#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xvs n VAL 3 N 0.00 1.44 -4.36 2.53 0.24 -1.26 -5.01 118.33 111.91 1xvs n VAL 3 Ca 0.00 -2.10 -0.30 0.00 -2.04 0.00 0.00 64.34 59.90 1xvs n VAL 3 Cb 0.00 0.05 -0.11 0.00 -1.47 0.00 0.00 33.84 32.31 1xvs n VAL 3 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1xvs s SER 4 N -2.60 4.15 0.69 -1.34 0.01 -1.26 -5.13 113.70 108.22 1xvs s SER 4 Ca 0.30 -0.42 -0.16 0.00 1.31 0.00 0.00 55.95 56.98 1xvs s SER 4 Cb 0.29 -0.73 0.02 0.00 0.21 0.00 0.00 66.02 65.81 1xvs s SER 4 CO -0.04 0.20 1.20 -0.76 0.41 0.00 0.00 173.24 174.25 1xvs s LEU 5 N -1.95 3.40 0.14 2.44 1.43 -1.26 -4.89 118.68 117.99 1xvs s LEU 5 Ca 0.19 2.32 -0.35 0.00 -1.03 0.00 0.00 54.13 55.26 1xvs s LEU 5 Cb -0.11 -4.59 -0.15 0.00 0.03 0.00 0.00 46.19 41.37 1xvs s LEU 5 CO 0.10 -2.04 1.35 -2.65 0.23 0.00 0.00 176.35 173.34 1xvs n PRO 6 N -2.44 1.46 -2.57 1.29 -0.02 -1.26 -4.89 135.00 126.57 1xvs n PRO 6 Ca 0.13 0.53 -0.43 0.00 -2.02 0.00 0.00 63.50 61.71 1xvs n PRO 6 Cb 0.50 -2.16 -0.02 0.00 -0.02 0.00 0.00 33.50 31.80 1xvs n PRO 6 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xvs s ILE 8 N 3.40 2.95 -0.23 0.00 -1.09 -1.26 -0.42 121.20 124.54 1xvs s ILE 8 Ca 0.48 -0.64 -0.09 0.00 -2.23 0.00 0.00 60.65 58.17 1xvs s ILE 8 Cb -0.17 -2.31 -0.04 0.00 -1.58 0.00 0.00 42.46 38.36 1xvs s ILE 8 CO 0.10 0.47 0.11 -0.75 -1.23 0.00 0.00 174.94 173.64 1xvs s LYS 9 N 1.28 3.91 -0.11 2.79 2.20 -0.15 -4.96 119.74 124.71 1xvs s LYS 9 Ca 0.03 -0.36 0.01 0.00 -0.36 0.00 0.00 55.97 55.29 1xvs s LYS 9 Cb -0.14 -3.39 -0.02 0.00 -1.51 0.00 0.00 37.83 32.77 1xvs s LYS 9 CO -0.05 0.03 -0.12 0.42 -0.36 0.00 0.00 175.35 175.27 1xvs s ILE 10 N 1.07 3.15 0.15 5.43 1.01 -1.26 -1.63 121.20 129.13 1xvs s ILE 10 Ca 0.05 -0.64 0.08 0.00 0.00 0.00 0.00 60.65 60.14 1xvs s ILE 10 Cb -0.14 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.99 1xvs s ILE 10 CO 0.04 0.54 -0.19 -1.10 0.00 0.00 0.00 174.94 174.24 1xvs s GLN 11 N 0.00 1.24 -0.02 2.79 -0.21 -0.70 -5.00 119.66 117.76 1xvs s GLN 11 Ca -0.03 -1.35 -0.04 0.00 0.02 0.00 0.00 55.36 53.96 1xvs s GLN 11 Cb -0.14 -1.33 0.00 0.00 1.00 0.00 0.00 33.01 32.54 1xvs s GLN 11 CO 0.04 0.28 0.09 0.54 -2.12 0.00 0.00 175.29 174.11 1xvs s VAL 12 N -1.87 0.03 0.07 1.09 0.11 -1.26 -1.85 120.40 116.73 1xvs s VAL 12 Ca 0.14 -0.28 0.06 0.00 -2.93 0.00 0.00 61.98 58.97 1xvs s VAL 12 Cb -0.07 -0.22 -0.03 0.00 -1.53 0.00 0.00 36.38 34.53 1xvs s VAL 12 CO 0.06 -0.15 -0.17 -1.10 -3.33 0.00 0.00 175.10 170.40 1xvs s GLN 13 N -0.47 1.01 0.10 1.54 -0.21 -0.47 -4.98 119.66 116.18 1xvs s GLN 13 Ca -0.05 -0.99 0.02 0.00 0.02 0.00 0.00 55.36 54.35 1xvs s GLN 13 Cb -0.03 -1.12 -0.04 0.00 1.00 0.00 0.00 33.01 32.81 1xvs s GLN 13 CO 0.00 0.26 -0.07 0.95 -2.12 0.00 0.00 175.29 174.32 1xvs s THR 14 N -1.10 0.69 -0.22 -0.19 -4.23 -1.26 -0.30 115.64 109.02 1xvs s THR 14 Ca 0.03 -1.90 -0.13 0.00 -1.18 0.00 0.00 61.69 58.51 1xvs s THR 14 Cb -0.09 -1.64 0.07 0.00 1.34 0.00 0.00 72.50 72.17 1xvs s THR 14 CO 0.03 -0.85 0.55 -0.60 -0.54 0.00 0.00 174.62 173.20 1xvs s ARG 15 N -3.74 0.55 0.13 3.99 3.52 -0.78 -5.00 118.95 117.62 1xvs s ARG 15 Ca 0.11 0.98 -0.31 0.00 -0.13 0.00 0.00 55.73 56.39 1xvs s ARG 15 Cb 0.05 0.08 -0.07 0.00 -1.56 0.00 0.00 34.95 33.44 1xvs s ARG 15 CO -0.05 -0.15 1.29 -0.47 -0.81 0.00 0.00 175.30 175.11 1xvs s TYR 16 N 1.42 3.33 -0.72 5.12 5.04 -1.26 -0.50 117.35 129.78 1xvs s TYR 16 Ca -0.09 1.18 -0.16 0.00 -2.44 0.00 0.00 57.07 55.56 1xvs s TYR 16 Cb -0.07 -3.55 0.17 0.00 0.35 0.00 0.00 41.96 38.86 1xvs s TYR 16 CO -0.15 -1.77 0.72 0.42 -1.34 0.00 0.00 175.55 173.43 1xvs s ILE 17 N 0.72 5.30 0.24 3.14 -1.09 0.81 -4.91 121.20 125.41 1xvs s ILE 17 Ca 0.59 -1.89 -0.05 0.00 -2.23 0.00 0.00 60.65 57.07 1xvs s ILE 17 Cb -0.34 -4.47 0.18 0.00 -1.58 0.00 0.00 42.46 36.26 1xvs s ILE 17 CO 0.32 -1.04 1.83 -0.08 -1.23 0.00 0.00 174.94 174.74 1xvs h GLU 18 N 8.41 1.12 0.00 2.79 4.81 -1.94 -2.56 114.58 127.20 1xvs h GLU 18 Ca -0.06 