#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 1.19 -4.35 2.53 0.24 -1.26 -5.02 118.33 111.66 1xvs n VAL 3 Ca 0.00 -1.86 -0.22 0.00 -2.04 0.00 0.00 64.34 60.21 1xvs n VAL 3 Cb 0.00 0.19 -0.11 0.00 -1.47 0.00 0.00 33.84 32.45 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 -2.44 2.81 0.67 -1.34 0.01 -1.26 -5.14 113.70 107.02 1xvs s SER 4 Ca 0.28 -0.87 -0.16 0.00 1.31 0.00 0.00 55.95 56.52 1xvs s SER 4 Cb 0.28 -0.17 0.01 0.00 0.21 0.00 0.00 66.02 66.35 1xvs s SER 4 CO -0.06 -0.02 1.15 -0.76 0.41 0.00 0.00 173.24 173.97 1xvs s LEU 5 N -2.72 3.40 0.16 2.44 1.43 -1.26 -4.88 118.68 117.25 1xvs s LEU 5 Ca 0.17 2.17 -0.34 0.00 -1.03 0.00 0.00 54.13 55.10 1xvs s LEU 5 Cb -0.06 -4.57 -0.15 0.00 0.03 0.00 0.00 46.19 41.44 1xvs s LEU 5 CO 0.07 -1.84 1.32 -2.65 0.23 0.00 0.00 176.35 173.49 1xvs n PRO 6 N -2.40 1.45 -2.41 1.29 -0.02 -1.26 -4.88 135.00 126.77 1xvs n PRO 6 Ca 0.12 0.52 -0.43 0.00 -2.02 0.00 0.00 63.50 61.69 1xvs n PRO 6 Cb 0.51 -2.13 -0.02 0.00 -0.02 0.00 0.00 33.50 31.84 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 3.53 2.06 -0.27 0.00 -1.09 -1.26 -0.96 121.20 123.21 1xvs s ILE 8 Ca 0.55 -1.08 -0.13 0.00 -2.23 0.00 0.00 60.65 57.76 1xvs s ILE 8 Cb -0.22 -1.94 -0.04 0.00 -1.58 0.00 0.00 42.46 38.68 1xvs s ILE 8 CO 0.15 0.41 0.29 -0.75 -1.23 0.00 0.00 174.94 173.81 1xvs s LYS 9 N 1.26 4.01 -0.16 2.79 2.20 -0.05 -4.95 119.74 124.84 1xvs s LYS 9 Ca 0.02 -0.10 -0.07 0.00 -0.36 0.00 0.00 55.97 55.46 1xvs s LYS 9 Cb -0.15 -3.64 -0.04 0.00 -1.51 0.00 0.00 37.83 32.49 1xvs s LYS 9 CO -0.11 -0.20 0.07 0.42 -0.36 0.00 0.00 175.35 175.17 1xvs s ILE 10 N 1.82 4.87 0.19 5.43 -1.09 -1.26 -0.79 121.20 130.37 1xvs s ILE 10 Ca 0.12 -0.01 0.07 0.00 -2.23 0.00 0.00 60.65 58.60 1xvs s ILE 10 Cb -0.16 -3.17 -0.05 0.00 -1.58 0.00 0.00 42.46 37.51 1xvs s ILE 10 CO 0.10 0.50 -0.14 -1.10 -1.23 0.00 0.00 174.94 173.07 1xvs s GLN 11 N 0.05 1.26 0.01 2.79 -0.21 -0.28 -5.01 119.66 118.28 1xvs s GLN 11 Ca 0.06 -1.54 -0.16 0.00 0.02 0.00 0.00 55.36 53.74 1xvs s GLN 11 Cb -0.12 -1.02 0.03 0.00 1.00 0.00 0.00 33.01 32.89 1xvs s GLN 11 CO 0.01 0.17 0.34 0.54 -2.12 0.00 0.00 175.29 174.22 1xvs s VAL 12 N -2.98 0.06 -0.02 1.09 0.11 -1.26 -1.68 120.40 115.73 1xvs s VAL 12 Ca 0.21 -0.53 0.02 0.00 -2.93 0.00 