#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h42 s VAL 10 N 0.00 4.50 0.06 5.18 1.01 -1.26 -5.01 120.40 124.87 1h42 s VAL 10 Ca 0.00 1.80 -0.31 0.00 0.00 0.00 0.00 61.98 63.48 1h42 s VAL 10 Cb 0.00 -4.16 -0.06 0.00 0.00 0.00 0.00 36.38 32.15 1h42 s VAL 10 CO 0.00 -0.12 1.36 -2.16 0.00 0.00 0.00 175.10 174.18 1h42 s PRO 11 N 3.04 4.32 -0.04 2.72 0.04 -1.26 -5.02 135.00 138.80 1h42 s PRO 11 Ca 0.50 1.98 -0.03 0.00 0.04 0.00 0.00 61.00 63.49 1h42 s PRO 11 Cb -0.19 -3.41 0.02 0.00 0.04 0.00 0.00 34.50 30.96 1h42 s PRO 11 CO 0.13 -0.47 0.09 0.14 0.04 0.00 0.00 177.00 176.93 1h42 s VAL 12 N 1.66 -0.01 -1.42 -0.36 -7.23 -1.26 -4.71 120.40 107.06 1h42 s VAL 12 Ca 0.63 0.05 -0.04 0.00 -1.81 0.00 0.00 61.98 60.82 1h42 s VAL 12 Cb -0.33 -0.14 0.03 0.00 0.56 0.00 0.00 36.38 36.49 1h42 s VAL 12 CO 0.28 0.02 0.65 0.59 -0.31 0.00 0.00 175.10 176.34 1h42 n ASN 13 N 3.36 -1.67 0.20 4.85 3.02 0.81 -4.80 115.26 121.03 1h42 n ASN 13 Ca -0.16 -0.90 0.06 0.00 -0.03 0.00 0.00 54.58 53.55 1h42 n ASN 13 Cb 0.57 -3.54 0.42 0.00 -0.61 0.00 0.00 39.78 36.62 1h42 n ASN 13 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1h42 h LEU 14 N -1.86 0.00 -8.24 3.41 3.38 -1.12 -3.43 115.31 107.45 1h42 h LEU 14 Ca -0.61 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 56.95 1h42 h LEU 14 Cb 1.37 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 41.87 1h42 h LEU 14 CO 0.62 0.33 -0.78 -0.31 0.09 0.00 0.00 178.44 178.39 1h42 s TYR 15 N -3.91 1.05 0.15 1.13 2.02 -0.63 -4.97 117.35 112.20 1h42 s TYR 15 Ca -0.01 -0.33 0.05 0.00 -0.37 0.00 0.00 57.07 56.41 1h42 s TYR 15 Cb 0.13 -0.63 -0.04 0.00 -0.40 0.00 0.00 41.96 41.01 1h42 s TYR 15 CO 0.68 0.01 -0.12 1.03 -1.57 0.00 0.00 175.55 175.58 1h42 s ARG 16 N -0.99 1.11 0.45 -0.62 0.52 -1.26 -0.28 118.95 117.88 1h42 s ARG 16 Ca 0.00 -1.44 0.27 0.00 -0.52 0.00 0.00 55.73 54.04 1h42 s ARG 16 Cb -0.07 -0.79 1.45 0.00 0.52 0.00 0.00 34.95 36.06 1h42 s ARG 16 CO 0.01 0.12 1.80 -1.00 0.02 0.00 0.00 175.30 176.24 1h42 h PRO 17 N 2.88 0.00 0.00 3.54 0.13 -1.98 -1.82 132.00 134.75 1h42 h PRO 17 Ca -0.38 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.62 1h42 h PRO 17 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 1h42 h PRO 17 CO 0.60 0.00 -0.88 -2.95 -0.23 0.00 0.00 178.00 174.54 1h42 h ASN 18 N 0.00 0.00 -1.78 1.44 -1.07 -2.01 -3.39 115.58 108.77 1h42 h ASN 18 Ca 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 56.30 55.85 1h42 h ASN 18 Cb 0.20 0.00 -0.36 0.00 -2.07 0.00 0.00 38.32 36.09 1h42 h ASN 18 CO 0.00 0.57 -1.04 0.00 0.07 0.00 0.00 177.43 177.03 1h42 n ALA 19 N -2.30 2.00 -1.53 4.14 0.00 -0.72 -5.15 120.51 116.95 1h42 n ALA 19 Ca -0.03 -3.18 -0.29 0.00 0.00 0.00 0.00 53.44 49.95 1h42 n ALA 19 Cb 0.79 -0.87 0.13 0.00 0.00 0.00 0.00 19.45 19.50 1h42 n ALA 19 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1h42 s PRO 20 N -0.98 1.36 0.04 0.00 0.04 -1.02 -4.09 135.00 130.35 1h42 s PRO 20 Ca 0.35 0.39 -0.30 0.00 0.04 0.00 0.00 61.00 61.48 1h42 s PRO 20 Cb 0.18 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.82 1h42 s PRO 20 CO -0.12 -2.07 0.98 0.12 0.04 0.00 0.00 177.00 175.95 1h42 s PHE 21 N -3.24 3.70 -0.64 0.56 5.36 0.51 -4.84 117.98 119.39 1h42 s PHE 21 Ca 0.63 1.72 -0.19 0.00 -0.96 0.00 0.00 56.93 58.13 1h42 s PHE 21 Cb -0.15 -3.11 0.11 0.00 -0.34 0.00 0.00 43.02 39.53 1h42 s PHE 21 CO 0.54 0.02 0.78 0.42 -1.46 0.00 0.00 175.22 175.52 1h42 s ILE 22 N 0.69 4.80 0.17 3.12 -1.09 -1.26 0.02 121.20 127.65 1h42 s ILE 22 Ca 0.51 -1.06 0.04 0.00 -2.23 0.00 0.00 60.65 57.91 1h42 s ILE 22 Cb -0.22 -4.54 -0.04 0.00 -1.58 0.00 0.00 42.46 36.09 1h42 s ILE 22 CO 0.29 -1.20 0.21 -0.83 -1.23 0.00 0.00 174.94 172.18 1h42 s GLY 23 N 3.56 1.65 -0.13 6.18 0.00 -0.38 -4.89 107.32 113.31 1h42 s GLY 23 Ca 0.15 -1.16 -0.07 0.00 0.00 0.00 0.00 44.72 43.64 1h42 s GLY 23 CO 0.04 -1.17 0.11 0.54 0.00 0.00 0.00 173.10 172.63 1h42 s LYS 24 N -3.27 3.55 0.13 2.90 1.02 -1.24 -0.02 119.74 122.80 1h42 s LYS 24 Ca 0.33 -0.21 -0.31 0.00 0.02 0.00 0.00 55.97 55.80 1h42 s LYS 24 Cb -0.10 -3.17 -0.09 0.00 -0.52 0.00 0.00 37.83 33.95 1h42 s LYS 24 CO 0.26 0.64 1.47 0.08 -0.92 0.00 0.00 175.35 176.88 1h42 s VAL 25 N -0.65 3.04 -0.24 3.17 1.01 -0.55 0.30 120.40 126.47 1h42 s VAL 25 Ca 0.12 0.73 -0.18 0.00 0.00 0.00 0.00 61.98 62.65 1h42 s VAL 25 Cb -0.12 -3.47 -0.16 0.00 0.00 0.00 0.00 36.38 32.64 1h42 s VAL 25 CO 0.02 0.05 -0.05 -0.38 0.00 0.00 0.00 175.10 174.75 1h42 n ILE 26 N 4.02 1.53 -3.84 2.22 5.41 0.37 -1.15 119.36 127.92 1h42 n ILE 26 Ca 0.13 -0.19 -0.11 0.00 1.00 0.00 0.00 62.75 63.57 1h42 n ILE 26 Cb 0.41 -1.97 -0.09 0.00 -0.71 0.00 0.00 39.64 37.28 1h42 n ILE 26 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1h42 s SER 27 N -7.15 -0.02 -0.31 4.38 1.04 -1.18 -4.72 113.70 105.74 1h42 s SER 27 Ca -0.33 -0.18 -0.03 0.00 0.48 0.00 0.00 55.95 55.89 1h42 s SER 27 Cb 0.10 0.25 0.11 0.00 0.10 0.00 0.00 66.02 66.58 1h42 s SER 27 CO 0.54 -0.43 0.16 0.21 0.98 0.00 0.00 173.24 174.70 1h42 s ASN 28 N -1.55 3.31 -0.02 7.02 3.04 -1.26 -1.52 114.94 123.96 1h42 s ASN 28 Ca -0.12 -1.57 0.03 0.00 0.04 0.00 0.00 52.86 51.24 1h42 s ASN 28 Cb -0.05 -0.34 -0.03 0.00 -1.54 0.00 0.00 41.25 39.28 1h42 s ASN 28 CO 0.01 -0.40 -0.10 -1.61 -3.04 0.00 0.00 177.10 171.96 1h42 s GLU 29 N 1.77 2.53 0.25 0.43 2.02 -0.41 -4.97 118.70 120.31 1h42 s GLU 29 Ca 0.12 -0.70 -0.30 0.00 0.02 0.00 0.00 54.97 54.11 1h42 s GLU 29 Cb -0.18 -2.45 -0.09 0.00 0.10 0.00 0.00 34.13 31.51 1h42 s GLU 29 CO -0.25 0.62 1.12 -1.25 0.02 0.00 0.00 175.26 175.52 1h42 s PRO 30 N -1.09 4.61 -0.16 0.39 0.04 -1.26 -0.82 135.00 136.71 1h42 s PRO 30 Ca 0.14 1.80 0.11 0.00 0.04 0.00 0.00 61.00 63.09 1h42 s PRO 30 Cb -0.11 -3.21 -0.17 0.00 0.04 0.00 0.00 34.50 31.04 1h42 s PRO 30 CO 0.04 0.14 0.00 1.28 0.04 0.00 0.00 177.00 178.50 1h42 n LEU 31 N 1.61 0.69 -4.63 -3.56 4.77 -0.08 -4.85 117.00 110.95 1h42 n LEU 31 Ca 0.00 -0.02 -0.43 0.00 -0.03 0.00 0.00 56.01 55.53 1h42 n LEU 31 Cb 0.45 0.13 -0.02 0.00 -2.33 0.00 0.00 43.42 41.65 1h42 n LEU 31 CO 0.54 0.48 1.09 -0.69 -1.33 0.00 0.00 177.39 177.48 1h42 s VAL 32 N -2.37 4.22 0.78 4.08 1.01 -1.22 -4.67 120.40 122.22 1h42 s VAL 32 Ca -0.12 1.37 -0.11 0.00 0.00 0.00 0.00 61.98 63.11 1h42 s VAL 32 Cb 0.05 -4.27 0.06 0.00 0.00 0.00 0.00 36.38 32.22 1h42 s VAL 32 CO 0.58 -0.55 1.10 -0.54 0.00 0.00 0.00 175.10 175.69 1h42 s LYS 33 N 4.12 2.26 0.14 2.72 -0.14 -0.72 -4.94 119.74 123.20 1h42 s LYS 33 Ca 0.53 0.57 -0.33 0.00 -1.36 0.00 0.00 55.97 55.39 1h42 s LYS 33 Cb -0.14 -1.94 -0.12 0.00 -1.68 0.00 0.00 37.83 33.94 1h42 s LYS 33 CO 0.23 -1.48 1.70 -0.85 -0.76 0.00 0.00 175.35 174.19 1h42 n GLU 34 N -3.33 2.47 0.00 1.68 0.28 -1.26 -2.23 120.64 118.25 1h42 n GLU 34 Ca 0.07 0.89 0.00 0.00 -0.16 0.00 0.00 57.16 57.96 1h42 n GLU 34 Cb 0.57 -2.72 0.00 0.00 1.43 0.00 0.00 31.44 30.72 1h42 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1h42 n GLY 35 N 3.84 0.47 3.98 -1.84 0.00 -1.26 -4.82 105.19 105.56 1h42 n GLY 35 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 1h42 n GLY 35 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h42 s GLY 36 N -1.63 1.76 -0.21 -0.02 0.00 -0.95 -4.86 107.32 101.42 1h42 s GLY 36 Ca 0.00 -1.59 -0.07 0.00 0.00 0.00 0.00 44.72 43.05 1h42 s GLY 36 CO 0.00 -1.03 0.07 -0.42 0.00 0.00 0.00 173.10 171.72 1h42 s ILE 37 N -3.21 4.63 0.00 0.90 1.01 -1.26 -5.02 121.20 118.24 1h42 s ILE 37 Ca 0.66 -0.08 0.00 0.00 0.00 0.00 0.00 60.65 61.23 1h42 s ILE 37 Cb -0.06 -3.11 0.00 0.00 0.01 0.00 0.00 42.46 39.30 1h42 s ILE 37 CO 0.45 0.41 0.00 0.61 0.00 0.00 0.00 174.94 176.41 1h42 n GLY 38 N 4.02 -2.39 3.10 6.18 0.00 -1.26 -4.90 105.19 109.94 1h42 n GLY 38 Ca -0.16 -1.57 -0.32 0.00 0.00 0.00 0.00 46.02 43.97 1h42 n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h42 s ILE 39 N -0.87 1.86 -0.08 -0.61 1.01 -1.26 -4.88 121.20 116.37 1h42 s ILE 39 Ca 0.00 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 59.84 1h42 s ILE 39 Cb 0.00 -1.69 0.01 0.00 0.01 0.00 0.00 42.46 40.79 1h42 s ILE 39 CO 0.00 0.51 -0.14 -0.69 0.00 0.00 0.00 174.94 174.61 1h42 s VAL 40 N 1.19 1.35 -0.00 2.92 1.01 -1.26 -1.09 120.40 124.51 1h42 s VAL 40 Ca 0.01 -0.59 0.08 0.00 0.00 0.00 0.00 61.98 61.48 1h42 s VAL 40 Cb -0.14 -1.22 -0.02 0.00 0.00 0.00 0.00 36.38 35.00 1h42 s VAL 40 CO -0.08 0.40 -0.26 -1.10 0.00 0.00 0.00 175.10 174.06 1h42 s GLN 41 N 0.71 2.04 -0.40 2.72 -1.52 -0.34 -0.91 119.66 121.96 1h42 s GLN 41 Ca -0.13 -0.97 -0.21 0.00 -1.95 0.00 0.00 55.36 52.09 1h42 s GLN 41 Cb -0.16 -2.03 0.01 0.00 -0.22 0.00 0.00 33.01 30.62 1h42 s GLN 41 CO 0.03 0.55 0.69 -1.58 -0.25 0.00 0.00 175.29 174.73 1h42 s HIS 42 N -0.66 3.09 -0.18 0.91 5.65 -0.00 -1.35 115.29 122.76 1h42 s HIS 42 Ca 0.10 0.23 -0.00 0.00 0.25 0.00 0.00 55.06 55.64 1h42 s HIS 42 Cb -0.10 -3.33 0.00 0.00 -1.18 0.00 0.00 32.58 27.97 1h42 s HIS 42 CO -0.00 -0.77 -0.15 0.42 -0.65 0.00 0.00 174.74 173.59 1h42 s ILE 43 N 2.90 2.61 -0.13 0.89 1.01 -0.64 -1.29 121.20 126.56 1h42 s ILE 43 Ca 0.26 -0.77 -0.03 0.00 0.00 0.00 0.00 60.65 60.11 1h42 s ILE 43 Cb -0.14 -2.12 -0.03 0.00 0.01 0.00 0.00 42.46 40.18 1h42 s ILE 43 CO 0.18 0.50 -0.02 -0.75 0.00 0.00 0.00 174.94 174.85 1h42 s LYS 44 N 1.10 3.41 0.15 2.79 2.20 -0.57 -0.89 119.74 127.92 1h42 s LYS 44 Ca 0.00 -0.48 0.11 0.00 -0.36 0.00 0.00 55.97 55.24 1h42 s LYS 44 Cb -0.14 -2.87 -0.04 0.00 -1.51 0.00 0.00 37.83 33.27 1h42 s LYS 44 CO -0.05 0.41 -0.23 -0.06 -0.36 0.00 0.00 175.35 175.06 1h42 s PHE 45 N -0.10 2.38 -0.12 4.03 0.40 0.22 -0.48 117.98 124.31 1h42 s PHE 45 Ca 0.03 -0.34 -0.19 0.00 -0.60 0.00 0.00 56.93 55.83 1h42 s PHE 45 Cb -0.13 -1.24 -0.04 0.00 0.51 0.00 0.00 43.02 42.12 1h42 s PHE 45 CO 0.02 0.40 0.53 0.34 0.70 0.00 0.00 175.22 177.21 1h42 s ASP 46 N -2.29 6.73 0.00 1.36 -1.08 0.15 -2.32 116.67 119.21 1h42 s ASP 46 Ca 0.17 0.87 0.15 0.00 -0.52 0.00 0.00 52.55 53.22 1h42 s ASP 46 Cb -0.09 -2.31 0.21 0.00 -1.46 0.00 0.00 42.92 39.27 1h42 s ASP 46 CO 0.08 -0.05 1.09 0.18 0.52 0.00 0.00 175.17 177.00 