#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i33 s PRO 6 N 0.00 2.89 0.51 2.12 0.04 -1.26 -5.00 135.00 134.30 3i33 s PRO 6 Ca 0.00 0.83 -0.06 0.00 0.04 0.00 0.00 61.00 61.81 3i33 s PRO 6 Cb 0.00 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 3i33 s PRO 6 CO 0.00 -1.10 0.83 0.00 0.04 0.00 0.00 177.00 176.77 3i33 s ALA 7 N -3.11 3.35 0.24 8.56 0.00 -1.26 -4.72 121.76 124.82 3i33 s ALA 7 Ca 0.58 -0.46 0.11 0.00 0.00 0.00 0.00 51.96 52.19 3i33 s ALA 7 Cb -0.13 -2.66 -0.05 0.00 0.00 0.00 0.00 23.12 20.28 3i33 s ALA 7 CO 0.54 -0.43 -0.15 0.96 0.00 0.00 0.00 175.76 176.69 3i33 s ILE 8 N -2.82 2.80 -0.17 0.00 -4.36 -0.66 -4.44 121.20 111.54 3i33 s ILE 8 Ca 0.49 -2.08 -0.04 0.00 -0.26 0.00 0.00 60.65 58.76 3i33 s ILE 8 Cb -0.10 -2.44 -0.03 0.00 1.25 0.00 0.00 42.46 41.14 3i33 s ILE 8 CO 0.46 -0.28 -0.01 -0.83 0.24 0.00 0.00 174.94 174.52 3i33 s GLY 9 N -3.24 1.73 -0.17 6.27 0.00 -0.03 -1.23 107.32 110.65 3i33 s GLY 9 Ca 0.27 -0.88 0.01 0.00 0.00 0.00 0.00 44.72 44.12 3i33 s GLY 9 CO 0.15 0.06 -0.19 -0.42 0.00 0.00 0.00 173.10 172.70 3i33 s ILE 10 N 0.61 1.96 -0.54 0.90 1.01 0.20 -1.07 121.20 124.27 3i33 s ILE 10 Ca -0.01 -0.87 -0.22 0.00 0.00 0.00 0.00 60.65 59.54 3i33 s ILE 10 Cb -0.14 -1.78 0.05 0.00 0.01 0.00 0.00 42.46 40.60 3i33 s ILE 10 CO 0.02 0.52 0.80 -0.62 0.00 0.00 0.00 174.94 175.67 3i33 s ASP 11 N 1.32 6.28 -0.88 3.58 2.15 0.05 -2.10 116.67 127.07 3i33 s ASP 11 Ca 0.05 -0.64 -0.17 0.00 0.43 0.00 0.00 52.55 52.22 3i33 s ASP 11 Cb -0.13 -2.37 0.16 0.00 -0.30 0.00 0.00 42.92 40.28 3i33 s ASP 11 CO -0.12 -1.09 0.99 -0.22 -0.17 0.00 0.00 175.17 174.55 3i33 s LEU 12 N 3.37 5.67 0.41 -1.34 2.96 -1.26 -1.47 118.68 127.02 3i33 s LEU 12 Ca 0.23 -2.26 -0.01 0.00 -0.22 0.00 0.00 54.13 51.88 3i33 s LEU 12 Cb -0.16 -2.33 -0.02 0.00 0.50 0.00 0.00 46.19 44.18 3i33 s LEU 12 CO 0.15 -0.89 0.64 -0.83 -1.32 0.00 0.00 176.35 174.11 3i33 s GLY 13 N 3.11 1.45 0.19 7.98 0.00 -0.83 -4.92 107.32 114.29 3i33 s GLY 13 Ca 0.27 -0.89 -0.12 0.00 0.00 0.00 0.00 44.72 43.98 3i33 s GLY 13 CO -0.09 -0.76 1.81 -0.84 0.00 0.00 0.00 173.10 173.22 3i33 h THR 14 N 0.51 1.02 0.00 0.90 2.02 -1.97 -3.36 112.91 112.02 3i33 h THR 14 Ca -0.48 -0.21 -0.18 0.00 0.77 0.00 0.00 66.41 66.31 3i33 h THR 14 Cb 1.23 0.35 -0.03 0.00 -1.74 0.00 0.00 68.15 67.96 3i33 h THR 14 CO 0.60 0.11 -1.69 0.35 0.37 0.00 0.00 175.52 175.26 3i33 n THR 15 N -4.81 0.69 -4.16 3.16 -2.24 -1.26 -4.09 114.28 101.57 3i33 n THR 15 Ca 0.05 -0.33 -0.16 0.00 -2.27 0.00 0.00 64.05 61.33 3i33 n THR 15 Cb 0.11 -0.85 -0.11 0.00 -2.10 0.00 0.00 70.33 67.37 3i33 n THR 15 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3i33 s TYR 16 N -2.24 1.08 0.22 4.78 1.51 -1.26 -0.71 117.35 120.73 3i33 s TYR 16 Ca -0.11 -0.54 0.11 0.00 -1.01 0.00 0.00 57.07 55.53 3i33 s TYR 16 Cb 0.04 -0.60 -0.05 0.00 -0.11 0.00 0.00 41.96 41.24 3i33 s TYR 16 CO 0.34 0.02 -0.22 -1.12 -1.11 0.00 0.00 175.55 173.45 3i33 s SER 17 N -1.99 3.43 -0.11 2.29 0.01 0.13 -1.96 113.70 115.50 3i33 s SER 17 Ca -0.00 -0.92 -0.09 0.00 1.31 0.00 0.00 55.95 56.25 3i33 s SER 17 Cb -0.07 -0.26 0.03 0.00 0.21 0.00 0.00 66.02 65.93 3i33 s SER 17 CO 0.01 0.09 0.28 0.00 0.41 0.00 0.00 173.24 174.03 3i33 s VAL 19 N 0.30 1.11 0.20 0.00 0.11 -1.26 -0.77 120.40 120.10 3i33 s VAL 19 Ca -0.01 -0.52 0.05 0.00 -2.93 0.00 0.00 61.98 58.56 3i33 s VAL 19 Cb -0.03 -0.98 -0.05 0.00 -1.53 0.00 0.00 36.38 33.79 3i33 s VAL 19 CO -0.01 0.34 -0.07 -0.83 -3.33 0.00 0.00 175.10 171.19 3i33 s GLY 20 N 0.24 1.38 -0.03 6.54 0.00 -0.23 -1.28 107.32 113.95 3i33 s GLY 20 Ca -0.06 -1.66 -0.03 0.00 0.00 0.00 0.00 44.72 42.97 3i33 s GLY 20 CO 0.02 -1.67 0.08 0.54 0.00 0.00 0.00 173.10 172.07 3i33 s VAL 21 N -3.26 0.02 -0.29 1.40 0.11 -0.28 -0.85 120.40 117.23 3i33 s VAL 21 Ca 0.23 -0.13 -0.10 0.00 -2.93 0.00 0.00 61.98 59.05 3i33 s VAL 21 Cb 0.03 -0.16 -0.03 0.00 -1.53 0.00 0.00 36.38 34.69 3i33 s VAL 21 CO 0.06 -0.07 0.17 0.12 -3.33 0.00 0.00 175.10 172.04 3i33 s PHE 22 N -0.19 3.18 -0.03 1.54 5.36 -1.26 -0.50 117.98 126.08 3i33 s PHE 22 Ca -0.02 -0.24 -0.04 0.00 -0.96 0.00 0.00 56.93 55.66 3i33 s PHE 22 Cb -0.02 -2.37 0.01 0.00 -0.34 0.00 0.00 43.02 40.30 3i33 s PHE 22 CO 0.00 -0.32 0.11 -0.65 -1.46 0.00 0.00 175.22 172.90 3i33 s GLN 23 N 1.68 0.23 -1.47 10.12 -0.21 -0.27 -4.89 119.66 124.86 3i33 s GLN 23 Ca 0.06 -0.04 -0.04 0.00 0.02 0.00 0.00 55.36 55.36 3i33 s GLN 23 Cb -0.16 0.10 0.03 0.00 1.00 0.00 0.00 33.01 33.98 3i33 s GLN 23 CO 0.08 -0.04 0.50 0.72 -2.12 0.00 0.00 175.29 174.43 3i33 n HIS 24 N 2.53 -1.69 -0.86 0.91 8.25 -1.26 -1.92 115.22 121.19 3i33 n HIS 24 Ca -0.16 0.76 0.00 0.00 -0.26 0.00 0.00 57.72 58.06 3i33 n HIS 24 Cb 0.58 -3.60 0.00 0.00 1.12 0.00 0.00 29.99 28.09 3i33 n HIS 24 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i33 n GLY 25 N -1.88 1.21 3.13 -1.41 0.00 -1.26 -4.99 105.19 99.99 3i33 n GLY 25 Ca -0.23 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.71 3i33 n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i33 s LYS 26 N -0.02 0.68 -0.03 1.61 -2.85 -0.81 -5.14 119.74 113.18 3i33 s LYS 26 Ca 0.00 -1.05 -0.21 0.00 -1.00 0.00 0.00 55.97 53.71 3i33 s LYS 26 Cb 0.00 0.26 -0.05 0.00 -2.06 0.00 0.00 37.83 35.98 3i33 s LYS 26 CO 0.00 -0.17 0.61 0.08 0.10 0.00 0.00 175.35 175.97 3i33 s VAL 27 N -3.66 4.97 -0.17 1.79 1.01 -1.26 -1.11 120.40 121.97 3i33 s VAL 27 Ca 0.04 1.27 -0.01 0.00 0.00 0.00 0.00 61.98 63.28 3i33 s VAL 27 Cb 0.05 -3.95 -0.01 0.00 0.00 0.00 0.00 36.38 32.47 3i33 s VAL 27 CO -0.09 0.36 -0.11 -1.61 0.00 0.00 0.00 175.10 173.65 3i33 s GLU 28 N 0.17 3.32 -0.10 2.72 2.02 0.34 -4.97 118.70 122.20 3i33 s GLU 28 Ca 0.32 -0.68 -0.22 0.00 0.02 0.00 0.00 54.97 54.41 3i33 s GLU 28 Cb -0.18 -2.77 -0.03 0.00 0.10 0.00 0.00 34.13 31.25 3i33 s GLU 28 CO 0.17 -0.01 0.66 0.42 0.02 0.00 0.00 175.26 176.52 3i33 s ILE 29 N 0.93 5.05 -0.19 -1.63 -1.09 -1.26 -1.13 121.20 121.88 3i33 s ILE 29 Ca -0.02 1.34 -0.16 0.00 -2.23 0.00 0.00 60.65 59.58 3i33 s ILE 29 Cb -0.15 -4.00 -0.04 0.00 -1.58 0.00 0.00 42.46 36.69 3i33 s ILE 29 CO -0.01 0.23 0.41 -0.63 -1.23 0.00 0.00 174.94 173.71 3i33 s ILE 30 N 1.03 5.20 0.34 2.92 1.01 -0.40 -5.00 121.20 126.30 3i33 s ILE 30 Ca 0.34 0.74 -0.26 0.00 0.00 0.00 0.00 60.65 61.48 3i33 s ILE 30 Cb -0.17 -3.74 -0.10 0.00 0.01 0.00 0.00 42.46 38.46 3i33 s ILE 30 CO 0.15 0.27 0.95 0.00 0.00 0.00 0.00 174.94 176.31 3i33 s ALA 31 N 1.17 3.19 0.91 9.38 0.00 -1.26 -4.59 121.76 130.56 3i33 s ALA 31 Ca 0.20 0.52 -0.03 0.00 0.00 0.00 0.00 51.96 52.65 3i33 s ALA 31 Cb -0.15 -3.19 0.05 0.00 0.00 0.00 0.00 23.12 19.84 3i33 s ALA 31 CO 0.08 0.15 0.32 0.27 0.00 0.00 0.00 175.76 176.58 3i33 n ASN 32 N 0.43 0.08 -0.07 0.00 0.23 0.65 -4.82 115.26 111.76 3i33 n ASN 32 Ca 0.03 -1.15 0.12 0.00 -0.53 0.00 0.00 54.58 53.04 3i33 n ASN 32 Cb 0.50 -0.24 0.66 0.00 -2.08 0.00 0.00 39.78 38.62 3i33 n ASN 32 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 3i33 n ASP 33 N -3.18 0.21 -1.05 0.53 5.68 -1.26 -0.90 116.55 116.58 3i33 n ASP 33 Ca 0.04 -1.32 0.09 0.00 -0.50 0.00 0.00 54.79 53.11 3i33 n ASP 33 Cb 0.15 -0.01 0.24 0.00 -1.14 0.00 0.00 41.12 40.36 3i33 n ASP 33 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3i33 n GLN 34 N -0.72 2.72 -0.87 0.11 6.02 -1.26 -4.97 117.38 118.40 3i33 n GLN 34 Ca 0.17 -2.37 0.00 0.00 -0.01 0.00 0.00 57.00 54.79 3i33 n GLN 34 Cb 0.11 -1.44 0.00 0.00 1.02 0.00 0.00 30.24 29.93 3i33 n GLN 34 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3i33 n GLY 35 N 1.19 0.51 3.71 1.08 0.00 -0.08 -5.04 105.19 106.56 3i33 n GLY 35 Ca 0.19 -0.46 -0.35 0.00 0.00 0.00 0.00 46.02 45.39 3i33 n GLY 35 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i33 s ASN 36 N -2.42 5.62 0.00 1.61 0.01 -1.25 -4.72 114.94 113.78 3i33 s ASN 36 Ca 0.00 0.19 0.29 0.00 -0.71 0.00 0.00 52.86 52.63 3i33 s ASN 36 Cb 0.00 -1.79 1.33 0.00 0.41 0.00 0.00 41.25 41.20 3i33 s ASN 36 CO 0.00 0.31 1.92 0.54 -1.51 0.00 0.00 177.10 178.36 3i33 n ARG 37 N 2.62 0.61 -4.21 -0.60 1.74 -1.26 -0.25 116.66 115.31 3i33 n ARG 37 Ca -0.18 -0.15 -0.17 0.00 -0.77 0.00 0.00 57.85 56.58 3i33 n ARG 37 Cb 0.53 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 30.37 3i33 n ARG 37 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3i33 s THR 38 N -2.49 1.17 -0.07 0.55 -4.23 -1.26 -4.57 115.64 104.73 3i33 s THR 38 Ca 0.29 -1.63 0.01 0.00 -1.18 0.00 0.00 61.69 59.18 3i33 s THR 38 Cb 0.20 -1.40 0.02 0.00 1.34 0.00 0.00 72.50 72.66 3i33 s THR 38 CO 0.47 -0.43 -0.08 -0.89 -0.54 0.00 0.00 174.62 173.14 3i33 s THR 39 N -2.10 0.92 0.32 3.99 2.01 0.24 -4.90 115.64 116.13 3i33 s THR 39 Ca 0.06 -0.31 -0.29 0.00 0.31 0.00 0.00 61.69 61.46 3i33 s THR 39 Cb -0.05 -0.90 -0.12 0.00 0.01 0.00 0.00 72.50 71.43 3i33 s THR 39 CO 0.02 0.32 1.37 -2.65 -0.69 0.00 0.00 174.62 173.00 3i33 n PRO 40 N 4.27 2.25 -1.65 4.92 -0.02 -1.26 0.18 135.00 143.69 3i33 n PRO 40 Ca -0.19 0.79 -0.40 0.00 -2.02 0.00 0.00 63.50 61.68 3i33 n PRO 40 Cb 0.51 -2.43 -0.02 0.00 -0.02 0.00 0.00 33.50 31.54 3i33 n PRO 40 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3i33 n SER 41 N 1.14 7.66 -4.19 2.55 7.64 0.11 -3.67 113.62 124.85 3i33 n SER 41 Ca 0.06 -2.82 -0.25 0.00 1.01 0.00 0.00 58.87 56.87 3i33 n SER 41 Cb 0.36 -1.51 -0.15 0.00 -1.01 0.00 0.00 64.21 61.90 3i33 n SER 41 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 3i33 s TYR 42 N 1.15 1.67 -0.06 1.43 1.51 -1.26 -4.32 117.35 117.48 3i33 s TYR 42 Ca 0.60 -0.33 -0.00 0.00 -1.01 0.00 0.00 57.07 56.33 3i33 s TYR 42 Cb 0.17 -1.06 0.03 0.00 -0.11 0.00 0.00 41.96 40.99 3i33 s TYR 42 CO -0.07 -0.00 -0.02 0.08 -1.11 0.00 0.00 175.55 174.43 3i33 s VAL 43 N -0.52 0.46 0.01 0.71 1.01 -0.32 -1.36 120.40 120.39 3i33 s VAL 43 Ca 0.07 0.01 0.05 0.00 0.00 0.00 0.00 61.98 62.11 3i33 s VAL 43 Cb -0.07 -0.56 -0.03 0.00 0.00 0.00 0.00 36.38 35.72 3i33 s VAL 43 CO -0.00 0.25 -0.15 0.00 0.00 0.00 0.00 175.10 175.20 3i33 s ALA 44 N 1.52 2.70 -0.03 5.51 0.00 0.50 0.01 121.76 131.98 3i33 s ALA 44 Ca -0.02 -1.10 0.06 0.00 0.00 0.00 0.00 51.96 50.90 3i33 s ALA 44 Cb -0.13 -0.88 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 3i33 s ALA 44 CO -0.03 0.58 -0.20 -0.06 0.00 0.00 0.00 175.76 176.04 3i33 s PHE 45 N -0.89 1.86 0.05 0.00 0.40 -0.42 -0.57 117.98 118.42 3i33 s PHE 45 Ca 0.14 -0.43 0.01 0.00 -0.60 0.00 0.00 56.93 56.05 3i33 s PHE 45 Cb -0.11 -1.21 -0.00 0.00 0.51 0.00 0.00 43.02 42.21 3i33 s PHE 45 CO 0.04 -0.09 0.02 0.25 0.70 0.00 0.00 175.22 176.15 3i33 n THR 46 N 2.77 0.00 0.39 0.64 -2.24 -0.49 -4.76 114.28 110.59 3i33 n THR 46 Ca -0.16 -0.33 0.12 0.00 -2.27 0.00 0.00 64.05 61.41 3i33 n THR 46 Cb 0.53 0.13 0.49 0.00 -2.10 0.00 0.00 70.33 69.37 3i33 n THR 46 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3i33 n ASP 47 N -2.16 0.63 0.00 3.42 2.03 -1.26 -0.59 116.55 118.62 3i33 n ASP 47 Ca -0.00 0.66 0.00 0.00 0.52 0.00 0.00 54.79 55.97 3i33 n ASP 47 Cb 0.08 -0.79 0.00 0.00 -0.72 0.00 0.00 41.12 39.69 3i33 n ASP 47 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 3i33 n THR 48 N -2.20 0.00 -3.98 5.18 -2.24 -1.26 -3.67 114.28 106.11 3i33 n THR 48 Ca 0.02 -0.14 -0.09 0.00 -2.27 0.00 0.00 64.05 61.57 3i33 n THR 48 Cb 0.22 0.77 -0.10 0.00 -2.10 0.00 0.00 70.33 69.11 3i33 n THR 48 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3i33 s GLU 49 N -0.51 0.42 -0.19 -0.78 2.02 -1.26 -5.02 118.70 113.39 3i33 s GLU 49 Ca 0.00 -0.71 0.00 0.00 0.02 0.00 0.00 54.97 54.28 3i33 s GLU 49 Cb 0.00 0.16 0.02 0.00 0.10 0.00 0.00 34.13 34.40 3i33 s GLU 49 CO 0.00 -0.08 -0.16 0.50 0.02 0.00 0.00 175.26 175.53 3i33 s ARG 50 N -2.03 3.04 -0.02 1.61 3.52 -1.26 -1.39 118.95 122.42 3i33 s ARG 50 Ca -0.10 -0.81 0.03 0.00 -0.13 0.00 0.00 55.73 54.71 3i33 s ARG 50 Cb -0.05 -2.67 -0.03 0.00 -1.56 0.00 0.00 34.95 30.63 3i33 s ARG 50 CO -0.03 -0.22 -0.07 -0.51 -0.81 0.00 0.00 175.30 173.66 3i33 s LEU 51 N 1.32 3.13 -0.03 -0.88 1.43 0.27 -4.96 118.68 118.96 3i33 s LEU 51 Ca 0.05 -0.12 0.02 0.00 -1.03 0.00 0.00 54.13 53.04 3i33 s LEU 51 Cb -0.14 -1.76 0.01 0.00 0.03 0.00 0.00 46.19 44.33 3i33 s LEU 51 CO -0.11 0.31 -0.07 -0.63 0.23 0.00 0.00 176.35 176.08 3i33 s ILE 52 N -0.93 0.64 0.00 -0.59 1.01 -1.26 -0.37 121.20 119.70 3i33 s ILE 52 Ca 0.16 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.56 3i33 s ILE 52 Cb -0.11 -0.60 0.00 0.00 0.01 0.00 0.00 42.46 41.76 3i33 s ILE 52 CO 0.06 0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.83 3i33 n GLY 53 N 3.59 0.71 0.31 6.18 0.00 -0.47 -4.20 105.19 111.30 3i33 n GLY 53 Ca -0.21 -1.23 -0.00 0.00 0.00 0.00 0.00 46.02 44.58 3i33 n GLY 53 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3i33 h ASP 54 N 3.25 0.79 -0.99 1.61 3.32 -1.91 -0.16 116.42 122.33 3i33 h ASP 54 Ca 0.00 0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.10 3i33 h ASP 54 Cb 0.00 -0.15 -0.06 0.00 0.22 0.00 0.00 39.33 39.34 3i33 h ASP 54 CO 0.00 0.51 0.65 0.00 -1.72 0.00 0.00 179.24 178.68 3i33 h ALA 55 N 1.38 1.31 -0.03 3.45 0.00 -1.97 0.69 119.26 124.10 3i33 h ALA 55 Ca 0.35 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 3i33 h ALA 55 Cb 0.15 