0.00 61.98 58.75 1xvs s VAL 12 Cb -0.00 -0.79 0.00 0.00 -1.53 0.00 0.00 36.38 34.06 1xvs s VAL 12 CO 0.05 -0.29 -0.06 -1.10 -3.33 0.00 0.00 175.10 170.37 1xvs s GLN 13 N -1.89 0.65 0.37 1.54 -0.21 -0.51 -4.98 119.66 114.63 1xvs s GLN 13 Ca -0.09 -0.19 0.08 0.00 0.02 0.00 0.00 55.36 55.17 1xvs s GLN 13 Cb -0.03 -0.65 -0.07 0.00 1.00 0.00 0.00 33.01 33.27 1xvs s GLN 13 CO 0.01 0.07 -0.01 0.95 -2.12 0.00 0.00 175.29 174.19 1xvs s THR 14 N 0.22 2.27 -0.14 -0.19 -4.23 -1.26 -0.56 115.64 111.75 1xvs s THR 14 Ca -0.03 -2.04 -0.12 0.00 -1.18 0.00 0.00 61.69 58.33 1xvs s THR 14 Cb -0.07 -2.82 0.04 0.00 1.34 0.00 0.00 72.50 70.99 1xvs s THR 14 CO -0.00 -0.12 0.37 -0.60 -0.54 0.00 0.00 174.62 173.73 1xvs s ARG 15 N -3.69 0.41 0.19 3.99 3.52 -0.70 -4.98 118.95 117.69 1xvs s ARG 15 Ca 0.35 0.56 -0.25 0.00 -0.13 0.00 0.00 55.73 56.26 1xvs s ARG 15 Cb 0.04 0.15 -0.08 0.00 -1.56 0.00 0.00 34.95 33.50 1xvs s ARG 15 CO 0.18 -0.08 0.80 -0.47 -0.81 0.00 0.00 175.30 174.92 1xvs s TYR 16 N 0.47 3.87 -0.75 5.12 5.04 -1.26 -0.96 117.35 128.87 1xvs s TYR 16 Ca -0.02 1.64 -0.08 0.00 -2.44 0.00 0.00 57.07 56.17 1xvs s TYR 16 Cb -0.04 -2.78 0.20 0.00 0.35 0.00 0.00 41.96 39.69 1xvs s TYR 16 CO -0.02 0.47 0.63 0.42 -1.34 0.00 0.00 175.55 175.71 1xvs s ILE 17 N -1.23 4.66 0.30 3.14 -1.09 0.34 -4.91 121.20 122.41 1xvs s ILE 17 Ca 0.38 -2.86 -0.01 0.00 -2.23 0.00 0.00 60.65 55.93 1xvs s ILE 17 Cb -0.22 -3.93 0.27 0.00 -1.58 0.00 0.00 42.46 37.00 1xvs s ILE 17 CO 0.26 -0.97 1.94 -0.08 -1.23 0.00 0.00 174.94 174.85 1xvs h GLU 18 N 7.23 1.07 0.00 2.79 4.81 -1.95 -2.39 114.58 126.14 1xvs h GLU 18 Ca 0.06 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1xvs h GLU 18 Cb 0.97 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.11 1xvs h GLU 18 CO 0.75 0.71 0.00 1.05 -0.73 0.00 0.00 179.01 180.78 1xvs h GLU 19 N 1.10 0.00 -0.02 1.92 9.09 -1.94 -1.76 114.58 122.96 1xvs h GLU 19 Ca 0.35 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.76 1xvs h GLU 19 Cb 0.03 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.13 1xvs h GLU 19 CO -0.11 0.00 -0.23 1.04 0.05 0.00 0.00 179.01 179.77 1xvs n GLN 20 N -2.52 1.73 -3.96 1.06 1.13 -0.91 -4.98 117.38 108.92 1xvs n GLN 20 Ca 0.02 -1.41 -0.22 0.00 -1.94 0.00 0.00 57.00 53.45 1xvs n