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 1xvs h GLU 18 Cb 1.06 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.25 1xvs h GLU 18 CO 0.92 0.88 0.00 -0.85 -0.73 0.00 0.00 179.01 179.23 1xvs n GLU 19 N -4.30 0.02 -0.01 1.92 0.00 -1.26 -1.99 120.64 115.01 1xvs n GLU 19 Ca 0.07 0.37 0.03 0.00 0.00 0.00 0.00 57.16 57.63 1xvs n GLU 19 Cb 0.16 -1.50 0.03 0.00 0.00 0.00 0.00 31.44 30.13 1xvs n GLU 19 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1xvs n GLN 20 N -1.45 0.14 -3.91 3.44 6.02 -0.98 -5.05 117.38 115.59 1xvs n GLN 20 Ca 0.02 -0.96 -0.21 0.00 -0.01 0.00 0.00 57.00 55.83 1xvs n GLN 20 Cb 0.06 -1.13 -0.04 0.00 1.02 0.00 0.00 30.24 30.15 1xvs n GLN 20 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1xvs s SER 21 N -0.58 5.36 -0.41 1.08 0.01 -0.84 -4.75 113.70 113.56 1xvs s SER 21 Ca 0.08 -0.42 0.04 0.00 1.31 0.00 0.00 55.95 56.96 1xvs s SER 21 Cb 0.06 -1.11 0.17 0.00 0.21 0.00 0.00 66.02 65.34 1xvs s SER 21 CO 0.08 -0.25 0.42 0.21 0.41 0.00 0.00 173.24 174.11 1xvs s ASN 22 N -3.94 0.88 0.31 2.44 3.84 0.45 -4.99 114.94 113.93 1xvs s ASN 22 Ca 0.38 -2.15 0.07 0.00 0.21 0.00 0.00 52.86 51.37 1xvs s ASN 22 Cb -0.06 0.41 0.78 0.00 -0.55 0.00 0.00 41.25 41.83 1xvs s ASN 22 CO 0.26 -0.19 1.78 -0.65 -2.79 0.00 0.00 177.10 175.50 1xvs h PRO 23 N 6.20 0.70 -0.75 0.43 0.11 -1.95 -1.13 132.00 135.61 1xvs h PRO 23 Ca 0.13 -0.04 0.12 0.00 0.11 0.00 0.00 66.00 66.32 1xvs h PRO 23 Cb 1.01 -0.16 -0.08 0.00 0.11 0.00 0.00 31.00 31.88 1xvs h PRO 23 CO 0.22 0.46 0.35 0.93 -0.21 0.00 0.00 178.00 179.75 1xvs h GLU 24 N 0.72 0.53 -0.78 1.05 5.08 -1.96 0.46 114.58 119.69 1xvs h GLU 24 Ca 0.58 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.82 1xvs h GLU 24 Cb 0.96 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 30.04 1xvs h GLU 24 CO -0.38 0.35 0.11 0.66 -1.00 0.00 0.00 179.01 178.76 1xvs n TYR 25 N -4.92 1.65 -3.86 4.33 4.02 -0.49 -4.94 117.16 112.94 1xvs n TYR 25 Ca 0.13 -0.74 -0.29 0.00 -0.01 0.00 0.00 57.90 56.99 1xvs n TYR 25 Cb 0.36 -0.48 0.01 0.00 -0.02 0.00 0.00 39.34 39.20 1xvs n TYR 25 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1xvs n GLN 26 N 0.17 -2.33 -3.79 -0.72 6.02 0.15 -4.96 117.38 111.92 1xvs n GLN 26 Ca 0.25 0.40 -0.27 0.00 -0.01 0.00 0.00 57.00 57.37 1xvs n GLN 26 Cb 1.02 -4.24 -0.17 0.00 1.02 0.00 0.00 30.24 27.88 1xvs n GLN 26 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1xvs s ARG 27 N -6.40 0.90 -0.19 -1.09 3.52 -0.81 -4.23 118.95 110.65 1xvs s ARG 27 Ca 0.21 -0.36 0.00 0.00 -0.13 0.00 0.00 55.73 55.46 1xvs s ARG 27 Cb -0.08 -1.86 0.04 0.00 -1.56 0.00 0.00 34.95 31.49 1xvs s ARG 27 CO 0.88 -0.51 -0.08 -0.06 -0.81 0.00 0.00 175.30 174.72 1xvs s PHE 28 N 1.80 2.18 -0.14 5.12 0.08 -0.09 -0.41 117.98 126.52 1xvs s PHE 28 Ca 0.01 -1.44 -0.03 0.00 0.12 0.00 0.00 56.93 55.59 1xvs s PHE 28 Cb -0.16 -1.53 -0.03 0.00 -0.57 0.00 0.00 43.02 40.73 1xvs s PHE 28 CO -0.07 -0.70 -0.03 0.08 -0.10 0.00 0.00 175.22 174.39 1xvs s VAL 29 N 1.47 3.94 0.03 -0.44 1.01 -1.26 0.03 120.40 125.19 1xvs s VAL 29 Ca -0.01 -0.35 0.07 0.00 0.00 0.00 0.00 61.98 61.69 1xvs s VAL 29 Cb -0.16 -2.71 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 1xvs s VAL 29 CO -0.08 0.52 -0.21 -0.36 0.00 0.00 0.00 175.10 174.98 1xvs s PHE 30 N 0.05 1.80 -0.02 5.22 0.08 0.26 -0.13 117.98 125.24 1xvs s PHE 30 Ca 0.00 -0.37 0.01 0.00 0.12 0.00 0.00 56.93 56.70 1xvs s PHE 30 Cb -0.13 -1.09 -0.03 0.00 -0.57 0.00 0.00 43.02 41.19 1xvs s PHE 30 CO 0.03 0.07 -0.02 0.00 -0.10 0.00 0.00 175.22 175.20 1xvs s ALA 31 N -0.74 3.21 -0.01 5.36 0.00 0.34 -1.37 121.76 128.55 1xvs s ALA 31 Ca 0.07 -0.93 0.04 0.00 0.00 0.00 0.00 51.96 51.14 1xvs s ALA 31 Cb -0.09 -1.32 -0.01 0.00 0.00 0.00 0.00 23.12 21.71 1xvs s ALA 31 CO 0.01 0.62 -0.14 1.52 0.00 0.00 0.00 175.76 177.78 1xvs s TYR 32 N -1.01 1.25 -0.19 0.00 -0.85 -0.43 -1.87 117.35 114.25 1xvs s TYR 32 Ca 0.17 -0.24 0.01 0.00 -0.52 0.00 0.00 57.07 56.49 1xvs s TYR 32 Cb -0.11 -0.81 0.02 0.00 0.38 0.00 0.00 41.96 41.44 