.78 116.67 122.74 2b39 s ASP 336 Ca 0.00 0.02 -0.12 0.00 1.18 0.00 0.00 52.55 53.63 2b39 s ASP 336 Cb 0.00 -2.05 0.08 0.00 -0.34 0.00 0.00 42.92 40.61 2b39 s ASP 336 CO 0.00 0.04 1.17 0.00 0.68 0.00 0.00 175.17 177.05 2b39 s MET 337 N 1.20 1.90 -0.10 2.11 0.23 -1.26 -3.37 119.30 120.01 2b39 s MET 337 Ca 0.06 0.18 -0.09 0.00 -1.03 0.00 0.00 55.69 54.81 2b39 s MET 337 Cb -0.14 -1.94 0.03 0.00 -1.53 0.00 0.00 34.83 31.25 2b39 s MET 337 CO 0.05 -1.66 0.26 0.08 -2.03 0.00 0.00 175.02 171.73 2b39 s VAL 338 N -3.51 -0.01 -0.15 5.16 1.01 -0.84 -4.94 120.40 117.12 2b39 s VAL 338 Ca 0.62 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.61 2b39 s VAL 338 Cb -0.12 -0.38 -0.01 0.00 0.00 0.00 0.00 36.38 35.88 2b39 s VAL 338 CO 0.50 0.01 -0.11 -1.83 0.00 0.00 0.00 175.10 173.67 2b39 s GLU 339 N 0.30 3.37 0.45 2.72 -1.05 -1.26 -0.52 118.70 122.71 2b39 s GLU 339 Ca -0.01 -0.68 0.07 0.00 -0.15 0.00 0.00 54.97 54.20 2b39 s GLU 339 Cb -0.03 -2.72 -0.02 0.00 -0.44 0.00 0.00 34.13 30.92 2b39 s GLU 339 CO -0.01 0.09 0.27 0.00 0.95 0.00 0.00 175.26 176.57 2b39 s ALA 340 N 0.67 3.93 -0.14 -0.84 0.00 -0.23 -4.81 121.76 120.34 2b39 s ALA 340 Ca -0.06 -1.77 -0.32 0.00 0.00 0.00 0.00 51.96 49.81 2b39 s ALA 340 Cb -0.15 -0.60 0.13 0.00 0.00 0.00 0.00 23.12 22.50 2b39 s ALA 340 CO 0.02 -0.24 1.09 -1.83 0.00 0.00 0.00 175.76 174.80 2b39 s GLU 341 N -4.05 0.48 -0.01 0.00 -1.05 -1.26 -1.83 118.70 110.98 2b39 s GLU 341 Ca 0.40 -0.11 0.02 0.00 -0.15 0.00 0.00 54.97 55.13 2b39 s GLU 341 Cb 0.01 0.22 -0.01 0.00 -0.44 0.00 0.00 34.13 33.91 2b39 s GLU 341 CO 0.23 -0.20 -0.07 1.03 0.95 0.00 0.00 175.26 177.20 2b39 s ARG 342 N -2.24 0.59 -0.03 -4.83 1.81 0.10 -4.77 118.95 109.58 2b39 s ARG 342 Ca 0.06 -0.26 -0.02 0.00 -1.72 0.00 0.00 55.73 53.79 2b39 s ARG 342 Cb -0.01 -0.57 0.01 0.00 -0.45 0.00 0.00 34.95 33.94 2b39 s ARG 342 CO -0.05 0.16 0.07 0.95 -0.68 0.00 0.00 175.30 175.74 2b39 s THR 343 N -0.18 -0.01 0.00 0.02 -4.23 -1.26 -1.09 115.64 108.89 2b39 s THR 343 Ca 0.03 0.05 0.00 0.00 -1.18 0.00 0.00 61.69 60.59 2b39 s THR 343 Cb -0.03 -0.11 0.00 0.00 1.34 0.00 0.00 72.50 73.70 2b39 s THR 343 CO -0.00 0.02 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 2b39 n GLY 344 N 3.36 0.76 3.60 3.99 0.00 -1.26 -5.06 105.19 110.57 2b39 n GLY 344 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 2b39 n GLY 344 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b39 s ILE 345 N -2.00 3.89 0.25 -0.61 1.01 -1.25 -4.94 121.20 117.55 2b39 s ILE 345 Ca 0.00 0.91 0.02 0.00 0.00 0.00 0.00 60.65 61.59 2b39 s ILE 345 Cb 0.00 -4.19 -0.03 0.00 0.01 0.00 0.00 42.46 38.25 2b39 s ILE 345 CO 0.00 -0.74 0.41 -2.16 0.00 0.00 0.00 174.94 172.44 2b39 s PRO 346 N 4.94 3.47 -1.00 2.79 0.04 -1.26 0.26 135.00 144.25 2b39 s PRO 346 Ca 0.62 -0.54 -0.01 0.00 0.04 0.00 0.00 61.00 61.11 2b39 s PRO 346 Cb -0.14 -2.83 0.32 0.00 0.04 0.00 0.00 34.50 31.89 2b39 s PRO 346 CO 0.32 0.36 1.74 -0.89 0.04 0.00 0.00 177.00 178.58 2b39 n ILE 347 N -1.26 5.84 -2.45 0.56 5.41 1.16 0.70 119.36 129.33 2b39 n ILE 347 Ca -0.07 -5.95 -0.42 0.00 1.00 0.00 0.00 62.75 57.31 2b39 n ILE 347 Cb 0.56 -1.57 -0.03 0.00 -0.71 0.00 0.00 39.64 37.90 2b39 n ILE 347 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2b39 s VAL 348 N -4.27 4.21 -0.55 1.39 1.01 -1.17 -4.06 120.40 116.96 2b39 s VAL 348 Ca 0.39 1.55 0.22 0.00 0.00 0.00 0.00 61.98 64.14 2b39 s VAL 348 Cb 0.19 -4.00 -0.22 0.00 0.00 0.00 0.00 36.38 32.36 2b39 s VAL 348 CO -0.12 0.02 0.82 0.35 0.00 0.00 0.00 175.10 176.17 2b39 n THR 349 N 4.47 0.07 -3.33 3.92 -2.24 -1.26 -3.63 114.28 112.27 2b39 n THR 349 Ca 0.11 -0.25 -0.39 0.00 -2.27 0.00 0.00 64.05 61.25 2b39 n THR 349 Cb 0.46 0.38 -0.03 0.00 -2.10 0.00 0.00 70.33 69.05 2b39 n THR 349 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2b39 n SER 350 N -1.92 5.16 -0.39 3.42 3.41 -1.26 -4.81 113.62 117.23 2b39 n SER 350 Ca 0.01 -3.26 0.35 0.00 -0.26 0.00 0.00 58.87 55.71 2b39 n SER 350 Cb 0.45 -1.13 0.69 0.00 -0.26 0.00 0.00 64.21 63.95 2b39 n SER 350 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2b39 h PRO 351 N 5.66 0.10 -4.36 4.33 0.13 -1.94 -3.40 132.00 132.53 2b39 h PRO 351 Ca 0.18 -0.01 -0.49 0.00 -0.87 0.00 0.00 66.00 64.82 2b39 h PRO 351 Cb 0.73 -0.02 -0.34 0.00 0.13 0.00 0.00 31.00 31.50 2b39 h PRO 351 CO 1.05 0.06 -0.80 0.71 -0.23 0.00 0.00 178.00 178.79 2b39 s TYR 352 N -5.11 1.30 -0.29 1.56 2.02 -1.26 -3.69 117.35 111.88 2b39 s TYR 352 Ca -0.06 -0.50 -0.10 0.00 -0.37 0.00 0.00 57.07 56.04 2b39 s TYR 352 Cb 0.25 -1.01 -0.03 0.00 -0.40 0.00 0.00 41.96 40.77 2b39 s TYR 352 CO 0.82 -0.31 0.16 -0.65 -1.57 0.00 0.00 175.55 174.00 2b39 s GLN 353 N 0.95 3.67 0.04 -0.62 -1.52 -0.96 -4.61 119.66 116.61 2b39 s GLN 353 Ca -0.10 -0.50 0.08 0.00 -1.95 0.00 0.00 55.36 52.90 2b39 s GLN 353 Cb -0.15 -3.57 -0.03 0.00 -0.22 0.00 0.00 33.01 29.05 2b39 s GLN 353 CO 0.00 -0.27 -0.23 0.96 -0.25 0.00 0.00 175.29 175.50 2b39 s ILE 354 N 1.68 2.39 0.20 1.08 -5.25 -1.26 -1.33 121.20 118.72 2b39 s ILE 354 Ca 0.06 -1.28 -0.04 0.00 -0.99 0.00 0.00 60.65 58.40 2b39 s ILE 354 Cb -0.16 -1.95 0.02 0.00 2.95 0.00 0.00 42.46 43.31 2b39 s ILE 354 CO 0.08 0.38 0.35 0.00 -1.79 0.00 0.00 174.94 173.96 2b39 n HIS 355 N 1.77 -1.35 -4.32 1.37 1.44 -1.23 -4.76 115.22 108.13 2b39 n HIS 355 Ca -0.17 -1.17 -0.21 0.00 -2.01 0.00 0.00 57.72 54.16 2b39 n HIS 355 Cb 0.52 0.40 -0.16 0.00 0.12 0.00 0.00 29.99 30.87 2b39 n HIS 355 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 2b39 s PHE 356 N -4.53 0.98 0.00 -1.40 0.40 -1.26 -1.02 117.98 111.14 2b39 s PHE 356 Ca 0.13 -0.30 0.00 0.00 -0.60 0.00 0.00 56.93 56.15 2b39 s PHE 356 Cb -0.02 -0.78 0.00 0.00 0.51 0.00 0.00 43.02 42.74 2b39 s PHE 356 CO 0.09 -0.20 0.00 2.41 0.70 0.00 0.00 175.22 178.22 2b39 n THR 357 N 3.86 0.00 0.93 0.64 -1.04 -1.26 -4.80 114.28 112.61 2b39 n THR 357 Ca -0.24 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 61.90 2b39 n THR 357 Cb 0.52 -0.07 0.37 0.00 -1.82 0.00 0.00 70.33 69.33 2b39 n THR 357 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2b39 n LYS 358 N -1.63 0.05 -0.65 -2.82 4.76 -1.26 -4.93 118.16 111.69 2b39 n LYS 358 Ca 0.00 0.02 -0.30 0.00 -2.87 0.00 0.00 58.31 55.16 2b39 n LYS 358 Cb 0.00 -1.54 0.17 0.00 -1.84 0.00 0.00 35.03 31.82 2b39 n LYS 358 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 2b39 n THR 359 N -1.62 0.00 -3.90 -0.18 -1.04 -1.26 -4.71 114.28 101.57 2b39 n THR 359 Ca 0.06 -0.23 -0.24 0.00 -2.04 0.00 0.00 64.05 61.60 2b39 n THR 359 Cb 0.35 -0.56 -0.04 0.00 -1.82 0.00 0.00 70.33 68.26 2b39 n THR 359 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2b39 s PRO 360 N -3.42 2.33 -0.09 -2.82 0.04 -1.26 -4.21 135.00 125.58 2b39 s PRO 360 Ca 0.51 -1.81 0.03 0.00 0.04 0.00 0.00 61.00 59.77 2b39 s PRO 360 Cb -0.09 -2.12 -0.07 0.00 0.04 0.00 0.00 34.50 32.25 2b39 s PRO 360 CO 0.60 -0.28 -0.04 0.36 0.04 0.00 0.00 177.00 177.67 2b39 n LYS 361 N -1.48 1.23 -4.35 4.56 2.85 -1.26 -4.91 118.16 114.81 2b39 n LYS 361 Ca -0.00 0.03 -0.33 0.00 -1.05 0.00 0.00 58.31 56.95 2b39 n LYS 361 Cb 0.64 -1.19 -0.15 0.00 -0.65 0.00 0.00 35.03 33.68 2b39 n LYS 361 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 2b39 s PHE 362 N -2.18 2.81 0.59 5.58 2.99 -1.25 -3.12 117.98 123.41 2b39 s PHE 362 Ca -0.09 -1.11 0.09 0.00 0.00 0.00 0.00 56.93 55.82 2b39 s PHE 362 Cb 0.03 -1.93 0.09 0.00 0.00 0.00 0.00 43.02 41.21 2b39 s PHE 362 CO 0.25 -0.53 0.76 -0.59 -0.00 0.00 0.00 175.22 175.11 2b39 s PHE 363 N 1.00 1.22 -0.33 0.36 -0.12 -1.05 -4.67 117.98 114.39 2b39 s PHE 363 Ca -0.02 -0.80 -0.01 0.00 -0.05 0.00 0.00 56.93 56.06 2b39 s PHE 363 Cb -0.15 -2.13 0.11 0.00 -0.63 0.00 0.00 43.02 40.22 2b39 s PHE 363 CO -0.03 -1.16 0.14 0.15 -0.05 0.00 0.00 175.22 174.27 2b39 s LYS 364 N -4.65 0.72 0.24 1.99 1.02 -1.26 -1.64 119.74 116.16 2b39 s LYS 364 Ca 0.58 -1.18 -0.10 0.00 0.02 0.00 0.00 55.97 55.28 2b39 s LYS 364 Cb -0.05 -1.86 -0.08 0.00 -0.52 0.00 0.00 37.83 35.33 2b39 s LYS 364 CO 0.37 -1.04 -0.01 -0.35 -0.92 0.00 0.00 175.35 173.39 2b39 n PRO 365 N 4.60 0.00 -1.94 -1.68 -0.04 -1.26 -2.68 135.00 132.00 2b39 n PRO 365 Ca 0.01 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.27 2b39 n PRO 365 Cb 0.40 -0.53 -0.05 0.00 -0.04 0.00 0.00 33.50 33.28 2b39 n PRO 365 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b39 n ALA 366 N -0.68 -0.43 -2.45 0.55 0.00 0.29 -4.80 120.51 113.00 2b39 n ALA 366 Ca 0.05 0.24 -0.08 0.00 0.00 0.00 0.00 53.44 53.65 2b39 n ALA 366 Cb 0.23 -2.03 -0.09 0.00 0.00 0.00 0.00 19.45 17.56 2b39 n ALA 366 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2b39 s MET 367 N -4.26 0.62 0.00 0.00 -1.94 -0.73 -4.92 119.30 108.06 2b39 s MET 367 Ca 0.00 -0.97 0.00 0.00 -1.71 0.00 0.00 55.69 53.01 2b39 s MET 367 Cb 0.00 0.23 0.00 0.00 2.01 0.00 0.00 34.83 37.07 2b39 s MET 367 CO 0.00 -0.15 0.00 -0.35 -0.01 0.00 0.00 175.02 174.51 2b39 n PRO 368 N 0.40 1.21 -3.66 2.03 -0.04 -1.26 -1.06 135.00 132.63 2b39 n PRO 368 Ca -0.17 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.20 2b39 n PRO 368 Cb 0.60 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.98 2b39 n PRO 368 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 2b39 s PHE 369 N 0.23 -0.88 -0.26 0.54 5.36 0.53 -4.71 117.98 118.79 2b39 s PHE 369 Ca 0.00 1.84 -0.11 0.00 -0.96 0.00 0.00 56.93 57.70 2b39 s PHE 369 Cb 0.00 0.47 -0.05 0.00 -0.34 0.00 0.00 43.02 43.10 2b39 s PHE 369 CO 0.00 -0.44 0.20 -0.51 -1.46 0.00 0.00 175.22 173.00 2b39 s ASP 370 N 1.31 6.08 0.29 6.13 1.01 -1.26 -2.43 116.67 127.79 2b39 s ASP 370 Ca -0.08 0.07 0.07 0.00 0.71 0.00 0.00 52.55 53.32 2b39 s ASP 370 Cb -0.06 -2.12 -0.06 0.00 1.01 0.00 0.00 42.92 41.69 2b39 s ASP 370 CO -0.14 -0.02 -0.07 -1.48 0.21 0.00 0.00 175.17 173.68 2b39 s LEU 371 N 1.51 2.51 -0.22 1.23 2.34 -1.22 -4.46 118.68 120.38 2b39 s LEU 371 Ca 0.08 -1.18 -0.02 0.00 0.06 0.00 0.00 54.13 53.06 2b39 s LEU 371 Cb -0.15 -0.69 0.07 0.00 -0.56 0.00 0.00 46.19 44.86 2b39 s LEU 371 CO 0.08 -0.31 0.04 -0.04 -1.06 0.00 0.00 176.35 175.06 2b39 s MET 372 N -3.71 0.73 -0.50 1.48 -1.94 -1.26 -3.73 119.30 110.37 2b39 s MET 372 Ca 0.30 -0.60 -0.20 0.00 -1.71 0.00 0.00 55.69 53.48 2b39 s MET 372 Cb 0.03 -2.09 0.05 0.00 2.01 0.00 0.00 34.83 34.83 2b39 s MET 372 CO 0.12 -0.72 0.68 0.08 -0.01 0.00 0.00 175.02 175.17 2b39 s VAL 373 N 1.78 4.79 -1.00 -6.03 1.01 -1.22 -4.01 120.40 115.72 2b39 s VAL 373 Ca 0.01 -0.24 -0.18 0.00 0.00 0.00 0.00 61.98 61.57 2b39 s VAL 373 Cb -0.17 -4.31 0.14 0.00 0.00 0.00 0.00 36.38 32.03 2b39 s VAL 373 CO -0.12 -0.81 1.22 -0.47 0.00 0.00 0.00 175.10 174.92 2b39 s TYR 374 N 2.87 3.19 0.46 5.22 5.04 -0.19 -0.60 117.35 133.33 2b39 s TYR 374 Ca 0.19 -1.55 -0.22 0.00 -2.44 0.00 0.00 57.07 53.04 2b39 s TYR 374 Cb -0.17 -4.31 -0.08 0.00 0.35 0.00 0.00 41.96 37.75 2b39 s TYR 374 CO 0.15 -1.48 1.08 0.08 -1.34 0.00 0.00 175.55 174.03 2b39 s VAL 375 N 2.51 3.54 0.33 3.14 1.01 0.57 -3.58 120.40 127.93 2b39 s VAL 375 Ca 0.36 1.08 -0.02 0.00 0.00 0.00 0.00 61.98 63.40 2b39 s VAL 375 Cb -0.04 -3.51 -0.00 0.00 0.00 0.00 0.00 36.38 32.83 2b39 s VAL 375 CO -0.07 -0.09 0.44 0.42 0.00 0.00 0.00 175.10 175.80 2b39 s THR 376 N -1.75 0.00 0.39 3.92 -4.23 -0.44 -3.80 115.64 109.74 2b39 s THR 376 Ca 0.64 -1.65 0.08 0.00 -1.18 0.00 0.00 61.69 59.57 2b39 s THR 376 Cb -0.22 -2.60 -0.02 0.00 1.34 0.00 0.00 72.50 71.00 2b39 s THR 376 CO 0.27 0.00 0.37 0.20 -0.54 0.00 0.00 174.62 174.92 2b39 s ASN 377 N -3.24 5.18 0.00 3.99 0.01 0.88 -2.25 114.94 119.50 2b39 s ASN 377 Ca 0.32 -0.64 0.00 0.00 -0.71 0.00 0.00 52.86 51.82 2b39 s ASN 377 Cb 0.00 -0.69 0.00 0.00 0.41 0.00 0.00 41.25 40.97 2b39 s ASN 377 CO 0.20 -0.58 0.28 -0.81 -1.51 0.00 0.00 177.10 174.68 2b39 n PRO 378 N -1.53 0.00 0.00 -0.60 -0.04 -1.24 -0.06 135.00 131.53 2b39 n PRO 378 Ca 0.02 0.03 0.02 0.00 -0.04 0.00 0.00 63.50 63.54 2b39 n PRO 378 Cb 0.61 -1.55 0.01 0.00 -0.04 0.00 0.00 33.50 32.53 2b39 n PRO 378 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2b39 n ASP 379 N -0.78 1.01 -0.21 3.54 5.75 -1.26 -4.98 116.55 119.63 2b39 n ASP 379 Ca 0.00 -1.01 0.00 0.00 -0.01 0.00 0.00 54.79 53.77 2b39 n ASP 379 Cb 0.05 0.34 0.00 0.00 -1.03 0.00 0.00 41.12 40.48 2b39 n ASP 379 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2b39 n GLY 380 N 0.56 0.92 3.15 6.12 0.00 0.91 -5.10 105.19 111.76 2b39 n GLY 380 Ca 0.02 -0.25 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 2b39 n GLY 380 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b39 s SER 381 N -2.30 2.72 -0.79 1.61 1.04 -1.24 -4.84 113.70 109.89 2b39 s SER 381 Ca 0.00 -0.49 -0.12 0.00 0.48 0.00 0.00 55.95 55.82 2b39 s SER 381 Cb 0.00 -1.24 -0.24 0.00 0.10 0.00 0.00 66.02 64.64 2b39 s SER 381 CO 0.00 0.11 1.99 -2.65 0.98 0.00 0.00 173.24 173.67 2b39 n PRO 382 N 3.72 0.11 -1.30 4.02 -0.02 -1.26 -0.08 135.00 140.19 2b39 n PRO 382 Ca -0.20 -0.26 -0.36 0.00 -2.02 0.00 0.00 63.50 60.66 2b39 n PRO 382 Cb 0.52 -1.69 0.08 0.00 -0.02 0.00 0.00 33.50 32.39 2b39 n PRO 382 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b39 n ALA 383 N 8.70 -0.91 -1.00 3.55 0.00 -1.25 -4.49 120.51 125.11 2b39 n ALA 383 Ca 0.50 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.73 2b39 n ALA 383 Cb 0.28 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 17.75 2b39 n ALA 383 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2b39 n ARG 384 N -1.27 -0.58 -1.54 0.00 5.12 -1.26 -4.29 116.66 112.83 2b39 n ARG 384 Ca 0.11 0.00 -0.35 0.00 -1.93 0.00 0.00 57.85 55.69 2b39 n ARG 384 Cb 0.50 0.00 -0.07 0.00 -1.16 0.00 0.00 32.46 31.73 2b39 n ARG 384 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2b39 n HIS 385 N -2.29 1.18 -4.74 -1.55 8.25 -1.24 -4.51 115.22 110.33 2b39 n HIS 385 Ca 0.00 0.16 -0.33 0.00 -0.26 0.00 0.00 57.72 57.29 2b39 n HIS 385 Cb 0.00 -2.52 -0.12 0.00 1.12 0.00 0.00 29.99 28.47 2b39 n HIS 385 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2b39 s ILE 386 N 11.46 3.41 -1.30 1.59 1.01 -1.15 -4.83 121.20 131.40 2b39 s ILE 386 Ca 1.07 -0.58 -0.18 0.00 0.00 0.00 0.00 60.65 60.95 2b39 s ILE 386 Cb -0.42 -2.38 0.06 0.00 0.01 0.00 0.00 42.46 39.74 2b39 s ILE 386 CO 0.30 0.59 1.75 -0.81 0.00 0.00 0.00 174.94 176.77 2b39 n PRO 387 N 2.37 3.15 -1.86 2.79 -0.04 -1.26 0.18 135.00 140.33 2b39 n PRO 387 Ca -0.18 -3.25 -0.40 0.00 -0.04 0.00 0.00 63.50 59.63 2b39 n PRO 387 Cb 0.53 -3.51 0.01 0.00 -0.04 0.00 0.00 33.50 30.49 2b39 n PRO 387 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2b39 s VAL 388 N 4.46 2.19 0.05 0.52 1.01 -1.09 -3.79 120.40 123.74 2b39 s VAL 388 Ca 0.54 0.17 -0.03 0.00 0.00 0.00 0.00 61.98 62.67 2b39 s VAL 388 Cb 0.04 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.29 2b39 s VAL 388 CO 0.08 0.03 0.04 -0.69 0.00 0.00 0.00 175.10 174.55 2b39 s VAL 389 N -1.20 0.18 0.00 2.92 1.01 0.13 -2.32 120.40 121.12 2b39 s VAL 389 Ca 0.59 -1.48 0.00 0.00 0.00 0.00 0.00 61.98 61.09 2b39 s VAL 389 Cb -0.43 -1.26 0.00 0.00 0.00 0.00 0.00 36.38 34.69 2b39 s VAL 389 CO 0.56 -0.82 0.00 0.35 0.00 0.00 0.00 175.10 175.19 2b39 n THR 390 N 0.33 0.00 0.34 3.92 -2.24 -1.26 0.11 114.28 115.48 2b39 n THR 390 Ca -0.16 0.00 0.21 0.00 -2.27 0.00 0.00 64.05 61.83 2b39 n THR 390 Cb 0.60 0.00 1.13 0.00 -2.10 0.00 0.00 70.33 69.96 2b39 n THR 390 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2b39 h GLN 391 N 0.00 0.00 -0.42 -0.78 4.20 -1.98 -2.12 115.11 114.01 2b39 h GLN 391 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2b39 h GLN 391 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2b39 h GLN 391 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 2b39 n GLY 392 N -1.11 1.32 2.41 3.46 0.00 -1.26 -4.95 105.19 105.05 2b39 n GLY 392 Ca -0.03 -0.59 -0.20 0.00 0.00 0.00 0.00 46.02 45.20 2b39 n GLY 392 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2b39 n SER 393 N 1.03 -5.80 -4.83 1.61 3.41 -0.80 -4.98 113.62 103.26 2b39 n SER 393 Ca 0.18 0.01 -0.33 0.00 -0.26 0.00 0.00 58.87 58.48 2b39 n SER 393 Cb 0.47 -4.84 -0.04 0.00 -0.26 0.00 0.00 64.21 59.53 2b39 n SER 393 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2b39 s ASN 394 N -2.08 6.60 -0.68 4.04 0.01 -1.26 -4.95 114.94 116.62 2b39 s ASN 394 Ca 0.00 1.67 0.05 0.00 -0.71 0.00 0.00 52.86 53.87 2b39 s ASN 394 Cb 0.00 -2.53 0.25 0.00 0.41 0.00 0.00 41.25 39.38 2b39 s ASN 394 CO 0.00 -0.60 0.80 0.52 -1.51 0.00 0.00 177.10 176.31 2b39 n VAL 395 N -1.28 2.59 -1.28 1.60 0.31 -1.26 -4.24 118.33 114.77 2b39 n VAL 395 Ca 0.07 -5.27 -0.11 0.00 -0.01 0.00 0.00 64.34 59.03 2b39 n VAL 395 Cb 0.54 -2.11 0.08 0.00 -0.91 0.00 0.00 33.84 31.44 2b39 n VAL 395 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2b39 n GLN 396 N 0.96 -0.61 -4.20 5.55 -0.06 -0.98 -4.92 117.38 113.12 2b39 n GLN 396 Ca 0.29 -0.75 -0.12 0.00 -2.00 0.00 0.00 57.00 54.42 2b39 n GLN 396 Cb 0.40 -0.52 -0.10 0.00 -4.06 0.00 0.00 30.24 25.96 2b39 n GLN 396 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 2b39 s SER 397 N -2.79 1.29 -0.18 1.69 0.15 -1.26 -2.68 113.70 109.92 2b39 s SER 397 Ca 0.28 -1.04 -0.05 0.00 0.70 0.00 0.00 55.95 55.83 2b39 s SER 397 Cb -0.01 0.08 -0.03 0.00 -1.71 0.00 0.00 66.02 64.35 2b39 s SER 397 CO 0.20 -0.46 0.01 -0.22 1.20 0.00 0.00 173.24 173.97 2b39 s LEU 398 N -3.09 3.45 0.69 3.45 2.96 0.48 -4.32 118.68 122.29 2b39 s LEU 398 Ca 0.15 -0.08 -0.15 0.00 -0.22 0.00 0.00 54.13 53.83 2b39 s LEU 398 Cb 0.05 -1.86 0.02 0.00 0.50 0.00 0.00 46.19 44.89 2b39 s LEU 398 CO -0.02 0.13 1.14 0.42 -1.32 0.00 0.00 176.35 176.70 2b39 s THR 399 N 0.61 2.93 -0.25 3.68 -4.23 -1.26 -2.92 115.64 114.20 2b39 s THR 399 Ca 0.00 0.43 -0.00 0.00 -1.18 0.00 0.00 61.69 60.94 2b39 s THR 399 Cb -0.14 -2.94 -0.16 0.00 1.34 0.00 0.00 72.50 70.60 2b39 s THR 399 CO 0.02 -0.27 -0.24 0.00 -0.54 0.00 0.00 174.62 173.59 2b39 n GLN 400 N -2.61 0.61 0.25 3.99 10.64 -1.26 -0.42 117.38 128.58 2b39 n GLN 400 Ca 0.11 0.16 0.14 0.00 -1.83 0.00 0.00 57.00 55.58 2b39 n GLN 400 Cb 0.51 -1.49 0.58 0.00 -0.86 0.00 0.00 30.24 28.98 2b39 n GLN 400 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.06 174.79 2b39 h ASP 401 N -0.13 0.00 0.00 2.61 3.32 -1.88 -3.28 116.42 117.06 2b39 h ASP 401 Ca -0.57 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.35 2b39 h ASP 401 Cb 1.82 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.35 2b39 h ASP 401 CO -0.13 0.08 -1.48 0.47 -1.72 0.00 0.00 179.24 176.46 2b39 n ASP 402 N -3.21 2.53 -0.93 6.45 8.00 -1.26 -5.00 116.55 123.13 2b39 n ASP 402 Ca 0.01 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.39 2b39 n ASP 402 Cb 0.36 -0.17 -0.05 0.00 -0.02 0.00 0.00 41.12 41.24 2b39 n ASP 402 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b39 n GLY 403 N 2.90 1.31 2.86 0.44 0.00 0.44 -4.63 105.19 108.52 2b39 n GLY 403 Ca -0.15 -0.46 -0.29 0.00 0.00 0.00 0.00 46.02 45.11 2b39 n GLY 403 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b39 s VAL 404 N -2.45 1.14 0.73 1.61 1.01 -1.25 -0.31 120.40 120.88 2b39 s VAL 404 Ca 0.00 -0.95 -0.12 0.00 0.00 0.00 0.00 61.98 60.91 2b39 s VAL 404 Cb 0.00 -1.49 0.04 0.00 0.00 0.00 0.00 36.38 34.92 2b39 s VAL 404 CO 0.00 -0.13 1.10 0.00 0.00 0.00 0.00 175.10 176.06 2b39 s ALA 405 N 1.58 2.34 -0.42 5.51 0.00 0.23 -4.23 121.76 126.76 2b39 s ALA 405 Ca -0.04 0.35 0.09 0.00 0.00 0.00 0.00 51.96 52.36 2b39 s ALA 405 Cb -0.18 -3.28 0.42 0.00 0.00 0.00 0.00 23.12 20.08 2b39 s ALA 405 CO -0.07 -1.59 1.04 1.63 0.00 0.00 0.00 175.76 176.77 2b39 n LYS 406 N -3.15 2.73 -0.76 0.00 4.76 -1.26 -3.42 118.16 117.06 2b39 n LYS 406 Ca 0.09 -4.18 -0.29 0.00 -2.87 0.00 0.00 58.31 51.06 2b39 n LYS 406 Cb 0.53 -1.97 0.21 0.00 -1.84 0.00 0.00 35.03 31.96 2b39 n LYS 406 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2b39 s LEU 407 N -3.38 1.40 -0.30 -0.35 0.20 -1.24 -4.93 118.68 110.07 2b39 s LEU 407 Ca 0.42 1.54 -0.07 0.00 0.69 0.00 0.00 54.13 56.72 2b39 s LEU 407 Cb 0.40 -3.62 0.17 0.00 -0.43 0.00 0.00 46.19 42.71 2b39 s LEU 407 CO -0.12 -3.68 0.73 -0.55 -0.29 0.00 0.00 176.35 172.43 2b39 s SER 408 N -2.82 -1.09 0.12 3.68 0.15 -1.26 -3.37 113.70 109.11 2b39 s SER 408 Ca 0.67 0.95 0.10 0.00 0.70 0.00 0.00 55.95 58.38 2b39 s SER 408 Cb -0.23 2.02 -0.04 0.00 -1.71 0.00 0.00 66.02 66.07 2b39 s SER 408 CO 0.61 -0.21 -0.26 0.27 1.20 0.00 0.00 173.24 174.86 2b39 s ILE 409 N 2.83 2.34 0.00 6.45 -5.25 -1.02 -4.91 121.20 121.65 2b39 s ILE 409 Ca 0.08 -1.68 -0.15 0.00 -0.99 0.00 0.00 60.65 57.91 2b39 s ILE 409 Cb -0.12 -2.03 -0.06 0.00 2.95 0.00 0.00 42.46 43.20 2b39 s ILE 409 CO -0.19 0.12 0.41 0.54 -1.79 0.00 0.00 174.94 174.04 2b39 s ASN 410 N -1.98 6.81 -0.07 4.36 4.22 -1.26 -0.34 114.94 126.68 2b39 s ASN 410 Ca 0.14 0.97 0.02 0.00 -2.14 0.00 0.00 52.86 51.86 2b39 s ASN 410 Cb -0.10 -2.25 -0.02 0.00 1.28 0.00 0.00 41.25 40.15 2b39 s ASN 410 CO 0.06 0.32 -0.13 0.42 -2.04 0.00 0.00 177.10 175.73 2b39 s THR 411 N -1.09 3.15 0.72 0.54 -4.23 -0.22 -4.91 115.64 109.60 2b39 s THR 411 Ca 0.24 -0.68 -0.12 0.00 -1.18 0.00 0.00 61.69 59.95 2b39 s THR 411 Cb -0.17 -2.26 0.17 0.00 1.34 0.00 0.00 72.50 71.58 2b39 s THR 411 CO 0.14 0.58 0.83 0.00 -0.54 0.00 0.00 174.62 175.62 2b39 n GLN 412 N 2.57 -1.47 -2.58 3.99 10.64 -1.26 -0.62 117.38 128.64 2b39 n GLN 412 Ca -0.17 -1.29 -0.42 0.00 -1.83 0.00 0.00 57.00 53.28 2b39 n GLN 412 Cb 0.52 -0.98 -0.02 0.00 -0.86 0.00 0.00 30.24 28.90 2b39 n GLN 412 CO 0.00 0.00 0.00 -0.80 -1.83 0.00 0.00 177.06 174.43 2b39 s ASN 413 N -3.94 6.48 0.29 2.61 0.01 -1.26 -0.55 114.94 118.58 2b39 s ASN 413 Ca 0.49 0.18 -0.20 0.00 -0.71 0.00 0.00 52.86 52.62 2b39 s ASN 413 Cb -0.03 -2.55 0.04 0.00 0.41 0.00 0.00 41.25 39.12 2b39 s ASN 413 CO 0.36 -1.45 0.80 -0.54 -1.51 0.00 0.00 177.10 174.76 2b39 s LYS 414 N 4.88 1.83 0.00 -0.60 1.02 -1.26 -4.92 119.74 120.68 2b39 s LYS 414 Ca 0.44 -1.09 0.00 0.00 0.02 0.00 0.00 55.97 55.35 2b39 s LYS 414 Cb -0.07 0.57 0.00 0.00 -0.52 0.00 0.00 37.83 37.81 2b39 s LYS 414 CO 0.27 -0.85 0.12 0.54 -0.92 0.00 0.00 175.35 174.51 2b39 n ARG 415 N -0.50 1.20 -0.99 1.68 1.74 -1.26 -4.57 116.66 113.96 2b39 n ARG 415 Ca -0.06 -0.12 -0.29 0.00 -0.77 0.00 0.00 57.85 56.61 2b39 n ARG 415 Cb 0.60 -0.49 0.19 0.00 -1.02 0.00 0.00 32.46 31.73 2b39 n ARG 415 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2b39 s ASP 416 N -0.21 2.32 0.01 0.55 1.01 -1.26 -4.60 116.67 114.49 2b39 s ASP 416 Ca 0.00 1.36 -0.30 0.00 0.71 0.00 0.00 52.55 54.32 2b39 s ASP 416 Cb 0.00 -2.06 -0.05 0.00 1.01 0.00 0.00 42.92 41.83 2b39 s ASP 416 CO 0.00 -3.35 1.21 -2.16 0.21 0.00 0.00 175.17 171.08 2b39 s PRO 417 N -4.81 4.40 -0.61 8.23 0.04 -1.26 -4.78 135.00 136.20 2b39 s PRO 417 Ca 0.66 1.74 -0.23 0.00 0.04 0.00 0.00 61.00 63.21 2b39 s PRO 417 Cb -0.20 -3.44 0.06 0.00 0.04 0.00 0.00 34.50 30.95 2b39 s PRO 417 CO 0.59 -0.34 0.93 -1.17 0.04 0.00 0.00 177.00 177.05 2b39 s LEU 418 N 1.57 4.35 -0.30 -3.56 2.96 -0.21 -4.97 118.68 118.51 2b39 s LEU 418 Ca 0.58 -0.79 -0.05 0.00 -0.22 0.00 0.00 54.13 53.64 2b39 s LEU 418 Cb -0.28 -2.54 0.03 0.00 0.50 0.00 0.00 46.19 43.90 2b39 s LEU 418 CO 0.26 -1.33 0.06 -0.89 -1.32 0.00 0.00 176.35 173.13 2b39 s THR 419 N 3.90 3.60 -0.14 3.68 2.01 -1.26 -0.48 115.64 126.95 2b39 s THR 419 Ca 0.24 -1.00 -0.00 0.00 0.31 0.00 0.00 61.69 61.24 2b39 s THR 419 Cb -0.16 -2.95 -0.01 0.00 0.01 0.00 0.00 72.50 69.39 2b39 s THR 419 CO 0.13 -0.02 -0.13 0.27 -0.69 0.00 0.00 174.62 174.18 2b39 s ILE 420 N 1.40 3.02 -0.00 1.82 -5.25 -0.76 -4.93 121.20 116.50 2b39 s ILE 420 Ca -0.00 -0.66 0.01 0.00 -0.99 0.00 0.00 60.65 59.00 2b39 s ILE 420 Cb -0.18 -2.28 -0.04 0.00 2.95 0.00 0.00 42.46 42.91 2b39 s ILE 420 CO 0.01 0.52 0.03 0.42 -1.79 0.00 0.00 174.94 174.13 2b39 s THR 421 N 0.48 4.39 -0.01 8.37 -4.23 -1.26 -0.95 115.64 122.43 2b39 s THR 421 Ca -0.09 -0.52 0.08 0.00 -1.18 0.00 0.00 61.69 59.97 2b39 s THR 421 Cb -0.16 -2.98 -0.02 0.00 1.34 0.00 0.00 72.50 70.68 2b39 s THR 421 CO 0.04 0.37 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.56 2b39 s VAL 422 N -1.13 2.26 0.27 2.29 1.01 -0.22 -3.52 120.40 121.37 2b39 s VAL 422 Ca 0.21 -1.12 0.02 0.00 0.00 0.00 0.00 61.98 61.09 2b39 s VAL 422 Cb -0.12 -1.83 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 2b39 s VAL 422 CO 0.12 0.52 0.08 -0.13 0.00 0.00 0.00 175.10 175.69 2b39 s ARG 423 N -0.81 1.47 -0.05 2.72 0.52 0.31 -3.29 118.95 119.82 2b39 s ARG 423 Ca 0.11 -1.80 -0.02 0.00 -0.52 0.00 0.00 55.73 53.50 2b39 s ARG 423 Cb -0.10 -0.45 0.03 0.00 0.52 0.00 0.00 34.95 34.95 2b39 s ARG 423 CO 0.00 -0.25 0.04 0.95 0.02 0.00 0.00 175.30 176.06 2b39 s THR 424 N -3.61 0.05 -0.74 0.02 -4.23 -1.23 0.22 115.64 106.13 2b39 s THR 424 Ca 0.37 0.32 0.04 0.00 -1.18 0.00 0.00 61.69 61.24 2b39 s THR 424 Cb 0.08 -0.27 0.28 0.00 1.34 0.00 0.00 72.50 73.92 2b39 s THR 424 CO 0.14 0.20 0.97 0.29 -0.54 0.00 0.00 174.62 175.68 2b39 n LYS 425 N 5.21 3.15 -1.95 3.99 4.76 -1.25 -4.13 118.16 127.94 2b39 n LYS 425 Ca -0.05 -4.68 -0.42 0.00 -2.87 0.00 0.00 58.31 50.29 2b39 n LYS 425 Cb 0.50 -2.32 -0.03 0.00 -1.84 0.00 0.00 35.03 31.34 2b39 n LYS 425 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2b39 s LYS 426 N -2.77 4.22 0.27 1.97 2.47 -1.26 -4.83 119.74 119.82 2b39 s LYS 426 Ca 0.39 2.35 0.11 0.00 -1.56 0.00 0.00 55.97 57.26 2b39 s LYS 426 Cb 0.15 -3.16 0.89 0.00 -1.46 0.00 0.00 37.83 34.26 2b39 s LYS 426 CO -0.01 -0.59 1.23 -0.40 0.16 0.00 0.00 175.35 175.74 2b39 n ASP 427 N 3.88 0.14 0.00 1.43 5.75 -1.26 -2.55 116.55 123.94 2b39 n ASP 427 Ca 0.13 1.31 0.00 0.00 -0.01 0.00 0.00 54.79 56.22 2b39 n ASP 427 Cb 0.39 -0.58 0.00 0.00 -1.03 0.00 0.00 41.12 39.90 2b39 n ASP 427 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2b39 n ASN 428 N -4.89 0.00 -4.59 -1.12 4.13 -1.26 -4.87 115.26 102.66 2b39 n ASN 428 Ca 0.26 0.81 -0.43 0.00 1.68 0.00 0.00 54.58 56.90 2b39 n ASN 428 Cb 0.87 -0.46 -0.00 0.00 -1.54 0.00 0.00 39.78 38.64 2b39 n ASN 428 CO 0.00 0.00 0.00 2.30 0.28 0.00 0.00 177.26 179.84 2b39 n ILE 429 N -1.88 2.14 -1.16 2.41 -5.35 -1.06 -5.00 119.36 109.46 2b39 n ILE 429 Ca 0.00 -0.50 -0.29 0.00 -0.27 0.00 0.00 62.75 61.69 2b39 n ILE 429 Cb 0.00 -1.06 0.20 0.00 -1.74 0.00 0.00 39.64 37.03 2b39 n ILE 429 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2b39 s PRO 430 N -1.75 -0.08 0.12 6.28 0.04 -1.26 -4.70 135.00 133.65 2b39 s PRO 430 Ca 0.60 0.31 0.12 0.00 0.04 0.00 0.00 61.00 62.08 2b39 s PRO 430 Cb -0.63 -1.70 0.59 0.00 0.04 0.00 0.00 34.50 32.80 2b39 s PRO 430 CO 0.59 -3.03 1.38 0.39 0.04 0.00 0.00 177.00 176.37 2b39 n GLU 431 N -4.35 0.07 0.12 4.56 -0.58 -1.26 -1.52 120.64 117.68 2b39 n GLU 431 Ca 0.07 0.47 0.07 0.00 -0.42 0.00 0.00 57.16 57.36 2b39 n GLU 431 Cb 0.58 -1.68 0.02 0.00 -0.57 0.00 0.00 31.44 29.80 2b39 n GLU 431 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 2b39 h GLY 432 N 0.88 0.00 -7.11 0.62 0.00 -1.99 -3.42 103.07 92.05 2b39 h GLY 432 Ca 0.00 0.00 -0.74 0.00 0.00 0.00 0.00 47.33 46.59 2b39 h GLY 432 CO 0.00 0.00 -0.11 -1.60 0.00 0.00 0.00 176.54 174.83 2b39 s ARG 433 N -3.16 3.01 0.10 4.80 3.52 -0.57 -5.02 118.95 121.63 2b39 s ARG 433 Ca 0.01 -1.58 -0.18 0.00 -0.13 0.00 0.00 55.73 53.86 2b39 s ARG 433 Cb 0.08 -4.29 0.04 0.00 -1.56 0.00 0.00 34.95 29.22 2b39 s ARG 433 CO 0.76 -1.40 0.43 1.14 -0.81 0.00 0.00 175.30 175.42 2b39 s GLN 434 N 1.96 1.05 0.02 5.12 0.00 -1.26 -4.63 119.66 121.91 2b39 s GLN 434 Ca 0.06 -0.57 -0.09 0.00 -0.00 0.00 0.00 55.36 54.75 2b39 s GLN 434 Cb -0.28 0.47 -0.05 0.00 0.00 0.00 0.00 33.01 33.14 2b39 s GLN 434 CO 0.04 -0.40 0.33 0.00 0.00 0.00 0.00 175.29 175.26 2b39 s ALA 435 N -3.40 3.78 -0.14 2.60 0.00 -1.26 -4.90 121.76 118.45 2b39 s ALA 435 Ca 0.00 -0.44 -0.06 0.00 0.00 0.00 0.00 51.96 51.46 2b39 s ALA 435 Cb 0.01 -2.20 0.06 0.00 0.00 0.00 0.00 23.12 20.99 2b39 s ALA 435 CO -0.09 0.58 0.31 0.99 0.00 0.00 0.00 175.76 177.55 2b39 s THR 436 N -1.26 -0.17 -0.10 0.00 2.01 -1.25 -3.56 115.64 111.30 2b39 s THR 436 Ca 0.27 0.16 -0.09 0.00 0.31 0.00 0.00 61.69 62.34 2b39 s THR 436 Cb -0.14 -0.49 0.03 0.00 0.01 0.00 0.00 72.50 71.91 2b39 s THR 436 CO 0.15 0.07 0.27 -0.13 -0.69 0.00 0.00 174.62 174.29 2b39 s ARG 437 N 1.68 0.32 0.47 4.92 1.81 -1.21 -4.98 118.95 121.96 2b39 s ARG 437 Ca -0.06 0.39 0.07 0.00 -1.72 0.00 0.00 55.73 54.40 2b39 s ARG 437 Cb -0.10 0.14 -0.00 0.00 -0.45 0.00 0.00 34.95 34.54 2b39 s ARG 437 CO -0.10 -0.04 0.36 0.99 -0.68 0.00 0.00 175.30 175.83 2b39 s THR 438 N 0.19 2.20 -0.06 0.02 2.01 -1.26 -1.06 115.64 117.70 2b39 s THR 438 Ca -0.00 -1.46 -0.29 0.00 0.31 0.00 0.00 61.69 60.25 2b39 s THR 438 Cb -0.02 -2.66 0.06 0.00 0.01 0.00 0.00 72.50 69.89 2b39 s THR 438 CO -0.00 0.00 0.64 -0.32 -0.69 0.00 0.00 174.62 174.25 2b39 s MET 439 N -4.16 1.00 -0.38 4.92 1.75 -0.12 -4.94 119.30 117.37 2b39 s MET 439 Ca 0.42 0.24 -0.11 0.00 -1.25 0.00 0.00 55.69 54.99 2b39 s MET 439 Cb -0.02 0.47 0.03 0.00 2.84 0.00 0.00 34.83 38.16 2b39 s MET 439 CO 0.25 -0.30 0.22 -1.14 -0.65 0.00 0.00 175.02 173.40 2b39 s GLN 440 N -1.13 2.80 -0.35 4.11 2.00 -1.26 -1.83 119.66 124.00 2b39 s GLN 440 Ca -0.11 -1.13 -0.13 0.00 -2.00 0.00 0.00 55.36 51.99 2b39 s GLN 440 Cb -0.01 -3.76 -0.01 0.00 0.80 0.00 0.00 33.01 30.03 2b39 s GLN 440 CO 0.09 -0.74 0.24 0.00 -0.50 0.00 0.00 175.29 174.37 2b39 s ALA 441 N 1.55 3.47 -0.10 1.58 0.00 0.37 -4.88 121.76 123.75 2b39 s ALA 441 Ca 0.02 -1.43 0.03 0.00 0.00 0.00 0.00 51.96 50.57 2b39 s ALA 441 Cb -0.20 -2.66 -0.01 0.00 0.00 0.00 0.00 23.12 20.25 2b39 s ALA 441 CO 0.06 -1.03 -0.19 -0.51 0.00 0.00 0.00 175.76 174.09 2b39 s LEU 442 N 1.70 2.40 0.96 0.00 1.02 -1.18 -1.05 118.68 122.52 2b39 s LEU 442 Ca 0.06 -0.43 -0.11 0.00 0.02 0.00 0.00 54.13 53.67 2b39 s LEU 442 Cb -0.18 -1.50 0.14 0.00 0.02 0.00 0.00 46.19 44.68 2b39 s LEU 442 CO 0.10 0.19 0.98 -2.65 0.02 0.00 0.00 176.35 174.99 2b39 n PRO 443 N 3.34 -0.67 -2.54 1.29 -0.02 -1.26 -2.51 135.00 132.63 2b39 n PRO 443 Ca -0.18 -0.14 -0.34 0.00 -2.02 0.00 0.00 63.50 60.82 2b39 n PRO 443 Cb 0.53 -2.25 -0.03 0.00 -0.02 0.00 0.00 33.50 31.72 2b39 n PRO 443 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2b39 s TYR 444 N -2.56 2.99 -0.74 6.00 5.04 -0.65 -4.73 117.35 122.70 2b39 s TYR 444 Ca 0.65 1.58 0.03 0.00 -2.44 0.00 0.00 57.07 56.89 2b39 s TYR 444 Cb -0.23 -3.08 0.29 0.00 0.35 0.00 0.00 41.96 39.30 2b39 s TYR 444 CO 0.61 -0.85 1.04 0.09 -1.34 0.00 0.00 175.55 175.09 2b39 n ASN 445 N -0.96 4.80 -4.44 4.32 4.13 -1.26 -4.95 115.26 116.90 2b39 n ASN 445 Ca 0.09 -3.54 -0.48 0.00 1.68 0.00 0.00 54.58 52.34 2b39 n ASN 445 Cb 0.52 -0.79 -0.03 0.00 -1.54 0.00 0.00 39.78 37.94 2b39 n ASN 445 CO 0.00 0.00 0.00 1.07 0.28 0.00 0.00 177.26 178.61 2b39 n THR 446 N 0.52 1.96 -1.58 3.41 5.66 -1.26 -4.67 114.28 118.32 2b39 n THR 446 Ca 0.31 -0.49 -0.45 0.00 -3.05 0.00 0.00 64.05 60.37 2b39 n THR 446 Cb 0.38 -0.19 -0.04 0.00 -1.55 0.00 0.00 70.33 68.92 2b39 n THR 446 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2b39 n GLN 447 N 0.96 1.87 -3.20 1.09 10.64 -1.26 -3.25 117.38 124.24 2b39 n GLN 447 Ca 0.16 0.55 -0.15 0.00 -1.83 0.00 0.00 57.00 55.74 2b39 n GLN 447 Cb 0.26 -3.02 0.07 0.00 -0.86 0.00 0.00 30.24 26.69 2b39 n GLN 447 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2b39 n GLY 448 N 5.73 -1.09 2.36 2.61 0.00 -1.26 -3.40 105.19 110.13 2b39 n GLY 448 Ca 0.31 0.56 -0.03 0.00 0.00 0.00 0.00 46.02 46.86 2b39 n GLY 448 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2b39 n ASN 449 N -3.17 -0.91 0.00 1.61 3.02 -1.20 -4.75 115.26 109.86 2b39 n ASN 449 Ca -0.07 0.30 0.03 0.00 -0.03 0.00 0.00 54.58 54.81 2b39 n ASN 449 Cb 0.62 -0.89 0.16 0.00 -0.61 0.00 0.00 39.78 39.06 2b39 n ASN 449 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2b39 n SER 450 N -1.33 0.00 -2.28 6.41 3.41 -1.22 -4.86 113.62 113.75 2b39 n SER 450 Ca 0.01 -0.88 -0.02 0.00 -0.26 0.00 0.00 58.87 57.72 2b39 n SER 450 Cb 0.42 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.37 2b39 n SER 450 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2b39 n ASN 451 N -0.66 -0.88 -4.35 4.04 3.02 -1.26 -4.57 115.26 110.60 2b39 n ASN 451 Ca 0.04 0.34 -0.46 0.00 -0.03 0.00 0.00 54.58 54.48 2b39 n ASN 451 Cb 0.02 -0.87 -0.01 0.00 -0.61 0.00 0.00 39.78 38.31 2b39 n ASN 451 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2b39 s ASN 452 N -1.74 6.92 0.53 6.41 0.02 -1.26 -4.04 114.94 121.78 2b39 s ASN 452 Ca 0.04 -2.90 0.06 0.00 -1.02 0.00 0.00 52.86 49.04 2b39 s ASN 452 Cb -0.02 -2.24 0.06 0.00 0.02 0.00 0.00 41.25 39.07 2b39 s ASN 452 CO 0.04 -0.55 0.52 -1.22 0.02 0.00 0.00 177.10 175.91 2b39 n TYR 453 N 3.95 -1.22 -3.73 2.20 4.01 -1.12 -4.87 117.16 116.38 2b39 n TYR 453 Ca 0.19 -2.14 -0.14 0.00 -0.16 0.00 0.00 57.90 55.65 2b39 n TYR 453 Cb 0.45 -0.46 -0.09 0.00 -0.31 0.00 0.00 39.34 38.93 2b39 n TYR 453 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 2b39 s LEU 454 N 0.00 0.52 -0.24 7.72 2.96 -1.26 -3.22 118.68 125.16 2b39 s LEU 454 Ca 0.39 0.49 -0.03 0.00 -0.22 0.00 0.00 54.13 54.76 2b39 s LEU 454 Cb -0.03 1.44 0.13 0.00 0.50 0.00 0.00 46.19 48.23 2b39 s LEU 454 CO 0.25 -0.32 0.34 -2.28 -1.32 0.00 0.00 176.35 173.02 2b39 s HIS 455 N -0.59 -0.70 -0.04 5.38 5.65 -0.59 -4.80 115.29 119.60 2b39 s HIS 455 Ca -0.07 0.62 -0.26 0.00 0.25 0.00 0.00 55.06 55.60 2b39 s HIS 455 Cb -0.04 -0.10 -0.03 0.00 -1.18 0.00 0.00 32.58 31.23 2b39 s HIS 455 CO 0.03 -0.72 0.81 -0.51 -0.65 0.00 0.00 174.74 173.71 2b39 s LEU 456 N 2.49 4.34 -0.04 8.88 1.43 -1.26 -2.93 118.68 131.59 2b39 s LEU 456 Ca 0.11 1.38 0.05 0.00 -1.03 0.00 0.00 54.13 54.64 2b39 s LEU 456 Cb -0.15 -3.28 -0.01 0.00 0.03 0.00 0.00 46.19 42.78 2b39 s LEU 456 CO -0.17 -0.18 -0.19 -0.94 0.23 0.00 0.00 176.35 175.10 2b39 s SER 457 N 0.89 2.37 -0.05 2.29 1.04 -1.13 -4.98 113.70 114.13 2b39 s SER 457 Ca 0.43 -0.38 -0.11 0.00 0.48 0.00 0.00 55.95 56.36 2b39 s SER 457 Cb -0.19 -0.55 0.02 0.00 0.10 0.00 0.00 66.02 65.40 2b39 s SER 457 CO 0.22 0.19 0.27 -0.69 0.98 0.00 0.00 173.24 174.21 2b39 s VAL 458 N -0.13 0.04 -0.09 5.02 1.01 -1.26 -2.01 120.40 122.98 2b39 s VAL 458 Ca -0.01 -0.32 -0.29 0.00 0.00 0.00 0.00 61.98 61.36 2b39 s VAL 458 Cb -0.11 -0.49 -0.05 0.00 0.00 0.00 0.00 36.38 35.73 2b39 s VAL 458 CO 0.02 -0.17 1.71 -2.16 0.00 0.00 0.00 175.10 174.49 2b39 s PRO 459 N -0.72 4.05 0.13 2.72 0.04 -1.26 -4.82 135.00 135.14 2b39 s PRO 459 Ca -0.08 2.12 0.08 0.00 0.04 0.00 0.00 61.00 63.16 2b39 s PRO 459 Cb -0.04 -4.03 0.46 0.00 0.04 0.00 0.00 34.50 30.93 2b39 s PRO 459 CO 0.02 -1.01 1.24 0.54 0.04 0.00 0.00 177.00 177.83 2b39 n ARG 460 N 7.36 0.05 -1.70 4.56 5.12 -1.26 -4.72 116.66 126.07 2b39 n ARG 460 Ca 0.18 0.54 -0.44 0.00 -1.93 0.00 0.00 57.85 56.21 2b39 n ARG 460 Cb 0.43 -1.71 -0.03 0.00 -1.16 0.00 0.00 32.46 29.99 2b39 n ARG 460 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 2b39 n VAL 461 N -1.79 0.66 -1.70 1.55 0.31 -1.26 -4.92 118.33 111.19 2b39 n VAL 461 Ca -0.01 -0.17 -0.39 0.00 -0.01 0.00 0.00 64.34 63.77 2b39 n VAL 461 Cb 0.04 -1.70 0.03 0.00 -0.91 0.00 0.00 33.84 31.31 2b39 n VAL 461 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2b39 n GLU 462 N 2.58 1.59 -4.18 5.55 4.07 -1.26 -5.02 120.64 123.97 2b39 n GLU 462 Ca 0.12 0.58 -0.18 0.00 -0.06 0.00 0.00 57.16 57.62 2b39 n GLU 462 Cb 0.33 -2.42 -0.15 0.00 -0.06 0.00 0.00 31.44 29.14 2b39 n GLU 462 CO 0.00 0.00 0.00 -0.48 -0.06 0.00 0.00 177.13 176.59 2b39 s LEU 463 N -2.53 1.67 0.69 4.31 0.05 -1.26 -5.05 118.68 116.56 2b39 s LEU 463 Ca 0.69 -0.11 -0.11 0.00 0.05 0.00 0.00 54.13 54.64 2b39 s LEU 463 Cb -0.45 -0.37 0.01 0.00 -2.05 0.00 0.00 46.19 43.32 2b39 s LEU 463 CO 0.52 0.01 1.07 -0.54 -0.55 0.00 0.00 176.35 176.86 2b39 s LYS 464 N 0.36 2.98 -0.02 1.48 1.02 -1.26 -3.84 119.74 120.47 2b39 s LYS 464 Ca -0.04 0.62 -0.06 0.00 0.02 0.00 0.00 55.97 56.50 2b39 s LYS 464 Cb -0.08 -2.02 -0.25 0.00 -0.52 0.00 0.00 37.83 34.95 2b39 s LYS 464 CO -0.00 -0.98 3.47 -0.35 -0.92 0.00 0.00 175.35 176.57 2b39 n PRO 465 N -3.00 1.92 0.00 -1.68 -0.04 -1.26 -2.11 135.00 128.83 2b39 n PRO 465 Ca 0.07 -0.96 0.00 0.00 -0.04 0.00 0.00 63.50 62.56 2b39 n PRO 465 Cb 0.56 -1.98 0.00 0.00 -0.04 0.00 0.00 33.50 32.03 2b39 n PRO 465 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2b39 n GLY 466 N 2.54 0.00 3.40 0.55 0.00 -1.19 -4.37 105.19 106.12 2b39 n GLY 466 Ca 0.41 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.13 2b39 n GLY 466 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2b39 s GLU 467 N -0.40 -2.33 -0.04 1.61 8.01 -0.90 -4.78 118.70 119.87 2b39 s GLU 467 Ca 0.00 0.12 0.01 0.00 0.01 0.00 0.00 54.97 55.10 2b39 s GLU 467 Cb 0.00 -1.45 0.02 0.00 -4.31 0.00 0.00 34.13 28.39 2b39 s GLU 467 CO 0.00 -4.48 -0.02 0.95 0.01 0.00 0.00 175.26 171.72 2b39 s THR 468 N -2.50 0.38 -0.14 3.63 -4.23 -1.26 -2.19 115.64 109.33 2b39 s THR 468 Ca 0.69 -0.02 -0.09 0.00 -1.18 0.00 0.00 61.69 61.10 2b39 s THR 468 Cb -0.13 -0.44 -0.04 0.00 1.34 0.00 0.00 72.50 73.23 2b39 s THR 468 CO 0.58 0.19 0.16 -0.22 -0.54 0.00 0.00 174.62 174.79 2b39 s LEU 469 N 1.03 4.33 -0.44 4.79 2.96 0.32 -4.84 118.68 126.84 2b39 s LEU 469 Ca -0.09 0.42 -0.11 0.00 -0.22 0.00 0.00 54.13 54.13 2b39 s LEU 469 Cb -0.14 -2.11 0.08 0.00 0.50 0.00 0.00 46.19 44.52 2b39 s LEU 469 CO -0.01 0.32 0.31 0.20 -1.32 0.00 0.00 176.35 175.85 2b39 s ASN 470 N -0.54 5.80 -0.35 3.68 0.01 -1.26 0.47 114.94 122.75 2b39 s ASN 470 Ca 0.13 -1.47 -0.20 0.00 -0.71 0.00 0.00 52.86 50.62 2b39 s ASN 470 Cb -0.12 -2.05 0.00 0.00 0.41 0.00 0.00 41.25 39.49 2b39 s ASN 470 CO 0.03 -0.58 0.63 -0.69 -1.51 0.00 0.00 177.10 174.97 2b39 s VAL 471 N 1.49 4.90 0.07 1.60 1.01 -0.14 -4.60 120.40 124.73 2b39 s VAL 471 Ca 0.03 0.58 -0.23 0.00 0.00 0.00 0.00 61.98 62.36 2b39 s VAL 471 Cb -0.24 -4.07 -0.06 0.00 0.00 0.00 0.00 36.38 32.01 2b39 s VAL 471 CO 0.03 -0.30 0.70 0.20 0.00 0.00 0.00 175.10 175.73 2b39 s ASN 472 N 1.78 7.19 -0.69 3.32 0.01 -0.85 -1.10 114.94 124.60 2b39 s ASN 472 Ca 0.24 1.41 -0.01 0.00 -0.71 0.00 0.00 52.86 53.79 2b39 s ASN 472 Cb -0.15 -2.44 0.17 0.00 0.41 0.00 0.00 41.25 39.25 2b39 s ASN 472 CO 0.15 0.13 0.51 -0.36 -1.51 0.00 0.00 177.10 176.01 2b39 s PHE 473 N -0.54 3.50 -0.13 2.20 0.08 0.16 -2.84 117.98 120.41 2b39 s PHE 473 Ca 0.35 -2.88 -0.29 0.00 0.12 0.00 0.00 56.93 54.22 2b39 s PHE 473 Cb -0.21 -3.14 -0.02 0.00 -0.57 0.00 0.00 43.02 39.09 2b39 s PHE 473 CO 0.22 -0.78 1.19 -1.01 -0.10 0.00 0.00 175.22 174.74 2b39 s HIS 474 N -0.51 3.09 -0.11 0.36 3.76 -1.15 -3.55 115.29 117.18 2b39 s HIS 474 Ca 0.20 1.19 -0.05 0.00 -0.15 0.00 0.00 55.06 56.25 2b39 s HIS 474 Cb -0.17 -3.42 -0.04 0.00 1.11 0.00 0.00 32.58 30.07 2b39 s HIS 474 CO -0.06 -1.27 0.07 -1.17 -0.85 0.00 0.00 174.74 171.46 2b39 s LEU 475 N 2.90 3.99 -0.43 0.89 2.96 -1.24 -1.55 118.68 126.21 2b39 s LEU 475 Ca 0.53 0.29 0.06 0.00 -0.22 0.00 0.00 54.13 54.79 2b39 s LEU 475 Cb -0.21 -1.95 0.21 0.00 0.50 0.00 0.00 46.19 44.74 2b39 s LEU 475 CO 0.16 0.37 0.54 -1.14 -1.32 0.00 0.00 176.35 174.95 2b39 n ARG 476 N 2.23 0.52 -0.46 1.98 0.63 -1.20 -4.91 116.66 115.46 2b39 n ARG 476 Ca -0.19 -2.86 0.00 0.00 -0.92 0.00 0.00 57.85 53.88 2b39 n ARG 476 Cb 0.54 -1.43 0.00 0.00 0.45 0.00 0.00 32.46 32.02 2b39 n ARG 476 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 2b39 n THR 477 N 2.10 0.00 -3.85 5.15 -2.24 -1.26 -2.78 114.28 111.40 2b39 n THR 477 Ca 0.22 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.78 2b39 n THR 477 Cb 0.53 -1.45 -0.04 0.00 -2.10 0.00 0.00 70.33 67.27 2b39 n THR 477 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2b39 s ASP 478 N -1.00 5.04 0.04 3.42 1.01 -1.26 -4.89 116.67 119.04 2b39 s ASP 478 Ca 0.00 -0.65 -0.16 0.00 0.71 0.00 0.00 52.55 52.45 2b39 s ASP 478 Cb 0.00 -0.81 -0.09 0.00 1.01 0.00 0.00 42.92 43.04 2b39 s ASP 478 CO 0.00 -0.41 0.38 -2.65 0.21 0.00 0.00 175.17 172.71 2b39 n PRO 479 N -1.34 0.00 0.00 8.23 -0.02 -1.26 -0.60 135.00 140.01 2b39 n PRO 479 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.47 2b39 n PRO 479 Cb 0.61 -0.60 0.00 0.00 -0.02 0.00 0.00 33.50 33.49 2b39 n PRO 479 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b39 n GLY 480 N 0.82 0.95 0.21 -1.23 0.00 -1.26 -4.71 105.19 99.96 2b39 n GLY 480 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.08 2b39 n GLY 480 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2b39 h GLU 481 N 0.00 0.42 0.00 1.61 4.39 -1.25 -3.38 114.58 116.37 2b39 h GLU 481 Ca 0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2b39 h GLU 481 Cb 0.00 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.56 2b39 h GLU 481 CO 0.00 0.27 0.00 1.04 -1.16 0.00 0.00 179.01 179.16 2b39 n GLN 482 N -4.95 0.00 0.00 2.33 6.02 -1.25 -1.28 117.38 118.25 2b39 n GLN 482 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 2b39 n GLN 482 Cb 0.18 -0.18 0.00 0.00 1.02 0.00 0.00 30.24 31.26 2b39 n GLN 482 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b39 n ALA 483 N -1.04 0.43 0.78 -1.58 0.00 -1.26 -2.69 120.51 115.14 2b39 n ALA 483 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 2b39 n ALA 483 Cb 0.00 -0.29 0.45 0.00 0.00 0.00 0.00 19.45 19.60 2b39 n ALA 483 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2b39 n LYS 484 N -0.69 0.16 -4.51 0.00 4.81 -0.40 -4.74 118.16 112.78 2b39 n LYS 484 Ca 0.00 0.11 -0.31 0.00 -0.87 0.00 0.00 58.31 57.24 2b39 n LYS 484 Cb 0.03 -1.67 -0.17 0.00 0.02 0.00 0.00 35.03 33.25 2b39 n LYS 484 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 2b39 s ILE 485 N -3.07 1.83 -0.56 3.15 -4.36 -1.10 -4.87 121.20 112.23 2b39 s ILE 485 Ca 0.11 -0.84 0.05 0.00 -0.26 0.00 0.00 60.65 59.72 2b39 s ILE 485 Cb 0.15 -1.65 0.11 0.00 1.25 0.00 0.00 42.46 42.33 2b39 s ILE 485 CO 0.59 0.51 0.95 -2.11 0.24 0.00 0.00 174.94 175.12 2b39 n ARG 486 N 4.21 1.68 -3.68 0.37 1.85 -1.26 -4.77 116.66 115.06 2b39 n ARG 486 Ca -0.19 -1.40 -0.14 0.00 -1.00 0.00 0.00 57.85 55.11 2b39 n ARG 486 Cb 0.51 -1.12 -0.08 0.00 -1.05 0.00 0.00 32.46 30.72 2b39 n ARG 486 CO 0.00 0.00 0.00 1.52 -0.01 0.00 0.00 177.63 179.14 2b39 s TYR 487 N -0.79 -0.47 -0.21 2.89 -0.85 -1.26 0.03 117.35 116.70 2b39 s TYR 487 Ca 0.10 0.98 -0.03 0.00 -0.52 0.00 0.00 57.07 57.60 2b39 s TYR 487 Cb 0.06 0.21 -0.01 0.00 0.38 0.00 0.00 41.96 42.60 2b39 s TYR 487 CO 0.08 -0.38 -0.07 0.71 -1.52 0.00 0.00 175.55 174.36 2b39 s TYR 488 N -0.54 2.92 -0.24 -3.49 2.02 -1.06 -4.68 117.35 112.28 2b39 s TYR 488 Ca -0.07 -0.99 -0.17 0.00 -0.37 0.00 0.00 57.07 55.48 2b39 s TYR 488 Cb -0.03 -2.06 -0.03 0.00 -0.40 0.00 0.00 41.96 39.44 2b39 s TYR 488 CO 0.04 -0.54 0.48 0.95 -1.57 0.00 0.00 175.55 174.90 2b39 s THR 489 N 1.34 5.11 0.12 -0.71 -4.23 -0.63 -1.55 115.64 115.09 2b39 s THR 489 Ca 0.04 0.82 0.06 0.00 -1.18 0.00 0.00 61.69 61.42 2b39 s THR 489 Cb -0.14 -3.79 -0.04 0.00 1.34 0.00 0.00 72.50 69.87 2b39 s THR 489 CO -0.04 0.14 -0.13 -0.72 -0.54 0.00 0.00 174.62 173.32 2b39 s TYR 490 N 2.02 1.36 0.08 3.99 -0.85 -0.93 -1.29 117.35 121.74 2b39 s TYR 490 Ca 0.20 -0.57 0.06 0.00 -0.52 0.00 0.00 57.07 56.25 2b39 s TYR 490 Cb -0.15 -0.71 -0.03 0.00 0.38 0.00 0.00 41.96 41.44 2b39 s TYR 490 CO 0.09 0.13 -0.17 -1.64 -1.52 0.00 0.00 175.55 172.44 2b39 s MET 491 N -2.71 0.97 -0.22 -3.49 -1.94 0.33 -1.76 119.30 110.47 2b39 s MET 491 Ca 0.09 -1.00 -0.05 0.00 -1.71 0.00 0.00 55.69 53.02 2b39 s MET 491 Cb -0.04 -1.08 -0.01 0.00 2.01 0.00 0.00 34.83 35.70 2b39 s MET 491 CO 0.03 0.25 -0.01 0.42 -0.01 0.00 0.00 175.02 175.69 2b39 s ILE 492 N -1.15 3.64 -0.24 2.53 -1.09 0.17 -1.39 121.20 123.66 2b39 s ILE 492 Ca 0.02 -0.40 -0.10 0.00 -2.23 0.00 0.00 60.65 57.94 2b39 s ILE 492 Cb -0.10 -2.66 -0.05 0.00 -1.58 0.00 0.00 42.46 38.07 2b39 s ILE 492 CO 0.03 0.41 0.15 -0.04 -1.23 0.00 0.00 174.94 174.25 2b39 s MET 493 N 1.44 4.00 -0.19 2.79 -1.94 0.47 0.97 119.30 126.84 2b39 s MET 493 Ca 0.05 -0.31 -0.04 0.00 -1.71 0.00 0.00 55.69 53.69 2b39 s MET 493 Cb -0.14 -3.50 0.09 0.00 2.01 0.00 0.00 34.83 33.29 2b39 s MET 493 CO -0.01 0.02 0.26 1.21 -0.01 0.00 0.00 175.02 176.49 2b39 s ASN 494 N 1.16 0.89 -0.48 3.03 2.47 -0.93 0.85 114.94 121.94 2b39 s ASN 494 Ca 0.07 0.07 -0.02 0.00 0.42 0.00 0.00 52.86 53.40 2b39 s ASN 494 Cb -0.14 0.61 0.00 0.00 -1.45 0.00 0.00 41.25 40.28 2b39 s ASN 494 CO 0.05 -0.30 0.25 0.29 -3.72 0.00 0.00 177.10 173.67 2b39 n LYS 495 N 5.34 -1.84 -1.51 0.43 5.02 -1.26 -3.45 118.16 120.89 2b39 n LYS 495 Ca -0.05 0.28 -0.16 0.00 -2.02 0.00 0.00 58.31 56.36 2b39 n LYS 495 Cb 0.50 -3.79 -0.07 0.00 -0.02 0.00 0.00 35.03 31.65 2b39 n LYS 495 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b39 n GLY 496 N -0.99 1.59 3.34 0.72 0.00 -1.26 -4.96 105.19 103.62 2b39 n GLY 496 Ca -0.03 -0.24 -0.21 0.00 0.00 0.00 0.00 46.02 45.55 2b39 n GLY 496 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b39 