1h42 n LEU 47 N 3.86 2.57 -4.77 -1.34 4.77 0.24 -3.65 117.00 118.69 1h42 n LEU 47 Ca -0.06 -1.33 -0.39 0.00 -0.03 0.00 0.00 56.01 54.20 1h42 n LEU 47 Cb 0.51 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.48 1h42 n LEU 47 CO 0.44 0.54 0.87 0.42 -1.33 0.00 0.00 177.39 178.32 1h42 s THR 48 N -1.16 3.07 0.00 -5.08 -4.23 -1.25 -2.94 115.64 104.05 1h42 s THR 48 Ca 0.22 0.94 0.00 0.00 -1.18 0.00 0.00 61.69 61.67 1h42 s THR 48 Cb 0.14 -3.55 0.00 0.00 1.34 0.00 0.00 72.50 70.43 1h42 s THR 48 CO 0.19 0.13 0.00 0.61 -0.54 0.00 0.00 174.62 175.01 1h42 n GLY 49 N 0.72 2.53 1.38 3.99 0.00 -1.26 -5.00 105.19 107.55 1h42 n GLY 49 Ca 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.98 1h42 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h42 n GLY 50 N -1.58 3.23 1.23 -0.02 0.00 -1.15 -5.09 105.19 101.80 1h42 n GLY 50 Ca 0.00 -1.65 -0.07 0.00 0.00 0.00 0.00 46.02 44.30 1h42 n GLY 50 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1h42 n ASN 51 N -2.24 3.06 -4.57 1.61 6.94 -1.26 -5.00 115.26 113.80 1h42 n ASN 51 Ca 0.02 -3.83 -0.40 0.00 -0.02 0.00 0.00 54.58 50.35 1h42 n ASN 51 Cb 0.25 -0.54 -0.03 0.00 -2.36 0.00 0.00 39.78 37.11 1h42 n ASN 51 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 1h42 s LEU 52 N -3.37 3.37 0.11 -4.53 1.98 -1.26 -4.98 118.68 110.01 1h42 s LEU 52 Ca 0.45 0.64 0.05 0.00 -2.89 0.00 0.00 54.13 52.39 1h42 s LEU 52 Cb 0.40 -2.87 -0.04 0.00 0.66 0.00 0.00 46.19 44.34 1h42 s LEU 52 CO -0.02 -2.13 0.01 -0.54 -1.89 0.00 0.00 176.35 171.78 1h42 s LYS 53 N 6.53 2.55 0.13 1.98 -0.14 -1.26 -5.04 119.74 124.48 1h42 s LYS 53 Ca 0.71 -0.89 -0.17 0.00 -1.36 0.00 0.00 55.97 54.26 1h42 s LYS 53 Cb -0.15 -2.52 0.04 0.00 -1.68 0.00 0.00 37.83 33.52 1h42 s LYS 53 CO 0.25 0.52 0.43 1.52 -0.76 0.00 0.00 175.35 177.31 1h42 s TYR 54 N -1.42 -0.26 0.41 3.18 1.13 -1.26 -4.53 117.35 114.60 1h42 s TYR 54 Ca 0.26 -0.04 0.01 0.00 -1.41 0.00 0.00 57.07 55.89 1h42 s TYR 54 Cb -0.11 0.31 -0.00 0.00 -1.10 0.00 0.00 41.96 41.05 1h42 s TYR 54 CO 0.19 -0.72 0.03 0.44 -2.51 0.00 0.00 175.55 172.98 1h42 n ILE 55 N -0.24 0.00 -2.39 -3.49 -5.35 -1.26 -4.34 119.36 102.29 1h42 n ILE 55 Ca -0.16 -2.03 -0.41 0.00 -0.27 0.00 0.00 62.75 59.88 1h42 n ILE 55 Cb 0.64 0.49 -0.03 0.00 -1.74 0.00 0.00 39.64 39.00 1h42 n ILE 55 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1h42 s GLU 56 N -3.49 4.49 0.00 6.28 8.01 -1.26 -3.09 118.70 129.65 1h42 s GLU 56 Ca 0.05 1.86 0.00 0.00 0.01 0.00 0.00 54.97 56.89 1h42 s GLU 56 Cb 0.00 -3.25 0.00 0.00 -4.31 0.00 0.00 34.13 26.57 1h42 s GLU 56 CO 0.03 -0.09 0.00 0.41 0.01 0.00 0.00 175.26 175.63 1h42 n GLY 57 N 2.25 0.69 3.92 -1.39 0.00 -1.26 -4.26 105.19 105.13 1h42 n GLY 57 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 1h42 n GLY 57 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h42 s GLN 58 N -0.77 1.94 0.25 1.61 -0.21 -1.18 -4.37 119.66 116.93 1h42 s GLN 58 Ca 0.00 -0.16 0.10 0.00 0.02 0.00 0.00 55.36 55.32 1h42 s GLN 58 Cb 0.00 -2.06 -0.05 0.00 1.00 0.00 0.00 33.01 31.90 1h42 s GLN 58 CO 0.00 -1.50 -0.18 -1.12 -2.12 0.00 0.00 175.29 170.37 1h42 s SER 59 N -4.59 3.22 0.14 5.90 0.01 0.23 -1.44 113.70 117.18 1h42 s SER 59 Ca 0.62 -1.02 0.08 0.00 1.31 0.00 0.00 55.95 56.94 1h42 s SER 59 Cb -0.10 -0.24 -0.04 0.00 0.21 0.00 0.00 66.02 65.85 1h42 s SER 59 CO 0.47 -0.04 -0.18 0.27 0.41 0.00 0.00 173.24 174.18 1h42 s ILE 60 N -2.66 1.69 0.07 1.44 -4.36 0.14 -0.75 121.20 116.76 1h42 s ILE 60 Ca 0.27 -1.81 -0.14 0.00 -0.26 0.00 0.00 60.65 58.72 1h42 s ILE 60 Cb -0.04 -1.72 -0.06 0.00 1.25 0.00 0.00 42.46 41.89 1h42 s ILE 60 CO 0.12 -0.29 0.46 -0.83 0.24 0.00 0.00 174.94 174.63 1h42 s GLY 61 N -2.49 2.45 -0.15 6.27 0.00 -0.43 0.06 107.32 113.03 1h42 s GLY 61 Ca 0.13 -0.22 0.01 0.00 0.00 0.00 0.00 44.72 44.64 1h42 s GLY 61 CO 0.05 0.08 -0.19 -0.42 0.00 0.00 0.00 173.10 172.63 1h42 s ILE 62 N -1.28 2.32 -0.39 0.90 -1.09 -0.35 -1.19 121.20 120.11 1h42 s ILE 62 Ca 0.31 -0.89 -0.17 0.00 -2.23 0.00 0.00 60.65 57.67 1h42 s ILE 62 Cb -0.16 -1.95 0.01 0.00 -1.58 0.00 0.00 42.46 38.78 1h42 s ILE 62 CO 0.17 0.53 0.42 -0.63 -1.23 0.00 0.00 174.94 174.21 1h42 s ILE 63 N 0.86 5.10 0.57 2.92 1.01 -0.88 -1.73 121.20 129.05 1h42 s ILE 63 Ca -0.05 -0.19 -0.17 0.00 0.00 0.00 0.00 60.65 60.24 1h42 s ILE 63 Cb -0.15 -3.98 -0.05 0.00 0.01 0.00 0.00 42.46 38.29 1h42 s ILE 63 CO -0.02 -0.32 1.05 -2.16 0.00 0.00 0.00 174.94 173.49 1h42 s PRO 64 N 2.13 3.41 0.69 2.79 0.04 -1.26 -4.38 135.00 138.42 1h42 s PRO 64 Ca 0.13 1.23 -0.11 0.00 0.04 0.00 0.00 61.00 62.28 1h42 s PRO 64 Cb -0.17 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.33 1h42 s PRO 64 CO 0.13 -0.74 1.07 -1.25 0.04 0.00 0.00 177.00 176.25 1h42 s PRO 65 N -3.93 3.00 2.05 0.56 0.04 -1.26 -4.58 135.00 130.88 1h42 s PRO 65 Ca 0.64 0.67 0.00 0.00 0.04 0.00 0.00 61.00 62.35 1h42 s PRO 65 Cb -0.16 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.36 1h42 s PRO 65 CO 0.34 -0.98 0.00 0.41 0.04 0.00 0.00 177.00 176.80 1h42 n GLY 66 N -2.61 -1.44 3.48 0.56 0.00 -1.26 -4.86 105.19 99.06 1h42 n GLY 66 Ca 0.07 -1.30 -0.23 0.00 0.00 0.00 0.00 46.02 44.55 1h42 n GLY 66 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1h42 s VAL 67 N 0.00 2.03 0.00 1.61 -7.23 -1.26 -2.70 120.40 112.84 1h42 s VAL 67 Ca 0.00 -2.21 0.00 0.00 -1.81 0.00 0.00 61.98 57.96 1h42 s VAL 67 Cb 0.00 -2.48 0.00 0.00 0.56 0.00 0.00 36.38 34.46 1h42 s VAL 67 CO 0.00 -0.29 0.00 -0.90 -0.31 0.00 0.00 175.10 173.60 1h42 n ASP 68 N -0.66 0.00 0.16 4.85 5.68 -0.34 -4.84 116.55 121.40 1h42 n ASP 68 Ca -0.05 -0.65 0.13 0.00 -0.50 0.00 0.00 54.79 53.72 1h42 n ASP 68 Cb 0.63 0.00 0.51 0.00 -1.14 0.00 0.00 41.12 41.12 1h42 n ASP 68 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1h42 h LYS 69 N 0.00 0.00 -0.30 0.11 2.10 -2.02 -2.60 116.57 113.86 1h42 h LYS 69 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1h42 h LYS 69 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1h42 h LYS 69 CO 0.00 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.54 1h42 n ASN 70 N -2.42 3.31 0.00 7.07 3.02 -1.26 -4.95 115.26 120.02 1h42 n ASN 70 Ca 0.02 -1.98 0.00 0.00 -0.03 0.00 0.00 54.58 52.60 1h42 n ASN 70 Cb 0.27 -0.19 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 1h42 n ASN 70 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h42 n GLY 71 N 1.42 0.82 3.83 7.41 0.00 -0.98 -5.05 105.19 112.64 1h42 n GLY 71 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 1h42 n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h42 s LYS 72 N -0.31 4.10 0.32 1.61 -0.14 -1.26 -4.75 119.74 119.32 1h42 s LYS 72 Ca 0.00 0.64 -0.28 0.00 -1.36 0.00 0.00 55.97 54.97 1h42 s LYS 72 Cb 0.00 -3.05 -0.13 0.00 -1.68 0.00 0.00 37.83 32.97 1h42 s LYS 72 CO 0.00 0.54 1.21 -2.30 -0.76 0.00 0.00 175.35 174.04 1h42 n PRO 73 N 1.18 1.89 -2.19 -1.68 -0.02 -1.26 -1.19 135.00 131.73 1h42 n PRO 73 Ca -0.07 0.66 -0.41 0.00 -2.02 0.00 0.00 63.50 61.67 1h42 n PRO 73 Cb 0.51 -2.18 -0.03 0.00 -0.02 0.00 0.00 33.50 31.78 1h42 n PRO 73 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1h42 s GLU 74 N -1.76 4.41 0.71 -0.52 0.41 -1.10 -4.77 118.70 116.07 1h42 s GLU 74 Ca 0.57 2.13 -0.10 0.00 -0.41 0.00 0.00 54.97 57.15 1h42 s GLU 74 Cb -0.61 -3.11 0.03 0.00 -1.78 0.00 0.00 34.13 28.66 1h42 s GLU 74 CO 0.61 -0.14 1.08 0.15 -0.49 0.00 0.00 175.26 176.48 1h42 s LYS 75 N -1.44 2.67 0.54 1.61 -0.14 -1.26 -4.73 119.74 117.00 1h42 s LYS 75 Ca 0.50 0.29 -0.20 0.00 -1.36 0.00 0.00 55.97 55.20 1h42 s LYS 75 Cb -0.38 -2.05 -0.05 0.00 -1.68 0.00 0.00 37.83 33.66 1h42 s LYS 75 CO 0.48 -1.10 1.18 -0.48 -0.76 0.00 0.00 175.35 174.68 1h42 s LEU 76 N -5.34 3.78 -0.07 3.17 0.05 -1.26 -4.45 118.68 114.57 1h42 s LEU 76 Ca 0.58 2.32 0.04 0.00 0.05 0.00 0.00 54.13 57.12 1h42 s LEU 76 Cb -0.11 -4.49 -0.02 0.00 -2.05 0.00 0.00 46.19 39.52 1h42 s LEU 76 CO 0.50 -1.31 -0.19 -0.13 -0.55 0.00 0.00 176.35 174.67 1h42 s ARG 77 N -3.15 2.66 -0.00 1.48 3.00 -0.71 -4.93 118.95 117.30 1h42 s ARG 77 Ca 0.72 -0.80 -0.26 0.00 0.00 0.00 0.00 55.73 55.40 1h42 s ARG 77 Cb -0.28 -2.31 -0.04 0.00 0.00 0.00 0.00 34.95 32.31 1h42 s ARG 77 CO 0.32 0.44 0.80 -0.51 0.00 0.00 0.00 175.30 176.36 1h42 s LEU 78 N -0.29 4.38 -0.05 2.53 1.43 -1.26 -1.21 118.68 124.21 1h42 s LEU 78 Ca 0.01 1.42 0.04 0.00 -1.03 0.00 0.00 54.13 54.57 1h42 s LEU 78 Cb -0.13 -3.28 -0.00 0.00 0.03 0.00 0.00 46.19 42.82 1h42 s LEU 78 CO 0.03 -0.10 -0.17 -0.31 0.23 0.00 0.00 176.35 176.02 1h42 s TYR 79 N 0.51 1.79 0.29 0.29 2.02 0.11 -4.97 117.35 117.38 1h42 s TYR 79 Ca 0.42 -0.56 -0.29 0.00 -0.37 0.00 0.00 57.07 56.26 1h42 s TYR 79 Cb -0.20 -1.22 -0.10 0.00 -0.40 0.00 0.00 41.96 40.04 1h42 s TYR 79 CO 0.23 -0.21 1.38 -1.12 -1.57 0.00 0.00 175.55 174.25 1h42 s SER 80 N 0.15 6.70 0.14 2.29 0.01 -1.26 -0.69 113.70 121.04 1h42 s SER 80 Ca -0.07 2.68 -0.30 0.00 1.31 0.00 0.00 55.95 59.57 1h42 s SER 80 Cb -0.13 -2.64 -0.07 0.00 0.21 0.00 0.00 66.02 63.39 1h42 s SER 80 CO 0.03 -0.63 1.24 -0.63 0.41 0.00 0.00 173.24 173.67 1h42 s ILE 81 N -0.54 3.63 -0.39 1.44 1.01 -0.52 -4.42 121.20 121.41 1h42 s ILE 81 Ca 0.54 1.26 0.23 0.00 0.00 0.00 0.00 60.65 62.68 1h42 s ILE 81 Cb -0.41 -3.81 -0.10 0.00 0.01 0.00 0.00 42.46 38.16 1h42 s ILE 81 CO 0.48 0.15 0.97 0.00 0.00 0.00 0.00 174.94 176.54 1h42 n ALA 82 N 3.22 2.97 -2.92 9.38 0.00 0.04 -4.23 120.51 128.97 1h42 n ALA 82 Ca 0.07 -0.35 -0.23 0.00 0.00 0.00 0.00 53.44 52.93 1h42 n ALA 82 Cb 0.45 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 1h42 n ALA 82 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1h42 s SER 83 N -4.53 6.12 1.24 0.00 1.04 -1.25 -3.95 113.70 112.37 1h42 s SER 83 Ca 0.01 0.02 -0.20 0.00 0.48 0.00 0.00 55.95 56.26 1h42 s SER 83 Cb 0.13 -1.76 0.30 0.00 0.10 0.00 0.00 66.02 64.79 1h42 s SER 83 CO 0.81 -0.02 1.08 0.42 0.98 0.00 0.00 173.24 176.51 1h42 s THR 84 N -1.93 1.53 0.62 2.02 -4.23 -1.26 -4.78 115.64 107.61 1h42 s THR 84 Ca 0.34 0.00 0.33 0.00 -1.18 0.00 0.00 61.69 61.17 1h42 s THR 84 Cb -0.09 -2.42 0.37 0.00 1.34 0.00 0.00 72.50 