1xvs s TYR 32 CO 0.08 -0.03 -0.18 -1.17 -1.52 0.00 0.00 175.55 172.73 1xvs s LEU 33 N -0.31 2.26 -0.02 -3.49 2.96 0.59 -1.08 118.68 119.59 1xvs s LEU 33 Ca 0.05 -0.66 0.07 0.00 -0.22 0.00 0.00 54.13 53.37 1xvs s LEU 33 Cb -0.06 -1.51 -0.02 0.00 0.50 0.00 0.00 46.19 45.11 1xvs s LEU 33 CO -0.00 -0.01 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.15 1xvs s ILE 34 N 1.30 1.89 -0.08 6.68 1.01 0.16 -1.36 121.20 130.80 1xvs s ILE 34 Ca 0.04 -1.02 0.04 0.00 0.00 0.00 0.00 60.65 59.72 1xvs s ILE 34 Cb -0.13 -1.57 -0.00 0.00 0.01 0.00 0.00 42.46 40.76 1xvs s ILE 34 CO -0.12 0.53 -0.21 -0.89 0.00 0.00 0.00 174.94 174.25 1xvs s THR 35 N -0.50 1.82 -0.26 2.92 2.01 -0.77 -1.18 115.64 119.68 1xvs s THR 35 Ca 0.08 -0.90 0.03 0.00 0.31 0.00 0.00 61.69 61.20 1xvs s THR 35 Cb -0.10 -1.58 0.06 0.00 0.01 0.00 0.00 72.50 70.90 1xvs s THR 35 CO -0.00 0.51 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.70 1xvs s ILE 36 N 0.25 2.11 -0.20 1.82 1.01 0.14 -1.72 121.20 124.62 1xvs s ILE 36 Ca -0.13 -1.59 -0.06 0.00 0.00 0.00 0.00 60.65 58.87 1xvs s ILE 36 Cb -0.16 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.05 1xvs s ILE 36 CO 0.06 -0.03 0.03 -0.54 0.00 0.00 0.00 174.94 174.47 1xvs s LYS 37 N 1.13 3.76 -0.44 2.79 1.02 -0.65 0.08 119.74 127.44 1xvs s LYS 37 Ca -0.08 -0.45 -0.23 0.00 0.02 0.00 0.00 55.97 55.23 1xvs s LYS 37 Cb -0.20 -3.15 0.02 0.00 -0.52 0.00 0.00 37.83 33.99 1xvs s LYS 37 CO -0.05 0.10 0.76 1.21 -0.92 0.00 0.00 175.35 176.46 1xvs s ASN 38 N 0.79 6.42 -0.30 2.83 3.84 -0.21 -0.97 114.94 127.34 1xvs s ASN 38 Ca 0.02 -0.07 0.11 0.00 0.21 0.00 0.00 52.86 53.13 1xvs s ASN 38 Cb -0.14 -2.38 0.78 0.00 -0.55 0.00 0.00 41.25 38.97 1xvs s ASN 38 CO 0.02 -0.87 1.80 0.18 -2.79 0.00 0.00 177.10 175.44 1xvs n LEU 39 N 6.61 6.03 0.00 3.21 4.77 0.44 -0.32 117.00 137.74 1xvs n LEU 39 Ca 0.02 -3.11 -0.04 0.00 -0.03 0.00 0.00 56.01 52.85 1xvs n LEU 39 Cb 0.48 -0.73 0.01 0.00 -2.33 0.00 0.00 43.42 40.85 1xvs n LEU 39 CO 0.57 0.74 0.05 -1.54 -1.33 0.00 0.00 177.39 175.89 1xvs n SER 40 N 0.14 0.62 -1.55 -1.43 3.41 -1.22 -4.63 113.62 108.96 1xvs n SER 40 Ca 0.37 -1.28 0.08 0.00 -0.26 0.00 0.00 58.87 57.78 1xvs n SER 40 Cb 1.33 -0.06 0.35 0.00 -0.26 0.00 0.00 64.21 65.58 1xvs n SER 40 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1xvs n SER 41 N -2.64 4.88 -4.24 4.04 3.41 -1.26 -4.33 113.62 113.49 1xvs n SER 41 Ca 0.02 -2.65 -0.13 0.00 -0.26 0.00 0.00 58.87 55.84 1xvs n SER 41 Cb 0.11 -0.59 -0.10 0.00 -0.26 0.00 0.00 64.21 63.36 1xvs n SER 41 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xvs s GLN 42 N -2.22 1.08 0.19 4.33 -2.07 -1.26 -4.84 119.66 114.87 1xvs s GLN 42 Ca 0.50 -1.50 -0.27 0.00 -1.82 0.00 0.00 55.36 52.26 1xvs s GLN 42 Cb 0.35 -0.32 -0.08 0.00 -1.09 0.00 0.00 33.01 31.87 1xvs s GLN 42 CO 0.20 -0.09 0.84 -0.08 -1.32 0.00 0.00 175.29 174.84 1xvs s THR 43 N -3.60 4.26 0.38 3.63 -1.32 -1.26 -3.54 115.64 114.19 1xvs s THR 43 Ca 0.22 1.86 0.05 0.00 -1.21 0.00 0.00 61.69 62.60 1xvs s THR 43 Cb 0.06 -4.22 -0.06 0.00 -1.51 0.00 0.00 72.50 66.77 1xvs s THR 43 CO 0.03 0.51 0.04 0.68 -2.21 0.00 0.00 174.62 173.67 1xvs s VAL 44 N -1.13 1.40 -0.14 5.08 -7.23 -0.23 -3.47 120.40 114.68 1xvs s VAL 44 Ca 0.38 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.47 1xvs s VAL 44 Cb -0.24 -2.74 0.05 0.00 0.56 0.00 0.00 36.38 34.00 1xvs s VAL 44 CO 0.28 0.00 0.33 -1.58 -0.31 0.00 0.00 175.10 173.83 1xvs s GLN 45 N -3.81 0.32 0.39 4.82 0.74 -0.68 0.44 119.66 121.88 1xvs s GLN 45 Ca 0.31 0.62 -0.09 0.00 0.05 0.00 0.00 55.36 56.25 1xvs s GLN 45 Cb 0.08 -0.02 -0.06 0.00 1.10 0.00 0.00 33.01 34.11 1xvs s GLN 45 CO 0.15 -0.14 0.73 -1.17 -0.55 0.00 0.00 175.29 174.31 1xvs s LEU 46 N 1.10 3.86 0.91 3.68 0.20 -0.62 -0.91 118.68 126.91 1xvs s LEU 46 Ca -0.08 1.03 -0.13 0.00 0.69 0.00 0.00 54.13 55.64 1xvs s LEU 46 Cb -0.08 -3.90 0.14 0.00 -0.43 0.00 0.00 46.19 41.92 1xvs s LEU 46 CO -0.09 -0.37 1.18 -0.94 -0.29 0.00 0.00 176.35 175.85 1xvs s SER 48 N -3.24 3.53 0.01 