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 3i33 h ALA 55 CO -0.16 0.54 -0.04 0.00 0.00 0.00 0.00 179.25 179.58 3i33 h ALA 56 N 1.40 0.04 -0.89 0.00 0.00 -1.40 -3.15 119.26 115.27 3i33 h ALA 56 Ca 0.39 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3i33 h ALA 56 Cb 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3i33 h ALA 56 CO -0.12 -0.16 0.47 -0.22 0.00 0.00 0.00 179.25 179.22 3i33 h LYS 57 N -0.44 1.24 0.00 0.00 3.64 -0.85 -2.67 116.57 117.49 3i33 h LYS 57 Ca 0.00 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 3i33 h LYS 57 Cb 0.59 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 3i33 h LYS 57 CO 0.01 0.92 0.00 -0.91 -2.27 0.00 0.00 179.45 177.19 3i33 h ASN 58 N 1.24 0.00 -0.46 4.20 4.21 -0.92 -2.75 115.58 121.09 3i33 h ASN 58 Ca 0.31 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.82 3i33 h ASN 58 Cb 0.04 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.24 3i33 h ASN 58 CO -0.05 0.00 0.00 0.00 -1.29 0.00 0.00 177.43 176.09 3i33 n GLN 59 N -2.72 2.90 0.17 0.81 -0.00 -1.02 -4.61 117.38 112.91 3i33 n GLN 59 Ca 0.01 -2.31 0.06 0.00 -0.00 0.00 0.00 57.00 54.76 3i33 n GLN 59 Cb 0.26 -1.42 0.55 0.00 -0.00 0.00 0.00 30.24 29.63 3i33 n GLN 59 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.06 176.82 3i33 h VAL 60 N 2.73 1.05 -0.58 -0.39 3.04 -1.33 -1.26 116.25 119.52 3i33 h VAL 60 Ca 0.00 -0.16 -0.00 0.00 -1.01 0.00 0.00 66.70 65.53 3i33 h VAL 60 Cb 0.89 0.90 -0.03 0.00 -2.01 0.00 0.00 31.29 31.04 3i33 h VAL 60 CO 0.03 0.06 0.36 0.00 -1.01 0.00 0.00 177.57 177.01 3i33 h ALA 61 N 1.89 1.54 0.00 3.17 0.00 -1.82 -2.59 119.26 121.45 3i33 h ALA 61 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3i33 h ALA 61 Cb 0.04 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.59 3i33 h ALA 61 CO -0.01 0.41 -0.64 -1.33 0.00 0.00 0.00 179.25 177.68 3i33 n MET 62 N -4.43 0.02 -2.98 0.00 2.81 -0.55 -4.56 117.12 107.43 3i33 n MET 62 Ca 0.06 0.00 -0.14 0.00 -1.81 0.00 0.00 57.70 55.80 3i33 n MET 62 Cb 0.06 -1.51 0.02 0.00 -0.71 0.00 0.00 33.22 31.09 3i33 n MET 62 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3i33 n ASN 63 N -1.54 -0.65 0.09 7.83 5.15 -0.77 -5.01 115.26 120.37 3i33 n ASN 63 Ca 0.05 -3.29 -0.04 0.00 -0.60 0.00 0.00 54.58 50.70 3i33 n ASN 63 Cb 0.34 0.52 0.15 0.00 -0.53 0.00 0.00 39.78 40.26 3i33 n ASN 63 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 3i33 h PRO 64 N 3.09 0.20 0.00 1.20 0.13 -1.73 -3.03 132.00 131.87 3i33 h PRO 64 Ca 0.01 -0.13 -0.08 0.00 -0.87 0.00 0.00 66.00 64.93 3i33 h PRO 64 Cb 1.02 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 3i33 h PRO 64 CO 0.34 0.72 -0.37 1.15 -0.23 0.00 0.00 178.00 179.61 3i33 h THR 65 N 0.16 0.69 -0.10 1.56 2.02 -1.90 -3.27 112.91 112.07 3i33 h THR 65 Ca -0.00 -1.79 -0.01 0.00 0.77 0.00 0.00 66.41 65.38 3i33 h THR 65 Cb 1.06 2.20 -0.00 0.00 -1.74 0.00 0.00 68.15 69.66 3i33 h THR 65 CO 0.09 0.36 -0.03 0.59 0.37 0.00 0.00 175.52 176.90 3i33 n ASN 66 N -3.26 2.81 -4.25 4.18 3.02 -1.24 -4.33 115.26 112.20 3i33 n ASN 66 Ca 0.02 -3.13 -0.37 0.00 -0.03 0.00 0.00 54.58 51.07 3i33 n ASN 66 Cb 0.63 -0.48 -0.13 0.00 -0.61 0.00 0.00 39.78 39.19 3i33 n ASN 66 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3i33 s THR 67 N -2.90 3.55 -0.02 3.41 2.01 -1.14 -1.30 115.64 119.25 3i33 s THR 67 Ca 0.36 -1.16 -0.16 0.00 0.31 0.00 0.00 61.69 61.04 3i33 s THR 67 Cb 0.31 -3.00 -0.05 0.00 0.01 0.00 0.00 72.50 69.77 3i33 s THR 67 CO 0.04 -0.13 0.43 -0.63 -0.69 0.00 0.00 174.62 173.65 3i33 s ILE 68 N 1.37 5.03 0.33 1.82 -1.09 0.10 -4.81 121.20 123.95 3i33 s ILE 68 Ca -0.02 0.89 -0.03 0.00 -2.23 0.00 0.00 60.65 59.25 3i33 s ILE 68 Cb -0.19 -3.74 0.00 0.00 -1.58 0.00 0.00 42.46 36.94 3i33 s ILE 68 CO 0.01 0.53 0.47 0.72 -1.23 0.00 0.00 174.94 175.44 3i33 s PHE 69 N -0.74 1.00 -2.02 3.97 -0.12 -1.26 -1.18 117.98 117.63 3i33 s PHE 69 Ca 0.24 -1.25 0.00 0.00 -0.05 0.00 0.00 56.93 55.88 3i33 s PHE 69 Cb -0.17 -0.07 0.00 0.00 -0.63 0.00 0.00 43.02 42.15 3i33 s PHE 69 CO 0.13 -1.11 0.00 -0.25 -0.05 0.00 0.00 175.22 173.94 3i33 n ASP 70 N -1.29 -5.56 0.28 1.98 9.92 -1.26 -4.86 116.55 115.76 3i33 n ASP 70 Ca 0.01 0.33 0.12 0.00 -0.53 0.00 0.00 54.79 54.72 3i33 n ASP 70 Cb 0.62 -4.76 0.80 0.00 -0.64 0.00 0.00 41.12 37.14 3i33 n ASP 70 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3i33 h ALA 71 N 0.31 1.65 0.00 2.24 0.00 -1.86 -0.58 119.26 121.02 3i33 h ALA 71 Ca -0.44 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 3i33 h ALA 71 Cb 1.34 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 3i33 h ALA 71 CO 0.60 0.03 -0.04 -0.22 0.00 0.00 0.00 179.25 179.61 3i33 h LYS 72 N 0.00 0.00 0.00 0.00 3.64 -1.89 -0.63 116.57 117.69 3i33 h LYS 72 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3i33 h LYS 72 Cb 0.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 3i33 h LYS 72 CO 0.00 0.04 0.00 0.00 -2.27 0.00 0.00 179.45 177.22 3i33 h ARG 73 N 0.00 0.00 0.00 1.90 3.08 -1.48 -3.27 114.38 114.60 3i33 h ARG 73 Ca -0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 3i33 h ARG 73 Cb 0.17 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 3i33 h ARG 73 CO 0.01 0.00 -2.03 1.28 -1.07 0.00 0.00 179.97 178.16 3i33 n LEU 74 N -2.81 0.00 -4.72 3.04 4.77 -0.35 -4.83 117.00 112.11 3i33 n LEU 74 Ca 0.03 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.59 3i33 n LEU 74 Cb 0.40 0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 41.62 3i33 n LEU 74 CO 0.29 0.16 1.25 -0.51 -1.33 0.00 0.00 177.39 177.25 3i33 s ILE 75 N -3.04 2.60 0.00 -0.08 2.07 -0.59 -1.60 121.20 120.55 3i33 s ILE 75 Ca -0.08 0.41 0.00 0.00 -1.41 0.00 0.00 60.65 59.57 3i33 s ILE 75 Cb 0.10 -3.26 0.00 0.00 0.13 0.00 0.00 42.46 39.43 3i33 s ILE 75 CO 0.79 0.03 0.00 0.61 -1.91 0.00 0.00 174.94 174.47 3i33 n GLY 76 N 3.79 0.33 3.93 1.50 0.00 -1.26 -4.57 105.19 108.90 3i33 n GLY 76 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 3i33 n GLY 76 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i33 s ARG 77 N -0.74 2.74 0.06 1.61 0.52 -0.63 -4.21 118.95 118.31 3i33 s ARG 77 Ca 0.00 -1.33 0.02 0.00 -0.52 0.00 0.00 55.73 53.89 3i33 s ARG 77 Cb 0.00 -2.58 -0.04 0.00 0.52 0.00 0.00 34.95 32.85 3i33 s ARG 77 CO 0.00 -0.14 0.13 0.15 0.02 0.00 0.00 175.30 175.45 3i33 s LYS 78 N -4.19 3.11 0.29 3.54 1.02 -1.26 -4.38 119.74 117.86 3i33 s LYS 78 Ca 0.49 -0.58 0.03 0.00 0.02 0.00 0.00 55.97 55.93 3i33 s LYS 78 Cb -0.07 -2.86 0.63 0.00 -0.52 0.00 0.00 37.83 35.02 3i33 s LYS 78 CO 0.30 0.59 1.80 0.35 -0.92 0.00 0.00 175.35 177.47 3i33 h PHE 79 N 3.30 1.06 -0.00 3.18 3.57 -1.38 -1.75 116.94 124.92 3i33 h PHE 79 Ca -0.46 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.07 3i33 h PHE 79 Cb 1.16 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 39.58 3i33 h PHE 79 CO 0.61 0.32 -0.02 0.39 -2.23 0.00 0.00 178.31 177.38 3i33 n GLU 80 N -4.72 0.77 -1.75 1.11 -0.58 -1.26 -4.24 120.64 109.96 3i33 n GLU 80 Ca 0.21 -0.09 -0.42 0.00 -0.42 0.00 0.00 57.16 56.44 3i33 n GLU 80 Cb 0.46 -1.50 -0.00 0.00 -0.57 0.00 0.00 31.44 29.83 3i33 n GLU 80 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3i33 n ASP 81 N -1.04 3.57 -0.24 1.62 8.00 -0.66 -4.83 116.55 122.97 3i33 n ASP 81 Ca 0.18 1.21 0.06 0.00 0.71 0.00 0.00 54.79 56.96 3i33 n ASP 81 Cb 0.20 -1.58 0.31 0.00 -0.02 0.00 0.00 41.12 40.03 3i33 n ASP 81 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3i33 h ALA 82 N 3.17 1.65 -0.56 2.24 0.00 -1.90 -1.43 119.26 122.44 3i33 h ALA 82 Ca -0.49 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.34 3i33 h ALA 82 Cb 1.25 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 3i33 h ALA 82 CO 0.66 0.20 0.11 1.79 0.00 0.00 0.00 179.25 182.02 3i33 h THR 83 N 0.85 1.25 -0.07 0.00 1.35 -1.95 -1.01 112.91 113.33 3i33 h THR 83 Ca 0.36 -0.93 -0.01 0.00 -0.55 0.00 0.00 66.41 65.29 3i33 h THR 83 Cb 0.31 0.77 -0.00 0.00 -1.73 0.00 0.00 68.15 67.50 3i33 h THR 83 CO -0.14 0.34 0.02 0.58 -0.25 0.00 0.00 175.52 176.07 3i33 h VAL 84 N 0.81 1.19 -0.68 6.82 2.07 -1.62 -0.43 116.25 124.41 3i33 h VAL 84 Ca 0.17 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 3i33 h VAL 84 Cb 0.38 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 3i33 h VAL 84 CO 0.01 0.16 0.41 1.56 0.02 0.00 0.00 177.57 179.73 3i33 h GLN 85 N -0.10 0.91 -0.08 1.57 1.08 -1.21 -0.90 115.11 116.38 3i33 h GLN 85 Ca 0.02 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.13 3i33 h GLN 85 Cb 0.24 -0.20 -0.00 0.00 -0.05 0.00 0.00 27.48 27.48 3i33 h GLN 85 CO 0.00 0.64 -0.04 1.03 -0.95 0.00 0.00 178.83 179.51 3i33 h SER 86 N 0.93 0.17 -0.42 1.46 0.87 -1.04 -3.25 113.55 112.26 3i33 h SER 86 Ca 0.24 -0.42 -0.03 0.00 -1.23 0.00 0.00 61.79 60.35 3i33 h SER 86 Cb -0.04 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 3i33 h SER 86 CO -0.05 0.55 0.15 0.44 -0.53 0.00 0.00 176.83 177.40 3i33 h ASP 87 N -0.22 0.64 -0.48 6.23 3.32 -0.73 -2.77 116.42 122.42 3i33 h ASP 87 Ca 0.02 -0.09 0.09 0.00 0.02 0.00 0.00 57.03 57.06 3i33 h ASP 87 Cb 0.49 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 3i33 h ASP 87 CO 0.01 0.61 0.33 0.24 -1.72 0.00 0.00 179.24 178.71 3i33 h MET 88 N 0.69 0.28 0.00 3.56 2.86 -1.21 -0.78 114.93 120.34 3i33 h MET 88 Ca 0.16 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 3i33 h MET 88 Cb 0.20 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.80 3i33 h MET 88 CO -0.01 0.18 0.00 0.87 1.06 0.00 0.00 176.91 179.02 3i33 h LYS 89 N 0.29 0.00 -0.06 1.72 1.57 -1.57 -2.97 116.57 115.54 3i33 h LYS 89 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 3i33 h LYS 89 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 3i33 h LYS 89 CO -0.05 0.00 0.00 0.72 -0.57 0.00 0.00 179.45 179.55 3i33 n HIS 90 N -2.38 0.06 -4.07 -1.35 8.25 -0.30 -5.00 115.22 110.44 3i33 n HIS 90 Ca 0.01 -0.06 -0.34 0.00 -0.26 0.00 0.00 57.72 57.08 3i33 n HIS 90 Cb 0.19 -0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.23 3i33 n HIS 90 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 3i33 s TRP 91 N -1.07 3.35 -0.63 4.41 0.51 -1.12 -5.01 118.94 119.38 3i33 s TRP 91 Ca 0.17 0.26 0.25 0.00 -2.12 0.00 0.00 56.10 54.66 3i33 s TRP 91 Cb 0.11 -1.78 0.61 0.00 -0.81 0.00 0.00 33.47 31.61 3i33 s TRP 91 CO 0.16 0.58 1.66 -1.00 -0.51 0.00 0.00 176.95 177.84 3i33 h PRO 92 N 4.21 0.00 -6.52 4.98 0.13 -1.88 -3.46 132.00 129.46 3i33 h PRO 92 Ca -0.50 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.16 3i33 h PRO 92 Cb 1.19 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.33 3i33 h PRO 92 CO 0.62 0.00 -0.19 -0.59 -0.23 0.00 0.00 178.00 177.61 3i33 s PHE 93 N -3.14 3.49 0.05 1.56 -0.12 -1.26 -4.50 117.98 114.06 3i33 s PHE 93 Ca 0.09 0.34 -0.19 0.00 -0.05 0.00 0.00 56.93 57.13 3i33 s PHE 93 Cb 0.10 -1.90 -0.06 0.00 -0.63 0.00 0.00 43.02 40.53 3i33 s PHE 93 CO 0.64 0.11 0.54 0.50 -0.05 0.00 0.00 175.22 176.96 3i33 s ARG 94 N -4.32 4.16 -0.08 1.99 3.52 -1.26 -5.00 118.95 117.96 3i33 s ARG 94 Ca 0.40 0.67 0.05 0.00 -0.13 0.00 0.00 55.73 56.72 3i33 s ARG 94 Cb -0.10 -3.25 -0.00 0.00 -1.56 0.00 0.00 34.95 30.04 3i33 s ARG 94 CO 0.36 0.61 -0.23 0.08 -0.81 0.00 0.00 175.30 175.32 3i33 s VAL 95 N -0.98 1.93 0.36 7.11 1.01 -1.26 -0.84 120.40 127.73 3i33 s VAL 95 Ca 0.28 -0.97 0.05 0.00 0.00 0.00 0.00 61.98 61.34 3i33 s VAL 95 Cb -0.19 -1.66 -0.06 0.00 0.00 0.00 0.00 36.38 34.47 3i33 s VAL 95 CO 0.18 0.53 0.05 0.68 0.00 0.00 0.00 175.10 176.54 3i33 s VAL 96 N 0.18 1.41 -0.15 2.92 -7.23 0.30 -4.93 120.40 112.89 3i33 s VAL 96 Ca -0.12 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 57.99 3i33 s VAL 96 Cb -0.16 -2.81 -0.04 0.00 0.56 0.00 0.00 36.38 33.94 3i33 s VAL 96 CO 0.06 0.00 0.04 -0.55 -0.31 0.00 0.00 175.10 174.35 3i33 s SER 97 N -3.58 5.51 -0.19 4.85 0.15 -1.26 -0.42 113.70 118.76 3i33 s SER 97 Ca 0.34 0.10 -0.02 0.00 0.70 0.00 0.00 55.95 57.07 3i33 s SER 97 Cb 0.08 -1.85 0.06 0.00 -1.71 0.00 0.00 66.02 62.60 3i33 s SER 97 CO 0.16 0.24 0.02 -0.70 1.20 0.00 0.00 173.24 174.15 3i33 s GLU 98 N -0.02 0.80 -1.46 5.44 2.12 0.13 -4.81 118.70 120.89 3i33 s GLU 98 Ca 0.05 -0.44 -0.10 0.00 0.36 0.00 0.00 54.97 54.84 3i33 s GLU 98 Cb -0.12 -2.06 0.04 0.00 0.26 0.00 0.00 34.13 32.25 3i33 s GLU 98 CO 0.01 -0.60 0.91 0.41 -0.54 0.00 0.00 175.26 175.45 3i33 n GLY 99 N 5.01 -0.52 2.70 -1.50 0.00 -1.26 -1.76 105.19 107.86 3i33 n GLY 99 Ca -0.09 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3i33 n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i33 n GLY 100 N -1.70 2.27 3.89 -0.02 0.00 -1.26 -5.02 105.19 103.36 3i33 n GLY 100 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 3i33 n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i33 s LYS 101 N -0.10 3.44 0.41 1.61 1.02 -0.72 -1.08 119.74 124.32 3i33 s LYS 101 Ca 0.00 -0.23 -0.24 0.00 0.02 0.00 0.00 55.97 55.52 3i33 s LYS 101 Cb 0.00 -3.14 -0.08 0.00 -0.52 0.00 0.00 37.83 34.09 3i33 s LYS 101 CO 0.00 0.73 1.14 -1.25 -0.92 0.00 0.00 175.35 175.04 3i33 s PRO 102 N -1.50 4.01 0.01 -1.68 0.04 -1.26 -0.70 135.00 133.92 3i33 s PRO 102 Ca 0.21 1.74 0.01 0.00 0.04 0.00 0.00 61.00 63.00 3i33 s PRO 102 Cb -0.12 -2.58 -0.01 