71.69 1h42 s THR 84 CO 0.28 0.00 2.15 0.08 -0.54 0.00 0.00 174.62 176.59 1h42 h ARG 85 N -2.73 0.00 0.00 3.99 0.11 -1.88 -1.15 114.38 112.72 1h42 h ARG 85 Ca -0.44 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.64 1h42 h ARG 85 Cb 1.30 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.38 1h42 h ARG 85 CO 0.33 0.00 -0.98 0.72 0.10 0.00 0.00 179.97 180.14 1h42 n HIS 86 N -3.49 0.22 0.00 4.08 8.25 -1.26 -4.73 115.22 118.28 1h42 n HIS 86 Ca -0.01 0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1h42 n HIS 86 Cb 0.25 -0.38 0.00 0.00 1.12 0.00 0.00 29.99 30.97 1h42 n HIS 86 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1h42 n GLY 87 N 1.39 -1.42 0.28 -1.41 0.00 -0.44 -0.75 105.19 102.84 1h42 n GLY 87 Ca 0.02 -1.58 0.15 0.00 0.00 0.00 0.00 46.02 44.61 1h42 n GLY 87 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1h42 h ASP 88 N 0.00 0.00 -0.37 1.61 3.32 -1.86 -1.73 116.42 117.39 1h42 h ASP 88 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1h42 h ASP 88 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1h42 h ASP 88 CO 0.00 0.08 0.00 0.47 -1.72 0.00 0.00 179.24 178.07 1h42 n ASP 89 N -3.56 3.21 -3.69 6.45 8.00 -1.26 -4.99 116.55 120.72 1h42 n ASP 89 Ca -0.02 -1.92 -0.23 0.00 0.71 0.00 0.00 54.79 53.32 1h42 n ASP 89 Cb 0.21 -0.24 0.03 0.00 -0.02 0.00 0.00 41.12 41.10 1h42 n ASP 89 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1h42 n VAL 90 N 1.20 -5.05 -0.22 2.53 0.31 -0.65 -4.92 118.33 111.53 1h42 n VAL 90 Ca 0.17 -0.68 0.00 0.00 -0.01 0.00 0.00 64.34 63.81 1h42 n VAL 90 Cb 0.53 -4.03 0.00 0.00 -0.91 0.00 0.00 33.84 29.43 1h42 n VAL 90 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1h42 n ASP 91 N -2.98 0.50 -2.49 4.52 5.68 -0.64 -5.00 116.55 116.14 1h42 n ASP 91 Ca -0.24 -0.82 -0.21 0.00 -0.50 0.00 0.00 54.79 53.03 1h42 n ASP 91 Cb 0.65 0.19 0.00 0.00 -1.14 0.00 0.00 41.12 40.83 1h42 n ASP 91 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1h42 n ASP 92 N -0.19 -5.86 0.00 -1.12 8.00 0.07 -4.88 116.55 112.57 1h42 n ASP 92 Ca 0.00 -0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.41 1h42 n ASP 92 Cb 0.05 -4.82 0.00 0.00 -0.02 0.00 0.00 41.12 36.34 1h42 n ASP 92 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1h42 n LYS 93 N -3.22 3.78 -4.41 -1.24 5.02 -1.26 -4.99 118.16 111.83 1h42 n LYS 93 Ca -0.21 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 55.88 1h42 n LYS 93 Cb 0.67 -0.61 -0.10 0.00 -0.02 0.00 0.00 35.03 34.96 1h42 n LYS 93 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1h42 s THR 94 N -1.13 1.20 -0.01 -0.18 -4.23 -1.26 -0.59 115.64 109.44 1h42 s THR 94 Ca 0.00 -2.03 -0.01 0.00 -1.18 0.00 0.00 61.69 58.47 1h42 s THR 94 Cb 0.00 -2.63 0.00 0.00 1.34 0.00 0.00 72.50 71.22 1h42 s THR 94 CO 0.00 -0.13 0.02 -0.51 -0.54 0.00 0.00 174.62 173.46 1h42 s ILE 95 N -3.30 0.01 0.18 2.99 2.07 -0.98 -4.10 121.20 118.06 1h42 s ILE 95 Ca 0.34 -0.06 0.11 0.00 -1.41 0.00 0.00 60.65 59.63 1h42 s ILE 95 Cb 0.07 -0.06 -0.04 0.00 0.13 0.00 0.00 42.46 42.56 1h42 s ILE 95 CO 0.13 -0.03 -0.25 -0.44 -1.91 0.00 0.00 174.94 172.44 1h42 s SER 96 N -0.09 3.39 0.20 4.50 0.01 -1.26 -0.61 113.70 119.84 1h42 s SER 96 Ca -0.01 -0.84 0.07 0.00 1.31 0.00 0.00 55.95 56.48 1h42 s SER 96 Cb -0.01 -0.24 -0.05 0.00 0.21 0.00 0.00 66.02 65.93 1h42 s SER 96 CO -0.00 0.13 -0.13 -0.76 0.41 0.00 0.00 173.24 172.89 1h42 s LEU 97 N -2.52 2.54 -0.37 2.44 1.43 -0.07 -0.78 118.68 121.35 1h42 s LEU 97 Ca 0.19 -1.03 0.01 0.00 -1.03 0.00 0.00 54.13 52.27 1h42 s LEU 97 Cb -0.08 -0.60 0.11 0.00 0.03 0.00 0.00 46.19 45.65 1h42 s LEU 97 CO 0.09 -0.22 0.15 0.00 0.23 0.00 0.00 176.35 176.60 1h42 s VAL 99 N 1.02 3.45 0.08 0.00 1.01 -0.46 -4.92 120.40 120.59 1h42 s VAL 99 Ca 0.13 -0.50 -0.27 0.00 0.00 0.00 0.00 61.98 61.34 1h42 s VAL 99 Cb -0.20 -2.59 -0.06 0.00 0.00 0.00 0.00 36.38 33.52 1h42 s VAL 99 CO -0.13 0.39 0.84 -0.60 0.00 0.00 0.00 175.10 175.60 1h42 s ARG 100 N 1.48 4.58 -0.23 2.72 3.52 -1.26 -1.20 118.95 128.57 1h42 s ARG 100 Ca 0.05 1.22 -0.29 0.00 -0.13 0.00 0.00 55.73 56.59 1h42 s ARG 100 Cb -0.15 -3.36 -0.00 0.00 -1.56 0.00 0.00 34.95 29.88 1h42 s ARG 100 CO -0.03 0.28 1.25 -1.14 -0.81 0.00 0.00 175.30 174.86 1h42 s GLN 101 N -0.14 4.11 -0.23 5.12 0.74 -0.25 -4.81 119.66 124.20 1h42 s GLN 101 Ca 0.41 1.45 -0.29 0.00 0.05 0.00 0.00 55.36 56.99 1h42 s GLN 101 Cb -0.22 -3.80 0.01 0.00 1.10 0.00 0.00 33.01 30.10 1h42 s GLN 101 CO 0.26 -0.87 1.08 -1.17 -0.55 0.00 0.00 175.29 174.05 1h42 s LEU 102 N 3.82 4.09 -0.00 3.68 2.96 -1.26 -4.68 118.68 127.28 1h42 s LEU 102 Ca 0.54 1.38 0.00 0.00 -0.22 0.00 0.00 54.13 55.83 1h42 s LEU 102 Cb -0.19 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 42.96 1h42 s LEU 102 CO 0.17 -0.72 -0.01 -1.83 -1.32 0.00 0.00 176.35 172.64 1h42 s GLU 103 N 3.32 0.10 0.00 1.98 -1.05 -1.26 -1.04 118.70 120.75 1h42 s GLU 103 Ca 0.46 -0.04 0.00 0.00 -0.15 0.00 0.00 54.97 55.24 1h42 s GLU 103 Cb -0.16 -0.11 0.00 0.00 -0.44 0.00 0.00 34.13 33.43 1h42 s GLU 103 CO 0.09 0.02 0.00 2.48 0.95 0.00 0.00 175.26 178.80 1h42 n TYR 104 N 3.10 0.00 -1.68 4.83 4.11 -1.10 -5.04 117.16 121.38 1h42 n TYR 104 Ca -0.13 0.00 -0.02 0.00 -0.00 0.00 0.00 57.90 57.75 1h42 n TYR 104 Cb 0.59 0.00 0.01 0.00 -0.00 0.00 0.00 39.34 39.94 1h42 n TYR 104 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.86 177.22 1h42 n LYS 105 N 0.00 0.25 -0.02 -3.48 2.85 -1.26 -3.71 118.16 112.78 1h42 n LYS 105 Ca 0.00 -0.16 -0.02 0.00 -1.05 0.00 0.00 58.31 57.07 1h42 n LYS 105 Cb 0.00 -0.07 -0.13 0.00 -0.65 0.00 0.00 35.03 34.18 1h42 n LYS 105 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1h42 n HIS 106 N -1.79 0.52 -1.52 5.58 8.25 -1.24 -4.26 115.22 120.76 1h42 n HIS 106 Ca 0.01 0.17 -0.29 0.00 -0.26 0.00 0.00 57.72 57.35 1h42 n HIS 106 Cb 0.04 -0.98 -0.06 0.00 1.12 0.00 0.00 29.99 30.11 1h42 n HIS 106 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1h42 n PRO 107 N -2.76 3.12 -2.93 -0.41 -0.04 -1.26 -4.35 135.00 126.37 1h42 n PRO 107 Ca -0.17 -2.38 -0.13 0.00 -0.04 0.00 0.00 63.50 60.78 1h42 n PRO 107 Cb 0.92 -2.34 0.02 0.00 -0.04 0.00 0.00 33.50 32.06 1h42 n PRO 107 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1h42 n GLU 108 N 1.78 1.04 -2.74 0.54 0.00 -1.26 -5.08 120.64 114.92 1h42 n GLU 108 Ca 0.56 -2.89 -0.04 0.00 0.00 0.00 0.00 57.16 54.79 1h42 n GLU 108 Cb 0.49 -1.30 -0.03 0.00 0.00 0.00 0.00 31.44 30.60 1h42 n GLU 108 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1h42 n SER 109 N 0.14 -3.02 0.00 4.31 2.88 -1.26 -4.91 113.62 111.76 1h42 n SER 109 Ca 0.15 1.24 0.00 0.00 -1.33 0.00 0.00 58.87 58.93 1h42 n SER 109 Cb 0.72 -3.98 0.00 0.00 -0.75 0.00 0.00 64.21 60.20 1h42 n SER 109 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1h42 n GLY 110 N 2.01 -0.73 0.43 0.46 0.00 -1.26 -4.87 105.19 101.23 1h42 n GLY 110 Ca -0.27 -2.11 -0.02 0.00 0.00 0.00 0.00 46.02 43.62 1h42 n GLY 110 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1h42 n GLU 111 N 0.00 0.14 -4.83 1.61 1.02 -1.26 -4.78 120.64 112.54 1h42 n GLU 111 Ca 0.00 0.06 -0.32 0.00 -0.02 0.00 0.00 57.16 56.88 1h42 n GLU 111 Cb 0.00 -0.64 -0.17 0.00 -0.02 0.00 0.00 31.44 30.61 1h42 n GLU 111 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1h42 s THR 112 N -1.70 1.99 -0.15 2.62 2.01 -1.26 -3.62 115.64 115.52 1h42 s THR 112 Ca -0.08 -0.95 -0.05 0.00 0.31 0.00 0.00 61.69 60.93 1h42 s THR 112 Cb 0.01 -1.75 -0.03 0.00 0.01 0.00 0.00 72.50 70.74 1h42 s THR 112 CO 0.12 0.54 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.89 1h42 s VAL 113 N 0.67 4.20 -0.12 3.82 1.01 -1.24 -5.01 120.40 123.73 1h42 s VAL 113 Ca -0.11 -0.25 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 1h42 s VAL 113 Cb -0.16 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.34 1h42 s VAL 113 CO 0.02 0.50 0.00 -0.31 0.00 0.00 0.00 175.10 175.31 1h42 s TYR 114 N 0.21 3.15 0.32 5.22 2.02 -1.26 -2.71 117.35 124.29 1h42 s TYR 114 Ca -0.00 0.05 -0.29 0.00 -0.37 0.00 0.00 57.07 56.46 1h42 s TYR 114 Cb -0.13 -1.89 -0.10 0.00 -0.40 0.00 0.00 41.96 39.44 1h42 s TYR 114 CO 0.02 0.29 1.29 0.20 -1.57 0.00 0.00 175.55 175.78 1h42 s GLY 115 N -0.34 2.98 0.03 0.71 0.00 -0.20 -4.97 107.32 105.53 1h42 s GLY 115 Ca 0.07 1.23 -0.26 0.00 0.00 0.00 0.00 44.72 45.76 1h42 s GLY 115 CO 0.02 1.89 1.30 -2.08 0.00 0.00 0.00 173.10 174.22 1h42 h VAL 116 N 3.07 0.00 -0.05 1.40 2.07 -1.99 -2.09 116.25 118.66 1h42 h VAL 116 Ca -0.49 -0.07 -0.14 0.00 0.82 0.00 0.00 66.70 66.83 1h42 h VAL 116 Cb 1.22 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1h42 h VAL 116 CO 0.66 0.00 -0.61 0.00 0.02 0.00 0.00 177.57 177.64 1h42 h SER 118 N 0.12 0.00 0.05 0.00 4.64 -1.87 -0.67 113.55 115.81 1h42 h SER 118 Ca -0.01 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.13 1h42 h SER 118 Cb 1.10 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1h42 h SER 118 CO 0.09 0.99 -0.66 0.74 -0.87 0.00 0.00 176.83 177.12 1h42 h THR 119 N 0.00 1.33 0.02 2.95 2.02 -1.39 -0.81 112.91 117.03 1h42 h THR 119 Ca -0.03 -1.95 0.02 0.00 0.77 0.00 0.00 66.41 65.22 1h42 h THR 119 Cb 1.78 1.92 -0.02 0.00 -1.74 0.00 0.00 68.15 70.09 1h42 h THR 119 CO 0.13 0.60 -0.11 0.22 0.37 0.00 0.00 175.52 176.73 1h42 h TYR 120 N 0.42 -0.28 -0.41 3.16 3.20 -1.38 -2.52 116.97 119.16 1h42 h TYR 120 Ca -0.02 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.71 1h42 h TYR 120 Cb 1.24 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 39.62 1h42 h TYR 120 CO 0.06 -0.17 -0.33 -0.07 -1.64 0.00 0.00 178.16 176.01 1h42 h LEU 121 N -0.20 1.01 -0.85 2.82 3.38 -1.08 -2.43 115.31 117.96 1h42 h LEU 121 Ca 0.03 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1h42 h LEU 121 Cb 0.24 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1h42 h LEU 121 CO -0.09 1.24 0.00 0.71 0.09 0.00 0.00 178.44 180.39 1h42 h THR 122 N 0.79 0.00 -0.29 0.22 1.35 -1.11 -2.82 112.91 111.05 1h42 h THR 122 Ca 0.08 -0.49 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 1h42 h THR 122 Cb 0.93 1.40 0.00 0.00 -1.73 0.00 0.00 68.15 68.75 1h42 