GLN 20 Cb 0.25 -1.44 -0.05 0.00 0.11 0.00 0.00 30.24 29.12 1xvs n GLN 20 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 1xvs s SER 21 N -2.13 5.05 -0.46 1.08 0.01 -0.66 -4.75 113.70 111.84 1xvs s SER 21 Ca 0.22 -0.58 0.06 0.00 1.31 0.00 0.00 55.95 56.95 1xvs s SER 21 Cb 0.18 -0.91 0.18 0.00 0.21 0.00 0.00 66.02 65.68 1xvs s SER 21 CO 0.41 -0.30 0.56 0.21 0.41 0.00 0.00 173.24 174.54 1xvs s ASN 22 N -3.92 -0.25 0.30 2.44 3.84 0.21 -5.01 114.94 112.55 1xvs s ASN 22 Ca 0.39 -2.08 0.05 0.00 0.21 0.00 0.00 52.86 51.43 1xvs s ASN 22 Cb -0.05 1.01 0.78 0.00 -0.55 0.00 0.00 41.25 42.44 1xvs s ASN 22 CO 0.25 -0.12 1.70 -0.65 -2.79 0.00 0.00 177.10 175.48 1xvs h PRO 23 N 5.57 0.40 -0.94 0.43 0.11 -1.94 0.71 132.00 136.34 1xvs h PRO 23 Ca 0.12 -0.02 0.12 0.00 0.11 0.00 0.00 66.00 66.33 1xvs h PRO 23 Cb 1.05 -0.09 -0.08 0.00 0.11 0.00 0.00 31.00 31.98 1xvs h PRO 23 CO 0.15 0.26 0.56 0.93 -0.21 0.00 0.00 178.00 179.70 1xvs h GLU 24 N 0.41 0.86 -0.62 1.05 5.08 -1.95 0.49 114.58 119.90 1xvs h GLU 24 Ca 0.58 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.89 1xvs h GLU 24 Cb 1.13 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.19 1xvs h GLU 24 CO -0.53 0.57 0.00 0.66 -1.00 0.00 0.00 179.01 178.70 1xvs n TYR 25 N -4.69 1.01 -3.78 4.33 4.02 0.07 -4.93 117.16 113.19 1xvs n TYR 25 Ca 0.18 -0.39 -0.24 0.00 -0.01 0.00 0.00 57.90 57.44 1xvs n TYR 25 Cb 0.36 -0.21 0.02 0.00 -0.02 0.00 0.00 39.34 39.49 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 0.59 -4.81 -3.92 -0.72 1.13 0.17 -5.00 117.38 104.83 1xvs n GLN 26 Ca 0.16 0.59 -0.29 0.00 -1.94 0.00 0.00 57.00 55.52 1xvs n GLN 26 Cb 0.65 -5.15 -0.16 0.00 0.11 0.00 0.00 30.24 25.68 1xvs n GLN 26 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1xvs s ARG 27 N -6.18 1.58 -0.15 -1.09 3.52 -0.22 -4.24 118.95 112.16 1xvs s ARG 27 Ca 0.14 -0.59 0.02 0.00 -0.13 0.00 0.00 55.73 55.16 1xvs s ARG 27 Cb -0.07 -2.11 0.02 0.00 -1.56 0.00 0.00 34.95 31.23 1xvs s ARG 27 CO 0.83 -0.43 -0.19 -0.06 -0.81 0.00 0.00 175.30 174.63 1xvs s PHE 28 N 1.58 2.54 -0.01 5.12 0.08 0.23 0.66 117.98 128.18 1xvs s PHE 28 Ca 0.00 -1.38 0.07 0.00 0.12 0.00 0.00 56.93 55.74 1xvs s PHE 28 Cb -0.15 -1.77 -0.02 0.00 -0.57 0.00 0.00 43.02 40.50 1xvs s PHE 28 CO -0.08 -0.67 -0.22 