0.00 0.04 0.00 0.00 34.50 31.83 3i33 s PRO 102 CO 0.12 -0.33 -0.03 0.15 0.04 0.00 0.00 177.00 176.95 3i33 s LYS 103 N -2.44 0.27 0.30 4.56 1.02 0.44 -4.22 119.74 119.67 3i33 s LYS 103 Ca 0.59 -0.24 -0.23 0.00 0.02 0.00 0.00 55.97 56.11 3i33 s LYS 103 Cb -0.28 -0.19 -0.09 0.00 -0.52 0.00 0.00 37.83 36.75 3i33 s LYS 103 CO 0.35 0.04 0.86 0.14 -0.92 0.00 0.00 175.35 175.82 3i33 s VAL 104 N -0.40 4.38 -0.13 3.17 -7.23 -0.13 -0.53 120.40 119.52 3i33 s VAL 104 Ca -0.02 1.55 0.01 0.00 -1.81 0.00 0.00 61.98 61.71 3i33 s VAL 104 Cb -0.03 -3.89 -0.00 0.00 0.56 0.00 0.00 36.38 33.02 3i33 s VAL 104 CO -0.00 0.09 -0.18 -1.58 -0.31 0.00 0.00 175.10 173.12 3i33 s GLN 105 N -2.22 3.17 0.14 4.82 0.74 -0.02 -1.04 119.66 125.25 3i33 s GLN 105 Ca 0.49 -0.79 0.01 0.00 0.05 0.00 0.00 55.36 55.12 3i33 s GLN 105 Cb -0.16 -2.51 -0.04 0.00 1.10 0.00 0.00 33.01 31.39 3i33 s GLN 105 CO 0.21 0.09 0.01 0.14 -0.55 0.00 0.00 175.29 175.18 3i33 s VAL 106 N 0.62 0.50 -0.20 1.34 -7.23 -0.19 -4.02 120.40 111.21 3i33 s VAL 106 Ca -0.10 -1.94 -0.14 0.00 -1.81 0.00 0.00 61.98 57.99 3i33 s VAL 106 Cb -0.16 -2.00 -0.04 0.00 0.56 0.00 0.00 36.38 34.73 3i33 s VAL 106 CO 0.03 -0.56 0.30 -1.61 -0.31 0.00 0.00 175.10 172.95 3i33 s GLU 107 N -3.94 4.17 -0.09 4.82 0.41 -1.26 -0.60 118.70 122.21 3i33 s GLU 107 Ca 0.21 0.03 -0.03 0.00 -0.41 0.00 0.00 54.97 54.77 3i33 s GLU 107 Cb 0.06 -3.50 0.05 0.00 -1.78 0.00 0.00 34.13 28.96 3i33 s GLU 107 CO 0.01 0.07 0.15 -0.47 -0.49 0.00 0.00 175.26 174.53 3i33 s TYR 108 N 0.99 -0.13 -1.33 1.61 5.04 0.30 -4.10 117.35 119.73 3i33 s TYR 108 Ca 0.15 0.48 -0.16 0.00 -2.44 0.00 0.00 57.07 55.09 3i33 s TYR 108 Cb -0.14 -0.33 0.02 0.00 0.35 0.00 0.00 41.96 41.86 3i33 s TYR 108 CO 0.06 -0.30 0.46 1.63 -1.34 0.00 0.00 175.55 176.06 3i33 n LYS 109 N 5.32 -1.18 -0.87 4.97 5.02 0.24 -2.27 118.16 129.40 3i33 n LYS 109 Ca -0.05 0.20 0.00 0.00 -2.02 0.00 0.00 58.31 56.45 3i33 n LYS 109 Cb 0.50 -3.46 0.00 0.00 -0.02 0.00 0.00 35.03 32.05 3i33 n LYS 109 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3i33 n GLY 110 N -2.15 0.73 3.04 0.72 0.00 -1.26 -5.01 105.19 101.27 3i33 n GLY 110 Ca -0.21 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.68 3i33 n GLY 110 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i33 s GLU 111 N -0.13 0.51 -0.18 1.61 2.02 -0.96 -5.11 118.70 116.46 3i33 s GLU 111 Ca 0.00 -0.63 -0.29 0.00 0.02 0.00 0.00 54.97 54.07 3i33 s GLU 111 Cb 0.00 -0.33 -0.01 0.00 0.10 0.00 0.00 34.13 33.89 3i33 s GLU 111 CO 0.00 0.07 1.21 0.99 0.02 0.00 0.00 175.26 177.55 3i33 s THR 112 N -1.08 4.37 0.05 3.63 2.01 -1.26 -0.54 115.64 122.81 3i33 s THR 112 Ca -0.07 1.66 0.09 0.00 0.31 0.00 0.00 61.69 63.67 3i33 s THR 112 Cb -0.08 -4.07 -0.03 0.00 0.01 0.00 0.00 72.50 68.33 3i33 s THR 112 CO 0.00 -0.14 -0.24 -0.54 -0.69 0.00 0.00 174.62 173.02 3i33 s LYS 113 N 3.40 1.88 0.03 4.92 -0.14 0.23 -4.97 119.74 125.09 3i33 s LYS 113 Ca 0.52 -1.08 0.09 0.00 -1.36 0.00 0.00 55.97 54.14 3i33 s LYS 113 Cb -0.20 -2.05 -0.03 0.00 -1.68 0.00 0.00 37.83 33.87 3i33 s LYS 113 CO 0.13 0.52 -0.25 0.95 -0.76 0.00 0.00 175.35 175.94 3i33 s THR 114 N -0.86 2.22 -0.04 2.17 -4.23 -1.26 -1.03 115.64 112.62 3i33 s THR 114 Ca 0.13 -1.30 0.02 0.00 -1.18 0.00 0.00 61.69 59.36 3i33 s THR 114 Cb -0.10 -1.85 0.01 0.00 1.34 0.00 0.00 72.50 71.89 3i33 s THR 114 CO 0.03 0.41 -0.08 -0.36 -0.54 0.00 0.00 174.62 174.08 3i33 s PHE 115 N -0.78 0.99 0.71 3.99 0.40 -0.21 -4.95 117.98 118.13 3i33 s PHE 115 Ca 0.12 -0.28 -0.15 0.00 -0.60 0.00 0.00 56.93 56.01 3i33 s PHE 115 Cb -0.10 -0.75 0.03 0.00 0.51 0.00 0.00 43.02 42.71 3i33 s PHE 115 CO 0.02 -0.16 1.19 -0.06 0.70 0.00 0.00 175.22 176.91 3i33 s PHE 116 N 0.47 2.18 0.29 0.36 0.08 -1.26 -0.96 117.98 119.14 3i33 s PHE 116 Ca -0.08 1.59 0.00 0.00 0.12 0.00 0.00 56.93 58.56 3i33 s PHE 116 Cb -0.12 -3.41 0.52 0.00 -0.57 0.00 0.00 43.02 39.44 3i33 s PHE 116 CO 0.01 -2.40 1.87 -1.35 -0.10 0.00 0.00 175.22 173.26 3i33 h PRO 117 N -0.17 1.02 0.00 0.24 0.11 -1.91 -0.13 132.00 131.16 3i33 h PRO 117 Ca -0.48 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.54 3i33 h PRO 117 Cb 1.29 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 3i33 h PRO 117 CO 0.51 0.67 -0.18 1.05 -0.21 0.00 0.00 178.00 179.84 3i33 h GLU 118 N 1.05 0.00 -0.23 1.05 9.09 -1.91 0.46 114.58 124.09 3i33 h GLU 118 Ca 0.45 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.76 3i33 h GLU 118 Cb 0.32 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.42 3i33 h GLU 118 CO -0.20 0.18 -0.22 0.93 0.05 0.00 0.00 179.01 179.75 3i33 h GLU 119 N 0.00 0.56 -0.26 1.06 5.08 -1.39 0.93 114.58 120.56 3i33 h GLU 119 Ca -0.00 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.06 3i33 h GLU 119 Cb 0.50 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 3i33 h GLU 119 CO 0.02 0.88 0.14 0.82 -1.00 0.00 0.00 179.01 179.87 3i33 h ILE 120 N 0.26 1.13 -0.13 3.13 1.08 -0.95 -1.58 117.51 120.46 3i33 h ILE 120 Ca 0.04 -0.37 -0.07 0.00 -0.39 0.00 0.00 64.86 64.07 3i33 h ILE 120 Cb 0.77 0.90 -0.01 0.00 -3.07 0.00 0.00 36.82 35.40 3i33 h ILE 120 CO 0.06 0.13 -0.22 0.28 -0.69 0.00 0.00 178.15 177.71 3i33 h SER 121 N 0.30 0.21 -0.55 1.72 0.02 -0.93 -1.28 113.55 113.04 3i33 h SER 121 Ca 0.09 -0.06 -0.04 0.00 -0.84 0.00 0.00 61.79 60.95 3i33 h SER 121 Cb 0.09 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.55 3i33 h SER 121 CO -0.01 0.45 0.21 -1.28 -1.14 0.00 0.00 176.83 175.05 3i33 h SER 122 N 0.20 0.81 -0.85 3.07 0.87 -0.46 0.11 113.55 117.29 3i33 h SER 122 Ca 0.03 -0.12 -0.03 0.00 -1.23 0.00 0.00 61.79 60.45 3i33 h SER 122 Cb 0.51 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 62.22 3i33 h SER 122 CO 0.03 0.75 0.43 0.24 -0.53 0.00 0.00 176.83 177.75 3i33 h MET 123 N 0.86 1.21 -0.27 2.24 2.07 -0.25 0.21 114.93 121.00 3i33 h MET 123 Ca 0.20 -0.16 -0.06 0.00 -2.07 0.00 0.00 59.70 57.60 3i33 h MET 123 Cb 0.21 -0.23 -0.01 0.00 -1.87 0.00 0.00 31.60 29.71 3i33 h MET 123 CO -0.01 0.91 -0.08 0.28 1.07 0.00 0.00 176.91 179.08 3i33 h VAL 124 N 1.21 1.29 -0.92 -2.22 2.07 -1.01 -1.97 116.25 114.69 3i33 h VAL 124 Ca 0.30 -1.12 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 3i33 h VAL 124 Cb 0.08 1.45 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 3i33 h VAL 124 CO -0.04 0.35 0.53 -0.07 0.02 0.00 0.00 177.57 178.36 3i33 h LEU 125 N 0.29 1.13 -0.78 2.57 3.38 -0.47 -0.65 115.31 120.79 3i33 h LEU 125 Ca 0.07 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3i33 h LEU 125 Cb 0.56 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 3i33 h LEU 125 CO 0.03 0.88 0.42 0.74 0.09 0.00 0.00 178.44 180.60 3i33 h THR 126 N 1.28 1.24 -0.56 0.22 2.02 -0.49 0.14 112.91 116.76 3i33 h THR 126 Ca 0.33 -0.60 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 3i33 h THR 126 Cb -0.02 0.21 -0.03 0.00 -1.74 0.00 0.00 68.15 66.58 3i33 h THR 126 CO -0.06 0.26 0.34 0.50 0.37 0.00 0.00 175.52 176.94 3i33 h LYS 127 N 1.08 0.76 -0.52 6.66 1.63 -0.80 0.12 116.57 125.51 3i33 h LYS 127 Ca 0.27 -0.07 -0.08 0.00 -0.85 0.00 0.00 60.65 59.93 3i33 h LYS 127 Cb 0.05 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 31.50 3i33 h LYS 127 CO -0.04 0.55 0.01 0.52 -3.45 0.00 0.00 179.45 177.03 3i33 h MET 128 N 0.76 0.88 -0.54 1.90 2.86 -0.57 -0.15 114.93 120.07 3i33 h MET 128 Ca 0.20 -0.25 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 3i33 h MET 128 Cb -0.02 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 3i33 h MET 128 CO -0.04 0.87 0.26 -0.22 1.06 0.00 0.00 176.91 178.84 3i33 h LYS 129 N 0.81 0.78 -0.58 1.72 3.64 -0.42 -1.33 116.57 121.19 3i33 h LYS 129 Ca 0.16 -0.11 -0.08 0.00 -1.27 0.00 0.00 60.65 59.35 3i33 h LYS 129 Cb 0.48 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 3i33 h LYS 129 CO 0.02 0.64 0.06 0.93 -2.27 0.00 0.00 179.45 178.83 3i33 h GLU 130 N 0.72 0.96 -0.47 1.90 5.08 -0.39 0.11 114.58 122.49 3i33 h GLU 130 Ca 0.19 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3i33 h GLU 130 Cb 0.12 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 3i33 h GLU 130 CO -0.02 0.91 0.31 0.82 -1.00 0.00 0.00 179.01 180.03 3i33 h ILE 131 N 0.90 1.12 -0.36 3.13 2.04 -0.89 -0.14 117.51 123.31 3i33 h ILE 131 Ca 0.18 -0.23 -0.12 0.00 1.00 0.00 0.00 64.86 65.69 3i33 h ILE 131 Cb 0.44 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.93 3i33 h ILE 131 CO 0.01 0.12 -0.25 0.00 0.00 0.00 0.00 178.15 178.03 3i33 h ALA 132 N 1.17 0.89 -0.48 1.87 0.00 -0.76 -1.83 119.26 120.11 3i33 h ALA 132 Ca 0.17 -0.38 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 3i33 h ALA 132 Cb -0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3i33 h ALA 132 CO -0.04 0.63 -0.21 0.93 0.00 0.00 0.00 179.25 180.55 3i33 h GLU 133 N 0.63 0.99 -0.99 0.00 5.08 -0.53 0.54 114.58 120.30 3i33 h GLU 133 Ca 0.08 -0.42 0.02 0.00 -1.00 0.00 0.00 59.36 58.04 3i33 h GLU 133 Cb 0.75 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.92 3i33 h GLU 133 CO 0.06 1.10 0.65 0.00 -1.00 0.00 0.00 179.01 179.82 3i33 h ALA 134 N 0.89 1.32 -0.19 3.43 0.00 -0.86 0.94 119.26 124.79 3i33 h ALA 134 Ca 0.11 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 3i33 h ALA 134 Cb 0.79 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 3i33 h ALA 134 CO 0.07 0.62 -0.27 -0.92 0.00 0.00 0.00 179.25 178.74 3i33 h TYR 135 N 1.31 0.63 0.02 0.00 5.03 -1.01 -3.36 116.97 119.59 3i33 h TYR 135 Ca 0.38 -0.21 -0.32 0.00 2.58 0.00 0.00 58.73 61.16 3i33 h TYR 135 Cb -0.10 -0.12 -0.05 0.00 1.55 0.00 0.00 36.73 38.01 3i33 h TYR 135 CO -0.00 0.91 -1.86 1.28 -1.32 0.00 0.00 178.16 177.17 3i33 n LEU 136 N -4.38 1.16 0.00 2.82 4.77 0.15 -5.09 117.00 116.43 3i33 n LEU 136 Ca -0.06 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 3i33 n LEU 136 Cb 0.45 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 3i33 n LEU 136 CO 0.43 0.50 0.00 0.61 -1.33 0.00 0.00 177.39 177.60 3i33 n GLY 137 N 1.68 -1.72 7.00 -0.72 0.00 0.32 -5.06 105.19 106.68 3i33 n GLY 137 Ca -0.22 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.54 3i33 n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i33 n GLY 138 N -0.21 -1.28 3.52 -0.02 0.00 -1.26 -4.89 105.19 101.05 3i33 n GLY 138 Ca 0.00 -1.27 -0.34 0.00 0.00 0.00 0.00 46.02 44.42 3i33 n GLY 138 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i33 s LYS 139 N 0.00 3.20 0.16 1.61 -0.14 -1.26 -4.72 119.74 118.59 3i33 s LYS 139 Ca 0.00 -0.55 -0.28 0.00 -1.36 0.00 0.00 55.97 53.78 3i33 s LYS 139 Cb 0.00 -2.73 -0.07 0.00 -1.68 0.00 0.00 37.83 33.35 3i33 s LYS 139 CO 0.00 0.44 0.87 0.08 -0.76 0.00 0.00 175.35 175.98 3i33 s VAL 140 N -0.20 4.35 -0.18 3.17 1.01 -1.26 -4.98 120.40 122.30 3i33 s VAL 140 Ca 0.03 1.91 -0.03 0.00 0.00 0.00 0.00 61.98 63.88 3i33 s VAL 140 Cb -0.13 -4.24 -0.10 0.00 0.00 0.00 0.00 36.38 31.91 3i33 s VAL 140 CO 0.03 0.45 -0.19 1.41 0.00 0.00 0.00 175.10 176.79 3i33 n HIS 141 N 2.00 0.00 -4.22 5.22 8.25 -1.26 -4.93 115.22 120.28 3i33 n HIS 141 Ca -0.02 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.26 3i33 n HIS 141 Cb 0.48 -0.66 -0.12 0.00 1.12 0.00 0.00 29.99 30.81 3i33 n HIS 141 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 3i33 s SER 142 N -6.12 1.55 -0.03 0.41 0.01 -1.26 -0.79 113.70 107.48 3i33 s SER 142 Ca -0.24 -0.54 -0.14 0.00 1.31 0.00 0.00 55.95 56.33 3i33 s SER 142 Cb 0.08 -0.06 0.02 0.00 0.21 0.00 0.00 66.02 66.27 3i33 s SER 142 CO 0.37 -0.05 0.31 0.00 0.41 0.00 0.00 173.24 174.28 3i33 s ALA 143 N -1.11 -0.78 -0.15 1.44 0.00 -0.27 -1.66 121.76 119.23 3i33 s ALA 143 Ca -0.02 0.40 -0.13 0.00 0.00 0.00 0.00 51.96 52.22 3i33 s ALA 143 Cb -0.09 -0.01 -0.05 0.00 0.00 0.00 0.00 23.12 22.97 3i33 s ALA 143 CO 0.02 -0.25 0.28 0.08 0.00 0.00 0.00 175.76 175.89 3i33 s VAL 144 N -1.13 5.31 -0.04 0.00 1.01 -0.36 -0.38 120.40 124.81 3i33 s VAL 144 Ca -0.12 0.51 0.06 0.00 0.00 0.00 0.00 61.98 62.44 3i33 s VAL 144 Cb -0.05 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 3i33 s VAL 144 CO 0.04 0.42 -0.21 -0.63 0.00 0.00 0.00 175.10 174.72 3i33 s ILE 145 N 0.26 2.47 0.17 2.22 1.01 -0.98 -0.62 121.20 125.73 3i33 s ILE 145 Ca 0.16 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 59.90 3i33 s ILE 145 Cb -0.13 -1.92 -0.03 0.00 0.01 0.00 0.00 42.46 40.39 3i33 s ILE 145 CO 0.04 0.58 0.27 0.42 0.00 0.00 0.00 174.94 176.25 3i33 s THR 146 N -0.57 5.18 0.10 2.92 -4.23 -0.89 -2.01 115.64 116.15 3i33 s THR 146 Ca 0.08 -0.80 -0.05 0.00 -1.18 0.00 0.00 61.69 59.75 3i33 s THR 146 Cb -0.11 -3.69 -0.02 0.00 1.34 0.00 0.00 72.50 70.02 3i33 s THR 146 CO 0.00 -0.13 0.11 0.68 -0.54 0.00 0.00 174.62 174.75 3i33 s VAL 147 N -1.78 0.14 0.59 2.29 -7.23 -0.41 -4.37 120.40 109.63 3i33 s VAL 147 Ca 0.34 -1.56 -0.19 0.00 -1.81 0.00 0.00 61.98 58.76 3i33 s VAL 147 Cb -0.11 -1.63 -0.03 0.00 0.56 0.00 0.00 36.38 35.17 3i33 s VAL 147 CO 0.28 -0.65 1.26 -2.84 -0.31 0.00 0.00 175.10 172.83 3i33 s PRO 148 N -3.94 2.92 0.51 4.82 0.02 -1.26 -0.19 135.00 137.88 3i33 s PRO 148 Ca 0.12 1.97 0.18 0.00 0.02 0.00 0.00 61.00 63.29 3i33 s PRO 148 Cb 0.06 -1.99 1.29 0.00 0.02 0.00 0.00 34.50 33.88 3i33 s PRO 148 CO -0.06 -1.28 2.12 0.00 -0.33 0.00 0.00 177.00 177.44 3i33 h ALA 149 N 0.95 1.79 -0.00 -1.55 0.00 -1.94 -1.38 119.26 117.14 3i33 h ALA 149 Ca -0.51 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.35 3i33 h ALA 149 Cb 1.