h THR 122 CO 0.09 0.00 0.00 1.41 -0.25 0.00 0.00 175.52 176.77 1h42 n HIS 123 N -2.73 0.38 -2.43 4.73 8.25 -0.95 -4.99 115.22 117.49 1h42 n HIS 123 Ca 0.02 -0.47 -0.41 0.00 -0.26 0.00 0.00 57.72 56.61 1h42 n HIS 123 Cb 0.33 -0.03 -0.04 0.00 1.12 0.00 0.00 29.99 31.37 1h42 n HIS 123 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 1h42 s ILE 124 N -0.99 3.49 0.23 1.59 2.07 -0.92 -5.03 121.20 121.63 1h42 s ILE 124 Ca 0.20 1.40 -0.10 0.00 -1.41 0.00 0.00 60.65 60.74 1h42 s ILE 124 Cb 0.11 -3.89 -0.07 0.00 0.13 0.00 0.00 42.46 38.73 1h42 s ILE 124 CO 0.14 0.30 0.55 -1.61 -1.91 0.00 0.00 174.94 172.41 1h42 s GLU 125 N -1.05 3.82 0.23 3.50 0.41 -1.26 -4.80 118.70 119.54 1h42 s GLU 125 Ca 0.47 0.30 -0.31 0.00 -0.41 0.00 0.00 54.97 55.02 1h42 s GLU 125 Cb -0.32 -2.66 -0.14 0.00 -1.78 0.00 0.00 34.13 29.23 1h42 s GLU 125 CO 0.40 0.32 1.36 -2.30 -0.49 0.00 0.00 175.26 174.56 1h42 n PRO 126 N -0.08 1.88 0.00 0.39 -0.02 -1.26 -2.72 135.00 133.19 1h42 n PRO 126 Ca 0.00 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1h42 n PRO 126 Cb 0.52 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1h42 n PRO 126 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h42 n GLY 127 N 2.12 3.12 3.78 -1.23 0.00 -0.30 -4.98 105.19 107.70 1h42 n GLY 127 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 1h42 n GLY 127 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1h42 s SER 128 N -1.15 6.30 -0.08 1.61 0.01 -1.10 -4.71 113.70 114.59 1h42 s SER 128 Ca 0.00 2.19 -0.17 0.00 1.31 0.00 0.00 55.95 59.28 1h42 s SER 128 Cb 0.00 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.59 1h42 s SER 128 CO 0.00 -0.82 0.46 -1.61 0.41 0.00 0.00 173.24 171.68 1h42 s GLU 129 N -2.73 4.22 -0.02 12.44 2.02 -1.26 -1.49 118.70 131.88 1h42 s GLU 129 Ca 0.63 0.45 0.05 0.00 0.02 0.00 0.00 54.97 56.12 1h42 s GLU 129 Cb -0.25 -3.37 -0.01 0.00 0.10 0.00 0.00 34.13 30.60 1h42 s GLU 129 CO 0.31 0.33 -0.17 0.08 0.02 0.00 0.00 175.26 175.84 1h42 s VAL 130 N 0.05 1.32 -0.44 2.63 1.01 0.96 -4.96 120.40 120.97 1h42 s VAL 130 Ca 0.25 -0.71 -0.24 0.00 0.00 0.00 0.00 61.98 61.29 1h42 s VAL 130 Cb -0.16 -1.10 0.02 0.00 0.00 0.00 0.00 36.38 35.14 1h42 s VAL 130 CO 0.11 0.38 0.82 -0.54 0.00 0.00 0.00 175.10 175.87 1h42 s LYS 131 N -0.34 3.47 -0.13 2.72 1.02 -1.26 -1.25 119.74 123.98 1h42 s LYS 131 Ca 0.05 -0.00 -0.01 0.00 0.02 0.00 0.00 55.97 56.03 1h42 s LYS 131 Cb -0.07 -3.92 -0.02 0.00 -0.52 0.00 0.00 37.83 33.30 1h42 s LYS 131 CO -0.00 -1.11 -0.08 0.42 -0.92 0.00 0.00 175.35 173.65 1h42 s ILE 132 N 3.38 3.50 0.19 2.17 1.01 0.10 -2.08 121.20 129.47 1h42 s ILE 132 Ca 0.32 -0.51 0.10 0.00 0.00 0.00 0.00 60.65 60.56 1h42 s ILE 132 Cb -0.12 -2.49 -0.04 0.00 0.01 0.00 0.00 42.46 39.82 1h42 s ILE 132 CO 0.23 0.52 -0.15 0.42 0.00 0.00 0.00 174.94 175.96 1h42 s THR 133 N 0.16 2.86 -0.67 2.92 -4.23 -0.33 -0.37 115.64 115.97 1h42 s THR 133 Ca -0.04 -1.82 0.00 0.00 -1.18 0.00 0.00 61.69 58.65 1h42 s THR 133 Cb -0.14 -2.40 0.00 0.00 1.34 0.00 0.00 72.50 71.29 1h42 s THR 133 CO 0.04 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.61 1h42 n GLY 134 N 0.10 0.37 3.83 3.99 0.00 0.61 -1.32 105.19 112.77 1h42 n GLY 134 Ca -0.11 -2.04 -0.32 0.00 0.00 0.00 0.00 46.02 43.55 1h42 n GLY 134 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h42 s PRO 135 N -0.27 3.52 0.20 1.61 0.04 -1.26 -0.60 135.00 138.24 1h42 s PRO 135 Ca 0.00 1.03 0.11 0.00 0.04 0.00 0.00 61.00 62.18 1h42 s PRO 135 Cb 0.00 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 1h42 s PRO 135 CO 0.00 -0.63 -0.22 0.14 0.04 0.00 0.00 177.00 176.32 1h42 s VAL 136 N -2.68 2.29 0.00 -0.36 -7.23 0.07 -0.14 120.40 112.36 1h42 s VAL 136 Ca 0.60 -2.08 0.00 0.00 -1.81 0.00 0.00 61.98 58.69 1h42 s VAL 136 Cb -0.13 -2.11 0.00 0.00 0.56 0.00 0.00 36.38 34.70 1h42 s VAL 136 CO 0.39 -0.20 0.00 0.61 -0.31 0.00 0.00 175.10 175.60 1h42 n GLY 137 N 0.12 2.54 0.21 2.32 0.00 -1.26 -0.60 105.19 108.52 1h42 n GLY 137 Ca -0.11 -1.36 0.04 0.00 0.00 0.00 0.00 46.02 44.58 1h42 n GLY 137 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1h42 n LYS 138 N 1.91 0.89 0.02 1.61 5.02 -1.26 -4.73 118.16 121.63 1h42 n LYS 138 Ca 0.00 -1.63 0.00 0.00 -2.02 0.00 0.00 58.31 54.66 1h42 n LYS 138 Cb 0.00 -0.96 -0.09 0.00 -0.02 0.00 0.00 35.03 33.96 1h42 n LYS 138 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1h42 n GLU 139 N -0.63 0.63 -1.41 1.97 4.07 -1.26 -4.32 120.64 119.69 1h42 n GLU 139 Ca 0.06 0.17 -0.10 0.00 -0.06 0.00 0.00 57.16 57.24 1h42 n GLU 139 Cb 0.60 -1.76 0.10 0.00 -0.06 0.00 0.00 31.44 30.32 1h42 n GLU 139 CO 0.00 0.00 0.00 -1.33 -0.06 0.00 0.00 177.13 175.74 1h42 n MET 140 N -2.82 2.60 -2.79 5.31 2.81 -1.26 -4.53 117.12 116.44 1h42 n MET 140 Ca -0.11 -3.73 -0.40 0.00 -1.81 0.00 0.00 57.70 51.65 1h42 n MET 140 Cb 0.83 -1.92 -0.06 0.00 -0.71 0.00 0.00 33.22 31.36 1h42 n MET 140 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1h42 s LEU 141 N -3.37 4.62 0.13 4.03 1.43 -1.26 -4.17 118.68 120.10 1h42 s LEU 141 Ca 0.44 1.87 -0.30 0.00 -1.03 0.00 0.00 54.13 55.12 1h42 s LEU 141 Cb 0.39 -3.55 -0.06 0.00 0.03 0.00 0.00 46.19 43.00 1h42 s LEU 141 CO -0.01 0.14 1.03 -0.22 0.23 0.00 0.00 176.35 177.52 1h42 s LEU 142 N -1.03 4.49 0.62 1.79 2.96 -1.26 -5.06 118.68 121.18 1h42 s LEU 142 Ca 0.41 1.92 -0.18 0.00 -0.22 0.00 0.00 54.13 56.06 1h42 s LEU 142 Cb -0.25 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 42.82 1h42 s LEU 142 CO 0.31 -0.15 1.20 -2.16 -1.32 0.00 0.00 176.35 174.23 1h42 s PRO 143 N -0.08 2.84 0.00 0.98 0.04 -1.26 -4.94 135.00 132.57 1h42 s PRO 143 Ca 0.48 1.79 0.29 0.00 0.04 0.00 0.00 61.00 63.60 1h42 s PRO 143 Cb -0.26 -1.92 1.27 0.00 0.04 0.00 0.00 34.50 33.63 1h42 s PRO 143 CO 0.32 -1.30 1.93 -0.25 0.04 0.00 0.00 177.00 177.74 1h42 n ASP 144 N -1.82 0.00 -4.65 6.66 8.00 -1.26 -4.81 116.55 118.68 1h42 n ASP 144 Ca 0.13 0.37 -0.43 0.00 0.71 0.00 0.00 54.79 55.58 1h42 n ASP 144 Cb 0.50 -0.46 -0.02 0.00 -0.02 0.00 0.00 41.12 41.12 1h42 n ASP 144 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1h42 s ASP 145 N -2.91 6.77 0.40 -2.24 -1.08 -1.26 -4.90 116.67 111.45 1h42 s ASP 145 Ca 0.17 1.65 0.29 0.00 -0.52 0.00 0.00 52.55 54.13 1h42 s ASP 145 Cb 0.19 -2.54 1.27 0.00 -1.46 0.00 0.00 42.92 40.38 1h42 s ASP 145 CO 0.50 -0.92 1.86 -0.65 0.52 0.00 0.00 175.17 176.48 1h42 h PRO 146 N 8.98 0.00 -0.12 4.34 0.11 -1.88 -2.86 132.00 140.57 1h42 h PRO 146 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1h42 h PRO 146 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1h42 h PRO 146 CO 0.99 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 179.17 1h42 n GLU 147 N -2.60 2.28 -2.21 1.05 1.02 -1.26 -1.50 120.64 117.41 1h42 n GLU 147 Ca 0.01 -1.88 -0.38 0.00 -0.02 0.00 0.00 57.16 54.90 1h42 n GLU 147 Cb 0.22 -1.47 -0.01 0.00 -0.02 0.00 0.00 31.44 30.16 1h42 n GLU 147 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1h42 s ALA 148 N -1.87 3.01 -0.01 0.62 0.00 -1.08 -4.54 121.76 117.89 1h42 s ALA 148 Ca 0.32 1.00 -0.12 0.00 0.00 0.00 0.00 51.96 53.15 1h42 s ALA 148 Cb 0.21 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.87 1h42 s ALA 148 CO 0.31 -0.71 0.35 -0.80 0.00 0.00 0.00 175.76 174.91 1h42 s ASN 149 N -1.24 6.70 -0.21 0.00 0.02 -1.14 -3.80 114.94 115.28 1h42 s ASN 149 Ca 0.63 0.83 -0.01 0.00 -1.02 0.00 0.00 52.86 53.29 1h42 s ASN 149 Cb -0.31 -2.20 0.06 0.00 0.02 0.00 0.00 41.25 38.82 1h42 s ASN 149 CO 0.38 0.32 -0.02 -0.69 0.02 0.00 0.00 177.10 177.10 1h42 s VAL 150 N -1.13 1.12 -0.19 1.60 1.01 -0.35 -0.96 120.40 121.51 1h42 s VAL 150 Ca 0.24 -0.90 -0.10 0.00 0.00 0.00 0.00 61.98 61.21 1h42 s VAL 150 Cb -0.15 -1.46 -0.05 0.00 0.00 0.00 0.00 36.38 34.72 1h42 s VAL 150 CO 0.12 -0.10 0.16 -0.63 0.00 0.00 0.00 175.10 174.66 1h42 s ILE 151 N 1.59 5.40 -0.22 2.22 1.01 -0.31 -1.20 121.20 129.69 1h42 s ILE 151 Ca -0.03 0.26 0.01 0.00 0.00 0.00 0.00 60.65 60.88 1h42 s ILE 151 Cb -0.18 -3.49 0.05 0.00 0.01 0.00 0.00 42.46 38.85 1h42 s ILE 151 CO -0.07 0.44 -0.08 -0.04 0.00 0.00 0.00 174.94 175.20 1h42 s MET 152 N 0.27 1.83 -0.41 2.79 -1.94 0.12 -0.48 119.30 121.48 1h42 s MET 152 Ca 0.10 -0.94 -0.05 0.00 -1.71 0.00 0.00 55.69 53.09 1h42 s MET 152 Cb -0.11 -2.51 0.10 0.00 2.01 0.00 0.00 34.83 34.31 1h42 s MET 152 CO -0.01 -0.52 0.21 -0.51 -0.01 0.00 0.00 175.02 174.19 1h42 s LEU 153 N 1.38 5.13 -0.09 -0.03 1.43 0.44 -1.01 118.68 125.93 1h42 s LEU 153 Ca -0.04 -1.78 0.04 0.00 -1.03 0.00 0.00 54.13 51.32 1h42 s LEU 153 Cb -0.18 -1.88 0.00 0.00 0.03 0.00 0.00 46.19 44.16 1h42 s LEU 153 CO -0.07 -0.53 -0.22 0.00 0.23 0.00 0.00 176.35 175.76 1h42 s ALA 154 N 1.26 2.01 -0.21 4.21 0.00 -0.27 -2.04 121.76 126.72 1h42 s ALA 154 Ca 0.05 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.14 1h42 s ALA 154 Cb -0.23 -0.74 0.03 0.00 0.00 0.00 0.00 23.12 22.19 1h42 s ALA 154 CO -0.02 0.28 -0.17 0.20 0.00 0.00 0.00 175.76 176.06 1h42 s GLY 155 N 0.30 1.48 0.00 0.00 0.00 -0.79 -0.62 107.32 107.69 1h42 s GLY 155 Ca -0.15 -1.42 0.00 0.00 0.00 0.00 0.00 44.72 43.15 1h42 s GLY 155 CO 0.07 0.40 0.00 0.61 0.00 0.00 0.00 173.10 174.18 1h42 n GLY 156 N 4.55 3.30 0.00 0.20 0.00 -0.34 -1.53 105.19 111.37 1h42 n GLY 156 Ca -0.18 -0.15 0.14 0.00 0.00 0.00 0.00 46.02 45.82 1h42 n GLY 156 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1h42 n THR 157 N 0.00 0.00 0.22 2.61 -2.24 -1.26 -2.51 114.28 111.09 1h42 n THR 157 Ca 0.00 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.86 1h42 n THR 157 Cb 0.00 -0.55 0.41 0.00 -2.10 0.00 0.00 70.33 68.09 1h42 n THR 157 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h42 n GLY 158 N 0.74 -0.90 0.33 3.38 0.00 -0.58 -2.04 105.19 106.12 1h42 n GLY 158 Ca 0.21 0.10 0.20 0.00 0.00 0.00 0.00 46.02 46.53 1h42 n GLY 158 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1h42 h ILE 159 N 0.00 0.16 -0.38 -0.61 6.09 -1.72 -3.36 117.51 117.69 1h42 h ILE 159 Ca 0.00 0.00 -0.04 0.00 -1.37 0.00 0.00 64.86 63.45 1h42 h ILE 159 Cb 0.11 0.95 -0.02 0.00 0.47 0.00 0.00 36.82 38.34 1h42 h ILE 