0.08 -0.10 0.00 0.00 175.22 174.23 1xvs s VAL 29 N 1.10 2.43 0.02 -0.44 1.01 -1.26 0.65 120.40 123.91 1xvs s VAL 29 Ca -0.01 -1.05 0.02 0.00 0.00 0.00 0.00 61.98 60.94 1xvs s VAL 29 Cb -0.14 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.31 1xvs s VAL 29 CO -0.07 0.53 -0.07 -0.36 0.00 0.00 0.00 175.10 175.13 1xvs s PHE 30 N -0.70 0.64 0.23 5.22 0.08 0.11 0.13 117.98 123.68 1xvs s PHE 30 Ca 0.11 -0.33 0.07 0.00 0.12 0.00 0.00 56.93 56.91 1xvs s PHE 30 Cb -0.10 -0.39 -0.04 0.00 -0.57 0.00 0.00 43.02 41.91 1xvs s PHE 30 CO 0.01 -0.04 0.09 0.00 -0.10 0.00 0.00 175.22 175.17 1xvs s ALA 31 N -0.86 3.38 -0.02 5.36 0.00 -0.13 -0.83 121.76 128.66 1xvs s ALA 31 Ca -0.04 -1.44 -0.01 0.00 0.00 0.00 0.00 51.96 50.46 1xvs s ALA 31 Cb -0.07 -1.10 0.02 0.00 0.00 0.00 0.00 23.12 21.97 1xvs s ALA 31 CO 0.00 0.34 0.04 1.52 0.00 0.00 0.00 175.76 177.67 1xvs s TYR 32 N -2.04 -0.03 -0.28 0.00 -0.85 0.14 -1.72 117.35 112.58 1xvs s TYR 32 Ca 0.31 0.15 -0.03 0.00 -0.52 0.00 0.00 57.07 56.97 1xvs s TYR 32 Cb -0.08 -0.09 0.03 0.00 0.38 0.00 0.00 41.96 42.20 1xvs s TYR 32 CO 0.22 -0.06 -0.00 -1.17 -1.52 0.00 0.00 175.55 173.01 1xvs s LEU 33 N 0.54 3.57 -0.13 -3.49 2.96 0.28 -1.39 118.68 121.01 1xvs s LEU 33 Ca -0.04 -0.94 -0.03 0.00 -0.22 0.00 0.00 54.13 52.90 1xvs s LEU 33 Cb -0.06 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.86 1xvs s LEU 33 CO -0.02 -0.19 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.15 1xvs s ILE 34 N 1.35 3.86 -0.14 6.68 1.01 -0.30 -1.43 121.20 132.24 1xvs s ILE 34 Ca -0.01 -0.38 -0.01 0.00 0.00 0.00 0.00 60.65 60.25 1xvs s ILE 34 Cb -0.18 -2.66 -0.02 0.00 0.01 0.00 0.00 42.46 39.61 1xvs s ILE 34 CO -0.02 0.52 -0.10 -0.89 0.00 0.00 0.00 174.94 174.45 1xvs s THR 35 N 0.08 3.29 -0.26 2.92 2.01 -0.67 -1.04 115.64 121.96 1xvs s THR 35 Ca -0.01 -0.58 -0.01 0.00 0.31 0.00 0.00 61.69 61.41 1xvs s THR 35 Cb -0.14 -2.40 0.04 0.00 0.01 0.00 0.00 72.50 70.01 1xvs s THR 35 CO 0.03 0.52 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.79 1xvs s ILE 36 N 0.35 2.78 -0.20 1.82 1.01 0.65 -1.13 121.20 126.48 1xvs s ILE 36 Ca -0.09 -1.22 -0.07 0.00 0.00 0.00 0.00 60.65 59.26 1xvs s ILE 36 Cb -0.15 -2.49 -0.04 0.00 0.01 0.00 0.00 42.46 39.78 1xvs s ILE 36 CO 0.05 0.08 0.06 -0.54 0.00 0.00 0.00 