3.68 1.04 -0.91 -3.84 113.70 113.98 1xvs s SER 48 Ca 0.49 0.75 -0.04 0.00 0.48 0.00 0.00 55.95 57.63 1xvs s SER 48 Cb -0.10 -1.17 -0.01 0.00 0.10 0.00 0.00 66.02 64.84 1xvs s SER 48 CO 0.32 -2.51 0.06 0.00 0.98 0.00 0.00 173.24 172.09 1xvs s ARG 49 N -5.50 0.42 -0.05 4.02 3.03 -0.01 -1.57 118.95 119.29 1xvs s ARG 49 Ca 0.66 -0.52 -0.02 0.00 2.03 0.00 0.00 55.73 57.87 1xvs s ARG 49 Cb -0.11 0.16 0.04 0.00 -1.03 0.00 0.00 34.95 34.01 1xvs s ARG 49 CO 0.52 -0.09 0.10 0.50 -1.13 0.00 0.00 175.30 175.20 1xvs s ARG 50 N -1.52 0.00 0.02 3.89 3.52 -0.43 -2.19 118.95 122.25 1xvs s ARG 50 Ca -0.15 0.38 0.06 0.00 -0.13 0.00 0.00 55.73 55.89 1xvs s ARG 50 Cb -0.08 -0.30 -0.03 0.00 -1.56 0.00 0.00 34.95 32.98 1xvs s ARG 50 CO 0.00 -0.24 -0.15 -1.58 -0.81 0.00 0.00 175.30 172.52 1xvs s TRP 51 N 1.69 2.65 -0.20 5.12 0.52 0.61 -0.99 118.94 128.34 1xvs s TRP 51 Ca -0.02 -0.19 0.01 0.00 0.02 0.00 0.00 56.10 55.92 1xvs s TRP 51 Cb -0.12 -1.51 0.04 0.00 -1.15 0.00 0.00 33.47 30.72 1xvs s TRP 51 CO -0.04 0.28 -0.14 -1.17 0.02 0.00 0.00 176.95 175.89 1xvs s LEU 52 N -1.37 2.45 -0.17 2.99 2.96 0.77 -2.01 118.68 124.30 1xvs s LEU 52 Ca 0.15 -0.89 0.01 0.00 -0.22 0.00 0.00 54.13 53.19 1xvs s LEU 52 Cb -0.11 -1.40 0.02 0.00 0.50 0.00 0.00 46.19 45.20 1xvs s LEU 52 CO 0.06 -0.09 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.17 1xvs s ILE 53 N 1.29 2.13 -0.14 6.68 1.01 -0.85 -2.07 121.20 129.26 1xvs s ILE 53 Ca -0.00 -0.92 0.02 0.00 0.00 0.00 0.00 60.65 59.74 1xvs s ILE 53 Cb -0.16 -1.89 0.01 0.00 0.01 0.00 0.00 42.46 40.44 1xvs s ILE 53 CO -0.09 0.54 -0.20 -0.89 0.00 0.00 0.00 174.94 174.30 1xvs s THR 54 N 1.19 1.90 0.42 2.92 2.01 0.60 -1.60 115.64 123.07 1xvs s THR 54 Ca 0.02 -0.87 -0.07 0.00 0.31 0.00 0.00 61.69 61.09 1xvs s THR 54 Cb -0.14 -1.70 0.10 0.00 0.01 0.00 0.00 72.50 70.77 1xvs s THR 54 CO -0.10 0.52 0.57 -0.90 -0.69 0.00 0.00 174.62 174.02 1xvs n ASP 55 N 4.25 0.09 0.15 3.53 5.68 -0.28 -0.58 116.55 129.39 1xvs n ASP 55 Ca -0.20 -1.24 0.12 0.00 -0.50 0.00 0.00 54.79 52.98 1xvs n ASP 55 Cb 0.51 -0.43 0.28 0.00 -1.14 0.00 0.00 41.12 40.34 1xvs n ASP 55 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1xvs h ALA 56 N -1.79 0.95 -0.01 2.12 0.00 -1.87 0.28 119.26 118.94 1xvs h ALA 56 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1xvs h ALA 56 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1xvs h ALA 56 CO 0.14 0.00 -0.24 -0.25 0.00 0.00 0.00 179.25 178.90 1xvs n ASP 57 N -2.62 1.59 0.00 0.00 8.00 -1.26 -4.95 116.55 117.31 1xvs n ASP 57 Ca 0.05 -1.29 0.00 0.00 0.71 0.00 0.00 54.79 54.26 1xvs n ASP 57 Cb 0.48 0.18 0.00 0.00 -0.02 0.00 0.00 41.12 41.76 1xvs n ASP 57 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xvs n GLY 58 N 1.33 0.88 3.72 0.44 0.00 0.99 -5.06 105.19 107.48 1xvs n GLY 58 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1xvs n GLY 58 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xvs s LYS 59 N -0.97 4.58 -0.03 1.61 2.20 -1.25 -4.77 119.74 121.10 1xvs s LYS 59 Ca 0.00 1.33 0.03 0.00 -0.36 0.00 0.00 55.97 56.97 1xvs s LYS 59 Cb 0.00 -3.42 -0.03 0.00 -1.51 0.00 0.00 37.83 32.87 1xvs s LYS 59 CO 0.00 0.08 -0.09 -0.65 -0.36 0.00 0.00 175.35 174.33 1xvs s GLN 60 N 0.55 2.58 0.02 4.03 -0.21 -1.26 -1.12 119.66 124.25 1xvs s GLN 60 Ca 0.47 -0.66 -0.01 0.00 0.02 0.00 0.00 55.36 55.17 1xvs s GLN 60 Cb -0.21 -2.49 -0.02 0.00 1.00 0.00 0.00 33.01 31.29 1xvs s GLN 60 CO 0.27 0.63 0.00 -0.08 -2.12 0.00 0.00 175.29 173.99 1xvs s THR 61 N -0.86 0.11 -0.02 -0.19 -1.32 -0.63 -4.98 115.64 107.75 1xvs s THR 61 Ca 0.14 -0.91 0.07 0.00 -1.21 0.00 0.00 61.69 59.77 1xvs s THR 61 Cb -0.11 -0.35 -0.02 0.00 -1.51 0.00 0.00 72.50 70.51 1xvs s THR 61 CO 0.03 -0.50 -0.22 -0.69 -2.21 0.00 0.00 174.62 171.03 1xvs s VAL 62 N -1.57 1.78 -0.07 5.08 1.01 -1.26 -2.00 120.40 123.37 1xvs s VAL 62 Ca -0.15 -0.96 -0.01 0.00 0.00 0.00 0.00 61.98 60.86 1xvs s VAL 62 Cb -0.09 -1.48 0.03 0.00 0.00 0.00 0.00 36.38 34.84 1xvs s VAL 62 CO -0.01 0.50 0.01 -0.69 