s LYS 497 N -3.44 1.30 -0.63 1.61 1.02 -1.22 -4.78 119.74 113.59 2b39 s LYS 497 Ca 0.00 -1.47 -0.27 0.00 0.02 0.00 0.00 55.97 54.25 2b39 s LYS 497 Cb 0.00 -1.27 0.03 0.00 -0.52 0.00 0.00 37.83 36.07 2b39 s LYS 497 CO 0.00 0.24 1.17 -1.17 -0.92 0.00 0.00 175.35 174.67 2b39 s LEU 498 N -2.89 3.51 0.00 3.17 0.20 -1.26 -2.18 118.68 119.22 2b39 s LEU 498 Ca 0.18 -0.21 0.00 0.00 0.69 0.00 0.00 54.13 54.79 2b39 s LEU 498 Cb -0.04 -2.87 0.00 0.00 -0.43 0.00 0.00 46.19 42.85 2b39 s LEU 498 CO 0.07 -1.56 0.24 -0.11 -0.29 0.00 0.00 176.35 174.70 2b39 n LEU 499 N 8.56 1.08 -4.33 -0.68 7.94 0.27 -4.76 117.00 125.09 2b39 n LEU 499 Ca 0.05 0.39 -0.18 0.00 -1.11 0.00 0.00 56.01 55.16 2b39 n LEU 499 Cb 0.49 -0.23 -0.10 0.00 0.53 0.00 0.00 43.42 44.10 2b39 n LEU 499 CO 0.70 -0.23 -0.44 -0.54 -1.11 0.00 0.00 177.39 175.76 2b39 s LYS 500 N -0.94 1.28 -0.27 1.96 -0.14 -1.19 -4.93 119.74 115.51 2b39 s LYS 500 Ca 0.00 -1.54 -0.01 0.00 -1.36 0.00 0.00 55.97 53.06 2b39 s LYS 500 Cb 0.00 -1.09 0.08 0.00 -1.68 0.00 0.00 37.83 35.14 2b39 s LYS 500 CO 0.00 0.19 0.06 0.14 -0.76 0.00 0.00 175.35 174.98 2b39 s VAL 501 N -2.84 0.87 0.20 3.17 -7.23 -1.26 0.44 120.40 113.74 2b39 s VAL 501 Ca 0.20 -1.16 0.11 0.00 -1.81 0.00 0.00 61.98 59.32 2b39 s VAL 501 Cb -0.01 -1.52 -0.04 0.00 0.56 0.00 0.00 36.38 35.36 2b39 s VAL 501 CO 0.06 -0.49 -0.20 -0.83 -0.31 0.00 0.00 175.10 173.33 2b39 s GLY 502 N 1.65 1.73 -0.28 2.32 0.00 -0.72 -4.96 107.32 107.04 2b39 s GLY 502 Ca 0.05 -1.62 -0.06 0.00 0.00 0.00 0.00 44.72 43.09 2b39 s GLY 502 CO -0.18 -1.65 0.06 -1.60 0.00 0.00 0.00 173.10 169.73 2b39 s ARG 503 N -2.77 3.11 -0.86 2.90 6.06 -1.26 -2.18 118.95 123.94 2b39 s ARG 503 Ca 0.22 -0.84 -0.08 0.00 -2.50 0.00 0.00 55.73 52.54 2b39 s ARG 503 Cb -0.08 -3.30 0.22 0.00 0.06 0.00 0.00 34.95 31.85 2b39 s ARG 503 CO 0.12 -0.41 0.78 -1.14 -2.50 0.00 0.00 175.30 172.14 2b39 s GLN 504 N 1.48 3.45 0.98 5.12 2.00 -0.60 -4.94 119.66 127.16 2b39 s GLN 504 Ca 0.03 -2.80 -0.11 0.00 -2.00 0.00 0.00 55.36 50.47 2b39 s GLN 504 Cb -0.17 -4.22 0.18 0.00 0.80 0.00 0.00 33.01 29.60 2b39 s GLN 504 CO 0.01 -1.25 1.09 0.71 -0.50 0.00 0.00 175.29 175.35 2b39 s TYR 505 N -0.49 1.84 -0.22 1.67 2.02 -1.26 -2.58 117.35 118.32 2b39 s TYR 505 Ca 0.22 1.39 -0.11 0.00 -0.37 0.00 0.00 57.07 58.20 2b39 s TYR 505 Cb -0.12 -3.19 0.08 0.00 -0.40 0.00 0.00 41.96 38.33 2b39 s TYR 505 CO -0.08 -2.95 0.52 -0.98 -1.57 0.00 0.00 175.55 170.48 2b39 s ARG 506 N -4.71 0.49 0.12 -0.62 1.04 0.11 -4.87 118.95 110.51 2b39 s ARG 506 Ca 0.66 1.02 -0.20 0.00 -1.04 0.00 0.00 55.73 56.17 2b39 s ARG 506 Cb -0.21 0.16 -0.07 0.00 -2.04 0.00 0.00 34.95 32.79 2b39 s ARG 506 CO 0.60 -0.17 0.62 -2.00 -0.04 0.00 0.00 175.30 174.30 2b39 s GLU 507 N 1.80 4.23 0.16 3.89 2.56 -1.26 -4.16 118.70 125.92 2b39 s GLU 507 Ca -0.08 0.78 -0.22 0.00 0.00 0.00 0.00 54.97 55.45 2b39 s GLU 507 Cb -0.08 -3.15 -0.13 0.00 2.00 0.00 0.00 34.13 32.76 2b39 s GLU 507 CO -0.16 0.58 0.41 -0.35 -0.56 0.00 0.00 175.26 175.18 2b39 n PRO 508 N 1.45 0.00 0.00 4.30 -0.04 -1.26 -2.20 135.00 137.25 2b39 n PRO 508 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 2b39 n PRO 508 Cb 0.51 -0.79 0.00 0.00 -0.04 0.00 0.00 33.50 33.17 2b39 n PRO 508 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2b39 n GLY 509 N 1.59 3.27 3.58 0.55 0.00 -1.26 -5.00 105.19 107.92 2b39 n GLY 509 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 2b39 n GLY 509 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2b39 s GLN 510 N -0.59 3.70 -0.29 1.61 -0.21 -0.93 -4.90 119.66 118.05 2b39 s GLN 510 Ca 0.00 0.35 0.08 0.00 0.02 0.00 0.00 55.36 55.82 2b39 s GLN 510 Cb 0.00 -3.85 0.46 0.00 1.00 0.00 0.00 33.01 30.62 2b39 s GLN 510 CO 0.00 -1.04 1.35 -0.40 -2.12 0.00 0.00 175.29 173.09 2b39 n ASP 511 N 6.85 3.17 -2.11 5.90 5.75 -1.26 -4.71 116.55 130.14 2b39 n ASP 511 Ca 0.06 -3.82 -0.01 0.00 -0.01 0.00 0.00 54.79 51.00 2b39 n ASP 511 Cb 0.48 -0.55 0.06 0.00 -1.03 0.00 0.00 41.12 40.09 2b39 n ASP 511 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 2b39 n LEU 512 N -1.01 -0.76 -4.76 -2.12 7.94 -1.25 -3.65 117.00 111.39 2b39 n LEU 512 Ca 0.33 -2.11 -0.39 0.00 -1.11 0.00 0.00 56.01 52.73 2b39 n LEU 512 Cb 0.89 0.55 0.03 0.00 0.53 0.00 0.00 43.42 45.42 2b39 n LEU 512 CO 0.21 1.36 1.00 0.54 -1.11 0.00 0.00 177.39 179.39 2b39 s VAL 513 N 0.07 2.14 -0.12 1.96 0.11 -1.23 -4.54 120.40 118.79 2b39 s VAL 513 Ca 0.05 0.12 0.02 0.00 -2.93 0.00 0.00 61.98 59.23 2b39 s VAL 513 Cb 0.22 -3.06 0.01 0.00 -1.53 0.00 0.00 36.38 32.02 2b39 s VAL 513 CO -0.06 0.01 -0.17 -0.69 -3.33 0.00 0.00 175.10 170.85 2b39 s VAL 514 N -1.28 1.65 -0.20 2.04 1.01 -1.26 0.36 120.40 122.71 2b39 s VAL 514 Ca 0.67 -0.74 -0.11 0.00 0.00 0.00 0.00 61.98 61.80 2b39 s VAL 514 Cb -0.41 -1.49 -0.05 0.00 0.00 0.00 0.00 36.38 34.43 2b39 s VAL 514 CO 0.50 0.47 0.18 -0.22 0.00 0.00 0.00 175.10 176.03 2b39 s LEU 515 N 0.91 4.19 -0.46 3.92 2.96 -0.26 -4.93 118.68 125.02 2b39 s LEU 515 Ca -0.07 0.26 -0.14 0.00 -0.22 0.00 0.00 54.13 53.96 2b39 s LEU 515 Cb -0.15 -2.17 0.07 0.00 0.50 0.00 0.00 46.19 44.44 2b39 s LEU 515 CO -0.01 0.12 0.36 -2.16 -1.32 0.00 0.00 176.35 173.33 2b39 s PRO 516 N 0.63 2.89 -0.13 0.98 0.04 -1.26 -0.97 135.00 137.19 2b39 s PRO 516 Ca 0.10 -1.36 -0.06 0.00 0.04 0.00 0.00 61.00 59.72 2b39 s PRO 516 Cb -0.12 -4.04 -0.04 0.00 0.04 0.00 0.00 34.50 30.34 2b39 s PRO 516 CO 0.01 -0.99 0.08 -1.17 0.04 0.00 0.00 177.00 174.97 2b39 s LEU 517 N 1.59 4.03 -0.42 -3.56 2.96 0.18 -4.88 118.68 118.58 2b39 s LEU 517 Ca 0.04 0.28 -0.21 0.00 -0.22 0.00 0.00 54.13 54.02 2b39 s LEU 517 Cb -0.24 -1.98 0.02 0.00 0.50 0.00 0.00 46.19 44.49 2b39 s LEU 517 CO 0.06 0.34 0.66 0.42 -1.32 0.00 0.00 176.35 176.51 2b39 s THR 518 N -0.61 4.81 -1.20 3.68 -4.23 -1.26 0.12 115.64 116.95 2b39 s THR 518 Ca 0.12 0.29 -0.21 0.00 -1.18 0.00 0.00 61.69 60.71 2b39 s THR 518 Cb -0.12 -4.19 -0.00 0.00 1.34 0.00 0.00 72.50 69.53 2b39 s THR 518 CO 0.02 -0.54 1.81 -0.63 -0.54 0.00 0.00 174.62 174.74 2b39 s ILE 519 N 2.87 3.83 1.14 2.99 1.01 -0.93 -4.97 121.20 127.13 2b39 s ILE 519 Ca 0.24 -1.32 -0.19 0.00 0.00 0.00 0.00 60.65 59.38 2b39 s ILE 519 Cb -0.14 -4.86 0.28 0.00 0.01 0.00 0.00 42.46 37.75 2b39 s ILE 519 CO 0.18 -1.53 1.07 0.35 0.00 0.00 0.00 174.94 175.01 2b39 n THR 520 N 7.10 0.00 -0.08 2.92 -2.24 -1.26 -3.15 114.28 117.58 2b39 n THR 520 Ca 0.45 -0.52 0.09 0.00 -2.27 0.00 0.00 64.05 61.81 2b39 n THR 520 Cb 0.47 -1.27 0.46 0.00 -2.10 0.00 0.00 70.33 67.89 2b39 n THR 520 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2b39 h SER 521 N -2.51 0.43 0.00 3.42 4.64 -1.94 -2.15 113.55 115.44 2b39 h SER 521 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 2b39 h SER 521 Cb 1.19 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2b39 h SER 521 CO 0.26 0.27 0.00 0.47 -0.87 0.00 0.00 176.83 176.96 2b39 n ASP 522 N -4.47 0.00 -0.01 4.97 8.00 -1.26 -1.98 116.55 121.80 2b39 n ASP 522 Ca 0.08 -0.40 0.09 0.00 0.71 0.00 0.00 54.79 55.27 2b39 n ASP 522 Cb 0.28 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.25 2b39 n ASP 522 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2b39 n PHE 523 N -0.94 0.00 -0.19 1.24 3.01 -0.81 -4.81 117.46 114.96 2b39 n PHE 523 Ca 0.07 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.49 2b39 n PHE 523 Cb 0.03 -0.35 -0.04 0.00 -0.01 0.00 0.00 39.48 39.11 2b39 n PHE 523 CO 0.00 0.00 0.00 1.51 1.01 0.00 0.00 176.76 179.28 2b39 n ILE 524 N -2.03 -0.31 -3.11 4.37 0.13 -0.84 -3.61 119.36 113.97 2b39 n ILE 524 Ca -0.03 1.12 -0.39 0.00 -1.10 0.00 0.00 62.75 62.35 2b39 n ILE 524 Cb 0.43 -1.39 -0.05 0.00 -0.84 0.00 0.00 39.64 37.79 2b39 n ILE 524 CO 0.00 0.00 0.00 -2.16 2.80 0.00 0.00 176.55 177.19 2b39 s PRO 525 N -5.25 4.40 0.00 9.51 0.04 -1.26 -4.23 135.00 138.21 2b39 s PRO 525 Ca -0.06 0.82 0.00 0.00 0.04 0.00 0.00 61.00 61.80 2b39 s PRO 525 Cb 0.06 -3.40 0.00 0.00 0.04 0.00 0.00 34.50 31.19 2b39 s PRO 525 CO 0.29 0.20 0.00 0.43 0.04 0.00 0.00 177.00 177.96 2b39 n SER 526 N 3.31 0.00 -4.07 6.66 7.64 -1.24 -4.72 113.62 121.20 2b39 n SER 526 Ca -0.04 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.74 2b39 n SER 526 Cb 0.51 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.63 2b39 n SER 526 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2b39 s PHE 527 N 0.00 0.69 0.05 1.43 -0.12 -0.14 -4.40 117.98 115.49 2b39 s PHE 527 Ca 0.00 -1.03 0.04 0.00 -0.05 0.00 0.00 56.93 55.89 2b39 s PHE 527 Cb 0.00 -0.28 -0.02 0.00 -0.63 0.00 0.00 43.02 42.09 2b39 s PHE 527 CO 0.00 -0.65 -0.12 1.03 -0.05 0.00 0.00 175.22 175.43 2b39 s ARG 528 N -4.03 0.74 -0.03 1.99 0.52 0.25 -0.06 118.95 118.32 2b39 s ARG 528 Ca 0.24 -0.81 0.01 0.00 -0.52 0.00 0.00 55.73 54.65 2b39 s ARG 528 Cb 0.05 -0.68 0.02 0.00 0.52 0.00 0.00 34.95 34.86 2b39 s ARG 528 CO 0.03 0.15 -0.03 -1.17 0.02 0.00 0.00 175.30 174.31 2b39 s LEU 529 N -1.46 1.35 0.02 2.53 2.96 -1.02 0.18 118.68 123.23 2b39 s LEU 529 Ca -0.03 -0.09 0.05 0.00 -0.22 0.00 0.00 54.13 53.84 2b39 s LEU 529 Cb -0.09 -0.36 -0.02 0.00 0.50 0.00 0.00 46.19 46.23 2b39 s LEU 529 CO 0.01 -0.06 -0.15 0.68 -1.32 0.00 0.00 176.35 175.52 2b39 s VAL 530 N 0.84 1.20 -0.07 1.68 -7.23 -0.49 -1.07 120.40 115.27 2b39 s VAL 530 Ca -0.10 -0.88 -0.07 0.00 -1.81 0.00 0.00 61.98 59.12 2b39 s VAL 530 Cb -0.13 -1.05 0.02 0.00 0.56 0.00 0.00 36.38 35.78 2b39 s VAL 530 CO -0.00 0.16 0.20 0.00 -0.31 0.00 0.00 175.10 175.14 2b39 s ALA 531 N -0.65 -0.49 0.19 1.32 0.00 -0.04 -0.51 121.76 121.58 2b39 s ALA 531 Ca 0.04 0.51 -0.07 0.00 0.00 0.00 0.00 51.96 52.44 2b39 s ALA 531 Cb -0.07 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.74 2b39 s ALA 531 CO 0.01 -0.11 0.27 1.52 0.00 0.00 0.00 175.76 177.45 2b39 s TYR 532 N -0.04 0.60 -0.06 0.00 -0.85 -0.41 -1.04 117.35 115.55 2b39 s TYR 532 Ca -0.01 -0.93 -0.06 0.00 -0.52 0.00 0.00 57.07 55.54 2b39 s TYR 532 Cb -0.02 -0.15 0.02 0.00 0.38 0.00 0.00 41.96 42.19 2b39 s TYR 532 CO 0.00 -0.75 0.18 1.52 -1.52 0.00 0.00 175.55 174.98 2b39 s TYR 533 N -4.03 -0.18 -0.81 -3.49 -0.85 -0.53 -1.60 117.35 105.86 2b39 s TYR 533 Ca 0.24 0.44 -0.03 0.00 -0.52 0.00 0.00 57.07 57.21 2b39 s TYR 533 Cb 0.04 0.06 0.25 0.00 0.38 0.00 0.00 41.96 42.69 2b39 s TYR 533 CO 0.05 -0.10 2.22 2.41 -1.52 0.00 0.00 175.55 178.60 2b39 n THR 534 N 2.90 4.06 -1.49 -3.49 -1.04 -1.26 -2.23 114.28 111.74 2b39 n THR 534 Ca -0.13 -4.23 -0.43 0.00 -2.04 0.00 0.00 64.05 57.22 2b39 n THR 534 Cb 0.59 -1.45 -0.09 0.00 -1.82 0.00 0.00 70.33 67.56 2b39 n THR 534 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2b39 n LEU 535 N 0.08 1.34 -4.56 -4.42 7.94 -1.19 -4.76 117.00 111.43 2b39 n LEU 535 Ca 0.52 0.05 -0.34 0.00 -1.11 0.00 0.00 56.01 55.13 2b39 n LEU 535 Cb 0.32 -1.20 -0.04 0.00 0.53 0.00 0.00 43.42 43.03 2b39 n LEU 535 CO 0.48 -0.99 1.40 0.27 -1.11 0.00 0.00 177.39 177.44 2b39 s ILE 536 N 9.46 3.63 0.41 1.96 -4.36 -1.26 -3.87 121.20 127.17 2b39 s ILE 536 Ca 1.18 -0.42 -0.09 0.00 -0.26 0.00 0.00 60.65 61.05 2b39 s ILE 536 Cb -0.85 -4.45 -0.07 0.00 1.25 0.00 0.00 42.46 38.34 2b39 s ILE 536 CO 0.43 -1.37 -0.46 -3.20 0.24 0.00 0.00 174.94 170.58 2b39 n ASN 537 N 11.71 -1.95 0.26 4.36 4.05 0.13 -4.72 115.26 129.10 2b39 n ASN 537 Ca 0.34 0.04 0.15 0.00 0.45 0.00 0.00 54.58 55.56 2b39 n ASN 537 Cb 0.49 -0.27 0.59 0.00 1.23 0.00 0.00 39.78 41.82 2b39 n ASN 537 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2b39 h ALA 538 N -0.41 1.01 -0.51 5.20 0.00 -1.91 -2.58 119.26 120.05 2b39 h ALA 538 Ca -0.17 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2b39 h ALA 538 Cb 0.55 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2b39 h ALA 538 CO 0.09 0.07 0.00 1.63 0.00 0.00 0.00 179.25 181.04 2b39 n LYS 539 N -3.17 3.94 -2.71 0.00 5.02 -1.26 -4.93 118.16 115.06 2b39 n LYS 539 Ca 0.01 -2.58 -0.15 0.00 -2.02 0.00 0.00 58.31 53.57 2b39 n LYS 539 Cb 0.35 -2.02 0.02 0.00 -0.02 0.00 0.00 35.03 33.36 2b39 n LYS 539 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b39 n GLY 540 N 0.71 -0.14 3.70 0.72 0.00 -0.97 -5.02 105.19 104.19 2b39 n GLY 540 Ca 0.23 -0.18 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 2b39 n GLY 540 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2b39 s GLN 541 N -5.24 3.31 -0.12 1.61 -1.52 -1.26 -4.93 119.66 111.52 2b39 s GLN 541 Ca 0.18 -0.35 0.01 0.00 -1.95 0.00 0.00 55.36 53.25 2b39 s GLN 541 Cb -0.08 -2.96 0.19 0.00 -0.22 0.00 0.00 33.01 29.94 2b39 s GLN 541 CO 0.22 0.60 1.22 -2.13 -0.25 0.00 0.00 175.29 174.96 2b39 n ARG 542 N 2.48 1.41 -0.80 2.91 0.63 -1.26 0.20 116.66 122.24 2b39 n ARG 542 Ca -0.18 -0.84 -0.26 0.00 -0.92 0.00 0.00 57.85 55.64 2b39 n ARG 542 Cb 0.54 -1.36 -0.00 0.00 0.45 0.00 0.00 32.46 32.08 2b39 n ARG 542 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 2b39 n GLU 543 N 0.05 0.00 -4.04 -0.14 2.13 -1.25 -4.79 120.64 112.59 2b39 n GLU 543 Ca 0.16 0.00 -0.22 0.00 0.66 0.00 0.00 57.16 57.76 2b39 n GLU 543 Cb 0.80 -0.61 -0.17 0.00 0.27 0.00 0.00 31.44 31.74 2b39 n GLU 543 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2b39 s VAL 544 N -0.98 0.56 -0.06 6.31 1.01 -1.26 -3.18 120.40 122.80 2b39 s VAL 544 Ca 0.36 -0.08 0.04 0.00 0.00 0.00 0.00 61.98 62.30 2b39 s VAL 544 Cb -0.41 -0.62 -0.00 0.00 0.00 0.00 0.00 36.38 35.35 2b39 s VAL 544 CO 0.38 0.25 -0.19 -0.69 0.00 0.00 0.00 175.10 174.86 2b39 s VAL 545 N 1.28 1.57 0.31 2.92 1.01 -0.94 -4.71 120.40 121.85 2b39 s VAL 545 Ca -0.05 -0.78 0.06 0.00 0.00 0.00 0.00 61.98 61.20 2b39 s VAL 545 Cb -0.14 -1.36 -0.02 0.00 0.00 0.00 0.00 36.38 34.87 2b39 s VAL 545 CO -0.02 0.45 0.30 0.00 0.00 0.00 0.00 175.10 175.83 2b39 n ALA 546 N 3.26 0.48 -3.83 5.51 0.00 -1.26 -1.45 120.51 123.23 2b39 n ALA 546 Ca -0.19 -1.76 -0.07 0.00 0.00 0.00 0.00 53.44 51.42 2b39 n ALA 546 Cb 0.53 1.43 0.01 0.00 0.00 0.00 0.00 19.45 21.42 2b39 n ALA 546 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2b39 s ASP 547 N -3.15 -0.05 -0.15 0.00 3.68 -0.20 -4.67 116.67 112.13 2b39 s ASP 547 Ca 0.35 -0.94 -0.31 0.00 2.13 0.00 0.00 52.55 53.78 2b39 s ASP 547 Cb 0.01 0.75 0.13 0.00 -1.45 0.00 0.00 42.92 42.37 2b39 s ASP 547 CO 0.25 -1.47 1.09 -0.94 0.13 0.00 0.00 175.17 174.23 2b39 s SER 548 N -3.10 -0.25 0.00 -0.34 1.04 -1.26 -0.86 113.70 108.94 2b39 s SER 548 Ca 0.16 0.12 -0.06 0.00 0.48 0.00 0.00 55.95 56.65 2b39 s SER 548 Cb -0.05 0.23 -0.00 0.00 0.10 0.00 0.00 66.02 66.31 2b39 s SER 548 CO 0.09 -0.34 0.10 -0.69 0.98 0.00 0.00 173.24 173.39 2b39 s VAL 549 N -2.04 0.08 -0.09 5.02 1.01 -0.23 -3.67 120.40 120.48 2b39 s VAL 549 Ca 0.05 -0.68 -0.12 0.00 0.00 0.00 0.00 61.98 61.22 2b39 s VAL 549 Cb -0.01 -0.38 -0.05 0.00 0.00 0.00 0.00 36.38 35.94 2b39 s VAL 549 CO -0.04 -0.37 0.30 0.86 0.00 0.00 0.00 175.10 175.84 2b39 s TRP 550 N -1.29 3.60 -0.08 5.22 -0.00 -1.25 -2.44 118.94 122.71 2b39 s TRP 550 Ca -0.14 0.73 -0.01 0.00 -0.00 0.00 0.00 56.10 56.68 2b39 s TRP 550 Cb -0.08 -2.22 0.03 0.00 -0.00 0.00 0.00 33.47 31.20 2b39 s TRP 550 CO 0.01 0.52 -0.01 0.08 -0.00 0.00 0.00 176.95 177.54 2b39 s VAL 551 N -0.49 0.49 0.12 5.86 1.01 0.91 -5.00 120.40 123.29 2b39 s VAL 551 Ca 0.19 0.04 -0.21 0.00 0.00 0.00 0.00 61.98 62.00 2b39 s VAL 551 Cb -0.14 -0.61 -0.07 0.00 0.00 0.00 0.00 36.38 35.55 2b39 s VAL 551 CO 0.08 0.27 0.66 -0.62 0.00 0.00 0.00 175.10 175.49 2b39 s ASP 552 N 1.85 7.18 -0.09 3.32 3.68 -1.26 -0.96 116.67 130.38 2b39 s ASP 552 Ca 0.04 1.41 0.01 0.00 2.13 0.00 0.00 52.55 56.13 2b39 s ASP 552 Cb -0.12 -2.41 0.02 0.00 -1.45 0.00 0.00 42.92 38.95 2b39 s ASP 552 CO -0.05 0.23 -0.10 0.68 0.13 0.00 0.00 175.17 176.06 2b39 s VAL 553 N -1.16 1.08 0.00 1.11 -7.23 -1.26 -4.54 120.40 108.39 2b39 s VAL 553 Ca 0.33 -0.37 0.00 0.00 -1.81 0.00 0.00 61.98 60.12 2b39 s VAL 553 Cb -0.21 -1.05 0.00 0.00 0.56 0.00 0.00 36.38 35.69 2b39 s VAL 553 CO 0.22 0.36 0.00 1.17 -0.31 0.00 0.00 175.10 176.54 2b39 n LYS 554 N 4.47 0.00 -0.87 4.82 3.00 -1.25 -4.36 118.16 123.97 2b39 n LYS 554 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.14 2b39 n LYS 554 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.54 2b39 n LYS 554 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2b39 n ASP 555 N 0.04 -1.70 -3.39 3.14 8.00 -1.26 -4.72 116.55 116.66 2b39 n ASP 555 Ca 0.00 -1.19 -0.21 0.00 0.71 0.00 0.00 54.79 54.10 2b39 n ASP 555 Cb 0.00 -0.50 -0.08 0.00 -0.02 0.00 0.00 41.12 40.53 2b39 n ASP 555 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2b39 n SER 556 N 3.86 -0.24 -3.18 -2.24 2.88 -1.26 -4.54 113.62 108.91 2b39 n SER 556 Ca 0.00 -3.19 -0.20 0.00 -1.33 0.00 0.00 58.87 54.15 2b39 n SER 556 Cb 0.42 1.52 0.17 0.00 -0.75 0.00 0.00 64.21 65.57 2b39 n SER 556 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2b39 s MET 558 N -4.57 -0.02 -0.46 0.00 1.75 -1.26 -4.86 119.30 109.88 2b39 s MET 558 Ca 0.46 0.31 -0.01 0.00 -1.25 0.00 0.00 55.69 55.19 2b39 s MET 558 Cb -0.05 -0.30 -0.01 0.00 2.84 0.00 0.00 34.83 37.31 2b39 s MET 558 CO 0.36 -0.22 0.39 0.41 -0.65 0.00 0.00 175.02 175.30 2b39 n GLY 559 N 4.57 0.10 1.38 2.11 0.00 -1.26 -4.73 105.19 107.36 2b39 n GLY 559 Ca -0.20 -0.12 -0.21 0.00 0.00 0.00 0.00 46.02 45.50 2b39 n GLY 559 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2b39 n THR 560 N -2.23 0.59 -4.13 2.61 -2.24 -1.26 -4.47 114.28 103.15 2b39 n THR 560 Ca -0.08 -0.15 -0.23 0.00 -2.27 0.00 0.00 64.05 61.32 2b39 n THR 560 Cb 0.56 0.00 -0.17 0.00 -2.10 0.00 0.00 70.33 68.62 2b39 n THR 560 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2b39 s LEU 561 N 0.89 1.24 0.21 3.22 0.20 -1.25 -4.40 118.68 118.78 2b39 s LEU 561 Ca 0.29 -0.20 0.02 0.00 0.69 0.00 0.00 54.13 54.93 2b39 s LEU 561 Cb -0.41 -0.63 -0.05 0.00 -0.43 0.00 0.00 46.19 44.67 2b39 s LEU 561 CO 0.23 -0.07 0.01 -0.69 -0.29 0.00 0.00 176.35 175.54 2b39 s VAL 562 N 1.24 0.80 -0.09 1.68 1.01 0.12 -4.63 120.40 120.53 2b39 s VAL 562 Ca -0.05 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 59.93 2b39 s VAL 562 Cb -0.14 -2.29 0.02 0.00 0.00 0.00 0.00 36.38 33.97 2b39 s VAL 562 CO -0.02 -0.34 -0.07 -0.69 0.00 0.00 0.00 175.10 173.98 2b39 s VAL 563 N -3.58 0.91 0.14 2.92 1.01 -1.26 -0.44 120.40 120.10 2b39 s VAL 563 Ca 0.28 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.00 2b39 s VAL 563 Cb 0.06 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 2b39 s VAL 563 CO 0.07 0.33 0.03 -0.75 0.00 0.00 0.00 175.10 174.78 2b39 s LYS 564 N 1.36 0.98 1.08 2.72 2.20 0.99 -4.92 119.74 124.14 2b39 s LYS 564 Ca -0.02 -1.46 -0.18 0.00 -0.36 0.00 0.00 55.97 53.94 2b39 s LYS 564 Cb -0.14 0.03 0.26 0.00 -1.51 0.00 0.00 37.83 36.48 2b39 s LYS 564 CO -0.04 -0.20 1.04 -1.71 -0.36 0.00 0.00 175.35 174.08 2b39 n ASN 565 N -0.14 -1.60 0.07 1.43 2.85 -1.26 0.18 115.26 116.78 2b39 n ASN 565 Ca -0.07 -1.17 0.00 0.00 -0.11 0.00 0.00 54.58 53.23 2b39 n ASN 565 Cb 0.63 -0.92 0.00 0.00 1.24 0.00 0.00 39.78 40.74 2b39 n ASN 565 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2b39 n GLY 566 N -3.89 -0.11 3.33 8.20 0.00 -1.08 -3.98 105.19 107.66 2b39 n GLY 566 Ca 0.14 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.69 2b39 n GLY 566 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b39 s GLY 567 N -4.12 2.55 0.26 -0.02 0.00 -1.26 -5.04 107.32 99.69 2b39 s GLY 567 Ca 0.00 -3.19 -0.30 0.00 0.00 0.00 0.00 44.72 41.23 2b39 s GLY 567 CO 0.00 1.29 1.18 1.17 0.00 0.00 0.00 173.10 176.74 2b39 n LYS 568 N 4.27 1.59 -3.86 2.90 3.00 -1.26 -4.87 118.16 119.92 2b39 n LYS 568 Ca 0.11 0.56 -0.11 0.00 -0.00 0.00 0.00 58.31 58.86 2b39 n LYS 568 Cb 0.46 -2.06 -0.11 0.00 0.00 0.00 0.00 35.03 33.33 2b39 n LYS 568 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 2b39 s GLU 569 N -1.10 0.36 0.00 1.64 2.02 -1.26 -5.18 118.70 115.19 2b39 s GLU 569 Ca 0.63 -0.21 0.00 0.00 0.02 0.00 0.00 54.97 55.41 2b39 s GLU 569 Cb -0.70 0.15 0.00 0.00 0.10 0.00 0.00 34.13 33.68 2b39 s GLU 569 CO 0.56 -0.08 0.00 -1.91 0.02 0.00 0.00 175.26 173.86 2b39 n GLU 570 N 1.99 -1.34 -0.12 1.61 2.13 -1.26 -4.79 120.64 118.86 2b39 n GLU 570 Ca -0.19 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.63 2b39 n GLU 570 Cb 0.57 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.28 2b39 n GLU 570 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2b39 n LYS 571 N -1.61 0.66 -3.54 5.31 4.81 -1.26 -4.46 118.16 118.07 2b39 n LYS 571 Ca 0.00 0.00 -0.23 0.00 -0.87 0.00 0.00 58.31 57.21 2b39 n LYS 571 Cb 0.00 -1.17 -0.15 0.00 0.02 0.00 0.00 35.03 33.73 2b39 n LYS 571 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 2b39 s HIS 572 N 0.47 0.01 0.06 5.64 3.76 -1.26 -4.68 115.29 119.28 2b39 s HIS 572 Ca 0.00 -0.24 0.07 0.00 -0.15 0.00 0.00 55.06 54.74 2b39 s HIS 572 Cb 0.00 -0.61 -0.03 0.00 1.11 0.00 0.00 32.58 33.05 2b39 s HIS 572 CO 0.00 -0.64 -0.16 -1.01 -0.85 0.00 0.00 174.74 172.08 2b39 s HIS 573 N 2.21 2.60 -0.19 1.40 3.76 -1.19 -4.96 115.29 118.92 2b39 s HIS 573 Ca 0.06 -0.23 -0.18 0.00 -0.15 0.00 0.00 55.06 54.56 2b39 s HIS 573 Cb -0.16 -1.45 -0.03 0.00 1.11 0.00 0.00 32.58 32.05 2b39 s HIS 573 CO -0.18 0.31 0.50 0.50 -0.85 0.00 0.00 174.74 175.02 2b39 s ARG 574 N -1.66 4.20 0.99 1.40 3.52 -1.26 -3.72 118.95 122.42 2b39 s ARG 574 Ca 0.16 0.39 -0.16 0.00 -0.13 0.00 0.00 55.73 55.98 2b39 s ARG 574 Cb -0.11 -3.55 -0.10 0.00 -1.56 0.00 0.00 34.95 29.63 2b39 s ARG 574 CO 0.07 -0.11 -0.54 -0.35 -0.81 0.00 0.00 175.30 173.56 2b39 n PRO 575 N 4.66 -0.09 0.00 5.12 -0.04 -1.26 0.14 135.00 143.53 2b39 n PRO 575 Ca -0.05 -0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 2b39 n PRO 575 Cb 0.51 -1.21 0.00 0.00 -0.04 0.00 0.00 33.50 32.75 2b39 n PRO 575 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2b39 n GLY 576 N 3.00 0.00 3.60 0.55 0.00 -0.24 -4.80 105.19 107.30 2b39 n GLY 576 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2b39 n GLY 576 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2b39 n GLN 577 N -0.92 1.29 -3.03 1.61 7.27 0.12 -3.75 117.38 119.96 2b39 n GLN 577 Ca 0.00 0.46 -0.32 0.00 0.07 0.00 0.00 57.00 57.21 2b39 n GLN 577 Cb 0.00 -1.99 -0.06 0.00 2.41 0.00 0.00 30.24 30.60 2b39 n GLN 577 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 2b39 s GLN 578 N -1.97 4.00 -0.12 3.69 0.74 -1.26 0.59 119.66 125.33 2b39 s GLN 578 Ca 0.63 0.71 -0.11 0.00 0.05 0.00 0.00 55.36 56.64 2b39 s GLN 578 Cb -0.57 -2.38 0.03 0.00 1.10 0.00 0.00 33.01 31.19 2b39 s GLN 578 CO 0.57 0.09 0.33 0.42 -0.55 0.00 0.00 175.29 176.15 2b39 s ILE 579 N -2.09 -0.00 0.06 -2.34 1.01 0.24 -4.85 121.20 113.24 2b39 s ILE 579 Ca 0.55 0.00 -0.04 0.00 0.00 0.00 0.00 60.65 61.16 2b39 s ILE 579 Cb -0.10 -0.46 -0.05 0.00 0.01 0.00 0.00 42.46 41.86 2b39 s ILE 579 CO 0.19 0.00 0.29 0.28 0.00 0.00 0.00 174.94 175.70 2b39 s THR 580 N 0.20 5.28 -0.05 2.92 -1.32 -1.26 -0.85 115.64 120.56 2b39 s THR 580 Ca -0.00 -0.01 0.05 0.00 -1.21 0.00 0.00 61.69 60.51 2b39 s THR 580 Cb -0.02 -3.60 -0.01 0.00 -1.51 0.00 0.00 72.50 67.36 2b39 s THR 580 CO 0.00 0.21 -0.20 -0.76 -2.21 0.00 0.00 174.62 171.66 2b39 s LEU 581 N -2.22 1.97 -0.22 9.08 1.43 0.72 -2.64 118.68 126.79 2b39 s LEU 581 Ca 0.34 -0.40 -0.12 0.00 -1.03 0.00 0.00 54.13 52.91 2b39 s LEU 581 Cb -0.13 -1.10 -0.05 0.00 0.03 0.00 0.00 46.19 44.95 2b39 s LEU 581 CO 0.22 0.18 0.21 -0.75 0.23 0.00 0.00 176.35 176.44 2b39 s LYS 582 N -0.04 4.14 -0.31 1.70 2.20 0.48 -0.11 119.74 127.79 2b39 s LYS 582 Ca -0.03 -0.13 0.02 0.00 -0.36 0.00 0.00 55.97 55.46 2b39 s LYS 582 Cb -0.12 -3.50 0.09 0.00 -1.51 0.00 0.00 37.83 32.79 2b39 s LYS 582 CO 0.03 0.11 0.05 0.42 -0.36 0.00 0.00 175.35 175.60 2b39 s ILE 583 N 0.88 1.71 -0.24 5.43 1.01 -0.66 -0.01 121.20 129.32 2b39 s ILE 583 Ca 0.11 -1.87 -0.14 0.00 0.00 0.00 0.00 60.65 58.75 2b39 s ILE 583 Cb -0.13 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 2b39 s ILE 583 CO 0.04 -0.55 0.34 -1.61 0.00 0.00 0.00 174.94 173.16 2b39 s GLU 584 N 1.21 4.08 0.29 2.79 2.02 0.41 -3.09 118.70 126.41 2b39 s GLU 584 Ca 0.08 0.04 -0.11 0.00 0.02 0.00 0.00 54.97 55.00 2b39 s GLU 584 Cb -0.18 -3.59 0.01 0.00 0.10 0.00 0.00 34.13 30.46 2b39 s GLU 584 CO -0.14 -0.13 0.52 0.00 0.02 0.00 0.00 175.26 175.54 2b39 s ALA 585 N 1.60 -0.07 1.17 5.21 0.00 -1.16 0.11 121.76 128.63 2b39 s ALA 585 Ca 0.15 -1.01 -0.16 0.00 0.00 0.00 0.00 51.96 50.93 2b39 s ALA 585 Cb -0.15 1.04 0.27 0.00 0.00 0.00 0.00 23.12 24.28 2b39 s ALA 585 CO 0.08 -0.86 1.06 -0.51 0.00 0.00 0.00 175.76 175.53 2b39 s ASP 586 N -3.08 1.12 0.61 0.00 1.11 -1.26 -2.60 116.67 112.56 2b39 s ASP 586 Ca 0.23 1.00 -0.17 0.00 0.18 0.00 0.00 52.55 53.80 2b39 s ASP 586 Cb -0.01 -1.52 -0.03 0.00 1.07 0.00 0.00 42.92 42.43 2b39 s ASP 586 CO 0.12 -4.04 1.11 -1.58 1.18 0.00 0.00 175.17 171.96 2b39 s GLN 587 N -5.02 3.07 -0.43 8.23 0.74 -1.20 -3.64 119.66 121.42 2b39 s GLN 587 Ca 0.68 1.44 0.00 0.00 0.05 0.00 0.00 55.36 57.53 2b39 s GLN 587 Cb -0.16 -1.98 0.00 0.00 1.10 0.00 0.00 33.01 31.96 2b39 s GLN 587 CO 0.59 -1.04 0.00 0.41 -0.55 0.00 0.00 175.29 174.70 2b39 n GLY 588 N -0.34 0.39 3.80 2.59 0.00 -1.25 -4.55 105.19 105.83 2b39 n GLY 588 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 2b39 n GLY 588 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b39 s ALA 589 N -1.03 2.65 -0.23 4.61 0.00 -1.24 -4.33 121.76 122.19 2b39 s ALA 589 Ca 0.00 0.26 -0.01 0.00 0.00 0.00 0.00 51.96 52.21 2b39 s ALA 589 Cb 0.00 -3.22 0.02 0.00 0.00 0.00 0.00 23.12 19.92 2b39 s ALA 589 CO 0.00 -1.10 -0.09 1.03 0.00 0.00 0.00 175.76 175.60 2b39 s ARG 590 N -4.55 2.92 0.20 0.00 1.81 -0.88 -4.74 118.95 113.71 2b39 s ARG 590 Ca 0.61 -0.91 -0.05 0.00 -1.72 0.00 0.00 55.73 53.66 2b39 s ARG 590 Cb -0.16 -2.88 -0.06 0.00 -0.45 0.00 0.00 34.95 31.41 2b39 s ARG 590 CO 0.46 -0.33 0.45 0.08 -0.68 0.00 0.00 175.30 175.28 2b39 s VAL 591 N 1.32 5.10 -0.33 3.52 1.01 -1.20 -1.76 120.40 128.07 2b39 s VAL 591 Ca 0.02 0.04 -0.07 0.00 0.00 0.00 0.00 61.98 61.97 2b39 s VAL 591 Cb -0.16 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.58 2b39 s VAL 591 CO -0.06 -0.11 0.11 -0.83 0.00 0.00 0.00 175.10 174.21 2b39 s GLY 592 N -2.73 1.83 -0.11 4.51 0.00 0.86 -2.37 107.32 109.31 2b39 s GLY 592 Ca 0.42 -1.65 -0.03 0.00 0.00 0.00 0.00 44.72 43.46 2b39 s GLY 592 CO 0.26 0.74 0.02 1.08 0.00 0.00 0.00 173.10 175.20 2b39 s LEU 593 N 1.45 3.67 -0.27 0.66 1.43 -0.74 -1.74 118.68 123.13 2b39 s LEU 593 Ca 0.00 0.14 -0.03 0.00 -1.03 0.00 0.00 54.13 53.21 2b39 s LEU 593 Cb -0.19 -1.86 0.16 0.00 0.03 0.00 0.00 46.19 44.33 2b39 s LEU 593 CO 0.03 0.33 0.51 -0.69 0.23 0.00 0.00 176.35 176.75 2b39 s VAL 594 N -0.56 -0.82 -0.25 -1.59 1.01 -0.98 -2.88 120.40 114.32 2b39 s VAL 594 Ca 0.10 -0.02 -0.24 0.00 0.00 0.00 0.00 61.98 61.83 2b39 s VAL 594 Cb -0.12 -0.91 -0.01 0.00 0.00 0.00 0.00 36.38 35.35 2b39 s VAL 594 CO 0.02 -0.04 0.79 0.00 0.00 0.00 0.00 175.10 175.87 2b39 s ALA 595 N 2.73 3.64 0.09 5.51 0.00 0.10 -1.77 121.76 132.06 2b39 s ALA 595 Ca 0.14 -0.21 0.08 0.00 0.00 0.00 0.00 51.96 51.97 2b39 s ALA 595 Cb -0.15 -3.24 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 2b39 s ALA 595 CO -0.18 -0.92 -0.20 0.08 0.00 0.00 0.00 175.76 174.54 2b39 s VAL 596 N 2.78 1.63 0.38 0.00 1.01 -1.12 -1.72 120.40 123.36 2b39 s VAL 596 Ca 0.33 -1.47 -0.26 0.00 0.00 0.00 0.00 61.98 60.58 2b39 s VAL 596 Cb -0.15 -1.48 -0.09 0.00 0.00 0.00 0.00 36.38 34.66 2b39 s VAL 596 CO 0.08 -0.05 1.21 -0.62 0.00 0.00 0.00 175.10 175.72 2b39 s ASP 597 N -1.80 6.56 0.24 3.32 2.15 -1.26 0.31 116.67 126.19 2b39 s ASP 597 Ca 0.05 2.45 -0.01 0.00 0.43 0.00 0.00 52.55 55.48 2b39 s ASP 597 Cb -0.10 -2.62 0.27 0.00 -0.30 0.00 0.00 42.92 40.17 2b39 s ASP 597 CO 0.04 -0.66 1.64 0.50 -0.17 0.00 0.00 175.17 176.52 2b39 h LYS 598 N 2.83 0.59 -0.82 4.34 3.64 -1.87 -2.98 116.57 122.29 2b39 h LYS 598 Ca -0.49 -0.26 0.13 0.00 -1.27 0.00 0.00 60.65 58.77 2b39 h LYS 598 Cb 1.23 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.98 2b39 h LYS 598 CO 0.63 0.83 0.54 0.78 -2.27 0.00 0.00 179.45 179.96 2b39 h GLY 599 N 1.02 1.01 0.06 5.01 0.00 -1.92 -2.87 103.07 105.38 2b39 h GLY 599 Ca 0.06 -0.26 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 2b39 h GLY 599 CO 0.06 0.10 -0.03 -2.08 0.00 0.00 0.00 176.54 174.60 2b39 h VAL 600 N 0.62 0.00 -0.28 4.60 2.07 -1.95 -3.32 116.25 117.99 2b39 h VAL 600 Ca 0.40 -0.76 0.04 0.00 0.82 0.00 0.00 66.70 67.20 2b39 h VAL 600 Cb 0.69 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 2b39 h VAL 600 CO -0.16 0.00 -0.12 0.33 0.02 0.00 0.00 177.57 177.64 2b39 n PHE 601 N -4.34 -0.02 0.23 1.57 7.35 -1.13 0.01 117.46 121.13 2b39 n PHE 601 Ca -0.01 0.34 0.10 0.00 -0.76 0.00 0.00 57.45 57.12 2b39 n PHE 601 Cb 0.03 -0.58 0.54 0.00 0.35 0.00 0.00 39.48 39.82 2b39 n PHE 601 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 2b39 h VAL 602 N 0.00 0.61 0.00 -2.13 2.07 -1.67 -3.41 116.25 111.72 2b39 h VAL 602 Ca 0.08 -0.96 0.00 0.00 0.82 0.00 0.00 66.70 66.65 2b39 h VAL 602 Cb 0.15 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 2b39 h VAL 602 CO -0.27 0.20 0.00 -0.11 0.02 0.00 0.00 177.57 177.41 2b39 n LEU 603 N -3.51 0.00 -4.01 2.57 7.94 0.10 -4.45 117.00 115.64 2b39 n LEU 603 Ca -0.01 0.64 -0.33 0.00 -1.11 0.00 0.00 56.01 55.20 2b39 n LEU 603 Cb 0.37 -0.14 -0.10 0.00 0.53 0.00 0.00 43.42 44.08 2b39 n LEU 603 CO 0.33 -0.14 0.08 0.21 -1.11 0.00 0.00 177.39 176.76 2b39 s ASN 604 N -2.40 5.20 0.30 1.96 3.84 -1.26 -4.99 114.94 117.59 2b39 s ASN 604 Ca 0.00 -3.50 0.00 0.00 0.21 0.00 0.00 52.86 49.58 2b39 s ASN 604 Cb 0.00 -1.77 0.46 0.00 -0.55 0.00 0.00 41.25 39.39 2b39 s ASN 604 CO 0.00 -0.19 1.84 0.11 -2.79 0.00 0.00 177.10 176.07 2b39 h LYS 605 N 6.07 0.74 -1.06 0.43 6.56 -1.81 -3.24 116.57 124.26 2b39 h LYS 605 Ca 0.08 -0.15 0.31 0.00 -1.06 0.00 0.00 60.65 59.83 2b39 h LYS 605 Cb 0.83 -0.11 -0.04 0.00 -0.57 0.00 0.00 32.23 32.34 2b39 h LYS 605 CO 0.76 0.69 0.76 1.57 -2.06 0.00 0.00 179.45 181.17 2b39 h LYS 606 N 0.72 0.00 -0.12 3.15 2.10 -1.97 -1.19 116.57 119.26 2b39 h LYS 606 Ca 0.16 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.81 2b39 h LYS 606 Cb 0.30 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.63 2b39 h LYS 606 CO 0.00 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.54 2b39 n ASN 607 N -4.21 1.59 -4.84 7.07 3.02 -1.22 -4.85 115.26 111.82 2b39 n ASN 607 Ca 0.22 -1.63 -0.37 0.00 -0.03 0.00 0.00 54.58 52.78 2b39 n ASN 607 Cb 1.12 -0.07 -0.07 0.00 -0.61 0.00 0.00 39.78 40.16 2b39 n ASN 607 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 2b39 s LYS 608 N -1.86 3.42 0.26 3.52 -2.85 -0.45 -4.69 119.74 117.09 2b39 s LYS 608 Ca 0.34 -0.18 -0.30 0.00 -1.00 0.00 0.00 55.97 54.83 2b39 s LYS 608 Cb 0.19 -3.14 -0.09 0.00 -2.06 0.00 0.00 37.83 32.72 2b39 s LYS 608 CO 0.29 0.73 1.04 -0.51 0.10 0.00 0.00 175.35 177.00 2b39 s LEU 609 N -0.90 4.58 -0.01 2.77 1.43 -1.26 -5.04 118.68 120.26 2b39 s LEU 609 Ca 0.14 2.15 -0.02 0.00 -1.03 0.00 0.00 54.13 55.37 2b39 s LEU 609 Cb -0.12 -3.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.48 2b39 s LEU 609 CO 0.03 -0.04 0.05 0.28 0.23 0.00 0.00 176.35 176.90 2b39 s THR 610 N -1.14 0.05 0.27 5.49 -1.32 -1.26 -5.03 115.64 112.69 2b39 s THR 610 Ca 0.43 -0.37 -0.02 0.00 -1.21 0.00 0.00 61.69 60.52 2b39 s THR 610 Cb -0.30 -0.20 0.27 0.00 -1.51 0.00 0.00 72.50 70.76 2b39 s THR 610 CO 0.38 -0.21 1.87 1.56 -2.21 0.00 0.00 174.62 176.01 2b39 h GLN 611 N 5.35 1.09 -0.79 7.08 1.08 -1.89 0.24 115.11 127.26 2b39 h GLN 611 Ca -0.28 -0.07 0.22 0.00 -1.45 0.00 0.00 58.65 57.08 2b39 h GLN 611 Cb 1.20 -0.25 -0.03 0.00 -0.05 0.00 0.00 27.48 28.35 2b39 h GLN 611 CO 0.44 0.72 0.56 -0.09 -0.95 0.00 0.00 178.83 179.52 2b39 h ARG 612 N 1.12 0.04 0.24 1.46 2.43 -1.95 -1.02 114.38 116.70 2b39 h ARG 612 Ca 0.44 -0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 59.28 2b39 h ARG 612 Cb 0.23 -0.01 0.04 0.00 -0.42 0.00 0.00 29.97 29.81 2b39 h ARG 612 CO -0.19 0.02 -1.47 0.87 -1.51 0.00 0.00 179.97 177.70 2b39 h LYS 613 N 0.04 0.52 0.00 0.20 1.57 -1.37 -3.04 116.57 114.49 2b39 h LYS 613 Ca 0.38 -0.88 -0.06 0.00 -1.87 0.00 0.00 60.65 58.21 2b39 h LYS 613 Cb 1.46 0.33 -0.01 0.00 0.08 0.00 0.00 32.23 34.09 2b39 h LYS 613 CO -0.02 1.42 -0.30 -0.84 -0.57 0.00 0.00 179.45 179.14 2b39 h ILE 614 N 0.14 0.99 0.48 1.86 3.07 -0.69 -3.02 117.51 120.33 2b39 h ILE 614 Ca -0.25 -1.13 -0.02 0.00 1.55 0.00 0.00 64.86 65.01 2b39 h ILE 614 Cb 2.16 1.65 0.00 0.00 -0.27 0.00 0.00 36.82 40.36 2b39 h ILE 614 CO 0.27 0.30 -0.23 -0.50 -1.05 0.00 0.00 178.15 176.94 2b39 h TRP 615 N 0.00 -0.60 0.00 0.16 -0.00 -1.44 -1.67 115.95 112.40 2b39 h TRP 615 Ca -0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 58.89 58.87 2b39 h TRP 615 Cb 0.63 0.20 0.00 0.00 -0.00 0.00 0.00 29.16 29.99 2b39 h TRP 615 CO 0.00 -0.29 0.47 -0.25 -0.00 0.00 0.00 178.44 178.36 2b39 n ASP 616 N -5.23 0.04 0.04 -3.49 8.00 -1.15 0.11 116.55 114.88 2b39 n ASP 616 Ca -0.10 0.19 -0.20 0.00 0.71 0.00 0.00 54.79 55.39 2b39 n ASP 616 Cb 0.30 -0.13 -0.14 0.00 -0.02 0.00 0.00 41.12 41.12 2b39 n ASP 616 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2b39 h VAL 617 N 0.00 1.42 0.07 2.53 2.07 -1.18 -2.90 116.25 118.26 2b39 h VAL 617 Ca 0.00 -2.51 -0.38 0.00 0.82 0.00 0.00 66.70 64.63 2b39 h VAL 617 Cb 0.93 3.11 -0.04 0.00 -1.52 0.00 0.00 31.29 33.77 2b39 h VAL 617 CO 0.00 0.71 -2.21 0.52 0.02 0.00 0.00 177.57 176.61 2b39 n VAL 618 N -4.09 1.66 -0.18 2.57 0.31 0.31 -3.57 118.33 115.34 2b39 n VAL 618 Ca -0.16 -0.62 0.00 0.00 -0.01 0.00 0.00 64.34 63.56 2b39 n VAL 618 Cb 0.84 -1.60 0.26 0.00 -0.91 0.00 0.00 33.84 32.42 2b39 n VAL 618 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2b39 h GLU 619 N 0.04 0.91 -0.77 5.55 4.81 0.06 0.37 114.58 125.54 2b39 h GLU 619 Ca -0.49 -0.08 -0.14 0.00 -0.13 0.00 0.00 59.36 58.52 2b39 h GLU 619 Cb 1.98 -0.19 -0.08 0.00 0.63 0.00 0.00 28.75 31.08 2b39 h GLU 619 CO 0.01 0.64 0.18 1.63 -0.73 0.00 0.00 179.01 180.74 2b39 n LYS 620 N -4.40 3.46 -2.74 1.92 5.02 -1.10 -4.40 118.16 115.92 2b39 n LYS 620 Ca 0.07 -2.53 -0.09 0.00 -2.02 0.00 0.00 58.31 53.74 2b39 n LYS 620 Cb 0.07 -2.07 0.09 0.00 -0.02 0.00 0.00 35.03 33.09 2b39 n LYS 620 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2b39 n ALA 621 N 0.06 1.06 -3.06 7.82 0.00 0.10 -4.96 120.51 121.54 2b39 n ALA 621 Ca 0.31 -1.79 -0.12 0.00 0.00 0.00 0.00 53.44 51.84 2b39 n ALA 621 Cb 1.17 -1.03 -0.07 0.00 0.00 0.00 0.00 19.45 19.52 2b39 n ALA 621 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2b39 s ASP 622 N -1.61 -0.18 0.65 0.00 -0.00 -1.12 -4.81 116.67 109.60 2b39 s ASP 622 Ca 0.24 -0.13 -0.18 0.00 -0.00 0.00 0.00 52.55 52.49 2b39 s ASP 622 Cb 0.37 0.38 -0.14 0.00 -0.00 0.00 0.00 42.92 43.54 2b39 s ASP 622 CO -0.06 -0.64 -0.23 2.30 -0.00 0.00 0.00 175.17 176.54 2b39 n ILE 623 N 0.54 0.20 -0.11 0.77 -5.35 -1.26 -4.69 119.36 109.47 2b39 n ILE 623 Ca -0.18 -0.49 0.00 0.00 -0.27 0.00 0.00 62.75 61.80 2b39 n ILE 623 Cb 0.60 -0.08 0.00 0.00 -1.74 0.00 0.00 39.64 38.42 2b39 n ILE 623 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2b39 n GLY 624 N 2.68 -1.27 0.58 3.28 0.00 -1.26 -4.67 105.19 104.54 2b39 n GLY 624 Ca 0.06 -1.08 0.05 0.00 0.00 0.00 0.00 46.02 45.04 2b39 n GLY 624 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b39 s THR 626 N -1.36 0.05 -0.78 0.00 -4.23 -1.16 -5.02 115.64 103.14 2b39 s THR 626 Ca 0.22 -0.42 0.18 0.00 -1.18 0.00 0.00 61.69 60.50 2b39 s THR 626 Cb 0.22 -1.00 -0.21 0.00 1.34 0.00 0.00 72.50 72.85 2b39 s THR 626 CO -0.04 -0.23 0.75 -0.81 -0.54 0.00 0.00 174.62 173.75 2b39 n PRO 627 N 0.33 0.86 -3.57 3.99 -0.05 -1.26 -4.79 135.00 130.51 2b39 n PRO 627 Ca -0.18 -0.02 -0.41 0.00 -0.05 0.00 0.00 63.50 62.85 2b39 n PRO 627 Cb 0.61 -1.38 -0.09 0.00 -0.05 0.00 0.00 33.50 32.58 2b39 n PRO 627 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 175.50 175.65 2b39 s GLY 628 N -2.90 2.01 0.00 0.55 0.00 -1.26 -3.77 107.32 101.95 2b39 s GLY 628 Ca 0.06 -2.36 0.00 0.00 0.00 0.00 0.00 44.72 42.42 2b39 s GLY 628 CO 0.76 1.05 0.00 -1.14 0.00 0.00 0.00 173.10 173.77 2b39 n SER 629 N 4.92 0.00 0.00 1.64 3.41 -1.24 -4.34 113.62 118.01 2b39 n SER 629 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.52 2b39 n SER 629 Cb 0.42 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 2b39 n SER 629 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b39 n GLY 630 N 0.00 3.83 3.55 5.00 0.00 -1.26 -4.16 105.19 112.14 2b39 n GLY 630 Ca 0.00 -1.60 -0.43 0.00 0.00 0.00 0.00 46.02 43.99 2b39 n GLY 630 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2b39 s ARG 631 N -2.52 3.48 0.24 1.61 0.52 -1.26 -4.54 118.95 116.49 2b39 s ARG 631 Ca 0.00 -0.07 0.00 0.00 -0.52 0.00 0.00 55.73 55.14 2b39 s ARG 631 Cb 0.00 -3.90 0.00 0.00 0.52 0.00 0.00 34.95 31.57 2b39 s ARG 631 CO 0.00 -0.99 0.00 0.09 0.02 0.00 0.00 175.30 174.42 2b39 n ASN 632 N 6.46 -5.62 -0.09 0.23 3.02 -1.26 -2.46 115.26 115.54 2b39 n ASN 632 Ca 0.01 0.45 -0.10 0.00 -0.03 0.00 0.00 54.58 54.91 2b39 n ASN 632 Cb 0.48 -2.90 -0.03 0.00 -0.61 0.00 0.00 39.78 36.72 2b39 n ASN 632 CO 0.00 0.00 0.00 0.10 -2.62 0.00 0.00 177.26 174.74 2b39 h TYR 633 N -0.88 0.42 -0.52 3.10 -0.00 -1.93 -2.56 116.97 114.59 2b39 h TYR 633 Ca -0.00 -0.03 0.06 0.00 -0.00 0.00 0.00 58.73 58.76 2b39 h TYR 633 Cb 0.87 -0.13 -0.05 0.00 -0.00 0.00 0.00 36.73 37.42 2b39 h TYR 633 CO -1.67 0.42 0.22 0.00 -0.00 0.00 0.00 178.16 177.14 2b39 h ALA 634 N 0.95 0.66 0.32 0.10 0.00 -1.87 -1.76 119.26 117.66 2b39 h ALA 634 Ca 0.09 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2b39 h ALA 634 Cb 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2b39 h ALA 634 CO -0.01 -0.16 -0.15 0.78 0.00 0.00 0.00 179.25 179.71 2b39 h GLY 635 N 0.43 -0.44 0.44 0.00 0.00 -1.45 -1.13 103.07 100.91 2b39 h GLY 635 Ca 0.25 0.16 0.07 0.00 0.00 0.00 0.00 47.33 47.81 2b39 h GLY 635 CO -0.22 -0.16 0.08 -2.08 0.00 0.00 0.00 176.54 174.16 2b39 h VAL 636 N -0.58 0.76 0.23 4.60 2.07 -1.29 0.43 116.25 122.47 2b39 h VAL 636 Ca -0.04 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 2b39 h VAL 636 Cb 0.42 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2b39 h VAL 636 CO 0.07 0.04 -0.11 -0.26 0.02 0.00 0.00 177.57 177.33 2b39 h PHE 637 N 0.21 -0.29 -0.97 1.57 0.04 -1.31 -3.02 116.94 113.17 2b39 h PHE 637 Ca 0.21 -0.01 0.05 0.00 2.80 0.00 0.00 57.97 61.03 2b39 h PHE 637 Cb 0.27 0.09 -0.06 0.00 2.20 0.00 0.00 35.95 38.46 2b39 h PHE 637 CO -0.21 0.00 0.63 1.79 -0.60 0.00 0.00 178.31 179.92 2b39 h THR 638 N -0.57 1.13 -0.28 -1.55 1.35 -1.03 0.63 112.91 112.59 2b39 h THR 638 Ca -0.03 -0.40 0.08 0.00 -0.55 0.00 0.00 66.41 65.50 2b39 h THR 638 Cb 0.42 -0.15 -0.01 0.00 -1.73 0.00 0.00 68.15 66.68 2b39 h THR 638 CO 0.05 0.22 0.23 0.44 -0.25 0.00 0.00 175.52 176.21 2b39 h ASP 639 N 1.18 0.00 -0.29 5.36 5.19 -0.06 -1.28 116.42 126.52 2b39 h ASP 639 Ca 0.40 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.81 2b39 h ASP 639 Cb 0.08 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.59 2b39 h ASP 639 CO -0.14 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 175.98 2b39 n ALA 640 N -2.49 2.58 -1.63 3.45 0.00 -0.53 -0.06 120.51 121.83 2b39 n ALA 640 Ca 0.04 -1.74 0.00 0.00 0.00 0.00 0.00 53.44 51.74 2b39 n ALA 640 Cb 0.38 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.27 2b39 n ALA 640 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b39 n GLY 641 N -0.05 0.97 3.41 0.00 0.00 -0.48 -4.41 105.19 104.62 2b39 n GLY 641 Ca 0.16 -0.45 -0.24 0.00 0.00 0.00 0.00 46.02 45.49 2b39 n GLY 641 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b39 s LEU 642 N -0.63 2.48 -0.30 0.99 1.43 0.21 0.10 118.68 122.96 2b39 s LEU 642 Ca 0.00 -0.91 -0.07 0.00 -1.03 0.00 0.00 54.13 52.11 2b39 s LEU 642 Cb 0.00 -1.03 0.15 0.00 0.03 0.00 0.00 46.19 45.33 2b39 s LEU 642 CO 0.00 0.04 0.63 0.42 0.23 0.00 0.00 176.35 177.68 2b39 s THR 643 N -2.05 -1.00 0.37 5.49 -4.23 -0.95 -2.81 115.64 110.47 2b39 s THR 643 Ca 0.22 0.00 0.04 0.00 -1.18 0.00 0.00 61.69 60.77 2b39 s THR 643 Cb -0.06 -1.00 -0.06 0.00 1.34 0.00 0.00 72.50 72.72 2b39 s THR 643 CO 0.10 0.00 0.06 -0.76 -0.54 0.00 0.00 174.62 173.48 2b39 s LEU 644 N 2.89 2.29 0.00 4.79 1.43 -1.26 -3.41 118.68 125.41 2b39 s LEU 644 Ca 0.02 -1.45 0.00 0.00 -1.03 0.00 0.00 54.13 51.67 2b39 s LEU 644 Cb -0.13 -0.47 -0.00 0.00 0.03 0.00 0.00 46.19 45.62 2b39 s LEU 644 CO -0.20 -0.66 0.07 1.17 0.23 0.00 0.00 176.35 176.97 2b39 n LYS 645 N -0.84 0.10 -0.37 1.70 4.81 -1.26 -4.11 118.16 118.19 2b39 n LYS 645 Ca -0.05 -0.55 0.00 0.00 -0.87 0.00 0.00 58.31 56.84 2b39 n LYS 645 Cb 0.66 0.49 0.00 0.00 0.02 0.00 0.00 35.03 36.20 2b39 n LYS 645 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 2b39 n THR 646 N -0.11 0.00 0.08 3.15 5.66 -1.26 -4.78 114.28 117.03 2b39 n THR 646 Ca 0.01 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.91 2b39 n THR 646 Cb 0.11 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 68.83 2b39 n THR 646 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 2b39 h SER 647 N 0.00 0.26 -2.46 1.09 4.64 -2.01 -3.39 113.55 111.68 2b39 h SER 647 Ca 0.00 -0.23 -0.48 0.00 -0.47 0.00 0.00 61.79 60.60 2b39 h SER 647 Cb 0.00 -0.08 -0.37 0.00 -0.31 0.00 0.00 62.40 61.64 2b39 h SER 647 CO 0.00 1.09 -0.76 -1.58 -0.87 0.00 0.00 176.83 174.71 2b39 s GLN 648 N -3.01 0.41 0.44 4.77 2.00 -1.26 -5.14 119.66 117.87 2b39 s GLN 648 Ca -0.03 -0.78 0.04 0.00 -2.00 0.00 0.00 55.36 52.59 2b39 s GLN 648 Cb 0.09 -1.04 -0.05 0.00 0.80 0.00 0.00 33.01 32.82 2b39 s GLN 648 CO 0.84 -1.12 0.02 0.20 -0.50 0.00 0.00 175.29 174.74 2b39 s GLY 649 N 1.69 2.67 0.33 2.59 0.00 -1.26 -4.96 107.32 108.38 2b39 s GLY 649 Ca 0.13 -1.43 -0.26 0.00 0.00 0.00 0.00 44.72 43.17 2b39 s GLY 649 CO -0.18 -2.08 0.73 1.47 0.00 0.00 0.00 173.10 173.04 2b39 n LEU 650 N -1.05 0.54 -4.59 0.66 -0.00 -1.26 -4.81 117.00 106.50 2b39 n LEU 650 Ca -0.10 1.05 -0.43 0.00 -0.00 0.00 0.00 56.01 56.53 2b39 n LEU 650 Cb 0.67 -1.16 -0.02 0.00 -0.00 0.00 0.00 43.42 42.90 2b39 n LEU 650 CO 0.43 -2.30 1.36 -1.61 -0.00 0.00 0.00 177.39 175.28 2b39 s GLU 651 N -1.49 3.41 -1.03 1.47 0.41 -1.26 -4.57 118.70 115.63 2b39 s GLU 651 Ca 0.62 1.04 -0.11 0.00 -0.41 0.00 0.00 54.97 56.11 2b39 s GLU 651 Cb -0.70 -4.12 0.26 0.00 -1.78 0.00 0.00 34.13 27.80 2b39 s GLU 651 CO 0.58 -1.77 1.02 0.95 -0.49 0.00 0.00 175.26 175.55 2b39 s THR 652 N 6.21 5.88 0.63 3.63 -4.23 -1.26 -4.79 115.64 121.70 2b39 s THR 652 Ca 0.67 -3.14 0.33 0.00 -1.18 0.00 0.00 61.69 58.38 2b39 s THR 652 Cb -0.16 -4.57 0.37 0.00 1.34 0.00 0.00 72.50 69.47 2b39 s THR 652 CO 0.32 -1.15 2.14 1.56 -0.54 0.00 0.00 174.62 176.95 2b39 h GLN 653 N 7.00 0.00 -3.85 3.99 7.50 -1.94 -3.45 115.11 124.36 2b39 h GLN 653 Ca 0.16 0.00 -0.17 0.00 0.50 0.00 0.00 58.65 59.14 2b39 h GLN 653 Cb 0.92 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.44 2b39 h GLN 653 CO 0.94 0.00 -0.21 0.00 -1.50 0.00 0.00 178.83 178.06 2b39 n GLN 654 N -3.41 -2.30 -1.64 1.46 10.64 -1.26 -4.84 117.38 116.04 2b39 n GLN 654 Ca -0.01 0.43 -0.43 0.00 -1.83 0.00 0.00 57.00 55.16 2b39 n GLN 654 Cb 0.26 -4.94 -0.03 0.00 -0.86 0.00 0.00 30.24 24.67 2b39 n GLN 654 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 2b39 n ARG 655 N -2.56 2.50 0.00 2.61 5.12 -1.26 -4.82 116.66 118.25 2b39 n ARG 655 Ca -0.10 0.86 0.10 0.00 -1.93 0.00 0.00 57.85 56.78 2b39 n ARG 655 Cb 0.54 -3.03 0.57 0.00 -1.16 0.00 0.00 32.46 29.37 2b39 n ARG 655 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2b39 n ALA 656 N 8.74 2.20 -1.29 7.54 0.00 -1.26 -4.81 120.51 131.62 2b39 n ALA 656 Ca 0.24 -0.12 -0.24 0.00 0.00 0.00 0.00 53.44 53.32 2b39 n ALA 656 Cb 0.40 -1.32 -0.17 0.00 0.00 0.00 0.00 19.45 18.36 2b39 n ALA 656 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2b39 n ASP 657 N -1.04 -0.77 -0.13 0.00 -0.08 -1.26 -4.71 116.55 108.56 2b39 n ASP 657 Ca 0.14 -0.26 0.04 0.00 -1.51 0.00 0.00 54.79 53.19 2b39 n ASP 657 Cb 0.08 -0.57 0.08 0.00 2.34 0.00 0.00 41.12 43.05 2b39 n ASP 657 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 2b39 n PRO 658 N 5.58 -0.03 0.00 -0.67 -0.02 -1.26 -4.33 135.00 134.26 2b39 n PRO 658 Ca 0.58 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.63 2b39 n PRO 658 Cb 0.09 -0.