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3i33 h ALA 149 CO 0.55 0.08 -0.04 2.48 0.00 0.00 0.00 179.25 182.31 3i33 n TYR 150 N -4.31 0.00 -1.72 0.00 4.11 -1.26 -4.89 117.16 109.08 3i33 n TYR 150 Ca -0.03 0.00 -0.43 0.00 -0.00 0.00 0.00 57.90 57.45 3i33 n TYR 150 Cb 0.14 -0.27 -0.02 0.00 -0.00 0.00 0.00 39.34 39.19 3i33 n TYR 150 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.86 178.05 3i33 n PHE 151 N -1.23 2.61 -2.30 -3.48 3.01 -0.52 -5.00 117.46 110.55 3i33 n PHE 151 Ca 0.14 0.33 -0.26 0.00 1.01 0.00 0.00 57.45 58.66 3i33 n PHE 151 Cb 0.26 -2.54 0.16 0.00 -0.01 0.00 0.00 39.48 37.35 3i33 n PHE 151 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 3i33 n ASN 152 N 2.05 0.79 0.04 4.37 0.23 -1.26 -4.84 115.26 116.64 3i33 n ASN 152 Ca 0.09 -1.85 -0.00 0.00 -0.53 0.00 0.00 54.58 52.29 3i33 n ASN 152 Cb 0.35 -0.83 0.30 0.00 -2.08 0.00 0.00 39.78 37.52 3i33 n ASN 152 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 3i33 h ASP 153 N -1.15 0.41 -0.59 0.53 3.32 -1.98 -0.96 116.42 116.00 3i33 h ASP 153 Ca -0.38 -0.09 -0.04 0.00 0.02 0.00 0.00 57.03 56.54 3i33 h ASP 153 Cb 1.23 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.64 3i33 h ASP 153 CO 0.34 0.55 0.23 -1.28 -1.72 0.00 0.00 179.24 177.36 3i33 h SER 154 N 0.41 0.82 -0.38 6.45 0.87 -1.94 0.12 113.55 119.90 3i33 h SER 154 Ca 0.08 -0.17 -0.12 0.00 -1.23 0.00 0.00 61.79 60.35 3i33 h SER 154 Cb 0.41 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.15 3i33 h SER 154 CO 0.02 0.77 -0.24 1.56 -0.53 0.00 0.00 176.83 178.41 3i33 h GLN 155 N 0.82 0.83 -0.43 2.24 4.20 -1.65 -0.67 115.11 120.44 3i33 h GLN 155 Ca 0.20 -0.39 -0.03 0.00 0.06 0.00 0.00 58.65 58.49 3i33 h GLN 155 Cb 0.21 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 3i33 h GLN 155 CO -0.02 1.03 0.17 0.00 -0.67 0.00 0.00 178.83 179.34 3i33 h ARG 156 N 0.63 0.65 -0.56 1.46 3.08 -1.07 -1.92 114.38 116.64 3i33 h ARG 156 Ca 0.08 -0.12 -0.10 0.00 0.07 0.00 0.00 59.98 59.90 3i33 h ARG 156 Cb 0.81 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.74 3i33 h ARG 156 CO 0.07 0.60 -0.05 0.37 -1.07 0.00 0.00 179.97 179.89 3i33 h GLN 157 N 0.55 1.02 -0.29 0.04 5.75 -0.66 -0.49 115.11 121.03 3i33 h GLN 157 Ca 0.14 -0.35 -0.05 0.00 -0.15 0.00 0.00 58.65 58.24 3i33 h GLN 157 Cb 0.20 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.66 3i33 h GLN 157 CO -0.01 1.04 -0.03 0.00 -2.65 0.00 0.00 178.83 177.18 3i33 h ALA 158 N 0.95 1.41 -0.40 3.38 0.00 -1.06 0.11 119.26 123.65 3i33 h ALA 158 Ca 0.15 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 3i33 h ALA 158 Cb 0.60 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3i33 h ALA 158 CO 0.04 0.41 0.01 1.15 0.00 0.00 0.00 179.25 180.86 3i33 h THR 159 N 0.44 1.26 -0.74 0.00 2.02 -0.93 -1.46 112.91 113.49 3i33 h THR 159 Ca 0.09 -1.00 0.06 0.00 0.77 0.00 0.00 66.41 66.33 3i33 h THR 159 Cb 0.33 1.11 -0.06 0.00 -1.74 0.00 0.00 68.15 67.80 3i33 h THR 159 CO 0.01 0.34 0.44 0.11 0.37 0.00 0.00 175.52 176.79 3i33 h LYS 160 N 0.54 0.78 -0.98 6.66 1.57 -0.54 -1.93 116.57 122.68 3i33 h LYS 160 Ca 0.11 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 3i33 h LYS 160 Cb 0.47 -0.18 -0.05 0.00 0.08 0.00 0.00 32.23 32.55 3i33 h LYS 160 CO 0.02 0.52 0.62 -0.44 -0.57 0.00 0.00 179.45 179.60 3i33 h ASP 161 N 0.80 1.14 -0.76 0.86 3.32 -0.51 0.20 116.42 121.48 3i33 h ASP 161 Ca 0.33 -0.05 0.01 0.00 0.02 0.00 0.00 57.03 57.34 3i33 h ASP 161 Cb 0.17 -0.29 -0.04 0.00 0.22 0.00 0.00 39.33 39.40 3i33 h ASP 161 CO -0.18 0.85 0.50 0.00 -1.72 0.00 0.00 179.24 178.70 3i33 h ALA 162 N 1.35 0.97 -0.80 3.45 0.00 -0.65 -0.51 119.26 123.07 3i33 h ALA 162 Ca 0.35 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 3i33 h ALA 162 Cb -0.12 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.33 3i33 h ALA 162 CO -0.07 0.37 0.45 0.78 0.00 0.00 0.00 179.25 180.78 3i33 h GLY 163 N 1.03 1.19 0.95 0.00 0.00 -0.56 -1.81 103.07 103.85 3i33 h GLY 163 Ca 0.28 -0.53 -0.05 0.00 0.00 0.00 0.00 47.33 47.03 3i33 h GLY 163 CO -0.06 0.51 0.05 -0.84 0.00 0.00 0.00 176.54 176.19 3i33 h THR 164 N 1.11 1.25 -0.92 4.70 2.02 -0.39 -1.45 112.91 119.22 3i33 h THR 164 Ca 0.28 -0.92 0.01 0.00 0.77 0.00 0.00 66.41 66.55 3i33 h THR 164 Cb 0.02 1.04 -0.05 0.00 -1.74 0.00 0.00 68.15 67.42 3i33 h THR 164 CO -0.05 0.32 0.61 0.40 0.37 0.00 0.00 175.52 177.17 3i33 h ILE 165 N 0.55 1.22 0.00 3.11 2.04 -0.96 -1.10 117.51 122.37 3i33 h ILE 165 Ca 0.12 -0.42 -0.04 0.00 1.00 0.00 0.00 64.86 65.51 3i33 h ILE 165 Cb 0.41 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.36 3i33 h ILE 165 CO 0.01 0.23 -0.21 0.74 0.00 0.00 0.00 178.15 178.91 3i33 h THR 166 N 1.24 0.69 0.00 -0.27 2.02 -0.99 -3.47 112.91 112.12 3i33 h THR 166 Ca 0.34 -0.91 0.00 0.00 0.77 0.00 0.00 66.41 66.61 3i33 h THR 166 Cb -0.12 1.58 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 3i33 h THR 166 CO -0.08 0.21 0.00 0.61 0.37 0.00 0.00 175.52 176.63 3i33 n GLY 167 N -0.31 1.36 3.85 2.16 0.00 -0.42 -4.94 105.19 106.89 3i33 n GLY 167 Ca -0.01 -0.28 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 3i33 n GLY 167 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i33 s LEU 168 N 0.00 4.20 -0.57 0.99 1.43 -0.68 -4.91 118.68 119.14 3i33 s LEU 168 Ca 0.00 0.34 -0.28 0.00 -1.03 0.00 0.00 54.13 53.16 3i33 s LEU 168 Cb 0.00 -2.24 0.03 0.00 0.03 0.00 0.00 46.19 44.00 3i33 s LEU 168 CO 0.00 0.34 1.26 0.21 0.23 0.00 0.00 176.35 178.38 3i33 s ASN 169 N -1.42 6.36 -0.66 2.29 2.47 0.03 -4.34 114.94 119.68 3i33 s ASN 169 Ca 0.20 0.17 -0.27 0.00 0.42 0.00 0.00 52.86 53.37 3i33 s ASN 169 Cb -0.12 -2.55 0.03 0.00 -1.45 0.00 0.00 41.25 37.16 3i33 s ASN 169 CO 0.10 -1.54 1.22 -0.69 -3.72 0.00 0.00 177.10 172.46 3i33 s VAL 170 N 5.25 3.90 0.17 -5.21 1.01 -1.26 -1.11 120.40 123.15 3i33 s VAL 170 Ca 0.46 0.58 -0.13 0.00 0.00 0.00 0.00 61.98 62.89 3i33 s VAL 170 Cb -0.08 -4.81 0.07 0.00 0.00 0.00 0.00 36.38 31.55 3i33 s VAL 170 CO 0.25 -1.60 1.76 -0.07 0.00 0.00 0.00 175.10 175.44 3i33 h LEU 171 N 12.42 0.74 -7.00 3.92 3.38 -1.10 -3.45 115.31 124.21 3i33 h LEU 171 Ca -0.27 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.55 3i33 h LEU 171 Cb 1.05 -0.19 -0.20 0.00 0.09 0.00 0.00 40.66 41.41 3i33 h LEU 171 CO 1.23 0.66 0.25 -0.60 0.09 0.00 0.00 178.44 180.06 3i33 s ARG 172 N -5.73 0.92 -0.32 1.13 3.52 -1.26 -5.04 118.95 112.17 3i33 s ARG 172 Ca -0.13 0.39 -0.12 0.00 -0.13 0.00 0.00 55.73 55.74 3i33 s ARG 172 Cb 0.12 0.44 -0.03 0.00 -1.56 0.00 0.00 34.95 33.92 3i33 s ARG 172 CO 0.78 -0.25 0.23 0.42 -0.81 0.00 0.00 175.30 175.66 3i33 s ILE 173 N -0.83 5.29 0.22 4.11 -1.09 -1.26 -2.32 121.20 125.33 3i33 s ILE 173 Ca -0.07 -0.10 0.11 0.00 -2.23 0.00 0.00 60.65 58.36 3i33 s ILE 173 Cb -0.01 -3.66 -0.05 0.00 -1.58 0.00 0.00 42.46 37.16 3i33 s ILE 173 CO 0.06 0.07 -0.19 0.27 -1.23 0.00 0.00 174.94 173.92 3i33 s ILE 174 N 1.73 2.58 0.30 2.92 -4.36 -0.85 -4.98 121.20 118.55 3i33 s ILE 174 Ca 0.06 -2.07 -0.28 0.00 -0.26 0.00 0.00 60.65 58.10 3i33 s ILE 174 Cb -0.17 -2.28 -0.09 0.00 1.25 0.00 0.00 42.46 41.16 3i33 s ILE 174 CO 0.11 -0.20 1.09 0.20 0.24 0.00 0.00 174.94 176.37 3i33 s ASN 175 N -2.97 7.18 0.19 4.36 0.01 -1.26 -1.29 114.94 121.16 3i33 s ASN 175 Ca 0.24 2.22 -0.12 0.00 -0.71 0.00 0.00 52.86 54.49 3i33 s ASN 175 Cb -0.07 -2.62 0.23 0.00 0.41 0.00 0.00 41.25 39.20 3i33 s ASN 175 CO 0.13 -0.20 1.70 -0.33 -1.51 0.00 0.00 177.10 176.88 3i33 h GLU 176 N 3.58 0.19 -0.11 -0.60 5.08 -0.88 -0.41 114.58 121.43 3i33 h GLU 176 Ca -0.47 -0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 57.80 3i33 h GLU 176 Cb 1.21 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 3i33 h GLU 176 CO 0.66 0.12 -0.28 -1.00 -1.00 0.00 0.00 179.01 177.51 3i33 h PRO 177 N 0.19 0.21 -0.38 2.33 0.13 -1.93 -1.51 132.00 131.05 3i33 h PRO 177 Ca 0.27 -0.07 -0.07 0.00 -0.87 0.00 0.00 66.00 65.26 3i33 h PRO 177 Cb 0.40 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.50 3i33 h PRO 177 CO -0.39 0.48 -0.04 1.15 -0.23 0.00 0.00 178.00 178.98 3i33 h THR 178 N 0.19 1.27 -0.60 1.56 2.02 -1.75 -1.28 112.91 114.31 3i33 h THR 178 Ca 0.03 -1.07 0.08 0.00 0.77 0.00 0.00 66.41 66.21 3i33 h THR 178 Cb 0.60 1.20 -0.06 0.00 -1.74 0.00 0.00 68.15 68.16 3i33 h THR 178 CO 0.04 0.36 0.27 0.00 0.37 0.00 0.00 175.52 176.56 3i33 h ALA 179 N 0.85 0.78 -0.71 6.16 0.00 -0.74 0.65 119.26 126.26 3i33 h ALA 179 Ca 0.10 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3i33 h ALA 179 Cb 0.53 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 3i33 h ALA 179 CO 0.03 -0.12 0.42 0.00 0.00 0.00 0.00 179.25 179.58 3i33 h ALA 180 N 1.37 0.90 -0.71 0.00 0.00 -1.06 -0.32 119.26 119.45 3i33 h ALA 180 Ca 0.29 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 3i33 h ALA 180 Cb 0.28 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3i33 h ALA 180 CO -0.24 0.38 0.28 0.00 0.00 0.00 0.00 179.25 179.67 3i33 h ALA 181 N 1.22 0.92 -0.90 0.00 0.00 -0.55 -2.49 119.26 117.45 3i33 h ALA 181 Ca 0.25 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3i33 h ALA 181 Cb -0.01 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 3i33 h ALA 181 CO -0.05 0.54 0.50 0.82 0.00 0.00 0.00 179.25 181.06 3i33 h ILE 182 N 1.01 1.26 -0.80 0.00 2.04 -0.52 -1.94 117.51 118.56 3i33 h ILE 182 Ca 0.23 -0.64 0.06 0.00 1.00 0.00 0.00 64.86 65.52 3i33 h ILE 182 Cb 0.22 0.04 -0.05 0.00 -0.74 0.00 0.00 36.82 36.28 3i33 h ILE 182 CO -0.02 0.29 0.52 0.00 0.00 0.00 0.00 178.15 178.94 3i33 h ALA 183 N 1.28 1.62 -0.21 1.87 0.00 -0.62 -0.57 119.26 122.63 3i33 h ALA 183 Ca 0.32 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3i33 h ALA 183 Cb 0.02 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.59 3i33 h ALA 183 CO -0.05 0.26 0.00 0.66 0.00 0.00 0.00 179.25 180.12 3i33 n TYR 184 N -4.48 0.27 -2.31 0.00 4.01 -0.97 -4.92 117.16 108.75 3i33 n TYR 184 Ca 0.12 -0.14 -0.17 0.00 -0.16 0.00 0.00 57.90 57.55 3i33 n TYR 184 Cb 0.21 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.23 3i33 n TYR 184 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3i33 n GLY 185 N 1.11 -0.30 0.14 2.72 0.00 -0.22 -4.87 105.19 103.77 3i33 n GLY 185 Ca 0.15 -0.15 0.13 0.00 0.00 0.00 0.00 46.02 46.14 3i33 n GLY 185 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3i33 h LEU 186 N 0.00 0.00 -0.61 0.99 3.38 -1.61 -1.09 115.31 116.37 3i33 h LEU 186 Ca -0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.56 3i33 h LEU 186 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 3i33 h LEU 186 CO 0.49 0.00 -0.15 -0.90 0.09 0.00 0.00 178.44 177.97 3i33 n ASP 187 N -2.33 1.10 -0.08 -0.43 5.75 -1.26 -3.89 116.55 115.41 3i33 n ASP 187 Ca 0.03 -1.06 0.10 0.00 -0.01 0.00 0.00 54.79 53.85 3i33 n ASP 187 Cb 0.29 0.06 0.13 0.00 -1.03 0.00 0.00 41.12 40.58 3i33 n ASP 187 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3i33 n LYS 188 N -0.42 1.26 -4.26 0.11 4.01 -0.43 -4.29 118.16 114.15 3i33 n LYS 188 Ca 0.15 -2.52 -0.33 0.00 -0.51 0.00 0.00 58.31 55.10 3i33 n LYS 188 Cb 0.34 -1.46 -0.16 0.00 -0.51 0.00 0.00 35.03 33.24 3i33 n LYS 188 CO 0.00 0.00 0.00 -1.59 -1.11 0.00 0.00 177.40 174.70 3i33 s LYS 189 N -2.77 3.08 0.00 1.97 -2.85 -1.13 -5.02 119.74 113.02 3i33 s LYS 189 Ca 0.31 -0.80 0.00 0.00 -1.00 0.00 0.00 55.97 54.48 3i33 s LYS 189 Cb 0.27 -2.61 0.00 0.00 -2.06 0.00 0.00 37.83 33.43 3i33 s LYS 189 CO 0.03 -0.14 0.00 0.41 0.10 0.00 0.00 175.35 175.75 3i33 n GLY 190 N 4.45 -0.07 0.97 0.59 0.00 -1.26 -5.00 105.19 104.88 3i33 n GLY 190 Ca -0.20 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.12 3i33 n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i33 n ALA 192 N -2.39 0.25 -1.63 0.00 0.00 -1.26 -4.95 120.51 110.52 3i33 n ALA 192 Ca 0.00 -0.19 -0.30 0.00 0.00 0.00 0.00 53.44 52.95 3i33 n ALA 192 Cb 0.20 -2.23 0.06 0.00 0.00 0.00 0.00 19.45 17.49 3i33 n ALA 192 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3i33 s GLY 193 N -1.75 1.64 0.00 0.00 0.00 -1.26 -4.98 107.32 100.97 3i33 s GLY 193 Ca 0.76 -0.12 0.00 0.00 0.00 0.00 0.00 44.72 45.36 3i33 s GLY 193 CO 0.48 0.25 0.00 0.61 0.00 0.00 0.00 173.10 174.43 3i33 n GLY 194 N -2.25 0.47 3.63 0.20 0.00 -1.26 -4.99 105.19 100.99 3i33 n GLY 194 Ca 0.07 -1.68 -0.22 0.00 0.00 0.00 0.00 46.02 44.19 3i33 n GLY 194 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i33 n GLU 195 N 0.65 -4.00 -1.13 1.61 1.02 -1.26 -4.92 120.64 112.61 3i33 n GLU 195 Ca 0.00 0.63 0.00 0.00 -0.02 0.00 0.00 57.16 57.78 3i33 n GLU 195 Cb 0.00 -5.11 0.13 0.00 -0.02 0.00 0.00 31.44 26.44 3i33 n GLU 195 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3i33 n LYS 196 N -4.11 1.65 -3.32 3.49 4.76 -1.26 -4.88 118.16 114.49 3i33 n LYS 196 Ca -0.24 -3.23 -0.39 0.00 -2.87 0.00 0.00 58.31 51.59 3i33 n LYS 196 Cb 0.66 -1.43 -0.07 0.00 -1.84 0.00 0.00 35.03 32.34 3i33 n LYS 196 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3i33 s ASN 197 N -3.10 6.45 -0.06 4.39 0.01 -1.26 -1.86 114.94 119.51 3i33 s ASN 197 Ca 0.39 0.53 0.05 0.00 -0.71 0.00 0.00 52.86 53.13 3i33 s ASN 197 Cb 0.38 -2.25 -0.01 0.00 0.41 0.00 0.00 41.25 39.77 3i33 s ASN 197 CO -0.07 -0.16 -0.23 -0.69 -1.51 0.00 0.00 177.10 174.45 3i33 s VAL 198 N 1.67 2.27 -0.19 1.60 1.01 0.06 -1.21 120.40 125.60 3i33 s VAL 198 Ca 0.20 -0.99 -0.05 0.00 0.00 0.00 0.00 61.98 61.15 3i33 s VAL 198 Cb -0.15 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.36 3i33 s VAL 198 CO 0.09 0.57 -0.01 -0.22 0.00 0.00 0.00 175.10 175.52 3i33 s LEU 199 N -0.24 3.21 -0.26 3.92 0.20 0.04 -0.83 118.68 124.71 3i33 s LEU 199 Ca -0.01 -0.21 -0.09 0.00 0.69 0.00 0.00 54.13 54.51 3i33 s LEU 199 Cb -0.13 -1.80 -0.04 0.00 -0.43 0.00 0.00 46.19 43.79 3i33 s LEU 199 CO 0.03 0.08 0.13 -0.63 -0.29 0.00 0.00 176.35 175.66 3i33 s ILE 200 N 0.90 4.80 -0.40 6.68 -1.09 0.49 -0.83 121.20 131.76 3i33 s ILE 200 Ca 0.01 -0.00 -0.06 0.00 -2.23 0.00 0.00 60.65 58.36 3i33 s ILE 200 Cb -0.14 -3.26 0.08 0.00 -1.58 0.00 0.00 42.46 37.56 3i33 s ILE 200 CO 0.02 0.30 0.20 0.12 -1.23 0.00 0.00 174.94 174.35 3i33 s PHE 201 N 1.63 3.41 -0.33 3.97 2.19 -0.19 -1.49 117.98 127.17 3i33 s PHE 201 Ca 0.07 -1.89 0.03 0.00 0.33 0.00 0.00 56.93 55.47 3i33 s PHE 201 Cb -0.15 -2.91 0.09 0.00 -1.31 0.00 0.00 43.02 38.74 3i33 s PHE 201 CO 0.07 -0.88 0.03 0.34 1.83 0.00 0.00 175.22 176.61 3i33 s ASP 202 N 1.88 4.76 -0.30 6.13 -1.08 0.17 -1.13 116.67 127.10 3i33 s ASP 202 Ca 0.03 -1.97 0.01 0.00 -0.52 0.00 0.00 52.55 50.09 3i33 s ASP 202 Cb -0.22 -1.64 0.07 0.00 -1.46 0.00 0.00 42.92 39.67 3i33 s ASP 202 CO -0.01 -0.35 -0.01 -0.22 0.52 0.00 0.00 175.17 175.10 3i33 s LEU 203 N 0.97 4.03 0.00 -1.34 2.96 -0.49 -0.25 118.68 124.56 3i33 s LEU 203 Ca 0.06 -1.53 0.00 0.00 -0.22 0.00 0.00 54.13 52.44 3i33 s LEU 203 Cb -0.20 -1.66 0.00 0.00 0.50 0.00 0.00 46.19 44.84 3i33 s LEU 203 CO -0.07 -0.29 0.00 0.61 -1.32 0.00 0.00 176.35 175.29 3i33 n GLY 204 N 4.50 2.76 0.07 7.98 0.00 -0.50 -1.77 105.19 118.22 3i33 n GLY 204 Ca -0.10 -1.82 -0.08 0.00 0.00 0.00 0.00 46.02 44.02 3i33 n GLY 204 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3i33 h GLY 205 N 0.00 0.02 0.00 -0.02 0.00 -1.91 0.13 103.07 101.28 3i33 h GLY 205 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.27 3i33 h GLY 205 CO 0.00 0.05 -0.68 0.61 0.00 0.00 0.00 176.54 176.52 3i33 n GLY 206 N 1.46 0.00 3.22 4.60 0.00 -1.26 -1.18 105.19 112.04 3i33 n GLY 206 Ca -0.08 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.78 3i33 n GLY 206 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3i33 s THR 207 N -1.52 1.16 -0.14 2.61 -4.23 -1.13 -2.59 115.64 109.80 3i33 s THR 207 Ca 0.00 -1.77 0.01 0.00 -1.18 0.00 0.00 61.69 58.74 3i33 s THR 207 Cb 0.00 -1.55 0.02 0.00 1.34 0.00 0.00 72.50 72.32 3i33 s THR 207 CO 0.00 -0.55 -0.14 0.12 -0.54 0.00 0.00 174.62 173.51 3i33 s PHE 208 N -2.53 2.14 -0.09 3.99 5.36 -0.20 -1.41 117.98 125.24 3i33 s PHE 208 Ca 0.10 -1.18 0.02 0.00 -0.96 0.00 0.00 56.93 54.91 3i33 s PHE 208 Cb -0.02 -1.57 0.01 0.00 -0.34 0.00 0.00 43.02 41.10 3i33 s PHE 208 CO 0.01 -0.64 -0.13 -0.51 -1.46 0.00 0.00 175.22 172.49 3i33 s ASP 209 N 1.41 2.14 -0.16 6.13 1.01 0.65 -0.72 116.67 127.14 3i33 s ASP 209 Ca 0.03 -0.36 -0.02 0.00 0.71 0.00 0.00 52.55 52.91 3i33 s ASP 209 Cb -0.13 -0.96 -0.02 0.00 1.01 0.00 0.00 42.92 42.83 3i33 s ASP 209 CO -0.09 0.01 -0.09 -0.69 0.21 0.00 0.00 175.17 174.52 3i33 s VAL 210 N 0.89 3.30 -0.01 -1.27 1.01 -0.02 -0.65 120.40 123.65 3i33 s VAL 210 Ca -0.09 -0.56 0.04 0.00 0.00 0.00 0.00 61.98 61.37 3i33 s VAL 210 Cb -0.15 -2.43 -0.01 0.00 0.00 0.00 0.00 36.38 33.79 3i33 s VAL 210 CO 0.01 0.49 -0.12 -0.44 0.00 0.00 0.00 175.10 175.03 3i33 s SER 211 N 0.65 1.47 -0.18 3.32 0.01 -0.55 -0.79 113.70 117.62 3i33 s SER 211 Ca -0.05 -0.23 -0.02 0.00 1.31 0.00 0.00 55.95 56.96 3i33 s SER 211 Cb -0.15 -0.18 -0.01 0.00 0.21 0.00 0.00 66.02 65.89 3i33 s SER 211 CO 0.02 0.15 -0.08 -0.63 0.41 0.00 0.00 173.24 173.11 3i33 s ILE 212 N -0.27 3.22 0.06 1.44 1.01 -0.35 -0.38 121.20 125.93 3i33 s ILE 212 Ca 0.04 -0.57 0.07 0.00 0.00 0.00 0.00 60.65 60.20 3i33 s ILE 212 Cb -0.05 -2.42 -0.03 0.00 0.01 0.00 0.00 42.46 39.97 3i33 s ILE 212 CO -0.00 0.47 -0.17 -0.76 0.00 0.00 0.00 174.94 174.47 3i33 s LEU 213 N 1.01 2.67 -0.10 2.97 1.43 -0.01 -0.06 118.68 126.60 3i33 s LEU 213 Ca -0.00 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.67 3i33 s LEU 213 Cb -0.15 -1.55 -0.02 0.00 0.03 0.00 0.00 46.19 44.51 3i33 s LEU 213 CO -0.01 0.23 -0.16 0.28 0.23 0.00 0.00 176.35 176.92 3i33 s THR 214 N -1.00 2.80 -0.30 5.49 -1.32 -0.21 -0.76 115.64 120.34 3i33 s THR 214 Ca 0.16 -0.77 0.02 0.00 -1.21 0.00 0.00 61.69 59.89 3i33 s THR 214 Cb -0.11 -2.13 0.08 0.00 -1.51 0.00 0.00 72.50 68.84 3i33 s THR 214 CO 0.07 0.55 0.00 -0.63 -2.21 0.00 0.00 174.62 172.40 3i33 s ILE 215 N 0.03 1.89 -0.14 5.08 1.01 -0.78 -1.11 121.20 127.18 3i33 s ILE 215 Ca -0.06 -1.83 0.01 0.00 0.00 0.00 0.00 60.65 58.77 3i33 s ILE 215 Cb -0.15 -2.27 0.00 0.00 0.01 0.00 0.00 42.46 40.06 3i33 s ILE 215 CO 0.05 -0.39 -0.19 -1.61 0.00 0.00 0.00 174.94 172.79 3i33 s GLU 216 N 1.15 3.12 -1.43 2.79 2.02 -0.87 -4.76 118.70 120.73 3i33 s GLU 216 Ca 0.03 -0.80 -0.08 0.00 0.02 0.00 0.00 54.97 54.14 3i33 s GLU 216 Cb -0.19 -2.52 0.04 0.00 0.10 0.00 0.00 34.13 31.56 3i33 s GLU 216 CO -0.10 0.02 0.61 -0.40 0.02 0.00 0.00 175.26 175.41 3i33 n ASP 217 N 4.01 -4.97 0.00 -0.19 5.68 -1.26 -1.07 116.55 118.75 3i33 n ASP 217 Ca -0.19 -0.38 0.00 0.00 -0.50 0.00 0.00 54.79 53.71 3i33 n ASP 217 Cb 0.52 -4.04 0.00 0.00 -1.14 0.00 0.00 41.12 36.46 3i33 n ASP 217 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3i33 n GLY 218 N -1.40 0.54 3.49 6.12 0.00 -1.26 -5.02 105.19 107.66 3i33 n GLY 218 Ca -0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 3i33 n GLY 218 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i33 s ILE 219 N -2.24 4.75 0.03 -0.61 -1.09 -0.24 -5.05 121.20 116.75 3i33 s ILE 219 Ca 0.00 -0.17 -0.27 0.00 -2.23 0.00 0.00 60.65 57.99 3i33 s ILE 219 Cb 0.00 -3.32 -0.05 0.00 -1.58 0.00 0.00 42.46 37.52 3i33 s ILE 219 CO 0.00 0.20 0.83 -0.36 -1.23 0.00 0.00 174.94 174.38 3i33 s PHE 220 N 1.66 3.71 -0.13 3.97 0.40 -1.26 -2.05 117.98 124.27 3i33 s PHE 220 Ca 0.06 1.54 0.01 0.00 -0.60 0.00 0.00 56.93 57.94 3i33 s PHE 220 Cb -0.16 -2.92 0.02 0.00 0.51 0.00 0.00 43.02 40.46 3i33 s PHE 220 CO 0.07 0.17 -0.16 -2.00 0.70 0.00 0.00 175.22 174.00 3i33 s GLU 221 N 0.32 2.36 -0.41 0.44 2.12 -0.27 -5.00 118.70 118.26 3i33 s GLU 221 Ca 0.43 -0.60 -0.29 0.00 0.36 0.00 0.00 54.97 54.87 3i33 s GLU 221 Cb -0.21 -2.05 0.02 0.00 0.26 0.00 0.00 34.13 32.16 3i33 s GLU 221 CO 0.24 -0.13 1.21 0.08 -0.54 0.00 0.00 175.26 176.12 3i33 s VAL 222 N 1.16 4.19 -0.00 3.70 1.01 -1.26 -1.05 120.40 128.15 3i33 s VAL 222 Ca -0.02 1.27 -0.01 0.00 0.00 0.00 0.00 61.98 63.22 3i33 s VAL 222 Cb -0.14 -4.43 -0.27 0.00 0.00 0.00 0.00 36.38 31.55 3i33 s VAL 222 CO -0.05 -0.78 0.84 0.11 0.00 0.00 0.00 175.10 175.21 3i33 h LYS 223 N 9.32 0.21 -2.54 2.72 1.79 -0.83 -3.49 116.57 123.76 3i33 h LYS 223 Ca -0.24 -0.36 0.01 0.00 -2.18 0.00 0.00 60.65 57.88 3i33 h LYS 223 Cb 1.07 0.14 -0.15 0.00 -1.58 0.00 0.00 32.23 31.71 3i33 h LYS 223 CO 1.09 1.06 0.30 -1.54 -1.08 0.00 0.00 179.45 179.27 3i33 s SER 224 N -6.89 -0.52 0.02 0.86 1.04 -1.14 -4.50 113.70 102.57 3i33 s SER 224 Ca -0.09 0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.51 3i33 s SER 224 Cb 0.07 0.52 -0.02 0.00 0.10 0.00 0.00 66.02 66.69 3i33 s SER 224 CO 0.84 -0.78 -0.04 0.42 0.98 0.00 0.00 173.24 174.67 3i33 s THR 225 N -2.95 0.18 0.31 2.02 -4.23 -1.26 -1.21 115.64 108.51 3i33 s THR 225 Ca -0.00 -0.85 -0.10 0.00 -1.18 0.00 0.00 61.69 59.56 3i33 s THR 225 Cb -0.01 -0.30 0.01 0.00 1.34 0.00 0.00 72.50 73.54 3i33 s THR 225 CO -0.07 -0.42 0.55 0.00 -0.54 0.00 0.00 174.62 174.14 3i33 s ALA 226 N -1.29 0.02 0.00 3.99 0.00 0.03 -4.79 121.76 119.72 3i33 s ALA 226 Ca -0.13 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 50.74 3i33 s ALA 226 Cb -0.09 1.02 0.00 0.00 0.00 0.00 0.00 23.12 24.05 3i33 s ALA 226 CO -0.01 -0.86 0.00 0.41 0.00 0.00 0.00 175.76 175.30 3i33 n GLY 227 N -0.49 0.45 3.04 0.00 0.00 -1.26 -0.84 105.19 106.10 3i33 n GLY 227 Ca -0.02 -1.50 -0.10 0.00 0.00 0.00 0.00 46.02 44.40 3i33 n GLY 227 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3i33 s ASP 228 N -4.00 0.11 0.00 1.61 -1.08 0.10 -4.95 116.67 108.47 3i33 s ASP 228 Ca 0.00 0.51 0.22 0.00 -0.52 0.00 0.00 52.55 52.76 3i33 s ASP 228 Cb 0.00 1.14 1.20 0.00 -1.46 0.00 0.00 42.92 43.80 3i33 s ASP 228 CO 0.00 -0.27 1.71 0.35 0.52 0.00 0.00 175.17 177.47 3i33 n THR 229 N 5.37 0.19 -2.36 1.71 -2.24 -1.26 -1.03 114.28 114.65 3i33 n THR 229 Ca -0.06 0.05 -0.17 0.00 -2.27 0.00 0.00 64.05 61.60 3i33 n THR 229 Cb 0.50 -0.69 0.03 0.00 -2.10 0.00 0.00 70.33 68.06 3i33 n THR 229 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3i33 n HIS 230 N -1.16 2.34 -3.78 4.78 8.25 -1.25 -4.40 115.22 120.00 3i33 n HIS 230 Ca 0.13 -2.39 -0.21 0.00 -0.26 0.00 0.00 57.72 54.99 3i33 n HIS 230 Cb 0.13 -0.27 -0.17 0.00 1.12 0.00 0.00 29.99 30.79 3i33 n HIS 230 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3i33 s LEU 231 N -3.60 0.58 0.00 2.41 2.96 -1.07 -5.00 118.68 114.96 3i33 s LEU 231 Ca 0.42 -0.04 -0.08 0.00 -0.22 0.00 0.00 54.13 54.21 3i33 s LEU 231 Cb 0.39 -0.35 0.03 0.00 0.50 0.00 0.00 46.19 46.76 3i33 s LEU 231 CO -0.02 -0.19 0.37 0.61 -1.32 0.00 0.00 176.35 175.81 3i33 n GLY 232 N 5.02 1.01 0.38 7.98 0.00 -1.25 -1.98 105.19 116.35 3i33 n GLY 232 Ca -0.09 -0.99 0.15 0.00 0.00 0.00 0.00 46.02 45.09 3i33 n GLY 232 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3i33 h GLY 233 N 0.70 0.84 1.68 -0.02 0.00 -0.31 -0.25 103.07 105.71 3i33 h GLY 233 Ca -0.10 -0.21 0.02 0.00 0.00 0.00 0.00 47.33 47.05 3i33 h GLY 233 CO 0.13 0.05 0.17 1.05 0.00 0.00 0.00 176.54 177.94 3i33 h GLU 234 N 0.47 0.24 -0.07 4.80 -0.00 -1.42 -0.96 114.58 117.65 3i33 h GLU 234 Ca 0.41 -0.01 -0.16 0.00 -0.00 0.00 0.00 59.36 59.59 3i33 h GLU 234 Cb 0.89 -0.05 -0.01 0.00 -0.00 0.00 0.00 28.75 29.57 3i33 h GLU 234 CO -0.15 0.16 -0.66 -0.44 -0.00 0.00 0.00 179.01 177.92 3i33 h ASP 235 N 0.25 0.32 -0.41 3.06 3.32 -1.28 -1.29 116.42 120.39 3i33 h ASP 235 Ca 0.10 -0.20 -0.13 0.00 0.02 0.00 0.00 57.03 56.82 3i33 h ASP 235 Cb 0.10 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3i33 h ASP 235 CO -0.02 0.89 -0.25 -0.26 -1.72 0.00 0.00 179.24 177.87 3i33 h PHE 236 N 0.20 1.05 -0.52 4.55 0.04 -1.29 -2.26 116.94 118.71 3i33 h PHE 236 Ca -0.01 -0.28 0.05 0.00 2.80 0.00 0.00 57.97 60.53 3i33 h PHE 236 Cb 1.19 -0.23 -0.05 0.00 2.20 0.00 0.00 35.95 39.06 3i33 h PHE 236 CO 0.03 1.07 0.24 -0.44 -0.60 0.00 0.00 178.31 178.62 3i33 h ASP 237 N 0.72 0.33 -0.20 2.17 3.32 -1.04 -2.67 116.42 119.05 3i33 h ASP 237 Ca 0.08 0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 3i33 h ASP 237 Cb 0.83 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.34 3i33 h ASP 237 CO 0.07 0.22 -0.02 0.78 -1.72 0.00 0.00 179.24 178.58 3i33 h ASN 238 N 0.47 0.47 -0.77 6.45 2.35 -0.97 -0.05 115.58 123.52 3i33 h ASN 238 Ca 0.24 -0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 55.87 3i33 h ASN 238 Cb 0.18 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.39 3i33 h ASN 238 CO -0.19 0.55 0.37 0.03 -1.65 0.00 0.00 177.43 176.54 3i33 h ARG 239 N 0.48 1.13 -0.16 0.81 2.47 -1.09 -1.70 114.38 116.31 3i33 h ARG 239 Ca 0.10 -0.17 -0.14 0.00 -1.26 0.00 0.00 59.98 58.52 3i33 h ARG 239 Cb 0.34 -0.20 -0.01 0.00 -1.65 0.00 0.00 29.97 28.44 3i33 h ARG 239 CO 0.01 0.87 -0.48 1.98 0.56 0.00 0.00 179.97 182.92 3i33 h MET 240 N 1.12 0.41 -0.17 0.04 4.05 -1.03 -2.67 114.93 116.68 3i33 h MET 240 Ca 0.27 -0.23 -0.01 0.00 -0.28 0.00 0.00 59.70 59.45 3i33 h MET 240 Cb 0.12 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 30.93 3i33 h MET 240 CO -0.03 0.81 0.07 0.28 0.23 0.00 0.00 176.91 178.26 3i33 h VAL 241 N 0.33 1.17 -0.52 -5.77 2.07 -0.66 -0.61 116.25 112.25 3i33 h VAL 241 Ca 0.02 -0.50 0.03 0.00 0.82 0.00 0.00 66.70 67.07 3i33 h VAL 241 Cb 0.97 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.87 3i33 h VAL 241 CO 0.08 0.16 0.30 0.28 0.02 0.00 0.00 177.57 178.41 3i33 h SER 242 N 0.12 0.47 -0.12 0.57 0.02 -1.30 0.10 113.55 113.41 3i33 h SER 242 Ca 0.06 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 3i33 h SER 242 Cb 0.19 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 3i33 h SER 242 CO -0.00 0.33 0.07 -0.74 -1.14 0.00 0.00 176.83 175.34 3i33 h HIS 243 N 0.59 0.17 0.00 3.45 6.17 -1.34 -2.17 115.15 122.01 3i33 h HIS 243 Ca 0.22 -0.00 -0.15 0.00 0.71 0.00 0.00 60.37 61.14 3i33 h HIS 243 Cb 0.06 -0.05 -0.02 0.00 2.52 0.00 0.00 27.41 29.91 3i33 h HIS 243 CO -0.08 0.18 -0.73 -0.07 0.71 0.00 0.00 177.93 177.94 3i33 h LEU 244 N 0.11 0.00 -0.67 0.26 3.38 -0.91 -2.24 115.31 115.24 3i33 h LEU 244 Ca 0.04 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 3i33 h LEU 244 Cb 0.06 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 3i33 h LEU 244 CO -0.01 0.73 0.16 0.00 0.09 0.00 0.00 178.44 179.41 