159 CO 0.00 0.00 0.09 0.74 -3.07 0.00 0.00 178.15 175.91 1h42 h THR 160 N 0.00 1.23 0.00 2.19 2.02 -1.70 0.64 112.91 117.28 1h42 h THR 160 Ca 0.01 -0.77 -0.04 0.00 0.77 0.00 0.00 66.41 66.38 1h42 h THR 160 Cb 0.12 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 1h42 h THR 160 CO -0.00 0.26 -0.20 1.55 0.37 0.00 0.00 175.52 177.50 1h42 h PRO 161 N 0.46 0.00 -0.16 6.66 0.13 -1.74 -2.99 132.00 134.37 1h42 h PRO 161 Ca 0.12 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.19 1h42 h PRO 161 Cb 0.31 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.42 1h42 h PRO 161 CO 0.00 0.20 -0.18 0.52 -0.23 0.00 0.00 178.00 178.31 1h42 h MET 162 N 0.00 0.27 -0.74 0.86 2.86 -1.43 -2.31 114.93 114.43 1h42 h MET 162 Ca -0.00 -0.07 -0.04 0.00 -2.06 0.00 0.00 59.70 57.53 1h42 h MET 162 Cb 0.94 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.54 1h42 h MET 162 CO 0.03 0.45 0.33 -0.09 1.06 0.00 0.00 176.91 178.69 1h42 h ARG 163 N 0.25 1.09 -0.11 1.72 2.43 -0.77 -0.87 114.38 118.12 1h42 h ARG 163 Ca 0.05 -0.18 -0.10 0.00 -0.81 0.00 0.00 59.98 58.93 1h42 h ARG 163 Cb 0.47 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1h42 h ARG 163 CO 0.03 0.87 -0.39 1.79 -1.51 0.00 0.00 179.97 180.76 1h42 h THR 164 N 1.06 1.30 0.03 0.20 1.35 -1.45 -0.65 112.91 114.75 1h42 h THR 164 Ca 0.25 -1.48 -0.00 0.00 -0.55 0.00 0.00 66.41 64.63 1h42 h THR 164 Cb 0.17 1.66 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 1h42 h THR 164 CO -0.03 0.44 -0.02 1.88 -0.25 0.00 0.00 175.52 177.55 1h42 h TYR 165 N 0.20 -0.04 0.00 4.73 0.05 -1.20 -2.87 116.97 117.84 1h42 h TYR 165 Ca 0.02 -0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.72 1h42 h TYR 165 Cb 0.79 0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.53 1h42 h TYR 165 CO 0.01 0.57 -0.39 -0.07 -1.05 0.00 0.00 178.16 177.24 1h42 h LEU 166 N -0.70 0.00 -0.07 3.88 3.38 -0.97 -0.59 115.31 120.24 1h42 h LEU 166 Ca -0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 1h42 h LEU 166 Cb 0.63 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.39 1h42 h LEU 166 CO 0.01 0.39 -0.48 -0.50 0.09 0.00 0.00 178.44 177.95 1h42 h TRP 167 N 0.00 0.61 -0.83 1.13 -0.00 -1.22 -0.75 115.95 114.89 1h42 h TRP 167 Ca -0.00 -0.29 -0.00 0.00 -0.00 0.00 0.00 58.89 58.60 1h42 h TRP 167 Cb 0.75 -0.09 -0.04 0.00 -0.00 0.00 0.00 29.16 29.78 1h42 h TRP 167 CO 0.00 1.06 0.50 -0.09 -0.00 0.00 0.00 178.44 179.92 1h42 h ARG 168 N -0.01 1.13 -0.13 0.49 2.43 -1.25 -1.65 114.38 115.38 1h42 h ARG 168 Ca -0.04 -0.10 -0.20 0.00 -0.81 0.00 0.00 59.98 58.83 1h42 h ARG 168 Cb 1.14 -0.24 0.01 0.00 -0.42 0.00 0.00 29.97 30.47 1h42 h ARG 168 CO 0.10 0.78 -0.70 0.52 -1.51 0.00 0.00 179.97 179.16 1h42 h MET 169 N 1.15 0.71 0.00 0.20 2.86 -1.04 -3.40 114.93 115.40 1h42 h MET 169 Ca 0.30 -0.59 0.00 0.00 -2.06 0.00 0.00 59.70 57.35 1h42 h MET 169 Cb -0.05 0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.73 1h42 h MET 169 CO -0.06 1.20 -0.46 1.19 1.06 0.00 0.00 176.91 179.84 1h42 n PHE 170 N -4.03 0.00 -2.34 -0.22 3.72 -0.29 -4.45 117.46 109.85 1h42 n PHE 170 Ca -0.08 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.91 1h42 n PHE 170 Cb 0.71 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.21 1h42 n PHE 170 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1h42 s LYS 171 N -1.16 4.47 0.26 -1.08 -0.14 -0.64 -4.94 119.74 116.50 1h42 s LYS 171 Ca 0.00 1.92 -0.02 0.00 -1.36 0.00 0.00 55.97 56.51 1h42 s LYS 171 Cb 0.00 -3.23 0.50 0.00 -1.68 0.00 0.00 37.83 33.42 1h42 s LYS 171 CO 0.00 -0.13 1.77 -0.44 -0.76 0.00 0.00 175.35 175.79 1h42 h ASP 172 N 5.25 0.52 0.80 2.83 3.32 -1.95 -1.74 116.42 125.45 1h42 h ASP 172 Ca -0.45 0.09 -0.15 0.00 0.02 0.00 0.00 57.03 56.54 1h42 h ASP 172 Cb 1.21 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.74 1h42 h ASP 172 CO 0.75 0.23 -0.70 0.00 -1.72 0.00 0.00 179.24 177.81 1h42 h ALA 173 N 1.54 0.78 -0.26 3.45 0.00 -1.94 -2.24 119.26 120.58 1h42 h ALA 173 Ca 0.44 -0.63 -0.18 0.00 0.00 0.00 0.00 54.91 54.54 1h42 h ALA 173 Cb 0.60 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1h42 h ALA 173 CO -0.35 0.87 -0.54 0.93 0.00 0.00 0.00 179.25 180.17 1h42 h GLU 174 N 0.00 0.83 -0.15 0.00 4.39 -1.72 -2.22 114.58 115.70 1h42 h GLU 174 Ca -0.01 -0.54 -0.07 0.00 0.34 0.00 0.00 59.36 59.08 1h42 h GLU 174 Cb 1.29 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.99 1h42 h GLU 174 CO 0.09 1.17 -0.22 0.00 -1.16 0.00 0.00 179.01 178.89 1h42 h ARG 175 N 0.59 0.26 -0.03 2.33 3.08 -1.10 0.14 114.38 119.64 1h42 h ARG 175 Ca 0.01 -0.08 -0.17 0.00 0.07 0.00 0.00 59.98 59.81 1h42 h ARG 175 Cb 1.15 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 1h42 h ARG 175 CO 0.12 0.48 -0.72 0.00 -1.07 0.00 0.00 179.97 178.78 1h42 h ALA 176 N 1.54 0.72 0.00 0.04 0.00 -1.38 -3.20 119.26 116.98 1h42 h ALA 176 Ca 0.04 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1h42 h ALA 176 Cb 0.53 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1h42 h ALA 176 CO 0.04 0.82 -0.60 0.00 0.00 0.00 0.00 179.25 179.50 1h42 h ALA 177 N 1.12 0.66 -3.14 0.00 0.00 -0.72 -3.41 119.26 113.77 1h42 h ALA 177 Ca -0.02 0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.26 1h42 h ALA 177 Cb 1.27 0.00 -0.42 0.00 0.00 0.00 0.00 17.79 18.65 1h42 h ALA 177 CO 0.11 0.00 -0.57 -0.80 0.00 0.00 0.00 179.25 177.99 1h42 s ASN 178 N -5.00 4.76 0.49 0.00 0.01 -0.03 -4.96 114.94 110.20 1h42 s ASN 178 Ca 0.04 -3.69 0.26 0.00 -0.71 0.00 0.00 52.86 48.76 1h42 s ASN 178 Cb 0.10 -1.65 1.26 0.00 0.41 0.00 0.00 41.25 41.38 1h42 s ASN 178 CO 0.73 -0.12 1.99 -0.65 -1.51 0.00 0.00 177.10 177.54 1h42 h PRO 179 N 5.63 0.00 -0.00 -0.60 0.11 -1.80 -2.30 132.00 133.03 1h42 h PRO 179 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1h42 h PRO 179 Cb 0.78 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.89 1h42 h PRO 179 CO 0.72 0.16 -0.15 0.39 -0.21 0.00 0.00 178.00 178.91 1h42 n GLU 180 N -3.57 0.63 -3.56 1.05 1.02 -1.26 -4.34 120.64 110.61 1h42 n GLU 180 Ca -0.01 -0.25 -0.27 0.00 -0.02 0.00 0.00 57.16 56.60 1h42 n GLU 180 Cb 0.30 -1.49 -0.11 0.00 -0.02 0.00 0.00 31.44 30.12 1h42 n GLU 180 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1h42 s TYR 181 N -2.54 1.89 -0.58 -0.32 5.04 -0.87 -4.86 117.35 115.12 1h42 s TYR 181 Ca 0.26 -2.65 -0.14 0.00 -2.44 0.00 0.00 57.07 52.10 1h42 s TYR 181 Cb 0.20 -1.50 0.14 0.00 0.35 0.00 0.00 41.96 41.15 1h42 s TYR 181 CO 0.50 -0.74 0.52 -0.65 -1.34 0.00 0.00 175.55 173.84 1h42 s GLN 182 N -0.42 3.00 0.21 4.97 -1.52 -1.26 -4.86 119.66 119.78 1h42 s GLN 182 Ca 0.30 -1.86 -0.30 0.00 -1.95 0.00 0.00 55.36 51.55 1h42 s GLN 182 Cb 0.01 -4.25 -0.09 0.00 -0.22 0.00 0.00 33.01 28.46 1h42 s GLN 182 CO -0.19 -1.30 1.35 0.12 -0.25 0.00 0.00 175.29 175.02 1h42 s PHE 183 N 1.29 3.19 0.00 0.91 5.36 -1.26 -4.83 117.98 122.64 1h42 s PHE 183 Ca 0.06 1.16 0.00 0.00 -0.96 0.00 0.00 56.93 57.19 1h42 s PHE 183 Cb -0.26 -3.67 0.00 0.00 -0.34 0.00 0.00 43.02 38.76 1h42 s PHE 183 CO 0.00 -2.11 0.54 0.36 -1.46 0.00 0.00 175.22 172.55 1h42 n LYS 184 N 2.58 0.00 0.00 10.12 2.85 -0.56 -5.05 118.16 128.09 1h42 n LYS 184 Ca 0.06 -0.53 0.00 0.00 -1.05 0.00 0.00 58.31 56.80 1h42 n LYS 184 Cb 0.42 -0.43 0.00 0.00 -0.65 0.00 0.00 35.03 34.37 1h42 n LYS 184 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1h42 n GLY 185 N 0.00 0.63 3.21 2.58 0.00 -1.03 -4.93 105.19 105.66 1h42 n GLY 185 Ca 0.00 -1.66 -0.29 0.00 0.00 0.00 0.00 46.02 44.07 1h42 n GLY 185 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1h42 s PHE 186 N 0.68 2.04 -0.03 1.61 5.36 -1.25 -4.62 117.98 121.77 1h42 s PHE 186 Ca 0.00 -0.55 0.06 0.00 -0.96 0.00 0.00 56.93 55.48 1h42 s PHE 186 Cb 0.00 -1.34 -0.01 0.00 -0.34 0.00 0.00 43.02 41.33 1h42 s PHE 186 CO 0.00 -0.15 -0.20 -1.54 -1.46 0.00 0.00 175.22 171.87 1h42 s SER 187 N -0.18 2.45 -0.12 6.13 1.04 0.25 -1.21 113.70 122.07 1h42 s SER 187 Ca -0.01 -0.39 -0.00 0.00 0.48 0.00 0.00 55.95 56.03 1h42 s SER 187 Cb -0.12 -0.48 0.03 0.00 0.10 0.00 0.00 66.02 65.55 1h42 s SER 187 CO 0.02 0.22 -0.07 0.86 0.98 0.00 0.00 173.24 175.25 1h42 s TRP 188 N -0.26 1.46 -0.24 5.02 -0.11 -0.34 -1.21 118.94 123.27 1h42 s TRP 188 Ca 0.02 -0.75 -0.07 0.00 1.22 0.00 0.00 56.10 56.52 1h42 s TRP 188 Cb -0.10 -1.22 -0.03 0.00 -1.50 0.00 0.00 33.47 30.62 1h42 s TRP 188 CO 0.01 -0.52 0.05 -1.17 -4.62 0.00 0.00 176.95 170.71 1h42 s LEU 189 N 1.72 3.42 -0.32 5.86 2.96 -0.54 0.12 118.68 131.90 1h42 s LEU 189 Ca 0.05 -0.19 -0.10 0.00 -0.22 0.00 0.00 54.13 53.67 1h42 s LEU 189 Cb -0.13 -1.91 -0.00 0.00 0.50 0.00 0.00 46.19 44.65 1h42 s LEU 189 CO -0.08 -0.00 0.15 -0.69 -1.32 0.00 0.00 176.35 174.41 1h42 s VAL 190 N 1.42 4.56 -0.20 1.68 1.01 -0.18 -0.61 120.40 128.07 1h42 s VAL 190 Ca 0.05 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 61.53 1h42 s VAL 190 Cb -0.15 -3.35 0.01 0.00 0.00 0.00 0.00 36.38 32.89 1h42 s VAL 190 CO 0.03 0.03 -0.12 0.12 0.00 0.00 0.00 175.10 175.16 1h42 s PHE 191 N 1.60 2.87 -0.26 5.22 5.36 -0.05 -1.12 117.98 131.59 1h42 s PHE 191 Ca 0.04 -1.28 -0.05 0.00 -0.96 0.00 0.00 56.93 54.68 1h42 s PHE 191 Cb -0.17 -2.01 0.00 0.00 -0.34 0.00 0.00 43.02 40.50 1h42 s PHE 191 CO 0.06 -0.67 0.03 0.20 -1.46 0.00 0.00 175.22 173.38 1h42 s GLY 192 N 1.37 1.71 0.08 13.12 0.00 0.21 -0.21 107.32 123.60 1h42 s GLY 192 Ca 0.05 -1.34 -0.03 0.00 0.00 0.00 0.00 44.72 43.40 1h42 s GLY 192 CO -0.08 0.56 0.05 -1.34 0.00 0.00 0.00 173.10 172.29 1h42 s VAL 193 N 1.48 0.17 0.14 1.40 -7.23 -0.74 -1.20 120.40 114.43 1h42 s VAL 193 Ca 0.03 -1.67 -0.08 0.00 -1.81 0.00 0.00 61.98 58.45 1h42 s VAL 193 Cb -0.16 -1.59 -0.11 0.00 0.56 0.00 0.00 36.38 35.09 1h42 s VAL 193 CO 0.00 -0.80 1.40 1.55 -0.31 0.00 0.00 175.10 176.94 1h42 h PRO 194 N 2.98 0.70 -5.11 4.82 0.13 -1.90 -2.81 132.00 130.81 1h42 h PRO 194 Ca -0.34 -0.51 -0.41 0.00 -0.87 0.00 0.00 66.00 63.88 1h42 h PRO 194 Cb 1.17 0.08 -0.14 0.00 0.13 0.00 0.00 31.00 32.24 1h42 h PRO 194 CO 0.62 1.13 -0.64 0.95 -0.23 0.00 0.00 178.00 179.83 1h42 s THR 195 N -3.89 1.02 0.24 1.56 -4.23 -1.26 -1.27 