0.00 0.00 0.00 175.10 174.91 1xvs s VAL 63 N -0.48 0.31 0.14 2.92 1.01 -0.85 -5.00 120.40 118.44 1xvs s VAL 63 Ca 0.07 0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.19 1xvs s VAL 63 Cb -0.09 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 1xvs s VAL 63 CO -0.00 0.25 0.09 -1.83 0.00 0.00 0.00 175.10 173.61 1xvs s GLU 64 N 2.00 0.96 0.00 2.72 -1.05 -1.26 -0.28 118.70 121.79 1xvs s GLU 64 Ca 0.05 -1.40 0.00 0.00 -0.15 0.00 0.00 54.97 53.47 1xvs s GLU 64 Cb -0.12 0.26 0.00 0.00 -0.44 0.00 0.00 34.13 33.83 1xvs s GLU 64 CO -0.05 -0.29 0.00 0.41 0.95 0.00 0.00 175.26 176.28 1xvs n GLY 65 N -0.11 -1.98 3.85 -3.83 0.00 -0.93 -5.02 105.19 97.17 1xvs n GLY 65 Ca -0.06 -1.16 -0.33 0.00 0.00 0.00 0.00 46.02 44.47 1xvs n GLY 65 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xvs s ASP 66 N -0.82 6.79 0.30 1.61 1.01 -1.26 -0.83 116.67 123.47 1xvs s ASP 66 Ca 0.00 1.17 0.00 0.00 0.71 0.00 0.00 52.55 54.43 1xvs s ASP 66 Cb 0.00 -2.32 0.00 0.00 1.01 0.00 0.00 42.92 41.61 1xvs s ASP 66 CO 0.00 -0.08 0.00 0.61 0.21 0.00 0.00 175.17 175.91 1xvs n GLY 67 N 0.08 -2.14 3.25 0.21 0.00 -1.26 -4.65 105.19 100.68 1xvs n GLY 67 Ca 0.00 -1.24 -0.32 0.00 0.00 0.00 0.00 46.02 44.46 1xvs n GLY 67 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xvs s VAL 68 N -2.46 2.11 -1.49 1.61 -7.23 0.56 -4.40 120.40 109.09 1xvs s VAL 68 Ca 0.00 -1.02 -0.13 0.00 -1.81 0.00 0.00 61.98 59.02 1xvs s VAL 68 Cb 0.00 -1.79 0.10 0.00 0.56 0.00 0.00 36.38 35.25 1xvs s VAL 68 CO 0.00 0.56 0.75 1.33 -0.31 0.00 0.00 175.10 177.44 1xvs n VAL 69 N 3.29 -1.42 -0.70 1.32 0.24 -1.26 -1.51 118.33 118.28 1xvs n VAL 69 Ca -0.18 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 1xvs n VAL 69 Cb 0.53 -2.25 0.00 0.00 -1.47 0.00 0.00 33.84 30.65 1xvs n VAL 69 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1xvs n GLY 70 N -1.43 0.73 3.18 7.63 0.00 -1.26 -5.02 105.19 109.02 1xvs n GLY 70 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 1xvs n GLY 70 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1xvs s GLU 71 N -0.30 0.87 -0.69 1.61 -1.05 -0.57 -4.99 118.70 113.58 1xvs s GLU 71 Ca 0.00 -1.30 -0.02 0.00 -0.15 0.00 0.00 54.97 53.50 1xvs s GLU 71 Cb 0.00 -0.36 0.17 0.00 -0.44 0.00 0.00 34.13 33.51 1xvs s GLU 71 CO 0.00 0.02 0.52 -0.65 0.95 0.00 0.00 175.26 176.10 1xvs s GLN 72 N -3.53 2.70 0.44 -4.83 -0.21 -1.26 -0.33 119.66 112.64 1xvs s GLN 72 Ca 0.11 -2.78 -0.25 0.00 0.02 0.00 0.00 55.36 52.46 1xvs s GLN 72 Cb 0.03 -3.74 -0.08 0.00 1.00 0.00 0.00 33.01 30.22 1xvs s GLN 72 CO -0.03 -1.20 1.30 -1.25 -2.12 0.00 0.00 175.29 172.00 1xvs s PRO 73 N -0.50 3.78 -0.24 2.91 0.04 -1.25 -4.65 135.00 135.09 1xvs s PRO 73 Ca 0.20 2.14 -0.05 0.00 0.04 0.00 0.00 61.00 63.32 1xvs s PRO 73 Cb -0.16 -2.61 -0.01 0.00 0.04 0.00 0.00 34.50 31.75 1xvs s PRO 73 CO -0.06 -0.65 0.01 0.50 0.04 0.00 0.00 177.00 176.84 1xvs s ARG 74 N -2.44 3.41 -0.20 4.56 3.52 -1.26 -1.59 118.95 124.95 1xvs s ARG 74 Ca 0.61 -0.62 -0.02 0.00 -0.13 0.00 0.00 55.73 55.57 1xvs s ARG 74 Cb -0.38 -3.17 0.00 0.00 -1.56 0.00 0.00 34.95 29.85 1xvs s ARG 74 CO 0.47 -0.24 -0.11 0.42 -0.81 0.00 0.00 175.30 175.04 1xvs s ILE 75 N 1.52 2.85 0.62 4.11 -1.09 0.17 -4.95 121.20 124.44 1xvs s ILE 75 Ca 0.05 -0.67 -0.17 0.00 -2.23 0.00 0.00 60.65 57.63 1xvs s ILE 75 Cb -0.15 -2.27 -0.02 0.00 -1.58 0.00 0.00 42.46 38.45 1xvs s ILE 75 CO -0.00 0.47 1.17 -0.54 -1.23 0.00 0.00 174.94 174.81 1xvs s LYS 76 N 1.39 2.86 0.01 2.79 1.02 -1.26 -1.07 119.74 125.48 1xvs s LYS 76 Ca 0.05 1.67 -0.39 0.00 0.02 0.00 0.00 55.97 57.32 1xvs s LYS 76 Cb -0.14 -1.93 -0.20 0.00 -0.52 0.00 0.00 37.83 35.05 1xvs s LYS 76 CO -0.07 -1.26 1.03 0.00 -0.92 0.00 0.00 175.35 174.13 1xvs n ALA 77 N -1.93 -3.57 -1.08 5.17 0.00 -1.23 -1.15 120.51 116.72 1xvs n ALA 77 Ca 0.12 0.58 -0.03 0.00 0.00 0.00 0.00 53.44 54.12 1xvs n ALA 77 Cb 0.51 -1.72 -0.01 0.00 0.00 0.00 0.00 19.45 18.22 1xvs n ALA 77 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1xvs n ASN 78 N 1.50 -4.43 -4.92 0.00 3.02 0.56 -4.97 115.26 106.03 1xvs n ASN 78 Ca 0.20 0.07 -0.21 0.00 -0.03 0.00 0.00 54.58 54.60 1xvs n ASN 78 Cb 0.09 -2.18 -0.01 0.00 -0.61 0.00 0.00 39.78 37.07 1xvs n ASN 78 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1xvs s ASP 79 N -2.24 5.03 0.06 6.41 1.11 -0.30 -4.91 116.67 121.83 1xvs s ASP 79 Ca 0.00 -0.83 -0.03 0.00 0.18 0.00 0.00 52.55 51.87 1xvs s ASP 79 Cb 0.00 -0.27 -0.03 0.00 1.07 0.00 0.00 42.92 43.69 1xvs s ASP 79 CO 0.00 -0.84 0.03 -1.83 1.18 0.00 0.00 175.17 173.70 1xvs s GLU 80 N -4.25 0.67 -0.05 8.23 -1.05 -1.26 -1.04 118.70 119.94 1xvs s GLU 80 Ca 0.48 -1.15 0.03 0.00 -0.15 0.00 0.00 54.97 54.18 1xvs s GLU 80 Cb -0.04 0.24 0.01 0.00 -0.44 0.00 0.00 34.13 33.90 1xvs s GLU 80 CO 0.29 -0.15 -0.13 -0.47 0.95 0.00 0.00 175.26 175.75 1xvs s TYR 81 N -3.89 1.43 0.05 4.83 5.04 0.11 -4.95 117.35 119.97 1xvs s TYR 81 Ca 0.06 -0.46 0.08 0.00 -2.44 0.00 0.00 57.07 54.31 1xvs s TYR 81 Cb 0.07 -1.01 -0.03 0.00 0.35 0.00 0.00 41.96 41.33 1xvs s TYR 81 CO -0.10 -0.21 -0.22 0.99 -1.34 0.00 0.00 175.55 174.67 1xvs s THR 82 N 0.40 2.50 0.27 4.34 2.01 -1.26 -0.68 115.64 123.22 1xvs s THR 82 Ca -0.09 -1.31 -0.12 0.00 0.31 0.00 0.00 61.69 60.47 1xvs s THR 82 Cb -0.13 -2.03 0.00 0.00 0.01 0.00 0.00 72.50 70.35 1xvs s THR 82 CO 0.03 0.33 0.52 -0.72 -0.69 0.00 0.00 174.62 174.09 1xvs s TYR 83 N -0.89 0.39 0.09 4.92 1.13 -0.32 -4.97 117.35 117.69 1xvs s TYR 83 Ca 0.13 -0.77 0.03 0.00 -1.41 0.00 0.00 57.07 55.06 1xvs s TYR 83 Cb -0.10 0.25 -0.04 0.00 -1.10 0.00 0.00 41.96 40.97 1xvs s TYR 83 CO 0.04 -1.08 -0.09 -1.54 -2.51 0.00 0.00 175.55 170.37 1xvs s SER 84 N -3.04 1.28 0.00 -0.18 1.04 -1.26 -0.66 113.70 110.87 1xvs s SER 84 Ca 0.22 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 55.82 1xvs s SER 84 Cb -0.01 0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.14 1xvs s SER 84 CO 0.11 -0.31 0.00 -0.24 0.98 0.00 0.00 173.24 173.77 1xvs n SER 85 N 0.52 0.00 -3.57 7.02 2.88 -0.24 -4.97 113.62 115.27 1xvs n SER 85 Ca -0.16 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.32 1xvs n SER 85 Cb 0.58 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.02 1xvs n SER 85 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1xvs s GLY 86 N 0.00 -0.37 0.04 0.46 0.00 -1.26 -1.31 107.32 104.88 1xvs s GLY 86 Ca 0.00 1.17 -0.05 0.00 0.00 0.00 0.00 44.72 45.84 1xvs s GLY 86 CO 0.00 0.38 0.08 -1.08 0.00 0.00 0.00 173.10 172.48 1xvs s THR 87 N -2.79 0.14 -0.00 0.90 -1.32 -0.47 -4.97 115.64 107.13 1xvs s THR 87 Ca 0.08 -1.19 0.05 0.00 -1.21 0.00 0.00 61.69 59.41 1xvs s THR 87 Cb -0.01 -0.99 -0.03 0.00 -1.51 0.00 0.00 72.50 69.97 1xvs s THR 87 CO -0.06 -0.66 -0.13 0.00 -2.21 0.00 0.00 174.62 171.56 1xvs s ALA 88 N -2.84 2.77 0.24 11.08 0.00 -1.26 -0.57 121.76 131.18 1xvs s ALA 88 Ca -0.03 -1.06 0.07 0.00 0.00 0.00 0.00 51.96 50.93 1xvs s ALA 88 Cb 0.00 -0.95 -0.05 0.00 0.00 0.00 0.00 23.12 22.12 1xvs s ALA 88 CO -0.06 0.58 -0.09 -0.51 0.00 0.00 0.00 175.76 175.69 1xvs s LEU 89 N -1.21 2.48 0.00 0.00 1.43 0.10 -4.95 118.68 116.54 1xvs s LEU 89 Ca 0.14 -1.12 0.29 0.00 -1.03 0.00 0.00 54.13 52.41 1xvs s LEU 89 Cb -0.11 -0.61 1.16 0.00 0.03 0.00 0.00 46.19 46.66 1xvs s LEU 89 CO 0.05 -0.29 1.86 0.47 0.23 0.00 0.00 176.35 178.67 1xvs n ASP 90 N -0.48 0.09 -4.36 2.29 8.00 -1.26 -0.91 116.55 119.91 1xvs n ASP 90 Ca -0.06 0.31 -0.20 0.00 0.71 0.00 0.00 54.79 55.55 1xvs n ASP 90 Cb 0.62 -0.36 -0.10 0.00 -0.02 0.00 0.00 41.12 41.26 1xvs n ASP 90 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1xvs s THR 91 N -2.95 1.85 -1.73 -3.53 -4.23 -1.26 -4.55 115.64 99.23 1xvs s THR 91 Ca 0.15 -2.20 0.25 0.00 -1.18 0.00 0.00 61.69 58.71 1xvs s THR 91 Cb 0.19 -2.05 0.58 0.00 1.34 0.00 0.00 72.50 72.55 1xvs s THR 91 CO 0.55 -0.53 1.83 -0.81 -0.54 0.00 0.00 174.62 175.11 1xvs n PRO 92 N -0.32 0.58 -3.84 3.99 -0.04 -1.26 -4.63 135.00 129.47 1xvs n PRO 92 Ca -0.08 0.03 -0.10 0.00 -0.04 0.00 0.00 63.50 63.30 1xvs n PRO 92 Cb 0.60 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.48 