3i33 h ALA 245 N 1.27 0.88 -0.84 1.53 0.00 -0.75 -0.65 119.26 120.70 3i33 h ALA 245 Ca -0.01 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 3i33 h ALA 245 Cb 1.45 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.94 3i33 h ALA 245 CO 0.09 0.60 0.52 1.49 0.00 0.00 0.00 179.25 181.95 3i33 h GLU 246 N 1.00 1.13 -0.43 0.00 4.81 -1.26 -1.71 114.58 118.11 3i33 h GLU 246 Ca 0.21 -0.09 -0.02 0.00 -0.13 0.00 0.00 59.36 59.32 3i33 h GLU 246 Cb 0.37 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 3i33 h GLU 246 CO 0.00 0.78 0.17 1.49 -0.73 0.00 0.00 179.01 180.73 3i33 h GLU 247 N 1.15 0.65 -0.75 1.92 4.81 -1.01 -0.09 114.58 121.27 3i33 h GLU 247 Ca 0.30 -0.12 -0.02 0.00 -0.13 0.00 0.00 59.36 59.40 3i33 h GLU 247 Cb -0.07 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.17 3i33 h GLU 247 CO -0.06 0.60 0.41 0.35 -0.73 0.00 0.00 179.01 179.58 3i33 h PHE 248 N 0.56 1.03 -0.55 0.92 3.04 -0.92 0.37 116.94 121.39 3i33 h PHE 248 Ca 0.14 -0.03 -0.03 0.00 3.98 0.00 0.00 57.97 62.04 3i33 h PHE 248 Cb 0.19 -0.33 -0.02 0.00 2.56 0.00 0.00 35.95 38.35 3i33 h PHE 248 CO 0.00 0.73 0.22 -0.22 -2.02 0.00 0.00 178.31 177.01 3i33 h LYS 249 N 1.04 0.83 -0.44 1.11 3.64 -1.08 0.71 116.57 122.38 3i33 h LYS 249 Ca 0.26 -0.15 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 3i33 h LYS 249 Cb 0.04 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 3i33 h LYS 249 CO -0.04 0.73 0.17 -0.09 -2.27 0.00 0.00 179.45 177.95 3i33 h ARG 250 N 0.76 0.66 0.00 1.90 2.43 -0.44 0.98 114.38 120.67 3i33 h ARG 250 Ca 0.18 -0.12 -0.22 0.00 -0.81 0.00 0.00 59.98 59.01 3i33 h ARG 250 Cb 0.21 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 3i33 h ARG 250 CO -0.01 0.60 -1.10 0.87 -1.51 0.00 0.00 179.97 178.82 3i33 h LYS 251 N 0.56 0.00 0.00 0.20 1.57 -0.81 -3.39 116.57 114.71 3i33 h LYS 251 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3i33 h LYS 251 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 3i33 h LYS 251 CO -0.01 0.92 0.00 0.72 -0.57 0.00 0.00 179.45 180.51 3i33 n HIS 252 N -3.30 0.00 -3.01 -1.35 8.25 0.23 -5.02 115.22 111.01 3i33 n HIS 252 Ca -0.02 -0.07 -0.22 0.00 -0.26 0.00 0.00 57.72 57.15 3i33 n HIS 252 Cb 0.95 -0.01 0.02 0.00 1.12 0.00 0.00 29.99 32.07 3i33 n HIS 252 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3i33 n LYS 253 N -0.07 -4.03 -4.64 -0.41 4.76 0.34 -4.98 118.16 109.13 3i33 n LYS 253 Ca 0.00 0.78 -0.24 0.00 -2.87 0.00 0.00 58.31 55.98 3i33 n LYS 253 Cb 0.13 -5.57 -0.16 0.00 -1.84 0.00 0.00 35.03 27.59 3i33 n LYS 253 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3i33 s LYS 254 N -5.67 1.50 -0.41 1.97 1.02 -1.25 -5.03 119.74 111.85 3i33 s LYS 254 Ca 0.28 -0.47 -0.12 0.00 0.02 0.00 0.00 55.97 55.68 3i33 s LYS 254 Cb -0.13 -1.31 0.05 0.00 -0.52 0.00 0.00 37.83 35.92 3i33 s LYS 254 CO 0.34 0.15 0.28 0.34 -0.92 0.00 0.00 175.35 175.54 3i33 s ASP 255 N 0.22 5.84 0.00 2.83 2.15 -1.26 -3.43 116.67 123.03 3i33 s ASP 255 Ca -0.06 -1.21 0.29 0.00 0.43 0.00 0.00 52.55 52.00 3i33 s ASP 255 Cb -0.11 -2.07 1.30 0.00 -0.30 0.00 0.00 42.92 41.74 3i33 s ASP 255 CO 0.02 -0.50 1.95 2.30 -0.17 0.00 0.00 175.17 178.78 3i33 n ILE 256 N 5.04 0.00 -0.25 4.11 -5.35 -1.26 -4.34 119.36 117.32 3i33 n ILE 256 Ca -0.11 -0.00 0.03 0.00 -0.27 0.00 0.00 62.75 62.39 3i33 n ILE 256 Cb 0.45 -0.49 0.12 0.00 -1.74 0.00 0.00 39.64 37.97 3i33 n ILE 256 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 3i33 h GLY 257 N 5.00 0.67 1.63 3.28 0.00 -1.96 0.06 103.07 111.75 3i33 h GLY 257 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.50 3i33 h GLY 257 CO 0.00 -0.28 0.00 -1.05 0.00 0.00 0.00 176.54 175.21 3i33 n PRO 258 N -5.41 0.24 -3.56 4.80 -0.02 -1.26 -4.61 135.00 125.19 3i33 n PRO 258 Ca 0.11 0.11 -0.41 0.00 -2.02 0.00 0.00 63.50 61.29 3i33 n PRO 258 Cb 0.42 -1.50 -0.10 0.00 -0.02 0.00 0.00 33.50 32.29 3i33 n PRO 258 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3i33 s ASN 259 N -2.63 5.81 0.22 2.55 3.84 0.01 -4.97 114.94 119.76 3i33 s ASN 259 Ca 0.18 -1.14 -0.09 0.00 0.21 0.00 0.00 52.86 52.01 3i33 s ASN 259 Cb 0.13 -2.05 0.18 0.00 -0.55 0.00 0.00 41.25 38.96 3i33 s ASN 259 CO 0.31 -0.46 1.89 0.11 -2.79 0.00 0.00 177.10 176.16 3i33 h LYS 260 N 8.49 1.05 -0.36 0.43 1.57 -1.82 -2.17 116.57 123.76 3i33 h LYS 260 Ca -0.25 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.42 3i33 h LYS 260 Cb 1.10 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.16 3i33 h LYS 260 CO 0.72 0.69 0.07 -0.09 -0.57 0.00 0.00 179.45 180.27 3i33 h ARG 261 N 1.08 0.59 -0.45 3.15 2.43 -1.94 -0.93 114.38 118.31 3i33 h ARG 261 Ca 0.30 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.30 3i33 h ARG 261 Cb -0.11 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 3i33 h ARG 261 CO -0.07 0.65 0.26 0.00 -1.51 0.00 0.00 179.97 179.30 3i33 h ALA 262 N 0.91 0.58 -0.76 2.80 0.00 -1.77 0.88 119.26 121.90 3i33 h ALA 262 Ca 0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3i33 h ALA 262 Cb 0.34 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 3i33 h ALA 262 CO 0.01 0.09 0.42 0.28 0.00 0.00 0.00 179.25 180.05 3i33 h VAL 263 N 0.60 1.23 -0.54 0.00 2.07 -1.28 -0.77 116.25 117.56 3i33 h VAL 263 Ca 0.16 -0.56 -0.10 0.00 0.82 0.00 0.00 66.70 67.02 3i33 h VAL 263 Cb 0.03 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 3i33 h VAL 263 CO -0.03 0.25 -0.06 -0.09 0.02 0.00 0.00 177.57 177.66 3i33 h ARG 264 N 1.05 0.99 -0.58 1.57 9.65 -0.64 -0.07 114.38 126.35 3i33 h ARG 264 Ca 0.27 -0.35 -0.09 0.00 -1.10 0.00 0.00 59.98 58.71 3i33 h ARG 264 Cb 0.02 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.51 3i33 h ARG 264 CO -0.04 1.02 0.01 0.00 2.80 0.00 0.00 179.97 183.76 3i33 h ARG 265 N 0.87 1.01 -0.67 0.20 3.08 -0.62 -0.74 114.38 117.51 3i33 h ARG 265 Ca 0.14 -0.30 -0.05 0.00 0.07 0.00 0.00 59.98 59.84 3i33 h ARG 265 Cb 0.62 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.54 3i33 h ARG 265 CO 0.04 0.98 0.22 1.25 -1.07 0.00 0.00 179.97 181.39 3i33 h LEU 266 N 0.92 0.97 -0.51 3.04 5.85 -0.88 -1.43 115.31 123.27 3i33 h LEU 266 Ca 0.17 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.69 3i33 h LEU 266 Cb 0.53 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 3i33 h LEU 266 CO 0.03 0.91 0.34 -0.09 -0.34 0.00 0.00 178.44 179.29 3i33 h ARG 267 N 0.97 0.67 -0.52 1.25 2.43 -0.63 0.17 114.38 118.72 3i33 h ARG 267 Ca 0.22 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.34 3i33 h ARG 267 Cb 0.29 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.66 3i33 h ARG 267 CO -0.01 0.44 0.31 1.15 -1.51 0.00 0.00 179.97 180.35 3i33 h THR 268 N 0.69 1.16 -0.81 0.20 2.02 -1.00 -0.22 112.91 114.95 3i33 h THR 268 Ca 0.19 -0.36 -0.02 0.00 0.77 0.00 0.00 66.41 66.99 3i33 h THR 268 Cb -0.07 0.46 -0.04 0.00 -1.74 0.00 0.00 68.15 66.76 3i33 h THR 268 CO -0.05 0.16 0.42 0.00 0.37 0.00 0.00 175.52 176.43 3i33 h ALA 269 N 1.15 1.04 -0.58 6.16 0.00 -0.80 -1.56 119.26 124.68 3i33 h ALA 269 Ca 0.19 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3i33 h ALA 269 Cb -0.01 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 3i33 h ALA 269 CO -0.03 0.57 0.23 0.00 0.00 0.00 0.00 179.25 180.02 3i33 h GLU 271 N 0.80 0.90 -0.23 0.00 4.22 -0.79 0.11 114.58 119.59 3i33 h GLU 271 Ca 0.19 -0.09 0.01 0.00 0.08 0.00 0.00 59.36 59.55 3i33 h GLU 271 Cb 0.20 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 3i33 h GLU 271 CO -0.02 0.65 0.14 0.00 -2.18 0.00 0.00 179.01 177.60 3i33 h ARG 272 N 0.89 0.28 -0.54 1.92 3.08 -1.12 -2.30 114.38 116.59 3i33 h ARG 272 Ca 0.23 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.24 3i33 h ARG 272 Cb -0.01 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 3i33 h ARG 272 CO -0.04 0.18 0.24 0.00 -1.07 0.00 0.00 179.97 179.28 3i33 h ALA 273 N 1.10 0.70 -0.53 0.04 0.00 -0.82 -2.51 119.26 117.23 3i33 h ALA 273 Ca 0.09 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 54.94 3i33 h ALA 273 Cb -0.01 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 17.49 3i33 h ALA 273 CO -0.03 0.28 0.14 -0.22 0.00 0.00 0.00 179.25 179.42 3i33 h LYS 274 N 0.73 0.28 -0.63 0.00 3.64 -0.63 -0.35 116.57 119.62 3i33 h LYS 274 Ca 0.18 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.56 3i33 h LYS 274 Cb 0.16 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 3i33 h LYS 274 CO -0.02 0.19 0.41 0.00 -2.27 0.00 0.00 179.45 177.76 3i33 h ARG 275 N 0.29 0.81 -0.78 1.90 3.08 -1.17 -1.84 114.38 116.67 3i33 h ARG 275 Ca 0.26 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 60.28 3i33 h ARG 275 Cb 0.34 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 30.17 3i33 h ARG 275 CO -0.32 0.53 0.51 1.15 -1.07 0.00 0.00 179.97 180.78 3i33 h THR 276 N 0.83 1.17 0.00 2.04 2.02 -0.89 -2.11 112.91 115.98 3i33 h THR 276 Ca 0.24 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 67.07 3i33 h THR 276 Cb -0.07 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.40 3i33 h THR 276 CO -0.06 0.19 0.00 0.18 0.37 0.00 0.00 175.52 176.19 3i33 n LEU 277 N -4.43 0.00 0.19 2.58 4.77 -0.23 -0.83 117.00 119.06 3i33 n LEU 277 Ca 0.09 0.43 0.13 0.00 -0.03 0.00 0.00 56.01 56.63 3i33 n LEU 277 Cb 0.06 -0.43 0.31 0.00 -2.33 0.00 0.00 43.42 41.03 3i33 n LEU 277 CO 0.36 -0.24 0.86 0.28 -1.33 0.00 0.00 177.39 177.32 3i33 h SER 278 N 0.00 0.00 0.00 -1.43 0.02 -1.23 -3.37 113.55 107.54 3i33 h SER 278 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3i33 h SER 278 Cb 0.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.73 3i33 h SER 278 CO 0.00 0.00 -0.26 -1.54 -1.14 0.00 0.00 176.83 173.89 3i33 n SER 279 N -2.83 1.32 -4.36 3.07 3.41 -0.55 -4.66 113.62 109.02 3i33 n SER 279 Ca 0.04 -0.26 -0.19 0.00 -0.26 0.00 0.00 58.87 58.20 3i33 n SER 279 Cb 0.46 0.79 -0.10 0.00 -0.26 0.00 0.00 64.21 65.10 3i33 n SER 279 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3i33 s SER 280 N -1.05 2.68 0.00 4.04 0.01 -0.01 -5.05 113.70 114.33 3i33 s SER 280 Ca 0.00 -1.02 0.27 0.00 1.31 0.00 0.00 55.95 56.51 3i33 s SER 280 Cb 0.00 -0.15 0.85 0.00 0.21 0.00 0.00 66.02 66.92 3i33 s SER 280 CO 0.00 -0.15 1.62 0.35 0.41 0.00 0.00 173.24 175.47 3i33 n THR 281 N -0.41 0.00 -3.84 1.44 -2.24 -1.26 -4.20 114.28 103.77 3i33 n THR 281 Ca -0.08 -0.22 -0.10 0.00 -2.27 0.00 0.00 64.05 61.39 3i33 n THR 281 Cb 0.60 0.55 -0.08 0.00 -2.10 0.00 0.00 70.33 69.31 3i33 n THR 281 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3i33 s GLN 282 N -2.21 0.77 -0.02 -0.78 -2.07 -1.26 -0.69 119.66 113.40 3i33 s GLN 282 Ca 0.31 -0.77 -0.10 0.00 -1.82 0.00 0.00 55.36 52.99 3i33 s GLN 282 Cb 0.20 0.32 0.01 0.00 -1.09 0.00 0.00 33.01 32.45 3i33 s GLN 282 CO 0.41 -0.23 0.21 0.00 -1.32 0.00 0.00 175.29 174.36 3i33 s ALA 283 N -3.15 -0.51 0.18 2.60 0.00 -0.15 -4.76 121.76 115.98 3i33 s ALA 283 Ca -0.01 0.16 -0.04 0.00 0.00 0.00 0.00 51.96 52.07 3i33 s ALA 283 Cb 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 23.12 23.08 3i33 s ALA 283 CO -0.07 -0.20 0.42 -1.12 0.00 0.00 0.00 175.76 174.78 3i33 s SER 284 N -1.07 6.47 -0.13 0.00 0.01 -1.26 -0.99 113.70 116.73 3i33 s SER 284 Ca -0.11 0.59 0.03 0.00 1.31 0.00 0.00 55.95 57.76 3i33 s SER 284 Cb -0.06 -2.09 0.01 0.00 0.21 0.00 0.00 66.02 64.09 3i33 s SER 284 CO 0.02 -0.02 -0.22 -0.63 0.41 0.00 0.00 173.24 172.80 3i33 s ILE 285 N -1.78 2.10 -0.28 1.44 -1.09 0.57 -4.71 121.20 117.44 3i33 s ILE 285 Ca 0.41 -0.98 -0.03 0.00 -2.23 0.00 0.00 60.65 57.83 3i33 s ILE 285 Cb -0.12 -1.83 0.09 0.00 -1.58 0.00 0.00 42.46 39.03 3i33 s ILE 285 CO 0.26 0.55 0.10 -1.61 -1.23 0.00 0.00 174.94 173.01 3i33 s GLU 286 N 0.66 0.46 -0.24 2.79 2.02 -1.26 -1.17 118.70 121.97 3i33 s GLU 286 Ca -0.11 -0.71 0.01 0.00 0.02 0.00 0.00 54.97 54.19 3i33 s GLU 286 Cb -0.16 -1.68 0.06 0.00 0.10 0.00 0.00 34.13 32.45 3i33 s GLU 286 CO 0.02 -0.93 -0.07 0.42 0.02 0.00 0.00 175.26 174.72 3i33 s ILE 287 N 1.87 1.66 0.13 -1.63 1.01 -0.09 -5.01 121.20 119.14 3i33 s ILE 287 Ca 0.07 -1.28 -0.30 0.00 0.00 0.00 0.00 60.65 59.14 3i33 s ILE 287 Cb -0.17 -1.88 -0.07 0.00 0.01 0.00 0.00 42.46 40.36 3i33 s ILE 287 CO -0.26 -0.06 1.16 -1.81 0.00 0.00 0.00 174.94 173.96 3i33 s ASP 288 N 1.34 7.15 -1.23 3.58 1.01 -1.26 -0.49 116.67 126.77 3i33 s ASP 288 Ca -0.06 2.08 -0.03 0.00 0.71 0.00 0.00 52.55 55.24 3i33 s ASP 288 Cb -0.19 -2.59 -0.01 0.00 1.01 0.00 0.00 42.92 41.14 3i33 s ASP 288 CO -0.06 -0.35 0.79 -1.20 0.21 0.00 0.00 175.17 174.56 3i33 n SER 289 N 3.06 -2.59 -0.25 0.27 7.64 -1.25 -4.88 113.62 115.62 3i33 n SER 289 Ca 0.06 -0.79 -0.07 0.00 1.01 0.00 0.00 58.87 59.07 3i33 n SER 289 Cb 0.46 -4.33 0.04 0.00 -1.01 0.00 0.00 64.21 59.38 3i33 n SER 289 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 3i33 h LEU 290 N -1.76 0.98 -7.04 -3.43 5.85 -1.06 -3.43 115.31 105.41 3i33 h LEU 290 Ca -0.61 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 57.93 3i33 h LEU 290 Cb 1.35 -0.25 -0.22 0.00 0.37 0.00 0.00 40.66 41.90 3i33 h LEU 290 CO 0.52 0.91 -0.12 -0.47 -0.34 0.00 0.00 178.44 178.94 3i33 s TYR 291 N -5.47 -1.10 -1.45 1.25 5.04 -1.12 -4.66 117.35 109.83 3i33 s TYR 291 Ca -0.12 2.05 -0.09 0.00 -2.44 0.00 0.00 57.07 56.47 3i33 s TYR 