115.64 107.82 1h42 s THR 195 Ca -0.09 -2.02 -0.01 0.00 -1.18 0.00 0.00 61.69 58.39 1h42 s THR 195 Cb 0.10 -2.54 0.04 0.00 1.34 0.00 0.00 72.50 71.44 1h42 s THR 195 CO 0.88 -0.17 1.66 0.74 -0.54 0.00 0.00 174.62 177.19 1h42 h THR 196 N 2.34 1.28 -0.03 3.99 2.02 -1.94 -2.20 112.91 118.36 1h42 h THR 196 Ca -0.39 -1.37 0.01 0.00 0.77 0.00 0.00 66.41 65.42 1h42 h THR 196 Cb 1.23 1.36 -0.00 0.00 -1.74 0.00 0.00 68.15 69.00 1h42 h THR 196 CO 0.65 0.44 0.07 -0.65 0.37 0.00 0.00 175.52 176.41 1h42 h PRO 197 N 0.52 0.00 -0.01 6.66 0.11 -1.88 -2.56 132.00 134.84 1h42 h PRO 197 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1h42 h PRO 197 Cb 0.75 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.86 1h42 h PRO 197 CO 0.06 0.00 -0.18 0.09 -0.21 0.00 0.00 178.00 177.76 1h42 n ASN 198 N -3.32 1.03 -4.56 -2.05 4.13 -0.84 -1.75 115.26 107.90 1h42 n ASN 198 Ca -0.02 -0.96 -0.31 0.00 1.68 0.00 0.00 54.58 54.96 1h42 n ASN 198 Cb 0.15 0.08 -0.04 0.00 -1.54 0.00 0.00 39.78 38.43 1h42 n ASN 198 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1h42 s ILE 199 N -2.40 3.35 0.18 2.41 1.01 -0.97 -4.88 121.20 119.91 1h42 s ILE 199 Ca 0.28 -0.08 -0.31 0.00 0.00 0.00 0.00 60.65 60.53 1h42 s ILE 199 Cb 0.20 -3.84 -0.10 0.00 0.01 0.00 0.00 42.46 38.72 1h42 s ILE 199 CO 0.48 -0.80 1.56 -0.76 0.00 0.00 0.00 174.94 175.42 1h42 s LEU 200 N 10.16 4.37 -1.50 2.97 1.43 -1.26 -2.83 118.68 132.01 1h42 s LEU 200 Ca 0.72 2.66 -0.00 0.00 -1.03 0.00 0.00 54.13 56.47 1h42 s LEU 200 Cb -0.10 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.52 1h42 s LEU 200 CO 0.10 -0.82 0.06 -1.22 0.23 0.00 0.00 176.35 174.70 1h42 n TYR 201 N 3.68 -0.94 -0.15 0.29 4.01 -1.26 -4.94 117.16 117.86 1h42 n TYR 201 Ca 0.13 0.05 -0.03 0.00 -0.16 0.00 0.00 57.90 57.88 1h42 n TYR 201 Cb 0.38 -3.59 0.03 0.00 -0.31 0.00 0.00 39.34 35.86 1h42 n TYR 201 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1h42 h LYS 202 N -0.13 0.02 -0.34 -0.72 3.64 -1.91 -0.83 116.57 116.30 1h42 h LYS 202 Ca -0.43 -0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 58.81 1h42 h LYS 202 Cb 1.31 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.12 1h42 h LYS 202 CO 0.50 0.02 -0.34 0.93 -2.27 0.00 0.00 179.45 178.28 1h42 h GLU 203 N 0.03 0.76 0.02 1.90 3.07 -1.92 -0.20 114.58 118.23 1h42 h GLU 203 Ca 0.23 -0.37 -0.22 0.00 -0.50 0.00 0.00 59.36 58.50 1h42 h GLU 203 Cb 0.35 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.25 1h42 h GLU 203 CO -0.46 0.99 -0.96 0.93 -1.40 0.00 0.00 179.01 178.11 1h42 h GLU 204 N 0.63 0.24 -0.51 2.33 5.08 -1.87 -0.54 114.58 119.93 1h42 h GLU 204 Ca 0.06 -0.29 -0.11 0.00 -1.00 0.00 0.00 59.36 58.03 1h42 h GLU 204 Cb 0.88 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.20 1h42 h GLU 204 CO 0.08 1.03 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.95 1h42 h LEU 205 N 0.12 0.94 -0.37 1.33 3.38 -0.91 -2.12 115.31 117.68 1h42 h LEU 205 Ca -0.06 -0.30 -0.13 0.00 0.09 0.00 0.00 57.88 57.48 1h42 h LEU 205 Cb 1.62 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 42.09 1h42 h LEU 205 CO 0.15 1.06 -0.62 -0.33 0.09 0.00 0.00 178.44 178.79 1h42 h GLU 206 N 0.85 0.00 -0.50 1.13 5.08 -0.95 -2.68 114.58 117.51 1h42 h GLU 206 Ca 0.14 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.40 1h42 h GLU 206 Cb 0.64 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 1h42 h GLU 206 CO 0.04 0.62 -0.06 0.93 -1.00 0.00 0.00 179.01 179.54 1h42 h GLU 207 N 0.00 0.93 -0.74 2.33 5.08 -0.93 -2.18 114.58 119.07 1h42 h GLU 207 Ca -0.01 -0.32 -0.04 0.00 -1.00 0.00 0.00 59.36 57.99 1h42 h GLU 207 Cb 1.31 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 1h42 h GLU 207 CO 0.08 0.98 0.31 0.82 -1.00 0.00 0.00 179.01 180.20 1h42 h ILE 208 N 0.78 1.25 -0.17 3.13 2.04 -1.27 -1.77 117.51 121.51 1h42 h ILE 208 Ca 0.13 -0.75 -0.12 0.00 1.00 0.00 0.00 64.86 65.12 1h42 h ILE 208 Cb 0.60 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 1h42 h ILE 208 CO 0.04 0.31 -0.42 -0.61 0.00 0.00 0.00 178.15 177.46 1h42 h GLN 209 N 1.05 0.40 -0.03 2.37 4.15 -1.38 0.14 115.11 121.81 1h42 h GLN 209 Ca 0.25 -0.20 -0.15 0.00 0.77 0.00 0.00 58.65 59.31 1h42 h GLN 209 Cb 0.18 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 1h42 h GLN 209 CO -0.02 0.76 -0.66 1.96 -1.93 0.00 0.00 178.83 178.93 1h42 h GLN 210 N 0.33 0.15 0.09 1.69 1.08 -1.26 -2.85 115.11 114.33 1h42 h GLN 210 Ca 0.03 -0.11 -0.27 0.00 -1.45 0.00 0.00 58.65 56.85 1h42 h GLN 210 Cb 0.88 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.32 1h42 h GLN 210 CO 0.07 0.75 -1.27 -0.22 -0.95 0.00 0.00 178.83 177.21 1h42 h LYS 211 N 0.10 0.19 -2.11 1.46 3.64 -1.07 -3.40 116.57 115.38 1h42 h LYS 211 Ca -0.01 -0.32 -0.56 0.00 -1.27 0.00 0.00 60.65 58.49 1h42 h LYS 211 Cb 1.18 0.12 -0.41 0.00 -0.41 0.00 0.00 32.23 32.71 1h42 h LYS 211 CO 0.10 1.10 -0.89 0.66 -2.27 0.00 0.00 179.45 178.15 1h42 n TYR 212 N -3.44 1.71 0.32 1.91 4.01 0.46 -4.96 117.16 117.17 1h42 n TYR 212 Ca -0.09 -3.87 0.15 0.00 -0.16 0.00 0.00 57.90 53.94 1h42 n TYR 212 Cb 1.01 -0.45 0.59 0.00 -0.31 0.00 0.00 39.34 40.17 1h42 n TYR 212 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1h42 h PRO 213 N 3.67 0.00 0.00 -0.72 0.13 -1.72 -1.04 132.00 132.32 1h42 h PRO 213 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1h42 h PRO 213 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1h42 h PRO 213 CO 0.64 0.00 -0.78 -0.25 -0.23 0.00 0.00 178.00 177.39 1h42 n ASP 214 N -2.81 0.76 -0.00 1.44 8.00 -1.26 -4.33 116.55 118.35 1h42 n ASP 214 Ca 0.01 -0.64 0.01 0.00 0.71 0.00 0.00 54.79 54.88 1h42 n ASP 214 Cb 0.30 0.66 -0.01 0.00 -0.02 0.00 0.00 41.12 42.05 1h42 n ASP 214 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1h42 n ASN 215 N -1.51 1.33 -3.71 -2.24 4.13 -0.88 -4.85 115.26 107.53 1h42 n ASN 215 Ca 0.05 -0.40 -0.18 0.00 1.68 0.00 0.00 54.58 55.73 1h42 n ASN 215 Cb 0.33 1.03 -0.17 0.00 -1.54 0.00 0.00 39.78 39.44 1h42 n ASN 215 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1h42 s PHE 216 N -1.47 0.01 -0.09 3.10 5.36 -0.45 -0.58 117.98 123.85 1h42 s PHE 216 Ca 0.00 0.27 0.00 0.00 -0.96 0.00 0.00 56.93 56.25 1h42 s PHE 216 Cb 0.02 -0.35 -0.03 0.00 -0.34 0.00 0.00 43.02 42.32 1h42 s PHE 216 CO 0.09 -0.17 -0.08 0.50 -1.46 0.00 0.00 175.22 174.11 1h42 s ARG 217 N 1.77 3.01 -0.21 10.12 3.52 -0.35 -4.61 118.95 132.20 1h42 s ARG 217 Ca -0.01 -0.58 0.01 0.00 -0.13 0.00 0.00 55.73 55.02 1h42 s ARG 217 Cb -0.12 -2.64 0.03 0.00 -1.56 0.00 0.00 34.95 30.66 1h42 s ARG 217 CO -0.04 0.51 -0.15 -1.17 -0.81 0.00 0.00 175.30 173.64 1h42 s LEU 218 N -0.39 2.61 -0.07 -0.88 2.96 -1.26 -1.46 118.68 120.19 1h42 s LEU 218 Ca 0.05 -0.85 0.05 0.00 -0.22 0.00 0.00 54.13 53.16 1h42 s LEU 218 Cb -0.12 -1.53 -0.01 0.00 0.50 0.00 0.00 46.19 45.03 1h42 s LEU 218 CO 0.02 -0.06 -0.23 -0.89 -1.32 0.00 0.00 176.35 173.87 1h42 s THR 219 N 1.26 2.25 -0.04 3.68 2.01 0.22 -5.01 115.64 120.00 1h42 s THR 219 Ca 0.01 -0.98 0.01 0.00 0.31 0.00 0.00 61.69 61.03 1h42 s THR 219 Cb -0.15 -1.84 -0.03 0.00 0.01 0.00 0.00 72.50 70.48 1h42 s THR 219 CO -0.10 0.56 -0.02 -0.31 -0.69 0.00 0.00 174.62 174.07 1h42 s TYR 220 N -0.05 3.05 -0.36 4.92 2.02 -1.26 -0.88 117.35 124.79 1h42 s TYR 220 Ca -0.06 0.09 0.04 0.00 -0.37 0.00 0.00 57.07 56.76 1h42 s TYR 220 Cb -0.15 -1.71 0.10 0.00 -0.40 0.00 0.00 41.96 39.81 1h42 s TYR 220 CO 0.05 0.43 0.08 0.00 -1.57 0.00 0.00 175.55 174.53 1h42 s ALA 221 N -0.96 2.92 -0.39 3.71 0.00 0.70 -4.90 121.76 122.83 1h42 s ALA 221 Ca 0.16 -2.61 -0.06 0.00 0.00 0.00 0.00 51.96 49.46 1h42 s ALA 221 Cb -0.11 -1.98 0.08 0.00 0.00 0.00 0.00 23.12 21.11 1h42 s ALA 221 CO 0.06 -1.73 0.19 0.42 0.00 0.00 0.00 175.76 174.70 1h42 s ILE 222 N 0.78 3.67 0.31 0.00 1.01 -1.26 -1.79 121.20 123.92 1h42 s ILE 222 Ca 0.12 -1.61 0.14 0.00 0.00 0.00 0.00 60.65 59.29 1h42 s ILE 222 Cb -0.20 -3.30 0.07 0.00 0.01 0.00 0.00 42.46 39.04 1h42 s ILE 222 CO -0.07 -0.49 1.76 0.77 0.00 0.00 0.00 174.94 176.91 1h42 h SER 223 N 8.20 0.00 0.27 3.58 4.64 -1.39 -0.81 113.55 128.05 1h42 h SER 223 Ca -0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 1h42 h SER 223 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 1h42 h SER 223 CO 0.69 0.44 -0.32 0.54 -0.87 0.00 0.00 176.83 177.30 1h42 n ARG 224 N -3.88 0.68 0.00 4.77 5.12 -0.40 -4.07 116.66 118.88 1h42 n ARG 224 Ca -0.01 -0.41 0.00 0.00 -1.93 0.00 0.00 57.85 55.50 1h42 n ARG 224 Cb 0.48 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 30.29 1h42 n ARG 224 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1h42 n GLU 225 N -0.80 1.68 -4.17 5.56 1.02 -0.97 -5.06 120.64 117.90 1h42 n GLU 225 Ca 0.11 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 57.08 1h42 n GLU 225 Cb 0.35 -0.88 -0.12 0.00 -0.02 0.00 0.00 31.44 30.77 1h42 n GLU 225 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1h42 s GLN 226 N -1.76 0.69 0.03 3.49 -0.21 -0.35 -5.06 119.66 116.50 1h42 s GLN 226 Ca 0.00 -0.75 0.06 0.00 0.02 0.00 0.00 55.36 54.69 1h42 s GLN 226 Cb 0.00 -0.60 -0.03 0.00 1.00 0.00 0.00 33.01 33.38 1h42 s GLN 226 CO 0.00 0.14 -0.14 0.15 -2.12 0.00 0.00 175.29 173.32 1h42 s LYS 227 N -1.36 2.22 0.87 2.91 -0.14 -1.26 -1.76 119.74 121.22 1h42 s LYS 227 Ca -0.04 -0.91 -0.12 0.00 -1.36 0.00 0.00 55.97 53.54 1h42 s LYS 227 Cb -0.09 -2.29 0.11 0.00 -1.68 0.00 0.00 37.83 33.88 1h42 s LYS 227 CO 0.01 0.56 1.12 0.54 -0.76 0.00 0.00 175.35 176.82 1h42 s ASN 228 N -1.49 3.88 0.41 2.83 2.20 0.25 -4.76 114.94 118.26 1h42 s ASN 228 Ca 0.16 1.11 0.26 0.00 -0.94 0.00 0.00 52.86 53.45 1h42 s ASN 228 Cb -0.11 -1.75 1.43 0.00 -2.00 0.00 0.00 41.25 38.83 1h42 s ASN 228 CO 0.07 -2.33 1.80 -0.65 -2.94 0.00 0.00 177.10 173.04 1h42 h PRO 229 N -1.34 0.00 -0.00 3.55 0.11 -1.97 -1.55 132.00 130.79 1h42 h PRO 229 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1h42 h PRO 229 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1h42 h PRO 229 CO 0.61 0.00 -0.27 1.04 -0.21 0.00 0.00 178.00 179.17 1h42 n GLN 230 N -2.44 0.45 -0.28 1.05 3.00 -1.26 -4.93 117.38 112.97 1h42 n