1xvs n PRO 92 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1xvs s VAL 93 N -2.27 0.11 0.00 0.52 1.01 -1.26 -0.95 120.40 117.57 1xvs s VAL 93 Ca 0.31 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.36 1xvs s VAL 93 Cb 0.17 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.58 1xvs s VAL 93 CO 0.32 -0.51 0.00 0.61 0.00 0.00 0.00 175.10 175.52 1xvs n GLY 94 N 0.58 1.10 0.00 4.51 0.00 -0.04 -2.98 105.19 108.36 1xvs n GLY 94 Ca -0.18 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.06 1xvs n GLY 94 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1xvs n VAL 95 N 0.00 0.00 0.00 1.61 0.31 0.25 -0.74 118.33 119.76 1xvs n VAL 95 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1xvs n VAL 95 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 1xvs n VAL 95 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xvs n GLN 97 N 0.00 0.00 0.00 5.55 10.64 -0.88 -0.29 117.38 132.40 1xvs n GLN 97 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 1xvs n GLN 97 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 1xvs n GLN 97 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1xvs n GLY 98 N -0.72 -0.72 3.18 2.61 0.00 -0.65 -0.16 105.19 108.73 1xvs n GLY 98 Ca 0.00 -0.41 -0.12 0.00 0.00 0.00 0.00 46.02 45.48 1xvs n GLY 98 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1xvs s GLN 99 N -0.68 0.57 -0.03 1.61 0.00 -0.16 -0.04 119.66 120.95 1xvs s GLN 99 Ca 0.00 -0.25 0.00 0.00 -0.00 0.00 0.00 55.36 55.11 1xvs s GLN 99 Cb 0.00 0.25 -0.04 0.00 0.00 0.00 0.00 33.01 33.22 1xvs s GLN 99 CO 0.00 -0.15 0.01 0.71 0.00 0.00 0.00 175.29 175.86 1xvs s TYR 100 N -1.28 3.13 0.14 9.60 2.02 0.07 -1.32 117.35 129.72 1xvs s TYR 100 Ca -0.13 0.13 0.05 0.00 -0.37 0.00 0.00 57.07 56.75 1xvs s TYR 100 Cb -0.06 -1.71 -0.04 0.00 -0.40 0.00 0.00 41.96 39.75 1xvs s TYR 100 CO 0.03 0.47 0.06 -1.17 -1.57 0.00 0.00 175.55 173.38 1xvs s LEU 101 N -1.38 3.60 -0.02 -1.29 0.20 -0.61 -0.11 118.68 119.08 1xvs s LEU 101 Ca 0.18 -0.20 -0.08 0.00 0.69 0.00 0.00 54.13 54.73 1xvs s LEU 101 Cb -0.12 -2.26 0.01 0.00 -0.43 0.00 0.00 46.19 43.40 1xvs s LEU 101 CO 0.08 0.11 0.17 0.27 -0.29 0.00 0.00 176.35 176.69 1xvs s ILE 103 N -1.61 0.06 0.00 6.68 -4.36 -0.08 -2.14 121.20 119.74 1xvs s ILE 103 Ca 0.29 -0.47 0.00 0.00 -0.26 0.00 0.00 60.65 60.21 1xvs s ILE 103 Cb -0.10 -0.41 0.00 0.00 1.25 0.00 0.00 42.46 43.20 1xvs s ILE 103 CO 0.21 -0.26 0.00 -0.90 0.24 0.00 0.00 174.94 174.23 1xvs n ASP 104 N 1.88 0.00 0.17 4.36 5.68 0.98 -1.68 116.55 127.94 1xvs n ASP 104 Ca -0.20 -0.50 0.13 0.00 -0.50 0.00 0.00 54.79 53.73 1xvs n ASP 104 Cb 0.56 0.00 0.45 0.00 -1.14 0.00 0.00 41.12 40.99 1xvs n ASP 104 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1xvs h GLU 105 N 0.00 0.00 -0.42 0.11 4.81 -1.89 -1.10 114.58 116.09 1xvs h GLU 105 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1xvs h GLU 105 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1xvs h GLU 105 CO 0.00 0.00 0.00 0.94 -0.73 0.00 0.00 179.01 179.22 1xvs n GLN 106 N -2.59 2.53 -0.97 1.92 -0.06 -1.26 -4.91 117.38 112.04 1xvs n GLN 106 Ca 0.03 -2.32 0.00 0.00 -2.00 0.00 0.00 57.00 52.71 1xvs n GLN 106 Cb 0.36 -1.52 0.00 0.00 -4.06 0.00 0.00 30.24 25.02 1xvs n GLN 106 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1xvs n GLY 107 N 1.53 0.46 3.71 1.69 0.00 -0.42 -5.02 105.19 107.14 1xvs n GLY 107 Ca 0.20 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 1xvs n GLY 107 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xvs s GLU 108 N -0.86 4.44 0.24 1.61 2.56 -1.26 -4.73 118.70 120.71 1xvs s GLU 108 Ca 0.00 1.69 -0.30 0.00 0.00 0.00 0.00 54.97 56.36 1xvs s GLU 108 Cb 0.00 -3.40 -0.09 0.00 2.00 0.00 0.00 34.13 32.64 1xvs s GLU 108 CO 0.00 -0.24 1.21 0.45 -0.56 0.00 0.00 175.26 176.12 1xvs s SER 109 N 1.11 7.04 -0.03 -1.70 0.15 -1.26 -0.01 113.70 119.00 1xvs s SER 109 Ca 0.57 2.36 -0.07 0.00 0.70 0.00 0.00 55.95 59.51 1xvs s SER 109 Cb -0.27 -2.62 0.01 0.00 -1.71 0.00 0.00 66.02 