174.94 174.59 1xvs s LYS 37 N 1.27 3.86 -0.59 2.79 1.02 0.03 -0.34 119.74 127.78 1xvs s LYS 37 Ca -0.03 -0.40 -0.26 0.00 0.02 0.00 0.00 55.97 55.30 1xvs s LYS 37 Cb -0.18 -3.23 0.04 0.00 -0.52 0.00 0.00 37.83 33.94 1xvs s LYS 37 CO -0.04 0.14 1.10 1.21 -0.92 0.00 0.00 175.35 176.84 1xvs s ASN 38 N 0.73 6.37 -0.13 2.83 3.84 -0.70 -0.87 114.94 127.02 1xvs s ASN 38 Ca 0.03 -0.16 0.14 0.00 0.21 0.00 0.00 52.86 53.09 1xvs s ASN 38 Cb -0.13 -2.50 0.64 0.00 -0.55 0.00 0.00 41.25 38.70 1xvs s ASN 38 CO 0.02 -1.41 1.51 0.18 -2.79 0.00 0.00 177.10 174.61 1xvs n LEU 39 N 8.12 4.36 0.00 3.21 4.77 -0.14 0.69 117.00 138.02 1xvs n LEU 39 Ca 0.05 -2.20 -0.07 0.00 -0.03 0.00 0.00 56.01 53.76 1xvs n LEU 39 Cb 0.48 -0.57 0.02 0.00 -2.33 0.00 0.00 43.42 41.03 1xvs n LEU 39 CO 0.68 0.66 0.12 -1.54 -1.33 0.00 0.00 177.39 175.99 1xvs n SER 40 N 0.82 0.72 -1.37 -1.43 3.41 -1.09 -4.67 113.62 110.01 1xvs n SER 40 Ca 0.22 -1.52 0.09 0.00 -0.26 0.00 0.00 58.87 57.40 1xvs n SER 40 Cb 0.85 -0.14 0.32 0.00 -0.26 0.00 0.00 64.21 64.98 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 -2.76 4.48 -4.26 4.04 3.41 -1.26 -4.33 113.62 112.93 1xvs n SER 41 Ca 0.05 -2.53 -0.18 0.00 -0.26 0.00 0.00 58.87 55.95 1xvs n SER 41 Cb 0.20 -0.54 -0.11 0.00 -0.26 0.00 0.00 64.21 63.51 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 -1.99 1.08 0.04 4.33 -2.07 -1.26 -4.91 119.66 114.88 1xvs s GLN 42 Ca 0.46 -1.31 -0.30 0.00 -1.82 0.00 0.00 55.36 52.38 1xvs s GLN 42 Cb 0.31 -0.93 -0.05 0.00 -1.09 0.00 0.00 33.01 31.24 1xvs s GLN 42 CO 0.20 0.17 1.25 -0.08 -1.32 0.00 0.00 175.29 175.51 1xvs s THR 43 N -2.35 3.94 0.39 3.63 -1.32 -1.26 -4.23 115.64 114.44 1xvs s THR 43 Ca 0.12 1.36 0.08 0.00 -1.21 0.00 0.00 61.69 62.04 1xvs s THR 43 Cb -0.04 -3.87 -0.07 0.00 -1.51 0.00 0.00 72.50 67.01 1xvs s THR 43 CO 0.03 0.07 0.03 0.68 -2.21 0.00 0.00 174.62 173.22 1xvs s VAL 44 N 1.48 2.17 -0.03 5.08 -7.23 -0.37 -2.90 120.40 118.60 1xvs s VAL 44 Ca 0.60 -1.97 -0.02 0.00 -1.81 0.00 0.00 61.98 58.78 1xvs s VAL 44 Cb -0.30 -2.92 0.01 0.00 0.56 0.00 0.00 36.38 33.74 1xvs s VAL 44 CO 0.28 -0.06 0.07 -1.58 -0.31 0.00 0.00 175.10 173.50 1xvs s GLN 45 N -3.73 0.06 0.41 4.82 0.74 -0.16 -0.14 119.66 121.66 1xvs s GLN 45 Ca 0.36 0.15 -0.02 0.00 0.05 0.00 0.00 