GLN 230 Ca -0.02 -0.22 0.00 0.00 -0.01 0.00 0.00 57.00 56.75 1h42 n GLN 230 Cb 0.07 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 28.82 1h42 n GLN 230 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1h42 n GLY 231 N 1.39 0.67 3.94 1.08 0.00 -0.58 -5.07 105.19 106.62 1h42 n GLY 231 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 1h42 n GLY 231 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h42 s GLY 232 N -1.35 1.72 0.37 -0.02 0.00 -1.26 -4.82 107.32 101.95 1h42 s GLY 232 Ca 0.00 -1.08 -0.27 0.00 0.00 0.00 0.00 44.72 43.36 1h42 s GLY 232 CO 0.00 -0.63 1.28 0.50 0.00 0.00 0.00 173.10 174.26 1h42 s ARG 233 N -5.27 4.18 -0.23 2.90 0.52 -1.26 -0.58 118.95 119.21 1h42 s ARG 233 Ca 0.62 2.14 -0.29 0.00 -0.52 0.00 0.00 55.73 57.68 1h42 s ARG 233 Cb -0.09 -2.91 -0.02 0.00 0.52 0.00 0.00 34.95 32.46 1h42 s ARG 233 CO 0.45 -0.31 1.44 1.41 0.02 0.00 0.00 175.30 178.31 1h42 s MET 234 N -2.02 3.94 0.42 3.54 -2.45 -0.72 -4.49 119.30 117.52 1h42 s MET 234 Ca 0.53 1.54 0.07 0.00 -1.25 0.00 0.00 55.69 56.57 1h42 s MET 234 Cb -0.38 -3.93 -0.05 0.00 1.25 0.00 0.00 34.83 31.72 1h42 s MET 234 CO 0.49 -1.11 0.14 0.71 1.05 0.00 0.00 175.02 176.31 1h42 s TYR 235 N 4.54 2.53 0.45 4.11 2.02 -1.26 -3.04 117.35 126.69 1h42 s TYR 235 Ca 0.63 -0.63 0.15 0.00 -0.37 0.00 0.00 57.07 56.85 1h42 s TYR 235 Cb -0.22 -1.91 1.08 0.00 -0.40 0.00 0.00 41.96 40.51 1h42 s TYR 235 CO 0.25 0.22 1.99 0.97 -1.57 0.00 0.00 175.55 177.41 1h42 h ILE 236 N 1.48 0.88 -0.05 2.71 2.10 -1.93 -2.16 117.51 120.53 1h42 h ILE 236 Ca -0.43 -0.12 -0.05 0.00 1.08 0.00 0.00 64.86 65.34 1h42 h ILE 236 Cb 1.25 0.50 -0.01 0.00 -1.09 0.00 0.00 36.82 37.47 1h42 h ILE 236 CO 0.72 0.06 -0.19 0.06 -1.08 0.00 0.00 178.15 177.73 1h42 h GLN 237 N 0.35 0.09 0.01 2.19 3.07 -1.91 -0.99 115.11 117.92 1h42 h GLN 237 Ca 0.27 -0.02 -0.22 0.00 0.09 0.00 0.00 58.65 58.77 1h42 h GLN 237 Cb 0.58 -0.01 -0.00 0.00 0.08 0.00 0.00 27.48 28.12 1h42 h GLN 237 CO -0.07 0.28 -0.94 -0.44 0.09 0.00 0.00 178.83 177.75 1h42 h ASP 238 N 0.08 0.42 0.89 0.06 3.32 -1.76 -0.37 116.42 119.06 1h42 h ASP 238 Ca 0.02 -0.35 -0.16 0.00 0.02 0.00 0.00 57.03 56.56 1h42 h ASP 238 Cb 0.38 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1h42 h ASP 238 CO 0.03 1.15 -0.78 0.03 -1.72 0.00 0.00 179.24 177.95 1h42 h ARG 239 N 0.17 0.00 -0.12 3.56 2.47 -1.31 -0.91 114.38 118.24 1h42 h ARG 239 Ca -0.07 0.00 -0.16 0.00 -1.26 0.00 0.00 59.98 58.49 1h42 h ARG 239 Cb 1.58 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.89 1h42 h ARG 239 CO 0.16 0.78 -0.61 0.28 0.56 0.00 0.00 179.97 181.13 1h42 h VAL 240 N 0.00 1.35 -0.19 2.04 2.07 -1.12 -2.61 116.25 117.80 1h42 h VAL 240 Ca -0.01 -1.94 -0.13 0.00 0.82 0.00 0.00 66.70 65.45 1h42 h VAL 240 Cb 1.44 1.93 -0.01 0.00 -1.52 0.00 0.00 31.29 33.12 1h42 h VAL 240 CO 0.10 0.59 -0.44 0.00 0.02 0.00 0.00 177.57 177.84 1h42 h ALA 241 N 1.03 0.90 -0.13 1.67 0.00 -0.87 0.11 119.26 121.95 1h42 h ALA 241 Ca -0.01 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.36 1h42 h ALA 241 Cb 1.15 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1h42 h ALA 241 CO 0.11 0.64 -0.34 1.49 0.00 0.00 0.00 179.25 181.15 1h42 h GLU 242 N 0.37 0.27 -0.06 0.00 4.81 -1.12 -3.15 114.58 115.69 1h42 h GLU 242 Ca 0.03 -0.11 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1h42 h GLU 242 Cb 0.92 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.29 1h42 h GLU 242 CO 0.08 0.58 -0.03 0.72 -0.73 0.00 0.00 179.01 179.64 1h42 n HIS 243 N -4.08 0.22 -0.36 0.92 8.25 -0.99 -4.82 115.22 114.36 1h42 n HIS 243 Ca -0.01 -1.01 -0.00 0.00 -0.26 0.00 0.00 57.72 56.44 1h42 n HIS 243 Cb 0.43 -0.20 0.13 0.00 1.12 0.00 0.00 29.99 31.48 1h42 n HIS 243 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1h42 h ALA 244 N 0.45 1.29 -0.22 -1.41 0.00 -0.75 -0.85 119.26 117.77 1h42 h ALA 244 Ca 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1h42 h ALA 244 Cb 1.11 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1h42 h ALA 244 CO 0.06 0.53 0.00 -0.44 0.00 0.00 0.00 179.25 179.40 1h42 h ASP 245 N 1.24 0.39 -0.30 0.00 5.19 -1.86 -1.14 116.42 119.94 1h42 h ASP 245 Ca 0.39 -0.30 -0.00 0.00 -0.62 0.00 0.00 57.03 56.49 1h42 h ASP 245 Cb -0.01 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 39.39 1h42 h ASP 245 CO -0.12 0.59 0.17 1.56 -3.12 0.00 0.00 179.24 178.33 1h42 h GLN 246 N 0.17 0.41 -0.62 3.56 4.20 -1.80 -1.39 115.11 119.64 1h42 h GLN 246 Ca 0.06 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.65 1h42 h GLN 246 Cb 0.39 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.07 1h42 h GLN 246 CO 0.01 0.34 0.08 -0.07 -0.67 0.00 0.00 178.83 178.52 1h42 h LEU 247 N 0.38 0.98 -0.67 1.46 3.38 -1.09 -1.79 115.31 117.96 1h42 h LEU 247 Ca 0.11 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.77 1h42 h LEU 247 Cb 0.04 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 1h42 h LEU 247 CO -0.02 0.99 0.13 -0.25 0.09 0.00 0.00 178.44 179.38 1h42 h TRP 248 N 0.95 1.16 -0.43 1.13 2.91 -1.05 -0.36 115.95 120.26 1h42 h TRP 248 Ca 0.19 -0.15 -0.04 0.00 1.13 0.00 0.00 58.89 60.01 1h42 h TRP 248 Cb 0.44 -0.32 -0.02 0.00 -0.51 0.00 0.00 29.16 28.75 1h42 h TRP 248 CO 0.03 0.97 0.09 1.96 -1.03 0.00 0.00 178.44 180.46 1h42 h GLN 249 N 1.02 0.64 -0.10 2.65 4.20 -0.93 -2.18 115.11 120.42 1h42 h GLN 249 Ca 0.21 -0.12 -0.22 0.00 0.06 0.00 0.00 58.65 58.58 1h42 h GLN 249 Cb 0.42 -0.10 0.01 0.00 0.30 0.00 0.00 27.48 28.10 1h42 h GLN 249 CO 0.01 0.59 -0.82 -0.07 -0.67 0.00 0.00 178.83 177.87 1h42 h LEU 250 N 0.62 0.78 -1.96 1.46 3.38 -0.99 -3.17 115.31 115.43 1h42 h LEU 250 Ca 0.14 -0.54 -0.02 0.00 0.09 0.00 0.00 57.88 57.55 1h42 h LEU 250 Cb 0.25 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 1h42 h LEU 250 CO -0.00 1.32 -0.11 0.40 0.09 0.00 0.00 178.44 180.14 1h42 h ILE 251 N 0.42 0.66 0.00 1.22 2.04 -0.72 -2.46 117.51 118.67 1h42 h ILE 251 Ca -0.06 -0.46 -0.03 0.00 1.00 0.00 0.00 64.86 65.31 1h42 h ILE 251 Cb 1.44 1.29 -0.00 0.00 -0.74 0.00 0.00 36.82 38.80 1h42 h ILE 251 CO 0.16 0.11 -0.15 0.11 0.00 0.00 0.00 178.15 178.37 1h42 h LYS 252 N 0.00 0.00 -6.66 2.37 1.57 -1.37 -3.43 116.57 109.05 1h42 h LYS 252 Ca -0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 1h42 h LYS 252 Cb 0.28 0.00 0.05 0.00 0.08 0.00 0.00 32.23 32.63 1h42 h LYS 252 CO 0.01 0.15 0.82 1.21 -0.57 0.00 0.00 179.45 181.08 1h42 s ASN 253 N -6.10 6.62 0.62 0.86 3.84 -0.93 -4.91 114.94 114.94 1h42 s ASN 253 Ca -0.01 2.62 0.38 0.00 0.21 0.00 0.00 52.86 56.07 1h42 s ASN 253 Cb 0.12 -2.61 2.08 0.00 -0.55 0.00 0.00 41.25 40.29 1h42 s ASN 253 CO 0.60 -0.77 2.27 0.06 -2.79 0.00 0.00 177.10 176.47 1h42 h GLN 254 N 6.08 0.00 -0.28 0.43 3.07 -1.89 -2.31 115.11 120.21 1h42 h GLN 254 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.30 1h42 h GLN 254 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.77 1h42 h GLN 254 CO 0.86 0.01 0.00 1.63 0.09 0.00 0.00 178.83 181.42 1h42 n LYS 255 N -3.31 2.28 -2.96 0.06 5.02 -1.26 -4.95 118.16 113.04 1h42 n LYS 255 Ca -0.02 -2.09 -0.40 0.00 -2.02 0.00 0.00 58.31 53.77 1h42 n LYS 255 Cb 0.12 -1.45 -0.04 0.00 -0.02 0.00 0.00 35.03 33.63 1h42 n LYS 255 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1h42 s THR 256 N -1.47 4.98 -0.06 -0.18 2.01 -0.87 -2.87 115.64 117.17 1h42 s THR 256 Ca 0.33 1.57 0.03 0.00 0.31 0.00 0.00 61.69 63.92 1h42 s THR 256 Cb 0.20 -4.10 -0.03 0.00 0.01 0.00 0.00 72.50 68.58 1h42 s THR 256 CO 0.28 0.17 -0.12 -1.00 -0.69 0.00 0.00 174.62 173.26 1h42 s HIS 257 N 1.23 2.77 -0.05 4.92 3.76 -0.14 -4.90 115.29 122.88 1h42 s HIS 257 Ca 0.39 -0.17 0.06 0.00 -0.15 0.00 0.00 55.06 55.20 1h42 s HIS 257 Cb -0.18 -1.67 -0.02 0.00 1.11 0.00 0.00 32.58 31.82 1h42 s HIS 257 CO 0.18 0.18 -0.22 0.99 -0.85 0.00 0.00 174.74 175.01 1h42 s THR 258 N -0.63 2.35 -0.14 1.30 2.01 -0.67 -1.16 115.64 118.69 1h42 s THR 258 Ca 0.09 -0.98 0.01 0.00 0.31 0.00 0.00 61.69 61.12 1h42 s THR 258 Cb -0.11 -1.86 0.02 0.00 0.01 0.00 0.00 72.50 70.55 1h42 s THR 258 CO 0.01 0.58 -0.17 -0.31 -0.69 0.00 0.00 174.62 174.04 1h42 s TYR 259 N -0.44 2.31 -0.17 4.92 1.51 0.37 -0.93 117.35 124.92 1h42 s TYR 259 Ca 0.05 -1.25 -0.02 0.00 -1.01 0.00 0.00 57.07 54.84 1h42 s TYR 259 Cb -0.12 -1.65 -0.01 0.00 -0.11 0.00 0.00 41.96 40.07 1h42 s TYR 259 CO 0.01 -0.64 -0.10 0.42 -1.11 0.00 0.00 175.55 174.13 1h42 s ILE 260 N 1.24 3.15 -0.08 2.71 1.01 0.24 -0.42 121.20 129.06 1h42 s ILE 260 Ca 0.01 -0.60 -0.08 0.00 0.00 0.00 0.00 60.65 59.97 1h42 s ILE 260 Cb -0.14 -2.37 0.02 0.00 0.01 0.00 0.00 42.46 39.98 1h42 s ILE 260 CO -0.08 0.49 0.23 0.00 0.00 0.00 0.00 174.94 175.58 1h42 n GLY 262 N 2.73 0.62 3.78 0.00 0.00 -1.18 -1.88 105.19 109.25 1h42 n GLY 262 Ca -0.14 -1.52 -0.37 0.00 0.00 0.00 0.00 46.02 44.00 1h42 n GLY 262 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h42 s PRO 263 N -2.00 3.92 0.09 1.61 0.04 -1.26 -2.33 135.00 135.06 1h42 s PRO 263 Ca 0.00 1.63 -0.31 0.00 0.04 0.00 0.00 61.00 62.37 1h42 s PRO 263 Cb 0.00 -2.43 -0.09 0.00 0.04 0.00 0.00 34.50 32.02 1h42 s PRO 263 CO 0.00 -0.38 1.79 0.50 0.04 0.00 0.00 177.00 178.94 1h42 s ARG 264 N -2.67 4.16 0.00 4.56 3.52 -1.26 -2.53 118.95 124.73 1h42 s ARG 264 Ca 0.62 2.50 0.00 0.00 -0.13 0.00 0.00 55.73 58.72 1h42 s ARG 264 Cb -0.25 -3.68 0.00 0.00 -1.56 0.00 0.00 34.95 29.46 1h42 s ARG 264 CO 0.31 -0.82 0.00 0.41 -0.81 0.00 0.00 175.30 174.38 1h42 n GLY 265 N 4.20 0.72 0.22 8.12 0.00 -1.26 -4.96 105.19 112.23 1h42 n GLY 265 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.33 1h42 n GLY 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h42 h MET 266 N 3.48 0.00 0.00 1.61 -0.00 -1.88 -3.26 114.93 114.87 1h42 h MET 266 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 59.70 59.66 1h42 h MET 266 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.59 1h42 h MET 266 CO 0.00 0.00 -0.19 0.93 -0.00 0.00 0.00 176.91 177.65 1h42 h GLU 267 N 0.00 0.00 -0.20 -0.10 3.07 -1.93 -3.30 114.58 112.12 1h42 h GLU 267 Ca 0.00 0.00 -0.06 0.00 -0.50 0.00 0.00 59.36 58.80 1h42 h