291 Cb 0.14 0.63 0.05 0.00 0.35 0.00 0.00 41.96 43.13 3i33 s TYR 291 CO 0.82 -0.56 0.76 0.39 -1.34 0.00 0.00 175.55 175.62 3i33 n GLU 292 N 4.90 -5.02 -0.96 4.97 1.02 -1.26 -0.94 120.64 123.34 3i33 n GLU 292 Ca -0.16 0.68 0.00 0.00 -0.02 0.00 0.00 57.16 57.66 3i33 n GLU 292 Cb 0.53 -5.53 0.00 0.00 -0.02 0.00 0.00 31.44 26.42 3i33 n GLU 292 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i33 n GLY 293 N -1.53 0.74 3.65 0.62 0.00 -1.26 -5.01 105.19 102.39 3i33 n GLY 293 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 3i33 n GLY 293 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i33 s VAL 294 N -3.06 5.18 0.61 1.61 1.01 -0.12 -4.62 120.40 121.01 3i33 s VAL 294 Ca 0.00 0.70 -0.16 0.00 0.00 0.00 0.00 61.98 62.51 3i33 s VAL 294 Cb 0.00 -3.73 -0.02 0.00 0.00 0.00 0.00 36.38 32.62 3i33 s VAL 294 CO 0.00 0.21 1.10 -1.81 0.00 0.00 0.00 175.10 174.60 3i33 s ASP 295 N 1.25 5.44 -0.30 3.32 1.01 -1.26 -0.69 116.67 125.44 3i33 s ASP 295 Ca 0.18 1.99 0.01 0.00 0.71 0.00 0.00 52.55 55.44 3i33 s ASP 295 Cb -0.15 -2.55 0.09 0.00 1.01 0.00 0.00 42.92 41.32 3i33 s ASP 295 CO 0.09 -1.40 0.06 0.12 0.21 0.00 0.00 175.17 174.24 3i33 s PHE 296 N -2.23 2.31 -0.14 4.23 5.36 0.35 -4.82 117.98 123.05 3i33 s PHE 296 Ca 0.67 -2.03 -0.01 0.00 -0.96 0.00 0.00 56.93 54.61 3i33 s PHE 296 Cb -0.20 -1.98 -0.01 0.00 -0.34 0.00 0.00 43.02 40.48 3i33 s PHE 296 CO 0.36 -0.87 -0.12 0.71 -1.46 0.00 0.00 175.22 173.84 3i33 s TYR 297 N 1.41 2.83 0.39 10.12 1.51 -1.26 -0.91 117.35 131.43 3i33 s TYR 297 Ca 0.07 -0.69 -0.10 0.00 -1.01 0.00 0.00 57.07 55.35 3i33 s TYR 297 Cb -0.18 -1.87 0.04 0.00 -0.11 0.00 0.00 41.96 39.84 3i33 s TYR 297 CO -0.17 -0.25 0.68 -0.08 -1.11 0.00 0.00 175.55 174.61 3i33 s THR 298 N 0.48 0.00 0.01 -0.71 -1.32 -0.32 -4.99 115.64 108.79 3i33 s THR 298 Ca -0.09 -1.23 0.04 0.00 -1.21 0.00 0.00 61.69 59.20 3i33 s THR 298 Cb -0.16 -2.88 -0.01 0.00 -1.51 0.00 0.00 72.50 67.94 3i33 s THR 298 CO 0.04 0.00 -0.12 -0.55 -2.21 0.00 0.00 174.62 171.78 3i33 s SER 299 N -3.16 1.44 0.00 8.08 0.15 -1.26 -0.32 113.70 118.64 3i33 s SER 299 Ca 0.22 -0.31 0.03 0.00 0.70 0.00 0.00 55.95 56.58 3i33 s SER 299 Cb -0.03 -0.13 -0.01 0.00 -1.71 0.00 0.00 66.02 64.14 3i33 s SER 299 CO 0.16 0.09 -0.08 -0.51 1.20 0.00 0.00 173.24 174.10 3i33 s ILE 300 N -0.52 0.63 0.26 6.45 2.07 -0.16 -4.97 121.20 124.96 3i33 s ILE 300 Ca 0.03 -0.48 0.00 0.00 -1.41 0.00 0.00 60.65 58.80 3i33 s ILE 300 Cb -0.06 -0.55 -0.04 0.00 0.13 0.00 0.00 42.46 41.94 3i33 s ILE 300 CO 0.00 0.08 0.45 0.42 -1.91 0.00 0.00 174.94 173.98 3i33 s THR 301 N -0.39 5.17 0.21 4.00 -4.23 -1.26 -0.97 115.64 118.16 3i33 s THR 301 Ca 0.01 -0.47 -0.09 0.00 -1.18 0.00 0.00 61.69 59.95 3i33 s THR 301 Cb -0.04 -3.80 0.14 0.00 1.34 0.00 0.00 72.50 70.14 3i33 s THR 301 CO -0.00 -0.34 1.81 -0.09 -0.54 0.00 0.00 174.62 175.45 3i33 h ARG 302 N 1.41 0.66 -0.72 3.99 2.43 -1.20 -1.25 114.38 119.70 3i33 h ARG 302 Ca -0.49 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 58.66 3i33 h ARG 302 Cb 1.21 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 30.56 3i33 h ARG 302 CO 0.64 0.44 0.46 0.00 -1.51 0.00 0.00 179.97 180.00 3i33 h ALA 303 N 1.34 0.94 -0.45 2.80 0.00 -1.95 0.02 119.26 121.97 3i33 h ALA 303 Ca 0.30 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.07 3i33 h ALA 303 Cb 0.18 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3i33 h ALA 303 CO -0.18 0.25 -0.14 -0.09 0.00 0.00 0.00 179.25 179.09 3i33 h ARG 304 N 0.90 0.89 -0.83 0.00 9.65 -1.86 -1.52 114.38 121.61 3i33 h ARG 304 Ca 0.29 -0.36 0.04 0.00 -1.10 0.00 0.00 59.98 58.85 3i33 h ARG 304 Cb -0.00 -0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 28.48 3i33 h ARG 304 CO -0.10 1.00 0.53 0.35 2.80 0.00 0.00 179.97 184.55 3i33 h PHE 305 N 0.72 0.99 -0.54 2.20 3.57 -0.74 -0.67 116.94 122.47 3i33 h PHE 305 Ca 0.11 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.57 3i33 h PHE 305 Cb 0.70 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 3i33 h PHE 305 CO 0.05 0.55 0.07 0.93 -2.23 0.00 0.00 178.31 177.68 3i33 h GLU 306 N 1.01 0.86 -0.50 1.11 5.08 -0.68 -2.80 114.58 118.66 3i33 h GLU 306 Ca 0.34 -0.21 -0.07 0.00 -1.00 0.00 0.00 59.36 58.42 3i33 h GLU 306 Cb 0.05 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 3i33 h GLU 306 CO -0.13 0.81 0.02 0.93 -1.00 0.00 0.00 179.01 179.65 3i33 h GLU 307 N 0.81 0.87 0.00 2.33 5.08 -0.56 -1.22 114.58 121.90 3i33 h GLU 307 Ca 0.17 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 3i33 h GLU 307 Cb 0.39 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 3i33 h GLU 307 CO 0.01 0.89 -0.03 -0.07 -1.00 0.00 0.00 179.01 178.81 3i33 h LEU 308 N 0.74 0.00 -2.95 1.33 3.38 -0.91 -2.97 115.31 113.92 3i33 h LEU 308 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3i33 h LEU 308 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3i33 h LEU 308 CO 0.02 0.03 -0.01 0.59 0.09 0.00 0.00 178.44 179.16 3i33 n ASN 309 N -3.47 2.18 -0.35 -0.43 3.02 -1.08 -4.85 115.26 110.28 3i33 n ASN 309 Ca -0.02 -2.77 -0.03 0.00 -0.03 0.00 0.00 54.58 51.73 3i33 n ASN 309 Cb 0.13 -0.31 0.10 0.00 -0.61 0.00 0.00 39.78 39.09 3i33 n ASN 309 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3i33 h ALA 310 N 0.00 1.18 -0.43 5.41 0.00 -1.06 -0.45 119.26 123.91 3i33 h ALA 310 Ca 0.00 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3i33 h ALA 310 Cb 0.89 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3i33 h ALA 310 CO 0.00 0.56 -0.01 0.38 0.00 0.00 0.00 179.25 180.18 3i33 h ASP 311 N 1.25 0.76 -0.20 0.00 2.03 -1.87 -1.91 116.42 116.48 3i33 h ASP 311 Ca 0.34 -0.31 -0.14 0.00 -0.73 0.00 0.00 57.03 56.18 3i33 h ASP 311 Cb -0.13 -0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 38.16 3i33 h ASP 311 CO -0.08 0.89 -0.39 -0.07 -1.03 0.00 0.00 179.24 178.56 3i33 h LEU 312 N 0.61 0.78 0.03 0.15 3.38 -1.66 0.40 115.31 119.02 3i33 h LEU 312 Ca 0.12 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 3i33 h LEU 312 Cb 0.51 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.04 3i33 h LEU 312 CO 0.02 1.08 -0.02 -0.26 0.09 0.00 0.00 178.44 179.36 3i33 h PHE 313 N 0.60 -0.04 -0.55 1.13 0.04 -1.14 -3.08 116.94 113.90 3i33 h PHE 313 Ca 0.05 -0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.78 3i33 h PHE 313 Cb 0.94 0.01 -0.03 0.00 2.20 0.00 0.00 35.95 39.08 3i33 h PHE 313 CO 0.05 0.35 0.19 -0.09 -0.60 0.00 0.00 178.31 178.21 3i33 h ARG 314 N -0.45 0.81 0.00 1.51 9.65 -1.31 -2.51 114.38 122.08 3i33 h ARG 314 Ca -0.00 -0.13 0.00 0.00 -1.10 0.00 0.00 59.98 58.74 3i33 h ARG 314 Cb 0.41 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.86 3i33 h ARG 314 CO 0.01 0.69 0.00 0.78 2.80 0.00 0.00 179.97 184.24 3i33 h GLY 315 N 0.94 0.00 2.00 2.80 0.00 -0.87 -2.59 103.07 105.35 3i33 h GLY 315 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 3i33 h GLY 315 CO -0.01 0.00 0.00 -0.91 0.00 0.00 0.00 176.54 175.62 3i33 h THR 316 N 0.00 0.00 0.00 4.70 1.35 -1.36 -2.42 112.91 115.18 3i33 h THR 316 Ca 0.00 -0.15 -0.03 0.00 -0.55 0.00 0.00 66.41 65.69 3i33 h THR 316 Cb 0.20 1.10 -0.00 0.00 -1.73 0.00 0.00 68.15 67.71 3i33 h THR 316 CO 0.00 0.00 -0.12 -0.07 -0.25 0.00 0.00 175.52 175.08 3i33 h LEU 317 N 0.00 0.00 -0.12 3.87 3.38 -1.66 -3.27 115.31 117.52 3i33 h LEU 317 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3i33 h LEU 317 Cb 0.15 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 3i33 h LEU 317 CO 0.00 0.12 0.01 -0.33 0.09 0.00 0.00 178.44 178.33 3i33 h GLU 318 N 0.00 0.20 0.00 1.13 3.07 -1.64 -1.09 114.58 116.25 3i33 h GLU 318 Ca -0.00 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.36 58.78 3i33 h GLU 318 Cb 0.86 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 28.75 3i33 h GLU 318 CO 0.02 0.43 -0.10 -1.35 -1.40 0.00 0.00 179.01 176.61 3i33 h PRO 319 N -0.05 0.00 -0.20 2.33 0.11 -1.73 -0.05 132.00 132.41 3i33 h PRO 319 Ca 0.03 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.14 3i33 h PRO 319 Cb 0.33 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.43 3i33 h PRO 319 CO 0.00 0.10 0.10 0.28 -0.21 0.00 0.00 178.00 178.27 3i33 h VAL 320 N 0.00 1.11 -0.87 3.15 2.07 -1.50 0.40 116.25 120.61 3i33 h VAL 320 Ca -0.00 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 67.21 3i33 h VAL 320 Cb 0.17 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 3i33 h VAL 320 CO 0.01 0.11 0.57 -0.33 0.02 0.00 0.00 177.57 177.96 3i33 h GLU 321 N 0.20 1.14 -0.31 1.57 5.08 -0.48 -1.41 114.58 120.37 3i33 h GLU 321 Ca 0.07 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 3i33 h GLU 321 Cb 0.08 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 3i33 h GLU 321 CO -0.01 0.75 0.06 -0.22 -1.00 0.00 0.00 179.01 178.60 3i33 h LYS 322 N 1.17 0.51 -0.67 2.33 3.64 -0.82 -0.77 116.57 121.96 3i33 h LYS 322 Ca 0.32 -0.13 0.02 0.00 -1.27 0.00 0.00 60.65 59.59 3i33 h LYS 322 Cb -0.13 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.58 3i33 h LYS 322 CO -0.07 0.60 0.43 0.00 -2.27 0.00 0.00 179.45 178.13 3i33 h ALA 323 N 0.90 0.87 -0.26 5.00 0.00 -0.65 0.14 119.26 125.26 3i33 h ALA 323 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3i33 h ALA 323 Cb 0.32 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3i33 h ALA 323 CO 0.00 0.21 0.16 -0.07 0.00 0.00 0.00 179.25 179.56 3i33 h LEU 324 N 0.85 0.30 -0.33 0.00 3.38 -1.08 -1.15 115.31 117.28 3i33 h LEU 324 Ca 0.26 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.23 3i33 h LEU 324 Cb -0.02 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 3i33 h LEU 324 CO -0.09 0.24 0.14 0.03 0.09 0.00 0.00 178.44 178.85 3i33 h ARG 325 N 0.33 0.29 -0.09 1.13 3.08 -0.70 -0.94 114.38 117.49 3i33 h ARG 325 Ca 0.09 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.06 3i33 h ARG 325 Cb -0.01 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 3i33 h ARG 325 CO -0.02 0.19 -0.25 -0.44 -1.07 0.00 0.00 179.97 178.39 3i33 h ASP 326 N 0.30 0.15 0.37 7.04 3.32 -0.82 -1.48 116.42 125.30 3i33 h ASP 326 Ca 0.14 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.15 3i33 h ASP 326 Cb 0.08 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.59 3i33 h ASP 326 CO -0.12 0.41 -0.06 0.00 -1.72 0.00 0.00 179.24 177.75 3i33 n ALA 327 N -2.48 2.67 -3.73 3.45 0.00 -0.45 -4.89 120.51 115.08 3i33 n ALA 327 Ca -0.01 -0.23 -0.24 0.00 0.00 0.00 0.00 53.44 52.96 3i33 n ALA 327 Cb 0.34 -1.39 0.04 0.00 0.00 0.00 0.00 19.45 18.44 3i33 n ALA 327 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3i33 n LYS 328 N -1.02 -5.44 -4.39 0.00 5.02 -0.56 -5.01 118.16 106.76 3i33 n LYS 328 Ca 0.16 0.65 -0.24 0.00 -2.02 0.00 0.00 58.31 56.85 3i33 n LYS 328 Cb 0.25 -5.37 -0.13 0.00 -0.02 0.00 0.00 35.03 29.76 3i33 n LYS 328 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3i33 s LEU 329 N -6.87 2.26 0.40 -0.35 1.43 -0.46 -5.04 118.68 110.05 3i33 s LEU 329 Ca 0.23 -0.63 -0.06 0.00 -1.03 0.00 0.00 54.13 52.64 3i33 s LEU 329 Cb -0.11 -0.90 -0.05 0.00 0.03 0.00 0.00 46.19 45.16 3i33 s LEU 329 CO 0.80 0.09 0.70 -0.62 0.23 0.00 0.00 176.35 177.55 3i33 s ASP 330 N -1.67 6.37 0.53 2.29 2.15 -1.26 -4.27 116.67 120.81 3i33 s ASP 330 Ca 0.06 0.87 0.23 0.00 0.43 0.00 0.00 52.55 54.14 3i33 s ASP 330 Cb -0.10 -2.22 1.37 0.00 -0.30 0.00 0.00 42.92 41.68 3i33 s ASP 330 CO 0.03 -0.42 2.04 0.07 -0.17 0.00 0.00 175.17 176.73 3i33 h LYS 331 N 0.86 0.00 0.00 4.34 2.10 -1.97 0.03 116.57 121.93 3i33 h LYS 331 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 3i33 h LYS 331 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 3i33 h LYS 331 CO 0.63 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 178.49 3i33 n GLY 332 N -1.61 -1.16 0.95 0.07 0.00 -1.26 -2.65 105.19 99.53 3i33 n GLY 332 Ca 0.06 -0.07 0.09 0.00 0.00 0.00 0.00 46.02 46.11 3i33 n GLY 332 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3i33 n GLN 333 N -1.49 2.21 -3.26 1.61 6.02 -0.00 -4.83 117.38 117.64 3i33 n GLN 333 Ca 0.05 -1.86 -0.40 0.00 -0.01 0.00 0.00 57.00 54.77 3i33 n GLN 333 Cb 0.23 -1.43 -0.08 0.00 1.02 0.00 0.00 30.24 29.98 3i33 n GLN 333 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3i33 s ILE 334 N -1.40 5.06 -0.08 5.09 -1.09 -1.08 -4.62 121.20 123.08 3i33 s ILE 334 Ca 0.36 0.62 0.14 0.00 -2.23 0.00 0.00 60.65 59.54 3i33 s ILE 334 Cb 0.19 -3.87 -0.11 0.00 -1.58 0.00 0.00 42.46 37.10 3i33 s ILE 334 CO 0.26 -0.03 1.05 1.56 -1.23 0.00 0.00 174.94 176.55 3i33 h GLN 335 N 8.22 0.00 -3.45 2.79 7.50 -1.48 -3.46 115.11 125.23 3i33 h GLN 335 Ca -0.29 0.00 -0.23 0.00 0.50 0.00 0.00 58.65 58.64 3i33 h GLN 335 Cb 1.14 0.00 -0.29 0.00 0.05 0.00 0.00 27.48 28.38 3i33 h GLN 335 CO 0.73 0.49 -0.62 -1.21 -1.50 0.00 0.00 178.83 176.72 3i33 s GLU 336 N -2.85 0.09 -0.13 1.46 0.41 -1.08 -5.04 118.70 111.55 3i33 s GLU 336 Ca -0.01 0.20 0.01 0.00 -0.41 0.00 0.00 54.97 54.76 3i33 s GLU 336 Cb 0.08 -0.04 -0.00 0.00 -1.78 0.00 0.00 34.13 32.39 3i33 s GLU 336 CO 0.80 -0.07 -0.17 0.42 -0.49 0.00 0.00 175.26 175.74 3i33 s ILE 337 N 0.45 2.58 -0.14 -1.63 1.01 -1.26 -0.78 121.20 121.43 3i33 s ILE 337 Ca -0.03 -0.82 0.02 0.00 0.00 0.00 0.00 60.65 59.82 3i33 s ILE 337 Cb -0.05 -2.06 0.00 0.00 0.01 0.00 0.00 42.46 40.36 3i33 s ILE 337 CO -0.02 0.53 -0.19 -0.69 0.00 0.00 0.00 174.94 174.57 3i33 s VAL 338 N 0.59 2.38 -0.14 2.92 1.01 -0.01 -0.50 120.40 126.65 3i33 s VAL 338 Ca -0.10 -0.88 -0.23 0.00 0.00 0.00 0.00 61.98 60.77 3i33 s VAL 338 Cb -0.16 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 3i33 s VAL 338 CO 0.03 0.54 0.71 -0.76 0.00 0.00 0.00 175.10 175.62 3i33 s LEU 339 N 0.67 4.21 0.05 3.92 1.43 -0.62 -1.02 118.68 127.33 3i33 s LEU 339 Ca -0.09 1.05 0.04 0.00 -1.03 0.00 0.00 54.13 54.10 3i33 s LEU 339 Cb -0.16 -3.05 -0.02 0.00 0.03 0.00 0.00 46.19 42.99 3i33 s LEU 339 CO 0.02 -0.25 -0.12 -0.69 0.23 0.00 0.00 176.35 175.53 3i33 s VAL 340 N 1.58 0.94 0.00 -1.59 1.01 -0.28 -4.59 120.40 117.47 3i33 s VAL 340 Ca 0.34 -1.11 0.00 0.00 0.00 0.00 0.00 61.98 61.22 3i33 s VAL 340 Cb -0.17 -0.91 0.00 0.00 0.00 0.00 0.00 36.38 35.31 3i33 s VAL 340 CO 0.13 -0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.67 3i33 n GLY 341 N 1.59 1.33 0.30 4.51 0.00 -0.28 -1.39 105.19 111.25 3i33 n GLY 341 Ca -0.20 -1.55 0.07 0.00 0.00 0.00 0.00 46.02 44.33 3i33 n GLY 341 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3i33 h GLY 342 N 0.00 0.34 2.00 -0.02 0.00 -1.80 -1.84 103.07 101.76 3i33 h GLY 342 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.21 3i33 h GLY 342 CO 0.00 0.12 0.00 1.76 0.00 0.00 0.00 176.54 178.42 3i33 h SER 343 N 0.32 0.00 0.25 0.19 0.02 -1.55 -2.67 113.55 110.10 3i33 h SER 343 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3i33 h SER 343 Cb 0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.60 3i33 h SER 343 CO -0.02 0.00 0.00 0.35 -1.14 0.00 0.00 176.83 176.02 3i33 n THR 344 N -2.30 0.13 0.33 -2.27 -2.24 -0.69 -2.05 114.28 105.20 3i33 n THR 344 Ca 0.02 0.03 0.15 0.00 -2.27 0.00 0.00 64.05 61.98 3i33 n THR 344 Cb 0.25 -0.64 0.59 0.00 -2.10 0.00 0.00 70.33 68.44 3i33 n THR 344 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 3i33 h ARG 345 N 0.00 0.00 -6.27 -0.78 3.08 -1.65 -3.42 114.38 105.33 3i33 h ARG 345 Ca 0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.50 3i33 h ARG 345 Cb 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 3i33 h ARG 345 CO 0.00 0.00 1.08 0.42 -1.07 0.00 0.00 179.97 180.40 3i33 s ILE 346 N -3.50 3.55 0.28 2.04 1.01 -0.87 -4.83 121.20 118.88 3i33 s ILE 346 Ca 0.03 0.68 0.01 0.00 0.00 0.00 0.00 60.65 61.37 3i33 s ILE 346 Cb 0.09 -3.44 0.28 0.00 0.01 0.00 0.00 42.46 39.40 3i33 s ILE 346 CO 0.49 -0.06 1.82 -0.65 0.00 0.00 0.00 174.94 176.53 3i33 h PRO 347 N 9.50 0.88 -0.41 2.79 0.11 -1.87 -2.00 132.00 141.00 3i33 h PRO 347 Ca -0.40 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.58 3i33 h PRO 347 Cb 1.18 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 3i33 h PRO 347 CO 0.95 0.58 -0.08 -0.22 -0.21 0.00 0.00 178.00 179.02 3i33 h LYS 348 N 0.90 0.71 -0.42 1.05 1.63 -1.97 -0.35 116.57 118.12 3i33 h LYS 348 Ca 0.50 -0.21 -0.06 0.00 -0.85 0.00 0.00 60.65 60.03 3i33 h LYS 348 Cb 0.57 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.12 3i33 h LYS 348 CO -0.30 0.78 0.04 0.82 -3.45 0.00 0.00 179.45 177.34 3i33 h ILE 349 N 0.65 1.25 -0.69 2.00 2.04 -1.73 -0.54 117.51 120.48 3i33 h ILE 349 Ca 0.12 -0.95 0.01 0.00 1.00 0.00 0.00 64.86 65.04 3i33 h ILE 349 Cb 0.53 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.61 3i33 h ILE 349 CO 0.03 0.33 0.45 1.56 0.00 0.00 0.00 178.15 180.51 3i33 h GLN 350 N 0.56 0.88 -0.22 2.37 4.20 -1.02 -1.65 115.11 120.24 3i33 h GLN 350 Ca 0.12 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.75 3i33 h GLN 350 Cb 0.43 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 3i33 h GLN 350 CO 0.01 0.58 0.02 -0.22 -0.67 0.00 0.00 178.83 178.56 3i33 h LYS 351 N 0.91 0.37 -0.76 1.46 3.11 -0.90 -0.24 116.57 120.51 3i33 h LYS 351 Ca 0.26 -0.11 0.05 0.00 -2.81 0.00 0.00 60.65 58.04 3i33 h LYS 351 Cb -0.07 -0.04 -0.05 0.00 -1.00 0.00 0.00 32.23 31.07 3i33 h LYS 351 CO -0.07 0.53 0.46 -0.07 -2.81 0.00 0.00 179.45 177.49 3i33 h LEU 352 N 0.16 0.73 -0.13 5.20 3.38 -0.95 -0.32 115.31 123.38 3i33 h LEU 352 Ca 0.06 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 3i33 h LEU 352 Cb 0.35 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 3i33 h LEU 352 CO 0.01 0.48 -0.16 0.25 0.09 0.00 0.00 178.44 179.11 3i33 h LEU 353 N 0.86 0.36 -0.76 1.67 5.85 -1.10 -1.21 115.31 120.98 3i33 h LEU 353 Ca 0.32 -0.50 -0.03 0.00 0.84 0.00 0.00 57.88 58.52 3i33 h LEU 353 Cb 0.11 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 3i33 h LEU 353 CO -0.15 0.79 0.38 -0.61 -0.34 0.00 0.00 178.44 178.51 3i33 h GLN 354 N -0.05 1.09 -0.69 1.25 4.15 -0.96 -0.86 115.11 119.04 3i33 h GLN 354 Ca 0.02 -0.15 -0.05 0.00 0.77 0.00 0.00 58.65 59.23 3i33 h GLN 354 Cb 0.70 -0.20 -0.03 0.00 0.21 0.00 0.00 27.48 28.16 3i33 h GLN 354 CO 0.04 0.84 0.24 -0.44 -1.93 0.00 0.00 178.83 177.58 3i33 h ASP 355 N 1.07 0.98 -0.96 -0.69 3.32 -1.02 0.27 116.42 119.39 3i33 h ASP 355 Ca 0.26 -0.20 0.05 0.00 0.02 0.00 0.00 57.03 57.16 3i33 h ASP 355 Cb 0.10 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 39.34 3i33 h ASP 355 CO -0.04 0.92 0.63 0.15 -1.72 0.00 0.00 179.24 179.18 3i33 h PHE 356 N 1.00 1.17 -0.41 4.55 3.57 -0.75 -1.13 116.94 124.94 3i33 h PHE 356 Ca 0.22 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.60 3i33 h PHE 356 Cb 0.27 -0.39 -0.09 0.00 2.79 0.00 0.00 35.95 38.53 3i33 h PHE 356 CO 0.02 0.65 0.19 1.19 -2.23 0.00 0.00 178.31 178.13 3i33 n PHE 357 N -4.49 1.32 -3.08 0.41 3.72 -0.37 -4.89 117.46 110.07 3i33 n PHE 357 Ca 0.13 -0.84 -0.23 0.00 -0.05 0.00 0.00 57.45 56.47 3i33 n PHE 357 Cb 0.12 -0.48 0.04 0.00 -0.94 0.00 0.00 39.48 38.22 3i33 n PHE 357 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3i33 n ASN 358 N -0.06 -5.99 0.00 4.37 3.02 -0.43 -2.09 115.26 114.08 3i33 n ASN 358 Ca 0.23 -0.31 0.00 0.00 -0.03 0.00 0.00 54.58 54.47 3i33 n ASN 358 Cb 0.94 -4.84 0.00 0.00 -0.61 0.00 0.00 39.78 35.27 3i33 n ASN 358 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3i33 n GLY 359 N -1.53 0.81 3.74 7.41 0.00 0.03 -5.01 105.19 110.63 3i33 n GLY 359 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 3i33 n GLY 359 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3i33 s LYS 360 N -0.52 4.13 0.34 1.61 2.20 -0.89 -4.92 119.74 121.69 3i33 s LYS 360 Ca 0.00 2.57 -0.28 0.00 -0.36 0.00 0.00 55.97 57.89 3i33 s LYS 360 Cb 0.00 -3.04 -0.10 0.00 -1.51 0.00 0.00 37.83 33.18 3i33 s LYS 360 CO 0.00 -0.65 1.29 -1.21 -0.36 0.00 0.00 175.35 174.42 3i33 s GLU 361 N -0.09 4.32 0.10 4.03 2.02 -1.26 -4.77 118.70 123.05 3i33 s GLU 361 Ca 0.66 2.18 -0.10 0.00 0.02 0.00 0.00 54.97 57.72 3i33 s GLU 361 Cb -0.48 -3.03 -0.06 0.00 0.10 0.00 0.00 34.13 30.66 3i33 s GLU 361 CO 0.44 -0.20 0.43 -0.51 0.02 0.00 0.00 175.26 175.44 3i33 s LEU 362 N -1.86 4.33 -0.42 1.80 1.43 -1.26 -4.69 118.68 118.00 3i33 s LEU 362 Ca 0.50 0.83 -0.29 0.00 -1.03 0.00 0.00 54.13 54.14 3i33 s LEU 362 Cb -0.39 -3.10 0.03 0.00 0.03 0.00 0.00 46.19 42.76 3i33 s LEU 362 CO 0.51 0.14 1.10 0.20 0.23 0.00 0.00 176.35 178.53 3i33 s ASN 363 N -1.84 6.73 0.00 2.29 0.01 0.35 -4.80 114.94 117.68 3i33 s ASN 363 Ca 0.35 0.65 0.01 0.00 -0.71 0.00 0.00 52.86 53.16 3i33 s ASN 363 Cb -0.14 -2.54 0.01 0.00 0.41 0.00 0.00 41.25 38.99 3i33 s ASN 363 CO 0.19 -1.11 0.83 2.29 -1.51 0.00 0.00 177.10 177.79 3i33 n LYS 364 N 7.46 0.00 0.24 -0.60 2.85 -1.26 -1.58 118.16 125.27 3i33 n LYS 364 Ca 0.12 -0.68 0.13 0.00 -1.05 0.00 0.00 58.31 56.82 3i33 n LYS 364 Cb 0.48 -0.30 0.43 0.00 -0.65 0.00 0.00 35.03 35.00 3i33 n LYS 364 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3i33 h SER 365 N 0.03 0.00 -3.39 -5.58 4.64 -1.96 -3.41 113.55 103.89 3i33 h SER 365 Ca -0.02 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.71 3i33 h SER 365 Cb 1.28 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.27 3i33 h SER 365 CO -0.00 0.09 -0.20 -0.63 -0.87 0.00 0.00 176.83 175.22 3i33 s ILE 366 N -3.48 5.22 -0.39 0.95 1.01 -1.26 -5.01 121.20 118.24 3i33 s ILE 366 Ca 0.03 0.76 -0.43 0.00 0.00 0.00 0.00 60.65 61.00 3i33 s ILE 366 Cb 0.08 -3.74 -0.18 0.00 0.01 0.00 0.00 42.46 38.63 3i33 s ILE 366 CO 0.62 0.30 1.72 0.59 0.00 0.00 0.00 174.94 178.16 3i33 n ASN 367 N 4.05 1.77 0.14 3.58 3.02 -1.26 -4.77 115.26 121.79 3i33 n ASN 367 Ca -0.09 1.08 0.05 0.00 -0.03 0.00 0.00 54.58 55.60 3i33 n ASN 367 Cb 0.51 -1.01 0.49 0.00 -0.61 0.00 0.00 39.78 39.16 3i33 n ASN 367 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 3i33 h PRO 368 N 6.49 0.23 0.00 3.52 0.11 -1.85 0.28 132.00 140.77 3i33 h PRO 368 Ca -0.43 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3i33 h PRO 368 Cb 1.35 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3i33 h PRO 368 CO 0.98 0.23 0.00 -0.40 -0.21 0.00 0.00 178.00 178.60 3i33 n ASP 369 N -4.42 0.00 -0.00 -2.05 5.75 -1.26 -1.13 116.55 113.44 3i33 n ASP 369 Ca -0.01 -0.29 0.04 0.00 -0.01 0.00 0.00 54.79 54.53 3i33 n ASP 369 Cb 0.15 -0.20 -0.05 0.00 -1.03 0.00 0.00 41.12 39.98 3i33 n ASP 369 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3i33 n GLU 370 N -1.20 3.75 -0.12 0.11 1.02 0.03 -4.78 120.64 119.45 3i33 n GLU 370 Ca 0.14 -0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.25 3i33 n GLU 370 Cb 0.17 -0.95 0.20 0.00 -0.02 0.00 0.00 31.44 30.84 3i33 n GLU 370 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3i33 h ALA 371 N 1.28 1.24 -0.06 0.62 0.00 -1.38 0.29 119.26 121.26 3i33 h ALA 371 Ca 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 3i33 h ALA 371 Cb 0.23 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3i33 h ALA 371 CO 0.00 0.53 0.00 0.28 0.00 0.00 0.00 179.25 180.06 3i33 h VAL 372 N 0.79 1.25 -0.73 0.00 2.07 -1.86 -1.39 116.25 116.37 3i33 h VAL 372 Ca 0.18 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.92 3i33 h VAL 372 Cb 0.27 1.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.66 3i33 h VAL 372 CO -0.00 0.21 0.42 0.00 0.02 0.00 0.00 177.57 178.21 3i33 h ALA 373 N 0.72 1.36 0.11 1.67 0.00 -1.76 -0.90 119.26 120.45 3i33 h ALA 373 Ca 0.02 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3i33 h ALA 373 Cb 0.33 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3i33 h ALA 373 CO 0.00 0.53 -0.09 -0.92 0.00 0.00 0.00 179.25 178.77 3i33 h TYR 374 N 1.01 -0.24 -0.39 0.00 5.03 -0.77 0.54 116.97 122.14 3i33 h TYR 374 Ca 0.26 0.00 -0.08 0.00 2.58 0.00 0.00 58.73 61.49 3i33 h TYR 374 Cb -0.00 0.09 -0.02 0.00 1.55 0.00 0.00 36.73 38.35 3i33 h TYR 374 CO 0.01 -0.15 -0.10 0.78 -1.32 0.00 0.00 178.16 177.38 3i33 h GLY 375 N -0.21 0.73 1.14 1.82 0.00 -0.99 -1.55 103.07 104.01 3i33 h GLY 375 Ca 0.00 -0.53 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 3i33 h GLY 375 CO -0.02 0.49 0.42 0.00 0.00 0.00 0.00 176.54 177.42 3i33 h ALA 376 N 1.27 1.23 -0.50 3.60 0.00 -0.87 -0.92 119.26 123.07 3i33 h ALA 376 Ca 0.11 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 3i33 h ALA 376 Cb 0.53 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3i33 h ALA 376 CO 0.03 0.61 -0.07 0.00 0.00 0.00 0.00 179.25 179.82 3i33 h ALA 377 N 1.33 0.68 -0.05 0.00 0.00 -0.34 -0.31 119.26 120.59 3i33 h ALA 377 Ca 0.28 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.87 3i33 h ALA 377 Cb 0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3i33 h ALA 377 CO -0.04 0.56 -0.02 0.28 0.00 0.00 0.00 179.25 180.03 3i33 h VAL 378 N 0.79 0.93 -0.83 0.00 2.07 -1.06 -2.12 116.25 116.04 3i33 h VAL 378 Ca 0.13 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.69 3i33 h VAL 378 Cb 0.62 0.93 -0.05 0.00 -1.52 0.00 0.00 31.29 31.27 3i33 h VAL 378 CO 0.04 0.00 0.53 -0.61 0.02 0.00 0.00 177.57 177.55 3i33 h GLN 379 N -0.02 0.98 -0.62 1.57 5.75 -0.99 -1.81 115.11 119.98 3i33 h GLN 379 Ca 0.03 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.43 3i33 h GLN 379 Cb 0.05 -0.22 -0.03 0.00 1.07 0.00 0.00 27.48 28.35 3i33 h GLN 379 CO -0.06 0.65 0.25 0.00 -2.65 0.00 0.00 178.83 177.02 3i33 h ALA 380 N 1.36 0.80 -0.70 3.38 0.00 -0.84 -1.04 119.26 122.22 3i33 h ALA 380 Ca 0.34 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 3i33 h ALA 380 Cb 0.05 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 3i33 h ALA 380 CO -0.13 0.41 0.23 0.00 0.00 0.00 0.00 179.25 179.76 3i33 h ALA 381 N 1.10 0.92 -0.60 0.00 0.00 -0.97 -0.65 119.26 119.06 3i33 h ALA 381 Ca 0.21 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3i33 h ALA 381 Cb 0.20 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3i33 h ALA 381 CO -0.02 0.59 0.37 0.82 0.00 0.00 0.00 179.25 181.02 3i33 h ILE 382 N 1.03 1.17 0.00 0.00 2.04 -0.93 -2.64 117.51 118.19 3i33 h ILE 382 Ca 0.23 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.71 3i33 h ILE 382 Cb 0.29 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 3i33 h ILE 382 CO -0.01 0.18 0.00 -0.07 0.00 0.00 0.00 178.15 178.25 3i33 h LEU 383 N 0.82 0.00 0.00 1.44 3.38 -0.82 -3.51 115.31 116.62 3i33 h LEU 383 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3i33 h LEU 383 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3i33 h LEU 383 CO -0.04 0.00 0.00 -0.38 0.09 0.00 0.00 178.44 178.11