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.69 2b39 n PRO 658 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b39 n GLN 659 N -4.50 0.00 -4.13 -0.52 0.00 -1.26 -4.99 117.38 101.98 2b39 n GLN 659 Ca 0.07 0.00 -0.15 0.00 0.00 0.00 0.00 57.00 56.92 2b39 n GLN 659 Cb 0.23 0.00 -0.05 0.00 0.00 0.00 0.00 30.24 30.42 2b39 n GLN 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2b39 n PRO 661 N -0.54 1.44 -1.20 0.00 -0.02 -1.26 -5.18 135.00 128.24 2b39 n PRO 661 Ca 0.02 0.54 0.15 0.00 -2.02 0.00 0.00 63.50 62.19 2b39 n PRO 661 Cb 0.62 -2.51 -0.05 0.00 -0.02 0.00 0.00 33.50 31.54 2b39 n PRO 661 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2b39 n GLN 662 N -1.25 -2.41 -2.57 -0.52 3.00 -1.26 -5.19 117.38 107.18 2b39 n GLN 662 Ca 0.12 1.67 -0.23 0.00 -0.01 0.00 0.00 57.00 58.56 2b39 n GLN 662 Cb 0.46 -2.95 0.07 0.00 0.00 0.00 0.00 30.24 27.82 2b39 n GLN 662 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2b39 s SER 670 N -6.09 4.77 0.36 1.08 0.15 -1.26 -5.14 113.70 107.57 2b39 s SER 670 Ca 0.00 -0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.51 2b39 s SER 670 Cb 0.00 -0.47 0.00 0.00 -1.71 0.00 0.00 66.02 63.84 2b39 s SER 670 CO 0.00 -1.54 0.00 0.52 1.20 0.00 0.00 173.24 173.42 2b39 n VAL 671 N -2.64 0.00 0.13 4.45 0.31 -1.26 -3.80 118.33 115.52 2b39 n VAL 671 Ca 0.11 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.52 2b39 n VAL 671 Cb 0.60 0.00 0.40 0.00 -0.91 0.00 0.00 33.84 33.93 2b39 n VAL 671 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2b39 n GLN 672 N 0.00 0.10 0.11 5.55 0.00 -1.26 -3.01 117.38 118.87 2b39 n GLN 672 Ca 0.00 0.57 -0.06 0.00 0.00 0.00 0.00 57.00 57.52 2b39 n GLN 672 Cb 0.00 -1.90 -0.03 0.00 0.00 0.00 0.00 30.24 28.31 2b39 n GLN 672 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.06 178.43 2b39 h LEU 673 N 0.00 -0.31 -1.79 2.61 8.10 -2.02 -3.23 115.31 118.67 2b39 h LEU 673 Ca 0.00 -0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.99 2b39 h LEU 673 Cb 0.18 0.08 -0.00 0.00 -0.44 0.00 0.00 40.66 40.48 2b39 h LEU 673 CO 0.00 0.15 0.40 0.24 -4.11 0.00 0.00 178.44 175.12 2b39 h MET 674 N -1.09 0.00 0.00 0.17 2.86 -1.87 -1.71 114.93 113.29 2b39 h MET 674 Ca -0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 2b39 h MET 674 Cb 0.30 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.96 2b39 h MET 674 CO 0.06 0.00 0.00 -1.91 1.06 0.00 0.00 176.91 176.12 2b39 n GLU 675 N -2.85 0.00 0.31 1.72 4.07 -1.22 -2.34 120.64 120.32 2b39 n GLU 675 Ca -0.02 0.20 0.19 0.00 -0.06 0.00 0.00 57.16 57.47 2b39 n GLU 675 Cb 0.45 -1.15 1.02 0.00 -0.06 0.00 0.00 31.44 31.70 2b39 n GLU 675 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 2b39 h LYS 676 N 0.00 0.00 0.00 5.31 1.57 -1.44 0.34 116.57 122.35 2b39 h LYS 676 Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 2b39 h LYS 676 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2b39 h LYS 676 CO 0.00 0.00 -0.22 -0.09 -0.57 0.00 0.00 179.45 178.57 2b39 h ARG 677 N 0.00 0.00 0.00 3.15 1.12 -1.26 -0.57 114.38 116.82 2b39 h ARG 677 Ca 0.00 0.00 -0.12 0.00 -1.11 0.00 0.00 59.98 58.75 2b39 h ARG 677 Cb 0.15 0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 30.09 2b39 h ARG 677 CO 0.00 0.22 -2.03 -1.33 -3.11 0.00 0.00 179.97 173.72 2b39 n MET 678 N -3.40 0.74 0.06 0.20 2.81 0.07 -3.06 117.12 114.53 2b39 n MET 678 Ca 0.00 -0.12 -0.14 0.00 -1.81 0.00 0.00 57.70 55.62 2b39 n MET 678 Cb 0.42 -1.47 -0.05 0.00 -0.71 0.00 0.00 33.22 31.41 2b39 n MET 678 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 2b39 h ASP 679 N 0.00 0.62 -0.00 7.83 3.32 -1.34 -0.50 116.42 126.35 2b39 h ASP 679 Ca -0.17 -0.48 -0.17 0.00 0.02 0.00 0.00 57.03 56.23 2b39 h ASP 679 Cb 1.33 -0.19 0.01 0.00 0.22 0.00 0.00 39.33 40.70 2b39 h ASP 679 CO 0.01 1.28 -0.66 0.50 -1.72 0.00 0.00 179.24 178.64 2b39 h LYS 680 N 0.28 0.45 -0.11 3.56 1.63 -1.27 -3.00 116.57 118.11 2b39 h LYS 680 Ca -0.08 -0.48 -0.03 0.00 -0.85 0.00 0.00 60.65 59.21 2b39 h LYS 680 Cb 1.56 0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 33.32 2b39 h LYS 680 CO 0.17 1.14 -0.05 0.00 -3.45 0.00 0.00 179.45 177.25 2b39 h ALA 681 N 0.33 1.71 -1.00 5.00 0.00 -1.58 -2.49 119.26 121.23 2b39 h ALA 681 Ca -0.08 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.78 2b39 h ALA 681 Cb 1.37 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 19.03 2b39 h ALA 681 CO 0.13 0.22 0.64 0.78 0.00 0.00 0.00 179.25 181.03 2b39 h GLY 682 N 0.48 1.53 0.96 0.00 0.00 -0.94 -2.50 103.07 102.60 2b39 h GLY 682 Ca 0.04 -0.47 0.07 0.00 0.00 0.00 0.00 47.33 46.97 2b39 h GLY 682 CO 0.01 0.33 0.45 1.46 0.00 0.00 0.00 176.54 178.78 2b39 h GLN 683 N 1.16 0.00 -5.99 4.80 4.20 -1.46 -3.41 115.11 114.41 2b39 h GLN 683 Ca 0.43 0.00 -0.63 0.00 0.06 0.00 0.00 58.65 58.52 2b39 h GLN 683 Cb 0.18 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.91 2b39 h GLN 683 CO -0.18 0.00 -0.53 0.71 -0.67 0.00 0.00 178.83 178.16 2b39 s TYR 684 N -4.38 3.41 0.30 2.96 2.02 -0.94 -5.11 117.35 115.61 2b39 s TYR 684 Ca -0.04 0.20 0.08 0.00 -0.37 0.00 0.00 57.07 56.95 2b39 s TYR 684 Cb 0.12 -1.72 -0.06 0.00 -0.40 0.00 0.00 41.96 39.90 2b39 s TYR 684 CO 0.41 0.57 -0.09 -1.54 -1.57 0.00 0.00 175.55 173.34 2b39 s SER 685 N -2.41 3.24 0.55 2.29 1.04 -1.26 -4.63 113.70 112.52 2b39 s SER 685 Ca 0.32 -1.18 0.00 0.00 0.48 0.00 0.00 55.95 55.58 2b39 s SER 685 Cb -0.13 -0.26 0.00 0.00 0.10 0.00 0.00 66.02 65.74 2b39 s SER 685 CO 0.25 -0.25 0.00 -1.54 0.98 0.00 0.00 173.24 172.68 2b39 n SER 686 N -0.67 0.00 0.28 7.02 3.41 -1.26 -2.38 113.62 120.02 2b39 n SER 686 Ca -0.05 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.70 2b39 n SER 686 Cb 0.63 0.00 0.84 0.00 -0.26 0.00 0.00 64.21 65.42 2b39 n SER 686 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2b39 h ASP 687 N 5.24 0.00 0.50 4.04 5.19 -2.02 -1.43 116.42 127.94 2b39 h ASP 687 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2b39 h ASP 687 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 2b39 h ASP 687 CO 0.00 0.05 0.00 0.18 -3.12 0.00 0.00 179.24 176.35 2b39 n LEU 688 N -3.72 0.00 0.09 1.55 4.77 -1.00 -2.07 117.00 116.63 2b39 n LEU 688 Ca -0.02 0.41 0.03 0.00 -0.03 0.00 0.00 56.01 56.40 2b39 n LEU 688 Cb 0.15 -0.41 -0.02 0.00 -2.33 0.00 0.00 43.42 40.81 2b39 n LEU 688 CO 0.28 -0.16 0.10 -0.09 -1.33 0.00 0.00 177.39 176.19 2b39 h ARG 689 N 0.00 0.00 -0.02 3.23 2.43 -1.14 -3.05 114.38 115.83 2b39 h ARG 689 Ca 0.00 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 58.98 2b39 h ARG 689 Cb 0.25 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 2b39 h ARG 689 CO 0.00 0.31 -0.81 0.87 -1.51 0.00 0.00 179.97 178.84 2b39 h LYS 690 N 0.00 0.22 0.68 0.20 1.57 -1.54 -1.61 116.57 116.10 2b39 h LYS 690 Ca -0.07 -0.21 -0.03 0.00 -1.87 0.00 0.00 60.65 58.46 2b39 h LYS 690 Cb 1.40 0.06 0.01 0.00 0.08 0.00 0.00 32.23 33.77 2b39 h LYS 690 CO 0.04 0.91 -0.33 0.00 -0.57 0.00 0.00 179.45 179.51 2b39 h GLU 693 N 0.26 -0.37 0.00 0.00 5.08 -1.29 -1.67 114.58 116.59 2b39 h GLU 693 Ca 0.17 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 2b39 h GLU 693 Cb 0.17 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2b39 h GLU 693 CO -0.19 -0.25 0.10 -0.44 -1.00 0.00 0.00 179.01 177.23 2b39 h ASP 694 N -0.38 0.00 0.51 1.42 3.32 -1.09 0.33 116.42 120.52 2b39 h ASP 694 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2b39 h ASP 694 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 2b39 h ASP 694 CO -0.14 0.00 -0.28 0.61 -1.72 0.00 0.00 179.24 177.70 2b39 n GLY 695 N -1.23 -1.11 1.10 2.75 0.00 -0.63 -3.46 105.19 102.61 2b39 n GLY 695 Ca -0.02 -0.30 0.09 0.00 0.00 0.00 0.00 46.02 45.80 2b39 n GLY 695 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2b39 n MET 696 N -1.22 2.81 -2.57 1.61 2.81 0.11 -3.83 117.12 116.84 2b39 n MET 696 Ca 0.09 -2.45 -0.23 0.00 -1.81 0.00 0.00 57.70 53.30 2b39 n MET 696 Cb 0.33 -1.47 0.04 0.00 -0.71 0.00 0.00 33.22 31.40 2b39 n MET 696 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2b39 s ARG 697 N -1.03 2.56 0.54 0.03 0.52 -1.22 -5.06 118.95 115.28 2b39 s ARG 697 Ca 0.40 -0.57 -0.09 0.00 -0.52 0.00 0.00 55.73 54.95 2b39 s ARG 697 Cb 0.21 -2.41 -0.04 0.00 0.52 0.00 0.00 34.95 33.23 2b39 s ARG 697 CO 0.27 -0.77 0.91 0.34 0.02 0.00 0.00 175.30 176.06 2b39 s ASP 698 N -4.41 6.28 -0.22 0.23 -1.08 -1.26 -5.07 116.67 111.13 2b39 s ASP 698 Ca 0.57 1.20 -0.02 0.00 -0.52 0.00 0.00 52.55 53.78 2b39 s ASP 698 Cb -0.10 -2.37 0.07 0.00 -1.46 0.00 0.00 42.92 39.06 2b39 s ASP 698 CO 0.40 -0.70 0.04 0.21 0.52 0.00 0.00 175.17 175.64 2b39 s ASN 699 N -4.03 3.26 0.18 -0.34 3.84 -1.26 -5.04 114.94 111.56 2b39 s ASN 699 Ca 0.52 -1.03 0.04 0.00 0.21 0.00 0.00 52.86 52.60 2b39 s ASN 699 Cb -0.11 -0.72 0.51 0.00 -0.55 0.00 0.00 41.25 40.38 2b39 s ASN 699 CO 0.48 -0.32 0.84 -2.65 -2.79 0.00 0.00 177.10 172.66 2b39 n PRO 700 N 4.96 -0.04 0.01 0.43 -0.02 -1.26 0.27 135.00 139.35 2b39 n PRO 700 Ca -0.08 0.78 0.12 0.00 -2.02 0.00 0.00 63.50 62.30 2b39 n PRO 700 Cb 0.46 -1.29 0.30 0.00 -0.02 0.00 0.00 33.50 32.95 2b39 n PRO 700 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b39 n MET 701 N -4.50 0.05 -3.22 -0.52 0.00 -1.26 -4.88 117.12 102.78 2b39 n MET 701 Ca 0.15 0.02 -0.15 0.00 0.00 0.00 0.00 57.70 57.72 2b39 n MET 701 Cb 0.50 -1.53 0.07 0.00 0.00 0.00 0.00 33.22 32.26 2b39 n MET 701 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 2b39 n LYS 702 N -1.61 -3.85 -2.67 3.17 4.01 0.75 -4.97 118.16 112.99 2b39 n LYS 702 Ca 0.05 0.81 -0.42 0.00 -0.51 0.00 0.00 58.31 58.24 2b39 n LYS 702 Cb 0.35 -5.60 -0.03 0.00 -0.51 0.00 0.00 35.03 29.24 2b39 n LYS 702 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 2b39 s PHE 703 N -3.35 3.68 0.45 2.13 0.08 -1.26 -4.99 117.98 114.71 2b39 s PHE 703 Ca 0.25 1.68 -0.23 0.00 0.12 0.00 0.00 56.93 58.75 2b39 s PHE 703 Cb -0.03 -3.14 -0.10 0.00 -0.57 0.00 0.00 43.02 39.18 2b39 s PHE 703 CO 0.69 -0.11 1.01 -0.35 -0.10 0.00 0.00 175.22 176.36 2b39 n PRO 704 N 3.48 1.31 -0.46 0.24 -0.04 -1.26 -4.57 135.00 133.70 2b39 n PRO 704 Ca 0.05 0.48 0.41 0.00 -0.04 0.00 0.00 63.50 64.39 2b39 n PRO 704 Cb 0.50 -2.07 0.75 0.00 -0.04 0.00 0.00 33.50 32.63 2b39 n PRO 704 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b39 h GLN 706 N 0.04 0.47 -0.27 0.00 4.20 -1.98 -2.73 115.11 114.83 2b39 h GLN 706 Ca 0.72 -0.39 -0.13 0.00 0.06 0.00 0.00 58.65 58.91 2b39 h GLN 706 Cb 2.74 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 30.60 2b39 h GLN 706 CO -0.08 1.03 -0.33 -0.09 -0.67 0.00 0.00 178.83 178.69 2b39 h ARG 707 N 0.32 0.71 -0.98 1.46 9.65 -0.33 -3.15 114.38 122.06 2b39 h ARG 707 Ca -0.04 -0.40 0.01 0.00 -1.10 0.00 0.00 59.98 58.45 2b39 h ARG 707 Cb 1.35 0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 29.90 2b39 h ARG 707 CO 0.13 1.01 0.63 0.00 2.80 0.00 0.00 179.97 184.55 2b39 h ARG 708 N 0.44 1.30 0.00 0.20 3.08 -1.41 -1.58 114.38 116.41 2b39 h ARG 708 Ca 0.04 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.00 2b39 h ARG 708 Cb 0.91 -0.29 0.00 0.00 0.08 0.00 0.00 29.97 30.67 2b39 h ARG 708 CO 0.08 0.87 0.00 0.00 -1.07 0.00 0.00 179.97 179.85 2b39 n ALA 709 N -2.38 1.11 0.09 0.04 0.00 -1.03 -1.48 120.51 116.86 2b39 n ALA 709 Ca 0.11 0.19 -0.03 0.00 0.00 0.00 0.00 53.44 53.71 2b39 n ALA 709 Cb 0.02 -1.32 0.19 0.00 0.00 0.00 0.00 19.45 18.34 2b39 n ALA 709 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2b39 h GLN 710 N 0.00 0.22 -0.13 0.00 4.20 -1.34 -2.42 115.11 115.64 2b39 h GLN 710 Ca 0.00 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.59 2b39 h GLN 710 Cb 0.04 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.83 2b39 h GLN 710 CO 0.00 0.67 0.00 1.19 -0.67 0.00 0.00 178.83 180.02 2b39 n PHE 711 N -3.96 0.18 -2.76 2.96 3.01 -0.55 -4.81 117.46 111.53 2b39 n PHE 711 Ca -0.02 -0.09 -0.42 0.00 1.01 0.00 0.00 57.45 57.93 2b39 n PHE 711 Cb 0.54 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.97 2b39 n PHE 711 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2b39 s ILE 712 N -1.82 4.84 -0.98 4.37 1.01 -0.91 -3.60 121.20 124.10 2b39 s ILE 712 Ca 0.20 1.91 0.11 0.00 0.00 0.00 0.00 60.65 62.87 2b39 s ILE 712 Cb 0.10 -4.25 0.29 0.00 0.01 0.00 0.00 42.46 38.61 2b39 s ILE 712 CO 0.15 0.05 1.22 -0.11 0.00 0.00 0.00 174.94 176.25 2b39 n LEU 713 N 4.84 2.85 -0.35 2.97 7.94 -1.25 -4.61 117.00 129.39 2b39 n LEU 713 Ca 0.07 -1.91 0.14 0.00 -1.11 0.00 0.00 56.01 53.19 2b39 n LEU 713 Cb 0.49 -0.21 0.49 0.00 0.53 0.00 0.00 43.42 44.72 2b39 n LEU 713 CO 0.51 0.70 0.80 0.00 -1.11 0.00 0.00 177.39 178.28 2b39 n GLN 714 N 0.54 1.26 0.00 1.96 3.00 -1.26 -5.06 117.38 117.81 2b39 n GLN 714 Ca 0.11 -0.70 0.00 0.00 -0.01 0.00 0.00 57.00 56.40 2b39 n GLN 714 Cb 0.42 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 29.17 2b39 n GLN 714 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2b39 n GLY 715 N 1.24 0.76 0.20 1.08 0.00 -1.26 -4.59 105.19 102.62 2b39 n GLY 715 Ca 0.16 -1.72 -0.05 0.00 0.00 0.00 0.00 46.02 44.41 2b39 n GLY 715 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2b39 n ASP 716 N -0.55 -0.50 -0.18 1.61 8.00 -1.26 -1.15 116.55 122.51 2b39 n ASP 716 Ca 0.00 0.86 -0.06 0.00 0.71 0.00 0.00 54.79 56.30 2b39 n ASP 716 Cb 0.00 -0.12 0.00 0.00 -0.02 0.00 0.00 41.12 40.99 2b39 n ASP 716 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2b39 h ALA 717 N 0.26 -0.07 0.00 2.24 0.00 -2.00 0.71 119.26 120.39 2b39 h ALA 717 Ca 0.08 0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 2b39 h ALA 717 Cb 0.20 0.76 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2b39 h ALA 717 CO -0.46 -0.69 -0.19 0.00 0.00 0.00 0.00 179.25 177.92 2b39 h VAL 719 N 0.00 1.45 -0.68 0.00 2.07 -0.63 -2.82 116.25 115.65 2b39 h VAL 719 Ca -0.00 -2.17 0.06 0.00 0.82 0.00 0.00 66.70 65.40 2b39 h VAL 719 Cb 0.42 2.73 -0.06 0.00 -1.52 0.00 0.00 31.29 32.87 2b39 h VAL 719 CO 0.02 0.63 0.38 0.11 0.02 0.00 0.00 177.57 178.73 2b39 h LYS 720 N -0.17 0.68 0.40 1.57 1.79 -0.79 0.17 116.57 120.21 2b39 h LYS 720 Ca -0.09 -0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.32 2b39 h LYS 720 Cb 1.38 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 2b39 h LYS 720 CO 0.12 0.45 -0.19 0.00 -1.08 0.00 0.00 179.45 178.75 2b39 h ALA 721 N 1.35 -0.53 -0.82 3.86 0.00 -1.60 -0.57 119.26 120.94 2b39 h ALA 721 Ca 0.30 -0.17 0.17 0.00 0.00 0.00 0.00 54.91 55.22 2b39 h ALA 721 Cb 0.19 0.21 -0.15 0.00 0.00 0.00 0.00 17.79 18.03 2b39 h ALA 721 CO -0.18 -0.70 -0.15 0.35 0.00 0.00 0.00 179.25 178.57 2b39 h PHE 722 N -0.73 -0.34 0.40 0.00 3.04 -1.12 0.23 116.94 118.42 2b39 h PHE 722 Ca -0.05 0.07 -0.02 0.00 3.98 0.00 0.00 57.97 61.95 2b39 h PHE 722 Cb 0.51 0.28 0.00 0.00 2.56 0.00 0.00 35.95 39.30 2b39 h PHE 722 CO -0.00 -0.34 -0.19 -0.07 -2.02 0.00 0.00 178.31 175.68 2b39 h LEU 723 N 0.02 -0.45 -0.23 0.59 -0.00 -0.52 -0.45 115.31 114.26 2b39 h LEU 723 Ca 0.41 0.00 0.03 0.00 -0.00 0.00 0.00 57.88 58.32 2b39 h LEU 723 Cb 0.67 0.12 -0.04 0.00 -0.00 0.00 0.00 40.66 41.41 2b39 h LEU 723 CO -0.82 -0.31 -0.28 -0.78 -0.00 0.00 0.00 178.44 176.26 2b39 h ASP 724 N -0.56 -0.94 0.02 -0.43 -0.00 0.10 0.27 116.42 114.89 2b39 h ASP 724 Ca -0.05 0.12 -0.02 0.00 -0.00 0.00 0.00 57.03 57.08 2b39 h ASP 724 Cb 0.42 0.39 -0.01 0.00 -0.00 0.00 0.00 39.33 40.14 2b39 h ASP 724 CO 0.09 -0.19 -0.05 0.00 -0.00 0.00 0.00 179.24 179.09 2b39 n GLU 727 N -5.05 0.10 0.00 0.00 0.28 0.83 -1.84 120.64 114.96 2b39 n GLU 727 Ca -0.09 0.46 0.00 0.00 -0.16 0.00 0.00 57.16 57.38 2b39 n GLU 727 Cb 0.26 -1.75 0.00 0.00 1.43 0.00 0.00 31.44 31.38 2b39 n GLU 727 CO 0.00 0.00 0.00 0.98 -0.16 0.00 0.00 177.13 177.95 2b39 n TYR 728 N -1.96 0.00 0.33 -1.84 9.36 -0.83 -2.87 117.16 119.34 2b39 n TYR 728 Ca 0.01 0.00 0.20 0.00 3.32 0.00 0.00 57.90 61.43 2b39 n TYR 728 Cb 0.12 -0.10 1.09 0.00 -0.63 0.00 0.00 39.34 39.82 2b39 n TYR 728 CO 0.00 0.00 0.00 -0.84 0.22 0.00 0.00 176.86 176.24 2b39 h ILE 729 N 0.00 0.00 0.58 2.97 -0.00 -1.56 0.26 117.51 119.77 2b39 h ILE 729 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 64.86 64.83 2b39 h ILE 729 Cb 0.00 0.88 0.01 0.00 -0.00 0.00 0.00 36.82 37.71 2b39 h ILE 729 CO 0.00 0.00 -0.28 0.74 -0.00 0.00 0.00 178.15 178.61 2b39 h THR 730 N 0.00 0.41 -0.09 0.16 2.02 -1.47 0.89 112.91 114.82 2b39 h THR 730 Ca 0.00 -0.12 -0.18 0.00 0.77 0.00 0.00 66.41 66.88 2b39 h THR 730 Cb 0.16 0.45 0.01 0.00 -1.74 0.00 0.00 68.15 67.04 2b39 h THR 730 CO 0.00 0.02 -0.65 0.06 0.37 0.00 0.00 175.52 175.32 2b39 h GLN 731 N -0.86 0.61 -0.08 6.66 3.07 -1.17 -2.73 115.11 120.61 2b39 h GLN 731 Ca -0.08 -0.53 0.02 0.00 0.09 0.00 0.00 58.65 58.16 2b39 h GLN 731 Cb 0.63 0.12 -0.00 0.00 0.08 0.00 0.00 27.48 28.30 2b39 h GLN 731 CO 0.13 1.15 0.12 1.25 0.09 0.00 0.00 178.83 181.56 2b39 h LEU 732 N 0.24 0.00 0.17 0.06 7.12 -0.52 -0.81 115.31 121.56 2b39 h LEU 732 Ca -0.05 0.00 -0.27 0.00 0.13 0.00 0.00 57.88 57.68 2b39 h LEU 732 Cb 1.30 0.00 0.02 0.00 -0.53 0.00 0.00 40.66 41.45 2b39 h LEU 732 CO 0.13 0.00 -1.29 -0.09 -0.13 0.00 0.00 178.44 177.07 2b39 h ARG 733 N 0.00 0.36 0.00 1.25 2.43 -0.67 -3.11 114.38 114.63 2b39 h ARG 733 Ca 0.04 -0.61 0.00 0.00 -0.81 0.00 0.00 59.98 58.59 2b39 h ARG 733 Cb 0.27 0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 2b39 h ARG 733 CO -0.00 1.29 0.00 1.04 -1.51 0.00 0.00 179.97 180.79 2b39 n GLN 734 N -3.89 0.29 -0.13 0.20 6.02 -0.35 -2.23 117.38 117.29 2b39 n GLN 734 Ca -0.19 0.01 -0.28 0.00 -0.01 0.00 0.00 57.00 56.53 2b39 n GLN 734 Cb 0.95 -1.50 -0.09 0.00 1.02 0.00 0.00 30.24 30.62 2b39 n GLN 734 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 2b39 n GLN 735 N -1.02 0.56 0.25 -1.09 7.27 -0.97 -3.32 117.38 119.07 2b39 n GLN 735 Ca 0.07 0.25 0.17 0.00 0.07 0.00 0.00 57.00 57.56 2b39 n GLN 735 Cb 0.04 -1.44 0.86 0.00 2.41 0.00 0.00 30.24 32.11 2b39 n GLN 735 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2b39 h HIS 736 N -0.95 0.00 0.00 3.69 3.86 -1.38 -2.06 115.15 118.31 2b39 h HIS 736 Ca -0.66 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 58.35 2b39 h HIS 736 Cb 1.58 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 30.01 2b39 h HIS 736 CO -0.09 0.00 -2.04 -1.13 0.86 0.00 0.00 177.93 175.53 2b39 n SER 737 N -2.75 0.18 -0.80 2.45 3.41 -0.95 -2.82 113.62 112.35 2b39 n SER 737 Ca -0.01 0.08 0.04 0.00 -0.26 0.00 0.00 58.87 58.71 2b39 n SER 737 Cb 0.12 1.18 0.14 0.00 -0.26 0.00 0.00 64.21 65.39 2b39 n SER 737 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2b39 n ARG 738 N -2.60 2.11 -0.48 4.33 1.85 -0.80 -2.55 116.66 118.51 2b39 n ARG 738 Ca -0.18 -1.13 0.00 0.00 -1.00 0.00 0.00 57.85 55.55 2b39 n ARG 738 Cb 0.88 -1.53 0.00 0.00 -1.05 0.00 0.00 32.46 30.76 2b39 n ARG 738 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2b39 n ASP 739 N 0.29 0.00 -2.71 2.89 8.00 -1.03 -4.92 116.55 119.07 2b39 n ASP 739 Ca 0.10 -1.58 -0.35 0.00 0.71 0.00 0.00 54.79 53.66 2b39 n ASP 739 Cb 0.44 -0.12 0.03 0.00 -0.02 0.00 0.00 41.12 41.46 2b39 n ASP 739 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b39 n GLY 740 N 0.00 5.72 0.00 0.44 0.00 -1.06 -4.07 105.19 106.22 2b39 n GLY 740 Ca 0.00 -2.55 0.00 0.00 0.00 0.00 0.00 46.02 43.47 2b39 n GLY 740 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b39 n ALA 741 N -0.57 0.25 0.00 4.61 0.00 -1.26 -5.00 120.51 118.53 2b39 n ALA 741 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.95 2b39 n ALA 741 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 2b39 n ALA 741 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2b39 n LEU 742 N -0.45 0.00 -0.83 0.00 4.77 -1.26 -5.25 117.00 113.99 2b39 n LEU 742 Ca 0.00 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.00 2b39 n LEU 742 Cb 0.00 0.00 0.18 0.00 -2.33 0.00 0.00 43.42 41.27 2b39 n LEU 742 CO 0.00 0.00 0.32 0.47 -1.33 0.00 0.00 177.39 176.85 2b39 n ASP 750 N 0.00 2.05 -2.66 -1.43 8.00 -1.26 -5.19 116.55 116.06 2b39 n ASP 750 Ca 0.00 -3.78 -0.09 0.00 0.71 0.00 0.00 54.79 51.63 2b39 n ASP 750 Cb 0.00 -0.50 -0.02 0.00 -0.02 0.00 0.00 41.12 40.58 2b39 n ASP 750 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2b39 n ASP 751 N -0.99 -0.05 -1.19 -2.24 5.68 -1.26 -4.65 116.55 111.86 2b39 n ASP 751 Ca 0.21 -0.31 0.00 0.00 -0.50 0.00 0.00 54.79 54.19 2b39 n ASP 751 Cb 0.75 -0.39 0.00 0.00 -1.14 0.00 0.00 41.12 40.34 2b39 n ASP 751 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2b39 n ASP 752 N -0.28 1.14 -4.56 -1.12 9.92 -1.26 -4.62 116.55 115.77 2b39 n ASP 752 Ca -0.04 -0.83 -0.43 0.00 -0.53 0.00 0.00 54.79 52.96 2b39 n ASP 752 Cb 0.15 -0.21 -0.00 0.00 -0.64 0.00 0.00 41.12 40.42 2b39 n ASP 752 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 2b39 s ILE 753 N 0.83 4.27 -0.35 0.53 1.10 -1.26 -4.65 121.20 121.68 2b39 s ILE 753 Ca 0.00 -1.99 0.15 0.00 -0.51 0.00 0.00 60.65 58.29 2b39 s ILE 753 Cb 0.00 -5.14 0.41 0.00 0.15 0.00 0.00 42.46 37.88 2b39 s ILE 753 CO 0.00 -1.96 0.90 -0.38 -2.11 0.00 0.00 174.94 171.39 2b39 n ILE 754 N 6.11 0.47 0.96 2.00 5.41 -1.26 -4.90 119.36 128.15 2b39 n ILE 754 Ca 0.46 -3.47 0.05 0.00 1.00 0.00 0.00 62.75 60.79 2b39 n ILE 754 Cb 0.46 0.38 0.14 0.00 -0.71 0.00 0.00 39.64 39.91 2b39 n ILE 754 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2b39 n PRO 755 N 0.05 1.76 -3.08 0.38 -0.04 -1.26 -4.92 135.00 127.89 2b39 n PRO 755 Ca 0.14 -1.15 -0.21 0.00 -0.04 0.00 0.00 63.50 62.25 2b39 n PRO 755 Cb 0.76 -1.26 -0.04 0.00 -0.04 0.00 0.00 33.50 32.91 2b39 n PRO 755 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2b39 n GLU 756 N 0.43 -0.87 -0.11 0.54 0.28 -1.26 -2.40 120.64 117.24 2b39 n GLU 756 Ca 0.11 0.07 0.00 0.00 -0.16 0.00 0.00 57.16 57.17 2b39 n GLU 756 Cb 0.28 -2.27 0.00 0.00 1.43 0.00 0.00 31.44 30.88 2b39 n GLU 756 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2b39 n GLU 757 N -2.36 -0.42 0.01 3.44 4.71 -1.26 -4.37 120.64 120.39 2b39 n GLU 757 Ca 0.02 0.02 0.00 0.00 -0.01 0.00 0.00 57.16 57.19 2b39 n GLU 757 Cb 0.24 -1.92 0.00 0.00 -1.01 0.00 0.00 31.44 28.75 2b39 n GLU 757 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2b39 n ASP 758 N 0.48 0.14 -2.36 1.62 8.00 -1.01 -5.12 116.55 118.30 2b39 n ASP 758 Ca 0.00 0.03 -0.01 0.00 0.71 0.00 0.00 54.79 55.52 2b39 n ASP 758 Cb 0.02 -0.04 -0.01 0.00 -0.02 0.00 0.00 41.12 41.07 2b39 n ASP 758 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2b39 n ILE 759 N -3.03 -9.51 -2.60 0.53 2.08 -1.22 -4.95 119.36 100.66 2b39 n ILE 759 Ca 0.00 1.49 -0.42 0.00 0.56 0.00 0.00 62.75 64.38 2b39 n ILE 759 Cb 0.39 -6.06 -0.03 0.00 -0.75 0.00 0.00 39.64 33.19 2b39 n ILE 759 CO 0.00 0.00 0.00 -0.51 0.56 0.00 0.00 176.55 176.60 2b39 s ILE 760 N -1.05 4.52 0.15 1.39 1.10 -1.26 -4.98 121.20 121.07 2b39 s ILE 760 Ca -0.04 1.83 0.08 0.00 -0.51 0.00 0.00 60.65 62.00 2b39 s ILE 760 Cb 0.00 -4.17 -0.04 0.00 0.15 0.00 0.00 42.46 38.40 2b39 s ILE 760 CO 0.57 0.15 -0.08 -0.94 -2.11 0.00 0.00 174.94 172.54 2b39 s SER 761 N 0.95 4.41 0.00 4.50 1.04 -1.26 -4.90 113.70 118.43 2b39 s SER 761 Ca 0.54 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.50 2b39 s SER 761 Cb -0.24 -0.82 0.00 0.00 0.10 0.00 0.00 66.02 65.05 2b39 s SER 761 CO 0.29 0.13 0.00 -1.14 0.98 0.00 0.00 173.24 173.50 2b39 n ARG 762 N 0.25 0.00 -0.02 4.02 3.00 -1.26 -4.87 116.66 117.78 2b39 n ARG 762 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.73 2b39 n ARG 762 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.00 2b39 n ARG 762 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2b39 n SER 763 N 0.00 0.00 -4.09 6.15 3.41 -1.26 -4.97 113.62 112.86 2b39 n SER 763 Ca 0.00 -1.03 -0.34 0.00 -0.26 0.00 0.00 58.87 57.24 2b39 n SER 763 Cb 0.00 -0.01 -0.13 0.00 -0.26 0.00 0.00 64.21 63.81 2b39 n SER 763 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2b39 s GLN 764 N 0.00 1.91 0.10 4.33 2.00 -1.26 -4.46 119.66 122.29 2b39 s GLN 764 Ca 0.00 -1.73 0.09 0.00 -2.00 0.00 0.00 55.36 51.72 2b39 s GLN 764 Cb 0.00 -3.36 -0.04 0.00 0.80 0.00 0.00 33.01 30.42 2b39 s GLN 764 CO 0.00 -0.93 -0.22 -0.06 -0.50 0.00 0.00 175.29 173.58 2b39 s PHE 765 N 1.08 1.90 0.50 1.67 0.40 -1.26 -5.05 117.98 117.22 2b39 s PHE 765 Ca 0.06 -0.41 -0.17 0.00 -0.60 0.00 0.00 56.93 55.81 2b39 s PHE 765 Cb -0.21 -1.05 -0.15 0.00 0.51 0.00 0.00 43.02 42.13 2b39 s PHE 765 CO -0.05 0.22 -0.13 -2.30 0.70 0.00 0.00 175.22 173.66 2b39 n PRO 766 N 1.11 0.00 -2.32 0.24 -0.02 -1.26 -4.83 135.00 127.92 2b39 n PRO 766 Ca -0.19 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 60.91 2b39 n PRO 766 Cb 0.53 -0.97 -0.02 0.00 -0.02 0.00 0.00 33.50 33.02 2b39 n PRO 766 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2b39 s GLU 767 N -1.00 3.98 0.19 -0.52 0.41 -1.26 -4.66 118.70 115.85 2b39 s GLU 767 Ca 0.55 1.77 -0.30 0.00 -0.41 0.00 0.00 54.97 56.58 2b39 s GLU 767 Cb -0.48 -2.57 -0.08 0.00 -1.78 0.00 0.00 34.13 29.22 2b39 s GLU 767 CO 0.64 -0.36 0.97 -1.12 -0.49 0.00 0.00 175.26 174.90 2b39 s SER 768 N -1.27 7.55 0.00 -0.19 0.01 -1.26 -4.88 113.70 113.66 2b39 s SER 768 Ca 0.59 1.92 0.00 0.00 1.31 0.00 0.00 55.95 59.77 2b39 s SER 768 Cb -0.29 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.34 2b39 s SER 768 CO 0.36 0.04 0.00 -2.67 0.41 0.00 0.00 173.24 171.38 2b39 n TRP 769 N 1.98 0.00 -2.74 2.43 4.27 -0.70 -4.88 117.44 117.80 2b39 n TRP 769 Ca -0.00 0.00 -0.21 0.00 -3.89 0.00 0.00 57.50 53.40 2b39 n TRP 769 Cb 0.48 0.00 0.01 0.00 -1.36 0.00 0.00 31.31 30.44 2b39 n TRP 769 CO 0.00 0.00 0.00 -0.11 -2.29 0.00 0.00 177.69 175.29 2b39 n LEU 770 N 0.00 -2.19 -4.46 5.67 7.94 -1.26 0.02 117.00 122.71 2b39 n LEU 770 Ca 0.00 -0.14 -0.43 0.00 -1.11 0.00 0.00 56.01 54.33 2b39 n LEU 770 Cb 0.00 -2.85 -0.04 0.00 0.53 0.00 0.00 43.42 41.06 2b39 n LEU 770 CO 0.00 0.01 0.84 0.86 -1.11 0.00 0.00 177.39 178.00 2b39 s TRP 771 N -3.07 2.71 -0.00 1.96 -0.11 -1.25 -3.41 118.94 115.76 2b39 s TRP 771 Ca 0.16 -0.65 -0.19 0.00 1.22 0.00 0.00 56.10 56.64 2b39 s TRP 771 Cb -0.07 -4.33 0.04 0.00 -1.50 0.00 0.00 33.47 27.60 2b39 s TRP 771 CO 0.20 -1.67 0.41 -0.08 -4.62 0.00 0.00 176.95 171.19 2b39 s THR 772 N 4.01 0.05 -0.19 5.86 -1.32 -1.14 -5.02 115.64 117.89 2b39 s THR 772 Ca 0.25 -0.39 -0.09 0.00 -1.21 0.00 0.00 61.69 60.26 2b39 s THR 772 Cb -0.14 -0.79 -0.05 0.00 -1.51 0.00 0.00 72.50 70.02 2b39 s THR 772 CO 0.07 -0.21 0.10 0.54 -2.21 0.00 0.00 174.62 172.91 2b39 s VAL 773 N -1.65 5.15 -0.12 5.08 0.11 -1.26 -1.80 120.40 125.92 2b39 s VAL 773 Ca -0.11 0.10 -0.19 0.00 -2.93 0.00 0.00 61.98 58.85 2b39 s VAL 773 Cb -0.03 -3.33 -0.04 0.00 -1.53 0.00 0.00 36.38 31.45 2b39 s VAL 773 CO 0.03 0.46 0.53 -0.63 -3.33 0.00 0.00 175.10 172.16 2b39 s ILE 774 N 0.27 5.15 0.00 7.04 1.01 -1.00 -4.94 121.20 128.73 2b39 s ILE 774 Ca 0.06 1.05 0.00 0.00 0.00 0.00 0.00 60.65 61.76 2b39 s ILE 774 Cb -0.12 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.49 2b39 s ILE 774 CO -0.01 0.29 0.00 -0.62 0.00 0.00 0.00 174.94 174.60 2b39 n GLU 775 N 3.85 0.00 -2.90 2.79 -0.58 -1.26 -3.23 120.64 119.31 2b39 n GLU 775 Ca -0.06 0.10 -0.42 0.00 -0.42 0.00 0.00 57.16 56.37 2b39 n GLU 775 Cb 0.51 -0.50 -0.04 0.00 -0.57 0.00 0.00 31.44 30.84 2b39 n GLU 775 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2b39 s ASP 776 N -3.03 6.86 -0.46 1.62 1.01 -1.26 -4.79 116.67 116.62 2b39 s ASP 776 Ca 0.00 1.07 0.03 0.00 0.71 0.00 0.00 52.55 54.35 2b39 s ASP 776 Cb 0.00 -2.44 0.15 0.00 1.01 0.00 0.00 42.92 41.64 2b39 s ASP 776 CO 0.00 -0.48 0.28 -0.76 0.21 0.00 0.00 175.17 174.42 2b39 s LEU 777 N 2.64 2.65 0.00 1.23 1.43 -1.26 -4.99 118.68 120.39 2b39 s LEU 777 Ca 0.36 -2.82 0.00 0.00 -1.03 0.00 0.00 54.13 50.64 2b39 s LEU 777 Cb -0.16 -0.98 0.00 0.00 0.03 0.00 0.00 46.19 45.09 2b39 s LEU 777 CO 0.09 -0.23 0.10 1.17 0.23 0.00 0.00 176.35 177.70 2b39 n LYS 778 N 3.27 0.00 0.00 1.70 4.81 -1.26 -3.79 118.16 122.89 2b39 n LYS 778 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.57 2b39 n LYS 778 Cb 0.37 -1.36 0.00 0.00 0.02 0.00 0.00 35.03 34.06 2b39 n LYS 778 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 2b39 n GLN 779 N 2.07 0.00 0.00 1.64 7.27 -1.26 -4.81 117.38 122.29 2b39 n GLN 779 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 2b39 n GLN 779 Cb 0.00 -3.36 0.00 0.00 2.41 0.00 0.00 30.24 29.29 2b39 n GLN 779 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2b39 n ALA 780 N 0.84 0.00 -3.23 1.69 0.00 -1.26 -4.60 120.51 113.95 2b39 n ALA 780 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 2b39 n ALA 780 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 2b39 n ALA 780 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2b39 s ASP 781 N -0.00 -0.36 0.30 0.00 2.15 -1.25 -4.86 116.67 112.66 2b39 s ASP 781 Ca 0.00 0.09 0.14 0.00 0.43 0.00 0.00 52.55 53.21 2b39 s ASP 781 Cb 0.00 0.45 0.41 0.00 -0.30 0.00 0.00 42.92 43.48 2b39 s ASP 781 CO 0.00 -0.68 1.62 0.11 -0.17 0.00 0.00 175.17 176.05 2b39 h LYS 782 N 2.94 0.00 0.00 4.34 1.57 -1.88 -2.81 116.57 120.73 2b39 h LYS 782 Ca -0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 2b39 h LYS 782 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 2b39 h LYS 782 CO 0.42 0.54 0.00 -1.71 -0.57 0.00 0.00 179.45 178.14 2b39 n ASN 783 N -3.59 0.00 0.00 0.86 2.85 -1.26 -4.84 115.26 109.27 2b39 n ASN 783 Ca -0.00 -1.19 0.00 0.00 -0.11 0.00 0.00 54.58 53.27 2b39 n ASN 783 Cb 0.61 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.63 2b39 n ASN 783 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2b39 n GLY 784 N 0.51 3.19 3.54 8.20 0.00 -1.06 -5.01 105.19 114.57 2b39 n GLY 784 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 2b39 n GLY 784 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b39 s ILE 785 N -1.83 4.37 0.08 -0.61 1.01 -1.26 -3.22 121.20 119.74 2b39 s ILE 785 Ca 0.00 0.53 -0.12 0.00 0.00 0.00 0.00 60.65 61.06 2b39 s ILE 785 Cb 0.00 -4.53 -0.06 0.00 0.01 0.00 0.00 42.46 37.88 2b39 s ILE 785 CO 0.00 -1.04 0.44 -0.55 0.00 0.00 0.00 174.94 173.79 2b39 s SER 786 N 2.65 6.72 0.30 3.58 0.15 -1.07 -3.78 113.70 122.25 2b39 s SER 786 Ca 0.34 0.90 0.10 0.00 0.70 0.00 0.00 55.95 57.99 2b39 s SER 786 Cb -0.11 -2.22 -0.06 0.00 -1.71 0.00 0.00 66.02 61.92 2b39 s SER 786 CO 0.23 0.18 -0.13 0.42 1.20 0.00 0.00 173.24 175.13 2b39 s THR 787 N -1.36 2.21 -0.22 6.45 -4.23 -1.26 -2.97 115.64 114.26 2b39 s THR 787 Ca 0.33 -2.27 -0.09 0.00 -1.18 0.00 0.00 61.69 58.48 2b39 s THR 787 Cb -0.15 -2.44 0.09 0.00 1.34 0.00 0.00 72.50 71.34 2b39 s THR 787 CO 0.18 -0.32 0.48 -0.75 -0.54 0.00 0.00 174.62 173.67 2b39 s LYS 788 N -3.59 0.42 0.15 3.99 2.20 -1.18 -4.81 119.74 116.93 2b39 s LYS 788 Ca 0.30 1.07 -0.06 0.00 -0.36 0.00 0.00 55.97 56.93 2b39 s LYS 788 Cb -0.00 0.33 -0.06 0.00 -1.51 0.00 0.00 37.83 36.58 2b39 s LYS 788 CO 0.15 -0.21 0.40 -0.51 -0.36 0.00 0.00 175.35 174.81 2b39 s LEU 789 N 2.28 4.26 -0.10 5.43 1.43 -1.26 -1.65 118.68 129.07 2b39 s LEU 789 Ca -0.05 0.64 -0.05 0.00 -1.03 0.00 0.00 54.13 53.64 2b39 s LEU 789 Cb -0.10 -3.33 0.05 0.00 0.03 0.00 0.00 46.19 42.83 2b39 s LEU 789 CO -0.15 0.05 0.23 -0.32 0.23 0.00 0.00 176.35 176.39 2b39 s MET 790 N -2.63 0.15 -0.35 1.70 1.75 0.84 -4.93 119.30 115.83 2b39 s MET 790 Ca 0.41 0.58 -0.11 0.00 -1.25 0.00 0.00 55.69 55.32 2b39 s MET 790 Cb -0.12 -0.12 0.01 0.00 2.84 0.00 0.00 34.83 37.43 2b39 s MET 790 CO 0.24 -0.22 0.21 -0.80 -0.65 0.00 0.00 175.02 173.80 2b39 s ASN 791 N 1.72 5.78 0.21 1.11 -0.87 -1.26 0.26 114.94 121.89 2b39 s ASN 791 Ca -0.05 -0.72 0.09 0.00 -1.57 0.00 0.00 52.86 50.62 2b39 s ASN 791 Cb -0.11 -2.06 -0.04 0.00 -0.02 0.00 0.00 41.25 39.02 2b39 s ASN 791 CO -0.08 -0.30 -0.05 -0.69 -2.57 0.00 0.00 177.10 173.41 2b39 s VAL 792 N 1.62 3.36 -0.27 1.60 1.01 -0.03 -4.94 120.40 122.75 2b39 s VAL 792 Ca 0.04 -1.73 -0.11 0.00 0.00 0.00 0.00 61.98 60.18 2b39 s VAL 792 Cb -0.18 -2.72 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 2b39 s VAL 792 CO 0.08 -0.22 0.21 -0.36 0.00 0.00 0.00 175.10 174.81 2b39 s PHE 793 N -1.96 3.24 0.00 5.22 0.08 -1.26 -0.59 117.98 122.71 2b39 s PHE 793 Ca 0.28 0.18 0.00 0.00 0.12 0.00 0.00 56.93 57.51 2b39 s PHE 793 Cb -0.08 -2.39 0.00 0.00 -0.57 0.00 0.00 43.02 39.98 2b39 s PHE 793 CO 0.18 -0.13 0.00 -0.11 -0.10 0.00 0.00 175.22 175.05 2b39 n LEU 794 N 4.96 0.00 -3.90 -0.37 7.94 0.20 -4.94 117.00 120.90 2b39 n LEU 794 Ca -0.13 0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 54.66 2b39 n LEU 794 Cb 0.52 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.37 2b39 n LEU 794 CO 0.34 0.00 -0.19 -0.54 -1.11 0.00 0.00 177.39 175.89 2b39 s LYS 795 N 0.00 0.55 0.00 1.96 -0.14 -1.26 -4.60 119.74 116.25 2b39 s LYS 795 Ca 0.00 -0.58 0.28 0.00 -1.36 0.00 0.00 55.97 54.31 2b39 s LYS 795 Cb 0.00 0.22 1.44 0.00 -1.68 0.00 0.00 37.83 37.81 2b39 s LYS 795 CO 0.00 -0.14 1.98 -0.25 -0.76 0.00 0.00 175.35 176.18 2b39 n ASP 796 N 1.09 0.00 -4.75 2.83 8.00 -1.26 -1.08 116.55 121.38 2b39 n ASP 796 Ca -0.21 -0.15 -0.34 0.00 0.71 0.00 0.00 54.79 54.80 2b39 n ASP 796 Cb 0.57 -0.27 0.07 0.00 -0.02 0.00 0.00 41.12 41.46 2b39 n ASP 796 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2b39 s SER 797 N -2.55 4.71 -0.85 -2.24 0.15 -1.26 -4.82 113.70 106.84 2b39 s SER 797 Ca 0.27 2.22 0.00 0.00 0.70 0.00 0.00 55.95 59.15 2b39 s SER 797 Cb 0.19 -2.58 0.21 0.00 -1.71 0.00 0.00 66.02 62.14 2b39 s SER 797 CO 0.43 -1.91 0.74 2.30 1.20 0.00 0.00 173.24 176.00 2b39 n ILE 798 N -2.42 2.74 -4.31 6.45 -6.64 -1.26 -4.78 119.36 109.14 2b39 n ILE 798 Ca 0.12 -5.08 -0.18 0.00 -1.77 0.00 0.00 62.75 55.84 2b39 n ILE 798 Cb 0.51 -2.32 -0.06 0.00 -1.44 0.00 0.00 39.64 36.33 2b39 n ILE 798 CO 0.00 0.00 0.00 1.07 -1.77 0.00 0.00 176.55 175.85 2b39 n THR 799 N 2.13 0.00 -3.32 7.28 5.66 -1.26 -4.89 114.28 119.88 2b39 n THR 799 Ca 0.22 -1.91 -0.35 0.00 -3.05 0.00 0.00 64.05 58.96 2b39 n THR 799 Cb 0.37 0.82 -0.04 0.00 -1.55 0.00 0.00 70.33 69.92 2b39 n THR 799 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 2b39 n THR 800 N -0.62 3.65 -1.59 1.09 -1.04 -1.26 -0.31 114.28 114.21 2b39 n THR 800 Ca 0.01 -5.47 -0.49 0.00 -2.04 0.00 0.00 64.05 56.06 2b39 n THR 800 Cb 0.48 -2.16 -0.04 0.00 -1.82 0.00 0.00 70.33 66.79 2b39 n THR 800 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 2b39 n TRP 801 N 1.37 1.39 -3.86 -1.42 5.03 0.56 -2.95 117.44 117.55 2b39 n TRP 801 Ca 0.27 0.65 -0.33 0.00 3.03 0.00 0.00 57.50 61.12 2b39 n TRP 801 Cb 0.37 -2.30 -0.12 0.00 -1.03 0.00 0.00 31.31 28.23 2b39 n TRP 801 CO 0.00 0.00 0.00 -1.21 -0.03 0.00 0.00 177.69 176.45 2b39 s GLU 802 N -0.24 2.12 0.06 -0.99 0.41 0.15 -1.14 118.70 119.06 2b39 s GLU 802 Ca 0.75 -2.38 -0.31 0.00 -0.41 0.00 0.00 54.97 52.62 2b39 s GLU 802 Cb -0.85 -3.49 -0.06 0.00 -1.78 0.00 0.00 34.13 27.95 2b39 s GLU 802 CO 0.51 -1.10 1.30 0.42 -0.49 0.00 0.00 175.26 175.90 2b39 s ILE 803 N 0.14 3.75 0.05 -1.63 1.01 -0.54 -2.80 121.20 121.18 2b39 s ILE 803 Ca 0.15 1.22 0.07 0.00 0.00 0.00 0.00 60.65 62.09 2b39 s ILE 803 Cb -0.23 -3.78 -0.02 0.00 0.01 0.00 0.00 42.46 38.44 2b39 s ILE 803 CO -0.03 0.07 -0.18 -0.76 0.00 0.00 0.00 174.94 174.03 2b39 s LEU 804 N 1.46 2.18 0.29 2.97 2.01 -0.73 -1.40 118.68 125.46 2b39 s LEU 804 Ca 0.61 -0.52 0.11 0.00 0.01 0.00 0.00 54.13 54.34 2b39 s LEU 804 Cb -0.32 -0.84 -0.05 0.00 0.01 0.00 0.00 46.19 44.99 2b39 s LEU 804 CO 0.28 0.11 -0.09 0.00 1.01 0.00 0.00 176.35 177.66 2b39 s ALA 805 N -0.85 2.97 -0.29 4.21 0.00 -1.25 -2.33 121.76 124.22 2b39 s ALA 805 Ca 0.05 -1.83 0.04 0.00 0.00 0.00 0.00 51.96 50.23 2b39 s ALA 805 Cb -0.09 -0.44 0.20 0.00 0.00 0.00 0.00 23.12 22.79 2b39 s ALA 805 CO 0.02 0.23 0.61 0.08 0.00 0.00 0.00 175.76 176.70 2b39 s VAL 806 N -2.45 -0.97 0.04 0.00 1.01 -0.71 -2.44 120.40 114.88 2b39 s VAL 806 Ca 0.31 0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.32 2b39 s VAL 806 Cb -0.04 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 2b39 s VAL 806 CO 0.17 0.00 0.02 -0.55 0.00 0.00 0.00 175.10 174.74 2b39 s SER 807 N 2.84 5.19 -0.30 3.32 0.15 -0.08 -0.10 113.70 124.73 2b39 s SER 807 Ca 0.12 -0.06 0.02 0.00 0.70 0.00 0.00 55.95 56.73 2b39 s SER 807 Cb -0.11 -1.33 0.09 0.00 -1.71 0.00 0.00 66.02 62.96 2b39 s SER 807 CO -0.25 0.22 0.02 -0.22 1.20 0.00 0.00 173.24 174.21 2b39 s LEU 808 N -1.98 3.45 -0.22 3.45 0.20 -0.72 0.04 118.68 122.90 2b39 s LEU 808 Ca 0.24 -1.70 -0.17 0.00 0.69 0.00 0.00 54.13 53.18 2b39 s LEU 808 Cb -0.12 -1.31 -0.03 0.00 -0.43 0.00 0.00 46.19 44.30 2b39 s LEU 808 CO 0.15 -0.33 0.48 -0.94 -0.29 0.00 0.00 176.35 175.42 2b39 s SER 809 N 1.23 6.49 -0.19 3.68 1.04 0.79 -2.07 113.70 124.66 2b39 s SER 809 Ca 0.04 0.58 -0.41 0.00 0.48 0.00 0.00 55.95 56.65 2b39 s SER 809 Cb -0.19 -2.27 -0.18 0.00 0.10 0.00 0.00 66.02 63.48 2b39 s SER 809 CO -0.11 -0.18 1.47 -0.67 0.98 0.00 0.00 173.24 174.73 2b39 n ASP 810 N 4.89 1.40 -3.38 7.02 -0.08 -1.26 -0.38 116.55 124.77 2b39 n ASP 810 Ca -0.06 1.13 -0.20 0.00 -1.51 0.00 0.00 54.79 54.16 2b39 n ASP 810 Cb 0.50 -1.04 -0.03 0.00 2.34 0.00 0.00 41.12 42.90 2b39 n ASP 810 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2b39 n LYS 811 N 3.54 -2.21 0.00 -0.67 5.02 -1.26 -4.65 118.16 117.93 2b39 n LYS 811 Ca 0.24 0.14 0.00 0.00 -2.02 0.00 0.00 58.31 56.68 2b39 n LYS 811 Cb 0.08 -4.71 0.00 0.00 -0.02 0.00 0.00 35.03 30.39 2b39 n LYS 811 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2b39 n LYS 812 N -3.27 1.97 0.00 1.97 0.00 0.49 -5.09 118.16 114.24 2b39 n LYS 812 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.35 2b39 n LYS 812 Cb 0.49 -0.71 0.00 0.00 0.00 0.00 0.00 35.03 34.81 2b39 n LYS 812 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2b39 n GLY 813 N 1.49 0.48 3.01 3.14 0.00 -0.68 -4.94 105.19 107.69 2b39 n GLY 813 Ca 0.00 -2.21 -0.31 0.00 0.00 0.00 0.00 46.02 43.49 2b39 n GLY 813 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b39 s ILE 814 N -0.57 1.86 -0.13 -0.61 1.01 -1.20 -0.15 121.20 121.41 2b39 s ILE 814 Ca 0.00 -1.39 -0.02 0.00 0.00 0.00 0.00 60.65 59.25 2b39 s ILE 814 Cb 0.00 -2.02 -0.02 0.00 0.01 0.00 0.00 42.46 40.43 2b39 s ILE 814 CO 0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 174.94 174.84 2b39 s VAL 816 N 0.20 5.49 0.25 0.00 1.01 -1.26 -0.90 120.40 125.19 2b39 s VAL 816 Ca -0.05 -2.19 -0.03 0.00 0.00 0.00 0.00 61.98 59.72 2b39 s VAL 816 Cb -0.14 -4.44 0.04 0.00 0.00 0.00 0.00 36.38 31.84 2b39 s VAL 816 CO 0.04 -0.99 0.09 0.00 0.00 0.00 0.00 175.10 174.23 2b39 n ALA 817 N 4.36 -0.54 -2.80 5.51 0.00 -1.02 -4.39 120.51 121.62 2b39 n ALA 817 Ca 0.06 -0.16 -0.22 0.00 0.00 0.00 0.00 53.44 53.13 2b39 n ALA 817 Cb 0.45 -0.01 -0.04 0.00 0.00 0.00 0.00 19.45 19.85 2b39 n ALA 817 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2b39 s ASP 818 N -1.45 5.64 0.07 0.00 1.01 -1.26 -4.84 116.67 115.83 2b39 s ASP 818 Ca 0.07 -0.22 -0.30 0.00 0.71 0.00 0.00 52.55 52.80 2b39 s ASP 818 Cb -0.01 -1.43 -0.09 0.00 1.01 0.00 0.00 42.92 42.40 2b39 s ASP 818 CO 0.06 -0.09 1.86 -2.84 0.21 0.00 0.00 175.17 174.37 2b39 s PRO 819 N -3.89 4.15 -0.51 8.23 0.02 -1.26 -4.63 135.00 137.10 2b39 s PRO 819 Ca 0.34 2.55 -0.13 0.00 0.02 0.00 0.00 61.00 63.78 2b39 s PRO 819 Cb -0.08 -3.86 0.12 0.00 0.02 0.00 0.00 34.50 30.71 2b39 s PRO 819 CO 0.26 -0.88 0.44 -0.47 -0.33 0.00 0.00 177.00 176.02 2b39 s TYR 820 N 3.54 3.32 0.62 6.54 5.04 -0.49 -4.97 117.35 130.94 2b39 s TYR 820 Ca 0.83 -1.51 -0.15 0.00 -2.44 0.00 0.00 57.07 53.80 2b39 s TYR 820 Cb -0.43 -3.67 -0.02 0.00 0.35 0.00 0.00 41.96 38.18 2b39 s TYR 820 CO 0.38 -1.01 1.07 -2.00 -1.34 0.00 0.00 175.55 172.65 2b39 s GLU 821 N 1.51 3.14 -0.28 4.97 2.12 -1.26 -1.47 118.70 127.44 2b39 s GLU 821 Ca 0.04 1.25 -0.02 0.00 0.36 0.00 0.00 54.97 56.60 2b39 s GLU 821 Cb -0.28 -2.01 0.16 0.00 0.26 0.00 0.00 34.13 32.26 2b39 s GLU 821 CO 0.02 -0.96 0.52 0.08 -0.54 0.00 0.00 175.26 174.37 2b39 s VAL 822 N -2.45 -0.84 -0.05 3.70 1.01 -0.29 -4.93 120.40 116.55 2b39 s VAL 822 Ca 0.64 -0.02 -0.04 0.00 0.00 0.00 0.00 61.98 62.57 2b39 s VAL 822 Cb -0.17 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 2b39 s VAL 822 CO 0.39 -0.04 0.14 0.42 0.00 0.00 0.00 175.10 176.01 2b39 s THR 823 N 2.74 5.28 -0.29 3.92 -4.23 -1.26 -0.33 115.64 121.47 2b39 s THR 823 Ca 0.16 -0.07 0.07 0.00 -1.18 0.00 0.00 61.69 60.66 2b39 s THR 823 Cb -0.15 -3.39 0.46 0.00 1.34 0.00 0.00 72.50 70.76 2b39 s THR 823 CO -0.19 0.45 1.22 0.52 -0.54 0.00 0.00 174.62 176.08 2b39 n VAL 824 N 1.42 2.54 -0.45 2.29 0.31 0.58 -3.17 118.33 121.86 2b39 n VAL 824 Ca -0.15 -4.11 -0.29 0.00 -0.01 0.00 0.00 64.34 59.78 2b39 n VAL 824 Cb 0.54 -1.07 0.25 0.00 -0.91 0.00 0.00 33.84 32.64 2b39 n VAL 824 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 2b39 n MET 825 N -0.75 -2.96 -3.69 5.55 0.00 -1.24 -4.36 117.12 109.67 2b39 n MET 825 Ca 0.43 -0.85 -0.05 0.00 0.00 0.00 0.00 57.70 57.22 2b39 n MET 825 Cb 0.94 -1.99 -0.02 0.00 0.00 0.00 0.00 33.22 32.16 2b39 n MET 825 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 175.97 174.83 2b39 s GLN 826 N -4.31 1.18 0.00 2.12 0.74 -1.26 -3.82 119.66 114.31 2b39 s GLN 826 Ca 0.65 -0.60 0.10 0.00 0.05 0.00 0.00 55.36 55.55 2b39 s GLN 826 Cb -0.20 0.43 0.12 0.00 1.10 0.00 0.00 33.01 34.47 2b39 s GLN 826 CO 0.62 -0.53 0.91 -0.25 -0.55 0.00 0.00 175.29 175.49 2b39 n ASP 827 N -0.42 2.05 -4.10 6.67 8.00 -1.26 -4.76 116.55 122.73 2b39 n ASP 827 Ca -0.07 -1.54 -0.17 0.00 0.71 0.00 0.00 54.79 53.72 2b39 n ASP 827 Cb 0.61 -0.04 -0.12 0.00 -0.02 0.00 0.00 41.12 41.54 2b39 n ASP 827 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2b39 s PHE 828 N -0.87 0.96 0.07 1.24 5.36 -1.26 -1.97 117.98 121.50 2b39 s PHE 828 Ca 0.14 -0.40 -0.06 0.00 -0.96 0.00 0.00 56.93 55.65 2b39 s PHE 828 Cb 0.09 -0.56 -0.01 0.00 -0.34 0.00 0.00 43.02 42.19 2b39 s PHE 828 CO 0.13 -0.00 0.11 -0.06 -1.46 0.00 0.00 175.22 173.93 2b39 s PHE 829 N -1.05 0.27 -0.28 10.12 0.08 -0.69 -4.95 117.98 121.47 2b39 s PHE 829 Ca -0.03 -0.72 0.01 0.00 0.12 0.00 0.00 56.93 56.31 2b39 s PHE 829 Cb -0.08 -0.17 0.15 0.00 -0.57 0.00 0.00 43.02 42.34 2b39 s PHE 829 CO 0.01 -0.46 0.36 -1.50 -0.10 0.00 0.00 175.22 173.53 2b39 s ILE 830 N -3.67 -0.54 -0.21 0.64 2.07 -1.26 -2.55 121.20 115.68 2b39 s ILE 830 Ca 0.04 -0.33 -0.05 0.00 -1.41 0.00 0.00 60.65 58.90 2b39 s ILE 830 Cb 0.05 -0.96 -0.02 0.00 0.13 0.00 0.00 42.46 41.66 2b39 s ILE 830 CO -0.10 -0.33 -0.01 -0.62 -1.91 0.00 0.00 174.94 171.98 2b39 s ASP 831 N 2.48 4.68 0.05 4.50 2.15 -0.77 -4.61 116.67 125.14 2b39 s ASP 831 Ca 0.10 -0.26 -0.19 0.00 0.43 0.00 0.00 52.55 52.63 2b39 s ASP 831 Cb -0.13 -1.80 -0.06 0.00 -0.30 0.00 0.00 42.92 40.62 2b39 s ASP 831 CO -0.29 0.03 0.55 -0.22 -0.17 0.00 0.00 175.17 175.07 2b39 s LEU 832 N 1.19 4.50 -0.27 -1.34 2.96 -1.26 0.11 118.68 124.57 2b39 s LEU 832 Ca 0.03 1.19 -0.01 0.00 -0.22 0.00 0.00 54.13 55.12 2b39 s LEU 832 Cb -0.15 -2.85 0.04 0.00 0.50 0.00 0.00 46.19 43.73 2b39 s LEU 832 CO 0.01 0.25 -0.04 -0.13 -1.32 0.00 0.00 176.35 175.11 2b39 s ARG 833 N -0.92 2.63 0.07 1.98 1.81 -0.38 -4.95 118.95 119.18 2b39 s ARG 833 Ca 0.28 -1.12 0.08 0.00 -1.72 0.00 0.00 55.73 53.25 2b39 s ARG 833 Cb -0.19 -3.05 -0.03 0.00 -0.45 0.00 0.00 34.95 31.23 2b39 s ARG 833 CO 0.18 -0.50 -0.22 -0.51 -0.68 0.00 0.00 175.30 173.57 2b39 s LEU 834 N 1.28 2.21 0.81 2.53 1.43 -1.26 -2.96 118.68 122.72 2b39 s LEU 834 Ca -0.03 -0.59 -0.12 0.00 -1.03 0.00 0.00 54.13 52.37 2b39 s LEU 834 Cb -0.18 -1.01 0.08 0.00 0.03 0.00 0.00 46.19 45.12 2b39 s LEU 834 CO -0.03 0.15 1.14 -2.16 0.23 0.00 0.00 176.35 175.67 2b39 s PRO 835 N -1.44 1.79 0.35 1.29 0.04 -1.26 -4.89 135.00 130.88 2b39 s PRO 835 Ca 0.08 1.46 0.06 0.00 0.04 0.00 0.00 61.00 62.65 2b39 s PRO 835 Cb -0.09 -1.82 0.73 0.00 0.04 0.00 0.00 34.50 33.36 2b39 s PRO 835 CO 0.03 -2.04 1.91 -0.92 0.04 0.00 0.00 177.00 176.02 2b39 h TYR 836 N -1.14 0.84 -3.20 0.56 3.20 -1.94 -3.45 116.97 111.83 2b39 h TYR 836 Ca -0.44 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.40 2b39 h TYR 836 Cb 1.26 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 39.24 2b39 h TYR 836 CO 0.52 0.39 0.18 -1.54 -1.64 0.00 0.00 178.16 176.07 2b39 s SER 837 N -5.99 0.09 -0.01 -2.11 1.04 -1.26 -4.50 113.70 100.96 2b39 s SER 837 Ca -0.10 -1.10 -0.20 0.00 0.48 0.00 0.00 55.95 55.03 2b39 s SER 837 Cb 0.20 0.79 0.04 0.00 0.10 0.00 0.00 66.02 67.15 2b39 s SER 837 CO 0.78 -1.55 0.43 -0.69 0.98 0.00 0.00 173.24 173.19 2b39 s VAL 838 N -2.77 0.04 -0.13 5.02 1.01 0.71 -4.68 120.40 119.60 2b39 s VAL 838 Ca 0.17 -0.36 -0.04 0.00 0.00 0.00 0.00 61.98 61.76 2b39 s VAL 838 Cb -0.04 -0.81 -0.03 0.00 0.00 0.00 0.00 36.38 35.50 2b39 s VAL 838 CO 0.12 -0.20 0.01 0.68 0.00 0.00 0.00 175.10 175.71 2b39 s VAL 839 N -1.63 4.36 0.52 2.92 -7.23 -1.26 0.22 120.40 118.30 2b39 s VAL 839 Ca -0.11 -0.21 -0.19 0.00 -1.81 0.00 0.00 61.98 59.66 2b39 s VAL 839 Cb -0.03 -2.88 -0.11 0.00 0.56 0.00 0.00 36.38 33.92 2b39 s VAL 839 CO 0.04 0.55 0.41 -2.11 -0.31 0.00 0.00 175.10 173.68 2b39 n ARG 840 N 2.78 0.43 -2.35 4.82 1.85 -0.54 -2.59 116.66 121.07 2b39 n ARG 840 Ca -0.18 0.17 -0.14 0.00 -1.00 0.00 0.00 57.85 56.70 2b39 n ARG 840 Cb 0.53 -1.53 -0.00 0.00 -1.05 0.00 0.00 32.46 30.41 2b39 n ARG 840 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2b39 n ASN 841 N 1.04 -4.32 -3.89 2.89 3.02 -0.96 -4.77 115.26 108.26 2b39 n ASN 841 Ca 0.11 -0.04 -0.27 0.00 -0.03 0.00 0.00 54.58 54.34 2b39 n ASN 841 Cb 0.46 -3.44 -0.17 0.00 -0.61 0.00 0.00 39.78 36.02 2b39 n ASN 841 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2b39 s GLU 842 N -4.79 1.45 0.00 3.52 2.12 -1.07 -4.78 118.70 115.14 2b39 s GLU 842 Ca 0.03 -0.38 -0.30 0.00 0.36 0.00 0.00 54.97 54.68 2b39 s GLU 842 Cb -0.01 -1.80 -0.04 0.00 0.26 0.00 0.00 34.13 32.53 2b39 s GLU 842 CO 0.04 -0.36 1.20 -0.65 -0.54 0.00 0.00 175.26 174.95 2b39 s GLN 843 N 1.68 4.40 -0.12 4.30 -0.21 -0.76 -4.27 119.66 124.68 2b39 s GLN 843 Ca 0.03 1.71 -0.01 0.00 0.02 0.00 0.00 55.36 57.11 2b39 s GLN 843 Cb -0.14 -3.46 0.03 0.00 1.00 0.00 0.00 33.01 30.44 2b39 s GLN 843 CO -0.08 -0.35 -0.04 0.08 -2.12 0.00 0.00 175.29 172.78 2b39 s VAL 844 N 1.66 0.85 -0.58 1.09 1.01 0.42 -0.52 120.40 124.33 2b39 s VAL 844 Ca 0.57 -0.27 -0.21 0.00 0.00 0.00 0.00 61.98 62.06 2b39 s VAL 844 Cb -0.27 -0.97 0.07 0.00 0.00 0.00 0.00 36.38 35.21 2b39 s VAL 844 CO 0.26 0.25 0.81 -0.70 0.00 0.00 0.00 175.10 175.72 2b39 s GLU 845 N 1.77 3.15 0.83 2.72 2.12 -0.81 -1.88 118.70 126.60 2b39 s GLU 845 Ca 0.04 -0.81 -0.08 0.00 0.36 0.00 0.00 54.97 54.47 2b39 s GLU 845 Cb -0.13 -4.16 0.16 0.00 0.26 0.00 0.00 34.13 30.26 2b39 s GLU 845 CO -0.07 -1.52 1.15 0.96 -0.54 0.00 0.00 175.26 175.23 2b39 s ILE 846 N 3.37 2.07 -0.23 -3.70 -0.00 -0.31 -4.26 121.20 118.15 2b39 s ILE 846 Ca 0.20 -0.31 -0.19 0.00 -0.00 0.00 0.00 60.65 60.35 2b39 s ILE 846 Cb -0.18 -2.76 0.06 0.00 -0.00 0.00 0.00 42.46 39.58 2b39 s ILE 846 CO 0.12 0.00 0.59 0.00 -0.00 0.00 0.00 174.94 175.65 2b39 s ARG 847 N -5.49 0.67 -0.04 0.37 1.70 -1.15 -1.62 118.95 113.39 2b39 s ARG 847 Ca 0.70 0.89 -0.18 0.00 -0.47 0.00 0.00 55.73 56.67 2b39 s ARG 847 Cb -0.05 0.27 -0.05 0.00 -0.57 0.00 0.00 34.95 34.55 2b39 s ARG 847 CO 0.48 -0.10 0.50 0.00 -1.08 0.00 0.00 175.30 175.10 2b39 s ALA 848 N 0.64 3.55 -0.39 7.88 0.00 -1.10 -1.25 121.76 131.09 2b39 s ALA 848 Ca -0.03 -0.12 -0.01 0.00 0.00 0.00 0.00 51.96 51.81 2b39 s ALA 848 Cb -0.05 -2.60 0.11 0.00 0.00 0.00 0.00 23.12 20.58 2b39 s ALA 848 CO -0.04 0.21 0.15 0.42 0.00 0.00 0.00 175.76 176.50 2b39 s ILE 849 N -0.20 2.94 -0.08 0.00 1.01 0.30 -1.56 121.20 123.61 2b39 s ILE 849 Ca 0.27 -2.16 -0.26 0.00 0.00 0.00 0.00 60.65 58.49 2b39 s ILE 849 Cb -0.17 -3.06 -0.03 0.00 0.01 0.00 0.00 42.46 39.21 2b39 s ILE 849 CO 0.14 -0.66 0.85 -0.76 0.00 0.00 0.00 174.94 174.51 2b39 s LEU 850 N 1.05 4.28 0.08 2.97 1.43 -0.99 -1.85 118.68 125.66 2b39 s LEU 850 Ca 0.09 1.35 0.07 0.00 -1.03 0.00 0.00 54.13 54.62 2b39 s LEU 850 Cb -0.21 -3.32 -0.04 0.00 0.03 0.00 0.00 46.19 42.65 2b39 s LEU 850 CO -0.06 -0.28 -0.15 -0.31 0.23 0.00 0.00 176.35 175.79 2b39 s TYR 851 N 1.38 2.62 -0.12 0.29 2.02 -1.06 -0.05 117.35 122.44 2b39 s TYR 851 Ca 0.43 -0.22 -0.00 0.00 -0.37 0.00 0.00 57.07 56.91 2b39 s TYR 851 Cb -0.18 -1.42 0.02 0.00 -0.40 0.00 0.00 41.96 39.98 2b39 s TYR 851 CO 0.19 0.36 -0.09 1.21 -1.57 0.00 0.00 175.55 175.65 2b39 s ASN 852 N -1.92 2.28 0.00 2.29 3.84 -1.23 -1.71 114.94 118.50 2b39 s ASN 852 Ca 0.18 -0.34 0.09 0.00 0.21 0.00 0.00 52.86 52.99 2b39 s ASN 852 Cb -0.11 -0.92 0.16 0.00 -0.55 0.00 0.00 41.25 39.84 2b39 s ASN 852 CO 0.10 -0.10 1.00 -1.22 -2.79 0.00 0.00 177.10 174.09 2b39 n TYR 853 N 4.85 0.19 -2.96 0.43 4.01 -0.83 -4.13 117.16 118.71 2b39 n TYR 853 Ca -0.14 -0.25 -0.40 0.00 -0.16 0.00 0.00 57.90 56.95 2b39 n TYR 853 Cb 0.50 -0.02 -0.05 0.00 -0.31 0.00 0.00 39.34 39.47 2b39 n TYR 853 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 2b39 s ARG 854 N -0.88 4.49 0.16 -0.72 1.70 -1.26 -5.01 118.95 117.44 2b39 s ARG 854 Ca 0.15 1.07 -0.29 0.00 -0.47 0.00 0.00 55.73 56.19 2b39 s ARG 854 Cb 0.09 -3.40 -0.07 0.00 -0.57 0.00 0.00 34.95 31.00 2b39 s ARG 854 CO 0.12 0.19 0.91 -2.00 -1.08 0.00 0.00 175.30 173.44 2b39 s GLU 855 N 0.28 4.72 0.00 3.89 2.12 -1.26 -4.01 118.70 124.43 2b39 s GLU 855 Ca 0.40 1.39 0.00 0.00 0.36 0.00 0.00 54.97 57.12 2b39 s GLU 855 Cb -0.20 -3.33 0.00 0.00 0.26 0.00 0.00 34.13 30.86 2b39 s GLU 855 CO 0.22 0.37 0.00 0.00 -0.54 0.00 0.00 175.26 175.32 2b39 n ALA 856 N 2.19 0.00 -2.43 6.30 0.00 -1.26 -5.01 120.51 120.30 2b39 n ALA 856 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.12 2b39 n ALA 856 Cb 0.48 -0.23 -0.14 0.00 0.00 0.00 0.00 19.45 19.57 2b39 n ALA 856 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2b39 s GLU 857 N -0.16 2.22 -0.44 0.00 2.02 -1.26 -5.02 118.70 116.06 2b39 s GLU 857 Ca 0.00 -0.88 -0.14 0.00 0.02 0.00 0.00 54.97 53.97 2b39 s GLU 857 Cb 0.00 -2.21 0.06 0.00 0.10 0.00 0.00 34.13 32.08 2b39 s GLU 857 CO 0.00 0.57 0.34 -0.80 0.02 0.00 0.00 175.26 175.39 2b39 s ASN 858 N -1.02 6.01 -0.29 -0.19 0.01 -1.26 -4.38 114.94 113.83 2b39 s ASN 858 Ca 0.12 -1.25 -0.29 0.00 -0.71 0.00 0.00 52.86 50.74 2b39 s ASN 858 Cb -0.10 -2.13 -0.01 0.00 0.41 0.00 0.00 41.25 39.42 2b39 s ASN 858 CO 0.02 -0.57 1.42 -0.76 -1.51 0.00 0.00 177.10 175.71 2b39 s LEU 859 N 1.60 3.84 0.26 0.60 2.01 -1.07 -4.81 118.68 121.12 2b39 s LEU 859 Ca 0.04 1.29 -0.27 0.00 0.01 0.00 0.00 54.13 55.20 2b39 s LEU 859 Cb -0.23 -3.54 -0.09 0.00 0.01 0.00 0.00 46.19 42.35 2b39 s LEU 859 CO 0.06 -1.19 0.90 -0.75 1.01 0.00 0.00 176.35 176.38 2b39 s LYS 860 N 4.45 4.66 0.05 1.70 2.20 -1.26 -0.48 119.74 131.06 2b39 s LYS 860 Ca 0.62 1.33 -0.07 0.00 -0.36 0.00 0.00 55.97 57.49 2b39 s LYS 860 Cb -0.19 -3.06 -0.01 0.00 -1.51 0.00 0.00 37.83 33.06 2b39 s LYS 860 CO 0.26 0.43 0.14 0.08 -0.36 0.00 0.00 175.35 175.90 2b39 s VAL 861 N -1.37 0.13 -0.35 4.02 1.01 0.18 -4.14 120.40 119.88 2b39 s VAL 861 Ca 0.44 -1.07 0.02 0.00 0.00 0.00 0.00 61.98 61.37 2b39 s VAL 861 Cb -0.22 -0.99 0.10 0.00 0.00 0.00 0.00 36.38 35.28 2b39 s VAL 861 CO 0.27 -0.59 0.09 -0.60 0.00 0.00 0.00 175.10 174.28 2b39 s ARG 862 N -2.82 1.20 0.24 2.72 3.52 -0.96 -0.46 118.95 122.39 2b39 s ARG 862 Ca -0.03 -1.62 0.06 0.00 -0.13 0.00 0.00 55.73 54.00 2b39 s ARG 862 Cb 0.00 -2.69 -0.03 0.00 -1.56 0.00 0.00 34.95 30.67 2b39 s ARG 862 CO -0.05 -0.98 0.26 0.14 -0.81 0.00 0.00 175.30 173.85 2b39 s VAL 863 N 1.07 4.79 -0.09 7.11 -7.23 -0.99 -1.33 120.40 123.73 2b39 s VAL 863 Ca 0.11 -1.20 -0.23 0.00 -1.81 0.00 0.00 61.98 58.86 2b39 s VAL 863 Cb -0.19 -3.58 0.05 0.00 0.56 0.00 0.00 36.38 33.22 2b39 s VAL 863 CO -0.14 -0.31 0.54 -0.70 -0.31 0.00 0.00 175.10 174.18 2b39 s GLU 864 N -3.81 0.82 -0.43 4.82 2.12 0.45 -2.01 118.70 120.66 2b39 s GLU 864 Ca 0.33 0.29 -0.15 0.00 0.36 0.00 0.00 54.97 55.81 2b39 s GLU 864 Cb -0.09 0.38 0.04 0.00 0.26 0.00 0.00 34.13 34.72 2b39 s GLU 864 CO 0.26 -0.21 0.33 -1.17 -0.54 0.00 0.00 175.26 173.94 2b39 s LEU 865 N -0.76 5.26 0.21 2.70 2.96 -1.26 -1.36 118.68 126.43 2b39 s LEU 865 Ca -0.08 -1.02 -0.32 0.00 -0.22 0.00 0.00 54.13 52.48 2b39 s LEU 865 Cb -0.03 -2.17 -0.13 0.00 0.50 0.00 0.00 46.19 44.37 2b39 s LEU 865 CO 0.05 -0.51 1.63 0.18 -1.32 0.00 0.00 176.35 176.38 2b39 n LEU 866 N 5.18 3.71 -4.75 -0.68 4.77 -0.35 -4.69 117.00 120.19 2b39 n LEU 866 Ca -0.11 1.09 -0.41 0.00 -0.03 0.00 0.00 56.01 56.55 2b39 n LEU 866 Cb 0.46 -1.52 -0.03 0.00 -2.33 0.00 0.00 43.42 40.00 2b39 n LEU 866 CO 0.43 -0.03 0.98 -0.47 -1.33 0.00 0.00 177.39 176.97 2b39 s TYR 867 N 0.74 3.19 -0.03 -1.77 5.04 -1.26 -4.66 117.35 118.60 2b39 s TYR 867 Ca 0.73 1.32 0.03 0.00 -2.44 0.00 0.00 57.07 56.71 2b39 s TYR 867 Cb -0.57 -3.62 0.00 0.00 0.35 0.00 0.00 41.96 38.12 2b39 s TYR 867 CO 0.39 -1.82 -0.11 1.21 -1.34 0.00 0.00 175.55 173.87 2b39 s ASN 868 N -0.09 1.50 0.33 4.32 3.84 -1.26 -5.03 114.94 118.55 2b39 s ASN 868 Ca 0.53 -0.24 0.25 0.00 0.21 0.00 0.00 52.86 53.61 2b39 s ASN 868 Cb -0.38 -0.40 1.16 0.00 -0.55 0.00 0.00 41.25 41.08 2b39 s ASN 868 CO 0.44 0.09 1.76 1.55 -2.79 0.00 0.00 177.10 178.16 2b39 h PRO 869 N 6.34 0.00 0.00 0.43 0.13 -1.97 -2.79 132.00 134.14 2b39 h PRO 869 Ca -0.33 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.71 2b39 h PRO 869 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2b39 h PRO 869 CO 0.48 0.00 -0.41 0.00 -0.23 0.00 0.00 178.00 177.85 2b39 h ALA 870 N 2.15 1.08 -2.81 -0.56 0.00 -1.95 -3.46 119.26 113.70 2b39 h ALA 870 Ca 0.00 -0.37 -0.15 0.00 0.00 0.00 0.00 54.91 54.39 2b39 h ALA 870 Cb 0.26 -0.06 -0.20 0.00 0.00 0.00 0.00 17.79 17.78 2b39 h ALA 870 CO 0.00 0.51 -0.59 -0.59 0.00 0.00 0.00 179.25 178.58 2b39 s PHE 871 N -3.75 0.17 0.46 0.00 -0.71 -1.05 0.03 117.98 113.12 2b39 s PHE 871 Ca -0.01 -0.38 -0.20 0.00 -1.04 0.00 0.00 56.93 55.30 2b39 s PHE 871 Cb 0.12 -0.13 -0.10 0.00 -1.21 0.00 0.00 43.02 41.70 2b39 s PHE 871 CO 0.70 -0.26 0.99 0.00 -1.34 0.00 0.00 175.22 175.31 2b39 n SER 873 N -0.84 -1.47 0.15 0.00 3.41 -1.26 -2.16 113.62 111.44 2b39 n SER 873 Ca 0.08 -1.63 0.13 0.00 -0.26 0.00 0.00 58.87 57.19 2b39 n SER 873 Cb 0.53 2.36 0.47 0.00 -0.26 0.00 0.00 64.21 67.32 2b39 n SER 873 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2b39 h LEU 874 N 0.00 0.00 -8.66 1.04 3.38 -1.96 -3.42 115.31 105.69 2b39 h LEU 874 Ca -0.24 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 57.10 2b39 h LEU 874 Cb 1.14 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.76 2b39 h LEU 874 CO 0.33 0.00 0.25 0.00 0.09 0.00 0.00 178.44 179.11 2b39 s ALA 875 N -3.30 3.35 0.51 1.53 0.00 -1.26 -4.60 121.76 117.99 2b39 s ALA 875 Ca 0.06 -1.01 -0.03 0.00 0.00 0.00 0.00 51.96 50.98 2b39 s ALA 875 Cb 0.10 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.86 2b39 s ALA 875 CO 0.49 -1.74 0.78 0.99 0.00 0.00 0.00 175.76 176.28 2b39 s THR 876 N 3.02 4.10 0.14 0.00 2.01 0.15 -4.53 115.64 120.54 2b39 s THR 876 Ca 0.27 -0.14 -0.30 0.00 0.31 0.00 0.00 61.69 61.83 2b39 s THR 876 Cb -0.13 -3.57 -0.05 0.00 0.01 0.00 0.00 72.50 68.76 2b39 s THR 876 CO 0.20 -0.51 1.56 0.00 -0.69 0.00 0.00 174.62 175.18 2b39 h ALA 877 N 0.14 -0.59 0.05 7.40 0.00 -1.96 -3.06 119.26 121.24 2b39 h ALA 877 Ca -0.46 0.03 -0.32 0.00 0.00 0.00 0.00 54.91 54.16 2b39 h ALA 877 Cb 1.24 0.99 -0.04 0.00 0.00 0.00 0.00 17.79 19.98 2b39 h ALA 877 CO 0.60 -0.95 -1.85 1.17 0.00 0.00 0.00 179.25 178.22 2b39 n LYS 878 N -5.40 0.68 -3.74 0.00 3.00 -1.26 -4.82 118.16 106.62 2b39 n LYS 878 Ca -0.02 0.27 -0.38 0.00 -0.00 0.00 0.00 58.31 58.19 2b39 n LYS 878 Cb 0.35 -1.75 -0.12 0.00 0.00 0.00 0.00 35.03 33.51 2b39 n LYS 878 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 2b39 s LYS 879 N -2.58 2.61 0.85 1.64 -2.85 -1.16 -5.09 119.74 113.16 2b39 s LYS 879 Ca -0.12 -1.22 -0.09 0.00 -1.00 0.00 0.00 55.97 53.54 2b39 s LYS 879 Cb 0.07 -3.50 0.16 0.00 -2.06 0.00 0.00 37.83 32.51 2b39 s LYS 879 CO 0.80 -0.70 1.17 -0.98 0.10 0.00 0.00 175.35 175.74 2b39 s ARG 880 N 1.40 1.17 -0.05 1.78 1.70 -1.25 0.34 118.95 124.05 2b39 s ARG 880 Ca -0.01 -0.66 -0.02 0.00 -0.47 0.00 0.00 55.73 54.57 2b39 s ARG 880 Cb -0.20 -2.06 0.03 0.00 -0.57 0.00 0.00 34.95 32.16 2b39 s ARG 880 CO 0.03 -1.95 0.10 -1.58 -1.08 0.00 0.00 175.30 170.82 2b39 s HIS 881 N -3.55 -0.08 -0.01 5.89 5.65 -1.26 -4.79 115.29 117.13 2b39 s HIS 881 Ca 0.70 0.33 0.04 0.00 0.25 0.00 0.00 55.06 56.38 2b39 s HIS 881 Cb -0.05 -0.14 -0.01 0.00 -1.18 0.00 0.00 32.58 31.20 2b39 s HIS 881 CO 0.49 -0.13 -0.14 -0.65 -0.65 0.00 0.00 174.74 173.66 2b39 s GLN 882 N 1.08 1.16 0.32 2.88 -0.21 -1.26 -4.10 119.66 119.54 2b39 s GLN 882 Ca -0.09 -0.50 0.09 0.00 0.02 0.00 0.00 55.36 54.88 2b39 s GLN 882 Cb -0.12 -1.12 -0.05 0.00 1.00 0.00 0.00 33.01 32.73 2b39 s GLN 882 CO -0.05 0.30 0.03 -0.65 -2.12 0.00 0.00 175.29 172.80 2b39 s GLN 883 N -0.31 2.17 -0.06 2.91 -0.21 -0.85 -5.00 119.66 118.31 2b39 s GLN 883 Ca 0.05 -1.63 0.01 0.00 0.02 0.00 0.00 55.36 53.81 2b39 s GLN 883 Cb -0.06 -2.03 0.02 0.00 1.00 0.00 0.00 33.01 31.94 2b39 s GLN 883 CO -0.00 0.19 -0.09 0.99 -2.12 0.00 0.00 175.29 174.25 2b39 s THR 884 N -2.45 0.92 0.02 -0.19 2.01 -1.26 -2.36 115.64 112.33 2b39 s THR 884 Ca 0.34 -0.33 -0.03 0.00 0.31 0.00 0.00 61.69 61.98 2b39 s THR 884 Cb -0.02 -0.88 -0.02 0.00 0.01 0.00 0.00 72.50 71.59 2b39 s THR 884 CO 0.20 0.31 0.03 0.27 -0.69 0.00 0.00 174.62 174.75 2b39 s ILE 885 N 0.90 0.12 -0.45 1.82 -4.36 0.39 -4.95 121.20 114.68 2b39 s ILE 885 Ca -0.11 -0.97 -0.11 0.00 -0.26 0.00 0.00 60.65 59.20 2b39 s ILE 885 Cb -0.15 -0.52 0.09 0.00 1.25 0.00 0.00 42.46 43.12 2b39 s ILE 885 CO 0.01 -0.54 0.32 -0.89 0.24 0.00 0.00 174.94 174.08 2b39 s THR 886 N -1.86 4.53 -0.31 8.37 2.01 -1.26 0.48 115.64 127.59 2b39 s THR 886 Ca -0.12 -1.38 -0.29 0.00 0.31 0.00 0.00 61.69 60.22 2b39 s THR 886 Cb -0.06 -3.79 -0.00 0.00 0.01 0.00 0.00 72.50 68.65 2b39 s THR 886 CO -0.02 -0.58 1.44 -0.63 -0.69 0.00 0.00 174.62 174.14 2b39 s ILE 887 N 1.48 3.92 0.75 1.82 1.09 0.37 -4.89 121.20 125.74 2b39 s ILE 887 Ca 0.04 1.01 -0.06 0.00 -1.10 0.00 0.00 60.65 60.53 2b39 s ILE 887 Cb -0.24 -4.02 0.09 0.00 -1.06 0.00 0.00 42.46 37.23 2b39 s ILE 887 CO 0.03 -0.51 0.20 -2.65 -0.10 0.00 0.00 174.94 171.91 2b39 n PRO 888 N 7.69 -1.21 0.00 2.79 -0.02 -1.26 -2.59 135.00 140.40 2b39 n PRO 888 Ca 0.17 -0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.29 2b39 n PRO 888 Cb 0.47 -1.23 0.00 0.00 -0.02 0.00 0.00 33.50 32.72 2b39 n PRO 888 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b39 n ALA 889 N -3.71 0.00 -3.10 3.55 0.00 -1.26 -4.03 120.51 111.95 2b39 n ALA 889 Ca 0.03 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.27 2b39 n ALA 889 Cb 0.16 0.24 -0.04 0.00 0.00 0.00 0.00 19.45 19.81 2b39 n ALA 889 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2b39 n ARG 890 N -1.32 0.75 -3.84 0.00 1.74 -1.26 -4.48 116.66 108.25 2b39 n ARG 890 Ca 0.00 -2.94 -0.22 0.00 -0.77 0.00 0.00 57.85 53.93 2b39 n ARG 890 Cb 0.00 -1.29 -0.05 0.00 -1.02 0.00 0.00 32.46 30.10 2b39 n ARG 890 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2b39 n SER 891 N 1.34 2.44 -4.53 0.55 7.64 -1.26 -4.59 113.62 115.21 2b39 n SER 891 Ca 0.19 -2.57 -0.24 0.00 1.01 0.00 0.00 58.87 57.26 2b39 n SER 891 Cb 0.56 0.40 -0.09 0.00 -1.01 0.00 0.00 64.21 64.07 2b39 n SER 891 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2b39 s SER 892 N -2.92 3.88 0.10 6.43 0.01 -1.26 -3.50 113.70 116.44 2b39 s SER 892 Ca 0.04 -0.95 0.09 0.00 1.31 0.00 0.00 55.95 56.44 2b39 s SER 892 Cb 0.00 -0.45 -0.03 0.00 0.21 0.00 0.00 66.02 65.74 2b39 s SER 892 CO 0.03 -0.02 -0.22 -0.69 0.41 0.00 0.00 173.24 172.75 2b39 s VAL 893 N -2.48 1.84 -0.08 3.43 1.01 0.92 -4.95 120.40 120.08 2b39 s VAL 893 Ca 0.31 -1.53 0.04 0.00 0.00 0.00 0.00 61.98 60.80 2b39 s VAL 893 Cb -0.04 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.69 2b39 s VAL 893 CO 0.17 0.03 -0.21 0.00 0.00 0.00 0.00 175.10 175.09 2b39 s ALA 894 N -1.07 2.32 -0.25 5.51 0.00 -1.26 -2.35 121.76 124.66 2b39 s ALA 894 Ca 0.08 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 51.07 2b39 s ALA 894 Cb -0.10 -0.86 0.06 0.00 0.00 0.00 0.00 23.12 22.23 2b39 s ALA 894 CO 0.04 0.36 -0.04 0.14 0.00 0.00 0.00 175.76 176.26 2b39 s VAL 895 N 0.02 1.55 0.30 0.00 -7.23 -0.60 -4.98 120.40 109.45 2b39 s VAL 895 Ca -0.08 -1.31 -0.29 0.00 -1.81 0.00 0.00 61.98 58.49 2b39 s VAL 895 Cb -0.15 -1.85 -0.10 0.00 0.56 0.00 0.00 36.38 34.84 2b39 s VAL 895 CO 0.05 -0.16 1.25 -2.16 -0.31 0.00 0.00 175.10 173.77 2b39 s PRO 896 N 1.37 4.44 -0.24 4.82 0.04 -1.26 -2.71 135.00 141.45 2b39 s PRO 896 Ca -0.04 2.08 -0.04 0.00 0.04 0.00 0.00 61.00 63.04 2b39 s PRO 896 Cb -0.19 -3.12 0.09 0.00 0.04 0.00 0.00 34.50 31.31 2b39 s PRO 896 CO -0.07 -0.09 0.12 0.71 0.04 0.00 0.00 177.00 177.71 2b39 s TYR 897 N -0.93 0.23 0.15 0.56 1.51 -0.64 -5.00 117.35 113.23 2b39 s TYR 897 Ca 0.49 -0.61 -0.30 0.00 -1.01 0.00 0.00 57.07 55.64 2b39 s TYR 897 Cb -0.37 -0.79 -0.07 0.00 -0.11 0.00 0.00 41.96 40.62 2b39 s TYR 897 CO 0.47 -0.70 1.06 0.08 -1.11 0.00 0.00 175.55 175.35 2b39 s VAL 898 N 2.13 4.08 -0.02 0.71 1.01 -1.26 -1.16 120.40 125.90 2b39 s VAL 898 Ca 0.06 1.75 -0.05 0.00 0.00 0.00 0.00 61.98 63.75 2b39 s VAL 898 Cb -0.16 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.10 2b39 s VAL 898 CO -0.26 0.28 0.10 -0.63 0.00 0.00 0.00 175.10 174.60 2b39 s ILE 899 N -0.08 0.05 -0.35 2.22 1.01 -0.79 -4.52 121.20 118.74 2b39 s ILE 899 Ca 0.49 -0.40 0.01 0.00 0.00 0.00 0.00 60.65 60.75 2b39 s ILE 899 Cb -0.27 -0.28 0.11 0.00 0.01 0.00 0.00 42.46 42.02 2b39 s ILE 899 CO 0.33 -0.22 0.13 -0.69 0.00 0.00 0.00 174.94 174.49 2b39 s VAL 900 N -0.71 1.28 0.71 2.92 1.01 -0.92 -0.43 120.40 124.26 2b39 s VAL 900 Ca -0.08 -1.89 -0.15 0.00 0.00 0.00 0.00 61.98 59.87 2b39 s VAL 900 Cb -0.05 -1.94 0.03 0.00 0.00 0.00 0.00 36.38 34.42 2b39 s VAL 900 CO 0.01 -0.72 1.17 -2.84 0.00 0.00 0.00 175.10 172.72 2b39 s PRO 901 N 1.14 2.32 0.03 2.72 0.02 -1.26 -1.06 135.00 138.92 2b39 s PRO 901 Ca 0.12 1.64 0.00 0.00 0.02 0.00 0.00 61.00 62.78 2b39 s PRO 901 Cb -0.20 -1.87 0.00 0.00 0.02 0.00 0.00 34.50 32.46 2b39 s PRO 901 CO -0.15 -1.67 0.00 1.28 -0.33 0.00 0.00 177.00 176.13 2b39 n LEU 902 N -2.65 0.08 -4.81 -5.54 4.77 0.10 -2.27 117.00 106.67 2b39 n LEU 902 Ca 0.12 0.06 -0.37 0.00 -0.03 0.00 0.00 56.01 55.79 2b39 n LEU 902 Cb 0.51 0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.55 2b39 n LEU 902 CO 0.48 -0.35 0.36 -0.54 -1.33 0.00 0.00 177.39 176.00 2b39 s LYS 903 N -2.00 4.25 0.00 3.23 3.01 -1.09 -4.79 119.74 122.35 2b39 s LYS 903 Ca 0.00 0.82 0.00 0.00 -1.01 0.00 0.00 55.97 55.78 2b39 s LYS 903 Cb 0.00 -3.06 0.00 0.00 -1.01 0.00 0.00 37.83 33.76 2b39 s LYS 903 CO 0.00 0.51 0.00 -0.89 0.51 0.00 0.00 175.35 175.48 2b39 n ILE 904 N 1.17 0.00 -0.65 2.17 5.41 -1.26 -4.81 119.36 121.40 2b39 n ILE 904 Ca -0.06 0.00 0.09 0.00 1.00 0.00 0.00 62.75 63.78 2b39 n ILE 904 Cb 0.51 -1.06 -0.02 0.00 -0.71 0.00 0.00 39.64 38.36 2b39 n ILE 904 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2b39 n GLY 905 N 2.64 -1.58 3.76 7.39 0.00 -1.13 -4.79 105.19 111.49 2b39 n GLY 905 Ca 0.00 -1.37 -0.39 0.00 0.00 0.00 0.00 46.02 44.26 2b39 n GLY 905 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b39 s LEU 906 N -4.38 4.42 0.02 0.99 1.43 -1.26 -2.52 118.68 117.39 2b39 s LEU 906 Ca 0.00 1.18 0.05 0.00 -1.03 0.00 0.00 54.13 54.33 2b39 s LEU 906 Cb 0.00 -2.94 -0.02 0.00 0.03 0.00 0.00 46.19 43.26 2b39 s LEU 906 CO 0.00 0.10 -0.14 -1.00 0.23 0.00 0.00 176.35 175.54 2b39 s HIS 907 N -0.21 1.23 0.02 0.29 3.76 -1.02 -4.94 115.29 114.43 2b39 s HIS 907 Ca 0.31 -0.30 -0.30 0.00 -0.15 0.00 0.00 55.06 54.62 2b39 s HIS 907 Cb -0.18 -0.76 -0.04 0.00 1.11 0.00 0.00 32.58 32.71 2b39 s HIS 907 CO 0.18 0.01 1.00 -1.21 -0.85 0.00 0.00 174.74 173.87 2b39 s GLU 908 N -0.79 4.56 -0.19 1.40 0.41 -1.26 -0.72 118.70 122.11 2b39 s GLU 908 Ca 0.03 1.46 0.00 0.00 -0.41 0.00 0.00 54.97 56.06 2b39 s GLU 908 Cb -0.07 -3.44 0.02 0.00 -1.78 0.00 0.00 34.13 28.86 2b39 s GLU 908 CO 0.01 -0.04 -0.17 0.08 -0.49 0.00 0.00 175.26 174.64 2b39 s VAL 909 N 0.90 2.24 -0.03 2.63 1.01 0.26 -4.94 120.40 122.47 2b39 s VAL 909 Ca 0.52 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.61 2b39 s VAL 909 Cb -0.22 -1.98 -0.00 0.00 0.00 0.00 0.00 36.38 34.18 2b39 s VAL 909 CO 0.28 0.48 -0.14 -0.70 0.00 0.00 0.00 175.10 175.02 2b39 s GLU 910 N 1.30 1.40 -0.07 2.72 2.12 -1.26 -0.06 118.70 124.85 2b39 s GLU 910 Ca 0.04 -0.50 0.01 0.00 0.36 0.00 0.00 54.97 54.88 2b39 s GLU 910 Cb -0.14 -1.27 0.02 0.00 0.26 0.00 0.00 34.13 33.00 2b39 s GLU 910 CO -0.11 0.23 -0.08 0.08 -0.54 0.00 0.00 175.26 174.83 2b39 s VAL 911 N -0.02 0.90 0.17 3.70 1.01 0.41 -1.21 120.40 125.36 2b39 s VAL 911 Ca -0.01 -0.30 0.07 0.00 0.00 0.00 0.00 61.98 61.74 2b39 s VAL 911 Cb -0.09 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.37 2b39 s VAL 911 CO 0.01 0.32 0.03 -0.54 0.00 0.00 0.00 175.10 174.92 2b39 s LYS 912 N 1.04 2.53 0.07 2.72 1.02 -0.47 -0.09 119.74 126.57 2b39 s LYS 912 Ca -0.08 -1.05 0.02 0.00 0.02 0.00 0.00 55.97 54.88 2b39 s LYS 912 Cb -0.14 -2.43 -0.03 0.00 -0.52 0.00 0.00 37.83 34.71 2b39 s LYS 912 CO -0.00 0.46 -0.08 0.00 -0.92 0.00 0.00 175.35 174.81 2b39 s ALA 913 N -1.74 0.80 -0.15 5.17 0.00 0.24 -0.41 121.76 125.66 2b39 s ALA 913 Ca 0.28 -1.01 -0.02 0.00 0.00 0.00 0.00 51.96 51.21 2b39 s ALA 913 Cb -0.09 0.07 0.05 0.00 0.00 0.00 0.00 23.12 23.14 2b39 s ALA 913 CO 0.20 -0.07 0.02 0.00 0.00 0.00 0.00 175.76 175.91 2b39 s ALA 914 N -2.17 0.88 0.38 0.00 0.00 -0.44 -2.89 121.76 117.53 2b39 s ALA 914 Ca -0.01 -0.49 -0.10 0.00 0.00 0.00 0.00 51.96 51.35 2b39 s ALA 914 Cb -0.05 -1.03 -0.07 0.00 0.00 0.00 0.00 23.12 21.98 2b39 s ALA 914 CO -0.01 -0.93 0.75 0.08 0.00 0.00 0.00 175.76 175.65 2b39 s VAL 915 N 1.91 4.80 0.34 0.00 1.01 -1.26 -2.26 120.40 124.93 2b39 s VAL 915 Ca 0.01 0.60 0.29 0.00 0.00 0.00 0.00 61.98 62.89 2b39 s VAL 915 Cb -0.15 -3.72 0.31 0.00 0.00 0.00 0.00 36.38 32.81 2b39 s VAL 915 CO -0.07 -0.47 2.03 0.22 0.00 0.00 0.00 175.10 176.82 2b39 h TYR 916 N 1.40 0.00 0.00 5.22 5.03 -1.99 -3.39 116.97 123.24 2b39 h TYR 916 Ca -0.47 0.00 -0.07 0.00 2.58 0.00 0.00 58.73 60.77 2b39 h TYR 916 Cb 1.19 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 39.45 2b39 h TYR 916 CO 0.61 0.12 -1.24 0.09 -1.32 0.00 0.00 178.16 176.41 2b39 n ASN 917 N -3.47 2.89 0.13 -2.11 3.02 -1.26 -4.77 115.26 109.69 2b39 n ASN 917 Ca -0.01 -0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.65 2b39 n ASN 917 Cb 0.27 -0.08 0.23 0.00 -0.61 0.00 0.00 39.78 39.59 2b39 n ASN 917 CO 0.00 0.00 0.00 -0.74 -2.62 0.00 0.00 177.26 173.90 2b39 h HIS 918 N -0.04 0.00 -1.43 3.10 2.76 -2.01 -3.43 115.15 114.10 2b39 h HIS 918 Ca -0.10 0.00 -0.38 0.00 -2.20 0.00 0.00 60.37 57.70 2b39 h HIS 918 Cb 1.14 0.00 -0.11 0.00 1.55 0.00 0.00 27.41 29.99 2b39 h HIS 918 CO 0.00 0.00 -0.38 0.34 -1.30 0.00 0.00 177.93 176.59 2b39 n PHE 919 N -2.82 -0.28 -3.73 5.26 -0.00 -1.26 -4.96 117.46 109.66 2b39 n PHE 919 Ca 0.08 0.00 -0.13 0.00 -0.00 0.00 0.00 57.45 57.40 2b39 n PHE 919 Cb 1.14 -3.29 -0.10 0.00 -0.00 0.00 0.00 39.48 37.23 2b39 n PHE 919 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 2b39 s ILE 920 N -2.76 0.01 -0.16 -2.13 1.01 -1.26 -5.15 121.20 110.76 2b39 s ILE 920 Ca 0.00 -0.09 -0.19 0.00 0.00 0.00 0.00 60.65 60.37 2b39 s ILE 920 Cb 0.00 -0.58 -0.03 0.00 0.01 0.00 0.00 42.46 41.85 2b39 s ILE 920 CO 0.00 -0.05 0.55 -0.94 0.00 0.00 0.00 174.94 174.50 2b39 s SER 921 N -0.13 6.68 -0.16 3.58 1.04 -1.26 -4.69 113.70 118.76 2b39 s SER 921 Ca -0.03 0.82 -0.05 0.00 0.48 0.00 0.00 55.95 57.17 2b39 s SER 921 Cb -0.03 -2.32 -0.03 0.00 0.10 0.00 0.00 66.02 63.74 2b39 s SER 921 CO 0.02 -0.13 -0.01 -0.62 0.98 0.00 0.00 173.24 173.47 2b39 s ASP 922 N 0.95 5.02 0.29 7.02 2.15 -1.14 -4.98 116.67 125.98 2b39 s ASP 922 Ca 0.27 -0.07 -0.13 0.00 0.43 0.00 0.00 52.55 53.05 2b39 s ASP 922 Cb -0.16 -1.82 0.01 0.00 -0.30 0.00 0.00 42.92 40.65 2b39 s ASP 922 CO 0.11 0.18 0.57 -0.83 -0.17 0.00 0.00 175.17 175.03 2b39 s GLY 923 N 0.33 0.54 -0.11 2.66 0.00 -1.26 0.80 107.32 110.27 2b39 s GLY 923 Ca -0.02 -0.85 -0.14 0.00 0.00 0.00 0.00 44.72 43.72 2b39 s GLY 923 CO 0.02 -0.53 0.36 -1.34 0.00 0.00 0.00 173.10 171.61 2b39 s VAL 924 N -3.59 0.01 0.02 1.40 -7.23 0.88 -4.96 120.40 106.92 2b39 s VAL 924 Ca 0.20 -0.10 0.03 0.00 -1.81 0.00 0.00 61.98 60.30 2b39 s VAL 924 Cb -0.02 -0.55 -0.01 0.00 0.56 0.00 0.00 36.38 36.36 2b39 s VAL 924 CO 0.11 -0.05 -0.08 -1.59 -0.31 0.00 0.00 175.10 173.17 2b39 s LYS 925 N -0.13 0.61 0.14 4.82 -2.85 -1.26 -0.45 119.74 120.63 2b39 s LYS 925 Ca -0.03 -0.50 -0.00 0.00 -1.00 0.00 0.00 55.97 54.44 2b39 s LYS 925 Cb -0.03 -0.54 -0.04 0.00 -2.06 0.00 0.00 37.83 35.16 2b39 s LYS 925 CO 0.01 0.13 0.04 0.15 0.10 0.00 0.00 175.35 175.79 2b39 s LYS 926 N -0.77 0.97 -0.14 1.78 1.02 0.92 -4.93 119.74 118.58 2b39 s LYS 926 Ca -0.01 -1.46 -0.08 0.00 0.02 0.00 0.00 55.97 54.44 2b39 s LYS 926 Cb -0.06 0.11 -0.04 0.00 -0.52 0.00 0.00 37.83 37.32 2b39 s LYS 926 CO 0.00 -0.22 0.13 0.95 -0.92 0.00 0.00 175.35 175.29 2b39 s THR 927 N -3.94 5.41 -0.20 2.17 -4.23 -1.26 0.89 115.64 114.48 2b39 s THR 927 Ca 0.24 0.18 -0.04 0.00 -1.18 0.00 0.00 61.69 60.89 2b39 s THR 927 Cb 0.07 -3.39 -0.01 0.00 1.34 0.00 0.00 72.50 70.51 2b39 s THR 927 CO 0.02 0.57 -0.04 -0.22 -0.54 0.00 0.00 174.62 174.40 2b39 s LEU 928 N -0.61 2.98 -0.13 4.79 2.96 0.11 -4.92 118.68 123.86 2b39 s LEU 928 Ca 0.13 -0.33 -0.29 0.00 -0.22 0.00 0.00 54.13 53.42 2b39 s LEU 928 Cb -0.12 -1.75 -0.03 0.00 0.50 0.00 0.00 46.19 44.80 2b39 s LEU 928 CO 0.02 0.03 1.41 -0.54 -1.32 0.00 0.00 176.35 175.95 2b39 s LYS 929 N 1.19 4.21 -0.75 1.98 -0.14 -1.26 -2.43 119.74 122.54 2b39 s LYS 929 Ca 0.02 1.85 0.02 0.00 -1.36 0.00 0.00 55.97 56.50 2b39 s LYS 929 Cb -0.14 -3.85 0.18 0.00 -1.68 0.00 0.00 37.83 32.34 2b39 s LYS 929 CO -0.01 -0.77 0.57 0.08 -0.76 0.00 0.00 175.35 174.47 2b39 s VAL 930 N 3.72 3.46 0.57 3.17 1.01 -1.05 -0.21 120.40 131.08 2b39 s VAL 930 Ca 0.62 -3.97 -0.18 0.00 0.00 0.00 0.00 61.98 58.45 2b39 s VAL 930 Cb -0.26 -3.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 2b39 s VAL 930 CO 0.20 -1.01 1.12 -0.69 0.00 0.00 0.00 175.10 174.73 2b39 s VAL 931 N -1.23 3.19 0.39 2.92 1.01 0.13 -2.82 120.40 123.99 2b39 s VAL 931 Ca 0.25 0.69 -0.18 0.00 0.00 0.00 0.00 61.98 62.73 2b39 s VAL 931 Cb -0.08 -3.25 -0.10 0.00 0.00 0.00 0.00 36.38 32.95 2b39 s VAL 931 CO -0.13 -0.21 0.86 -2.16 0.00 0.00 0.00 175.10 173.47 2b39 s PRO 932 N -3.48 4.13 1.22 2.72 0.04 -1.26 -1.46 135.00 136.91 2b39 s PRO 932 Ca 0.71 0.93 -0.16 0.00 0.04 0.00 0.00 61.00 62.53 2b39 s PRO 932 Cb -0.23 -2.28 0.27 0.00 0.04 0.00 0.00 34.50 32.30 2b39 s PRO 932 CO 0.30 0.05 0.75 -0.85 0.04 0.00 0.00 177.00 177.29 2b39 n GLU 933 N -0.53 -2.77 -0.20 4.56 0.00 -1.26 -4.79 120.64 115.66 2b39 n GLU 933 Ca 0.06 -0.79 0.03 0.00 0.00 0.00 0.00 57.16 56.45 2b39 n GLU 933 Cb 0.54 -2.00 -0.01 0.00 0.00 0.00 0.00 31.44 29.97 2b39 n GLU 933 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2b39 n GLY 934 N 1.45 -2.18 3.26 -1.84 0.00 -1.26 -4.84 105.19 99.77 2b39 n GLY 934 Ca 0.03 -1.47 -0.32 0.00 0.00 0.00 0.00 46.02 44.26 2b39 n GLY 934 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2b39 s VAL 935 N -1.05 2.27 0.24 1.61 -7.23 -0.12 -4.87 120.40 111.25 2b39 s VAL 935 Ca 0.00 -0.95 -0.30 0.00 -1.81 0.00 0.00 61.98 58.92 2b39 s VAL 935 Cb 0.00 -1.88 -0.11 0.00 0.56 0.00 0.00 36.38 34.95 2b39 s VAL 935 CO 0.00 0.55 1.53 -0.60 -0.31 0.00 0.00 175.10 176.28 2b39 s ARG 936 N 0.28 4.20 -0.01 4.82 3.52 -1.26 -0.54 118.95 129.96 2b39 s ARG 936 Ca -0.16 2.43 0.02 0.00 -0.13 0.00 0.00 55.73 57.89 2b39 s ARG 936 Cb -0.17 -3.09 -0.00 0.00 -1.56 0.00 0.00 34.95 30.13 2b39 s ARG 936 CO 0.08 -0.55 -0.08 0.08 -0.81 0.00 0.00 175.30 174.02 2b39 s VAL 937 N 0.30 0.64 -0.77 7.11 1.01 0.12 -4.88 120.40 123.92 2b39 s VAL 937 Ca 0.64 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 62.32 2b39 s VAL 937 Cb -0.45 -0.55 0.21 0.00 0.00 0.00 0.00 36.38 35.59 2b39 s VAL 937 CO 0.42 0.19 0.69 0.59 0.00 0.00 0.00 175.10 176.99 2b39 n ASN 938 N 3.04 3.72 -4.69 3.32 4.13 -1.26 -0.82 115.26 122.70 2b39 n ASN 938 Ca -0.15 -3.26 -0.42 0.00 1.68 0.00 0.00 54.58 52.43 2b39 n ASN 938 Cb 0.56 -0.85 -0.03 0.00 -1.54 0.00 0.00 39.78 37.92 2b39 n ASN 938 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2b39 s LYS 939 N -1.75 4.16 -0.18 3.52 1.02 -0.31 -4.01 119.74 122.18 2b39 s LYS 939 Ca 0.29 2.51 -0.22 0.00 0.02 0.00 0.00 55.97 58.58 2b39 s LYS 939 Cb -0.00 -3.68 -0.02 0.00 -0.52 0.00 0.00 37.83 33.60 2b39 s LYS 939 CO -0.11 -0.83 0.68 -0.08 -0.92 0.00 0.00 175.35 174.09 2b39 s THR 940 N 2.98 4.99 -0.13 2.17 -1.32 -1.26 -0.78 115.64 122.30 2b39 s THR 940 Ca 0.80 1.30 0.19 0.00 -1.21 0.00 0.00 61.69 62.76 2b39 s THR 940 Cb -0.43 -3.99 -0.22 0.00 -1.51 0.00 0.00 72.50 66.34 2b39 s THR 940 CO 0.36 0.10 0.50 0.52 -2.21 0.00 0.00 174.62 173.88 2b39 n VAL 941 N 4.66 0.93 -3.49 5.08 0.31 0.23 -4.95 118.33 121.09 2b39 n VAL 941 Ca -0.00 -0.69 -0.12 0.00 -0.01 0.00 0.00 64.34 63.52 2b39 n VAL 941 Cb 0.50 -0.45 -0.03 0.00 -0.91 0.00 0.00 33.84 32.94 2b39 n VAL 941 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2b39 s ALA 942 N -2.95 -1.75 -0.28 3.52 0.00 -1.10 -4.78 121.76 114.41 2b39 s ALA 942 Ca -0.06 0.98 -0.12 0.00 0.00 0.00 0.00 51.96 52.75 2b39 s ALA 942 Cb 0.09 0.34 0.11 0.00 0.00 0.00 0.00 23.12 23.66 2b39 s ALA 942 CO 0.84 -0.60 0.64 0.08 0.00 0.00 0.00 175.76 176.72 2b39 s VAL 943 N -2.69 -0.61 -0.03 0.00 1.01 -1.26 -0.66 120.40 116.17 2b39 s VAL 943 Ca -0.00 0.01 -0.06 0.00 0.00 0.00 0.00 61.98 61.93 2b39 s VAL 943 Cb -0.01 -0.96 0.01 0.00 0.00 0.00 0.00 36.38 35.42 2b39 s VAL 943 CO -0.05 0.01 0.15 -0.13 0.00 0.00 0.00 175.10 175.07 2b39 s ARG 944 N 2.41 0.34 0.07 2.72 1.81 -0.10 -4.94 118.95 121.26 2b39 s ARG 944 Ca -0.07 -0.10 -0.24 0.00 -1.72 0.00 0.00 55.73 53.60 2b39 s ARG 944 Cb -0.10 0.15 -0.06 0.00 -0.45 0.00 0.00 34.95 34.49 2b39 s ARG 944 CO -0.19 -0.07 0.73 -0.08 -0.68 0.00 0.00 175.30 175.01 2b39 s THR 945 N -0.68 4.66 -0.25 0.02 -1.32 -1.26 -1.19 115.64 115.62 2b39 s THR 945 Ca -0.08 1.56 -0.15 0.00 -1.21 0.00 0.00 61.69 61.82 2b39 s THR 945 Cb -0.05 -4.08 -0.04 0.00 -1.51 0.00 0.00 72.50 66.83 2b39 s THR 945 CO 0.01 0.43 0.35 -0.76 -2.21 0.00 0.00 174.62 172.44 2b39 s LEU 946 N -0.47 4.07 -0.39 9.08 1.43 0.20 -4.90 118.68 127.70 2b39 s LEU 946 Ca 0.36 0.32 -0.01 0.00 -1.03 0.00 0.00 54.13 53.76 2b39 s LEU 946 Cb -0.21 -2.41 0.19 0.00 0.03 0.00 0.00 46.19 43.80 2b39 s LEU 946 CO 0.23 -0.13 0.90 0.21 0.23 0.00 0.00 176.35 177.79 2b39 s ASN 947 N 1.44 -0.83 0.21 2.29 3.84 -1.26 0.12 114.94 120.75 2b39 s ASN 947 Ca 0.15 -0.71 -0.10 0.00 0.21 0.00 0.00 52.86 52.41 2b39 s ASN 947 Cb -0.15 1.08 0.29 0.00 -0.55 0.00 0.00 41.25 41.91 2b39 s ASN 947 CO 0.09 -0.06 1.72 -0.65 -2.79 0.00 0.00 177.10 175.41 2b39 h PRO 948 N 5.31 0.29 -0.95 0.43 0.11 -1.75 -1.11 132.00 134.32 2b39 h PRO 948 Ca 0.01 -0.02 0.22 0.00 0.11 0.00 0.00 66.00 66.32 2b39 h PRO 948 Cb 1.17 -0.07 -0.08 0.00 0.11 0.00 0.00 31.00 32.14 2b39 h PRO 948 CO -0.03 0.19 0.62 1.49 -0.21 0.00 0.00 178.00 180.07 2b39 h GLU 949 N 0.30 0.44 0.00 1.05 4.81 -1.85 0.49 114.58 119.82 2b39 h GLU 949 Ca 0.31 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.51 2b39 h GLU 949 Cb 0.44 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.72 2b39 h GLU 949 CO -0.37 0.29 -1.16 1.58 -0.73 0.00 0.00 179.01 178.62 2b39 n HIS 950 N -4.56 0.00 -0.10 0.92 -0.00 -0.96 -4.61 115.22 105.90 2b39 n HIS 950 Ca 0.21 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.39 2b39 n HIS 950 Cb 0.73 -0.15 0.00 0.00 -0.12 0.00 0.00 29.99 30.45 2b39 n HIS 950 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 2b39 n LEU 951 N -1.66 0.43 -4.96 0.27 4.77 -0.46 -5.07 117.00 110.32 2b39 n LEU 951 Ca 0.01 -0.62 -0.23 0.00 -0.03 0.00 0.00 56.01 55.14 2b39 n LEU 951 Cb 0.32 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.45 2b39 n LEU 951 CO 0.33 0.11 0.42 -0.83 -1.33 0.00 0.00 177.39 176.09 2b39 s GLY 952 N -0.38 1.76 -0.53 -0.72 0.00 0.17 -4.67 107.32 102.94 2b39 s GLY 952 Ca 0.00 -1.18 0.02 0.00 0.00 0.00 0.00 44.72 43.57 2b39 s GLY 952 CO 0.00 -0.88 0.29 1.20 0.00 0.00 0.00 173.10 173.71 2b39 s GLN 953 N -4.86 2.10 0.00 2.90 1.11 -1.23 -4.40 119.66 115.28 2b39 s GLN 953 Ca 0.57 -2.54 0.00 0.00 0.01 0.00 0.00 55.36 53.39 2b39 s GLN 953 Cb -0.10 -3.42 0.00 0.00 -1.01 0.00 0.00 33.01 28.47 2b39 s GLN 953 CO 0.40 -1.11 0.00 0.41 0.01 0.00 0.00 175.29 175.00 2b39 n GLY 954 N 3.30 1.02 2.14 3.09 0.00 -1.26 -3.81 105.19 109.67 2b39 n GLY 954 Ca 0.06 -0.23 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 2b39 n GLY 954 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b39 n GLY 955 N -1.98 0.74 2.81 -0.02 0.00 -1.26 -4.98 105.19 100.50 2b39 n GLY 955 Ca 0.00 -0.85 -0.28 0.00 0.00 0.00 0.00 46.02 44.89 2b39 n GLY 955 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b39 s VAL 956 N -2.18 2.36 0.19 1.61 1.01 -1.25 -4.32 120.40 117.82 2b39 s VAL 956 Ca 0.00 -3.82 -0.30 0.00 0.00 0.00 0.00 61.98 57.86 2b39 s VAL 956 Cb 0.00 -2.57 -0.08 0.00 0.00 0.00 0.00 36.38 33.73 2b39 s VAL 956 CO 0.00 -1.01 1.23 -1.58 0.00 0.00 0.00 175.10 173.73 2b39 s GLN 957 N -0.98 4.46 -0.11 2.72 0.74 -0.75 -3.48 119.66 122.26 2b39 s GLN 957 Ca 0.25 1.92 -0.02 0.00 0.05 0.00 0.00 55.36 57.56 2b39 s GLN 957 Cb -0.07 -3.23 0.04 0.00 1.10 0.00 0.00 33.01 30.85 2b39 s GLN 957 CO -0.14 -0.14 0.02 -0.98 -0.55 0.00 0.00 175.29 173.50 2b39 s ARG 958 N -0.19 0.58 -0.09 1.67 1.70 -1.26 -0.34 118.95 121.02 2b39 s ARG 958 Ca 0.54 -0.03 -0.01 0.00 -0.47 0.00 0.00 55.73 55.76 2b39 s ARG 958 Cb -0.34 -1.30 -0.03 0.00 -0.57 0.00 0.00 34.95 32.72 2b39 s ARG 958 CO 0.37 -0.41 -0.02 -1.21 -1.08 0.00 0.00 175.30 172.95 2b39 s GLU 959 N 1.96 3.00 -0.30 3.89 0.41 -0.33 -4.95 118.70 122.37 2b39 s GLU 959 Ca 0.03 -0.45 -0.08 0.00 -0.41 0.00 0.00 54.97 54.06 2b39 s GLU 959 Cb -0.14 -2.76 0.00 0.00 -1.78 0.00 0.00 34.13 29.46 2b39 s GLU 959 CO -0.06 0.64 0.11 -2.00 -0.49 0.00 0.00 175.26 173.46 2b39 s GLU 960 N -0.72 3.16 -0.10 1.61 -6.30 -1.26 -0.17 118.70 114.91 2b39 s GLU 960 Ca 0.11 -0.82 -0.09 0.00 -2.50 0.00 0.00 54.97 51.67 2b39 s GLU 960 Cb -0.11 -3.46 -0.04 0.00 0.00 0.00 0.00 34.13 30.51 2b39 s GLU 960 CO 0.02 -0.45 0.21 0.08 0.02 0.00 0.00 175.26 175.14 2b39 s VAL 961 N 1.54 5.38 0.37 3.70 1.01 -0.59 -5.01 120.40 126.80 2b39 s VAL 961 Ca 0.03 0.37 0.01 0.00 0.00 0.00 0.00 61.98 62.38 2b39 s VAL 961 Cb -0.17 -3.49 0.07 0.00 0.00 0.00 0.00 36.38 32.79 2b39 s VAL 961 CO 0.04 0.58 0.50 -0.81 0.00 0.00 0.00 175.10 175.41 2b39 n PRO 962 N 2.20 0.31 -3.79 2.72 -0.04 -1.26 -1.67 135.00 133.47 2b39 n PRO 962 Ca -0.18 -1.42 -0.37 0.00 -0.04 0.00 0.00 63.50 61.49 2b39 n PRO 962 Cb 0.54 -0.32 -0.06 0.00 -0.04 0.00 0.00 33.50 33.63 2b39 n PRO 962 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b39 s ALA 963 N -2.90 3.84 0.98 0.55 0.00 -1.26 -4.39 121.76 118.59 2b39 s ALA 963 Ca 0.34 -0.55 -0.11 0.00 0.00 0.00 0.00 51.96 51.63 2b39 s ALA 963 Cb -0.02 -2.06 0.18 0.00 0.00 0.00 0.00 23.12 21.22 2b39 s ALA 963 CO 0.22 0.60 1.10 0.00 0.00 0.00 0.00 175.76 177.68 2b39 s ALA 964 N -1.08 0.90 -1.12 0.00 0.00 -1.26 -4.92 121.76 114.28 2b39 s ALA 964 Ca 0.19 0.27 -0.08 0.00 0.00 0.00 0.00 51.96 52.34 2b39 s ALA 964 Cb -0.13 -3.35 0.28 0.00 0.00 0.00 0.00 23.12 19.92 2b39 s ALA 964 CO 0.08 -3.01 1.27 -3.47 0.00 0.00 0.00 175.76 170.63 2b39 n ASP 965 N -4.38 5.75 -3.25 0.00 2.03 -1.26 -4.90 116.55 110.54 2b39 n ASP 965 Ca 0.08 -3.14 -0.37 0.00 0.52 0.00 0.00 54.79 51.88 2b39 n ASP 965 Cb 0.53 -1.37 -0.03 0.00 -0.72 0.00 0.00 41.12 39.54 2b39 n ASP 965 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2b39 n LEU 966 N 2.52 8.00 -1.97 -2.67 4.77 -1.26 -4.60 117.00 121.78 2b39 n LEU 966 Ca 0.26 -4.55 -0.21 0.00 -0.03 0.00 0.00 56.01 51.48 2b39 n LEU 966 Cb 0.37 -1.42 0.17 0.00 -2.33 0.00 0.00 43.42 40.21 2b39 n LEU 966 CO 0.56 2.02 1.12 -1.54 -1.33 0.00 0.00 177.39 178.23 2b39 n SER 967 N 2.29 4.00 -0.18 -1.43 3.41 -1.26 -4.01 113.62 116.44 2b39 n SER 967 Ca 0.66 -3.69 0.00 0.00 -0.26 0.00 0.00 58.87 55.58 2b39 n SER 967 Cb 0.31 -0.79 0.00 0.00 -0.26 0.00 0.00 64.21 63.47 2b39 n SER 967 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2b39 n ASP 968 N -1.10 0.00 -4.68 4.04 5.75 -1.26 -5.07 116.55 114.23 2b39 n ASP 968 Ca 0.53 -1.04 -0.42 0.00 -0.01 0.00 0.00 54.79 53.85 2b39 n ASP 968 Cb 1.35 -0.01 -0.03 0.00 -1.03 0.00 0.00 41.12 41.41 2b39 n ASP 968 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2b39 s GLN 969 N 0.00 4.28 -0.31 0.11 -2.07 -1.25 -0.60 119.66 119.82 2b39 s GLN 969 Ca 0.00 1.83 -0.39 0.00 -1.82 0.00 0.00 55.36 54.98 2b39 s GLN 969 Cb 0.00 -3.66 -0.14 0.00 -1.09 0.00 0.00 33.01 28.12 2b39 s GLN 969 CO 0.00 -0.60 1.92 0.28 -1.32 0.00 0.00 175.29 175.57 2b39 n VAL 970 N 4.90 0.26 0.00 3.63 0.31 0.95 -4.89 118.33 123.50 2b39 n VAL 970 Ca 0.13 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 2b39 n VAL 970 Cb 0.45 -1.32 0.00 0.00 -0.91 0.00 0.00 33.84 32.05 2b39 n VAL 970 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2b39 n PRO 971 N 6.47 0.00 -0.27 5.55 -0.02 -1.26 -2.45 135.00 143.02 2b39 n PRO 971 Ca 0.33 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.79 2b39 n PRO 971 Cb 0.15 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.61 2b39 n PRO 971 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2b39 n ASP 972 N 0.00 2.09 -4.54 2.55 2.03 -1.26 -4.78 116.55 112.64 2b39 n ASP 972 Ca 0.00 -1.68 -0.25 0.00 0.52 0.00 0.00 54.79 53.38 2b39 n ASP 972 Cb 0.00 -0.49 -0.10 0.00 -0.72 0.00 0.00 41.12 39.81 2b39 n ASP 972 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2b39 s THR 973 N 1.60 2.49 0.43 5.18 -4.23 -1.03 -5.12 115.64 114.96 2b39 s THR 973 Ca 0.10 -2.20 0.08 0.00 -1.18 0.00 0.00 61.69 58.48 2b39 s THR 973 Cb 0.05 -2.58 -0.01 0.00 1.34 0.00 0.00 72.50 71.30 2b39 s THR 973 CO 0.00 -0.28 0.42 -1.61 -0.54 0.00 0.00 174.62 172.61 2b39 s GLU 974 N -3.60 2.54 0.05 3.99 2.02 -1.26 -5.00 118.70 117.43 2b39 s GLU 974 Ca 0.32 -1.54 -0.00 0.00 0.02 0.00 0.00 54.97 53.77 2b39 s GLU 974 Cb -0.01 -2.41 -0.03 0.00 0.10 0.00 0.00 34.13 31.77 2b39 s GLU 974 CO 0.17 -0.25 -0.04 -1.54 0.02 0.00 0.00 175.26 173.62 2b39 s SER 975 N -4.18 0.52 -0.19 -0.19 1.04 -1.26 -4.34 113.70 105.09 2b39 s SER 975 Ca 0.49 -0.83 -0.06 0.00 0.48 0.00 0.00 55.95 56.03 2b39 s SER 975 Cb -0.04 0.15 0.09 0.00 0.10 0.00 0.00 66.02 66.32 2b39 s SER 975 CO 0.28 -0.47 0.37 -0.70 0.98 0.00 0.00 173.24 173.70 2b39 s GLU 976 N -3.07 0.28 -0.30 4.02 2.12 -0.54 -4.49 118.70 116.73 2b39 s GLU 976 Ca -0.00 0.86 -0.11 0.00 0.36 0.00 0.00 54.97 56.09 2b39 s GLU 976 Cb 0.01 0.07 -0.03 0.00 0.26 0.00 0.00 34.13 34.45 2b39 s GLU 976 CO -0.06 -0.34 0.18 -0.08 -0.54 0.00 0.00 175.26 174.42 2b39 s THR 977 N 2.55 5.04 -0.23 -1.70 -1.32 0.56 -1.83 115.64 118.71 2b39 s THR 977 Ca 0.02 -0.10 -0.15 0.00 -1.21 0.00 0.00 61.69 60.25 2b39 s THR 977 Cb -0.13 -3.48 -0.04 0.00 -1.51 0.00 0.00 72.50 67.34 2b39 s THR 977 CO -0.12 0.15 0.35 -1.59 -2.21 0.00 0.00 174.62 171.20 2b39 s LYS 978 N 1.70 4.10 -0.24 7.08 0.00 -0.30 -2.31 119.74 129.79 2b39 s LYS 978 Ca 0.06 0.07 -0.15 0.00 0.00 0.00 0.00 55.97 55.96 2b39 s LYS 978 Cb -0.16 -3.58 -0.04 0.00 0.00 0.00 0.00 37.83 34.05 2b39 s LYS 978 CO 0.09 -0.10 0.35 0.42 0.00 0.00 0.00 175.35 176.10 2b39 s ILE 979 N 1.53 5.22 -0.05 3.79 1.01 -1.17 -2.82 121.20 128.70 2b39 s ILE 979 Ca 0.16 0.56 0.06 0.00 0.00 0.00 0.00 60.65 61.42 2b39 s ILE 979 Cb -0.15 -3.68 -0.01 0.00 0.01 0.00 0.00 42.46 38.64 2b39 s ILE 979 CO 0.08 0.23 -0.22 -0.22 0.00 0.00 0.00 174.94 174.81 2b39 s LEU 980 N 1.59 2.01 0.04 2.97 2.96 -0.63 -1.37 118.68 126.25 2b39 s LEU 980 Ca 0.15 -0.45 0.05 0.00 -0.22 0.00 0.00 54.13 53.67 2b39 s LEU 980 Cb -0.15 -1.22 -0.03 0.00 0.50 0.00 0.00 46.19 45.29 2b39 s LEU 980 CO 0.08 0.22 -0.11 -0.76 -1.32 0.00 0.00 176.35 174.46 2b39 s LEU 981 N -0.13 2.98 -0.02 -0.68 1.43 -0.24 -2.05 118.68 119.96 2b39 s LEU 981 Ca -0.03 -0.29 0.03 0.00 -1.03 0.00 0.00 54.13 52.82 2b39 s LEU 981 Cb -0.13 -1.74 -0.00 0.00 0.03 0.00 0.00 46.19 44.35 2b39 s LEU 981 CO 0.03 0.25 -0.10 -1.10 0.23 0.00 0.00 176.35 175.65 2b39 s GLN 982 N -1.63 0.94 0.16 1.70 -0.21 -0.22 -2.92 119.66 117.48 2b39 s GLN 982 Ca 0.18 -0.36 -0.09 0.00 0.02 0.00 0.00 55.36 55.11 2b39 s GLN 982 Cb -0.11 -0.89 0.03 0.00 1.00 0.00 0.00 33.01 33.04 2b39 s GLN 982 CO 0.09 0.18 1.53 0.78 -2.12 0.00 0.00 175.29 175.74 2b39 h GLY 983 N 6.11 0.98 -2.81 3.09 0.00 -0.93 -2.74 103.07 106.77 2b39 h GLY 983 Ca -0.32 -0.94 -0.46 0.00 0.00 0.00 0.00 47.33 45.61 2b39 h GLY 983 CO 0.49 0.85 -0.75 -0.51 0.00 0.00 0.00 176.54 176.63 2b39 s THR 984 N -4.48 1.70 -2.00 4.70 -4.23 -1.26 -3.65 115.64 106.42 2b39 s THR 984 Ca -0.10 -2.10 0.15 0.00 -1.18 0.00 0.00 61.69 58.46 2b39 s THR 984 Cb 0.12 -1.95 0.42 0.00 1.34 0.00 0.00 72.50 72.44 2b39 s THR 984 CO 0.87 -0.53 1.38 -0.81 -0.54 0.00 0.00 174.62 174.99 2b39 n PRO 985 N -0.15 0.71 -0.10 3.99 -0.04 -1.24 -1.99 135.00 136.19 2b39 n PRO 985 Ca -0.10 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.41 2b39 n PRO 985 Cb 0.59 -1.32 0.10 0.00 -0.04 0.00 0.00 33.50 32.83 2b39 n PRO 985 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2b39 n VAL 986 N -0.82 0.75 0.11 0.52 3.14 -1.26 -4.73 118.33 116.04 2b39 n VAL 986 Ca 0.11 -0.88 -0.11 0.00 -2.96 0.00 0.00 64.34 60.50 2b39 n VAL 986 Cb 0.05 0.67 -0.07 0.00 -1.06 0.00 0.00 33.84 33.43 2b39 n VAL 986 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2b39 h ALA 987 N 1.61 -0.89 0.42 1.55 0.00 -1.78 -2.23 119.26 117.94 2b39 h ALA 987 Ca 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2b39 h ALA 987 Cb 0.60 0.70 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 2b39 h ALA 987 CO 0.00 -0.96 -0.43 0.37 0.00 0.00 0.00 179.25 178.23 2b39 h GLN 988 N -0.54 -0.82 -0.64 0.00 -0.00 -1.85 -2.93 115.11 108.33 2b39 h GLN 988 Ca -0.01 0.06 0.13 0.00 -0.00 0.00 0.00 58.65 58.83 2b39 h GLN 988 Cb 0.52 0.19 -0.11 0.00 0.00 0.00 0.00 27.48 28.08 2b39 h GLN 988 CO -0.15 -0.55 -0.02 0.52 0.00 0.00 0.00 178.83 178.63 2b39 h MET 989 N -0.85 0.09 0.08 1.69 2.86 -1.89 -2.33 114.93 114.58 2b39 h MET 989 Ca -0.05 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2b39 h MET 989 Cb 0.74 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.38 2b39 h MET 989 CO -0.06 0.06 -0.06 1.79 1.06 0.00 0.00 176.91 179.70 2b39 h THR 990 N 0.10 0.85 0.00 2.22 1.35 -1.38 -0.12 112.91 115.93 2b39 h THR 990 Ca 0.33 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.19 2b39 h THR 990 Cb 0.54 0.85 0.00 0.00 -1.73 0.00 0.00 68.15 67.82 2b39 h THR 990 CO -0.57 0.00 0.00 1.21 -0.25 0.00 0.00 175.52 175.91 2b39 n GLU 991 N -5.17 0.23 -0.01 4.72 2.13 -0.90 -2.10 120.64 119.55 2b39 n GLU 991 Ca -0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.75 2b39 n GLU 991 Cb 0.10 -1.36 -0.02 0.00 0.27 0.00 0.00 31.44 30.43 2b39 n GLU 991 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2b39 n ASP 992 N -0.86 4.35 0.20 4.31 9.92 -0.46 -4.10 116.55 129.92 2b39 n ASP 992 Ca 0.04 0.00 0.10 0.00 -0.53 0.00 0.00 54.79 54.40 2b39 n ASP 992 Cb 0.02 0.87 0.22 0.00 -0.64 0.00 0.00 41.12 41.59 2b39 n ASP 992 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2b39 h ALA 993 N 0.20 0.91 0.18 2.24 0.00 -0.51 -2.40 119.26 119.88 2b39 h ALA 993 Ca -0.03 -0.15 -0.35 0.00 0.00 0.00 0.00 54.91 54.37 2b39 h ALA 993 Cb 0.60 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.37 2b39 h ALA 993 CO 0.00 0.21 -1.76 0.82 0.00 0.00 0.00 179.25 178.52 2b39 h ILE 994 N 0.00 0.92 -2.76 0.00 2.04 -1.77 -3.38 117.51 112.56 2b39 h ILE 994 Ca -0.00 -2.50 -0.54 0.00 1.00 0.00 0.00 64.86 62.82 2b39 h ILE 994 Cb 1.03 2.75 -0.00 0.00 -0.74 0.00 0.00 36.82 39.86 2b39 h ILE 994 CO 0.02 0.86 0.96 -0.62 0.00 0.00 0.00 178.15 179.37 2b39 s ASP 995 N -7.29 6.74 0.40 1.72 -1.08 -1.22 -4.66 116.67 111.29 2b39 s ASP 995 Ca -0.16 2.21 0.13 0.00 -0.52 0.00 0.00 52.55 54.20 2b39 s ASP 995 Cb 0.05 -2.55 0.96 0.00 -1.46 0.00 0.00 42.92 39.92 2b39 s ASP 995 CO 0.85 -0.83 1.90 1.23 0.52 0.00 0.00 175.17 178.84 2b39 h GLY 996 N 9.10 0.91 0.29 2.66 0.00 -1.88 -2.07 103.07 112.09 2b39 h GLY 996 Ca -0.39 -0.23 -0.36 0.00 0.00 0.00 0.00 47.33 46.36 2b39 h GLY 996 CO 0.93 0.07 -2.22 -2.21 0.00 0.00 0.00 176.54 173.11 2b39 n GLU 997 N -4.51 0.68 0.24 4.80 4.07 -1.26 -4.26 120.64 120.40 2b39 n GLU 997 Ca 0.16 0.14 0.08 0.00 -0.06 0.00 0.00 57.16 57.48 2b39 n GLU 997 Cb 0.51 -1.60 0.60 0.00 -0.06 0.00 0.00 31.44 30.88 2b39 n GLU 997 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2b39 h ARG 998 N 0.01 0.00 0.51 5.31 2.47 -1.79 -3.11 114.38 117.78 2b39 h ARG 998 Ca -0.49 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.22 2b39 h ARG 998 Cb 2.07 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 30.37 2b39 h ARG 998 CO 0.01 0.14 -0.39 1.25 0.56 0.00 0.00 179.97 181.55 2b39 h LEU 999 N 0.00 -1.03 -1.38 3.04 5.85 -0.84 -2.31 115.31 118.64 2b39 h LEU 999 Ca -0.00 0.07 0.22 0.00 0.84 0.00 0.00 57.88 59.01 2b39 h LEU 999 Cb 0.28 0.33 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 2b39 h LEU 999 CO 0.02 -0.57 0.92 0.11 -0.34 0.00 0.00 178.44 178.57 2b39 h LYS 1000N -0.89 0.00 -0.64 1.25 1.79 -1.76 -0.87 116.57 115.45 2b39 h LYS 1000Ca -0.06 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 2b39 h LYS 1000Cb 0.75 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.40 2b39 h LYS 1000CO 0.00 0.00 0.00 0.72 -1.08 0.00 0.00 179.45 179.09 2b39 n HIS 1001N -3.37 1.32 0.12 -1.35 8.25 -0.87 -4.29 115.22 115.03 2b39 n HIS 1001Ca 0.16 -0.53 -0.08 0.00 -0.26 0.00 0.00 57.72 57.02 2b39 n HIS 1001Cb 1.17 -0.22 -0.04 0.00 1.12 0.00 0.00 29.99 32.01 2b39 n HIS 1001CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2b39 h LEU 1002N 3.66 -0.32-10.18 2.41 3.38 -1.24 -3.44 115.31 109.58 2b39 h LEU 1002Ca 0.00 -0.10 -0.53 0.00 0.09 0.00 0.00 57.88 57.35 2b39 h LEU 1002Cb 1.31 0.08 0.14 0.00 0.09 0.00 0.00 40.66 42.29 2b39 h LEU 1002CO 0.20 0.16 0.39 -0.63 0.09 0.00 0.00 178.44 178.66 2b39 s ILE 1003N -3.08 2.49 -0.42 1.22 1.09 -1.26 -4.56 121.20 116.68 2b39 s ILE 1003Ca -0.08 0.24 0.05 0.00 -1.10 0.00 0.00 60.65 59.76 2b39 s ILE 1003Cb 0.01 -2.80 -0.00 0.00 -1.06 0.00 0.00 42.46 38.60 2b39 s ILE 1003CO 0.27 -0.13 0.43 1.67 -0.10 0.00 0.00 174.94 177.08 2b39 n GLN 1004N -2.64 2.48 -3.85 2.79 7.27 0.11 -4.99 117.38 118.54 2b39 n GLN 1004Ca 0.13 -0.42 -0.21 0.00 0.07 0.00 0.00 57.00 56.58 2b39 n GLN 1004Cb 0.51 -0.91 -0.02 0.00 2.41 0.00 0.00 30.24 32.22 2b39 n GLN 1004CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 2b39 s THR 1005N -0.89 4.48 0.50 1.69 -4.23 -1.22 -5.05 115.64 110.92 2b39 s THR 1005Ca 0.04 -1.16 -0.19 0.00 -1.18 0.00 0.00 61.69 59.20 2b39 s THR 1005Cb 0.04 -3.52 -0.08 0.00 1.34 0.00 0.00 72.50 70.28 2b39 s THR 1005CO 0.12 -0.27 1.03 -2.16 -0.54 0.00 0.00 174.62 172.80 2b39 s PRO 1006N -4.00 3.76 0.00 3.99 0.04 -1.26 -5.02 135.00 132.51 2b39 s PRO 1006Ca 0.38 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.69 2b39 s PRO 1006Cb -0.08 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.36 2b39 s PRO 1006CO 0.28 -0.45 0.00 -1.13 0.04 0.00 0.00 177.00 175.74 2b39 n SER 1007N -1.19 0.00 -0.80 6.66 3.41 -1.26 -4.89 113.62 115.55 2b39 n SER 1007Ca 0.09 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.65 2b39 n SER 1007Cb 0.53 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.49 2b39 n SER 1007CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b39 n GLY 1008N 5.00 0.46 3.39 5.00 0.00 -1.26 -4.84 105.19 112.93 2b39 n GLY 1008Ca 0.00 -0.60 -0.14 0.00 0.00 0.00 0.00 46.02 45.28 2b39 n GLY 1008CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b39 n GLY 1010N 0.48 -0.17 0.19 0.00 0.00 0.14 -1.85 105.19 103.97 2b39 n GLY 1010Ca -0.18 0.03 -0.07 0.00 0.00 0.00 0.00 46.02 45.80 2b39 n GLY 1010CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2b39 h GLU 1011N 0.00 -0.41 -1.41 1.61 4.22 -1.91 -3.35 114.58 113.33 2b39 h GLU 1011Ca 0.00 0.03 0.48 0.00 0.08 0.00 0.00 59.36 59.94 2b39 h GLU 1011Cb 0.00 0.09 -0.13 0.00 0.50 0.00 0.00 28.75 29.22 2b39 h GLU 1011CO 0.00 -0.28 0.92 1.04 -2.18 0.00 0.00 179.01 178.51 2b39 n GLN 1012N -4.35 -0.03 0.15 1.92 6.02 -1.10 -0.36 117.38 119.63 2b39 n GLN 1012Ca -0.05 1.20 0.11 0.00 -0.01 0.00 0.00 57.00 58.25 2b39 n GLN 1012Cb 0.17 -2.40 0.55 0.00 1.02 0.00 0.00 30.24 29.57 2b39 n GLN 1012CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2b39 n ASN 1013N -4.57 0.58 0.00 1.08 5.15 -0.77 -2.62 115.26 114.12 2b39 n ASN 1013Ca 0.40 0.73 0.03 0.00 -0.60 0.00 0.00 54.58 55.14 2b39 n ASN 1013Cb 1.57 -0.82 0.15 0.00 -0.53 0.00 0.00 39.78 40.16 2b39 n ASN 1013CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 2b39 n MET 1014N -2.23 0.05 0.31 1.20 2.81 0.51 -1.81 117.12 117.95 2b39 n MET 1014Ca -0.00 0.31 0.18 0.00 -1.81 0.00 0.00 57.70 56.37 2b39 n MET 1014Cb 0.09 -1.50 1.01 0.00 -0.71 0.00 0.00 33.22 32.11 2b39 n MET 1014CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 2b39 h ILE 1015N 0.00 0.31 0.00 2.02 2.10 -1.75 0.47 117.51 120.67 2b39 h ILE 1015Ca 0.00 -0.08 0.00 0.00 1.08 0.00 0.00 64.86 65.86 2b39 h ILE 1015Cb 0.09 1.06 0.00 0.00 -1.09 0.00 0.00 36.82 36.87 2b39 h ILE 1015CO 0.00 0.01 0.00 0.61 -1.08 0.00 0.00 178.15 177.69 2b39 n GLY 1016N -1.11 -0.79 1.90 8.18 0.00 -0.75 -4.45 105.19 108.16 2b39 n GLY 1016Ca -0.03 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2b39 n GLY 1016CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2b39 n MET 1017N -0.98 0.00 -0.08 1.61 2.81 0.15 -3.68 117.12 116.94 2b39 n MET 1017Ca 0.18 0.00 -0.07 0.00 -1.81 0.00 0.00 57.70 56.00 2b39 n MET 1017Cb 0.08 -0.05 -0.01 0.00 -0.71 0.00 0.00 33.22 32.53 2b39 n MET 1017CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 2b39 h THR 1018N 0.00 0.38 -0.55 2.03 2.02 -1.32 0.50 112.91 115.97 2b39 h THR 1018Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 2b39 h THR 1018Cb 0.02 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 66.78 2b39 h THR 1018CO 0.00 0.00 0.25 -0.65 0.37 0.00 0.00 175.52 175.49 2b39 h PRO 1019N -0.21 0.80 -0.56 6.66 0.11 -1.80 -2.07 132.00 134.94 2b39 h PRO 1019Ca 0.16 -0.13 -0.09 0.00 0.11 0.00 0.00 66.00 66.05 2b39 h PRO 1019Cb 0.46 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.41 2b39 h PRO 1019CO -0.44 0.67 -0.01 1.15 -0.21 0.00 0.00 178.00 179.17 2b39 h THR 1020N 0.74 1.26 -0.50 -1.15 2.02 -1.70 -1.38 112.91 112.20 2b39 h THR 1020Ca 0.19 -1.12 -0.01 0.00 0.77 0.00 0.00 66.41 66.24 2b39 h THR 1020Cb 0.15 0.84 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 2b39 h THR 1020CO -0.02 0.40 0.25 0.58 0.37 0.00 0.00 175.52 177.10 2b39 h VAL 1021N 0.89 1.16 -0.01 3.16 2.07 -0.65 -1.83 116.25 121.04 2b39 h VAL 1021Ca 0.16 -0.45 0.00 0.00 0.82 0.00 0.00 66.70 67.23 2b39 h VAL 1021Cb 0.53 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 2b39 h VAL 1021CO 0.03 0.19 -0.28 2.30 0.02 0.00 0.00 177.57 179.83 2b39 n ILE 1022N -4.39 0.00 0.03 4.57 -5.35 -0.80 -2.47 119.36 110.95 2b39 n ILE 1022Ca 0.04 -0.15 -0.20 0.00 -0.27 0.00 0.00 62.75 62.17 2b39 n ILE 1022Cb 0.12 0.52 -0.14 0.00 -1.74 0.00 0.00 39.64 38.39 2b39 n ILE 1022CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2b39 h ALA 1023N 3.73 0.38 0.29 -1.28 0.00 -0.63 -3.04 119.26 118.70 2b39 h ALA 1023Ca 0.00 -1.31 -0.01 0.00 0.00 0.00 0.00 54.91 53.59 2b39 h ALA 1023Cb 0.54 0.58 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2b39 h ALA 1023CO 0.00 1.25 -0.14 0.28 0.00 0.00 0.00 179.25 180.64 2b39 h VAL 1024N 0.07 0.00 -0.98 0.00 2.07 -1.44 0.21 116.25 116.18 2b39 h VAL 1024Ca -0.37 -0.07 0.34 0.00 0.82 0.00 0.00 66.70 67.41 2b39 h VAL 1024Cb 2.05 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 31.66 2b39 h VAL 1024CO 0.12 0.00 0.46 0.45 0.02 0.00 0.00 177.57 178.62 2b39 h HIS 1025N -0.46 0.73 0.71 1.57 -0.00 -1.67 0.49 115.15 116.52 2b39 h HIS 1025Ca -0.04 0.04 -0.03 0.00 -0.00 0.00 0.00 60.37 60.34 2b39 h HIS 1025Cb 0.29 -0.16 0.01 0.00 -0.00 0.00 0.00 27.41 27.55 2b39 h HIS 1025CO 0.12 -0.30 -0.34 -0.92 -0.00 0.00 0.00 177.93 176.48 2b39 h TYR 1026N 0.17 -0.88 -0.63 2.45 3.20 -1.39 -0.98 116.97 118.91 2b39 h TYR 1026Ca 0.74 -0.02 0.18 0.00 3.14 0.00 0.00 58.73 62.76 2b39 h TYR 1026Cb 1.75 0.29 -0.03 0.00 1.54 0.00 0.00 36.73 40.28 2b39 h TYR 1026CO -0.09 -0.55 0.45 -0.07 -1.64 0.00 0.00 178.16 176.26 2b39 h LEU 1027N -1.12 0.05 0.36 2.82 3.38 0.13 -1.01 115.31 119.91 2b39 h LEU 1027Ca -0.10 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 2b39 h LEU 1027Cb 0.73 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2b39 h LEU 1027CO 0.16 0.02 -0.17 0.44 0.09 0.00 0.00 178.44 178.98 2b39 h ASP 1028N 0.05 -0.40 -1.36 -0.43 3.32 0.09 -1.56 116.42 116.13 2b39 h ASP 1028Ca 0.30 0.01 0.39 0.00 0.02 0.00 0.00 57.03 57.76 2b39 h ASP 1028Cb 1.14 0.10 -0.05 0.00 0.22 0.00 0.00 39.33 40.74 2b39 h ASP 1028CO -0.02 -0.28 0.98 -1.28 -1.72 0.00 0.00 179.24 176.92 2b39 h SER 1029N -0.49 0.00 -0.22 6.45 0.87 0.01 -0.89 113.55 119.27 2b39 h SER 1029Ca -0.05 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.51 2b39 h SER 1029Cb 0.37 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 2b39 h SER 1029CO 0.08 0.00 0.00 0.35 -0.53 0.00 0.00 176.83 176.73 2b39 n THR 1030N -4.12 0.39 -3.69 2.23 -2.24 -0.50 -5.01 114.28 101.33 2b39 n THR 1030Ca 0.30 -0.69 -0.25 0.00 -2.27 0.00 0.00 64.05 61.13 2b39 n THR 1030Cb 1.42 1.03 0.01 0.00 -2.10 0.00 0.00 70.33 70.69 2b39 n THR 1030CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2b39 n ASP 1031N 1.00 -5.33 0.00 3.42 2.03 -0.34 -4.91 116.55 112.41 2b39 n ASP 1031Ca 0.13 -0.88 0.00 0.00 0.52 0.00 0.00 54.79 54.56 2b39 n ASP 1031Cb 0.46 -2.61 0.00 0.00 -0.72 0.00 0.00 41.12 38.25 2b39 n ASP 1031CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2b39 n GLN 1032N -3.17 1.17 0.27 -0.67 6.02 -1.15 -4.78 117.38 115.07 2b39 n GLN 1032Ca -0.19 -0.26 0.18 0.00 -0.01 0.00 0.00 57.00 56.72 2b39 n GLN 1032Cb 0.62 -0.72 0.92 0.00 1.02 0.00 0.00 30.24 32.08 2b39 n GLN 1032CO 0.00 0.00 0.00 -1.49 -1.01 0.00 0.00 177.06 174.56 2b39 h TRP 1033N 0.00 0.00 -1.10 1.08 6.55 -1.91 -2.22 115.95 118.35 2b39 h TRP 1033Ca 0.00 0.00 0.32 0.00 0.95 0.00 0.00 58.89 60.16 2b39 h TRP 1033Cb 0.08 0.00 -0.04 0.00 -0.86 0.00 0.00 29.16 28.34 2b39 h TRP 1033CO 0.00 0.00 0.88 1.05 -1.05 0.00 0.00 178.44 179.32 2b39 h GLU 1034N 0.00 0.00 -0.07 0.49 4.11 -1.93 0.24 114.58 117.42 2b39 h GLU 1034Ca 0.05 0.00 -0.21 0.00 0.07 0.00 0.00 59.36 59.26 2b39 h GLU 1034Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2b39 h GLU 1034CO -0.00 0.00 -0.83 -0.22 0.07 0.00 0.00 179.01 178.03 2b39 h LYS 1035N 0.00 0.52 -6.61 1.06 3.11 -1.76 -3.46 116.57 109.43 2b39 h LYS 1035Ca 0.52 -0.47 -0.44 0.00 -2.81 0.00 0.00 60.65 57.45 2b39 h LYS 1035Cb 2.29 0.11 0.03 0.00 -1.00 0.00 0.00 32.23 33.66 2b39 h LYS 1035CO -0.01 1.10 -0.16 -0.06 -2.81 0.00 0.00 179.45 177.52 2b39 s PHE 1036N -3.52 3.04 0.78 1.91 0.40 0.84 -5.02 117.98 116.41 2b39 s PHE 1036Ca -0.07 -0.02 -0.15 0.00 -0.60 0.00 0.00 56.93 56.09 2b39 s PHE 1036Cb 0.09 -2.37 0.01 0.00 0.51 0.00 0.00 43.02 41.26 2b39 s PHE 1036CO 0.87 -0.42 0.70 0.41 0.70 0.00 0.00 175.22 177.48 2b39 n GLY 1037N -2.02 -1.17 0.29 4.36 0.00 -1.26 -4.87 105.19 100.52 2b39 n GLY 1037Ca 0.04 -0.47 -0.04 0.00 0.00 0.00 0.00 46.02 45.55 2b39 n GLY 1037CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2b39 h LEU 1038N -0.69 0.82 -1.38 0.99 3.38 -1.94 -2.71 115.31 113.78 2b39 h LEU 1038Ca -0.45 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.50 2b39 h LEU 1038Cb 1.32 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.85 2b39 h LEU 1038CO 0.42 0.58 0.29 -0.33 0.09 0.00 0.00 178.44 179.50 2b39 h GLU 1039N 0.97 0.71 -0.65 1.13 3.07 -1.98 -3.30 114.58 114.53 2b39 h GLU 1039Ca 0.29 -0.07 0.24 0.00 -0.50 0.00 0.00 59.36 59.32 2b39 h GLU 1039Cb -0.05 -0.15 -0.12 0.00 -0.84 0.00 0.00 28.75 27.59 2b39 h GLU 1039CO -0.09 0.52 0.22 1.63 -1.40 0.00 0.00 179.01 179.89 2b39 n LYS 1040N -4.41 -0.04 -0.01 2.33 4.76 -1.02 0.59 118.16 120.35 2b39 n LYS 1040Ca 0.05 0.93 -0.13 0.00 -2.87 0.00 0.00 58.31 56.29 2b39 n LYS 1040Cb 0.09 -1.60 -0.10 0.00 -1.84 0.00 0.00 35.03 31.58 2b39 n LYS 1040CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 2b39 h ARG 1041N 0.00 -0.01 -0.45 1.97 2.43 -1.79 -1.34 114.38 115.19 2b39 h ARG 1041Ca 0.49 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.64 2b39 h ARG 1041Cb 1.21 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.74 2b39 h ARG 1041CO -0.55 0.51 0.19 0.37 -1.51 0.00 0.00 179.97 178.98 2b39 h GLN 1042N -0.53 0.67 -0.82 0.20 5.75 -0.24 0.19 115.11 120.32 2b39 h GLN 1042Ca -0.00 -0.11 0.08 0.00 -0.15 0.00 0.00 58.65 58.47 2b39 h GLN 1042Cb 0.52 -0.11 -0.06 0.00 1.07 0.00 0.00 27.48 28.90 2b39 h GLN 1042CO 0.00 0.59 0.54 0.93 -2.65 0.00 0.00 178.83 178.24 2b39 h GLU 1043N 0.59 0.81 0.04 1.69 5.08 0.15 -1.78 114.58 121.15 2b39 h GLU 1043Ca 0.15 -0.05 -0.24 0.00 -1.00 0.00 0.00 59.36 58.22 2b39 h GLU 1043Cb 0.17 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2b39 h GLU 1043CO -0.01 0.53 -1.20 0.66 -1.00 0.00 0.00 179.01 177.99 2b39 h SER 1044N 0.83 0.12 0.09 1.42 4.64 -0.79 -3.09 113.55 116.77 2b39 h SER 1044Ca 0.37 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2b39 h SER 1044Cb 0.34 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2b39 h SER 1044CO -0.14 1.12 0.00 -0.07 -0.87 0.00 0.00 176.83 176.87 2b39 h LEU 1045N 0.02 0.00 0.04 5.97 3.38 0.22 -0.69 115.31 124.26 2b39 h LEU 1045Ca -0.09 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 2b39 h LEU 1045Cb 1.87 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.62 2b39 h LEU 1045CO 0.14 0.00 -0.28 -0.33 0.09 0.00 0.00 178.44 178.06 2b39 h GLU 1046N 0.00 0.12 -0.60 1.13 4.39 -1.36 -2.91 114.58 115.35 2b39 h GLU 1046Ca 0.00 -0.18 0.12 0.00 0.34 0.00 0.00 59.36 59.64 2b39 h GLU 1046Cb 0.04 0.06 -0.10 0.00 -0.10 0.00 0.00 28.75 28.66 2b39 h GLU 1046CO 0.00 1.04 0.00 -0.07 -1.16 0.00 0.00 179.01 178.82 2b39 h LEU 1047N -0.70 -0.27 -0.84 1.33 3.38 -1.15 0.38 115.31 117.45 2b39 h LEU 1047Ca -0.05 0.15 0.05 0.00 0.09 0.00 0.00 57.88 58.12 2b39 h LEU 1047Cb 1.16 0.26 -0.06 0.00 0.09 0.00 0.00 40.66 42.12 2b39 h LEU 1047CO 0.05 -0.11 0.53 0.40 0.09 0.00 0.00 178.44 179.40 2b39 h ILE 1048N 0.12 1.09 0.14 1.22 2.04 -1.52 -0.15 117.51 120.44 2b39 h ILE 1048Ca 0.31 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 2b39 h ILE 1048Cb 0.50 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 2b39 h ILE 1048CO -0.51 0.18 -0.07 0.03 0.00 0.00 0.00 178.15 177.78 2b39 h ARG 1049N 1.00 -0.18 -0.71 2.37 3.08 -0.19 -1.46 114.38 118.29 2b39 h ARG 1049Ca 0.35 0.01 0.13 0.00 0.07 0.00 0.00 59.98 60.54 2b39 h ARG 1049Cb 0.09 0.04 -0.09 0.00 0.08 0.00 0.00 29.97 30.08 2b39 h ARG 1049CO -0.14 -0.01 0.25 -0.22 -1.07 0.00 0.00 179.97 178.77 2b39 h LYS 1050N -0.31 0.38 -0.79 0.04 3.64 -0.22 0.15 116.57 119.46 2b39 h LYS 1050Ca -0.02 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2b39 h LYS 1050Cb 0.24 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.94 2b39 h LYS 1050CO 0.03 0.25 0.52 0.78 -2.27 0.00 0.00 179.45 178.76 2b39 h GLY 1051N 0.39 1.12 0.92 5.01 0.00 -0.77 -1.26 103.07 108.47 2b39 h GLY 1051Ca 0.39 -0.42 0.02 0.00 0.00 0.00 0.00 47.33 47.31 2b39 h GLY 1051CO -0.40 0.41 0.28 -1.82 0.00 0.00 0.00 176.54 175.01 2b39 h TYR 1052N 1.08 0.53 0.53 5.60 3.20 0.33 0.54 116.97 128.77 2b39 h TYR 1052Ca 0.29 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.16 2b39 h TYR 1052Cb -0.12 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 37.97 2b39 h TYR 1052CO -0.02 0.32 -0.36 1.15 -1.64 0.00 0.00 178.16 177.61 2b39 h THR 1053N 0.57 0.27 0.16 1.81 2.02 -0.75 -1.22 112.91 115.77 2b39 h THR 1053Ca 0.18 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.38 2b39 h THR 1053Cb -0.01 0.27 -0.04 0.00 -1.74 0.00 0.00 68.15 66.64 2b39 h THR 1053CO -0.07 0.00 -0.32 1.56 0.37 0.00 0.00 175.52 177.06 2b39 h GLN 1054N -0.85 -0.54 -0.00 6.66 4.20 -0.86 -1.35 115.11 122.37 2b39 h GLN 1054Ca -0.06 0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.69 2b39 h GLN 1054Cb 0.71 0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.61 2b39 h GLN 1054CO 0.04 -0.36 0.18 0.37 -0.67 0.00 0.00 178.83 178.39 2b39 h GLN 1055N -0.56 0.00 0.00 1.46 5.75 0.14 0.66 115.11 122.56 2b39 h GLN 1055Ca 0.02 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 2b39 h GLN 1055Cb 0.58 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.13 2b39 h GLN 1055CO -0.16 0.00 0.00 1.25 -2.65 0.00 0.00 178.83 177.27 2b39 h LEU 1056N 0.00 0.00 -1.83 -2.39 5.85 -0.03 -3.03 115.31 113.89 2b39 h LEU 1056Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2b39 h LEU 1056Cb 0.37 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.39 2b39 h LEU 1056CO -0.00 0.00 -0.13 0.00 -0.34 0.00 0.00 178.44 177.97 2b39 h ALA 1057N 2.02 1.63 -0.00 1.25 0.00 0.39 -1.24 119.26 123.31 2b39 h ALA 1057Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2b39 h ALA 1057Cb 0.74 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2b39 h ALA 1057CO 0.00 0.16 -0.10 1.19 0.00 0.00 0.00 179.25 180.51 2b39 n PHE 1058N -4.16 0.00 -2.00 0.00 3.01 -1.14 -4.79 117.46 108.38 2b39 n PHE 1058Ca -0.02 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.01 2b39 n PHE 1058Cb 0.21 -0.18 -0.03 0.00 -0.01 0.00 0.00 39.48 39.47 2b39 n PHE 1058CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 2b39 s ARG 1059N -2.45 4.22 0.67 -1.08 3.52 -0.47 -2.88 118.95 120.48 2b39 s ARG 1059Ca 0.30 2.25 -0.03 0.00 -0.13 0.00 0.00 55.73 58.12 2b39 s ARG 1059Cb 0.20 -3.58 0.08 0.00 -1.56 0.00 0.00 34.95 30.09 2b39 s ARG 1059CO 0.47 -0.69 0.95 -0.65 -0.81 0.00 0.00 175.30 174.56 2b39 s GLN 1060N 2.53 2.06 0.18 5.12 -0.21 0.12 -4.98 119.66 124.48 2b39 s GLN 1060Ca 0.71 -0.71 -0.15 0.00 0.02 0.00 0.00 55.36 55.24 2b39 s GLN 1060Cb -0.38 -2.31 0.16 0.00 1.00 0.00 0.00 33.01 31.48 2b39 s GLN 1060CO 0.31 -1.20 1.66 0.87 -2.12 0.00 0.00 175.29 174.81 2b39 h LYS 1061N -0.41 0.02 -1.48 2.91 6.56 -1.94 -2.51 116.57 119.71 2b39 h LYS 1061Ca -0.41 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.18 2b39 h LYS 1061Cb 1.29 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.94 2b39 h LYS 1061CO 0.50 0.02 0.00 -1.13 -2.06 0.00 0.00 179.45 176.78 2b39 n SER 1062N -5.32 3.70 -0.21 0.86 3.41 -1.26 -4.78 113.62 110.01 2b39 n SER 1062Ca 0.04 -2.04 -0.02 0.00 -0.26 0.00 0.00 58.87 56.60 2b39 n SER 1062Cb 0.26 -0.71 -0.01 0.00 -0.26 0.00 0.00 64.21 63.49 2b39 n SER 1062CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2b39 n SER 1063N 0.98 -4.14 -4.95 4.04 7.64 -0.95 -4.91 113.62 111.33 2b39 n SER 1063Ca 0.00 0.05 -0.20 0.00 1.01 0.00 0.00 58.87 59.73 2b39 n SER 1063Cb 0.46 -2.74 0.04 0.00 -1.01 0.00 0.00 64.21 60.96 2b39 n SER 1063CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b39 s ALA 1064N -0.93 4.07 0.12 -0.43 0.00 -1.26 -4.39 121.76 118.94 2b39 s ALA 1064Ca 0.00 -1.50 0.07 0.00 0.00 0.00 0.00 51.96 50.54 2b39 s ALA 1064Cb 0.00 -1.93 -0.04 0.00 0.00 0.00 0.00 23.12 21.15 2b39 s ALA 1064CO 0.00 -0.72 -0.18 0.71 0.00 0.00 0.00 175.76 175.57 2b39 s TYR 1065N -2.70 1.64 0.02 0.00 1.51 -1.26 0.12 117.35 116.68 2b39 s TYR 1065Ca 0.58 -0.46 0.03 0.00 -1.01 0.00 0.00 57.07 56.20 2b39 s TYR 1065Cb -0.09 -0.87 -0.02 0.00 -0.11 0.00 0.00 41.96 40.87 2b39 s TYR 1065CO 0.38 0.20 -0.08 0.00 -1.11 0.00 0.00 175.55 174.94 2b39 s ALA 1066N -1.58 0.67 0.44 3.71 0.00 -1.14 -0.91 121.76 122.95 2b39 s ALA 1066Ca 0.08 -0.59 0.20 0.00 0.00 0.00 0.00 51.96 51.65 2b39 s ALA 1066Cb -0.08 -0.06 1.22 0.00 0.00 0.00 0.00 23.12 24.20 2b39 s ALA 1066CO 0.04 0.08 2.03 0.00 0.00 0.00 0.00 175.76 177.92 2b39 h ALA 1067N 5.13 1.51 -3.54 0.00 0.00 -1.90 -3.39 119.26 117.07 2b39 h ALA 1067Ca -0.34 -0.14 -0.23 0.00 0.00 0.00 0.00 54.91 54.20 2b39 h ALA 1067Cb 1.19 -0.02 -0.26 0.00 0.00 0.00 0.00 17.79 18.70 2b39 h ALA 1067CO 0.45 0.19 -0.72 -0.06 0.00 0.00 0.00 179.25 179.11 2b39 s PHE 1068N -4.44 0.16 0.28 0.00 0.40 -1.26 0.24 117.98 113.36 2b39 s PHE 1068Ca -0.03 -0.17 0.13 0.00 -0.60 0.00 0.00 56.93 56.25 2b39 s PHE 1068Cb 0.15 -0.11 0.95 0.00 0.51 0.00 0.00 43.02 44.51 2b39 s PHE 1068CO 0.64 -0.05 1.23 0.00 0.70 0.00 0.00 175.22 177.74 2b39 n GLN 1069N 2.61 -0.05 -3.02 0.44 10.64 -1.26 -2.49 117.38 124.25 2b39 n GLN 1069Ca -0.16 1.10 -0.28 0.00 -1.83 0.00 0.00 57.00 55.84 2b39 n GLN 1069Cb 0.58 -1.92 -0.05 0.00 -0.86 0.00 0.00 30.24 28.00 2b39 n GLN 1069CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 2b39 n TYR 1070N -4.85 3.94 -3.96 2.61 0.53 -1.26 -5.03 117.16 109.15 2b39 n TYR 1070Ca 0.27 -3.98 -0.08 0.00 -1.02 0.00 0.00 57.90 53.09 2b39 n TYR 1070Cb 0.91 -0.53 -0.09 0.00 -1.03 0.00 0.00 39.34 38.60 2b39 n TYR 1070CO 0.00 0.00 0.00 1.03 -1.02 0.00 0.00 176.86 176.87 2b39 s ARG 1071N -3.31 0.70 0.68 -0.72 0.52 -1.04 -5.15 118.95 110.64 2b39 s ARG 1071Ca 0.47 -1.00 -0.16 0.00 -0.52 0.00 0.00 55.73 54.52 2b39 s ARG 1071Cb 0.25 0.27 0.01 0.00 0.52 0.00 0.00 34.95 36.00 2b39 s ARG 1071CO -0.11 -0.18 1.17 -1.25 0.02 0.00 0.00 175.30 174.95 2b39 s PRO 1072N -3.59 2.51 0.63 3.54 0.04 -1.26 -4.87 135.00 132.00 2b39 s PRO 1072Ca 0.03 1.65 -0.18 0.00 0.04 0.00 0.00 61.00 62.55 2b39 s PRO 1072Cb 0.05 -1.89 -0.02 0.00 0.04 0.00 0.00 34.50 32.68 2b39 s PRO 1072CO -0.09 -1.52 1.19 -1.25 0.04 0.00 0.00 177.00 175.37 2b39 s PRO 1073N -3.85 2.79 -0.25 0.56 0.04 -1.26 -4.62 135.00 128.40 2b39 s PRO 1073Ca 0.72 1.76 -0.08 0.00 0.04 0.00 0.00 61.00 63.44 2b39 s PRO 1073Cb -0.26 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.33 2b39 s PRO 1073CO 0.41 -1.34 0.10 0.45 0.04 0.00 0.00 177.00 176.67 2b39 s SER 1074N -1.80 5.37 0.13 6.66 0.15 -0.09 -2.91 113.70 121.21 2b39 s SER 1074Ca 0.75 -0.14 -0.18 0.00 0.70 0.00 0.00 55.95 57.08 2b39 s SER 1074Cb -0.29 -1.97 -0.03 0.00 -1.71 0.00 0.00 66.02 62.02 2b39 s SER 1074CO 0.36 -0.02 1.76 0.74 1.20 0.00 0.00 173.24 177.28 2b39 h THR 1075N 5.46 1.11 0.50 6.45 2.02 -1.85 -1.26 112.91 125.34 2b39 h THR 1075Ca -0.37 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 66.54 2b39 h THR 1075Cb 1.18 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 68.29 2b39 h THR 1075CO 0.58 0.11 -0.44 -0.25 0.37 0.00 0.00 175.52 175.88 2b39 h TRP 1076N 0.39 -1.20 -0.46 3.16 7.01 -1.94 -1.59 115.95 121.33 2b39 h TRP 1076Ca 0.11 0.00 0.09 0.00 2.11 0.00 0.00 58.89 61.20 2b39 h TRP 1076Cb 0.01 0.46 -0.08 0.00 -2.10 0.00 0.00 29.16 27.45 2b39 h TRP 1076CO -0.04 -0.61 -0.01 1.25 -2.79 0.00 0.00 178.44 176.23 2b39 h LEU 1077N -0.94 -0.22 0.01 0.65 6.46 -1.89 -0.66 115.31 118.72 2b39 h LEU 1077Ca -0.05 0.11 0.03 0.00 -0.12 0.00 0.00 57.88 57.85 2b39 h LEU 1077Cb 0.81 0.20 -0.05 0.00 -0.73 0.00 0.00 40.66 40.89 2b39 h LEU 1077CO -0.03 -0.07 -0.32 0.74 -0.62 0.00 0.00 178.44 178.14 2b39 h THR 1078N 0.10 0.31 -0.15 1.05 2.02 -1.09 0.24 112.91 115.40 2b39 h THR 1078Ca 0.23 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.46 2b39 h THR 1078Cb 0.34 0.31 -0.06 0.00 -1.74 0.00 0.00 68.15 67.00 2b39 h THR 1078CO -0.39 0.00 -0.28 0.00 0.37 0.00 0.00 175.52 175.23 2b39 h ALA 1079N 0.26 -0.27 -0.78 6.16 0.00 -0.71 -0.82 119.26 123.09 2b39 h ALA 1079Ca 0.06 0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.18 2b39 h ALA 1079Cb 0.55 0.53 -0.11 0.00 0.00 0.00 0.00 17.79 18.77 2b39 h ALA 1079CO -0.26 -0.74 0.24 -0.92 0.00 0.00 0.00 179.25 177.58 2b39 h TYR 1080N -0.34 0.39 -0.01 0.00 3.20 -0.27 0.32 116.97 120.27 2b39 h TYR 1080Ca 0.10 0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.96 2b39 h TYR 1080Cb 0.50 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 2b39 h TYR 1080CO -0.38 -0.06 -0.26 0.28 -1.64 0.00 0.00 178.16 176.10 2b39 h VAL 1081N 0.32 1.19 -0.10 1.81 2.07 0.05 -1.35 116.25 120.24 2b39 h VAL 1081Ca 0.45 -0.92 -0.10 0.00 0.82 0.00 0.00 66.70 66.96 2b39 h VAL 1081Cb 0.78 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 32.03 2b39 h VAL 1081CO -0.50 0.26 -0.38 0.58 0.02 0.00 0.00 177.57 177.55 2b39 h VAL 1082N 0.01 1.29 0.11 2.57 2.07 0.96 -1.46 116.25 121.81 2b39 h VAL 1082Ca -0.00 -1.42 -0.01 0.00 0.82 0.00 0.00 66.70 66.09 2b39 h VAL 1082Cb 0.47 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 2b39 h VAL 1082CO 0.03 0.42 -0.05 0.50 0.02 0.00 0.00 177.57 178.50 2b39 h LYS 1083N 0.18 -0.14 -0.66 1.57 3.64 -0.47 -1.00 116.57 119.69 2b39 h LYS 1083Ca 0.02 0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.33 2b39 h LYS 1083Cb 0.75 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.58 2b39 h LYS 1083CO 0.06 0.30 0.09 0.28 -2.27 0.00 0.00 179.45 177.91 2b39 h VAL 1084N -0.65 1.26 -0.02 2.00 2.07 -1.37 -1.82 116.25 117.73 2b39 h VAL 1084Ca -0.01 -1.05 -0.00 0.00 0.82 0.00 0.00 66.70 66.45 2b39 h VAL 1084Cb 0.51 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2b39 h VAL 1084CO 0.02 0.39 0.01 -0.26 0.02 0.00 0.00 177.57 177.75 2b39 h PHE 1085N 1.02 0.03 -0.01 1.57 -1.00 -1.32 -0.11 116.94 117.12 2b39 h PHE 1085Ca 0.20 -0.00 0.03 0.00 2.81 0.00 0.00 57.97 61.01 2b39 h PHE 1085Cb 0.46 -0.01 -0.05 0.00 3.61 0.00 0.00 35.95 39.96 2b39 h PHE 1085CO 0.03 0.22 -0.31 0.00 -1.61 0.00 0.00 178.31 176.65 2b39 h ALA 1086N 0.81 -0.43 -0.15 2.45 0.00 -1.12 0.19 119.26 121.00 2b39 h ALA 1086Ca 0.01 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.95 2b39 h ALA 1086Cb 0.21 0.55 -0.05 0.00 0.00 0.00 0.00 17.79 18.49 2b39 h ALA 1086CO -0.00 -0.82 -0.17 -0.07 0.00 0.00 0.00 179.25 178.19 2b39 h LEU 1087N -0.45 -0.55 -1.49 0.00 3.38 -1.23 -2.13 115.31 112.84 2b39 h LEU 1087Ca 0.06 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 2b39 h LEU 1087Cb 0.54 0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 2b39 h LEU 1087CO -0.26 -0.22 -0.18 0.00 0.09 0.00 0.00 178.44 177.87 2b39 h ALA 1088N 0.84 1.12 0.00 1.53 0.00 -0.78 -3.01 119.26 118.96 2b39 h ALA 1088Ca 0.10 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2b39 h ALA 1088Cb 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2b39 h ALA 1088CO -0.28 0.22 0.24 0.00 0.00 0.00 0.00 179.25 179.44 2b39 n ALA 1089N -2.24 0.69 1.40 0.00 0.00 0.65 0.12 120.51 121.13 2b39 n ALA 1089Ca -0.01 0.12 0.14 0.00 0.00 0.00 0.00 53.44 53.69 2b39 n ALA 1089Cb 0.34 -0.85 0.45 0.00 0.00 0.00 0.00 19.45 19.39 2b39 n ALA 1089CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2b39 n ASN 1090N -2.00 1.72 0.00 0.00 4.05 -1.14 -4.31 115.26 113.59 2b39 n ASN 1090Ca -0.01 -1.55 0.00 0.00 0.45 0.00 0.00 54.58 53.47 2b39 n ASN 1090Cb 0.26 0.01 0.00 0.00 1.23 0.00 0.00 39.78 41.28 2b39 n ASN 1090CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 2b39 n LEU 1091N 0.33 0.00 -4.35 1.20 4.77 0.32 -5.11 117.00 114.16 2b39 n LEU 1091Ca 0.18 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.97 2b39 n LEU 1091Cb 0.39 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.38 2b39 n LEU 1091CO 0.17 0.00 -0.43 -0.63 -1.33 0.00 0.00 177.39 175.16 2b39 s ILE 1092N -1.00 1.72 -0.85 -0.08 -1.09 -0.13 -5.04 121.20 114.72 2b39 s ILE 1092Ca 0.00 -2.20 -0.25 0.00 -2.23 0.00 0.00 60.65 55.97 2b39 s ILE 1092Cb 0.00 -2.08 0.01 0.00 -1.58 0.00 0.00 42.46 38.81 2b39 s ILE 1092CO 0.00 -0.57 1.58 0.00 -1.23 0.00 0.00 174.94 174.72 2b39 s ALA 1093N -2.98 2.41 -0.17 9.38 0.00 -1.26 -4.46 121.76 124.67 2b39 s ALA 1093Ca 0.23 -1.60 -0.07 0.00 0.00 0.00 0.00 51.96 50.52 2b39 s ALA 1093Cb -0.00 -4.43 -0.04 0.00 0.00 0.00 0.00 23.12 18.65 2b39 s ALA 1093CO 0.07 -3.83 0.06 0.42 0.00 0.00 0.00 175.76 172.48 2b39 s ILE 1094N 6.93 4.82 -0.31 0.00 -1.09 -1.26 -4.96 121.20 125.32 2b39 s ILE 1094Ca 0.52 -0.03 -0.28 0.00 -2.23 0.00 0.00 60.65 58.63 2b39 s ILE 1094Cb -0.06 -3.16 -0.05 0.00 -1.58 0.00 0.00 42.46 37.62 2b39 s ILE 1094CO 0.04 0.48 2.17 -0.62 -1.23 0.00 0.00 174.94 175.78 2b39 s ASP 1095N 0.19 5.30 0.40 3.58 -1.08 -1.26 -4.84 116.67 118.95 2b39 s ASP 1095Ca 0.05 1.55 0.16 0.00 -0.52 0.00 0.00 52.55 53.79 2b39 s ASP 1095Cb -0.12 -2.51 0.83 0.00 -1.46 0.00 0.00 42.92 39.66 2b39 s ASP 1095CO 0.00 -2.14 1.85 0.77 0.52 0.00 0.00 175.17 176.18 2b39 h SER 1096N 15.67 0.00 0.08 -0.34 4.64 -1.96 -2.26 113.55 129.38 2b39 h SER 1096Ca -0.36 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2b39 h SER 1096Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2b39 h SER 1096CO 1.03 0.33 -0.04 0.50 -0.87 0.00 0.00 176.83 177.78 2b39 h LYS 1097N 0.00 -0.10 -0.36 4.77 1.63 -1.97 -2.58 116.57 117.96 2b39 h LYS 1097Ca -0.00 0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 59.76 2b39 h LYS 1097Cb 0.65 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.29 2b39 h LYS 1097CO 0.04 0.15 0.05 0.22 -3.45 0.00 0.00 179.45 176.46 2b39 h ASP 1098N -0.35 0.58 0.12 4.20 -0.00 -1.95 0.02 116.42 119.04 2b39 h ASP 1098Ca -0.01 -0.26 0.02 0.00 -0.00 0.00 0.00 57.03 56.77 2b39 h ASP 1098Cb 0.30 -0.15 -0.05 0.00 -0.00 0.00 0.00 39.33 39.43 2b39 h ASP 1098CO 0.02 0.70 -0.49 0.25 -0.00 0.00 0.00 179.24 179.71 2b39 h LEU 1099N 0.43 -1.48 -1.65 2.28 6.46 -1.44 0.54 115.31 120.46 2b39 h LEU 1099Ca 0.11 0.16 -0.02 0.00 -0.12 0.00 0.00 57.88 58.00 2b39 h LEU 1099Cb 0.37 0.55 -0.01 0.00 -0.73 0.00 0.00 40.66 40.84 2b39 h LEU 1099CO 0.01 -0.54 -0.04 0.00 -0.62 0.00 0.00 178.44 177.25 2b39 h GLU 1101N 0.17 0.00 0.05 0.00 4.39 0.10 0.62 114.58 119.91 2b39 h GLU 1101Ca 0.04 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.64 2b39 h GLU 1101Cb 0.19 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.85 2b39 h GLU 1101CO 0.01 0.12 -0.42 1.15 -1.16 0.00 0.00 179.01 178.71 2b39 h THR 1102N 0.00 1.59 -0.59 1.13 2.02 0.14 -2.98 112.91 114.23 2b39 h THR 1102Ca -0.00 -2.28 0.08 0.00 0.77 0.00 0.00 66.41 64.98 2b39 h THR 1102Cb 0.47 3.08 -0.06 0.00 -1.74 0.00 0.00 68.15 69.90 2b39 h THR 1102CO 0.02 0.63 0.25 0.58 0.37 0.00 0.00 175.52 177.36 2b39 h VAL 1103N -0.55 0.83 -0.51 3.16 2.07 -0.59 -0.68 116.25 119.98 2b39 h VAL 1103Ca -0.07 -0.15 0.06 0.00 0.82 0.00 0.00 66.70 67.36 2b39 h VAL 1103Cb 1.26 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 2b39 h VAL 1103CO 0.08 0.08 0.23 0.11 0.02 0.00 0.00 177.57 178.09 2b39 h LYS 1104N 0.45 0.43 -0.39 1.57 1.57 -0.97 -0.78 116.57 118.45 2b39 h LYS 1104Ca 0.29 -0.03 0.07 0.00 -1.87 0.00 0.00 60.65 59.11 2b39 h LYS 1104Cb 0.31 -0.10 -0.06 0.00 0.08 0.00 0.00 32.23 32.47 2b39 h LYS 1104CO -0.26 0.29 0.03 2.35 -0.57 0.00 0.00 179.45 181.29 2b39 h TRP 1105N 0.44 0.04 0.36 -1.35 7.01 -1.00 0.25 115.95 121.71 2b39 h TRP 1105Ca 0.23 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.26 2b39 h TRP 1105Cb 0.19 0.04 -0.02 0.00 -2.10 0.00 0.00 29.16 27.27 2b39 h TRP 1105CO -0.13 -0.04 -0.30 -0.07 -2.79 0.00 0.00 178.44 175.12 2b39 h LEU 1106N 0.15 -0.78 -0.50 0.65 3.38 -0.29 0.58 115.31 118.49 2b39 h LEU 1106Ca 0.19 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.18 2b39 h LEU 1106Cb 0.25 0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 2b39 h LEU 1106CO -0.28 -0.44 0.17 0.40 0.09 0.00 0.00 178.44 178.38 2b39 h ILE 1107N -0.66 1.22 0.06 1.22 1.08 -0.91 0.32 117.51 119.84 2b39 h ILE 1107Ca -0.03 -0.74 -0.00 0.00 -0.39 0.00 0.00 64.86 63.70 2b39 h ILE 1107Cb 0.58 0.77 0.00 0.00 -3.07 0.00 0.00 36.82 35.10 2b39 h ILE 1107CO -0.02 0.27 -0.03 -0.07 -0.69 0.00 0.00 178.15 177.61 2b39 h LEU 1108N 0.67 -0.07 -0.04 1.44 -0.00 -0.47 -3.26 115.31 113.58 2b39 h LEU 1108Ca 0.16 -0.40 -0.23 0.00 -0.00 0.00 0.00 57.88 57.41 2b39 h LEU 1108Cb 0.25 0.02 -0.01 0.00 -0.00 0.00 0.00 40.66 40.92 2b39 h LEU 1108CO -0.01 0.59 -1.06 -0.33 -0.00 0.00 0.00 178.44 177.64 2b39 h GLU 1109N -0.97 0.18 -0.00 1.13 4.39 0.05 -3.40 114.58 115.95 2b39 h GLU 1109Ca -0.01 -0.26 0.00 0.00 0.34 0.00 0.00 59.36 59.43 2b39 h GLU 1109Cb 0.46 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2b39 h GLU 1109CO 0.01 1.08 -0.18 1.63 -1.16 0.00 0.00 179.01 180.39 2b39 n LYS 1110N -3.53 2.96 -3.47 2.33 4.76 0.04 -4.97 118.16 116.28 2b39 n LYS 1110Ca -0.05 -0.37 -0.40 0.00 -2.87 0.00 0.00 58.31 54.63 2b39 n LYS 1110Cb 0.93 -0.93 -0.10 0.00 -1.84 0.00 0.00 35.03 33.09 2b39 n LYS 1110CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 2b39 s GLN 1111N -1.21 3.75 1.17 1.97 0.74 -0.82 0.11 119.66 125.36 2b39 s GLN 1111Ca 0.05 -0.34 -0.13 0.00 0.05 0.00 0.00 55.36 54.99 2b39 s GLN 1111Cb 0.05 -3.74 0.29 0.00 1.10 0.00 0.00 33.01 30.72 2b39 s GLN 1111CO 0.19 -0.37 1.03 0.15 -0.55 0.00 0.00 175.29 175.74 2b39 s LYS 1112N 1.91 -0.99 0.51 1.67 1.02 0.50 -4.89 119.74 119.46 2b39 s LYS 1112Ca 0.10 0.85 0.29 0.00 0.02 0.00 0.00 55.97 57.23 2b39 s LYS 1112Cb -0.16 -1.54 1.31 0.00 -0.52 0.00 0.00 37.83 36.91 2b39 s LYS 1112CO 0.11 -3.78 1.98 -1.00 -0.92 0.00 0.00 175.35 171.75 2b39 h PRO 1113N -2.66 0.00 -0.64 -1.68 0.13 -1.98 -3.04 132.00 122.14 2b39 h PRO 1113Ca -0.62 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 2b39 h PRO 1113Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2b39 h PRO 1113CO 0.50 0.13 0.00 -0.40 -0.23 0.00 0.00 178.00 178.00 2b39 n ASP 1114N -3.39 3.81 0.00 1.44 5.68 -1.26 -4.95 116.55 117.88 2b39 n ASP 1114Ca -0.01 -2.42 0.00 0.00 -0.50 0.00 0.00 54.79 51.87 2b39 n ASP 1114Cb 0.31 -0.53 0.00 0.00 -1.14 0.00 0.00 41.12 39.76 2b39 n ASP 1114CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2b39 n GLY 1115N 0.78 3.08 3.53 6.12 0.00 -1.15 -4.70 105.19 112.86 2b39 n GLY 1115Ca 0.19 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.89 2b39 n GLY 1115CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2b39 n ILE 1116N 0.00 2.04 -4.19 -0.61 5.41 -1.26 -4.49 119.36 116.25 2b39 n ILE 1116Ca 0.00 -0.50 -0.34 0.00 1.00 0.00 0.00 62.75 62.91 2b39 n ILE 1116Cb 0.00 -0.79 -0.12 0.00 -0.71 0.00 0.00 39.64 38.02 2b39 n ILE 1116CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2b39 s PHE 1117N -1.25 3.09 0.21 1.39 0.40 -1.26 -0.37 117.98 120.18 2b39 s PHE 1117Ca 0.62 -0.25 -0.08 0.00 -0.60 0.00 0.00 56.93 56.61 2b39 s PHE 1117Cb -0.65 -2.03 -0.07 0.00 0.51 0.00 0.00 43.02 40.78 2b39 s PHE 1117CO 0.58 -0.06 0.50 -1.14 0.70 0.00 0.00 175.22 175.80 2b39 s GLN 1118N 0.59 3.74 -0.43 0.44 0.74 0.12 -4.71 119.66 120.15 2b39 s GLN 1118Ca -0.00 0.16 0.03 0.00 0.05 0.00 0.00 55.36 55.60 2b39 s GLN 1118Cb -0.14 -2.70 0.12 0.00 1.10 0.00 0.00 33.01 31.39 2b39 s GLN 1118CO 0.02 0.35 0.16 -2.00 -0.55 0.00 0.00 175.29 173.27 2b39 s GLU 1119N -2.81 1.75 0.00 1.67 2.56 -1.26 -4.71 118.70 115.90 2b39 s GLU 1119Ca 0.45 -2.22 0.28 0.00 0.00 0.00 0.00 54.97 53.48 2b39 s GLU 1119Cb -0.11 -3.29 1.05 0.00 2.00 0.00 0.00 34.13 33.78 2b39 s GLU 1119CO 0.22 -1.03 1.74 -0.25 -0.56 0.00 0.00 175.26 175.39 2b39 n ASP 1120N 3.75 0.97 -4.98 -1.70 8.00 -1.26 -4.86 116.55 116.47 2b39 n ASP 1120Ca 0.04 -1.02 -0.19 0.00 0.71 0.00 0.00 54.79 54.33 2b39 n ASP 1120Cb 0.38 0.03 0.05 0.00 -0.02 0.00 0.00 41.12 41.56 2b39 n ASP 1120CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2b39 s GLY 1121N -2.30 1.81 0.48 0.44 0.00 -1.15 -4.94 107.32 101.67 2b39 s GLY 1121Ca 0.32 -1.90 -0.23 0.00 0.00 0.00 0.00 44.72 42.91 2b39 s GLY 1121CO 0.44 -1.52 1.24 2.56 0.00 0.00 0.00 173.10 175.82 2b39 s PRO 1122N -4.63 3.58 0.31 2.90 0.04 -1.26 -4.92 135.00 131.01 2b39 s PRO 1122Ca 0.60 1.97 -0.29 0.00 0.04 0.00 0.00 61.00 63.32 2b39 s PRO 1122Cb -0.07 -2.40 -0.10 0.00 0.04 0.00 0.00 34.50 31.97 2b39 s PRO 1122CO 0.38 -0.75 1.20 0.08 0.04 0.00 0.00 177.00 177.94 2b39 s VAL 1123N -1.43 3.11 -0.17 -0.36 1.01 -1.26 -4.90 120.40 116.40 2b39 s VAL 1123Ca 0.65 1.11 -0.03 0.00 0.00 0.00 0.00 61.98 63.72 2b39 s VAL 1123Cb -0.33 -3.71 -0.09 0.00 0.00 0.00 0.00 36.38 32.24 2b39 s VAL 1123CO 0.40 0.26 -0.18 -0.38 0.00 0.00 0.00 175.10 175.21 2b39 n ILE 1124N 0.97 0.95 -4.06 2.22 5.41 -1.26 -4.28 119.36 119.30 2b39 n ILE 1124Ca -0.00 -0.31 -0.35 0.00 1.00 0.00 0.00 62.75 63.08 2b39 n ILE 1124Cb 0.43 -1.34 -0.12 0.00 -0.71 0.00 0.00 39.64 37.90 2b39 n ILE 1124CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 2b39 s HIS 1125N -2.33 3.08 0.18 1.39 2.46 -1.26 -3.63 115.29 115.19 2b39 s HIS 1125Ca -0.23 -0.32 -0.25 0.00 0.47 0.00 0.00 55.06 54.73 2b39 s HIS 1125Cb 0.07 -2.09 0.05 0.00 -0.13 0.00 0.00 32.58 30.48 2b39 s HIS 1125CO 0.35 -0.15 1.48 0.94 -2.47 0.00 0.00 174.74 174.89 2b39 n GLN 1126N 4.11 -0.34 0.00 2.88 7.27 -1.26 -1.67 117.38 128.36 2b39 n GLN 1126Ca -0.17 1.46 0.00 0.00 0.07 0.00 0.00 57.00 58.36 2b39 n GLN 1126Cb 0.52 -2.15 0.00 0.00 2.41 0.00 0.00 30.24 31.01 2b39 n GLN 1126CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 2b39 n GLU 1127N -5.28 0.00 -2.27 3.69 4.07 -1.26 -3.46 120.64 116.13 2b39 n GLU 1127Ca 0.05 0.00 -0.13 0.00 -0.06 0.00 0.00 57.16 57.02 2b39 n GLU 1127Cb 0.30 -1.41 0.04 0.00 -0.06 0.00 0.00 31.44 30.31 2b39 n GLU 1127CO 0.00 0.00 0.00 -1.33 -0.06 0.00 0.00 177.13 175.74 2b39 n MET 1128N 0.96 2.71 -3.71 5.31 2.81 -0.67 -4.69 117.12 119.85 2b39 n MET 1128Ca 0.00 -3.82 -0.12 0.00 -1.81 0.00 0.00 57.70 51.94 2b39 n MET 1128Cb 0.00 -1.93 -0.13 0.00 -0.71 0.00 0.00 33.22 30.45 2b39 n MET 1128CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2b39 s ILE 1129N -4.12 -0.14 -0.56 2.02 1.01 -1.22 -4.93 121.20 113.25 2b39 s ILE 1129Ca 0.41 0.17 -0.22 0.00 0.00 0.00 0.00 60.65 61.01 2b39 s ILE 1129Cb 0.37 -0.43 0.06 0.00 0.01 0.00 0.00 42.46 42.47 2b39 s ILE 1129CO -0.00 0.07 0.82 -0.83 0.00 0.00 0.00 174.94 175.00 2b39 s GLY 1130N 1.58 1.56 0.32 6.18 0.00 -1.26 -4.94 107.32 110.76 2b39 s GLY 1130Ca -0.07 -1.62 -0.06 0.00 0.00 0.00 0.00 44.72 42.97 2b39 s GLY 1130CO -0.09 1.81 0.61 -0.32 0.00 0.00 0.00 173.10 175.11 2b39 s GLY 1131N 3.03 1.85 0.08 0.20 0.00 -1.26 -4.79 107.32 106.41 2b39 s GLY 1131Ca 0.22 -0.49 0.00 0.00 0.00 0.00 0.00 44.72 44.45 2b39 s GLY 1131CO 0.14 -0.36 0.00 0.69 0.00 0.00 0.00 173.10 173.57 2b39 n PHE 1132N -1.10 -2.27 0.09 1.90 3.72 -1.26 -3.53 117.46 115.01 2b39 n PHE 1132Ca -0.01 0.42 0.18 0.00 -0.05 0.00 0.00 57.45 57.99 2b39 n PHE 1132Cb 0.54 -0.60 0.51 0.00 -0.94 0.00 0.00 39.48 38.99 2b39 n PHE 1132CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 176.76 176.78 2b39 h ARG 1133N 0.00 0.00 -4.86 -1.08 0.11 -2.01 -3.24 114.38 103.31 2b39 h ARG 1133Ca 0.01 0.00 -0.61 0.00 0.10 0.00 0.00 59.98 59.48 2b39 h ARG 1133Cb 0.31 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.37 2b39 h ARG 1133CO 0.00 0.00 2.26 -0.25 0.10 0.00 0.00 179.97 182.08 2b39 n ASP 1134N -3.15 3.55 0.18 0.08 8.00 -1.23 -4.62 116.55 119.35 2b39 n ASP 1134Ca 0.09 -2.78 0.12 0.00 0.71 0.00 0.00 54.79 52.93 2b39 n ASP 1134Cb 0.94 -1.54 0.63 0.00 -0.02 0.00 0.00 41.12 41.14 2b39 n ASP 1134CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 2b39 h THR 1135N 4.93 0.00 -4.22 -3.53 1.35 -1.82 -3.41 112.91 106.21 2b39 h THR 1135Ca 0.43 -0.03 -0.52 0.00 -0.55 0.00 0.00 66.41 65.74 2b39 h THR 1135Cb 0.76 0.59 0.12 0.00 -1.73 0.00 0.00 68.15 67.89 2b39 h THR 1135CO 1.68 0.00 0.36 -0.13 -0.25 0.00 0.00 175.52 177.18 2b39 s ARG 1136N -3.58 2.46 -0.26 4.72 0.52 -1.26 -2.71 118.95 118.84 2b39 s ARG 1136Ca -0.02 1.43 0.00 0.00 -0.52 0.00 0.00 55.73 56.62 2b39 s ARG 1136Cb 0.07 -1.90 0.00 0.00 0.52 0.00 0.00 34.95 33.64 2b39 s ARG 1136CO 0.24 -1.52 0.00 0.39 0.02 0.00 0.00 175.30 174.43 2b39 n GLU 1137N -2.79 -1.06 -2.97 3.54 1.02 -1.26 -4.83 120.64 112.29 2b39 n GLU 1137Ca 0.11 0.41 -0.41 0.00 -0.02 0.00 0.00 57.16 57.25 2b39 n GLU 1137Cb 0.52 -4.29 -0.05 0.00 -0.02 0.00 0.00 31.44 27.60 2b39 n GLU 1137CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2b39 s LYS 1138N -1.51 4.21 0.00 3.49 2.20 -1.10 -3.83 119.74 123.19 2b39 s LYS 1138Ca 0.00 0.84 0.00 0.00 -0.36 0.00 0.00 55.97 56.45 2b39 s LYS 1138Cb 0.00 -3.62 0.00 0.00 -1.51 0.00 0.00 37.83 32.70 2b39 s LYS 1138CO 0.00 -0.40 0.00 -0.25 -0.36 0.00 0.00 175.35 174.34 2b39 n ASP 1139N 5.59 0.00 0.17 1.43 8.00 -1.26 -4.88 116.55 125.60 2b39 n ASP 1139Ca 0.03 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.39 2b39 n ASP 1139Cb 0.48 -0.58 -0.08 0.00 -0.02 0.00 0.00 41.12 40.92 2b39 n ASP 1139CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2b39 h VAL 1140N 0.00 0.72 -0.20 2.53 2.07 -1.97 0.10 116.25 119.50 2b39 h VAL 1140Ca 0.00 -0.40 0.05 0.00 0.82 0.00 0.00 66.70 67.17 2b39 h VAL 1140Cb 0.00 0.93 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 2b39 h VAL 1140CO 0.00 0.08 -0.13 0.28 0.02 0.00 0.00 177.57 177.82 2b39 h SER 1141N -0.64 -0.44 -0.21 0.57 0.02 -1.88 -1.79 113.55 109.19 2b39 h SER 1141Ca -0.04 0.09 -0.06 0.00 -0.84 0.00 0.00 61.79 60.94 2b39 h SER 1141Cb 0.45 0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.21 2b39 h SER 1141CO 0.07 -0.17 -0.12 0.25 -1.14 0.00 0.00 176.83 175.72 2b39 h LEU 1142N -0.13 0.47 -1.08 5.07 5.85 -1.83 -1.81 115.31 121.86 2b39 h LEU 1142Ca 0.12 -0.42 0.07 0.00 0.84 0.00 0.00 57.88 58.48 2b39 h LEU 1142Cb 0.30 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.14 2b39 h LEU 1142CO -0.28 0.79 0.62 0.74 -0.34 0.00 0.00 178.44 179.97 2b39 h THR 1143N 0.15 1.06 -0.27 1.05 2.02 -0.68 0.59 112.91 116.83 2b39 h THR 1143Ca 0.04 -0.37 -0.11 0.00 0.77 0.00 0.00 66.41 66.74 2b39 h THR 1143Cb 0.62 -0.13 -0.00 0.00 -1.74 0.00 0.00 68.15 66.90 2b39 h THR 1143CO 0.03 0.20 -0.26 0.00 0.37 0.00 0.00 175.52 175.86 2b39 h ALA 1144N 1.49 0.40 0.38 6.16 0.00 -1.29 0.80 119.26 127.19 2b39 h ALA 1144Ca 0.42 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2b39 h ALA 1144Cb 0.22 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2b39 h ALA 1144CO -0.17 0.39 -0.49 0.35 0.00 0.00 0.00 179.25 179.33 2b39 h PHE 1145N 0.39 -1.39 -0.68 0.00 3.57 -0.37 0.43 116.94 118.89 2b39 h PHE 1145Ca 0.04 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.65 2b39 h PHE 1145Cb 0.83 0.56 -0.07 0.00 2.79 0.00 0.00 35.95 40.06 2b39 h PHE 1145CO 0.07 -0.63 0.34 0.28 -2.23 0.00 0.00 178.31 176.14 2b39 h VAL 1146N -0.90 0.86 -0.29 1.41 2.07 -0.93 -1.93 116.25 116.54 2b39 h VAL 1146Ca -0.05 -0.20 0.06 0.00 0.82 0.00 0.00 66.70 67.34 2b39 h VAL 1146Cb 0.81 0.23 -0.06 0.00 -1.52 0.00 0.00 31.29 30.74 2b39 h VAL 1146CO -0.12 0.11 -0.14 0.25 0.02 0.00 0.00 177.57 177.68 2b39 h LEU 1147N 0.58 -0.47 -0.33 2.57 5.85 -0.13 -0.22 115.31 123.17 2b39 h LEU 1147Ca 0.33 0.11 0.07 0.00 0.84 0.00 0.00 57.88 59.23 2b39 h LEU 1147Cb 0.33 0.26 -0.06 0.00 0.37 0.00 0.00 40.66 41.56 2b39 h LEU 1147CO -0.26 -0.18 -0.09 0.40 -0.34 0.00 0.00 178.44 177.98 2b39 h ILE 1148N -0.10 0.66 0.12 4.05 2.04 -0.18 0.12 117.51 124.23 2b39 h ILE 1148Ca 0.15 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.02 2b39 h ILE 1148Cb 0.33 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 2b39 h ILE 1148CO -0.35 0.00 -0.23 0.00 0.00 0.00 0.00 178.15 177.57 2b39 h ALA 1149N 1.32 -0.40 -0.68 1.87 0.00 -0.76 -1.76 119.26 118.85 2b39 h ALA 1149Ca 0.16 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.10 2b39 h ALA 1149Cb 0.25 0.37 -0.06 0.00 0.00 0.00 0.00 17.79 18.34 2b39 h ALA 1149CO -0.34 -0.77 0.36 -0.07 0.00 0.00 0.00 179.25 178.43 2b39 h LEU 1150N -0.43 0.51 -1.73 0.00 3.38 -0.73 -0.76 115.31 115.54 2b39 h LEU 1150Ca 0.03 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.13 2b39 h LEU 1150Cb 0.45 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 2b39 h LEU 1150CO -0.13 0.31 0.36 -0.74 0.09 0.00 0.00 178.44 178.33 2b39 h HIS 1151N 0.64 0.33 -0.22 1.13 2.76 -0.08 0.95 115.15 120.66 2b39 h HIS 1151Ca 0.32 0.01 -0.14 0.00 -2.20 0.00 0.00 60.37 58.36 2b39 h HIS 1151Cb 0.27 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.11 2b39 h HIS 1151CO -0.09 0.16 -0.46 1.49 -1.30 0.00 0.00 177.93 177.73 2b39 h GLU 1152N 0.31 0.56 -0.26 5.26 4.57 -0.30 -2.11 114.58 122.61 2b39 h GLU 1152Ca 0.24 -0.31 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2b39 h GLU 1152Cb 0.54 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.15 2b39 h GLU 1152CO -0.06 0.90 0.00 0.00 -1.18 0.00 0.00 179.01 178.68 2b39 n ALA 1153N -2.51 2.47 -0.35 2.92 0.00 0.04 -4.34 120.51 118.75 2b39 n ALA 1153Ca -0.02 -0.48 0.16 0.00 0.00 0.00 0.00 53.44 53.10 2b39 n ALA 1153Cb 0.55 -1.00 0.37 0.00 0.00 0.00 0.00 19.45 19.37 2b39 n ALA 1153CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2b39 h LYS 1154N 1.62 0.62 0.00 0.00 3.64 -0.19 -2.52 116.57 119.73 2b39 h LYS 1154Ca 0.00 -0.04 -0.26 0.00 -1.27 0.00 0.00 60.65 59.08 2b39 h LYS 1154Cb 0.37 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 32.01 2b39 h LYS 1154CO 0.00 0.41 -1.43 -0.25 -2.27 0.00 0.00 179.45 175.91 2b39 n ASP 1155N -4.82 1.87 -0.17 4.20 8.00 -1.26 -3.17 116.55 121.20 2b39 n ASP 1155Ca 0.25 0.41 0.28 0.00 0.71 0.00 0.00 54.79 56.45 2b39 n ASP 1155Cb 0.69 -0.95 0.72 0.00 -0.02 0.00 0.00 41.12 41.57 2b39 n ASP 1155CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2b39 h ILE 1156N -1.00 0.53 0.00 0.53 5.03 -1.81 -0.43 117.51 120.36 2b39 h ILE 1156Ca -0.40 0.00 -0.00 0.00 -0.12 0.00 0.00 64.86 64.34 2b39 h ILE 1156Cb 1.35 0.55 -0.00 0.00 -3.03 0.00 0.00 36.82 35.69 2b39 h ILE 1156CO -0.24 0.00 -0.04 0.00 -0.68 0.00 0.00 178.15 177.19 2b39 h GLU 1158N 0.04 -0.12 0.10 0.00 4.57 -1.02 -1.49 114.58 116.66 2b39 h GLU 1158Ca -0.00 0.01 -0.14 0.00 -1.18 0.00 0.00 59.36 58.05 2b39 h GLU 1158Cb 1.02 0.03 0.02 0.00 -0.16 0.00 0.00 28.75 29.65 2b39 h GLU 1158CO 0.00 -0.08 -0.62 0.00 -1.18 0.00 0.00 179.01 177.14 2b39 h ALA 1159N 1.07 -0.06 -0.77 2.92 0.00 -1.87 -3.36 119.26 117.19 2b39 h ALA 1159Ca 0.15 -0.64 0.18 0.00 0.00 0.00 0.00 54.91 54.59 2b39 h ALA 1159Cb 0.35 0.07 -0.14 0.00 0.00 0.00 0.00 17.79 18.07 2b39 h ALA 1159CO -0.35 0.29 -0.01 1.96 0.00 0.00 0.00 179.25 181.13 2b39 h GLN 1160N -0.50 0.08 -5.11 0.00 1.08 -1.84 -3.38 115.11 105.45 2b39 h GLN 1160Ca -0.11 -0.01 -0.67 0.00 -1.45 0.00 0.00 58.65 56.42 2b39 h GLN 1160Cb 1.48 -0.02 -0.33 0.00 -0.05 0.00 0.00 27.48 28.56 2b39 h GLN 1160CO 0.12 0.06 -0.83 0.08 -0.95 0.00 0.00 178.83 177.30 2b39 s VAL 1161N -6.12 2.36 -0.42 -0.54 1.01 -0.57 -4.99 120.40 111.13 2b39 s VAL 1161Ca -0.14 -0.85 0.06 0.00 0.00 0.00 0.00 61.98 61.05 2b39 s VAL 1161Cb 0.23 -2.00 0.49 0.00 0.00 0.00 0.00 36.38 35.10 2b39 s VAL 1161CO 0.76 0.52 1.43 0.59 0.00 0.00 0.00 175.10 178.40 2b39 n ASN 1162N 4.42 3.82 0.00 3.32 3.02 -1.26 -3.77 115.26 124.81 2b39 n ASN 1162Ca -0.20 -2.79 0.00 0.00 -0.03 0.00 0.00 54.58 51.56 2b39 n ASN 1162Cb 0.51 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 39.01 2b39 n ASN 1162CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2b39 n SER 1163N -0.01 