55.36 55.90 1xvs s GLN 45 Cb 0.06 -0.03 -0.03 0.00 1.10 0.00 0.00 33.01 34.11 1xvs s GLN 45 CO 0.19 -0.05 0.65 -1.17 -0.55 0.00 0.00 175.29 174.35 1xvs s LEU 46 N 0.35 3.84 0.98 3.68 0.20 0.14 -1.19 118.68 126.68 1xvs s LEU 46 Ca -0.03 0.64 -0.14 0.00 0.69 0.00 0.00 54.13 55.29 1xvs s LEU 46 Cb -0.04 -3.54 0.18 0.00 -0.43 0.00 0.00 46.19 42.37 1xvs s LEU 46 CO -0.01 -0.43 1.16 -0.94 -0.29 0.00 0.00 176.35 175.84 1xvs s SER 48 N -4.07 2.86 0.09 3.68 1.04 -1.14 -3.63 113.70 112.53 1xvs s SER 48 Ca 0.43 0.79 0.02 0.00 0.48 0.00 0.00 55.95 57.67 1xvs s SER 48 Cb -0.10 -1.21 -0.04 0.00 0.10 0.00 0.00 66.02 64.77 1xvs s SER 48 CO 0.40 -2.94 -0.07 0.00 0.98 0.00 0.00 173.24 171.60 1xvs s ARG 49 N -5.39 0.80 -0.13 4.02 1.04 -0.34 -1.58 118.95 117.36 1xvs s ARG 49 Ca 0.67 -1.24 -0.05 0.00 -1.04 0.00 0.00 55.73 54.07 1xvs s ARG 49 Cb -0.12 -0.27 0.06 0.00 -2.04 0.00 0.00 34.95 32.58 1xvs s ARG 49 CO 0.54 0.01 0.27 0.50 -0.04 0.00 0.00 175.30 176.58 1xvs s ARG 50 N -3.40 0.16 0.01 3.89 3.52 0.33 -2.66 118.95 120.80 1xvs s ARG 50 Ca 0.08 0.75 0.04 0.00 -0.13 0.00 0.00 55.73 56.48 1xvs s ARG 50 Cb 0.02 -0.02 -0.03 0.00 -1.56 0.00 0.00 34.95 33.35 1xvs s ARG 50 CO -0.03 -0.28 -0.11 -1.58 -0.81 0.00 0.00 175.30 172.50 1xvs s TRP 51 N 2.35 2.77 -0.23 5.12 0.52 0.15 -1.05 118.94 128.57 1xvs s TRP 51 Ca 0.00 -0.11 -0.02 0.00 0.02 0.00 0.00 56.10 55.99 1xvs s TRP 51 Cb -0.12 -1.56 0.01 0.00 -1.15 0.00 0.00 33.47 30.65 1xvs s TRP 51 CO -0.09 0.32 -0.07 -1.17 0.02 0.00 0.00 176.95 175.97 1xvs s LEU 52 N -1.38 2.96 -0.19 2.99 2.96 0.17 -1.50 118.68 124.68 1xvs s LEU 52 Ca 0.16 -0.67 -0.04 0.00 -0.22 0.00 0.00 54.13 53.36 1xvs s LEU 52 Cb -0.11 -1.67 -0.02 0.00 0.50 0.00 0.00 46.19 44.89 1xvs s LEU 52 CO 0.06 -0.07 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.35 1xvs s ILE 53 N 1.38 3.60 -0.23 6.68 1.09 -0.08 -2.47 121.20 131.18 1xvs s ILE 53 Ca 0.03 -0.43 -0.00 0.00 -1.10 0.00 0.00 60.65 59.14 1xvs s ILE 53 Cb -0.15 -2.61 0.03 0.00 -1.06 0.00 0.00 42.46 38.66 1xvs s ILE 53 CO -0.05 0.45 -0.11 -0.89 -0.10 0.00 0.00 174.94 174.24 1xvs s THR 54 N 1.00 2.56 0.88 2.92 2.01 0.46 -0.74 115.64 124.73 1xvs s THR 54 Ca 0.01 -1.07 -0.12 0.00 0.31 0.00 0.00 61.69 60.81 1xvs s THR 54 Cb -0.15 -2.27 0.12 0.00 0.01 0.00 0.00 