61.43 1xvs s SER 109 CO 0.28 -0.37 0.16 0.72 1.20 0.00 0.00 173.24 175.24 1xvs s PHE 110 N -0.56 -0.07 -0.14 3.44 -0.71 -1.26 -4.93 117.98 113.75 1xvs s PHE 110 Ca 0.50 0.13 -0.09 0.00 -1.04 0.00 0.00 56.93 56.44 1xvs s PHE 110 Cb -0.35 0.01 -0.04 0.00 -1.21 0.00 0.00 43.02 41.43 1xvs s PHE 110 CO 0.41 -0.22 0.15 0.99 -1.34 0.00 0.00 175.22 175.22 1xvs s THR 111 N -0.79 5.45 -0.14 -4.49 2.01 -1.26 -4.41 115.64 112.00 1xvs s THR 111 Ca -0.09 0.25 0.02 0.00 0.31 0.00 0.00 61.69 62.18 1xvs s THR 111 Cb -0.05 -3.45 0.00 0.00 0.01 0.00 0.00 72.50 69.02 1xvs s THR 111 CO 0.01 0.55 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.60 1xvs s VAL 112 N -0.49 2.30 -0.02 3.82 1.01 0.85 -4.97 120.40 122.90 1xvs s VAL 112 Ca 0.13 -0.90 -0.26 0.00 0.00 0.00 0.00 61.98 60.95 1xvs s VAL 112 Cb -0.12 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 1xvs s VAL 112 CO 0.02 0.54 0.81 -1.61 0.00 0.00 0.00 175.10 174.86 1xvs s GLU 113 N 0.76 4.50 -0.43 2.72 0.41 -1.26 -0.75 118.70 124.65 1xvs s GLU 113 Ca -0.07 1.11 -0.16 0.00 -0.41 0.00 0.00 54.97 55.43 1xvs s GLU 113 Cb -0.16 -3.44 0.03 0.00 -1.78 0.00 0.00 34.13 28.79 1xvs s GLU 113 CO -0.00 0.07 0.37 0.42 -0.49 0.00 0.00 175.26 175.63 1xvs s ILE 114 N 0.71 5.19 0.61 -1.63 1.01 0.95 -4.96 121.20 123.07 1xvs s ILE 114 Ca 0.43 -0.64 -0.19 0.00 0.00 0.00 0.00 60.65 60.25 1xvs s ILE 114 Cb -0.19 -4.02 -0.03 0.00 0.01 0.00 0.00 42.46 38.23 1xvs s ILE 114 CO 0.23 -0.42 1.25 -1.61 0.00 0.00 0.00 174.94 174.39 1xvs s GLU 115 N 1.85 2.82 0.23 2.79 0.41 -1.26 -1.64 118.70 123.90 1xvs s GLU 115 Ca 0.07 1.94 -0.31 0.00 -0.41 0.00 0.00 54.97 56.26 1xvs s GLU 115 Cb -0.19 -1.92 -0.14 0.00 -1.78 0.00 0.00 34.13 30.10 1xvs s GLU 115 CO 0.10 -1.35 1.28 -2.30 -0.49 0.00 0.00 175.26 172.50 1xvs n PRO 116 N -1.67 1.72 -4.09 0.39 -0.02 -1.26 -4.68 135.00 125.38 1xvs n PRO 116 Ca 0.14 0.61 -0.11 0.00 -2.02 0.00 0.00 63.50 62.13 1xvs n PRO 116 Cb 0.49 -2.18 -0.11 0.00 -0.02 0.00 0.00 33.50 31.68 1xvs n PRO 116 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1xvs s PHE 117 N -0.28 0.66 0.04 6.00 -0.71 -1.26 -4.98 117.98 117.44 1xvs s PHE 117 Ca 0.68 -0.73 -0.17 0.00 -1.04 0.00 0.00 56.93 55.66 1xvs s PHE 117 Cb -0.71 -0.40 -0.06 0.00 -1.21 0.00 0.00 43.02 40.64 1xvs s PHE 117 CO 0.52 -0.17 0.50 1.03 -1.34 0.00 0.00 175.22 175.76 1xvs s ARG 118 N -2.68 4.08 -0.18 1.99 0.52 -1.26 -4.31 118.95 117.11 1xvs s ARG 118 Ca -0.01 0.59 -0.09 0.00 -0.52 0.00 0.00 55.73 55.71 1xvs s ARG 118 Cb -0.02 -3.23 -0.05 0.00 0.52 0.00 0.00 34.95 32.17 1xvs s ARG 118 CO -0.03 0.66 0.10 -0.51 0.02 0.00 0.00 175.30 175.54 1xvs s LEU 119 N -1.07 4.07 -0.25 2.53 1.43 0.08 -4.94 118.68 120.53 1xvs s LEU 119 Ca 0.27 0.20 -0.21 0.00 -1.03 0.00 0.00 54.13 53.35 1xvs s LEU 119 Cb -0.18 -2.04 0.07 0.00 0.03 0.00 0.00 46.19 44.07 1xvs s LEU 119 CO 0.16 0.20 0.66 0.00 0.23 0.00 0.00 176.35 177.61 1xvs s ALA 120 N 0.21 -1.66 0.79 4.21 0.00 -1.26 -0.86 121.76 123.18 1xvs s ALA 120 Ca 0.07 1.97 -0.15 0.00 0.00 0.00 0.00 51.96 53.85 1xvs s ALA 120 Cb -0.12 -1.15 0.00 0.00 0.00 0.00 0.00 23.12 21.85 1xvs s ALA 120 CO -0.01 -0.33 0.64 1.55 0.00 0.00 0.00 175.76 177.62 1xvs n VAL 121 N 3.12 1.51 -1.77 0.00 3.14 -0.12 -4.42 118.33 119.79 1xvs n VAL 121 Ca -0.16 -0.32 -0.41 0.00 -2.96 0.00 0.00 64.34 60.49 1xvs n VAL 121 Cb 0.56 -0.82 -0.00 0.00 -1.06 0.00 0.00 33.84 32.52 1xvs n VAL 121 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 1xvs n PRO 122 N -1.44 2.69 -2.81 1.45 -0.02 -1.26 -4.94 135.00 128.66 1xvs n PRO 122 Ca 0.10 0.94 -0.10 0.00 -2.02 0.00 0.00 63.50 62.42 1xvs n PRO 122 Cb 0.51 -2.68 0.06 0.00 -0.02 0.00 0.00 33.50 31.37 1xvs n PRO 122 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 1xvs n HIS 123 N 0.59 -1.48 1.45 6.00 1.44 -1.26 -5.21 115.22 116.75 1xvs n HIS 123 Ca 0.02 -2.54 0.14 0.00 -2.01 0.00 0.00 57.72 53.33 1xvs n HIS 123 Cb 0.39 0.87 0.48 0.00 0.12 0.00 0.00 29.99 31.85 1xvs n HIS 123 CO 0.00 0.00 0.00 1.55 -2.81 0.00 0.00 176.34 175.08