4.66 -0.19 6.41 7.64 -1.26 -4.77 113.62 126.09 2b39 n SER 1163Ca 0.27 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 60.11 2b39 n SER 1163Cb 1.04 0.88 0.03 0.00 -1.01 0.00 0.00 64.21 65.15 2b39 n SER 1163CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2b39 h LEU 1164N 0.00 -0.91 -0.24 -3.43 6.46 -1.91 0.14 115.31 115.42 2b39 h LEU 1164Ca 0.00 0.21 0.06 0.00 -0.12 0.00 0.00 57.88 58.03 2b39 h LEU 1164Cb 0.09 0.49 -0.07 0.00 -0.73 0.00 0.00 40.66 40.44 2b39 h LEU 1164CO 0.00 -0.27 -0.31 1.23 -0.62 0.00 0.00 178.44 178.47 2b39 h GLY 1165N -0.11 -0.32 1.04 3.75 0.00 -1.86 -0.33 103.07 105.23 2b39 h GLY 1165Ca 0.26 0.38 -0.08 0.00 0.00 0.00 0.00 47.33 47.89 2b39 h GLY 1165CO -0.65 -0.21 0.07 3.21 0.00 0.00 0.00 176.54 178.96 2b39 h ARG 1166N -0.32 1.00 -0.02 4.80 2.47 -1.66 -2.75 114.38 117.90 2b39 h ARG 1166Ca 0.13 -0.28 0.01 0.00 -1.26 0.00 0.00 59.98 58.57 2b39 h ARG 1166Cb 0.52 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.73 2b39 h ARG 1166CO -0.42 0.95 -0.01 1.03 0.56 0.00 0.00 179.97 182.08 2b39 h SER 1167N 0.89 -0.04 -0.82 7.04 0.87 -0.25 -1.52 113.55 119.72 2b39 h SER 1167Ca 0.18 0.01 0.05 0.00 -1.23 0.00 0.00 61.79 60.80 2b39 h SER 1167Cb 0.46 0.02 -0.06 0.00 -0.44 0.00 0.00 62.40 62.39 2b39 h SER 1167CO 0.02 -0.02 0.51 0.40 -0.53 0.00 0.00 176.83 177.21 2b39 h ILE 1168N -0.02 1.06 -0.19 2.23 2.04 -1.05 -1.76 117.51 119.83 2b39 h ILE 1168Ca 0.01 -0.33 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 2b39 h ILE 1168Cb 0.03 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.13 2b39 h ILE 1168CO -0.03 0.17 0.06 0.00 0.00 0.00 0.00 178.15 178.36 2b39 h ALA 1169N 1.37 0.25 0.12 1.87 0.00 -1.24 -2.08 119.26 119.55 2b39 h ALA 1169Ca 0.35 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.14 2b39 h ALA 1169Cb 0.12 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2b39 h ALA 1169CO -0.15 -0.14 -0.20 0.87 0.00 0.00 0.00 179.25 179.63 2b39 h LYS 1170N 0.13 -0.37 -0.63 0.00 1.57 -0.94 0.16 116.57 116.49 2b39 h LYS 1170Ca 0.06 0.03 0.14 0.00 -1.87 0.00 0.00 60.65 59.01 2b39 h LYS 1170Cb 0.22 0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.58 2b39 h LYS 1170CO -0.00 -0.25 0.43 0.00 -0.57 0.00 0.00 179.45 179.06 2b39 h ALA 1171N 0.42 2.23 -0.07 3.86 0.00 -1.31 -0.46 119.26 123.93 2b39 h ALA 1171Ca 0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2b39 h ALA 1171Cb 0.40 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2b39 h ALA 1171CO -0.11 -0.40 -0.02 0.78 0.00 0.00 0.00 179.25 179.51 2b39 h GLY 1172N 0.26 0.15 0.77 0.00 0.00 -0.47 -2.29 103.07 101.50 2b39 h GLY 1172Ca 0.30 -0.13 0.03 0.00 0.00 0.00 0.00 47.33 47.54 2b39 h GLY 1172CO -0.07 0.12 0.18 -0.55 0.00 0.00 0.00 176.54 176.22 2b39 h ASP 1173N -0.19 0.26 0.02 0.19 3.32 0.46 0.16 116.42 120.65 2b39 h ASP 1173Ca 0.02 0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.12 2b39 h ASP 1173Cb 0.41 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.89 2b39 h ASP 1173CO 0.01 0.19 -0.27 0.15 -1.72 0.00 0.00 179.24 177.60 2b39 h PHE 1174N 0.38 -0.72 0.71 4.55 3.57 -1.11 0.15 116.94 124.47 2b39 h PHE 1174Ca 0.17 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.66 2b39 h PHE 1174Cb 0.09 0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 2b39 h PHE 1174CO -0.11 -0.36 -0.47 -0.07 -2.23 0.00 0.00 178.31 175.07 2b39 h LEU 1175N -0.42 -1.20 -1.41 0.59 3.38 -1.11 -0.40 115.31 114.74 2b39 h LEU 1175Ca 0.06 0.07 0.30 0.00 0.09 0.00 0.00 57.88 58.40 2b39 h LEU 1175Cb 0.50 0.36 -0.10 0.00 0.09 0.00 0.00 40.66 41.51 2b39 h LEU 1175CO -0.22 -0.70 0.71 -0.08 0.09 0.00 0.00 178.44 178.24 2b39 h GLU 1176N -1.11 0.30 0.05 1.13 4.81 -0.81 0.06 114.58 119.00 2b39 h GLU 1176Ca -0.09 -0.02 -0.24 0.00 -0.13 0.00 0.00 59.36 58.88 2b39 h GLU 1176Cb 0.90 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.20 2b39 h GLU 1176CO 0.07 0.20 -1.15 -0.91 -0.73 0.00 0.00 179.01 176.50 2b39 h ASN 1177N 0.31 0.15 -0.55 1.04 2.35 -0.26 -3.28 115.58 115.33 2b39 h ASN 1177Ca 0.64 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 56.22 2b39 h ASN 1177Cb 1.76 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 40.08 2b39 h ASN 1177CO -0.31 1.13 0.00 1.41 -1.65 0.00 0.00 177.43 178.02 2b39 n HIS 1178N -3.39 0.78 -0.06 1.19 8.25 -0.14 -4.47 115.22 117.38 2b39 n HIS 1178Ca -0.04 -0.38 -0.10 0.00 -0.26 0.00 0.00 57.72 56.93 2b39 n HIS 1178Cb 0.98 -0.02 -0.04 0.00 1.12 0.00 0.00 29.99 32.03 2b39 n HIS 1178CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 2b39 h TYR 1179N 3.23 0.32 -1.02 4.41 3.20 -1.22 -2.91 116.97 122.98 2b39 h TYR 1179Ca 0.00 -0.01 0.26 0.00 3.14 0.00 0.00 58.73 62.12 2b39 h TYR 1179Cb 0.78 -0.10 -0.08 0.00 1.54 0.00 0.00 36.73 38.88 2b39 h TYR 1179CO 0.39 0.31 0.68 0.07 -1.64 0.00 0.00 178.16 177.97 2b39 h ARG 1180N 0.23 0.31 0.00 1.82 0.11 -1.84 -0.22 114.38 114.78 2b39 h ARG 1180Ca 0.08 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.14 2b39 h ARG 1180Cb 0.11 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.13 2b39 h ARG 1180CO -0.01 0.20 0.00 0.93 0.10 0.00 0.00 179.97 181.19 2b39 h GLU 1181N 0.32 0.00 -7.09 0.08 5.08 -1.84 -3.46 114.58 107.66 2b39 h GLU 1181Ca 0.55 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 58.37 2b39 h GLU 1181Cb 1.55 0.00 0.14 0.00 0.50 0.00 0.00 28.75 30.94 2b39 h GLU 1181CO -0.21 0.00 0.51 -0.51 -1.00 0.00 0.00 179.01 177.80 2b39 s LEU 1182N -5.84 3.66 0.00 1.33 1.43 -0.09 -4.77 118.68 114.40 2b39 s LEU 1182Ca 0.05 2.55 0.00 0.00 -1.03 0.00 0.00 54.13 55.70 2b39 s LEU 1182Cb 0.08 -4.56 0.00 0.00 0.03 0.00 0.00 46.19 41.74 2b39 s LEU 1182CO 0.60 -1.77 0.00 0.54 0.23 0.00 0.00 176.35 175.95 2b39 n ARG 1183N -1.63 0.13 -2.47 1.70 1.74 -1.26 -5.02 116.66 109.85 2b39 n ARG 1183Ca 0.14 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.81 2b39 n ARG 1183Cb 0.48 -0.56 -0.04 0.00 -1.02 0.00 0.00 32.46 31.32 2b39 n ARG 1183CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2b39 s ARG 1184N -1.13 4.58 0.16 5.56 0.52 -1.26 -4.94 118.95 122.44 2b39 s ARG 1184Ca 0.00 1.78 -0.23 0.00 -0.52 0.00 0.00 55.73 56.76 2b39 s ARG 1184Cb 0.00 -3.25 0.04 0.00 0.52 0.00 0.00 34.95 32.27 2b39 s ARG 1184CO 0.00 0.07 1.62 -1.35 0.02 0.00 0.00 175.30 175.65 2b39 h PRO 1185N 4.84 -0.25 -0.33 3.54 0.11 -1.89 -0.99 132.00 137.03 2b39 h PRO 1185Ca -0.45 0.02 0.07 0.00 0.11 0.00 0.00 66.00 65.75 2b39 h PRO 1185Cb 1.21 0.06 -0.07 0.00 0.11 0.00 0.00 31.00 32.30 2b39 h PRO 1185CO 0.72 -0.16 -0.17 -0.92 -0.21 0.00 0.00 178.00 177.25 2b39 h TYR 1186N -0.26 -0.42 0.29 0.65 3.20 -1.92 0.17 116.97 118.69 2b39 h TYR 1186Ca 0.15 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 2b39 h TYR 1186Cb 0.50 0.24 0.00 0.00 1.54 0.00 0.00 36.73 39.01 2b39 h TYR 1186CO -0.45 -0.25 -0.14 1.15 -1.64 0.00 0.00 178.16 176.84 2b39 h THR 1187N -0.12 0.74 -0.91 1.81 2.02 -1.91 -0.50 112.91 114.05 2b39 h THR 1187Ca 0.17 -0.15 0.20 0.00 0.77 0.00 0.00 66.41 67.41 2b39 h THR 1187Cb 0.38 0.82 -0.12 0.00 -1.74 0.00 0.00 68.15 67.50 2b39 h THR 1187CO -0.41 0.03 0.45 0.58 0.37 0.00 0.00 175.52 176.54 2b39 h VAL 1188N -0.46 0.56 0.20 3.16 2.07 -0.49 -0.74 116.25 120.54 2b39 h VAL 1188Ca -0.04 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 2b39 h VAL 1188Cb 0.35 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 2b39 h VAL 1188CO 0.06 0.09 -0.10 0.00 0.02 0.00 0.00 177.57 177.65 2b39 h ALA 1189N 1.67 -0.27 -0.77 1.67 0.00 -0.43 -2.25 119.26 118.88 2b39 h ALA 1189Ca 0.55 -0.20 0.15 0.00 0.00 0.00 0.00 54.91 55.41 2b39 h ALA 1189Cb 0.98 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.82 2b39 h ALA 1189CO -0.47 -0.32 0.51 0.97 0.00 0.00 0.00 179.25 179.94 2b39 h ILE 1190N -0.93 0.80 0.02 0.00 -0.00 -0.77 0.53 117.51 117.17 2b39 h ILE 1190Ca -0.03 -0.16 -0.21 0.00 -0.00 0.00 0.00 64.86 64.47 2b39 h ILE 1190Cb 0.49 0.30 -0.02 0.00 -0.00 0.00 0.00 36.82 37.59 2b39 h ILE 1190CO 0.04 0.08 -0.96 0.00 -0.00 0.00 0.00 178.15 177.32 2b39 h ALA 1191N 1.64 0.42 -0.38 0.18 0.00 -1.21 -3.12 119.26 116.79 2b39 h ALA 1191Ca 0.38 -0.81 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 2b39 h ALA 1191Cb 0.83 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2b39 h ALA 1191CO -0.13 1.05 0.02 0.00 0.00 0.00 0.00 179.25 180.19 2b39 h ALA 1192N 0.96 1.33 -0.23 0.00 0.00 -0.27 -2.15 119.26 118.89 2b39 h ALA 1192Ca -0.04 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.57 2b39 h ALA 1192Cb 1.65 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.27 2b39 h ALA 1192CO 0.14 0.46 -0.24 -0.92 0.00 0.00 0.00 179.25 178.69 2b39 h TYR 1193N 0.57 0.69 -0.19 0.00 3.20 -1.45 0.68 116.97 120.47 2b39 h TYR 1193Ca 0.12 -0.21 0.05 0.00 3.14 0.00 0.00 58.73 61.83 2b39 h TYR 1193Cb 0.33 -0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.40 2b39 h TYR 1193CO 0.01 0.91 -0.14 0.00 -1.64 0.00 0.00 178.16 177.30 2b39 h ALA 1194N 0.67 -0.01 -0.22 1.82 0.00 -1.42 0.71 119.26 120.81 2b39 h ALA 1194Ca 0.04 0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 2b39 h ALA 1194Cb 0.80 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2b39 h ALA 1194CO 0.06 -0.58 -0.38 -0.07 0.00 0.00 0.00 179.25 178.29 2b39 h LEU 1195N -0.15 0.51 -0.53 0.00 3.38 -1.30 -2.95 115.31 114.26 2b39 h LEU 1195Ca 0.11 -0.21 0.06 0.00 0.09 0.00 0.00 57.88 57.93 2b39 h LEU 1195Cb 0.32 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.88 2b39 h LEU 1195CO -0.28 0.84 0.24 0.00 0.09 0.00 0.00 178.44 179.33 2b39 h ALA 1196N 1.19 0.68 0.00 1.53 0.00 0.17 0.16 119.26 122.99 2b39 h ALA 1196Ca 0.04 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2b39 h ALA 1196Cb 0.84 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2b39 h ALA 1196CO 0.07 -0.13 -0.04 -0.07 0.00 0.00 0.00 179.25 179.08 2b39 h LEU 1197N 0.47 0.00 -3.26 0.00 3.38 -0.74 -0.54 115.31 114.61 2b39 h LEU 1197Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2b39 h LEU 1197Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2b39 h LEU 1197CO -0.20 0.04 0.00 0.18 0.09 0.00 0.00 178.44 178.55 2b39 n LEU 1198N -3.72 4.78 0.00 1.67 4.77 0.34 -4.92 117.00 119.93 2b39 n LEU 1198Ca -0.03 -2.64 0.00 0.00 -0.03 0.00 0.00 56.01 53.32 2b39 n LEU 1198Cb 0.13 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.64 2b39 n LEU 1198CO 0.28 0.74 0.00 0.61 -1.33 0.00 0.00 177.39 177.69 2b39 n GLY 1199N 0.70 0.09 0.63 -0.72 0.00 -0.21 -4.81 105.19 100.87 2b39 n GLY 1199Ca 0.25 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.29 2b39 n GLY 1199CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b39 n LYS 1200N -1.50 1.68 -3.15 1.61 5.02 0.01 -4.48 118.16 117.35 2b39 n LYS 1200Ca 0.00 -0.63 -0.41 0.00 -2.02 0.00 0.00 58.31 55.25 2b39 n LYS 1200Cb 0.09 -1.49 -0.01 0.00 -0.02 0.00 0.00 35.03 33.60 2b39 n LYS 1200CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2b39 n LEU 1201N 0.08 5.84 0.00 -0.35 7.94 -1.22 -4.83 117.00 124.45 2b39 n LEU 1201Ca 0.06 -5.21 -0.20 0.00 -1.11 0.00 0.00 56.01 49.55 2b39 n LEU 1201Cb 0.35 -1.22 -0.08 0.00 0.53 0.00 0.00 43.42 43.00 2b39 n LEU 1201CO 0.06 1.68 -0.10 -0.62 -1.11 0.00 0.00 177.39 177.29 2b39 n GLU 1202N 1.54 0.42 0.00 1.96 -0.58 -1.26 -4.52 120.64 118.20 2b39 n GLU 1202Ca 0.26 -3.32 0.00 0.00 -0.42 0.00 0.00 57.16 53.68 2b39 n GLU 1202Cb 0.35 2.65 0.00 0.00 -0.57 0.00 0.00 31.44 33.87 2b39 n GLU 1202CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2b39 n GLY 1203N -0.65 2.65 0.24 0.62 0.00 -1.26 -2.65 105.19 104.14 2b39 n GLY 1203Ca 0.07 -0.37 0.08 0.00 0.00 0.00 0.00 46.02 45.80 2b39 n GLY 1203CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2b39 h ASP 1204N 8.54 0.00 0.18 1.61 5.19 -1.98 -2.51 116.42 127.45 2b39 h ASP 1204Ca 0.00 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 2b39 h ASP 1204Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 2b39 h ASP 1204CO 0.00 0.11 -0.09 0.03 -3.12 0.00 0.00 179.24 176.17 2b39 h ARG 1205N 0.00 -0.24 -0.98 3.56 -0.00 -1.86 -1.59 114.38 113.28 2b39 h ARG 1205Ca -0.00 0.02 0.09 0.00 -0.50 0.00 0.00 59.98 59.58 2b39 h ARG 1205Cb 0.21 0.05 -0.07 0.00 0.00 0.00 0.00 29.97 30.16 2b39 h ARG 1205CO 0.01 -0.01 0.62 1.25 0.00 0.00 0.00 179.97 181.85 2b39 h LEU 1206N -0.44 0.95 -0.66 3.04 7.12 -1.41 0.53 115.31 124.44 2b39 h LEU 1206Ca -0.03 0.03 -0.08 0.00 0.13 0.00 0.00 57.88 57.93 2b39 h LEU 1206Cb 0.34 -0.17 -0.01 0.00 -0.53 0.00 0.00 40.66 40.29 2b39 h LEU 1206CO 0.04 0.57 -0.39 0.00 -0.13 0.00 0.00 178.44 178.53 2b39 h THR 1207N 1.06 0.81 -0.01 1.05 1.03 -1.36 -1.70 112.91 113.79 2b39 h THR 1207Ca 0.45 -1.67 -0.08 0.00 -0.01 0.00 0.00 66.41 65.10 2b39 h THR 1207Cb 0.30 2.06 0.01 0.00 -1.07 0.00 0.00 68.15 69.45 2b39 h THR 1207CO -0.21 0.38 -0.30 0.50 -0.01 0.00 0.00 175.52 175.88 2b39 h LYS 1208N 0.00 0.22 -0.47 0.00 3.64 -0.19 -2.09 116.57 117.69 2b39 h LYS 1208Ca -0.00 -0.22 0.10 0.00 -1.27 0.00 0.00 60.65 59.25 2b39 h LYS 1208Cb 1.03 0.06 -0.10 0.00 -0.41 0.00 0.00 32.23 32.81 2b39 h LYS 1208CO 0.05 0.94 -0.20 0.35 -2.27 0.00 0.00 179.45 178.32 2b39 h PHE 1209N -0.41 -0.49 -0.51 1.91 3.57 -0.85 -0.05 116.94 120.12 2b39 h PHE 1209Ca -0.03 0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 2b39 h PHE 1209Cb 1.03 0.29 -0.02 0.00 2.79 0.00 0.00 35.95 40.04 2b39 h PHE 1209CO 0.17 -0.28 0.13 -0.07 -2.23 0.00 0.00 178.31 176.03 2b39 h LEU 1210N -0.10 0.76 -0.79 0.59 3.38 -1.35 -2.93 115.31 114.87 2b39 h LEU 1210Ca 0.22 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2b39 h LEU 1210Cb 0.44 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2b39 h LEU 1210CO -0.53 0.78 0.00 0.78 0.09 0.00 0.00 178.44 179.56 2b39 h ASN 1211N 0.69 0.00 1.53 -0.43 2.35 -0.64 -2.99 115.58 116.09 2b39 h ASN 1211Ca 0.16 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.90 2b39 h ASN 1211Cb 0.32 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.68 2b39 h ASN 1211CO -0.00 0.00 -0.03 0.74 -1.65 0.00 0.00 177.43 176.49 2b39 h THR 1212N 0.00 0.05 -3.44 2.81 2.02 -0.83 -3.45 112.91 110.06 2b39 h THR 1212Ca 0.00 -0.84 -0.54 0.00 0.77 0.00 0.00 66.41 65.80 2b39 h THR 1212Cb 0.51 1.80 -0.03 0.00 -1.74 0.00 0.00 68.15 68.68 2b39 h THR 1212CO 0.00 0.02 0.22 0.00 0.37 0.00 0.00 175.52 176.13 2b39 s ALA 1213N -3.41 3.31 0.01 6.16 0.00 -1.13 -4.82 121.76 121.87 2b39 s ALA 1213Ca 0.04 0.36 -0.26 0.00 0.00 0.00 0.00 51.96 52.10 2b39 s ALA 1213Cb 0.07 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 20.05 2b39 s ALA 1213CO 0.62 -0.02 0.81 0.15 0.00 0.00 0.00 175.76 177.31 2b39 s LYS 1214N 0.25 4.51 -1.40 0.00 -0.14 -0.57 -4.04 119.74 118.34 2b39 s LYS 1214Ca 0.42 1.11 -0.03 0.00 -1.36 0.00 0.00 55.97 56.12 2b39 s LYS 1214Cb -0.21 -3.41 0.01 0.00 -1.68 0.00 0.00 37.83 32.55 2b39 s LYS 1214CO 0.24 0.14 0.23 0.39 -0.76 0.00 0.00 175.35 175.59 2b39 n GLU 1215N 3.34 -2.93 -0.59 1.68 1.02 -1.26 -2.80 120.64 119.10 2b39 n GLU 1215Ca 0.00 0.76 0.00 0.00 -0.02 0.00 0.00 57.16 57.90 2b39 n GLU 1215Cb 0.51 -5.46 0.00 0.00 -0.02 0.00 0.00 31.44 26.47 2b39 n GLU 1215CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2b39 n LYS 1216N -3.31 -0.88 0.00 3.49 5.02 -1.26 -4.68 118.16 116.55 2b39 n LYS 1216Ca -0.14 0.18 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 2b39 n LYS 1216Cb 0.62 -4.17 0.00 0.00 -0.02 0.00 0.00 35.03 31.46 2b39 n LYS 1216CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2b39 n ASN 1217N -0.12 0.93 -3.75 4.39 2.04 -1.12 -4.53 115.26 113.10 2b39 n ASN 1217Ca 0.00 -1.10 -0.06 0.00 -0.44 0.00 0.00 54.58 52.98 2b39 n ASN 1217Cb 0.18 0.00 -0.02 0.00 -2.53 0.00 0.00 39.78 37.41 2b39 n ASN 1217CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2b39 s ARG 1218N -0.10 1.40 -0.59 -3.83 1.70 -1.15 -3.99 118.95 112.40 2b39 s ARG 1218Ca 0.00 -0.74 0.05 0.00 -0.47 0.00 0.00 55.73 54.56 2b39 s ARG 1218Cb 0.00 0.50 0.17 0.00 -0.57 0.00 0.00 34.95 35.05 2b39 s ARG 1218CO 0.00 -0.64 0.43 -1.58 -1.08 0.00 0.00 175.30 172.43 2b39 s TRP 1219N -3.56 2.61 0.25 5.89 0.51 -1.26 -1.51 118.94 121.86 2b39 s TRP 1219Ca 0.10 -2.94 0.11 0.00 -2.12 0.00 0.00 56.10 51.24 2b39 s TRP 1219Cb -0.03 -2.02 -0.05 0.00 -0.81 0.00 0.00 33.47 30.57 2b39 s TRP 1219CO 0.02 -0.66 -0.13 -1.83 -0.51 0.00 0.00 176.95 173.84 2b39 s GLU 1220N -0.86 1.91 -0.02 4.98 -1.05 -1.26 -4.07 118.70 118.33 2b39 s GLU 1220Ca 0.28 -1.54 0.03 0.00 -0.15 0.00 0.00 54.97 53.59 2b39 s GLU 1220Cb -0.02 -1.97 -0.00 0.00 -0.44 0.00 0.00 34.13 31.70 2b39 s GLU 1220CO -0.18 0.37 -0.12 -2.00 0.95 0.00 0.00 175.26 174.28 2b39 s GLU 1221N -3.32 1.19 -0.17 -4.83 2.12 -1.26 -4.81 118.70 107.62 2b39 s GLU 1221Ca 0.28 -0.44 -0.41 0.00 0.36 0.00 0.00 54.97 54.76 2b39 s GLU 1221Cb -0.06 -1.10 -0.19 0.00 0.26 0.00 0.00 34.13 33.04 2b39 s GLU 1221CO 0.16 0.21 1.39 -2.30 -0.54 0.00 0.00 175.26 174.18 2b39 n PRO 1222N 3.05 0.45 -3.25 4.30 -0.02 -1.26 -3.59 135.00 134.67 2b39 n PRO 1222Ca -0.17 0.16 -0.23 0.00 -2.02 0.00 0.00 63.50 61.25 2b39 n PRO 1222Cb 0.54 -1.73 0.02 0.00 -0.02 0.00 0.00 33.50 32.32 2b39 n PRO 1222CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2b39 n ASN 1223N 3.08 -6.54 -0.56 2.55 4.05 -1.26 -4.92 115.26 111.65 2b39 n ASN 1223Ca 0.24 0.03 -0.01 0.00 0.45 0.00 0.00 54.58 55.29 2b39 n ASN 1223Cb 0.07 -3.35 -0.01 0.00 1.23 0.00 0.00 39.78 37.72 2b39 n ASN 1223CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2b39 n GLN 1224N -0.59 0.00 0.00 1.20 1.13 -1.24 -5.08 117.38 112.81 2b39 n GLN 1224Ca -0.03 -0.14 0.00 0.00 -1.94 0.00 0.00 57.00 54.89 2b39 n GLN 1224Cb 0.59 0.07 0.00 0.00 0.11 0.00 0.00 30.24 31.01 2b39 n GLN 1224CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2b39 n LYS 1225N 0.00 0.00 0.12 -1.09 4.76 -1.26 0.88 118.16 121.56 2b39 n LYS 1225Ca -0.04 0.00 0.02 0.00 -2.87 0.00 0.00 58.31 55.42 2b39 n LYS 1225Cb 0.52 0.00 0.39 0.00 -1.84 0.00 0.00 35.03 34.10 2b39 n LYS 1225CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2b39 h LEU 1226N 0.00 0.23 -1.59 -0.35 3.38 -1.95 -1.68 115.31 113.35 2b39 h LEU 1226Ca 0.00 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 2b39 h LEU 1226Cb 0.00 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2b39 h LEU 1226CO 0.00 0.38 -0.22 1.88 0.09 0.00 0.00 178.44 180.56 2b39 h TYR 1227N 0.23 0.00 -0.14 1.13 0.05 0.24 -1.77 116.97 116.72 2b39 h TYR 1227Ca 0.05 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.65 2b39 h TYR 1227Cb 0.36 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.10 2b39 h TYR 1227CO 0.01 0.22 -0.62 -0.91 -1.05 0.00 0.00 178.16 175.81 2b39 h ASN 1228N 0.00 0.78 -0.72 3.88 2.35 -0.80 -1.45 115.58 119.62 2b39 h ASN 1228Ca -0.00 -0.63 0.03 0.00 -0.55 0.00 0.00 56.30 55.14 2b39 h ASN 1228Cb 0.44 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.54 2b39 h ASN 1228CO 0.03 1.28 0.48 0.58 -1.65 0.00 0.00 177.43 178.14 2b39 h VAL 1229N 0.33 1.13 0.41 2.81 2.07 -0.96 0.45 116.25 122.49 2b39 h VAL 1229Ca -0.04 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 2b39 h VAL 1229Cb 1.25 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2b39 h VAL 1229CO 0.13 0.17 -0.20 -0.33 0.02 0.00 0.00 177.57 177.36 2b39 h GLU 1230N 0.91 -0.53 -0.95 1.57 5.08 -1.19 -1.87 114.58 117.60 2b39 h GLU 1230Ca 0.28 0.04 0.10 0.00 -1.00 0.00 0.00 59.36 58.77 2b39 h GLU 1230Cb 0.00 0.12 -0.12 0.00 0.50 0.00 0.00 28.75 29.25 2b39 h GLU 1230CO -0.07 -0.35 -0.52 0.00 -1.00 0.00 0.00 179.01 177.07 2b39 n ALA 1231N -2.42 -0.50 0.02 3.43 0.00 -0.56 -0.51 120.51 119.96 2b39 n ALA 1231Ca -0.07 0.84 -0.10 0.00 0.00 0.00 0.00 53.44 54.11 2b39 n ALA 1231Cb 0.22 -0.20 -0.04 0.00 0.00 0.00 0.00 19.45 19.43 2b39 n ALA 1231CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2b39 h THR 1232N 0.00 0.39 -0.22 0.00 2.02 -0.98 0.10 112.91 114.22 2b39 h THR 1232Ca 0.19 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.42 2b39 h THR 1232Cb 0.43 0.39 -0.07 0.00 -1.74 0.00 0.00 68.15 67.16 2b39 h THR 1232CO -0.90 0.00 -0.41 0.28 0.37 0.00 0.00 175.52 174.85 2b39 h SER 1233N -0.35 -1.32 -0.90 4.18 0.02 -0.03 0.24 113.55 115.40 2b39 h SER 1233Ca 0.09 0.18 0.22 0.00 -0.84 0.00 0.00 61.79 61.44 2b39 h SER 1233Cb 0.48 0.55 -0.12 0.00 0.14 0.00 0.00 62.40 63.45 2b39 h SER 1233CO -0.29 -0.40 0.40 1.88 -1.14 0.00 0.00 176.83 177.28 2b39 h TYR 1234N -0.43 0.67 0.97 3.45 -1.99 -0.32 0.18 116.97 119.51 2b39 h TYR 1234Ca 0.10 0.04 -0.05 0.00 2.00 0.00 0.00 58.73 60.82 2b39 h TYR 1234Cb 0.61 -0.15 0.01 0.00 2.00 0.00 0.00 36.73 39.19 2b39 h TYR 1234CO -0.52 -0.04 -0.47 0.00 -0.00 0.00 0.00 178.16 177.13 2b39 h ALA 1235N 1.71 -1.31 -0.97 3.88 0.00 0.14 -1.34 119.26 121.36 2b39 h ALA 1235Ca 0.56 -0.29 0.24 0.00 0.00 0.00 0.00 54.91 55.43 2b39 h ALA 1235Cb 1.07 0.51 -0.13 0.00 0.00 0.00 0.00 17.79 19.24 2b39 h ALA 1235CO -0.52 -1.21 0.53 1.25 0.00 0.00 0.00 179.25 179.29 2b39 h LEU 1236N -1.35 0.55 -0.77 0.00 5.85 0.67 0.71 115.31 120.97 2b39 h LEU 1236Ca -0.13 0.14 -0.06 0.00 0.84 0.00 0.00 57.88 58.67 2b39 h LEU 1236Cb 1.00 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 42.07 2b39 h LEU 1236CO 0.22 0.06 0.22 -0.07 -0.34 0.00 0.00 178.44 178.53 2b39 h LEU 1237N 0.51 1.07 -0.38 2.25 3.38 -0.50 -0.45 115.31 121.19 2b39 h LEU 1237Ca 0.62 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 58.33 2b39 h LEU 1237Cb 1.19 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 2b39 h LEU 1237CO -0.50 1.00 0.04 0.00 0.09 0.00 0.00 178.44 179.07 2b39 h ALA 1238N 1.14 0.51 -0.38 1.53 0.00 0.14 0.12 119.26 122.32 2b39 h ALA 1238Ca 0.24 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2b39 h ALA 1238Cb 0.32 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2b39 h ALA 1238CO -0.01 0.24 0.25 -0.07 0.00 0.00 0.00 179.25 179.66 2b39 h LEU 1239N 0.48 0.42 -0.89 0.00 3.38 -0.41 -1.00 115.31 117.28 2b39 h LEU 1239Ca 0.11 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 2b39 h LEU 1239Cb 0.40 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 2b39 h LEU 1239CO 0.01 0.31 0.15 -0.07 0.09 0.00 0.00 178.44 178.93 2b39 h LEU 1240N 0.51 0.91 -1.86 1.67 3.38 -0.91 0.21 115.31 119.22 2b39 h LEU 1240Ca 0.14 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 57.94 2b39 h LEU 1240Cb -0.05 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 2b39 h LEU 1240CO -0.04 0.88 0.11 0.00 0.09 0.00 0.00 178.44 179.49 2b39 h ALA 1241N 1.23 1.92 0.00 1.53 0.00 -0.10 0.21 119.26 124.05 2b39 h ALA 1241Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2b39 h ALA 1241Cb 0.33 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2b39 h ALA 1241CO 0.00 0.07 -0.33 0.00 0.00 0.00 0.00 179.25 178.99 2b39 h ARG 1242N 0.20 0.00 -0.27 0.00 3.08 0.27 -3.47 114.38 114.18 2b39 h ARG 1242Ca 0.07 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 2b39 h ARG 1242Cb 0.03 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 2b39 h ARG 1242CO -0.01 0.00 -0.06 1.63 -1.07 0.00 0.00 179.97 180.45 2b39 n LYS 1243N -2.69 -0.22 0.00 0.04 5.02 0.74 -4.91 118.16 116.14 2b39 n LYS 1243Ca 0.03 0.39 0.00 0.00 -2.02 0.00 0.00 58.31 56.71 2b39 n LYS 1243Cb 0.50 -4.03 0.00 0.00 -0.02 0.00 0.00 35.03 31.48 2b39 n LYS 1243CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2b39 n ASP 1244N 1.48 1.62 -0.05 4.39 9.92 -0.58 -4.68 116.55 128.65 2b39 n ASP 1244Ca -0.03 -1.30 0.04 0.00 -0.53 0.00 0.00 54.79 52.97 2b39 n ASP 1244Cb 0.30 -0.33 0.07 0.00 -0.64 0.00 0.00 41.12 40.53 2b39 n ASP 1244CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2b39 n TYR 1245N 0.55 0.09 0.05 1.24 4.01 -1.26 0.10 117.16 121.94 2b39 n TYR 1245Ca 0.00 0.09 -0.09 0.00 -0.16 0.00 0.00 57.90 57.74 2b39 n TYR 1245Cb 0.28 -0.43 0.05 0.00 -0.31 0.00 0.00 39.34 38.93 2b39 n TYR 1245CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 2b39 h ASP 1246N 0.00 0.45 0.68 7.72 5.19 -1.99 -3.29 116.42 125.18 2b39 h ASP 1246Ca 0.10 -0.29 -0.11 0.00 -0.62 0.00 0.00 57.03 56.11 2b39 h ASP 1246Cb 0.30 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.67 2b39 h ASP 1246CO -0.06 1.01 -0.52 0.74 -3.12 0.00 0.00 179.24 177.29 2b39 h THR 1247N 0.27 1.24 0.03 0.35 2.02 0.30 -3.38 112.91 113.73 2b39 h THR 1247Ca -0.02 -1.86 -0.21 0.00 0.77 0.00 0.00 66.41 65.09 2b39 h THR 1247Cb 1.25 2.04 -0.01 0.00 -1.74 0.00 0.00 68.15 69.69 2b39 h THR 1247CO 0.12 0.51 -0.97 0.71 0.37 0.00 0.00 175.52 176.26 2b39 h THR 1248N 0.00 1.53 -0.93 3.16 1.35 -1.63 -3.39 112.91 113.00 2b39 h THR 1248Ca -0.01 -2.83 0.30 0.00 -0.55 0.00 0.00 66.41 63.32 2b39 h THR 1248Cb 1.00 2.62 -0.17 0.00 -1.73 0.00 0.00 68.15 69.86 2b39 h THR 1248CO 0.07 0.82 0.17 -2.65 -0.25 0.00 0.00 175.52 173.68 2b39 n PRO 1249N -3.59 -0.07 -0.07 4.72 -0.02 -1.26 -0.84 135.00 133.88 2b39 n PRO 1249Ca -0.04 1.37 -0.08 0.00 -2.02 0.00 0.00 63.50 62.73 2b39 n PRO 1249Cb 0.87 -2.25 0.09 0.00 -0.02 0.00 0.00 33.50 32.19 2b39 n PRO 1249CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2b39 h PRO 1250N 0.00 0.72 -0.53 0.52 0.11 -1.89 -2.48 132.00 128.46 2b39 h PRO 1250Ca 0.64 -0.31 -0.08 0.00 0.11 0.00 0.00 66.00 66.35 2b39 h PRO 1250Cb 1.45 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.52 2b39 h PRO 1250CO -0.83 0.91 -0.00 0.28 -0.21 0.00 0.00 178.00 178.15 2b39 h VAL 1251N 0.62 1.25 -0.15 3.15 2.07 -1.12 -2.23 116.25 119.85 2b39 h VAL 1251Ca 0.08 -1.07 -0.01 0.00 0.82 0.00 0.00 66.70 66.52 2b39 h VAL 1251Cb 0.78 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 2b39 h VAL 1251CO 0.06 0.38 0.05 0.58 0.02 0.00 0.00 177.57 178.67 2b39 h VAL 1252N 0.83 1.17 -0.74 2.57 2.07 -1.31 -1.40 116.25 119.44 2b39 h VAL 1252Ca 0.16 -0.52 0.09 0.00 0.82 0.00 0.00 66.70 67.24 2b39 h VAL 1252Cb 0.49 1.24 -0.07 0.00 -1.52 0.00 0.00 31.29 31.44 2b39 h VAL 1252CO 0.02 0.16 0.40 0.03 0.02 0.00 0.00 177.57 178.20 2b39 h ARG 1253N 0.07 0.66 0.73 1.57 3.08 -1.24 0.19 114.38 119.46 2b39 h ARG 1253Ca 0.05 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 2b39 h ARG 1253Cb 0.20 -0.15 0.01 0.00 0.08 0.00 0.00 29.97 30.11 2b39 h ARG 1253CO -0.00 0.44 -0.35 2.35 -1.07 0.00 0.00 179.97 181.33 2b39 h TRP 1254N 0.68 -0.91 -1.07 3.04 7.01 -1.20 -2.42 115.95 121.09 2b39 h TRP 1254Ca 0.35 -0.02 0.30 0.00 2.11 0.00 0.00 58.89 61.63 2b39 h TRP 1254Cb 0.32 0.30 -0.12 0.00 -2.10 0.00 0.00 29.16 27.57 2b39 h TRP 1254CO -0.09 -0.55 0.66 -0.07 -2.79 0.00 0.00 178.44 175.61 2b39 h LEU 1255N -1.15 0.48 -2.41 0.65 3.38 -0.99 0.44 115.31 115.72 2b39 h LEU 1255Ca -0.10 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2b39 h LEU 1255Cb 0.78 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.59 2b39 h LEU 1255CO 0.17 0.01 -0.01 -1.13 0.09 0.00 0.00 178.44 177.56 2b39 h ASN 1256N 0.38 0.00 -0.01 -0.43 -0.00 -0.12 -3.12 115.58 112.28 2b39 h ASN 1256Ca 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.97 2b39 h ASN 1256Cb 1.64 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.96 2b39 h ASN 1256CO -0.42 0.01 -0.01 -1.84 -0.00 0.00 0.00 177.43 175.17 2b39 n GLU 1257N -3.88 0.37 -1.39 6.67 0.28 0.15 -4.70 120.64 118.15 2b39 n GLU 1257Ca -0.03 -1.02 -0.31 0.00 -0.16 0.00 0.00 57.16 55.64 2b39 n GLU 1257Cb 0.09 -1.17 -0.07 0.00 1.43 0.00 0.00 31.44 31.73 2b39 n GLU 1257CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 2b39 n GLN 1258N 0.47 3.27 -2.99 3.44 1.13 -1.04 -4.67 117.38 117.00 2b39 n GLN 1258Ca 0.05 -2.15 -0.37 0.00 -1.94 0.00 0.00 57.00 52.59 2b39 n GLN 1258Cb 0.23 -2.47 -0.01 0.00 0.11 0.00 0.00 30.24 28.09 2b39 n GLN 1258CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2b39 n ARG 1259N 2.59 4.17 0.00 -1.09 1.74 -1.26 -4.75 116.66 118.05 2b39 n ARG 1259Ca 0.62 -4.66 0.13 0.00 -0.77 0.00 0.00 57.85 53.18 2b39 n ARG 1259Cb 0.46 -2.41 0.75 0.00 -1.02 0.00 0.00 32.46 30.24 2b39 n ARG 1259CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2b39 n TYR 1260N 0.65 0.00 -3.93 -1.55 4.02 -1.16 -3.41 117.16 111.77 2b39 n TYR 1260Ca 0.33 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.92 2b39 n TYR 1260Cb 0.34 0.00 -0.14 0.00 -0.02 0.00 0.00 39.34 39.51 2b39 n TYR 1260CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 2b39 s TYR 1261N -2.00 3.15 -1.43 -0.72 1.51 -0.63 -4.71 117.35 112.52 2b39 s TYR 1261Ca 0.38 -2.89 -0.09 0.00 -1.01 0.00 0.00 57.07 53.46 2b39 s TYR 1261Cb 0.17 -2.66 0.03 0.00 -0.11 0.00 0.00 41.96 39.40 2b39 s TYR 1261CO 0.29 -0.84 1.04 0.41 -1.11 0.00 0.00 175.55 175.34 2b39 n GLY 1262N 3.78 -0.53 2.41 0.71 0.00 -1.26 -0.08 105.19 110.22 2b39 n GLY 1262Ca 0.04 0.22 -0.05 0.00 0.00 0.00 0.00 46.02 46.23 2b39 n GLY 1262CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b39 n GLY 1263N -1.85 0.73 2.46 -0.02 0.00 -1.22 -4.96 105.19 100.32 2b39 n GLY 1263Ca -0.00 -0.27 -0.19 0.00 0.00 0.00 0.00 46.02 45.55 2b39 n GLY 1263CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b39 n GLY 1264N -1.34 3.49 0.84 -0.02 0.00 0.89 -4.89 105.19 104.17 2b39 n GLY 1264Ca -0.05 -2.08 0.07 0.00 0.00 0.00 0.00 46.02 43.96 2b39 n GLY 1264CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2b39 n TYR 1265N -0.69 0.63 0.00 1.61 4.02 -1.26 -1.61 117.16 119.86 2b39 n TYR 1265Ca -0.05 -0.30 0.00 0.00 -0.01 0.00 0.00 57.90 57.54 2b39 n TYR 1265Cb 0.45 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.75 2b39 n TYR 1265CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2b39 n GLY 1266N 1.16 0.19 3.71 2.72 0.00 -1.26 -4.60 105.19 107.11 2b39 n GLY 1266Ca 0.15 -0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 2b39 n GLY 1266CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2b39 s SER 1267N 0.00 4.16 0.02 1.61 0.15 -1.26 0.05 113.70 118.42 2b39 s SER 1267Ca 0.00 -1.34 -0.11 0.00 0.70 0.00 0.00 55.95 55.20 2b39 s SER 1267Cb 0.00 -0.14 -0.06 0.00 -1.71 0.00 0.00 66.02 64.11 2b39 s SER 1267CO 0.00 -0.62 1.15 0.71 1.20 0.00 0.00 173.24 175.67 2b39 h THR 1268N 1.49 0.00 -0.53 6.45 1.35 -1.88 -2.76 112.91 117.04 2b39 h THR 1268Ca -0.43 -0.01 0.05 0.00 -0.55 0.00 0.00 66.41 65.47 2b39 h THR 1268Cb 1.27 0.00 -0.05 0.00 -1.73 0.00 0.00 68.15 67.64 2b39 h THR 1268CO 0.74 0.00 0.26 1.56 -0.25 0.00 0.00 175.52 177.84 2b39 h GLN 1269N -0.41 0.49 -0.67 4.72 1.08 -1.97 0.27 115.11 118.63 2b39 h GLN 1269Ca -0.04 -0.03 0.07 0.00 -1.45 0.00 0.00 58.65 57.20 2b39 h GLN 1269Cb 0.31 -0.11 -0.06 0.00 -0.05 0.00 0.00 27.48 27.57 2b39 h GLN 1269CO 0.07 0.33 0.35 0.00 -0.95 0.00 0.00 178.83 178.63 2b39 h ALA 1270N 1.29 0.91 0.21 3.87 0.00 -1.88 0.15 119.26 123.81 2b39 h ALA 1270Ca 0.23 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2b39 h ALA 1270Cb 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2b39 h ALA 1270CO -0.17 -0.01 -0.10 1.15 0.00 0.00 0.00 179.25 180.12 2b39 h THR 1271N 0.63 0.66 -0.66 0.00 2.02 -1.07 -0.10 112.91 114.39 2b39 h THR 1271Ca 0.31 -1.00 0.17 0.00 0.77 0.00 0.00 66.41 66.66 2b39 h THR 1271Cb 0.26 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 2b39 h THR 1271CO -0.22 0.17 0.46 -0.26 0.37 0.00 0.00 175.52 176.04 2b39 h PHE 1272N -0.91 0.16 0.05 3.16 0.04 -0.39 -1.23 116.94 117.82 2b39 h PHE 1272Ca -0.03 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.74 2b39 h PHE 1272Cb 0.50 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 38.59 2b39 h PHE 1272CO 0.06 0.06 -0.03 0.52 -0.60 0.00 0.00 178.31 178.33 2b39 h MET 1273N 0.14 -0.07 -1.01 1.51 2.86 -0.65 -2.54 114.93 115.16 2b39 h MET 1273Ca 0.32 0.00 0.24 0.00 -2.06 0.00 0.00 59.70 58.20 2b39 h MET 1273Cb 1.07 0.02 -0.11 0.00 0.06 0.00 0.00 31.60 32.63 2b39 h MET 1273CO -0.04 -0.05 0.61 -0.24 1.06 0.00 0.00 176.91 178.25 2b39 h VAL 1274N -0.20 0.57 0.35 -2.22 3.04 -0.95 -1.79 116.25 115.05 2b39 h VAL 1274Ca -0.01 -0.20 -0.02 0.00 -1.01 0.00 0.00 66.70 65.47 2b39 h VAL 1274Cb 0.05 -0.06 0.00 0.00 -2.01 0.00 0.00 31.29 29.28 2b39 h VAL 1274CO 0.01 0.11 -0.17 0.15 -1.01 0.00 0.00 177.57 176.66 2b39 h PHE 1275N 0.58 -0.43 -0.94 3.17 -0.00 -1.35 0.16 116.94 118.13 2b39 h PHE 1275Ca 0.62 -0.01 0.17 0.00 -0.00 0.00 0.00 57.97 58.75 2b39 h PHE 1275Cb 1.22 0.14 -0.16 0.00 -0.00 0.00 0.00 35.95 37.15 2b39 h PHE 1275CO -0.01 -0.27 -0.30 0.94 -0.00 0.00 0.00 178.31 178.68 2b39 n GLN 1276N -3.40 -0.15 -0.05 1.11 7.27 -0.75 0.26 117.38 121.66 2b39 n GLN 1276Ca -0.06 1.45 -0.10 0.00 0.07 0.00 0.00 57.00 58.37 2b39 n GLN 1276Cb 0.18 -2.16 -0.03 0.00 2.41 0.00 0.00 30.24 30.64 2b39 n GLN 1276CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2b39 h ALA 1277N 1.58 0.29 -0.14 1.69 0.00 -1.29 0.47 119.26 121.86 2b39 h ALA 1277Ca 0.39 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.32 2b39 h ALA 1277Cb 0.62 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2b39 h ALA 1277CO -0.95 -0.24 -0.06 -0.07 0.00 0.00 0.00 179.25 177.93 2b39 h LEU 1278N 0.30 -0.21 -0.51 0.00 3.38 0.28 -1.64 115.31 116.91 2b39 h LEU 1278Ca 0.08 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 2b39 h LEU 1278Cb -0.03 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2b39 h LEU 1278CO -0.02 -0.09 0.24 0.00 0.09 0.00 0.00 178.44 178.67 2b39 h ALA 1279N 1.09 0.65 -0.74 1.53 0.00 -0.61 -2.66 119.26 118.52 2b39 h ALA 1279Ca 0.08 -0.12 0.16 0.00 0.00 0.00 0.00 54.91 55.03 2b39 h ALA 1279Cb 0.16 -0.20 -0.13 0.00 0.00 0.00 0.00 17.79 17.62 2b39 h ALA 1279CO -0.18 0.22 -0.07 0.37 0.00 0.00 0.00 179.25 179.59 2b39 h GLN 1280N 0.67 0.05 0.59 0.00 5.75 0.71 0.32 115.11 123.21 2b39 h GLN 1280Ca 0.17 -0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.64 2b39 h GLN 1280Cb 0.12 -0.01 0.01 0.00 1.07 0.00 0.00 27.48 28.66 2b39 h GLN 1280CO -0.02 0.04 -0.28 -0.92 -2.65 0.00 0.00 178.83 174.99 2b39 h TYR 1281N 0.05 -0.73 -0.97 3.99 3.20 -0.98 -2.74 116.97 118.79 2b39 h TYR 1281Ca 0.39 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.31 2b39 h TYR 1281Cb 0.65 0.24 -0.07 0.00 1.54 0.00 0.00 36.73 39.09 2b39 h TYR 1281CO -0.49 -0.44 0.62 1.96 -1.64 0.00 0.00 178.16 178.17 2b39 h GLN 1282N -0.82 1.10 -0.17 1.82 7.50 -1.17 0.75 115.11 124.11 2b39 h GLN 1282Ca -0.08 -0.07 0.02 0.00 0.50 0.00 0.00 58.65 59.02 2b39 h GLN 1282Cb 0.62 -0.25 -0.03 0.00 0.05 0.00 0.00 27.48 27.87 2b39 h GLN 1282CO 0.13 0.72 -0.16 0.87 -1.50 0.00 0.00 178.83 178.90 2b39 h LYS 1283N 1.13 -0.07 -0.64 1.46 1.57 -0.13 -2.89 116.57 117.01 2b39 h LYS 1283Ca 0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.21 2b39 h LYS 1283Cb 0.18 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.50 2b39 h LYS 1283CO -0.18 -0.04 0.00 -0.40 -0.57 0.00 0.00 179.45 178.26 2b39 n ASP 1284N -3.51 4.80 -2.82 0.86 5.68 -1.06 -4.35 116.55 116.16 2b39 n ASP 1284Ca -0.00 -2.62 -0.11 0.00 -0.50 0.00 0.00 54.79 51.56 2b39 n ASP 1284Cb 0.09 -0.61 0.04 0.00 -1.14 0.00 0.00 41.12 39.49 2b39 n ASP 1284CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 2b39 n VAL 1285N 0.78 0.39 -1.70 2.12 0.31 0.24 -5.06 118.33 115.41 2b39 n VAL 1285Ca 0.24 -3.04 -0.33 0.00 -0.01 0.00 0.00 64.34 61.20 2b39 n VAL 1285Cb 0.96 0.56 0.06 0.00 -0.91 0.00 0.00 33.84 34.51 2b39 n VAL 1285CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2b39 s PRO 1286N -1.98 2.66 0.00 5.55 0.04 -1.11 -4.63 135.00 135.53 2b39 s PRO 1286Ca 0.29 1.48 0.00 0.00 0.04 0.00 0.00 61.00 62.81 2b39 s PRO 1286Cb 0.40 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 33.02 2b39 s PRO 1286CO -0.03 -1.37 0.29 -0.25 0.04 0.00 0.00 177.00 175.68 2b39 n ASP 1287N -2.46 0.00 -0.08 6.66 8.00 -1.26 -4.97 116.55 122.44 2b39 n ASP 1287Ca 0.11 -0.86 -0.06 0.00 0.71 0.00 0.00 54.79 54.69 2b39 n ASP 1287Cb 0.52 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.61 2b39 n ASP 1287CO 0.00 0.00 0.00 0.45 -0.39 0.00 0.00 177.20 177.26 2b39 h HIS 1288N 0.00 -0.32 -1.30 1.24 3.86 -1.96 -0.62 115.15 116.04 2b39 h HIS 1288Ca 0.00 0.03 0.38 0.00 -1.16 0.00 0.00 60.37 59.62 2b39 h HIS 1288Cb 0.86 0.19 -0.07 0.00 1.06 0.00 0.00 27.41 29.44 2b39 h HIS 1288CO -0.17 -0.21 0.91 1.57 0.86 0.00 0.00 177.93 180.90 2b39 h LYS 1289N -0.08 0.09 -0.00 2.45 -0.00 -1.95 0.60 116.57 117.67 2b39 h LYS 1289Ca 0.16 -0.01 0.00 0.00 -0.00 0.00 0.00 60.65 60.80 2b39 h LYS 1289Cb 0.33 -0.02 0.00 0.00 -0.00 0.00 0.00 32.23 32.54 2b39 h LYS 1289CO -0.37 0.06 -0.21 0.39 -0.00 0.00 0.00 179.45 179.32 2b39 n GLU 1290N -4.30 0.66 -1.68 0.07 1.02 -0.25 -4.71 120.64 111.45 2b39 n GLU 1290Ca 0.30 -0.31 -0.45 0.00 -0.02 0.00 0.00 57.16 56.67 2b39 n GLU 1290Cb 1.32 -1.49 -0.04 0.00 -0.02 0.00 0.00 31.44 31.21 2b39 n GLU 1290CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2b39 n LEU 1291N -0.90 3.21 -2.72 -4.62 0.00 0.21 -4.54 117.00 107.64 2b39 n LEU 1291Ca 0.12 1.08 -0.04 0.00 0.00 0.00 0.00 56.01 57.17 2b39 n LEU 1291Cb 0.32 -1.44 0.03 0.00 0.00 0.00 0.00 43.42 42.32 2b39 n LEU 1291CO 0.26 -0.23 0.31 -3.20 0.00 0.00 0.00 177.39 174.53 2b39 n ASN 1292N 3.51 -2.44 -4.87 1.96 5.15 -0.12 -2.37 115.26 116.07 2b39 n ASN 1292Ca 0.17 -2.07 -0.36 0.00 -0.60 0.00 0.00 54.58 51.71 2b39 n ASN 1292Cb 0.29 1.27 -0.06 0.00 -0.53 0.00 0.00 39.78 40.76 2b39 n ASN 1292CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2b39 s LEU 1293N 0.70 4.40 -0.57 1.20 1.43 -0.08 -3.50 118.68 122.25 2b39 s LEU 1293Ca 0.27 0.57 0.06 0.00 -1.03 0.00 0.00 54.13 54.00 2b39 s LEU 1293Cb 0.09 -2.33 0.32 0.00 0.03 0.00 0.00 46.19 44.30 2b39 s LEU 1293CO -0.09 0.35 0.88 -0.67 0.23 0.00 0.00 176.35 177.05 2b39 n ASP 1294N 1.69 3.97 -4.76 2.29 2.03 0.23 -1.96 116.55 120.05 2b39 n ASP 1294Ca -0.16 -3.57 -0.39 0.00 0.52 0.00 0.00 54.79 51.19 2b39 n ASP 1294Cb 0.54 -0.59 0.01 0.00 -0.72 0.00 0.00 41.12 40.36 2b39 n ASP 1294CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2b39 s VAL 1295N -3.87 2.52 -0.30 5.18 1.01 -1.12 -3.49 120.40 120.33 2b39 s VAL 1295Ca 0.46 0.43 -0.01 0.00 0.00 0.00 0.00 61.98 62.87 2b39 s VAL 1295Cb 0.26 -3.24 0.13 0.00 0.00 0.00 0.00 36.38 33.53 2b39 s VAL 1295CO -0.11 0.04 0.25 -0.55 0.00 0.00 0.00 175.10 174.73 2b39 s SER 1296N -0.86 2.22 -0.03 3.32 0.15 0.11 -2.09 113.70 116.51 2b39 s SER 1296Ca 0.62 -1.10 -0.30 0.00 0.70 0.00 0.00 55.95 55.87 2b39 s SER 1296Cb -0.38 0.21 -0.04 0.00 -1.71 0.00 0.00 66.02 64.11 2b39 s SER 1296CO 0.47 -0.38 1.18 -0.63 1.20 0.00 0.00 173.24 175.08 2b39 s ILE 1297N 2.09 4.28 -0.37 6.45 1.01 -0.10 -2.53 121.20 132.03 2b39 s ILE 1297Ca 0.11 1.61 0.03 0.00 0.00 0.00 0.00 60.65 62.39 2b39 s ILE 1297Cb -0.15 -4.03 0.10 0.00 0.01 0.00 0.00 42.46 38.39 2b39 s ILE 1297CO -0.28 0.03 0.09 -1.58 0.00 0.00 0.00 174.94 173.20 2b39 s GLN 1298N 1.92 1.61 0.23 2.79 2.00 -0.13 -1.42 119.66 126.67 2b39 s GLN 1298Ca 0.56 -1.92 -0.19 0.00 -2.00 0.00 0.00 55.36 51.80 2b39 s GLN 1298Cb -0.25 -3.29 -0.08 0.00 0.80 0.00 0.00 33.01 30.19 2b39 s GLN 1298CO 0.23 -0.98 0.73 -0.51 -0.50 0.00 0.00 175.29 174.26 2b39 s LEU 1299N 0.86 4.32 0.04 3.68 1.43 -1.26 -2.67 118.68 125.07 2b39 s LEU 1299Ca 0.11 1.41 -0.26 0.00 -1.03 0.00 0.00 54.13 54.36 2b39 s LEU 1299Cb -0.20 -3.63 -0.17 0.00 0.03 0.00 0.00 46.19 42.22 2b39 s LEU 1299CO -0.07 0.01 1.44 1.55 0.23 0.00 0.00 176.35 179.52 2b39 h PRO 1300N 3.32 -0.31 0.05 1.29 0.13 -1.90 -3.32 132.00 131.25 2b39 h PRO 1300Ca -0.48 0.02 0.01 0.00 -0.87 0.00 0.00 66.00 64.68 2b39 h PRO 1300Cb 1.19 0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.37 2b39 h PRO 1300CO 0.65 -0.06 -0.25 0.66 -0.23 0.00 0.00 178.00 178.77 2b39 h SER 1301N -0.54 -0.76 -4.26 1.44 4.64 -1.94 -3.42 113.55 108.71 2b39 h SER 1301Ca -0.03 0.08 -0.52 0.00 -0.47 0.00 0.00 61.79 60.84 2b39 h SER 1301Cb 0.40 0.28 0.19 0.00 -0.31 0.00 0.00 62.40 62.96 2b39 h SER 1301CO 0.05 -0.26 0.25 -0.13 -0.87 0.00 0.00 176.83 175.88 2b39 s ARG 1302N -4.30 1.19 -0.24 4.77 0.52 -1.25 -4.99 118.95 114.65 2b39 s ARG 1302Ca -0.08 1.59 -0.16 0.00 -0.52 0.00 0.00 55.73 56.57 2b39 s ARG 1302Cb 0.03 -1.74 -0.10 0.00 0.52 0.00 0.00 34.95 33.65 2b39 s ARG 1302CO 0.29 -2.51 -0.30 0.27 0.02 0.00 0.00 175.30 173.06 2b39 n ASN 1303N -3.99 1.94 -4.72 0.23 0.23 -1.26 -4.73 115.26 102.95 2b39 n ASN 1303Ca 0.12 0.36 -0.40 0.00 -0.53 0.00 0.00 54.58 54.13 2b39 n ASN 1303Cb 0.52 -0.81 -0.04 0.00 -2.08 0.00 0.00 39.78 37.36 2b39 n ASN 1303CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2b39 s SER 1304N -6.91 7.10 0.34 0.53 1.04 -1.26 -5.01 113.70 109.53 2b39 s SER 1304Ca -0.34 1.33 -0.29 0.00 0.48 0.00 0.00 55.95 57.13 2b39 s SER 1304Cb 0.10 -2.45 -0.11 0.00 0.10 0.00 0.00 66.02 63.66 2b39 s SER 1304CO 0.47 -0.10 1.50 0.00 0.98 0.00 0.00 173.24 176.09 2b39 n ALA 1305N 3.55 2.28 -2.30 5.32 0.00 -1.26 -4.93 120.51 123.17 2b39 n ALA 1305Ca -0.00 0.36 -0.39 0.00 0.00 0.00 0.00 53.44 53.40 2b39 n ALA 1305Cb 0.51 -2.41 -0.06 0.00 0.00 0.00 0.00 19.45 17.49 2b39 n ALA 1305CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2b39 s VAL 1306N -0.71 4.68 -0.01 0.00 0.11 -0.51 -4.97 120.40 118.99 2b39 s VAL 1306Ca 0.57 1.50 0.00 0.00 -2.93 0.00 0.00 61.98 61.13 2b39 s VAL 1306Cb -0.50 -4.05 0.01 0.00 -1.53 0.00 0.00 36.38 30.32 2b39 s VAL 1306CO 0.58 0.44 -0.00 -0.60 -3.33 0.00 0.00 175.10 172.19 2b39 s ARG 1307N -0.50 0.15 0.26 1.54 3.52 -1.26 -0.93 118.95 121.73 2b39 s ARG 1307Ca 0.35 0.03 0.05 0.00 -0.13 0.00 0.00 55.73 56.03 2b39 s ARG 1307Cb -0.20 -0.27 -0.06 0.00 -1.56 0.00 0.00 34.95 32.86 2b39 s ARG 1307CO 0.22 -0.06 -0.03 -1.01 -0.81 0.00 0.00 175.30 173.61 2b39 s HIS 1308N 0.53 1.80 -0.03 5.12 3.76 -0.89 -5.03 115.29 120.55 2b39 s HIS 1308Ca -0.05 -0.80 -0.01 0.00 -0.15 0.00 0.00 55.06 54.05 2b39 s HIS 1308Cb -0.07 -1.04 0.02 0.00 1.11 0.00 0.00 32.58 32.59 2b39 s HIS 1308CO -0.01 0.14 0.06 0.50 -0.85 0.00 0.00 174.74 174.58 2b39 s ARG 1309N -3.79 0.03 -0.11 1.40 3.52 -1.26 -2.80 118.95 115.94 2b39 s ARG 1309Ca 0.29 0.16 0.00 0.00 -0.13 0.00 0.00 55.73 56.06 2b39 s ARG 1309Cb 0.05 -0.11 0.02 0.00 -1.56 0.00 0.00 34.95 33.35 2b39 s ARG 1309CO 0.11 -0.09 -0.10 0.42 -0.81 0.00 0.00 175.30 174.83 2b39 s ILE 1310N 0.60 1.15 0.28 4.11 1.01 -0.83 -4.99 121.20 122.53 2b39 s ILE 1310Ca -0.05 -0.38 0.12 0.00 0.00 0.00 0.00 60.65 60.34 2b39 s ILE 1310Cb -0.07 -1.13 -0.05 0.00 0.01 0.00 0.00 42.46 41.23 2b39 s ILE 1310CO -0.02 0.38 -0.19 -0.76 0.00 0.00 0.00 174.94 174.35 2b39 s LEU 1311N 1.50 2.61 0.28 2.97 1.43 -1.26 -0.90 118.68 125.30 2b39 s LEU 1311Ca 0.02 -1.02 0.01 0.00 -1.03 0.00 0.00 54.13 52.11 2b39 s LEU 1311Cb -0.13 -1.12 0.64 0.00 0.03 0.00 0.00 46.19 45.61 2b39 s LEU 1311CO -0.07 0.04 1.69 -0.25 0.23 0.00 0.00 176.35 177.99 2b39 h TRP 1312N 2.26 0.52 0.88 0.29 -0.00 -1.65 -2.33 115.95 115.92 2b39 h TRP 1312Ca -0.40 0.04 -0.04 0.00 -0.00 0.00 0.00 58.89 58.49 2b39 h TRP 1312Cb 1.26 -0.10 0.00 0.00 -0.00 0.00 0.00 29.16 30.32 2b39 h TRP 1312CO 0.81 -0.06 -0.49 1.49 -0.00 0.00 0.00 178.44 180.19 2b39 h GLU 1313N 0.36 -1.22 -2.60 2.65 4.81 -1.90 -3.48 114.58 113.21 2b39 h GLU 1313Ca 0.51 0.08 -0.26 0.00 -0.13 0.00 0.00 59.36 59.57 2b39 h GLU 1313Cb 0.94 0.28 0.08 0.00 0.63 0.00 0.00 28.75 30.68 2b39 h GLU 1313CO -0.53 -0.81 -0.56 -1.13 -0.73 0.00 0.00 179.01 175.25 2b39 n SER 1314N -5.58 -1.79 -0.08 1.04 3.41 -0.88 -4.84 113.62 104.90 2b39 n SER 1314Ca -0.16 0.24 -0.02 0.00 -0.26 0.00 0.00 58.87 58.68 2b39 n SER 1314Cb 0.51 -0.36 -0.02 0.00 -0.26 0.00 0.00 64.21 64.08 2b39 n SER 1314CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b39 n ALA 1315N -0.74 -0.12 -2.27 7.33 0.00 -1.26 -4.71 120.51 118.74 2b39 n ALA 1315Ca 0.03 0.16 -0.15 0.00 0.00 0.00 0.00 53.44 53.47 2b39 n ALA 1315Cb 0.21 0.30 -0.10 0.00 0.00 0.00 0.00 19.45 19.86 2b39 n ALA 1315CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2b39 s SER 1316N -3.53 1.43 0.00 0.00 1.04 -1.26 -4.94 113.70 106.44 2b39 s SER 1316Ca -0.02 -1.20 0.13 0.00 0.48 0.00 0.00 55.95 55.34 2b39 s SER 1316Cb 0.02 0.08 0.39 0.00 0.10 0.00 0.00 66.02 66.61 2b39 s SER 1316CO 0.11 -0.55 1.31 0.18 0.98 0.00 0.00 173.24 175.27 2b39 n LEU 1317N -0.31 1.86 -4.47 2.42 4.77 -1.26 -4.89 117.00 115.11 2b39 n LEU 1317Ca -0.06 -0.91 -0.27 0.00 -0.03 0.00 0.00 56.01 54.74 2b39 n LEU 1317Cb 0.63 -0.21 -0.11 0.00 -2.33 0.00 0.00 43.42 41.40 2b39 n LEU 1317CO 0.35 0.45 -0.49 -0.76 -1.33 0.00 0.00 177.39 175.61 2b39 s LEU 1318N -1.10 2.63 -0.25 2.23 1.43 -1.26 -0.22 118.68 122.14 2b39 s LEU 1318Ca 0.25 -0.72 -0.10 0.00 -1.03 0.00 0.00 54.13 52.54 2b39 s LEU 1318Cb 0.13 -1.38 0.10 0.00 0.03 0.00 0.00 46.19 45.08 2b39 s LEU 1318CO 0.18 0.13 0.56 -0.13 0.23 0.00 0.00 176.35 177.32 2b39 s ARG 1319N -2.57 0.49 0.46 1.70 1.81 -1.15 -4.99 118.95 114.70 2b39 s ARG 1319Ca 0.21 1.23 0.05 0.00 -1.72 0.00 0.00 55.73 55.50 2b39 s ARG 1319Cb -0.09 0.53 -0.04 0.00 -0.45 0.00 0.00 34.95 34.90 2b39 s ARG 1319CO 0.11 -0.21 0.10 -1.54 -0.68 0.00 0.00 175.30 173.08 2b39 s SER 1320N 2.52 4.19 -0.40 0.23 1.04 -1.26 -1.08 113.70 118.94 2b39 s SER 1320Ca -0.05 -1.36 0.08 0.00 0.48 0.00 0.00 55.95 55.09 2b39 s SER 1320Cb -0.11 -0.06 0.18 0.00 0.10 0.00 0.00 66.02 66.14 2b39 s SER 1320CO -0.16 -0.67 0.61 -0.70 