GLU 267 Cb 0.80 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.71 1h42 h GLU 267 CO 0.00 0.19 -0.10 1.49 -1.40 0.00 0.00 179.01 179.18 1h42 h GLU 268 N 0.00 0.43 0.01 2.33 4.81 -1.99 -0.67 114.58 119.49 1h42 h GLU 268 Ca -0.00 -0.19 -0.20 0.00 -0.13 0.00 0.00 59.36 58.84 1h42 h GLU 268 Cb 0.52 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.86 1h42 h GLU 268 CO 0.02 0.72 -0.95 0.78 -0.73 0.00 0.00 179.01 178.85 1h42 h GLY 269 N 0.13 0.02 1.01 1.92 0.00 -1.80 -2.43 103.07 101.91 1h42 h GLY 269 Ca 0.04 -0.04 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 1h42 h GLY 269 CO 0.03 0.04 0.00 -2.22 0.00 0.00 0.00 176.54 174.39 1h42 h ILE 270 N 0.01 1.26 -0.46 2.60 2.04 -1.61 -2.31 117.51 119.03 1h42 h ILE 270 Ca -0.02 -1.07 -0.08 0.00 1.00 0.00 0.00 64.86 64.70 1h42 h ILE 270 Cb 1.67 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 38.71 1h42 h ILE 270 CO 0.13 0.37 -0.03 0.44 0.00 0.00 0.00 178.15 179.06 1h42 h ASP 271 N 0.73 0.75 0.17 1.72 3.32 -1.04 -2.00 116.42 120.07 1h42 h ASP 271 Ca 0.14 -0.19 -0.14 0.00 0.02 0.00 0.00 57.03 56.85 1h42 h ASP 271 Cb 0.51 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1h42 h ASP 271 CO 0.02 0.84 -0.53 0.00 -1.72 0.00 0.00 179.24 177.85 1h42 h ALA 272 N 1.24 0.83 -0.10 3.45 0.00 -1.36 -0.04 119.26 123.29 1h42 h ALA 272 Ca 0.14 -0.50 -0.15 0.00 0.00 0.00 0.00 54.91 54.40 1h42 h ALA 272 Cb 0.48 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.19 1h42 h ALA 272 CO 0.02 0.68 -0.53 0.00 0.00 0.00 0.00 179.25 179.43 1h42 h ALA 273 N 1.12 0.20 0.00 0.00 0.00 -1.26 -2.76 119.26 116.57 1h42 h ALA 273 Ca 0.01 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 1h42 h ALA 273 Cb 1.03 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 1h42 h ALA 273 CO 0.09 0.40 -0.06 -0.07 0.00 0.00 0.00 179.25 179.61 1h42 h LEU 274 N 0.13 0.00 -0.49 0.00 3.38 -1.30 -2.96 115.31 114.08 1h42 h LEU 274 Ca -0.04 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.80 1h42 h LEU 274 Cb 1.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 1h42 h LEU 274 CO 0.11 0.06 -0.20 -1.28 0.09 0.00 0.00 178.44 177.22 1h42 h SER 275 N 0.00 1.02 0.31 -0.43 0.87 -0.89 -0.80 113.55 113.63 1h42 h SER 275 Ca -0.00 -0.39 -0.12 0.00 -1.23 0.00 0.00 61.79 60.04 1h42 h SER 275 Cb 0.85 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.51 1h42 h SER 275 CO 0.01 1.18 -0.51 0.00 -0.53 0.00 0.00 176.83 176.98 1h42 h ALA 276 N 0.87 0.99 -0.13 6.23 0.00 -1.42 -1.82 119.26 123.98 1h42 h ALA 276 Ca 0.11 -0.48 -0.10 0.00 0.00 0.00 0.00 54.91 54.45 1h42 h ALA 276 Cb 0.78 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1h42 h ALA 276 CO 0.06 0.66 -0.31 0.00 0.00 0.00 0.00 179.25 179.66 1h42 h ALA 277 N 1.30 0.21 -0.09 0.00 0.00 -1.38 -3.27 119.26 116.03 1h42 h ALA 277 Ca 0.01 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.38 1h42 h ALA 277 Cb 0.96 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1h42 h ALA 277 CO 0.08 0.24 -0.45 0.00 0.00 0.00 0.00 179.25 179.12 1h42 h ALA 278 N 0.52 1.08 0.00 0.00 0.00 -1.09 -2.89 119.26 116.88 1h42 h ALA 278 Ca -0.00 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 1h42 h ALA 278 Cb 0.92 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1h42 h ALA 278 CO 0.07 0.61 -0.11 0.00 0.00 0.00 0.00 179.25 179.82 1h42 h ALA 279 N 1.36 1.27 0.00 0.00 0.00 -1.11 -1.98 119.26 118.80 1h42 h ALA 279 Ca 0.01 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1h42 h ALA 279 Cb 0.86 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1h42 h ALA 279 CO 0.07 0.14 -0.11 0.87 0.00 0.00 0.00 179.25 180.22 1h42 h LYS 280 N 0.00 0.00 -0.28 0.00 1.57 -1.56 -1.88 116.57 114.43 1h42 h LYS 280 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1h42 h LYS 280 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1h42 h LYS 280 CO 0.01 0.11 0.00 0.39 -0.57 0.00 0.00 179.45 179.40 1h42 n GLU 281 N -3.40 2.87 -1.00 3.15 1.02 -0.80 -4.98 120.64 117.51 1h42 n GLU 281 Ca -0.01 -2.50 0.00 0.00 -0.02 0.00 0.00 57.16 54.63 1h42 n GLU 281 Cb 0.29 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 1h42 n GLU 281 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1h42 n GLY 282 N -0.14 0.44 3.70 0.62 0.00 -0.70 -5.03 105.19 104.08 1h42 n GLY 282 Ca 0.17 -0.54 -0.35 0.00 0.00 0.00 0.00 46.02 45.30 1h42 n GLY 282 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h42 s VAL 283 N -2.00 4.99 -0.30 1.61 1.01 -0.86 -4.97 120.40 119.87 1h42 s VAL 283 Ca 0.00 0.03 -0.22 0.00 0.00 0.00 0.00 61.98 61.79 1h42 s VAL 283 Cb 0.00 -3.23 -0.00 0.00 0.00 0.00 0.00 36.38 33.15 1h42 s VAL 283 CO 0.00 0.50 0.72 0.42 0.00 0.00 0.00 175.10 176.74 1h42 s THR 284 N -0.01 4.86 0.20 3.92 -4.23 -1.26 -2.70 115.64 116.42 1h42 s THR 284 Ca 0.07 1.05 -0.09 0.00 -1.18 0.00 0.00 61.69 61.54 1h42 s THR 284 Cb -0.12 -4.08 0.13 0.00 1.34 0.00 0.00 72.50 69.78 1h42 s THR 284 CO 0.01 -0.19 1.76 -0.25 -0.54 0.00 0.00 174.62 175.41 1h42 h TRP 285 N 8.13 1.12 0.00 3.99 2.91 -1.89 -2.63 115.95 127.58 1h42 h TRP 285 Ca -0.25 -0.09 -0.01 0.00 1.13 0.00 0.00 58.89 59.67 1h42 h TRP 285 Cb 1.11 -0.34 -0.00 0.00 -0.51 0.00 0.00 29.16 29.42 1h42 h TRP 285 CO 0.77 0.86 -0.03 0.66 -1.03 0.00 0.00 178.44 179.67 1h42 h SER 286 N 1.06 0.00 0.20 2.65 4.64 -1.94 0.23 113.55 120.39 1h42 h SER 286 Ca 0.24 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.21 1h42 h SER 286 Cb 0.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 1h42 h SER 286 CO -0.02 0.03 -1.83 0.44 -0.87 0.00 0.00 176.83 174.58 1h42 h ASP 287 N 0.00 0.49 -0.28 4.97 3.32 -1.95 -3.10 116.42 119.87 1h42 h ASP 287 Ca -0.00 -0.87 -0.08 0.00 0.02 0.00 0.00 57.03 56.10 1h42 h ASP 287 Cb 0.09 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1h42 h ASP 287 CO 0.00 1.76 -0.09 0.22 -1.72 0.00 0.00 179.24 179.41 1h42 h TYR 288 N 0.09 0.74 -0.35 4.55 3.20 -1.04 -2.90 116.97 121.25 1h42 h TYR 288 Ca -0.37 -0.12 -0.07 0.00 3.14 0.00 0.00 58.73 61.31 1h42 h TYR 288 Cb 2.06 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 40.12 1h42 h TYR 288 CO 0.08 0.75 -0.08 0.37 -1.64 0.00 0.00 178.16 177.65 1h42 h GLN 289 N 0.63 0.59 -0.74 1.82 4.15 -0.68 -1.76 115.11 119.12 1h42 h GLN 289 Ca 0.11 -0.16 -0.04 0.00 0.77 0.00 0.00 58.65 59.33 1h42 h GLN 289 Cb 0.53 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.12 1h42 h GLN 289 CO 0.03 0.67 0.30 0.87 -1.93 0.00 0.00 178.83 178.77 1h42 h LYS 290 N 0.55 1.09 -0.06 1.69 1.57 -1.43 -0.34 116.57 119.64 1h42 h LYS 290 Ca 0.10 -0.19 -0.15 0.00 -1.87 0.00 0.00 60.65 58.55 1h42 h LYS 290 Cb 0.47 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1h42 h LYS 290 CO 0.02 0.88 -0.62 -0.44 -0.57 0.00 0.00 179.45 178.73 1h42 h ASP 291 N 1.07 0.27 -0.18 0.86 3.32 -1.34 -1.66 116.42 118.75 1h42 h ASP 291 Ca 0.25 -0.16 -0.15 0.00 0.02 0.00 0.00 57.03 56.99 1h42 h ASP 291 Cb 0.20 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1h42 h ASP 291 CO -0.02 0.82 -0.43 -0.07 -1.72 0.00 0.00 179.24 177.82 1h42 h LEU 292 N 0.17 0.79 -1.00 1.55 3.38 -0.98 -1.38 115.31 117.84 1h42 h LEU 292 Ca -0.01 -0.37 -0.06 0.00 0.09 0.00 0.00 57.88 57.53 1h42 h LEU 292 Cb 1.13 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 1h42 h LEU 292 CO 0.10 1.11 0.07 0.11 0.09 0.00 0.00 178.44 179.92 1h42 h LYS 293 N 0.59 0.80 -0.21 1.13 1.57 -0.89 0.13 116.57 119.69 1h42 h LYS 293 Ca 0.04 -0.18 -0.16 0.00 -1.87 0.00 0.00 60.65 58.48 1h42 h LYS 293 Cb 0.98 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.17 1h42 h LYS 293 CO 0.09 0.76 -0.52 -0.22 -0.57 0.00 0.00 179.45 178.99 1h42 h LYS 294 N 0.76 0.60 0.00 3.15 3.64 -1.19 -2.56 116.57 120.97 1h42 h LYS 294 Ca 0.16 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 1h42 h LYS 294 Cb 0.35 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1h42 h LYS 294 CO 0.01 0.97 0.00 0.00 -2.27 0.00 0.00 179.45 178.15 1h42 n ALA 295 N -2.52 2.24 -2.06 5.00 0.00 -0.53 -4.91 120.51 117.73 1h42 n ALA 295 Ca -0.03 -0.10 -0.04 0.00 0.00 0.00 0.00 53.44 53.27 1h42 n ALA 295 Cb 0.59 -1.42 -0.00 0.00 0.00 0.00 0.00 19.45 18.61 1h42 n ALA 295 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h42 n GLY 296 N 1.07 0.22 0.11 0.00 0.00 -0.79 -4.96 105.19 100.84 1h42 n GLY 296 Ca 0.09 -0.73 0.02 0.00 0.00 0.00 0.00 46.02 45.39 1h42 n GLY 296 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h42 n ARG 297 N -1.37 0.51 -3.99 1.61 1.74 0.39 -4.88 116.66 110.67 1h42 n ARG 297 Ca -0.04 -0.58 -0.31 0.00 -0.77 0.00 0.00 57.85 56.15 1h42 n ARG 297 Cb 0.53 -0.99 -0.15 0.00 -1.02 0.00 0.00 32.46 30.82 1h42 n ARG 297 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 1h42 s TRP 298 N -0.43 2.93 -0.19 -1.55 -0.11 -1.17 -1.66 118.94 116.75 1h42 s TRP 298 Ca 0.03 -2.19 -0.03 0.00 1.22 0.00 0.00 56.10 55.13 1h42 s TRP 298 Cb 0.03 -1.96 -0.01 0.00 -1.50 0.00 0.00 33.47 30.03 1h42 s TRP 298 CO 0.05 -0.85 -0.07 -1.01 -4.62 0.00 0.00 176.95 170.45 1h42 s HIS 299 N 1.21 2.92 -0.05 5.86 3.76 -0.11 -4.62 115.29 124.25 1h42 s HIS 299 Ca -0.03 -0.90 0.04 0.00 -0.15 0.00 0.00 55.06 54.02 1h42 s HIS 299 Cb -0.19 -2.03 0.00 0.00 1.11 0.00 0.00 32.58 31.47 1h42 s HIS 299 CO -0.07 -0.47 -0.16 0.08 -0.85 0.00 0.00 174.74 173.27 1h42 s VAL 300 N 1.17 1.39 -0.34 -0.90 1.01 -1.26 -0.59 120.40 120.87 1h42 s VAL 300 Ca 0.02 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.34 1h42 s VAL 300 Cb -0.14 -1.21 0.14 0.00 0.00 0.00 0.00 36.38 35.17 1h42 s VAL 300 CO -0.02 0.41 0.31 -0.70 0.00 0.00 0.00 175.10 175.10 1h42 s GLU 301 N 0.21 0.52 0.20 2.72 2.12 -0.13 -4.95 118.70 119.39 1h42 s GLU 301 Ca -0.07 -0.77 0.11 0.00 0.36 0.00 0.00 54.97 54.60 1h42 s GLU 301 Cb -0.13 -0.84 -0.04 0.00 0.26 0.00 0.00 34.13 33.37 1h42 s GLU 301 CO 0.03 -1.15 -0.23 0.95 -0.54 0.00 0.00 175.26 174.32 1h42 s THR 302 N 1.61 2.30 0.00 -1.70 -4.23 -1.26 -3.13 115.64 109.23 1h42 s THR 302 Ca 0.15 -2.06 0.00 0.00 -1.18 0.00 0.00 61.69 58.60 1h42 s THR 302 Cb -0.16 -2.11 0.00 0.00 1.34 0.00 0.00 72.50 71.56 1h42 s THR 302 CO -0.11 -0.17 0.00 0.00 -0.54 0.00 0.00 174.62 173.80