0.98 0.00 0.00 173.24 173.29 2b39 s GLU 1321N -3.88 0.79 0.79 4.02 2.56 -0.47 -4.98 118.70 117.53 2b39 s GLU 1321Ca 0.28 -0.28 -0.11 0.00 0.00 0.00 0.00 54.97 54.86 2b39 s GLU 1321Cb 0.04 0.04 0.06 0.00 2.00 0.00 0.00 34.13 36.28 2b39 s GLU 1321CO 0.15 -1.18 1.09 -1.21 -0.56 0.00 0.00 175.26 173.55 2b39 s GLU 1322N 1.86 2.14 -0.05 4.30 2.02 -1.26 -3.05 118.70 124.66 2b39 s GLU 1322Ca 0.16 1.08 -0.30 0.00 0.02 0.00 0.00 54.97 55.93 2b39 s GLU 1322Cb -0.05 -1.89 0.08 0.00 0.10 0.00 0.00 34.13 32.37 2b39 s GLU 1322CO -0.07 -1.70 0.74 -0.08 0.02 0.00 0.00 175.26 174.17 2b39 s THR 1323N -2.93 0.00 -0.35 3.63 -1.32 -0.98 -4.95 115.64 108.74 2b39 s THR 1323Ca 0.61 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 61.15 2b39 s THR 1323Cb -0.17 -1.00 0.45 0.00 -1.51 0.00 0.00 72.50 70.27 2b39 s THR 1323CO 0.56 0.00 1.20 0.29 -2.21 0.00 0.00 174.62 174.46 2b39 n LYS 1324N 0.71 3.53 -0.09 7.08 5.02 -1.26 -0.32 118.16 132.82 2b39 n LYS 1324Ca -0.17 -4.24 -0.12 0.00 -2.02 0.00 0.00 58.31 51.76 2b39 n LYS 1324Cb 0.58 -2.27 -0.09 0.00 -0.02 0.00 0.00 35.03 33.24 2b39 n LYS 1324CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2b39 n GLU 1325N -0.64 0.57 -3.26 1.97 -0.58 -1.26 -4.84 120.64 112.59 2b39 n GLU 1325Ca 0.43 0.09 -0.13 0.00 -0.42 0.00 0.00 57.16 57.13 2b39 n GLU 1325Cb 0.86 -1.36 0.04 0.00 -0.57 0.00 0.00 31.44 30.41 2b39 n GLU 1325CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2b39 n ASN 1326N -2.98 -6.79 -3.90 1.62 5.15 -1.26 -5.03 115.26 102.07 2b39 n ASN 1326Ca -0.31 -0.57 -0.13 0.00 -0.60 0.00 0.00 54.58 52.98 2b39 n ASN 1326Cb 0.85 -4.93 -0.14 0.00 -0.53 0.00 0.00 39.78 35.03 2b39 n ASN 1326CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2b39 s GLU 1327N -4.19 0.12 0.53 1.20 2.02 -1.26 -4.79 118.70 112.34 2b39 s GLU 1327Ca 0.31 -0.10 -0.22 0.00 0.02 0.00 0.00 54.97 54.99 2b39 s GLU 1327Cb -0.05 -0.08 -0.05 0.00 0.10 0.00 0.00 34.13 34.04 2b39 s GLU 1327CO 0.76 0.02 1.33 -0.98 0.02 0.00 0.00 175.26 176.41 2b39 s ARG 1328N -0.16 3.23 0.11 1.61 1.70 -1.26 -4.71 118.95 119.46 2b39 s ARG 1328Ca -0.01 2.17 0.02 0.00 -0.47 0.00 0.00 55.73 57.45 2b39 s ARG 1328Cb -0.01 -2.28 -0.01 0.00 -0.57 0.00 0.00 34.95 32.08 2b39 s ARG 1328CO -0.00 -1.10 0.08 1.97 -1.08 0.00 0.00 175.30 175.17 2b39 n PHE 1329N -0.94 -0.19 -3.87 5.89 1.16 -0.67 -4.34 117.46 114.49 2b39 n PHE 1329Ca 0.10 -0.85 -0.11 0.00 -1.87 0.00 0.00 57.45 54.71 2b39 n PHE 1329Cb 0.45 0.07 -0.12 0.00 -1.61 0.00 0.00 39.48 38.28 2b39 n PHE 1329CO 0.00 0.00 0.00 0.95 -1.87 0.00 0.00 176.76 175.84 2b39 s THR 1330N -2.35 0.05 0.16 1.97 -4.23 -1.09 -1.53 115.64 108.62 2b39 s THR 1330Ca 0.11 -0.37 0.09 0.00 -1.18 0.00 0.00 61.69 60.34 2b39 s THR 1330Cb 0.01 -0.26 -0.04 0.00 1.34 0.00 0.00 72.50 73.54 2b39 s THR 1330CO 0.08 -0.21 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.14 2b39 s VAL 1331N -0.66 3.07 0.05 2.29 1.01 0.76 -0.95 120.40 125.97 2b39 s VAL 1331Ca -0.07 -1.63 0.03 0.00 0.00 0.00 0.00 61.98 60.31 2b39 s VAL 1331Cb -0.05 -2.49 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 2b39 s VAL 1331CO 0.00 -0.05 -0.10 -0.54 0.00 0.00 0.00 175.10 174.41 2b39 s LYS 1332N -2.64 0.63 -0.06 2.72 1.02 -1.05 -1.18 119.74 119.17 2b39 s LYS 1332Ca 0.23 -0.80 -0.08 0.00 0.02 0.00 0.00 55.97 55.33 2b39 s LYS 1332Cb -0.09 -0.48 0.02 0.00 -0.52 0.00 0.00 37.83 36.76 2b39 s LYS 1332CO 0.14 0.10 0.22 0.00 -0.92 0.00 0.00 175.35 174.88 2b39 s ALA 1333N -1.30 -0.54 0.04 5.17 0.00 0.54 0.04 121.76 125.72 2b39 s ALA 1333Ca -0.07 0.49 0.01 0.00 0.00 0.00 0.00 51.96 52.38 2b39 s ALA 1333Cb -0.10 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 2b39 s ALA 1333CO 0.01 -0.13 -0.05 -1.21 0.00 0.00 0.00 175.76 174.38 2b39 s GLU 1334N -0.23 0.46 0.00 0.00 2.02 -1.23 -1.82 118.70 117.90 2b39 s GLU 1334Ca -0.03 -0.81 0.00 0.00 0.02 0.00 0.00 54.97 54.15 2b39 s GLU 1334Cb -0.03 -0.00 0.00 0.00 0.10 0.00 0.00 34.13 34.20 2b39 s GLU 1334CO 0.01 -0.03 0.00 0.41 0.02 0.00 0.00 175.26 175.67 2b39 n GLY 1335N 1.18 0.94 3.65 -1.39 0.00 -1.26 -0.60 105.19 107.72 2b39 n GLY 1335Ca -0.21 -1.71 -0.40 0.00 0.00 0.00 0.00 46.02 43.70 2b39 n GLY 1335CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b39 n LYS 1336N 1.02 1.48 0.00 1.61 5.02 -1.23 -4.34 118.16 121.72 2b39 n LYS 1336Ca 0.00 0.54 0.00 0.00 -2.02 0.00 0.00 58.31 56.83 2b39 n LYS 1336Cb 0.00 -2.24 0.00 0.00 -0.02 0.00 0.00 35.03 32.77 2b39 n LYS 1336CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b39 n GLY 1337N 1.04 3.83 2.57 0.72 0.00 -1.26 -0.95 105.19 111.14 2b39 n GLY 1337Ca 0.09 -1.38 -0.22 0.00 0.00 0.00 0.00 46.02 44.51 2b39 n GLY 1337CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2b39 s GLN 1338N -2.58 0.72 0.00 1.61 0.74 -1.25 -4.22 119.66 114.69 2b39 s GLN 1338Ca 0.00 -1.37 0.00 0.00 0.05 0.00 0.00 55.36 54.04 2b39 s GLN 1338Cb 0.00 -1.04 0.00 0.00 1.10 0.00 0.00 33.01 33.07 2b39 s GLN 1338CO 0.00 -1.27 0.00 0.41 -0.55 0.00 0.00 175.29 173.88 2b39 n GLY 1339N 3.68 4.16 3.00 2.59 0.00 0.33 -3.61 105.19 115.34 2b39 n GLY 1339Ca 0.17 -2.08 -0.14 0.00 0.00 0.00 0.00 46.02 43.98 2b39 n GLY 1339CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b39 s THR 1340N 1.02 0.40 -0.09 2.61 2.01 -1.03 0.58 115.64 121.15 2b39 s THR 1340Ca 0.00 -0.66 0.03 0.00 0.31 0.00 0.00 61.69 61.37 2b39 s THR 1340Cb 0.00 -0.43 0.00 0.00 0.01 0.00 0.00 72.50 72.08 2b39 s THR 1340CO 0.00 -0.18 -0.21 -0.22 -0.69 0.00 0.00 174.62 173.32 2b39 s LEU 1341N -0.91 1.97 0.10 4.42 2.96 -0.33 -1.06 118.68 125.83 2b39 s LEU 1341Ca -0.05 -0.49 0.04 0.00 -0.22 0.00 0.00 54.13 53.40 2b39 s LEU 1341Cb -0.06 -1.26 -0.04 0.00 0.50 0.00 0.00 46.19 45.33 2b39 s LEU 1341CO 0.00 0.12 -0.11 -0.94 -1.32 0.00 0.00 176.35 174.10 2b39 s SER 1342N 0.45 1.60 -0.34 3.68 1.04 -0.87 -0.92 113.70 118.33 2b39 s SER 1342Ca -0.17 -0.81 0.01 0.00 0.48 0.00 0.00 55.95 55.45 2b39 s SER 1342Cb -0.17 -0.01 0.14 0.00 0.10 0.00 0.00 66.02 66.08 2b39 s SER 1342CO 0.07 -0.23 0.29 -0.69 0.98 0.00 0.00 173.24 173.66 2b39 s VAL 1343N -2.36 -0.21 0.16 5.02 1.01 0.16 -1.60 120.40 122.58 2b39 s VAL 1343Ca 0.06 -1.02 -0.02 0.00 0.00 0.00 0.00 61.98 61.00 2b39 s VAL 1343Cb -0.03 -0.88 -0.05 0.00 0.00 0.00 0.00 36.38 35.42 2b39 s VAL 1343CO 0.01 -0.67 0.36 -0.69 0.00 0.00 0.00 175.10 174.11 2b39 s VAL 1344N 1.63 5.21 -0.01 2.92 1.01 -1.13 0.74 120.40 130.77 2b39 s VAL 1344Ca 0.15 -0.21 0.01 0.00 0.00 0.00 0.00 61.98 61.93 2b39 s VAL 1344Cb -0.17 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.54 2b39 s VAL 1344CO -0.13 -0.05 -0.02 0.42 0.00 0.00 0.00 175.10 175.32 2b39 s THR 1345N -1.74 0.27 -0.09 3.92 -4.23 0.04 -1.14 115.64 112.66 2b39 s THR 1345Ca 0.39 -0.07 0.01 0.00 -1.18 0.00 0.00 61.69 60.84 2b39 s THR 1345Cb -0.12 -0.28 -0.02 0.00 1.34 0.00 0.00 72.50 73.42 2b39 s THR 1345CO 0.27 0.11 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.67 2b39 s VAL 1346N 0.35 3.34 0.38 2.29 1.01 -0.76 -1.17 120.40 125.83 2b39 s VAL 1346Ca -0.03 -0.60 -0.12 0.00 0.00 0.00 0.00 61.98 61.23 2b39 s VAL 1346Cb -0.06 -2.37 0.05 0.00 0.00 0.00 0.00 36.38 34.00 2b39 s VAL 1346CO -0.01 0.56 0.72 0.00 0.00 0.00 0.00 175.10 176.37 2b39 n TYR 1347N 2.77 -2.17 -4.42 5.22 0.18 -0.00 -1.47 117.16 117.27 2b39 n TYR 1347Ca -0.18 -1.91 -0.34 0.00 1.88 0.00 0.00 57.90 57.36 2b39 n TYR 1347Cb 0.53 0.84 -0.12 0.00 -0.38 0.00 0.00 39.34 40.20 2b39 n TYR 1347CO 0.00 0.00 0.00 -1.01 -2.08 0.00 0.00 176.86 173.77 2b39 s HIS 1348N -2.47 3.02 0.06 -3.48 3.76 -1.26 0.15 115.29 115.07 2b39 s HIS 1348Ca 0.18 -0.30 0.08 0.00 -0.15 0.00 0.00 55.06 54.87 2b39 s HIS 1348Cb -0.04 -1.95 -0.03 0.00 1.11 0.00 0.00 32.58 31.67 2b39 s HIS 1348CO 0.13 -0.03 -0.23 0.00 -0.85 0.00 0.00 174.74 173.76 2b39 s ALA 1349N 0.34 2.00 0.00 -1.40 0.00 0.30 -0.04 121.76 122.97 2b39 s ALA 1349Ca -0.04 -1.19 0.00 0.00 0.00 0.00 0.00 51.96 50.73 2b39 s ALA 1349Cb -0.14 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.59 2b39 s ALA 1349CO 0.03 0.46 0.00 1.63 0.00 0.00 0.00 175.76 177.88 2b39 n LYS 1350N 1.68 0.00 -3.61 0.00 5.02 0.23 -0.94 118.16 120.54 2b39 n LYS 1350Ca -0.17 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.00 2b39 n LYS 1350Cb 0.53 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.49 2b39 n LYS 1350CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 2b39 s LEU 1351N 0.00 0.23 -0.51 -0.35 2.34 -1.26 -4.68 118.68 114.45 2b39 s LEU 1351Ca 0.00 -0.16 0.07 0.00 0.06 0.00 0.00 54.13 54.11 2b39 s LEU 1351Cb 0.00 1.95 0.27 0.00 -0.56 0.00 0.00 46.19 47.85 2b39 s LEU 1351CO 0.00 -0.81 0.68 2.29 -1.06 0.00 0.00 176.35 177.45 2b39 n LYS 1352N -0.03 1.75 -0.37 1.48 2.85 -1.26 -5.10 118.16 117.48 2b39 n LYS 1352Ca -0.17 -4.00 -0.14 0.00 -1.05 0.00 0.00 58.31 52.95 2b39 n LYS 1352Cb 0.63 -1.80 -0.02 0.00 -0.65 0.00 0.00 35.03 33.19 2b39 n LYS 1352CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2b39 n GLY 1353N 0.86 -0.16 4.08 2.58 0.00 -1.26 -1.25 105.19 110.03 2b39 n GLY 1353Ca 0.26 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.44 2b39 n GLY 1353CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b39 n LYS 1354N 0.34 0.00 -3.82 1.61 5.02 -1.26 -4.98 118.16 115.07 2b39 n LYS 1354Ca 0.05 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.05 2b39 n LYS 1354Cb 0.03 -0.84 -0.04 0.00 -0.02 0.00 0.00 35.03 34.16 2b39 n LYS 1354CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2b39 s VAL 1355N -0.60 5.29 -0.90 -0.18 1.01 -0.38 -4.51 120.40 120.13 2b39 s VAL 1355Ca 0.00 -0.36 -0.05 0.00 0.00 0.00 0.00 61.98 61.57 2b39 s VAL 1355Cb 0.00 -3.67 -0.06 0.00 0.00 0.00 0.00 36.38 32.65 2b39 s VAL 1355CO 0.00 0.00 0.79 -0.24 0.00 0.00 0.00 175.10 175.65 2b39 n SER 1356N -0.14 -6.05 -3.15 3.32 2.88 -1.26 -4.77 113.62 104.45 2b39 n SER 1356Ca -0.05 -0.59 0.04 0.00 -1.33 0.00 0.00 58.87 56.94 2b39 n SER 1356Cb 0.52 -4.57 -0.01 0.00 -0.75 0.00 0.00 64.21 59.40 2b39 n SER 1356CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2b39 s LYS 1358N 2.85 0.69 -0.41 0.00 -2.85 -1.07 -4.86 119.74 114.09 2b39 s LYS 1358Ca 0.19 -1.02 0.00 0.00 -1.00 0.00 0.00 55.97 54.14 2b39 s LYS 1358Cb -0.14 -0.31 0.00 0.00 -2.06 0.00 0.00 37.83 35.32 2b39 s LYS 1358CO -0.22 0.03 0.00 1.63 0.10 0.00 0.00 175.35 176.89 2b39 n LYS 1359N 0.81 -1.08 -3.54 1.78 4.76 -1.26 -1.83 118.16 117.79 2b39 n LYS 1359Ca -0.18 0.49 -0.17 0.00 -2.87 0.00 0.00 58.31 55.58 2b39 n LYS 1359Cb 0.57 -4.42 -0.06 0.00 -1.84 0.00 0.00 35.03 29.28 2b39 n LYS 1359CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2b39 s PHE 1360N -1.73 -0.66 -0.04 2.13 0.08 -1.26 -3.30 117.98 113.19 2b39 s PHE 1360Ca 0.00 1.22 0.03 0.00 0.12 0.00 0.00 56.93 58.30 2b39 s PHE 1360Cb 0.00 0.39 -0.03 0.00 -0.57 0.00 0.00 43.02 42.81 2b39 s PHE 1360CO 0.00 -0.56 -0.11 -0.51 -0.10 0.00 0.00 175.22 173.94 2b39 s ASP 1361N -0.93 4.29 -0.23 1.36 1.01 0.74 -4.81 116.67 118.11 2b39 s ASP 1361Ca -0.09 -0.15 -0.06 0.00 0.71 0.00 0.00 52.55 52.97 2b39 s ASP 1361Cb -0.01 -0.96 0.11 0.00 1.01 0.00 0.00 42.92 43.07 2b39 s ASP 1361CO 0.08 0.34 0.44 -0.22 0.21 0.00 0.00 175.17 176.02 2b39 s LEU 1362N -0.91 -0.75 -0.03 1.23 1.98 -1.26 -1.17 118.68 117.76 2b39 s LEU 1362Ca 0.13 0.83 0.05 0.00 -2.89 0.00 0.00 54.13 52.24 2b39 s LEU 1362Cb -0.11 1.45 -0.03 0.00 0.66 0.00 0.00 46.19 48.16 2b39 s LEU 1362CO 0.02 -0.25 -0.17 -0.60 -1.89 0.00 0.00 176.35 173.46 2b39 s ARG 1363N 2.64 2.36 -0.08 1.98 3.52 0.10 -4.81 118.95 124.66 2b39 s ARG 1363Ca 0.04 -0.78 -0.03 0.00 -0.13 0.00 0.00 55.73 54.82 2b39 s ARG 1363Cb -0.13 -2.28 0.05 0.00 -1.56 0.00 0.00 34.95 31.02 2b39 s ARG 1363CO -0.15 0.60 0.16 0.08 -0.81 0.00 0.00 175.30 175.18 2b39 s VAL 1364N -0.73 -0.26 0.04 7.11 1.01 -1.26 -1.79 120.40 124.53 2b39 s VAL 1364Ca 0.12 0.35 0.03 0.00 0.00 0.00 0.00 61.98 62.48 2b39 s VAL 1364Cb -0.10 -0.30 -0.02 0.00 0.00 0.00 0.00 36.38 35.96 2b39 s VAL 1364CO 0.01 0.15 -0.10 -0.44 0.00 0.00 0.00 175.10 174.71 2b39 s SER 1365N 2.25 1.19 -0.00 3.32 0.01 -1.05 -4.78 113.70 114.64 2b39 s SER 1365Ca 0.03 -0.50 -0.02 0.00 1.31 0.00 0.00 55.95 56.76 2b39 s SER 1365Cb -0.12 -0.03 -0.00 0.00 0.21 0.00 0.00 66.02 66.08 2b39 s SER 1365CO -0.06 -0.09 0.04 -0.51 0.41 0.00 0.00 173.24 173.03 2b39 s ILE 1366N -1.11 0.05 -0.06 1.44 2.07 -1.26 -1.78 121.20 120.54 2b39 s ILE 1366Ca -0.04 -0.43 -0.30 0.00 -1.41 0.00 0.00 60.65 58.46 2b39 s ILE 1366Cb -0.09 -0.21 0.07 0.00 0.13 0.00 0.00 42.46 42.36 2b39 s ILE 1366CO 0.01 -0.24 0.68 0.00 -1.91 0.00 0.00 174.94 173.48 2b39 s ARG 1367N -0.73 1.04 0.16 3.50 1.70 -0.91 -4.72 118.95 118.99 2b39 s ARG 1367Ca -0.08 0.30 -0.34 0.00 -0.47 0.00 0.00 55.73 55.14 2b39 s ARG 1367Cb -0.05 0.49 -0.15 0.00 -0.57 0.00 0.00 34.95 34.67 2b39 s ARG 1367CO -0.00 -0.31 1.36 -0.35 -1.08 0.00 0.00 175.30 174.91 2b39 n PRO 1368N 1.03 1.57 -0.90 3.89 -0.04 -1.26 -1.20 135.00 138.09 2b39 n PRO 1368Ca -0.19 0.56 -0.30 0.00 -0.04 0.00 0.00 63.50 63.54 2b39 n PRO 1368Cb 0.57 -2.19 0.18 0.00 -0.04 0.00 0.00 33.50 32.01 2b39 n PRO 1368CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b39 s ALA 1369N 0.27 0.90 0.66 0.55 0.00 -0.43 -4.71 121.76 119.00 2b39 s ALA 1369Ca 0.76 0.05 -0.17 0.00 0.00 0.00 0.00 51.96 52.61 2b39 s ALA 1369Cb -0.80 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.06 2b39 s ALA 1369CO 0.47 -2.91 1.21 -1.25 0.00 0.00 0.00 175.76 173.28 2b39 s PRO 1370N -4.73 2.56 0.18 0.00 0.04 -1.26 -4.93 135.00 126.86 2b39 s PRO 1370Ca 0.66 1.78 -0.13 0.00 0.04 0.00 0.00 61.00 63.35 2b39 s PRO 1370Cb -0.21 -1.88 0.09 0.00 0.04 0.00 0.00 34.50 32.54 2b39 s PRO 1370CO 0.59 -1.52 1.82 1.49 0.04 0.00 0.00 177.00 179.43 2b39 h GLU 1371N 0.26 0.82 -1.80 4.56 4.57 -1.98 -3.03 114.58 117.98 2b39 h GLU 1371Ca -0.49 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 57.62 2b39 h GLU 1371Cb 1.30 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.71 2b39 h GLU 1371CO 0.52 0.58 0.00 0.25 -1.18 0.00 0.00 179.01 179.19 2b39 n THR 1372N -4.62 0.47 -4.06 0.32 -2.24 -1.26 -4.83 114.28 98.06 2b39 n THR 1372Ca 0.04 -0.07 -0.30 0.00 -2.27 0.00 0.00 64.05 61.46 2b39 n THR 1372Cb 0.05 -0.87 -0.06 0.00 -2.10 0.00 0.00 70.33 67.36 2b39 n THR 1372CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2b39 s VAL 1373N 0.93 4.51 -1.22 2.28 0.11 -1.15 -5.04 120.40 120.83 2b39 s VAL 1373Ca 0.00 -0.84 -0.21 0.00 -2.93 0.00 0.00 61.98 58.00 2b39 s VAL 1373Cb 0.00 -3.20 -0.03 0.00 -1.53 0.00 0.00 36.38 31.62 2b39 s VAL 1373CO 0.00 0.08 1.87 2.29 -3.33 0.00 0.00 175.10 176.01 2b39 n LYS 1374N 0.29 2.21 -3.53 1.54 2.85 -1.26 -4.97 118.16 115.29 2b39 n LYS 1374Ca -0.09 -2.74 -0.37 0.00 -1.05 0.00 0.00 58.31 54.06 2b39 n LYS 1374Cb 0.52 -3.60 -0.06 0.00 -0.65 0.00 0.00 35.03 31.24 2b39 n LYS 1374CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 2b39 s LYS 1375N 5.50 4.01 0.09 -1.58 2.36 -1.12 -4.91 119.74 124.10 2b39 s LYS 1375Ca 0.62 0.27 -0.34 0.00 -2.55 0.00 0.00 55.97 53.96 2b39 s LYS 1375Cb 0.02 -3.30 -0.14 0.00 -1.05 0.00 0.00 37.83 33.36 2b39 s LYS 1375CO 0.11 0.50 1.62 -2.30 1.55 0.00 0.00 175.35 176.83 2b39 n PRO 1376N 2.58 2.05 -0.47 4.03 -0.02 -1.26 -4.27 135.00 137.64 2b39 n PRO 1376Ca -0.13 0.74 0.42 0.00 -2.02 0.00 0.00 63.50 62.51 2b39 n PRO 1376Cb 0.52 -2.51 0.78 0.00 -0.02 0.00 0.00 33.50 32.27 2b39 n PRO 1376CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 2b39 h GLN 1377N 6.50 0.00 0.00 -0.52 -0.00 -1.83 0.36 115.11 119.61 2b39 h GLN 1377Ca -0.46 0.00 -0.14 0.00 -0.00 0.00 0.00 58.65 58.05 2b39 h GLN 1377Cb 1.27 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.72 2b39 h GLN 1377CO 0.89 0.00 -0.82 0.22 -0.00 0.00 0.00 178.83 179.12 2b39 h ASP 1378N 0.00 0.00 -3.22 0.06 1.82 -1.96 -3.47 116.42 109.65 2b39 h ASP 1378Ca 0.71 0.00 -0.55 0.00 -0.39 0.00 0.00 57.03 56.80 2b39 h ASP 1378Cb 2.85 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 42.84 2b39 h ASP 1378CO -0.01 0.60 0.56 0.00 -1.61 0.00 0.00 179.24 178.78 2b39 s ALA 1379N -2.91 3.37 -0.94 -0.78 0.00 0.13 -4.89 121.76 115.74 2b39 s ALA 1379Ca 0.02 0.61 0.00 0.00 0.00 0.00 0.00 51.96 52.58 2b39 s ALA 1379Cb 0.08 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.76 2b39 s ALA 1379CO 0.77 -0.52 0.39 1.63 0.00 0.00 0.00 175.76 178.03 2b39 n LYS 1380N 4.54 0.73 0.00 0.00 5.02 0.39 -4.80 118.16 124.05 2b39 n LYS 1380Ca 0.09 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.38 2b39 n LYS 1380Cb 0.48 -1.35 0.00 0.00 -0.02 0.00 0.00 35.03 34.14 2b39 n LYS 1380CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b39 n GLY 1381N 0.17 4.38 3.04 0.72 0.00 -1.20 -4.94 105.19 107.36 2b39 n GLY 1381Ca 0.00 -1.38 -0.09 0.00 0.00 0.00 0.00 46.02 44.56 2b39 n GLY 1381CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b39 s SER 1382N 0.00 0.45 0.37 1.61 1.04 -1.26 -0.15 113.70 115.76 2b39 s SER 1382Ca 0.00 -0.70 0.06 0.00 0.48 0.00 0.00 55.95 55.79 2b39 s SER 1382Cb 0.00 0.12 -0.07 0.00 0.10 0.00 0.00 66.02 66.17 2b39 s SER 1382CO 0.00 -0.39 0.02 -0.04 0.98 0.00 0.00 173.24 173.80 2b39 s MET 1383N -2.40 1.83 -0.16 4.02 -1.94 -0.64 -1.32 119.30 118.68 2b39 s MET 1383Ca -0.06 -2.02 -0.03 0.00 -1.71 0.00 0.00 55.69 51.87 2b39 s MET 1383Cb -0.03 -1.35 -0.02 0.00 2.01 0.00 0.00 34.83 35.44 2b39 s MET 1383CO -0.04 -0.08 -0.06 0.42 -0.01 0.00 0.00 175.02 175.25 2b39 s ILE 1384N -2.93 3.62 -0.19 2.53 1.01 -0.34 -1.33 121.20 123.57 2b39 s ILE 1384Ca 0.35 -0.45 -0.00 0.00 0.00 0.00 0.00 60.65 60.55 2b39 s ILE 1384Cb 0.09 -2.59 0.01 0.00 0.01 0.00 0.00 42.46 39.98 2b39 s ILE 1384CO 0.17 0.48 -0.15 -0.22 0.00 0.00 0.00 174.94 175.22 2b39 s LEU 1385N 0.61 2.38 -0.17 2.97 2.96 -0.60 -2.14 118.68 124.69 2b39 s LEU 1385Ca -0.04 -0.56 -0.03 0.00 -0.22 0.00 0.00 54.13 53.29 2b39 s LEU 1385Cb -0.15 -1.56 -0.02 0.00 0.50 0.00 0.00 46.19 44.96 2b39 s LEU 1385CO 0.03 0.01 -0.06 -1.81 -1.32 0.00 0.00 176.35 173.19 2b39 s ASP 1386N 1.27 4.43 -0.05 3.68 1.01 -0.74 -1.57 116.67 124.71 2b39 s ASP 1386Ca 0.04 -0.27 0.05 0.00 0.71 0.00 0.00 52.55 53.08 2b39 s ASP 1386Cb -0.14 -1.73 -0.02 0.00 1.01 0.00 0.00 42.92 42.05 2b39 s ASP 1386CO -0.08 0.10 -0.21 -0.63 0.21 0.00 0.00 175.17 174.56 2b39 s ILE 1387N 0.78 2.48 -0.14 0.77 1.01 0.22 -2.51 121.20 123.80 2b39 s ILE 1387Ca -0.02 -0.93 -0.06 0.00 0.00 0.00 0.00 60.65 59.64 2b39 s ILE 1387Cb -0.15 -1.93 0.06 0.00 0.01 0.00 0.00 42.46 40.46 2b39 s ILE 1387CO 0.02 0.58 0.30 0.00 0.00 0.00 0.00 174.94 175.83 2b39 s THR 1389N 2.01 0.88 -0.06 0.00 -1.32 -0.64 -0.72 115.64 115.79 2b39 s THR 1389Ca -0.03 -1.90 -0.06 0.00 -1.21 0.00 0.00 61.69 58.48 2b39 s THR 1389Cb -0.11 -1.65 0.02 0.00 -1.51 0.00 0.00 72.50 69.24 2b39 s THR 1389CO -0.10 -0.77 0.17 -0.75 -2.21 0.00 0.00 174.62 170.97 2b39 s LYS 1390N -3.57 0.20 0.33 7.08 2.20 -0.32 0.28 119.74 125.94 2b39 s LYS 1390Ca 0.12 0.24 -0.24 0.00 -0.36 0.00 0.00 55.97 55.73 2b39 s LYS 1390Cb 0.03 0.09 -0.10 0.00 -1.51 0.00 0.00 37.83 36.34 2b39 s LYS 1390CO -0.02 -0.03 0.90 -0.47 -0.36 0.00 0.00 175.35 175.37 2b39 s TYR 1391N 0.13 3.60 -0.28 4.03 6.04 -0.26 -0.18 117.35 130.42 2b39 s TYR 1391Ca -0.00 1.67 0.10 0.00 0.04 0.00 0.00 57.07 58.87 2b39 s TYR 1391Cb -0.02 -2.85 0.53 0.00 -1.04 0.00 0.00 41.96 38.59 2b39 s TYR 1391CO -0.00 0.16 1.50 1.28 -1.54 0.00 0.00 175.55 176.95 2b39 n LEU 1392N 0.31 4.34 -4.79 6.97 4.77 -1.21 -4.39 117.00 123.00 2b39 n LEU 1392Ca 0.02 -3.61 -0.22 0.00 -0.03 0.00 0.00 56.01 52.17 2b39 n LEU 1392Cb 0.51 -0.64 -0.05 0.00 -2.33 0.00 0.00 43.42 40.91 2b39 n LEU 1392CO 0.43 1.13 -0.13 -0.83 -1.33 0.00 0.00 177.39 176.65 2b39 s GLY 1393N -2.30 1.91 0.00 -0.72 0.00 -1.26 -4.97 107.32 99.98 2b39 s GLY 1393Ca 0.45 -1.78 0.01 0.00 0.00 0.00 0.00 44.72 43.41 2b39 s GLY 1393CO 0.03 -1.69 0.75 1.22 0.00 0.00 0.00 173.10 173.41 2b39 n ASP 1394N -1.28 0.00 -4.09 1.64 8.00 -1.26 -4.65 116.55 114.91 2b39 n ASP 1394Ca -0.02 0.15 -0.10 0.00 0.71 0.00 0.00 54.79 55.53 2b39 n ASP 1394Cb 0.61 -0.18 -0.09 0.00 -0.02 0.00 0.00 41.12 41.44 2b39 n ASP 1394CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2b39 s GLN 1395N -2.36 1.09 0.26 -1.24 -0.21 -1.26 -5.11 119.66 110.83 2b39 s GLN 1395Ca 0.02 -1.38 -0.30 0.00 0.02 0.00 0.00 55.36 53.72 2b39 s GLN 1395Cb 0.01 0.30 -0.10 0.00 1.00 0.00 0.00 33.01 34.23 2b39 s GLN 1395CO 0.02 -0.36 1.38 -0.51 -2.12 0.00 0.00 175.29 173.70 2b39 s ASP 1396N -3.04 6.73 0.62 5.90 1.11 -1.26 -4.63 116.67 122.09 2b39 s ASP 1396Ca 0.25 2.62 -0.19 0.00 0.18 0.00 0.00 52.55 55.41 2b39 s ASP 1396Cb 0.06 -2.63 -0.02 0.00 1.07 0.00 0.00 42.92 41.39 2b39 s ASP 1396CO 0.04 -0.63 1.27 0.00 1.18 0.00 0.00 175.17 177.03 2b39 s ALA 1397N -0.28 2.48 0.46 5.23 0.00 0.09 -4.86 121.76 124.89 2b39 s ALA 1397Ca 0.56 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.68 2b39 s ALA 1397Cb -0.40 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.20 2b39 s ALA 1397CO 0.45 -1.43 0.00 -2.37 0.00 0.00 0.00 175.76 172.41 2b39 n THR 1398N -1.70 0.00 -1.65 0.00 5.66 -1.26 -2.42 114.28 112.91 2b39 n THR 1398Ca 0.15 0.00 -0.53 0.00 -3.05 0.00 0.00 64.05 60.62 2b39 n THR 1398Cb 0.48 -1.36 -0.06 0.00 -1.55 0.00 0.00 70.33 67.84 2b39 n THR 1398CO 0.00 0.00 0.00 0.80 -3.05 0.00 0.00 175.07 172.82 2b39 n MET 1399N 0.00 1.39 -4.50 1.09 1.56 -0.72 -4.12 117.12 111.81 2b39 n MET 1399Ca 0.00 0.50 -0.24 0.00 -0.27 0.00 0.00 57.70 57.69 2b39 n MET 1399Cb 0.00 -2.20 -0.09 0.00 2.15 0.00 0.00 33.22 33.08 2b39 n MET 1399CO 0.00 0.00 0.00 -1.12 -0.73 0.00 0.00 175.97 174.12 2b39 s SER 1400N 2.00 2.68 0.02 6.12 0.01 -0.51 -2.03 113.70 121.99 2b39 s SER 1400Ca 0.90 -1.56 0.02 0.00 1.31 0.00 0.00 55.95 56.61 2b39 s SER 1400Cb -0.93 0.29 -0.01 0.00 0.21 0.00 0.00 66.02 65.57 2b39 s SER 1400CO 0.53 -0.81 -0.06 -0.63 0.41 0.00 0.00 173.24 172.68 2b39 s ILE 1401N -3.24 0.46 -0.23 1.44 1.01 0.55 -1.41 121.20 119.78 2b39 s ILE 1401Ca 0.28 -0.64 -0.03 0.00 0.00 0.00 0.00 60.65 60.26 2b39 s ILE 1401Cb 0.05 -0.47 0.01 0.00 0.01 0.00 0.00 42.46 42.06 2b39 s ILE 1401CO 0.14 -0.13 -0.06 -0.76 0.00 0.00 0.00 174.94 174.13 2b39 s LEU 1402N -0.83 3.00 -0.77 2.97 1.43 -0.20 -2.02 118.68 122.26 2b39 s LEU 1402Ca -0.04 -0.63 -0.10 0.00 -1.03 0.00 0.00 54.13 52.33 2b39 s LEU 1402Cb -0.06 -1.69 0.20 0.00 0.03 0.00 0.00 46.19 44.67 2b39 s LEU 1402CO 0.00 -0.07 0.67 -0.62 0.23 0.00 0.00 176.35 176.55 2b39 s ASP 1403N 1.40 6.22 -0.36 2.29 -1.08 0.18 -1.22 116.67 124.09 2b39 s ASP 1403Ca 0.03 -2.82 -0.16 0.00 -0.52 0.00 0.00 52.55 49.08 2b39 s ASP 1403Cb -0.15 -2.08 -0.01 0.00 -1.46 0.00 0.00 42.92 39.23 2b39 s ASP 1403CO -0.04 -0.48 0.37 -0.63 0.52 0.00 0.00 175.17 174.91 2b39 s ILE 1404N -0.03 5.16 -0.10 4.11 1.01 -0.26 -2.24 121.20 128.84 2b39 s ILE 1404Ca 0.18 -0.04 -0.12 0.00 0.00 0.00 0.00 60.65 60.67 2b39 s ILE 1404Cb -0.13 -3.86 -0.05 0.00 0.01 0.00 0.00 42.46 38.43 2b39 s ILE 1404CO -0.07 -0.15 0.29 -0.94 0.00 0.00 0.00 174.94 174.06 2b39 s SER 1405N 1.74 6.54 0.38 3.58 1.04 -0.32 0.17 113.70 126.83 2b39 s SER 1405Ca 0.12 0.64 -0.15 0.00 0.48 0.00 0.00 55.95 57.03 2b39 s SER 1405Cb -0.17 -2.17 -0.08 0.00 0.10 0.00 0.00 66.02 63.70 2b39 s SER 1405CO 0.12 0.25 0.81 -0.04 0.98 0.00 0.00 173.24 175.36 2b39 s MET 1406N -0.40 3.97 0.33 4.02 1.00 0.23 -3.29 119.30 125.17 2b39 s MET 1406Ca 0.18 0.72 -0.27 0.00 0.00 0.00 0.00 55.69 56.33 2b39 s MET 1406Cb -0.14 -2.35 -0.09 0.00 0.00 0.00 0.00 34.83 32.25 2b39 s MET 1406CO 0.07 0.03 1.03 -1.64 0.00 0.00 0.00 175.02 174.50 2b39 s MET 1407N -3.36 4.47 -0.39 2.03 -1.94 -1.26 -4.54 119.30 114.30 2b39 s MET 1407Ca 0.55 1.55 -0.42 0.00 -1.71 0.00 0.00 55.69 55.66 2b39 s MET 1407Cb -0.10 -2.86 -0.17 0.00 2.01 0.00 0.00 34.83 33.71 2b39 s MET 1407CO 0.22 0.12 1.84 0.25 -0.01 0.00 0.00 175.02 177.44 2b39 n THR 1408N 0.59 0.15 0.00 2.05 -2.24 -1.26 -0.60 114.28 112.97 2b39 n THR 1408Ca 0.02 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 2b39 n THR 1408Cb 0.48 -0.95 0.00 0.00 -2.10 0.00 0.00 70.33 67.76 2b39 n THR 1408CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b39 n GLY 1409N 5.08 3.11 3.74 3.38 0.00 -1.26 -4.91 105.19 114.33 2b39 n GLY 1409Ca 0.35 -1.06 -0.32 0.00 0.00 0.00 0.00 46.02 44.99 2b39 n GLY 1409CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2b39 s PHE 1410N -0.23 2.34 -0.28 1.61 0.08 0.23 -3.23 117.98 118.49 2b39 s PHE 1410Ca 0.00 1.60 -0.21 0.00 0.12 0.00 0.00 56.93 58.45 2b39 s PHE 1410Cb 0.00 -3.20 0.08 0.00 -0.57 0.00 0.00 43.02 39.33 2b39 s PHE 1410CO 0.00 -2.07 0.71 0.45 -0.10 0.00 0.00 175.22 174.20 2b39 s SER 1411N -2.83 -0.85 0.64 1.36 0.15 -0.80 -4.76 113.70 106.62 2b39 s SER 1411Ca 0.66 1.48 -0.18 0.00 0.70 0.00 0.00 55.95 58.61 2b39 s SER 1411Cb -0.21 1.43 -0.02 0.00 -1.71 0.00 0.00 66.02 65.51 2b39 s SER 1411CO 0.51 -0.24 1.28 -2.16 1.20 0.00 0.00 173.24 173.83 2b39 s PRO 1412N 1.01 2.62 -0.38 5.44 0.04 -1.26 -2.14 135.00 140.32 2b39 s PRO 1412Ca -0.05 2.04 -0.29 0.00 0.04 0.00 0.00 61.00 62.74 2b39 s PRO 1412Cb -0.05 -1.86 0.01 0.00 0.04 0.00 0.00 34.50 32.64 2b39 s PRO 1412CO -0.09 -1.54 1.33 0.34 0.04 0.00 0.00 177.00 177.07 2b39 s ASP 1413N -1.41 6.51 0.46 6.66 -1.08 0.11 -4.84 116.67 123.08 2b39 s ASP 1413Ca 0.82 0.91 0.16 0.00 -0.52 0.00 0.00 52.55 53.92 2b39 s ASP 1413Cb -0.37 -2.54 1.07 0.00 -1.46 0.00 0.00 42.92 39.62 2b39 s ASP 1413CO 0.39 -1.27 2.00 0.58 0.52 0.00 0.00 175.17 177.39 2b39 h VAL 1414N 6.24 1.06 -0.10 1.11 2.07 -1.92 -2.57 116.25 122.14 2b39 h VAL 1414Ca -0.26 -0.61 -0.20 0.00 0.82 0.00 0.00 66.70 66.45 2b39 h VAL 1414Cb 1.09 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 32.20 2b39 h VAL 1414CO 1.07 0.17 -0.76 -0.33 0.02 0.00 0.00 177.57 177.74 2b39 h GLU 1415N 0.00 0.54 0.10 1.57 4.39 -1.98 -2.32 114.58 116.88 2b39 h GLU 1415Ca -0.00 -0.45 -0.01 0.00 0.34 0.00 0.00 59.36 59.24 2b39 h GLU 1415Cb 0.32 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 2b39 h GLU 1415CO 0.02 1.08 -0.05 -0.44 -1.16 0.00 0.00 179.01 178.46 2b39 h ASP 1416N 0.37 -0.12 -0.75 1.42 3.32 -1.89 -2.95 116.42 115.83 2b39 h ASP 1416Ca -0.04 -0.28 0.06 0.00 0.02 0.00 0.00 57.03 56.79 2b39 h ASP 1416Cb 1.36 0.03 -0.05 0.00 0.22 0.00 0.00 39.33 40.90 2b39 h ASP 1416CO 0.14 0.22 0.49 -0.07 -1.72 0.00 0.00 179.24 178.30 2b39 h LEU 1417N -0.47 0.70 -0.11 1.55 3.38 -1.51 -1.51 115.31 117.34 2b39 h LEU 1417Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2b39 h LEU 1417Cb 0.39 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 2b39 h LEU 1417CO 0.02 0.45 0.04 0.50 0.09 0.00 0.00 178.44 179.54 2b39 h LYS 1418N 0.79 0.16 -0.66 1.13 3.64 -1.38 -1.41 116.57 118.84 2b39 h LYS 1418Ca 0.32 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.64 2b39 h LYS 1418Cb 0.25 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 2b39 h LYS 1418CO -0.11 0.29 0.31 1.79 -2.27 0.00 0.00 179.45 179.46 2b39 h THR 1419N 0.00 1.22 0.00 1.00 1.35 -1.27 0.97 112.91 116.18 2b39 h THR 1419Ca 0.03 -0.62 0.00 0.00 -0.55 0.00 0.00 66.41 65.28 2b39 h THR 1419Cb 0.19 0.38 0.00 0.00 -1.73 0.00 0.00 68.15 66.99 2b39 h THR 1419CO -0.00 0.26 0.00 -0.07 -0.25 0.00 0.00 175.52 175.46 2b39 h LEU 1420N 0.93 0.00 -1.49 3.87 3.38 -1.01 -3.19 115.31 117.80 2b39 h LEU 1420Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 2b39 h LEU 1420Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2b39 h LEU 1420CO -0.03 0.00 0.00 -1.20 0.09 0.00 0.00 178.44 177.30 2b39 n SER 1421N -2.47 1.69 0.00 -0.43 7.64 0.19 -1.72 113.62 118.52 2b39 n SER 1421Ca 0.01 -1.38 0.00 0.00 1.01 0.00 0.00 58.87 58.51 2b39 n SER 1421Cb 0.21 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 2b39 n SER 1421CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2b39 n THR 1422N 0.33 0.00 -0.51 0.44 -1.04 -0.32 -4.84 114.28 108.34 2b39 n THR 1422Ca 0.04 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.76 2b39 n THR 1422Cb 0.19 0.15 0.24 0.00 -1.82 0.00 0.00 70.33 69.10 2b39 n THR 1422CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2b39 n GLY 1423N 2.37 -2.05 0.23 3.41 0.00 -1.23 -4.84 105.19 103.07 2b39 n GLY 1423Ca 0.00 -1.11 0.03 0.00 0.00 0.00 0.00 46.02 44.95 2b39 n GLY 1423CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2b39 h VAL 1424N -2.58 1.17 -2.90 1.61 2.07 -1.90 -3.08 116.25 110.63 2b39 h VAL 1424Ca -0.60 -0.75 -0.77 0.00 0.82 0.00 0.00 66.70 65.41 2b39 h VAL 1424Cb 1.34 1.26 -0.23 0.00 -1.52 0.00 0.00 31.29 32.14 2b39 h VAL 1424CO 0.47 0.23 0.85 1.51 0.02 0.00 0.00 177.57 180.65 2b39 s ASP 1425N -6.92 7.14 -0.10 0.57 -4.77 -1.26 -3.88 116.67 107.45 2b39 s ASP 1425Ca -0.05 -3.19 -0.30 0.00 -3.30 0.00 0.00 52.55 45.72 2b39 s ASP 1425Cb 0.15 -2.30 -0.02 0.00 -1.09 0.00 0.00 42.92 39.67 2b39 s ASP 1425CO 0.72 -0.55 1.04 -0.13 0.70 0.00 0.00 175.17 176.95 2b39 s ARG 1426N 0.30 4.41 0.00 2.11 0.52 -1.17 -4.89 118.95 120.23 2b39 s ARG 1426Ca 0.35 1.44 0.12 0.00 -0.52 0.00 0.00 55.73 57.12 2b39 s ARG 1426Cb -0.07 -3.55 -0.08 0.00 0.52 0.00 0.00 34.95 31.78 2b39 s ARG 1426CO -0.05 -0.34 0.59 0.66 0.02 0.00 0.00 175.30 176.18 2b39 n TYR 1427N 5.06 0.00 -3.74 -0.53 4.01 -0.76 -4.89 117.16 116.31 2b39 n TYR 1427Ca 0.09 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.71 2b39 n TYR 1427Cb 0.48 0.00 -0.12 0.00 -0.31 0.00 0.00 39.34 39.39 2b39 n TYR 1427CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2b39 s ILE 1428N -1.91 -0.02 -0.02 -0.72 1.01 -0.70 -4.98 121.20 113.86 2b39 s ILE 1428Ca 0.07 0.07 -0.07 0.00 0.00 0.00 0.00 60.65 60.71 2b39 s ILE 1428Cb 0.09 -0.43 -0.30 0.00 0.01 0.00 0.00 42.46 41.84 2b39 s ILE 1428CO 0.42 0.03 0.77 0.28 0.00 0.00 0.00 174.94 176.43 2b39 h SER 1429N 6.49 0.52 -4.36 3.58 0.02 -1.73 -3.39 113.55 114.69 2b39 h SER 1429Ca -0.33 -0.75 0.06 0.00 -0.84 0.00 0.00 61.79 59.93 2b39 h SER 1429Cb 1.18 -0.17 -0.21 0.00 0.14 0.00 0.00 62.40 63.34 2b39 h SER 1429CO 0.34 1.63 0.48 -0.75 -1.14 0.00 0.00 176.83 177.38 2b39 s LYS 1430N -2.60 0.71 0.12 3.45 2.20 -1.24 -4.88 119.74 117.52 2b39 s LYS 1430Ca -0.12 0.08 0.00 0.00 -0.36 0.00 0.00 55.97 55.57 2b39 s LYS 1430Cb 0.06 0.34 -0.04 0.00 -1.51 0.00 0.00 37.83 36.67 2b39 s LYS 1430CO 0.86 -0.24 0.00 1.52 -0.36 0.00 0.00 175.35 177.13 2b39 s TYR 1431N -1.50 0.92 -0.18 4.03 -0.85 -1.26 0.38 117.35 118.89 2b39 s TYR 1431Ca -0.02 -1.07 -0.30 0.00 -0.52 0.00 0.00 57.07 55.16 2b39 s TYR 1431Cb -0.00 -0.54 0.14 0.00 0.38 0.00 0.00 41.96 41.93 2b39 s TYR 1431CO 0.01 -0.32 1.07 -1.83 -1.52 0.00 0.00 175.55 172.95 2b39 s GLU 1432N -3.94 0.49 0.76 -3.49 -1.05 -0.26 -4.99 118.70 106.22 2b39 s GLU 1432Ca 0.19 0.11 -0.08 0.00 -0.15 0.00 0.00 54.97 55.04 2b39 s GLU 1432Cb 0.07 0.23 0.09 0.00 -0.44 0.00 0.00 34.13 34.08 2b39 s GLU 1432CO -0.01 -0.15 1.08 -1.64 0.95 0.00 0.00 175.26 175.48 2b39 s MET 1433N -1.13 1.86 -0.18 -4.83 -1.94 -1.26 -0.11 119.30 111.71 2b39 s MET 1433Ca 0.00 -0.35 -0.04 0.00 -1.71 0.00 0.00 55.69 53.59 2b39 s MET 1433Cb -0.01 -2.12 0.07 0.00 2.01 0.00 0.00 34.83 34.79 2b39 s MET 1433CO -0.00 -1.49 0.15 1.21 -0.01 0.00 0.00 175.02 174.87 2b39 s ASN 1434N -4.61 1.85 1.14 3.03 2.47 0.08 -4.78 114.94 114.12 2b39 s ASN 1434Ca 0.63 -0.40 -0.07 0.00 0.42 0.00 0.00 52.86 53.44 2b39 s ASN 1434Cb -0.09 0.04 0.11 0.00 -1.45 0.00 0.00 41.25 39.86 2b39 s ASN 1434CO 0.46 -0.33 0.28 0.54 -3.72 0.00 0.00 177.10 174.33 2b39 n ARG 1435N 5.30 -2.71 -1.62 0.43 1.74 -1.26 -4.04 116.66 114.49 2b39 n ARG 1435Ca -0.06 -0.46 -0.03 0.00 -0.77 0.00 0.00 57.85 56.53 2b39 n ARG 1435Cb 0.49 -0.57 -0.01 0.00 -1.02 0.00 0.00 32.46 31.35 2b39 n ARG 1435CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2b39 n ASP 1436N -3.83 -1.16 -4.07 0.55 5.75 -1.26 -4.91 116.55 107.63 2b39 n ASP 1436Ca 0.04 0.21 -0.32 0.00 -0.01 0.00 0.00 54.79 54.72 2b39 n ASP 1436Cb 0.18 -1.31 -0.16 0.00 -1.03 0.00 0.00 41.12 38.81 2b39 n ASP 1436CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2b39 s SER 1437N -1.55 3.19 0.05 -1.12 1.04 -1.26 -4.99 113.70 109.07 2b39 s SER 1437Ca 0.00 -0.72 -0.02 0.00 0.48 0.00 0.00 55.95 55.69 2b39 s SER 1437Cb 0.00 -1.36 0.09 0.00 0.10 0.00 0.00 66.02 64.84 2b39 s SER 1437CO 0.00 -0.06 0.31 0.59 0.98 0.00 0.00 173.24 175.06 2b39 n ASN 1438N 4.65 -0.08 -4.61 7.02 3.02 -1.26 -4.13 115.26 119.87 2b39 n ASN 1438Ca -0.18 0.35 -0.32 0.00 -0.03 0.00 0.00 54.58 54.40 2b39 n ASN 1438Cb 0.49 -0.10 -0.10 0.00 -0.61 0.00 0.00 39.78 39.45 2b39 n ASN 1438CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2b39 s LYS 1439N -5.24 2.57 -0.32 3.52 1.02 -1.26 -4.72 119.74 115.31 2b39 s LYS 1439Ca -0.03 -0.72 -0.37 0.00 0.02 0.00 0.00 55.97 54.87 2b39 s LYS 1439Cb 0.05 -2.52 -0.13 0.00 -0.52 0.00 0.00 37.83 34.71 2b39 s LYS 1439CO 0.15 0.60 2.02 -1.71 -0.92 0.00 0.00 175.35 175.49 2b39 n ASN 1440N 1.47 2.23 -4.40 2.83 2.85 -1.26 -4.80 115.26 114.18 2b39 n ASN 1440Ca -0.15 0.70 -0.31 0.00 -0.11 0.00 0.00 54.58 54.70 2b39 n ASN 1440Cb 0.53 -1.20 -0.14 0.00 1.24 0.00 0.00 39.78 40.20 2b39 n ASN 1440CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 2b39 s THR 1441N 5.72 2.54 -0.24 -0.44 -4.23 -1.26 0.77 115.64 118.51 2b39 s THR 1441Ca 1.05 -1.09 -0.05 0.00 -1.18 0.00 0.00 61.69 60.43 2b39 s THR 1441Cb -0.96 -1.99 -0.01 0.00 1.34 0.00 0.00 72.50 70.88 2b39 s THR 1441CO 0.56 0.47 -0.00 -0.22 -0.54 0.00 0.00 174.62 174.89 2b39 s LEU 1442N -1.00 3.17 -0.15 4.79 2.96 0.46 -0.74 118.68 128.17 2b39 s LEU 1442Ca 0.12 -0.46 -0.08 0.00 -0.22 0.00 0.00 54.13 53.50 2b39 s LEU 1442Cb -0.10 -1.79 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 2b39 s LEU 1442CO 0.02 -0.06 0.13 -0.63 -1.32 0.00 0.00 176.35 174.49 2b39 s ILE 1443N 1.49 5.42 -0.09 6.68 1.01 0.84 -1.11 121.20 135.45 2b39 s ILE 1443Ca 0.05 0.18 0.02 0.00 0.00 0.00 0.00 60.65 60.90 2b39 s ILE 1443Cb -0.15 -3.40 0.01 0.00 0.01 0.00 0.00 42.46 38.93 2b39 s ILE 1443CO -0.01 0.56 -0.14 -0.63 0.00 0.00 0.00 174.94 174.72 2b39 s ILE 1444N -0.53 1.33 -0.22 2.92 1.01 -0.36 -1.10 121.20 124.24 2b39 s ILE 1444Ca 0.12 -0.56 -0.12 0.00 0.00 0.00 0.00 60.65 60.09 2b39 s ILE 1444Cb -0.12 -1.22 -0.05 0.00 0.01 0.00 0.00 42.46 41.09 2b39 s ILE 1444CO 0.02 0.40 0.24 -0.31 0.00 0.00 0.00 174.94 175.29 2b39 s TYR 1445N 0.88 3.35 -0.11 3.97 2.02 0.16 -1.03 117.35 126.59 2b39 s TYR 1445Ca -0.10 0.37 -0.01 0.00 -0.37 0.00 0.00 57.07 56.97 2b39 s TYR 1445Cb -0.15 -2.34 -0.03 0.00 -0.40 0.00 0.00 41.96 39.04 2b39 s TYR 1445CO 0.01 0.07 -0.07 -0.51 -1.57 0.00 0.00 175.55 173.48 2b39 s LEU 1446N 1.04 3.11 0.27 -1.29 1.43 -0.50 -2.05 118.68 120.69 2b39 s LEU 1446Ca 0.11 -0.11 0.02 0.00 -1.03 0.00 0.00 54.13 53.12 2b39 s LEU 1446Cb -0.14 -1.70 0.38 0.00 0.03 0.00 0.00 46.19 44.76 2b39 s LEU 1446CO 0.05 0.26 1.71 0.44 0.23 0.00 0.00 176.35 179.04 2b39 h ASP 1447N 6.00 0.50 -2.67 2.29 5.19 -1.89 -1.35 116.42 124.50 2b39 h ASP 1447Ca -0.39 -0.17 -0.02 0.00 -0.62 0.00 0.00 57.03 55.83 2b39 h ASP 1447Cb 1.19 -0.14 0.01 0.00 0.18 0.00 0.00 39.33 40.57 2b39 h ASP 1447CO 0.56 0.76 0.24 2.29 -3.12 0.00 0.00 179.24 179.97 2b39 n LYS 1448N -4.11 0.96 -3.63 3.56 -0.00 -1.26 -1.76 118.16 111.91 2b39 n LYS 1448Ca -0.00 -1.87 -0.14 0.00 -0.00 0.00 0.00 58.31 56.29 2b39 n LYS 1448Cb 0.42 2.34 -0.13 0.00 -0.00 0.00 0.00 35.03 37.66 2b39 n LYS 1448CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2b39 s VAL 1449N -2.24 -0.39 0.35 0.58 1.01 -1.01 -4.78 120.40 113.92 2b39 s VAL 1449Ca 0.14 0.24 -0.27 0.00 0.00 0.00 0.00 61.98 62.08 2b39 s VAL 1449Cb -0.04 -0.46 -0.12 0.00 0.00 0.00 0.00 36.38 35.76 2b39 s VAL 1449CO 0.10 0.08 1.14 -0.24 0.00 0.00 0.00 175.10 176.18 2b39 n SER 1450N 5.34 1.97 -0.45 3.32 2.88 -1.26 -0.73 113.62 124.69 2b39 n SER 1450Ca -0.06 1.15 0.07 0.00 -1.33 0.00 0.00 58.87 58.70 2b39 n SER 1450Cb 0.50 -1.40 0.03 0.00 -0.75 0.00 0.00 64.21 62.58 2b39 n SER 1450CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2b39 n HIS 1451N 0.05 0.00 -0.06 0.66 1.44 -1.26 -1.10 115.22 114.95 2b39 n HIS 1451Ca 0.07 0.00 -0.06 0.00 -2.01 0.00 0.00 57.72 55.73 2b39 n HIS 1451Cb 0.36 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.45 2b39 n HIS 1451CO 0.00 0.00 0.00 2.41 -2.81 0.00 0.00 176.34 175.94 2b39 n THR 1452N 0.29 1.00 -3.09 0.61 -1.04 -1.26 -4.76 114.28 106.03 2b39 n THR 1452Ca 0.07 0.26 -0.00 0.00 -2.04 0.00 0.00 64.05 62.35 2b39 n THR 1452Cb 0.34 -2.07 0.00 0.00 -1.82 0.00 0.00 70.33 66.78 2b39 n THR 1452CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2b39 n VAL 1453N -3.81 0.00 -4.58 12.58 0.24 -1.26 -5.08 118.33 116.42 2b39 n VAL 1453Ca -0.09 -0.01 -0.34 0.00 -2.04 0.00 0.00 64.34 61.86 2b39 n VAL 1453Cb 0.33 -0.91 -0.11 0.00 -1.47 0.00 0.00 33.84 31.68 2b39 n VAL 1453CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2b39 s GLU 1454N -2.01 2.86 -0.34 7.34 2.12 -1.26 -4.67 118.70 122.74 2b39 s GLU 1454Ca 0.00 -0.53 -0.11 0.00 0.36 0.00 0.00 54.97 54.70 2b39 s GLU 1454Cb -0.00 -2.64 0.01 0.00 0.26 0.00 0.00 34.13 31.75 2b39 s GLU 1454CO 0.00 0.63 0.18 -0.51 -0.54 0.00 0.00 175.26 175.02 2b39 s ASP 1455N -0.70 5.68 0.29 -1.70 1.01 0.14 -4.92 116.67 116.47 2b39 s ASP 1455Ca 0.11 -0.69 0.03 0.00 0.71 0.00 0.00 52.55 52.70 2b39 s ASP 1455Cb -0.11 -2.03 -0.03 0.00 1.01 0.00 0.00 42.92 41.76 2b39 s ASP 1455CO 0.02 -0.27 0.44 0.00 0.21 0.00 0.00 175.17 175.56 2b39 s LEU 1457N -4.12 0.07 -0.03 0.00 1.02 0.13 -4.97 118.68 110.78 2b39 s LEU 1457Ca 0.37 0.79 0.02 0.00 0.02 0.00 0.00 54.13 55.32 2b39 s LEU 1457Cb -0.09 1.19 0.01 0.00 0.02 0.00 0.00 46.19 47.32 2b39 s LEU 1457CO 0.32 -0.18 -0.07 -0.55 0.02 0.00 0.00 176.35 175.89 2b39 s SER 1458N 1.29 1.07 0.11 2.29 0.15 -1.26 0.71 113.70 118.06 2b39 s SER 1458Ca -0.09 -0.16 -0.21 0.00 0.70 0.00 0.00 55.95 56.19 2b39 s SER 1458Cb -0.09 -0.40 0.05 0.00 -1.71 0.00 0.00 66.02 63.88 2b39 s SER 1458CO -0.11 0.01 0.52 0.72 1.20 0.00 0.00 173.24 175.58 2b39 s PHE 1459N 0.52 -0.40 0.30 3.44 -0.12 -0.61 -4.55 117.98 116.56 2b39 s PHE 1459Ca -0.08 0.26 -0.12 0.00 -0.05 0.00 0.00 56.93 56.95 2b39 s PHE 1459Cb -0.11 0.39 -0.08 0.00 -0.63 0.00 0.00 43.02 42.59 2b39 s PHE 1459CO 0.01 -0.73 0.67 0.15 -0.05 0.00 0.00 175.22 175.26 2b39 s LYS 1460N -3.28 3.88 -0.11 1.99 1.02 -1.26 -1.55 119.74 120.43 2b39 s LYS 1460Ca -0.01 0.47 -0.01 0.00 0.02 0.00 0.00 55.97 56.44 2b39 s LYS 1460Cb 0.00 -2.51 0.03 0.00 -0.52 0.00 0.00 37.83 34.84 2b39 s LYS 1460CO -0.08 0.18 -0.01 0.14 -0.92 0.00 0.00 175.35 174.66 2b39 s VAL 1461N -2.00 0.59 0.22 3.17 -7.23 -0.44 -0.71 120.40 114.00 2b39 s VAL 1461Ca 0.51 -0.14 -0.09 0.00 -1.81 0.00 0.00 61.98 60.44 2b39 s VAL 1461Cb -0.11 -0.78 -0.07 0.00 0.56 0.00 0.00 36.38 35.98 2b39 s VAL 1461CO 0.22 0.18 0.53 -1.00 -0.31 0.00 0.00 175.10 174.72 2b39 s HIS 1462N 1.87 3.43 -0.14 2.82 0.09 -0.91 -1.62 115.29 120.83 2b39 s HIS 1462Ca 0.04 0.85 -0.04 0.00 -0.00 0.00 0.00 55.06 55.91 2b39 s HIS 1462Cb -0.13 -2.24 -0.03 0.00 -0.00 0.00 0.00 32.58 30.18 2b39 s HIS 1462CO -0.07 0.29 -0.02 -1.14 -0.00 0.00 0.00 174.74 173.80 2b39 s GLN 1463N -2.79 3.54 0.00 1.40 0.74 0.79 -1.90 119.66 121.45 2b39 s GLN 1463Ca 0.47 -0.48 0.16 0.00 0.05 0.00 0.00 55.36 55.56 2b39 s GLN 1463Cb -0.11 -2.91 0.26 0.00 1.10 0.00 0.00 33.01 31.34 2b39 s GLN 1463CO 0.21 0.36 1.16 0.66 -0.55 0.00 0.00 175.29 177.13 2b39 n TYR 1464N 3.20 0.29 -3.92 1.67 4.01 -1.20 -0.46 117.16 120.75 2b39 n TYR 1464Ca -0.17 -0.22 -0.10 0.00 -0.16 0.00 0.00 57.90 57.25 2b39 n TYR 1464Cb 0.53 -0.01 -0.10 0.00 -0.31 0.00 0.00 39.34 39.45 2b39 n TYR 1464CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2b39 s PHE 1465N -1.19 0.16 -0.41 -0.72 0.08 -1.26 -4.56 117.98 110.08 2b39 s PHE 1465Ca 0.25 -0.37 -0.23 0.00 0.12 0.00 0.00 56.93 56.71 2b39 s PHE 1465Cb 0.15 -0.12 0.02 0.00 -0.57 0.00 0.00 43.02 42.50 2b39 s PHE 1465CO 0.21 -0.28 0.77 -0.80 -0.10 0.00 0.00 175.22 175.02 2b39 s ASN 1466N -1.64 6.47 -0.15 1.36 0.01 -1.26 -4.95 114.94 114.77 2b39 s ASN 1466Ca -0.12 0.09 -0.00 0.00 -0.71 0.00 0.00 52.86 52.12 2b39 s ASN 1466Cb -0.06 -2.39 -0.01 0.00 0.41 0.00 0.00 41.25 39.20 2b39 s ASN 1466CO -0.01 -0.82 -0.13 -0.69 -1.51 0.00 0.00 177.10 173.94 2b39 s VAL 1467N 3.18 2.92 -0.02 1.60 1.01 -1.26 -1.92 120.40 125.91 2b39 s VAL 1467Ca 0.30 -0.69 -0.06 0.00 0.00 0.00 0.00 61.98 61.53 2b39 s VAL 1467Cb -0.13 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.97 2b39 s VAL 1467CO 0.20 0.51 0.23 -0.83 0.00 0.00 0.00 175.10 175.20 2b39 s GLY 1468N 0.64 2.22 -1.21 4.51 0.00 0.32 -4.31 107.32 109.49 2b39 s GLY 1468Ca -0.07 -0.64 -0.05 0.00 0.00 0.00 0.00 44.72 43.96 2b39 s GLY 1468CO 0.03 -0.46 1.04 1.04 0.00 0.00 0.00 173.10 174.75 2b39 n LEU 1469N 1.21 -3.53 -4.77 0.66 4.77 0.99 -1.82 117.00 114.51 2b39 n LEU 1469Ca -0.12 -0.53 -0.41 0.00 -0.03 0.00 0.00 56.01 54.92 2b39 n LEU 1469Cb 0.53 -2.89 -0.02 0.00 -2.33 0.00 0.00 43.42 38.71 2b39 n LEU 1469CO 0.40 0.51 0.95 -0.51 -1.33 0.00 0.00 177.39 177.42 2b39 s ILE 1470N -3.31 2.87 0.29 -0.08 2.07 -1.22 -4.67 121.20 117.15 2b39 s ILE 1470Ca 0.34 0.86 -0.13 0.00 -1.41 0.00 0.00 60.65 60.31 2b39 s ILE 1470Cb -0.15 -3.55 -0.08 0.00 0.13 0.00 0.00 42.46 38.81 2b39 s ILE 1470CO 0.68 0.20 0.67 -1.10 -1.91 0.00 0.00 174.94 173.48 2b39 s GLN 1471N -1.63 3.93 0.55 3.50 -1.52 -1.26 -4.90 119.66 118.32 2b39 s GLN 1471Ca 0.49 0.53 -0.20 0.00 -1.95 0.00 0.00 55.36 54.22 2b39 s GLN 1471Cb -0.38 -2.51 -0.05 0.00 -0.22 0.00 0.00 33.01 29.85 2b39 s GLN 1471CO 0.50 0.21 1.20 -1.25 -0.25 0.00 0.00 175.29 175.70 2b39 s PRO 1472N -2.92 3.24 0.67 2.91 0.04 -1.26 -4.62 135.00 133.05 2b39 s PRO 1472Ca 0.52 1.81 -0.03 0.00 0.04 0.00 0.00 61.00 63.34 2b39 s PRO 1472Cb -0.11 -2.08 0.14 0.00 0.04 0.00 0.00 34.50 32.49 2b39 s PRO 1472CO 0.19 -0.99 0.92 0.41 0.04 0.00 0.00 177.00 177.57 2b39 n GLY 1473N 0.44 0.18 3.24 0.56 0.00 -0.11 -4.86 105.19 104.64 2b39 n GLY 1473Ca 0.12 -1.95 -0.13 0.00 0.00 0.00 0.00 46.02 44.06 2b39 n GLY 1473CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b39 s ALA 1474N -3.32 -0.79 -0.21 4.61 0.00 -1.21 -1.65 121.76 119.19 2b39 s ALA 1474Ca 0.58 0.43 0.01 0.00 0.00 0.00 0.00 51.96 52.98 2b39 s ALA 1474Cb -0.03 -0.02 0.05 0.00 0.00 0.00 0.00 23.12 23.12 2b39 s ALA 1474CO 0.39 -0.24 -0.09 0.08 0.00 0.00 0.00 175.76 175.90 2b39 s VAL 1475N -1.09 1.65 0.01 0.00 1.01 0.58 -1.18 120.40 121.39 2b39 s VAL 1475Ca -0.11 -1.11 0.01 0.00 0.00 0.00 0.00 61.98 60.77 2b39 s VAL 1475Cb -0.05 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 2b39 s VAL 1475CO 0.04 0.08 0.03 -0.75 0.00 0.00 0.00 175.10 174.50 2b39 s LYS 1476N 1.38 2.85 0.01 2.72 2.20 -0.95 -1.53 119.74 126.42 2b39 s LYS 1476Ca -0.03 -0.60 0.03 0.00 -0.36 0.00 0.00 55.97 55.01 2b39 s LYS 1476Cb -0.17 -2.72 -0.01 0.00 -1.51 0.00 0.00 37.83 33.42 2b39 s LYS 1476CO -0.07 0.62 -0.10 0.54 -0.36 0.00 0.00 175.35 175.97 2b39 s VAL 1477N -1.16 0.78 0.19 4.02 0.11 0.80 -0.65 120.40 124.49 2b39 s VAL 1477Ca 0.22 -0.64 -0.22 0.00 -2.93 0.00 0.00 61.98 58.41 2b39 s VAL 1477Cb -0.12 -0.70 0.05 0.00 -1.53 0.00 0.00 36.38 34.09 2b39 s VAL 1477CO 0.13 0.07 0.62 -0.72 -3.33 0.00 0.00 175.10 171.86 2b39 s TYR 1478N -0.54 -0.40 0.12 1.54 -0.85 -0.86 -1.53 117.35 114.83 2b39 s TYR 1478Ca 0.01 0.11 -0.28 0.00 -0.52 0.00 0.00 57.07 56.39 2b39 s TYR 1478Cb -0.05 0.58 -0.06 0.00 0.38 0.00 0.00 41.96 42.80 2b39 s TYR 1478CO 0.00 -0.95 0.88 0.45 -1.52 0.00 0.00 175.55 174.41 2b39 s SER 1479N -2.81 7.43 0.23 -0.18 0.15 -1.01 -0.33 113.70 117.19 2b39 s SER 1479Ca 0.04 1.71 -0.04 0.00 0.70 0.00 0.00 55.95 58.37 2b39 s SER 1479Cb -0.02 -2.55 0.25 0.00 -1.71 0.00 0.00 66.02 61.99 2b39 s SER 1479CO -0.07 0.02 1.69 0.22 1.20 0.00 0.00 173.24 176.31 2b39 h TYR 1480N 5.24 0.88 -0.94 3.44 3.20 -1.73 -3.09 116.97 123.97 2b39 h TYR 1480Ca -0.44 -0.16 -0.46 0.00 3.14 0.00 0.00 58.73 60.81 2b39 h TYR 1480Cb 1.21 -0.23 -0.28 0.00 1.54 0.00 0.00 36.73 38.97 2b39 h TYR 1480CO 0.64 0.86 0.59 0.66 -1.64 0.00 0.00 178.16 179.27 2b39 n TYR 1481N -4.16 2.93 -2.67 -3.82 4.02 -1.26 -4.56 117.16 107.64 2b39 n TYR 1481Ca 0.01 -1.72 -0.04 0.00 -0.01 0.00 0.00 57.90 56.14 2b39 n TYR 1481Cb 0.36 -0.90 0.07 0.00 -0.02 0.00 0.00 39.34 38.85 2b39 n TYR 1481CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2b39 n ASN 1482N -0.96 -1.37 0.00 7.72 5.15 -1.17 -4.57 115.26 120.06 2b39 n ASN 1482Ca 0.56 -1.66 0.00 0.00 -0.60 0.00 0.00 54.58 52.88 2b39 n ASN 1482Cb 1.61 0.75 0.00 0.00 -0.53 0.00 0.00 39.78 41.61 2b39 n ASN 1482CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2b39 n LEU 1483N 1.74 0.00 0.10 1.20 4.77 -1.24 -1.57 117.00 122.00 2b39 n LEU 1483Ca 0.04 0.12 -0.05 0.00 -0.03 0.00 0.00 56.01 56.09 2b39 n LEU 1483Cb 0.69 -0.12 0.09 0.00 -2.33 0.00 0.00 43.42 41.75 2b39 n LEU 1483CO -0.13 -0.12 0.41 0.44 -1.33 0.00 0.00 177.39 176.66 2b39 h ASP 1484N 0.00 0.18 -2.59 -1.43 5.19 -1.95 -3.40 116.42 112.41 2b39 h ASP 1484Ca 0.00 -0.12 -0.59 0.00 -0.62 0.00 0.00 57.03 55.70 2b39 h ASP 1484Cb 0.67 -0.05 -0.11 0.00 0.18 0.00 0.00 39.33 40.01 2b39 h ASP 1484CO 0.00 0.81 0.76 -1.61 -3.12 0.00 0.00 179.24 176.09 2b39 s GLU 1485N -3.54 3.17 -0.15 3.56 2.02 -0.61 -4.73 118.70 118.41 2b39 s GLU 1485Ca -0.03 -0.52 -0.30 0.00 0.02 0.00 0.00 54.97 54.14 2b39 s GLU 1485Cb 0.12 -4.19 0.12 0.00 0.10 0.00 0.00 34.13 30.28 2b39 s GLU 1485CO 0.80 -1.92 0.98 -0.08 0.02 0.00 0.00 175.26 175.05 2b39 s THR 1486N 4.75 0.00 0.03 3.63 -1.32 -0.76 -2.40 115.64 119.56 2b39 s THR 1486Ca 0.28 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.77 2b39 s THR 1486Cb -0.13 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 69.84 2b39 s THR 1486CO 0.13 0.00 -0.04 0.00 -2.21 0.00 0.00 174.62 172.51 2b39 s ILE 1488N -1.85 -0.05 0.17 0.00 2.07 -1.26 -0.14 121.20 120.14 2b39 s ILE 1488Ca -0.11 0.17 0.08 0.00 -1.41 0.00 0.00 60.65 59.38 2b39 s ILE 1488Cb -0.07 -0.17 -0.04 0.00 0.13 0.00 0.00 42.46 42.30 2b39 s ILE 1488CO -0.02 0.07 -0.16 -0.13 -1.91 0.00 0.00 174.94 172.79 2b39 s ARG 1489N 1.02 1.25 0.02 3.50 3.00 -0.58 -4.81 118.95 122.34 2b39 s ARG 1489Ca -0.08 -1.46 0.05 0.00 0.00 0.00 0.00 55.73 54.23 2b39 s ARG 1489Cb -0.11 -1.14 -0.03 0.00 0.00 0.00 0.00 34.95 33.67 2b39 s ARG 1489CO -0.04 0.21 -0.10 -0.06 0.00 0.00 0.00 175.30 175.30 2b39 s PHE 1490N -2.52 2.78 -0.01 -0.53 0.08 -1.26 -0.31 117.98 116.22 2b39 s PHE 1490Ca 0.18 -0.11 0.07 0.00 0.12 0.00 0.00 56.93 57.18 2b39 s PHE 1490Cb -0.03 -1.56 -0.02 0.00 -0.57 0.00 0.00 43.02 40.84 2b39 s PHE 1490CO 0.06 0.33 -0.21 1.52 -0.10 0.00 0.00 175.22 176.82 2b39 s TYR 1491N -0.98 1.91 0.15 0.36 -0.85 -0.66 -4.94 117.35 112.33 2b39 s TYR 1491Ca 0.17 -0.36 -0.00 0.00 -0.52 0.00 0.00 57.07 56.35 2b39 s TYR 1491Cb -0.11 -1.21 -0.04 0.00 0.38 0.00 0.00 41.96 40.98 2b39 s TYR 1491CO 0.07 -0.01 0.05 -1.58 -1.52 0.00 0.00 175.55 172.56 2b39 s HIS 1492N -0.55 0.96 0.00 -3.49 2.46 -1.26 -0.93 115.29 112.48 2b39 s HIS 1492Ca 0.08 -1.20 0.00 0.00 0.47 0.00 0.00 55.06 54.41 2b39 s HIS 1492Cb -0.08 -0.54 0.00 0.00 -0.13 0.00 0.00 32.58 31.83 2b39 s HIS 1492CO -0.00 -0.47 0.00 -2.30 -2.47 0.00 0.00 174.74 169.50 2b39 n PRO 1493N -0.14 0.00 -4.01 2.88 -0.02 -1.26 -4.50 135.00 127.95 2b39 n PRO 1493Ca -0.05 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.34 2b39 n PRO 1493Cb 0.64 0.00 -0.11 0.00 -0.02 0.00 0.00 33.50 34.01 2b39 n PRO 1493CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2b39 s ASP 1494N -1.11 0.30 0.44 2.55 -1.08 -1.26 -4.93 116.67 111.58 2b39 s ASP 1494Ca 0.00 -0.63 0.10 0.00 -0.52 0.00 0.00 52.55 51.50 2b39 s ASP 1494Cb 0.00 0.13 0.99 0.00 -1.46 0.00 0.00 42.92 42.58 2b39 s ASP 1494CO 0.00 -0.39 2.08 0.07 0.52 0.00 0.00 175.17 177.45 2b39 h LYS 1495N 4.22 0.38 -0.35 4.34 2.10 -2.03 -2.54 116.57 122.70 2b39 h LYS 1495Ca -0.33 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 58.28 2b39 h LYS 1495Cb 1.19 -0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 32.42 2b39 h LYS 1495CO 0.48 0.25 0.14 1.49 -2.00 0.00 0.00 179.45 179.82 2b39 h GLU 1496N 0.39 0.51 -0.20 0.07 4.57 -2.04 -3.32 114.58 114.57 2b39 h GLU 1496Ca 0.12 -0.09 0.06 0.00 -1.18 0.00 0.00 59.36 58.28 2b39 h GLU 1496Cb 0.02 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.51 2b39 h GLU 1496CO -0.03 0.50 0.13 -0.25 -1.18 0.00 0.00 179.01 178.18 2b39 n ASP 1497N -4.70 0.02 -0.82 1.04 9.92 -0.96 -4.60 116.55 116.45 2b39 n ASP 1497Ca -0.01 0.15 -0.09 0.00 -0.53 0.00 0.00 54.79 54.31 2b39 n ASP 1497Cb 0.13 -0.08 -0.03 0.00 -0.64 0.00 0.00 41.12 40.51 2b39 n ASP 1497CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2b39 n GLY 1498N -1.08 0.68 0.10 0.44 0.00 -1.25 -4.85 105.19 99.23 2b39 n GLY 1498Ca 0.05 -0.58 -0.15 0.00 0.00 0.00 0.00 46.02 45.34 2b39 n GLY 1498CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2b39 h MET 1499N 0.00 0.22 -0.99 1.61 -1.53 -1.84 -2.57 114.93 109.82 2b39 h MET 1499Ca -0.20 -0.37 -0.00 0.00 -3.44 0.00 0.00 59.70 55.69 2b39 h MET 1499Cb 0.80 0.14 -0.00 0.00 -0.55 0.00 0.00 31.60 31.99 2b39 h MET 1499CO 0.26 1.14 0.00 1.47 0.14 0.00 0.00 176.91 179.92 2b39 n LEU 1500N -3.47 1.31 -4.77 3.39 -0.00 -1.26 0.33 117.00 112.53 2b39 n LEU 1500Ca -0.10 -0.66 -0.40 0.00 -0.00 0.00 0.00 56.01 54.86 2b39 n LEU 1500Cb 1.02 -0.50 -0.06 0.00 -0.00 0.00 0.00 43.42 43.88 2b39 n LEU 1500CO 0.52 0.29 0.47 -0.44 -0.00 0.00 0.00 177.39 178.22 2b39 s SER 1501N 0.10 7.31 -0.83 1.45 0.01 -0.97 -4.42 113.70 116.35 2b39 s SER 1501Ca 0.01 1.56 -0.28 0.00 1.31 0.00 0.00 55.95 58.55 2b39 s SER 1501Cb 0.01 -2.48 -0.26 0.00 0.21 0.00 0.00 66.02 63.49 2b39 s SER 1501CO 0.00 0.13 1.97 0.29 0.41 0.00 0.00 173.24 176.05 2b39 n LYS 1502N 2.09 0.21 -0.27 12.44 4.01 -1.26 -3.80 118.16 131.58 2b39 n LYS 1502Ca -0.04 -1.60 0.33 0.00 -0.51 0.00 0.00 58.31 56.49 2b39 n LYS 1502Cb 0.49 -3.57 0.64 0.00 -0.51 0.00 0.00 35.03 32.09 2b39 n LYS 1502CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 2b39 h LEU 1503N 21.00 0.00-10.28 -0.35 5.85 -1.91 -3.39 115.31 126.23 2b39 h LEU 1503Ca 0.09 0.00 -0.52 0.00 0.84 0.00 0.00 57.88 58.29 2b39 h LEU 1503Cb 0.92 0.00 0.15 0.00 0.37 0.00 0.00 40.66 42.10 2b39 h LEU 1503CO 1.29 0.00 0.29 0.00 -0.34 0.00 0.00 178.44 179.69 2b39 s HIS 1505N -2.71 1.77 0.00 0.00 2.46 -1.26 -4.75 115.29 110.80 2b39 s HIS 1505Ca 0.64 -1.28 0.00 0.00 0.47 0.00 0.00 55.06 54.89 2b39 s HIS 1505Cb -0.20 -1.10 0.00 0.00 -0.13 0.00 0.00 32.58 31.15 2b39 s HIS 1505CO 0.55 -0.33 0.00 1.63 -2.47 0.00 0.00 174.74 174.12 2b39 n LYS 1506N -0.82 0.00 -0.05 2.88 5.02 -1.26 -1.12 118.16 122.81 2b39 n LYS 1506Ca -0.04 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.13 2b39 n LYS 1506Cb 0.65 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.59 2b39 n LYS 1506CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 2b39 h ASP 1507N 0.00 -1.46 -0.51 4.39 3.32 -1.99 -2.26 116.42 117.92 2b39 h ASP 1507Ca 0.00 0.20 0.10 0.00 0.02 0.00 0.00 57.03 57.35 2b39 h ASP 1507Cb 0.00 0.60 -0.08 0.00 0.22 0.00 0.00 39.33 40.07 2b39 h ASP 1507CO 0.00 -0.42 0.02 0.71 -1.72 0.00 0.00 179.24 177.83 2b39 h THR 1508N -0.45 0.61 -0.59 0.35 1.35 -1.67 0.76 112.91 113.27 2b39 h THR 1508Ca 0.09 -0.05 0.05 0.00 -0.55 0.00 0.00 66.41 65.95 2b39 h THR 1508Cb 0.62 0.47 -0.05 0.00 -1.73 0.00 0.00 68.15 67.46 2b39 h THR 1508CO -0.48 0.02 0.33 0.00 -0.25 0.00 0.00 175.52 175.15 2b39 h ARG 1510N 0.63 0.00 -0.10 0.00 1.12 -0.39 -2.28 114.38 113.35 2b39 h ARG 1510Ca 0.26 0.00 -0.01 0.00 -1.11 0.00 0.00 59.98 59.12 2b39 h ARG 1510Cb 0.12 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 30.08 2b39 h ARG 1510CO -0.15 0.00 0.04 0.00 -3.11 0.00 0.00 179.97 176.75 2b39 n ALA 1512N -2.21 6.80 0.00 0.00 0.00 -0.86 -3.29 120.51 120.94 2b39 n ALA 1512Ca -0.06 -3.01 0.00 0.00 0.00 0.00 0.00 53.44 50.38 2b39 n ALA 1512Cb 0.12 -2.64 0.00 0.00 0.00 0.00 0.00 19.45 16.92 2b39 n ALA 1512CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2b39 n GLU 1513N 2.24 3.80 -0.04 0.00 -0.58 -1.19 -4.79 120.64 120.08 2b39 n GLU 1513Ca 0.58 0.00 -0.09 0.00 -0.42 0.00 0.00 57.16 57.22 2b39 n GLU 1513Cb 0.52 -0.67 -0.03 0.00 -0.57 0.00 0.00 31.44 30.70 2b39 n GLU 1513CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 2b39 h GLU 1514N 0.00 -0.31 0.17 3.49 4.39 -1.75 -2.61 114.58 117.96 2b39 h GLU 1514Ca 0.00 0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.73 2b39 h GLU 1514Cb 0.00 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 2b39 h GLU 1514CO 0.00 -0.21 -0.20 -0.91 -1.16 0.00 0.00 179.01 176.53 2b39 h ASN 1515N -0.32 -0.54 -0.56 1.42 -0.26 -1.87 -3.26 115.58 110.19 2b39 h ASN 1515Ca 0.12 0.06 0.05 0.00 -0.56 0.00 0.00 56.30 55.97 2b39 h ASN 1515Cb 0.52 0.19 -0.07 0.00 -1.06 0.00 0.00 38.32 37.91 2b39 h ASN 1515CO -0.40 -0.29 -0.33 0.00 -1.06 0.00 0.00 177.43 175.35 2b39 n PHE 1517N -4.33 0.00 -2.72 0.00 1.16 -1.18 -4.33 117.46 106.05 2b39 n PHE 1517Ca 0.01 0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.51 2b39 n PHE 1517Cb 0.15 0.00 0.10 0.00 -1.61 0.00 0.00 39.48 38.12 2b39 n PHE 1517CO 0.00 0.00 0.00 2.41 -1.87 0.00 0.00 176.76 177.30 2b39 n THR 1526N 0.00 0.02 0.00 1.97 -1.04 -1.26 -4.58 114.28 109.39 2b39 n THR 1526Ca 0.00 -1.61 0.00 0.00 -2.04 0.00 0.00 64.05 60.40 2b39 n THR 1526Cb 0.00 1.20 0.00 0.00 -1.82 0.00 0.00 70.33 69.71 2b39 n THR 1526CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2b39 n LEU 1527N -0.12 0.00 0.00 -4.42 0.00 -1.26 -4.89 117.00 106.31 2b39 n LEU 1527Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.03 2b39 n LEU 1527Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 43.42 44.20 2b39 n LEU 1527CO -0.01 0.00 -0.24 -1.84 0.00 0.00 0.00 177.39 175.30 2b39 n GLU 1528N -0.33 2.64 0.27 1.96 0.28 -1.26 -4.28 120.64 119.92 2b39 n GLU 1528Ca 0.00 0.00 0.18 0.00 -0.16 0.00 0.00 57.16 57.18 2b39 n GLU 1528Cb 0.00 -0.74 0.80 0.00 1.43 0.00 0.00 31.44 32.93 2b39 n GLU 1528CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 2b39 h ASP 1529N 0.00 0.00 0.00 -1.84 3.32 -1.99 -1.28 116.42 114.63 2b39 h ASP 1529Ca 0.00 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 2b39 h ASP 1529Cb 0.19 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 2b39 h ASP 1529CO 0.00 0.00 -1.65 -2.11 -1.72 0.00 0.00 179.24 173.76 2b39 n ARG 1530N -2.91 1.13 0.15 3.56 1.85 -1.26 -3.37 116.66 115.81 2b39 n ARG 1530Ca -0.00 -0.07 0.03 0.00 -1.00 0.00 0.00 57.85 56.81 2b39 n ARG 1530Cb 0.21 -1.29 0.40 0.00 -1.05 0.00 0.00 32.46 30.73 2b39 n ARG 1530CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 2b39 h LEU 1531N 0.00 0.15 0.00 2.89 3.38 -1.62 -2.11 115.31 118.00 2b39 h LEU 1531Ca -0.13 -0.03 -0.18 0.00 0.09 0.00 0.00 57.88 57.63 2b39 h LEU 1531Cb 1.05 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.73 2b39 h LEU 1531CO 0.01 0.35 -1.58 0.47 0.09 0.00 0.00 178.44 177.78 2b39 n ASP 1532N -4.25 0.69 -1.30 -0.43 8.00 -0.53 -3.56 116.55 115.18 2b39 n ASP 1532Ca -0.01 0.30 -0.01 0.00 0.71 0.00 0.00 54.79 55.78 2b39 n ASP 1532Cb 0.29 0.41 0.17 0.00 -0.02 0.00 0.00 41.12 41.98 2b39 n ASP 1532CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2b39 n LYS 1533N -2.82 2.59 0.00 -1.24 3.00 -0.91 -3.13 118.16 115.64 2b39 n LYS 1533Ca -0.12 -1.53 0.00 0.00 -0.00 0.00 0.00 58.31 56.66 2b39 n LYS 1533Cb 0.85 -1.80 0.00 0.00 0.00 0.00 0.00 35.03 34.08 2b39 n LYS 1533CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2b39 n ALA 1534N 0.15 1.80 -1.59 3.14 0.00 -0.84 -4.76 120.51 118.41 2b39 n ALA 1534Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.31 2b39 n ALA 1534Cb 0.81 0.22 -0.05 0.00 0.00 0.00 0.00 19.45 20.43 2b39 n ALA 1534CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b39 s GLU 1536N -0.87 2.31 -1.02 0.00 2.02 -1.26 -4.97 118.70 114.91 2b39 s GLU 1536Ca 0.59 -1.02 -0.23 0.00 0.02 0.00 0.00 54.97 54.34 2b39 s GLU 1536Cb 0.29 -2.37 -0.12 0.00 0.10 0.00 0.00 34.13 32.03 2b39 s GLU 1536CO -0.14 0.49 1.92 -2.30 0.02 0.00 0.00 175.26 175.26 2b39 n PRO 1537N 0.37 1.49 0.00 0.39 -0.02 -1.26 -2.39 135.00 133.59 2b39 n PRO 1537Ca -0.11 -2.22 0.00 0.00 -2.02 0.00 0.00 63.50 59.15 2b39 n PRO 1537Cb 0.53 -3.44 0.00 0.00 -0.02 0.00 0.00 33.50 30.57 2b39 n PRO 1537CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b39 n GLY 1538N 5.37 0.17 3.45 -1.23 0.00 -1.26 -5.15 105.19 106.54 2b39 n GLY 1538Ca 0.46 -0.01 -0.28 0.00 0.00 0.00 0.00 46.02 46.19 2b39 n GLY 1538CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b39 s VAL 1539N 0.00 1.96 0.00 1.61 1.01 -1.00 -3.91 120.40 120.06 2b39 s VAL 1539Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61.98 61.98 2b39 s VAL 1539Cb 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 36.38 34.37 2b39 s VAL 1539CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 175.10 174.43 2b39 n ASP 1540N -5.10 0.00 -3.68 3.32 -0.08 -1.01 -4.64 116.55 105.35 2b39 n ASP 1540Ca 0.03 0.00 -0.20 0.00 -1.51 0.00 0.00 54.79 53.11 2b39 n ASP 1540Cb 0.54 0.00 -0.18 0.00 2.34 0.00 0.00 41.12 43.83 2b39 n ASP 1540CO 0.00 0.00 0.00 -0.72 0.12 0.00 0.00 177.20 176.60 2b39 s TYR 1541N -0.93 0.09 -0.20 -0.67 1.13 -1.16 -2.88 117.35 112.74 2b39 s TYR 1541Ca 0.00 0.23 0.01 0.00 -1.41 0.00 0.00 57.07 55.90 2b39 s TYR 1541Cb 0.00 -0.48 0.04 0.00 -1.10 0.00 0.00 41.96 40.42 2b39 s TYR 1541CO 0.00 -0.19 -0.12 0.08 -2.51 0.00 0.00 175.55 172.81 2b39 s VAL 1542N 2.10 1.74 0.26 -3.49 1.01 -1.26 -2.29 120.40 118.47 2b39 s VAL 1542Ca 0.04 -1.02 0.02 0.00 0.00 0.00 0.00 61.98 61.02 2b39 s VAL 1542Cb -0.12 -1.76 -0.01 0.00 0.00 0.00 0.00 36.38 34.49 2b39 s VAL 1542CO -0.03 0.23 0.06 -1.22 0.00 0.00 0.00 175.10 174.14 2b39 n TYR 1543N 4.66 0.26 -3.42 5.22 0.53 -0.10 -0.20 117.16 124.11 2b39 n TYR 1543Ca -0.16 -1.52 -0.27 0.00 -1.02 0.00 0.00 57.90 54.93 2b39 n TYR 1543Cb 0.47 -0.06 -0.11 0.00 -1.03 0.00 0.00 39.34 38.61 2b39 n TYR 1543CO 0.00 0.00 0.00 0.21 -1.02 0.00 0.00 176.86 176.05 2b39 s LYS 1544N -2.96 0.66 0.42 -0.72 2.36 -0.19 -2.50 119.74 116.80 2b39 s LYS 1544Ca 0.09 -1.52 0.02 0.00 -2.55 0.00 0.00 55.97 52.01 2b39 s LYS 1544Cb 0.00 -1.27 -0.00 0.00 -1.05 0.00 0.00 37.83 35.51 2b39 s LYS 1544CO 0.06 -1.26 0.62 0.95 1.55 0.00 0.00 175.35 177.27 2b39 s THR 1545N 0.80 3.99 -0.06 3.43 -4.23 -0.44 -1.68 115.64 117.45 2b39 s THR 1545Ca 0.22 -0.63 0.03 0.00 -1.18 0.00 0.00 61.69 60.14 2b39 s THR 1545Cb -0.14 -3.45 0.01 0.00 1.34 0.00 0.00 72.50 70.25 2b39 s THR 1545CO -0.05 -0.28 -0.15 -0.60 -0.54 0.00 0.00 174.62 172.99 2b39 s ARG 1546N -4.46 1.85 -0.77 3.99 3.52 0.46 0.69 118.95 124.23 2b39 s ARG 1546Ca 0.48 -0.53 -0.26 0.00 -0.13 0.00 0.00 55.73 55.29 2b39 s ARG 1546Cb -0.10 -1.53 0.02 0.00 -1.56 0.00 0.00 34.95 31.78 2b39 s ARG 1546CO 0.36 0.12 1.48 -1.17 -0.81 0.00 0.00 175.30 175.27 2b39 s LEU 1547N 0.41 3.24 -0.01 -0.88 0.20 -0.59 0.36 118.68 121.41 2b39 s LEU 1547Ca -0.11 -0.46 -0.18 0.00 0.69 0.00 0.00 54.13 54.07 2b39 s LEU 1547Cb -0.14 -2.56 -0.34 0.00 -0.43 0.00 0.00 46.19 42.73 2b39 s LEU 1547CO 0.04 -1.96 0.91 -0.29 -0.29 0.00 0.00 176.35 174.76 2b39 h ILE 1548N 6.42 1.31 -3.36 6.68 2.10 -1.80 -0.47 117.51 128.39 2b39 h ILE 1548Ca -0.17 -2.62 -0.41 0.00 1.08 0.00 0.00 64.86 62.74 2b39 h ILE 1548Cb 1.06 3.06 -0.36 0.00 -1.09 0.00 0.00 36.82 39.49 2b39 h ILE 1548CO 1.29 0.78 -0.76 -1.58 -1.08 0.00 0.00 178.15 176.79 2b39 s GLN 1549N -2.53 0.59 -0.36 2.19 -0.44 -1.07 -4.84 119.66 113.20 2b39 s GLN 1549Ca -0.12 0.05 -0.09 0.00 -2.50 0.00 0.00 55.36 52.70 2b39 s GLN 1549Cb 0.03 -0.82 0.03 0.00 -1.64 0.00 0.00 33.01 30.61 2b39 s GLN 1549CO 0.89 -0.21 0.16 0.21 0.50 0.00 0.00 175.29 176.85 2b39 s LYS 1550N 1.48 2.75 -0.37 1.67 2.20 -1.26 -0.84 119.74 125.37 2b39 s LYS 1550Ca -0.03 -1.12 -0.10 0.00 -0.36 0.00 0.00 55.97 54.37 2b39 s LYS 1550Cb -0.13 -3.62 0.03 0.00 -1.51 0.00 0.00 37.83 32.61 2b39 s LYS 1550CO -0.03 -0.68 0.20 0.21 -0.36 0.00 0.00 175.35 174.68 2b39 s LYS 1551N 1.49 2.76 -0.24 4.03 2.20 -0.93 -5.03 119.74 124.02 2b39 s LYS 1551Ca 0.01 -1.14 -0.17 0.00 -0.36 0.00 0.00 55.97 54.30 2b39 s LYS 1551Cb -0.19 -3.70 -0.03 0.00 -1.51 0.00 0.00 37.83 32.40 2b39 s LYS 1551CO 0.05 -0.72 0.49 -0.51 -0.36 0.00 0.00 175.35 174.30 2b39 s LEU 1552N 1.52 4.08 0.24 5.43 1.43 -1.26 -1.47 118.68 128.64 2b39 s LEU 1552Ca 0.01 0.52 0.11 0.00 -1.03 0.00 0.00 54.13 53.74 2b39 s LEU 1552Cb -0.20 -2.63 -0.05 0.00 0.03 0.00 0.00 46.19 43.35 2b39 s LEU 1552CO 0.06 -0.24 -0.19 -1.61 0.23 0.00 0.00 176.35 174.60 2b39 s GLU 1553N 2.06 1.54 -0.41 1.70 0.41 -1.26 -5.01 118.70 117.72 2b39 s GLU 1553Ca 0.21 -1.66 -0.03 0.00 -0.41 0.00 0.00 54.97 53.08 2b39 s GLU 1553Cb -0.16 -1.58 0.14 0.00 -1.78 0.00 0.00 34.13 30.75 2b39 s GLU 1553CO 0.09 0.30 2.45 -0.40 -0.49 0.00 0.00 175.26 177.21 2b39 n ASP 1554N -0.37 6.53 0.00 -0.19 3.85 -1.26 -4.38 116.55 120.73 2b39 n ASP 1554Ca -0.07 -3.18 0.00 0.00 -0.71 0.00 0.00 54.79 50.83 2b39 n ASP 1554Cb 0.59 -1.15 0.00 0.00 -1.35 0.00 0.00 41.12 39.21 2b39 n ASP 1554CO 0.00 0.00 0.00 -0.67 -1.01 0.00 0.00 177.20 175.52 2b39 n ASP 1555N 0.59 0.00 -3.82 -1.12 2.03 -1.26 -4.68 116.55 108.29 2b39 n ASP 1555Ca 0.42 0.00 -0.24 0.00 0.52 0.00 0.00 54.79 55.49 2b39 n ASP 1555Cb 0.57 0.15 -0.17 0.00 -0.72 0.00 0.00 41.12 40.94 2b39 n ASP 1555CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 2b39 s PHE 1556N -0.35 0.89 0.29 -0.67 0.40 -1.26 -2.50 117.98 114.78 2b39 s PHE 1556Ca 0.00 -0.32 -0.29 0.00 -0.60 0.00 0.00 56.93 55.72 2b39 s PHE 1556Cb 0.00 -0.91 -0.09 0.00 0.51 0.00 0.00 43.02 42.53 2b39 s PHE 1556CO 0.00 -0.37 1.07 -0.51 0.70 0.00 0.00 175.22 176.11 2b39 s ASP 1557N 1.82 7.24 -0.51 1.36 -0.00 -0.10 -4.44 116.67 122.04 2b39 s ASP 1557Ca 0.04 2.20 0.00 0.00 -0.00 0.00 0.00 52.55 54.78 2b39 s ASP 1557Cb -0.12 -2.62 0.13 0.00 -0.00 0.00 0.00 42.92 40.31 2b39 s ASP 1557CO -0.06 -0.15 0.28 -1.61 -0.00 0.00 0.00 175.17 173.64 2b39 s GLU 1558N -1.56 2.13 -0.56 8.23 2.02 -0.54 -2.75 118.70 125.66 2b39 s GLU 1558Ca 0.46 -2.32 -0.22 0.00 0.02 0.00 0.00 54.97 52.91 2b39 s GLU 1558Cb -0.30 -3.51 0.05 0.00 0.10 0.00 0.00 34.13 30.48 2b39 s GLU 1558CO 0.38 -1.10 0.85 0.71 0.02 0.00 0.00 175.26 176.12 2b39 s TYR 1559N 0.25 2.85 -0.48 1.61 1.51 0.51 -2.19 117.35 121.41 2b39 s TYR 1559Ca 0.14 -0.29 -0.28 0.00 -1.01 0.00 0.00 57.07 55.63 2b39 s TYR 1559Cb -0.22 -3.97 0.03 0.00 -0.11 0.00 0.00 41.96 37.69 2b39 s TYR 1559CO -0.03 -1.32 1.09 0.42 -1.11 0.00 0.00 175.55 174.60 2b39 s ILE 1560N 3.57 4.25 -0.11 2.71 1.01 -0.02 -1.10 121.20 131.51 2b39 s ILE 1560Ca 0.24 1.07 0.00 0.00 0.00 0.00 0.00 60.65 61.96 2b39 s ILE 1560Cb -0.16 -4.58 -0.02 0.00 0.01 0.00 0.00 42.46 37.72 2b39 s ILE 1560CO 0.15 -1.00 -0.11 -0.04 0.00 0.00 0.00 174.94 173.93 2b39 s MET 1561N 4.33 3.16 -0.01 2.79 -1.94 -1.16 -2.28 119.30 124.19 2b39 s MET 1561Ca 0.45 -0.65 -0.25 0.00 -1.71 0.00 0.00 55.69 53.53 2b39 s MET 1561Cb -0.08 -2.61 -0.04 0.00 2.01 0.00 0.00 34.83 34.11 2b39 s MET 1561CO 0.30 0.36 0.75 0.08 -0.01 0.00 0.00 175.02 176.50 2b39 s VAL 1562N -0.02 4.90 -0.71 -6.03 1.01 0.16 -2.98 120.40 116.72 2b39 s VAL 1562Ca -0.02 1.57 -0.21 0.00 0.00 0.00 0.00 61.98 63.31 2b39 s VAL 1562Cb -0.14 -4.09 0.09 0.00 0.00 0.00 0.00 36.38 32.24 2b39 s VAL 1562CO 0.04 0.30 0.95 -0.63 0.00 0.00 0.00 175.10 175.75 2b39 s ILE 1563N 0.43 4.53 -1.94 2.22 1.09 -1.26 0.17 121.20 126.45 2b39 s ILE 1563Ca 0.39 -0.80 0.00 0.00 -1.10 0.00 0.00 60.65 59.14 2b39 s ILE 1563Cb -0.19 -4.67 0.00 0.00 -1.06 0.00 0.00 42.46 36.54 2b39 s ILE 1563CO 0.21 -1.40 0.79 -0.62 -0.10 0.00 0.00 174.94 173.82 2b39 n GLU 1564N 7.12 0.81 0.00 2.79 -0.58 -0.68 -1.24 120.64 128.86 2b39 n GLU 1564Ca 0.02 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 2b39 n GLU 1564Cb 0.46 -1.03 0.00 0.00 -0.57 0.00 0.00 31.44 30.30 2b39 n GLU 1564CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2b39 n ASN 1565N -0.46 0.00 -4.66 1.62 2.85 -1.13 -4.95 115.26 108.53 2b39 n ASN 1565Ca 0.00 0.00 -0.34 0.00 -0.11 0.00 0.00 54.58 54.13 2b39 n ASN 1565Cb 0.01 0.00 -0.10 0.00 1.24 0.00 0.00 39.78 40.93 2b39 n ASN 1565CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2b39 s ILE 1566N -0.31 4.12 0.00 -1.44 1.01 -1.26 -1.03 121.20 122.29 2b39 s ILE 1566Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 60.65 60.27 2b39 s ILE 1566Cb 0.00 -2.74 0.00 0.00 0.01 0.00 0.00 42.46 39.73 2b39 s ILE 1566CO 0.00 0.56 0.00 -0.38 0.00 0.00 0.00 174.94 175.12 2b39 n ILE 1567N 2.01 0.00 -4.21 2.92 5.41 0.72 -4.98 119.36 121.23 2b39 n ILE 1567Ca -0.18 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.45 2b39 n ILE 1567Cb 0.53 0.08 -0.10 0.00 -0.71 0.00 0.00 39.64 39.44 2b39 n ILE 1567CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2b39 s LYS 1568N -1.73 1.00 -1.41 0.38 2.47 -1.00 -4.71 119.74 114.75 2b39 s LYS 1568Ca 0.00 -1.46 -0.15 0.00 -1.56 0.00 0.00 55.97 52.79 2b39 s LYS 1568Cb 0.00 -0.18 0.05 0.00 -1.46 0.00 0.00 37.83 36.24 2b39 s LYS 1568CO 0.00 -0.11 2.06 0.43 0.16 0.00 0.00 175.35 177.89 2b39 n SER 1569N -0.16 4.24 -4.52 1.43 7.64 -1.26 -4.54 113.62 116.44 2b39 n SER 1569Ca -0.08 -2.87 -0.28 0.00 1.01 0.00 0.00 58.87 56.65 2b39 n SER 1569Cb 0.63 -1.69 -0.14 0.00 -1.01 0.00 0.00 64.21 61.99 2b39 n SER 1569CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2b39 n GLY 1570N 4.54 -0.31 2.80 0.23 0.00 -1.14 -4.79 105.19 106.52 2b39 n GLY 1570Ca 0.51 0.50 -0.39 0.00 0.00 0.00 0.00 46.02 46.64 2b39 n GLY 1570CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2b39 n SER 1571N 11.36 -1.30 0.00 1.61 3.41 -1.24 0.81 113.62 128.26 2b39 n SER 1571Ca 0.58 0.88 0.00 0.00 -0.26 0.00 0.00 58.87 60.08 2b39 n SER 1571Cb 0.24 -0.78 0.00 0.00 -0.26 0.00 0.00 64.21 63.41 2b39 n SER 1571CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2b39 n ASP 1572N 1.71 0.00 -3.39 4.04 8.00 -1.26 -4.81 116.55 120.84 2b39 n ASP 1572Ca 0.14 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.65 2b39 n ASP 1572Cb 0.23 -0.77 -0.03 0.00 -0.02 0.00 0.00 41.12 40.53 2b39 n ASP 1572CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2b39 s GLU 1573N 0.00 0.55 -0.39 -1.24 2.12 0.24 -5.07 118.70 114.92 2b39 s GLU 1573Ca 0.00 1.19 0.03 0.00 0.36 0.00 0.00 54.97 56.55 2b39 s GLU 1573Cb 0.00 0.70 0.16 0.00 0.26 0.00 0.00 34.13 35.25 2b39 s GLU 1573CO 0.00 -0.39 0.30 0.08 -0.54 0.00 0.00 175.26 174.71 2b39 s VAL 1574N 2.87 0.20 -0.34 3.70 1.01 -1.24 -4.01 120.40 122.59 2b39 s VAL 1574Ca 0.07 -2.21 -0.01 0.00 0.00 0.00 0.00 61.98 59.83 2b39 s VAL 1574Cb -0.13 -1.15 0.12 0.00 0.00 0.00 0.00 36.38 35.22 2b39 s VAL 1574CO -0.20 -1.10 0.17 -1.10 0.00 0.00 0.00 175.10 172.88 2b39 s GLN 1575N 0.50 0.60 0.67 2.72 1.11 -1.26 -5.07 119.66 118.93 2b39 s GLN 1575Ca 0.27 -1.17 -0.17 0.00 0.01 0.00 0.00 55.36 54.30 2b39 s GLN 1575Cb -0.07 -1.55 0.01 0.00 -1.01 0.00 0.00 33.01 30.39 2b39 s GLN 1575CO -0.11 -1.11 1.24 0.08 0.01 0.00 0.00 175.29 175.39 2b39 s VAL 1576N 1.34 2.29 -1.46 1.09 1.01 -1.26 -4.01 120.40 119.39 2b39 s VAL 1576Ca 0.14 0.16 -0.11 0.00 0.00 0.00 0.00 61.98 62.17 2b39 s VAL 1576Cb -0.20 -2.91 0.06 0.00 0.00 0.00 0.00 36.38 33.33 2b39 s VAL 1576CO -0.14 -0.06 0.99 0.29 0.00 0.00 0.00 175.10 176.18 2b39 n LYS 1577N -2.22 -6.02 -3.79 2.72 4.76 -0.38 -5.01 118.16 108.23 2b39 n LYS 1577Ca 0.14 0.66 -0.13 0.00 -2.87 0.00 0.00 58.31 56.11 2b39 n LYS 1577Cb 0.49 -5.55 -0.12 0.00 -1.84 0.00 0.00 35.03 28.02 2b39 n LYS 1577CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 2b39 s GLN 1578N -6.44 0.24 0.59 1.97 -2.07 -1.26 -4.92 119.66 107.77 2b39 s GLN 1578Ca 0.55 0.33 -0.09 0.00 -1.82 0.00 0.00 55.36 54.33 2b39 s GLN 1578Cb -0.27 0.08 -0.06 0.00 -1.09 0.00 0.00 33.01 31.67 2b39 s GLN 1578CO 0.80 -0.05 -0.50 0.39 -1.32 0.00 0.00 175.29 174.61 2b39 n GLU 1579N 3.16 0.00 0.00 9.60 -0.58 -1.26 -4.01 120.64 127.56 2b39 n GLU 1579Ca -0.15 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 2b39 n GLU 1579Cb 0.58 -0.85 0.00 0.00 -0.57 0.00 0.00 31.44 30.59 2b39 n GLU 1579CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2b39 n ARG 1580N 1.86 0.00 -1.60 3.49 5.12 -1.16 -4.84 116.66 119.53 2b39 n ARG 1580Ca -0.01 0.00 -0.44 0.00 -1.93 0.00 0.00 57.85 55.47 2b39 n ARG 1580Cb 0.24 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.51 2b39 n ARG 1580CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2b39 n LYS 1581N 0.00 2.05 -3.56 5.56 5.02 -1.26 -2.99 118.16 122.98 2b39 n LYS 1581Ca 0.00 0.62 -0.36 0.00 -2.02 0.00 0.00 58.31 56.55 2b39 n LYS 1581Cb 0.00 -3.07 -0.07 0.00 -0.02 0.00 0.00 35.03 31.87 2b39 n LYS 1581CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2b39 s PHE 1582N 7.20 3.44 0.05 2.13 0.40 -0.26 -0.21 117.98 130.72 2b39 s PHE 1582Ca 0.99 0.54 0.06 0.00 -0.60 0.00 0.00 56.93 57.92 2b39 s PHE 1582Cb -0.44 -2.32 -0.03 0.00 0.51 0.00 0.00 43.02 40.73 2b39 s PHE 1582CO 0.39 0.22 -0.14 0.42 0.70 0.00 0.00 175.22 176.81 2b39 s ILE 1583N 0.54 3.07 -0.19 0.64 -1.09 0.29 -0.37 121.20 124.09 2b39 s ILE 1583Ca 0.15 -1.14 -0.25 0.00 -2.23 0.00 0.00 60.65 57.18 2b39 s ILE 1583Cb -0.13 -2.34 0.07 0.00 -1.58 0.00 0.00 42.46 38.48 2b39 s ILE 1583CO 0.03 0.29 0.67 -0.94 -1.23 0.00 0.00 174.94 173.76 2b39 s SER 1584N -1.61 -0.68 1.12 3.58 1.04 -1.11 0.16 113.70 116.20 2b39 s SER 1584Ca 0.16 1.15 -0.12 0.00 0.48 0.00 0.00 55.95 57.62 2b39 s SER 1584Cb -0.11 1.12 0.25 0.00 0.10 0.00 0.00 66.02 67.38 2b39 s SER 1584CO 0.07 -0.34 0.98 1.57 0.98 0.00 0.00 173.24 176.50 2b39 n HIS 1585N 2.17 -0.82 -0.22 5.02 -0.00 -1.26 -0.93 115.22 119.18 2b39 n HIS 1585Ca -0.16 -0.01 -0.02 0.00 0.46 0.00 0.00 57.72 57.99 2b39 n HIS 1585Cb 0.56 -1.76 0.09 0.00 -0.12 0.00 0.00 29.99 28.75 2b39 n HIS 1585CO 0.00 0.00 0.00 0.82 0.46 0.00 0.00 176.34 177.62 2b39 h ILE 1586N -2.48 0.99 -0.73 3.57 2.04 -1.82 -3.03 117.51 116.06 2b39 h ILE 1586Ca -0.57 -0.24 0.14 0.00 1.00 0.00 0.00 64.86 65.20 2b39 h ILE 1586Cb 1.32 0.24 -0.14 0.00 -0.74 0.00 0.00 36.82 37.50 2b39 h ILE 1586CO 0.46 0.13 -0.20 0.07 0.00 0.00 0.00 178.15 178.61 2b39 h LYS 1587N 0.69 -0.01 0.00 2.37 2.10 -1.89 -0.27 116.57 119.56 2b39 h LYS 1587Ca 0.28 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.93 2b39 h LYS 1587Cb 0.15 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.48 2b39 h LYS 1587CO -0.16 -0.01 0.00 0.00 -2.00 0.00 0.00 179.45 177.28 2b39 n ARG 1589N -2.96 -0.06 0.08 0.00 0.63 -0.11 -0.48 116.66 113.76 2b39 n ARG 1589Ca -0.01 1.32 -0.16 0.00 -0.92 0.00 0.00 57.85 58.07 2b39 n ARG 1589Cb 0.15 -2.32 -0.14 0.00 0.45 0.00 0.00 32.46 30.59 2b39 n ARG 1589CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2b39 h GLU 1590N 0.00 0.25 0.13 -0.14 4.39 -1.80 -2.47 114.58 114.94 2b39 h GLU 1590Ca 0.77 -0.42 0.01 0.00 0.34 0.00 0.00 59.36 60.06 2b39 h GLU 1590Cb 1.97 0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 30.76 2b39 h GLU 1590CO -0.75 1.14 -0.21 0.00 -1.16 0.00 0.00 179.01 178.03 2b39 h ALA 1591N 0.55 -0.36 0.21 3.43 0.00 -1.01 -2.99 119.26 119.09 2b39 h ALA 1591Ca -0.19 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2b39 h ALA 1591Cb 1.99 0.32 0.00 0.00 0.00 0.00 0.00 17.79 20.11 2b39 h ALA 1591CO 0.18 -0.74 -0.10 -0.07 0.00 0.00 0.00 179.25 178.51 2b39 h LEU 1592N -0.40 -0.24 -1.76 0.00 -0.00 -1.56 -3.47 115.31 107.88 2b39 h LEU 1592Ca 0.02 -0.16 -0.48 0.00 -0.00 0.00 0.00 57.88 57.26 2b39 h LEU 1592Cb 0.41 0.06 -0.04 0.00 -0.00 0.00 0.00 40.66 41.10 2b39 h LEU 1592CO -0.10 0.02 -0.86 1.17 -0.00 0.00 0.00 178.44 178.67 2b39 n LYS 1593N -5.12 -3.83 -1.40 1.13 4.81 -0.93 -4.94 118.16 107.88 2b39 n LYS 1593Ca -0.09 0.47 -0.31 0.00 -0.87 0.00 0.00 58.31 57.51 2b39 n LYS 1593Cb 0.21 -4.79 0.07 0.00 0.02 0.00 0.00 35.03 30.54 2b39 n LYS 1593CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2b39 s LEU 1594N -6.94 3.09 -0.05 3.14 1.43 -1.26 -5.06 118.68 113.03 2b39 s LEU 1594Ca 0.10 1.77 0.01 0.00 -1.03 0.00 0.00 54.13 54.98 2b39 s LEU 1594Cb -0.05 -4.51 0.02 0.00 0.03 0.00 0.00 46.19 41.67 2b39 s LEU 1594CO 0.87 -1.80 -0.06 -0.54 0.23 0.00 0.00 176.35 175.04 2b39 s LYS 1595N -4.89 1.06 -0.35 1.70 -0.14 -1.26 -5.08 119.74 110.77 2b39 s LYS 1595Ca 0.60 -0.17 -0.28 0.00 -1.36 0.00 0.00 55.97 54.76 2b39 s LYS 1595Cb -0.16 -1.01 -0.02 0.00 -1.68 0.00 0.00 37.83 34.95 2b39 s LYS 1595CO 0.54 -0.07 1.80 -1.83 -0.76 0.00 0.00 175.35 175.03 2b39 s GLU 1596N 0.94 3.28 0.00 1.68 -1.05 -1.26 -2.21 118.70 120.08 2b39 s GLU 1596Ca -0.10 1.35 0.00 0.00 -0.15 0.00 0.00 54.97 56.07 2b39 s GLU 1596Cb -0.14 -4.21 0.00 0.00 -0.44 0.00 0.00 34.13 29.34 2b39 s GLU 1596CO 0.00 -1.92 0.00 0.41 0.95 0.00 0.00 175.26 174.70 2b39 n GLY 1597N 5.43 0.51 3.33 -3.83 0.00 -0.19 -4.97 105.19 105.48 2b39 n GLY 1597Ca 0.23 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.99 2b39 n GLY 1597CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b39 s ALA 1598N -0.92 2.07 0.05 4.61 0.00 -0.94 -4.97 121.76 121.66 2b39 s ALA 1598Ca 0.00 -1.37 0.01 0.00 0.00 0.00 0.00 51.96 50.59 2b39 s ALA 1598Cb 0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 2b39 s ALA 1598CO 0.00 0.41 0.13 -1.01 0.00 0.00 0.00 175.76 175.29 2b39 s HIS 1599N -1.26 3.34 0.13 0.00 3.76 -1.25 -1.54 115.29 118.47 2b39 s HIS 1599Ca 0.11 0.18 0.02 0.00 -0.15 0.00 0.00 55.06 55.22 2b39 s HIS 1599Cb -0.09 -1.71 -0.04 0.00 1.11 0.00 0.00 32.58 31.85 2b39 s HIS 1599CO 0.05 0.56 -0.04 0.71 -0.85 0.00 0.00 174.74 175.18 2b39 s TYR 1600N -1.38 1.03 -0.34 1.40 1.51 0.22 -2.08 117.35 117.71 2b39 s TYR 1600Ca 0.29 -0.96 -0.04 0.00 -1.01 0.00 0.00 57.07 55.35 2b39 s TYR 1600Cb -0.12 -0.59 0.06 0.00 -0.11 0.00 0.00 41.96 41.19 2b39 s TYR 1600CO 0.22 -0.18 0.08 -1.17 -1.11 0.00 0.00 175.55 173.39 2b39 s LEU 1601N -3.10 4.32 -0.17 -1.29 1.98 -0.97 -1.32 118.68 118.13 2b39 s LEU 1601Ca 0.17 -1.35 -0.01 0.00 -2.89 0.00 0.00 54.13 50.05 2b39 s LEU 1601Cb 0.06 -1.80 -0.01 0.00 0.66 0.00 0.00 46.19 45.10 2b39 s LEU 1601CO -0.01 -0.34 -0.11 0.68 -1.89 0.00 0.00 176.35 174.68 2b39 s VAL 1602N 1.30 3.08 -0.05 1.68 -7.23 -1.04 -2.33 120.40 115.80 2b39 s VAL 1602Ca -0.01 -0.63 -0.02 0.00 -1.81 0.00 0.00 61.98 59.51 2b39 s VAL 1602Cb -0.20 -2.33 0.04 0.00 0.56 0.00 0.00 36.38 34.44 2b39 s VAL 1602CO 0.00 0.49 0.10 -1.66 -0.31 0.00 0.00 175.10 173.72 2b39 s TRP 1603N 0.82 -0.08 0.34 2.82 -2.14 -1.14 -0.93 118.94 118.65 2b39 s TRP 1603Ca -0.04 0.34 -0.11 0.00 2.66 0.00 0.00 56.10 58.95 2b39 s TRP 1603Cb -0.15 -0.18 0.03 0.00 -3.10 0.00 0.00 33.47 30.07 2b39 s TRP 1603CO 0.01 -0.14 0.63 0.20 -2.66 0.00 0.00 176.95 174.98 2b39 s GLY 1604N 1.25 0.77 0.75 3.67 0.00 -0.97 -2.35 107.32 110.44 2b39 s GLY 1604Ca -0.08 -1.02 -0.12 0.00 0.00 0.00 0.00 44.72 43.51 2b39 s GLY 1604CO -0.05 -0.59 1.10 0.14 0.00 0.00 0.00 173.10 173.70 2b39 s VAL 1605N -2.93 3.25 -0.51 1.40 1.01 -1.26 -2.42 120.40 118.95 2b39 s VAL 1605Ca 0.22 0.45 0.25 0.00 0.00 0.00 0.00 61.98 62.89 2b39 s VAL 1605Cb -0.03 -2.92 0.28 0.00 0.00 0.00 0.00 36.38 33.70 2b39 s VAL 1605CO 0.14 -0.49 1.75 -1.28 0.00 0.00 0.00 175.10 175.22 2b39 h SER 1606N -0.89 0.00 -0.12 3.32 0.87 -1.83 -3.23 113.55 111.67 2b39 h SER 1606Ca -0.44 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.10 2b39 h SER 1606Cb 1.24 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.19 2b39 h SER 1606CO 0.52 0.00 0.01 0.77 -0.53 0.00 0.00 176.83 177.59 2b39 h SER 1607N 0.00 0.19 0.00 6.23 4.64 -1.91 -3.20 113.55 119.50 2b39 h SER 1607Ca 0.00 -0.29 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 2b39 h SER 1607Cb 0.52 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 2b39 h SER 1607CO 0.00 0.43 0.00 -0.90 -0.87 0.00 0.00 176.83 175.49 2b39 n ASP 1608N -4.81 3.98 -4.71 4.97 5.68 -1.22 -4.79 116.55 115.64 2b39 n ASP 1608Ca -0.06 -2.04 -0.36 0.00 -0.50 0.00 0.00 54.79 51.83 2b39 n ASP 1608Cb 0.19 -0.83 -0.08 0.00 -1.14 0.00 0.00 41.12 39.26 2b39 n ASP 1608CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 2b39 s LEU 1609N 0.00 4.19 0.00 -2.12 2.96 -1.21 -2.04 118.68 120.46 2b39 s LEU 1609Ca 0.00 0.31 0.00 0.00 -0.22 0.00 0.00 54.13 54.22 2b39 s LEU 1609Cb 0.00 -2.21 0.00 0.00 0.50 0.00 0.00 46.19 44.48 2b39 s LEU 1609CO 0.00 0.11 0.00 1.87 -1.32 0.00 0.00 176.35 177.01 2b39 n TRP 1610N 3.78 0.00 -4.95 5.38 -0.00 -1.01 -4.91 117.44 115.72 2b39 n TRP 1610Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.36 2b39 n TRP 1610Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.83 2b39 n TRP 1610CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2b39 n GLY 1611N 5.00 -0.86 3.33 5.87 0.00 -1.26 -2.92 105.19 114.35 2b39 n GLY 1611Ca 0.00 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 2b39 n GLY 1611CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2b39 s GLU 1612N 0.00 0.97 0.00 1.61 2.56 -0.60 -4.74 118.70 118.50 2b39 s GLU 1612Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 54.97 54.55 2b39 s GLU 1612Cb 0.00 0.43 0.00 0.00 2.00 0.00 0.00 34.13 36.56 2b39 s GLU 1612CO 0.00 -0.35 0.00 1.63 -0.56 0.00 0.00 175.26 175.98 2b39 n LYS 1613N 0.34 0.00 0.09 4.30 5.02 -1.26 -0.96 118.16 125.69 2b39 n LYS 1613Ca -0.18 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 55.92 2b39 n LYS 1613Cb 0.61 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.50 2b39 n LYS 1613CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2b39 h PRO 1614N 0.00 0.51 -4.57 1.97 0.13 -2.02 -3.42 132.00 124.60 2b39 h PRO 1614Ca 0.00 -0.68 -0.65 0.00 -0.87 0.00 0.00 66.00 63.80 2b39 h PRO 1614Cb 0.00 0.23 -0.40 0.00 0.13 0.00 0.00 31.00 30.96 2b39 h PRO 1614CO 0.00 1.29 -0.74 -1.59 -0.23 0.00 0.00 178.00 176.73 2b39 s LYS 1615N -2.97 1.50 -0.10 0.86 -2.85 -0.13 -5.10 119.74 110.95 2b39 s LYS 1615Ca -0.08 -1.68 -0.14 0.00 -1.00 0.00 0.00 55.97 53.08 2b39 s LYS 1615Cb 0.07 -3.00 -0.05 0.00 -2.06 0.00 0.00 37.83 32.78 2b39 s LYS 1615CO 0.91 -0.88 0.34 0.42 0.10 0.00 0.00 175.35 176.23 2b39 s ILE 1616N 1.03 5.22 0.63 3.79 1.01 -1.25 -1.56 121.20 130.07 2b39 s ILE 1616Ca 0.08 0.66 0.06 0.00 0.00 0.00 0.00 60.65 61.45 2b39 s ILE 1616Cb -0.19 -3.65 0.11 0.00 0.01 0.00 0.00 42.46 38.74 2b39 s ILE 1616CO -0.09 0.47 0.86 -1.20 0.00 0.00 0.00 174.94 174.98 2b39 n SER 1617N 2.79 1.85 -3.58 3.58 7.64 -1.15 -4.51 113.62 120.25 2b39 n SER 1617Ca -0.13 -2.40 -0.26 0.00 1.01 0.00 0.00 58.87 57.08 2b39 n SER 1617Cb 0.52 -0.50 -0.16 0.00 -1.01 0.00 0.00 64.21 63.07 2b39 n SER 1617CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2b39 s TYR 1618N -2.74 0.20 -0.39 1.43 2.02 0.71 -2.41 117.35 116.17 2b39 s TYR 1618Ca 0.62 -0.45 -0.28 0.00 -0.37 0.00 0.00 57.07 56.59 2b39 s TYR 1618Cb -0.04 -0.74 0.02 0.00 -0.40 0.00 0.00 41.96 40.80 2b39 s TYR 1618CO 0.40 -0.61 1.05 0.42 -1.57 0.00 0.00 175.55 175.25 2b39 s ILE 1619N 2.14 4.43 -1.17 2.71 1.09 -0.87 0.10 121.20 129.64 2b39 s ILE 1619Ca 0.04 1.40 -0.20 0.00 -1.10 0.00 0.00 60.65 60.79 2b39 s ILE 1619Cb -0.16 -4.46 -0.05 0.00 -1.06 0.00 0.00 42.46 36.74 2b39 s ILE 1619CO -0.17 -0.68 1.91 -0.38 -0.10 0.00 0.00 174.94 175.52 2b39 n ILE 1620N 6.23 2.62 -1.68 2.92 5.41 0.12 -4.76 119.36 130.22 2b39 n ILE 1620Ca 0.11 -2.60 -0.30 0.00 1.00 0.00 0.00 62.75 60.95 2b39 n ILE 1620Cb 0.48 -2.30 0.20 0.00 -0.71 0.00 0.00 39.64 37.31 2b39 n ILE 1620CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2b39 s GLY 1621N 5.21 1.72 0.31 7.39 0.00 -1.26 -4.58 107.32 116.11 2b39 s GLY 1621Ca 0.60 -1.10 0.08 0.00 0.00 0.00 0.00 44.72 44.29 2b39 s GLY 1621CO 0.09 -0.31 1.72 0.07 0.00 0.00 0.00 173.10 174.67 2b39 h LYS 1622N -1.90 0.52 0.00 2.90 2.10 -1.35 -0.50 116.57 118.34 2b39 h LYS 1622Ca -0.45 -0.03 -0.06 0.00 -2.00 0.00 0.00 60.65 58.11 2b39 h LYS 1622Cb 1.26 -0.12 -0.01 0.00 -0.90 0.00 0.00 32.23 32.46 2b39 h LYS 1622CO 0.38 0.35 -0.29 -0.44 -2.00 0.00 0.00 179.45 177.44 2b39 h ASP 1623N 0.54 0.00 -3.88 7.07 5.19 -1.85 -3.41 116.42 120.08 2b39 h ASP 1623Ca 0.62 0.00 -0.50 0.00 -0.62 0.00 0.00 57.03 56.53 2b39 h ASP 1623Cb 1.17 0.00 0.02 0.00 0.18 0.00 0.00 39.33 40.70 2b39 h ASP 1623CO -0.49 0.29 0.45 -0.89 -3.12 0.00 0.00 179.24 175.49 2b39 s THR 1624N -3.40 3.58 0.01 0.35 2.01 -0.20 -4.64 115.64 113.36 2b39 s THR 1624Ca 0.02 1.41 0.00 0.00 0.31 0.00 0.00 61.69 63.44 2b39 s THR 1624Cb 0.09 -3.83 -0.01 0.00 0.01 0.00 0.00 72.50 68.76 2b39 s THR 1624CO 0.67 0.21 -0.02 0.26 -0.69 0.00 0.00 174.62 175.05 2b39 s TRP 1625N -1.38 0.20 0.19 4.92 0.52 -0.99 -4.33 118.94 118.07 2b39 s TRP 1625Ca 0.50 -0.29 0.09 0.00 0.02 0.00 0.00 56.10 56.43 2b39 s TRP 1625Cb -0.28 -0.14 -0.04 0.00 -1.15 0.00 0.00 33.47 31.87 2b39 s TRP 1625CO 0.35 -0.09 -0.09 0.08 0.02 0.00 0.00 176.95 177.22 2b39 s VAL 1626N -0.78 3.19 -0.06 4.03 1.01 -1.26 -2.86 120.40 123.66 2b39 s VAL 1626Ca -0.08 -1.71 0.01 0.00 0.00 0.00 0.00 61.98 60.20 2b39 s VAL 1626Cb -0.05 -2.59 0.02 0.00 0.00 0.00 0.00 36.38 33.75 2b39 s VAL 1626CO -0.00 -0.15 -0.08 -1.61 0.00 0.00 0.00 175.10 173.26 2b39 s GLU 1627N -2.94 1.24 -0.09 2.72 0.41 -0.98 -4.94 118.70 114.12 2b39 s GLU 1627Ca 0.26 -0.23 -0.02 0.00 -0.41 0.00 0.00 54.97 54.56 2b39 s GLU 1627Cb -0.08 -1.14 -0.05 0.00 -1.78 0.00 0.00 34.13 31.08 2b39 s GLU 1627CO 0.16 -0.06 2.58 1.28 -0.49 0.00 0.00 175.26 178.73 2b39 n LEU 1628N 4.07 5.58 -0.65 1.80 4.32 -1.26 -2.30 117.00 128.56 2b39 n LEU 1628Ca -0.22 -2.93 -0.09 0.00 -0.02 0.00 0.00 56.01 52.75 2b39 n LEU 1628Cb 0.51 -1.22 -0.01 0.00 -1.62 0.00 0.00 43.42 41.08 2b39 n LEU 1628CO 0.23 1.32 0.11 1.87 -1.22 0.00 0.00 177.39 179.70 2b39 n TRP 1629N 1.59 0.14 -0.23 -1.77 -0.00 -0.89 -4.85 117.44 111.44 2b39 n TRP 1629Ca 0.22 0.15 -0.29 0.00 -0.00 0.00 0.00 57.50 57.59 2b39 n TRP 1629Cb 0.65 -0.30 0.28 0.00 -0.00 0.00 0.00 31.31 31.94 2b39 n TRP 1629CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 177.69 175.39 2b39 n PRO 1630N 0.33 -4.67 0.00 5.87 -0.02 -1.26 -3.93 135.00 131.32 2b39 n PRO 1630Ca 0.03 -1.39 0.00 0.00 -2.02 0.00 0.00 63.50 60.13 2b39 n PRO 1630Cb 0.00 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 2b39 n PRO 1630CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2b39 n GLU 1631N -5.50 3.94 0.00 -0.52 -0.58 -1.26 -4.67 120.64 112.05 2b39 n GLU 1631Ca 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 2b39 n GLU 1631Cb 0.57 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.44 2b39 n GLU 1631CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2b39 n ALA 1632N -3.00 0.00 -0.33 0.62 0.00 -1.26 -3.22 120.51 113.32 2b39 n ALA 1632Ca 0.00 0.00 0.25 0.00 0.00 0.00 0.00 53.44 53.69 2b39 n ALA 1632Cb 0.00 0.00 0.54 0.00 0.00 0.00 0.00 19.45 19.99 2b39 n ALA 1632CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2b39 h GLU 1633N 0.00 0.32 -0.92 0.00 4.11 -2.00 0.88 114.58 116.97 2b39 h GLU 1633Ca 0.00 -0.02 0.11 0.00 0.07 0.00 0.00 59.36 59.52 2b39 h GLU 1633Cb 0.00 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.11 2b39 h GLU 1633CO 0.00 0.21 0.59 0.93 0.07 0.00 0.00 179.01 180.81 2b39 h GLU 1634N 0.33 0.87 0.00 1.06 5.08 -2.00 -0.05 114.58 119.87 2b39 h GLU 1634Ca 0.61 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.91 2b39 h GLU 1634Cb 1.65 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.70 2b39 h GLU 1634CO -0.28 0.57 0.00 0.00 -1.00 0.00 0.00 179.01 178.31 2b39 n GLN 1636N -1.99 2.76 -0.08 0.00 1.13 -0.03 -3.82 117.38 115.35 2b39 n GLN 1636Ca -0.00 -3.37 0.00 0.00 -1.94 0.00 0.00 57.00 51.69 2b39 n GLN 1636Cb 0.05 -2.28 0.00 0.00 0.11 0.00 0.00 30.24 28.12 2b39 n GLN 1636CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2b39 n ASP 1637N -0.91 1.36 -0.02 1.08 8.00 -1.09 -4.99 116.55 119.97 2b39 n ASP 1637Ca 0.61 -0.05 -0.20 0.00 0.71 0.00 0.00 54.79 55.86 2b39 n ASP 1637Cb 0.73 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.70 2b39 n ASP 1637CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2b39 n GLU 1638N -0.02 0.73 0.10 -1.24 1.02 -1.26 -3.40 120.64 116.58 2b39 n GLU 1638Ca 0.00 0.25 -0.15 0.00 -0.02 0.00 0.00 57.16 57.23 2b39 n GLU 1638Cb 0.00 -1.69 -0.14 0.00 -0.02 0.00 0.00 31.44 29.59 2b39 n GLU 1638CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2b39 h GLU 1639N 0.05 0.26 0.00 3.49 5.08 -1.97 -3.34 114.58 118.15 2b39 h GLU 1639Ca -0.43 -0.44 -0.19 0.00 -1.00 0.00 0.00 59.36 57.29 2b39 h GLU 1639Cb 2.02 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 31.41 2b39 h GLU 1639CO 0.06 1.21 -0.90 -0.91 -1.00 0.00 0.00 179.01 177.48 2b39 h ASN 1640N 0.07 0.03 -0.67 1.42 4.21 -1.82 -3.32 115.58 115.49 2b39 h ASN 1640Ca -0.13 -0.03 0.02 0.00 1.21 0.00 0.00 56.30 57.38 2b39 h ASN 1640Cb 1.96 -0.01 -0.04 0.00 -1.12 0.00 0.00 38.32 39.12 2b39 h ASN 1640CO 0.20 0.91 0.45 -0.61 -1.29 0.00 0.00 177.43 177.09 2b39 h GLN 1641N 0.01 0.82 -0.68 0.81 5.75 -1.65 -1.09 115.11 119.08 2b39 h GLN 1641Ca -0.01 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.41 2b39 h GLN 1641Cb 1.58 -0.19 -0.03 0.00 1.07 0.00 0.00 27.48 29.92 2b39 h GLN 1641CO 0.12 0.55 0.31 0.87 -2.65 0.00 0.00 178.83 178.03 2b39 h LYS 1642N 0.85 0.99 0.00 1.69 1.57 -1.74 -3.29 116.57 116.63 2b39 h LYS 1642Ca 0.26 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2b39 h LYS 1642Cb -0.00 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.14 2b39 h LYS 1642CO -0.07 0.79 -0.09 0.37 -0.57 0.00 0.00 179.45 179.89 2b39 h GLN 1643N 0.95 0.00 0.00 3.15 4.15 -1.58 -3.29 115.11 118.49 2b39 h GLN 1643Ca 0.23 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.65 2b39 h GLN 1643Cb 0.14 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.83 2b39 h GLN 1643CO -0.03 0.00 0.04 0.00 -1.93 0.00 0.00 178.83 176.92 2b39 n GLU 1645N -1.19 0.68 0.06 0.00 2.13 -1.24 -3.00 120.64 118.08 2b39 n GLU 1645Ca 0.00 0.14 -0.03 0.00 0.66 0.00 0.00 57.16 57.92 2b39 n GLU 1645Cb 0.04 -1.57 0.19 0.00 0.27 0.00 0.00 31.44 30.38 2b39 n GLU 1645CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 2b39 h ASP 1646N 0.01 0.35 1.63 4.31 3.45 -0.47 -2.14 116.42 123.57 2b39 h ASP 1646Ca -0.53 -0.15 -0.07 0.00 0.43 0.00 0.00 57.03 56.72 2b39 h ASP 1646Cb 2.01 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 40.68 2b39 h ASP 1646CO -0.02 0.72 -0.31 -0.07 -1.57 0.00 0.00 179.24 177.99 2b39 h LEU 1647N 0.28 0.00 0.00 1.55 3.38 -1.28 -2.97 115.31 116.27 2b39 h LEU 1647Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2b39 h LEU 1647Cb 0.83 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.58 2b39 h LEU 1647CO 0.07 0.31 0.00 0.00 0.09 0.00 0.00 178.44 178.91 2b39 n ALA 1648N -2.18 2.19 0.08 1.53 0.00 -0.81 -2.43 120.51 118.89 2b39 n ALA 1648Ca 0.03 -0.12 0.09 0.00 0.00 0.00 0.00 53.44 53.43 2b39 n ALA 1648Cb 0.64 -1.33 -0.13 0.00 0.00 0.00 0.00 19.45 18.64 2b39 n ALA 1648CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2b39 n ASN 1649N -1.09 1.04 -0.08 0.00 3.02 -1.12 -4.21 115.26 112.82 2b39 n ASN 1649Ca 0.13 -0.10 -0.15 0.00 -0.03 0.00 0.00 54.58 54.43 2b39 n ASN 1649Cb 0.10 1.70 -0.12 0.00 -0.61 0.00 0.00 39.78 40.85 2b39 n ASN 1649CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 2b39 h PHE 1650N 0.00 0.00 -1.08 3.10 -1.00 -1.58 -3.31 116.94 113.06 2b39 h PHE 1650Ca 0.00 0.00 0.29 0.00 2.81 0.00 0.00 57.97 61.07 2b39 h PHE 1650Cb 0.74 0.00 -0.08 0.00 3.61 0.00 0.00 35.95 40.22 2b39 h PHE 1650CO 0.00 1.06 0.72 0.00 -1.61 0.00 0.00 178.31 178.48 2b39 h THR 1651N -1.00 0.47 -2.14 -1.55 1.03 -1.75 -2.53 112.91 105.45 2b39 h THR 1651Ca -0.10 -0.10 -0.57 0.00 -0.01 0.00 0.00 66.41 65.63 2b39 h THR 1651Cb 1.02 0.17 -0.42 0.00 -1.07 0.00 0.00 68.15 67.86 2b39 h THR 1651CO -0.06 0.05 -0.72 -1.84 -0.01 0.00 0.00 175.52 172.94 2b39 n GLU 1652N -4.53 2.99 0.00 0.00 0.28 -1.26 -4.50 120.64 113.62 2b39 n GLU 1652Ca 0.26 -4.63 0.00 0.00 -0.16 0.00 0.00 57.16 52.62 2b39 n GLU 1652Cb 0.99 -2.17 0.00 0.00 1.43 0.00 0.00 31.44 31.70 2b39 n GLU 1652CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 2b39 n ASN 1653N -0.22 0.00 -0.00 -1.84 2.85 -1.06 -4.93 115.26 110.06 2b39 n ASN 1653Ca 0.31 -0.04 0.09 0.00 -0.11 0.00 0.00 54.58 54.84 2b39 n ASN 1653Cb 0.46 0.00 -0.13 0.00 1.24 0.00 0.00 39.78 41.35 2b39 n ASN 1653CO 0.00 0.00 0.00 0.23 -2.11 0.00 0.00 177.26 175.38 2b39 n MET 1654N 0.00 0.71 0.10 1.20 2.81 -0.98 -2.32 117.12 118.64 2b39 n MET 1654Ca 0.00 -0.09 0.04 0.00 -1.81 0.00 0.00 57.70 55.84 2b39 n MET 1654Cb 0.01 -1.42 -0.01 0.00 -0.71 0.00 0.00 33.22 31.09 2b39 n MET 1654CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2b39 h VAL 1655N 0.00 0.46 -0.38 2.03 2.07 -1.83 -3.05 116.25 115.56 2b39 h VAL 1655Ca 0.00 -1.78 -0.19 0.00 0.82 0.00 0.00 66.70 65.56 2b39 h VAL 1655Cb 0.66 2.04 -0.11 0.00 -1.52 0.00 0.00 31.29 32.36 2b39 h VAL 1655CO 0.00 0.26 -0.04 1.33 0.02 0.00 0.00 177.57 179.15 2b39 n VAL 1656N -2.97 2.57 -0.11 2.57 0.24 -1.26 -5.04 118.33 114.34 2b39 n VAL 1656Ca -0.03 -2.65 -0.15 0.00 -2.04 0.00 0.00 64.34 59.47 2b39 n VAL 1656Cb 0.72 -0.32 0.15 0.00 -1.47 0.00 0.00 33.84 32.92 2b39 n VAL 1656CO 0.00 0.00 0.00 2.22 -2.14 0.00 0.00 176.83 176.91 2b39 n PHE 1657N -1.08 -2.89 -2.67 6.34 -0.00 -0.98 -4.94 117.46 111.23 2b39 n PHE 1657Ca 0.34 -0.40 -0.04 0.00 -0.00 0.00 0.00 57.45 57.34 2b39 n PHE 1657Cb 1.06 -0.62 0.09 0.00 -0.00 0.00 0.00 39.48 40.01 2b39 n PHE 1657CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2b39 n GLY 1658N -2.87 -1.46 0.46 4.97 0.00 -1.26 -5.01 105.19 100.02 2b39 n GLY 1658Ca 0.07 0.86 0.28 0.00 0.00 0.00 0.00 46.02 47.23 2b39 n GLY 1658CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b39 n PRO 1660N -4.31 2.26 0.00 0.00 -0.02 -1.26 -4.98 135.00 126.69 2b39 n PRO 1660Ca 0.20 -2.16 0.00 0.00 -2.02 0.00 0.00 63.50 59.51 2b39 n PRO 1660Cb 0.96 -3.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 2b39 n PRO 1660CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57