72.50 70.22 1xvs s THR 54 CO 0.01 0.27 1.15 1.51 -0.69 0.00 0.00 174.62 176.87 1xvs s ASP 55 N 1.29 3.84 0.39 3.53 1.47 -0.87 0.92 116.67 127.23 1xvs s ASP 55 Ca 0.00 0.91 0.27 0.00 1.18 0.00 0.00 52.55 54.92 1xvs s ASP 55 Cb -0.16 -1.46 1.35 0.00 -0.34 0.00 0.00 42.92 42.31 1xvs s ASP 55 CO -0.07 -2.34 1.83 0.00 0.68 0.00 0.00 175.17 175.27 1xvs h ALA 56 N -1.35 1.00 -0.67 2.11 0.00 -1.71 0.16 119.26 118.79 1xvs h ALA 56 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1xvs h ALA 56 Cb 1.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1xvs h ALA 56 CO 0.63 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.63 1xvs n ASP 57 N -2.48 3.82 0.00 0.00 8.00 -1.26 -4.96 116.55 119.68 1xvs n ASP 57 Ca -0.00 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.50 1xvs n ASP 57 Cb 0.12 -0.45 0.00 0.00 -0.02 0.00 0.00 41.12 40.78 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 1.53 0.72 3.69 0.44 0.00 0.56 -5.02 105.19 107.11 1xvs n GLY 58 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.62 4.31 0.01 1.61 2.20 -1.26 -4.78 119.74 121.20 1xvs s LYS 59 Ca 0.00 1.87 0.02 0.00 -0.36 0.00 0.00 55.97 57.50 1xvs s LYS 59 Cb 0.00 -3.57 -0.04 0.00 -1.51 0.00 0.00 37.83 32.72 1xvs s LYS 59 CO 0.00 -0.53 -0.02 -0.65 -0.36 0.00 0.00 175.35 173.79 1xvs s GLN 60 N 2.34 2.69 0.03 4.03 -0.21 -1.26 -2.04 119.66 125.24 1xvs s GLN 60 Ca 0.61 -0.67 0.01 0.00 0.02 0.00 0.00 55.36 55.33 1xvs s GLN 60 Cb -0.29 -2.61 -0.02 0.00 1.00 0.00 0.00 33.01 31.09 1xvs s GLN 60 CO 0.25 0.61 -0.05 -0.08 -2.12 0.00 0.00 175.29 173.90 1xvs s THR 61 N -1.08 0.29 -0.11 -0.19 -1.32 0.09 -4.98 115.64 108.33 1xvs s THR 61 Ca 0.19 -1.03 0.02 0.00 -1.21 0.00 0.00 61.69 59.66 1xvs s THR 61 Cb -0.11 -0.47 -0.01 0.00 -1.51 0.00 0.00 72.50 70.40 1xvs s THR 61 CO 0.10 -0.48 -0.19 -0.69 -2.21 0.00 0.00 174.62 171.15 1xvs s VAL 62 N -1.58 2.51 -0.08 5.08 1.01 -1.26 -0.90 120.40 125.18 1xvs s VAL 62 Ca -0.12 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.02 1xvs s VAL 62 Cb -0.09 -2.01 0.02 0.00 0.00 0.00 0.00 36.38 34.30 1xvs s VAL 62 CO -0.01 0.54 -0.12 -0.69 0.00 0.00 0.00 175.10 174.83 1xvs s VAL 63 N 0.33 1.19 0.21 2.92 1.01 -0.56 -4.96 120.40 120.54 1xvs s VAL 63 Ca -0.15 -0.48 -0.12 0.00 0.00 0.00 0.00 61.98 61.24 1xvs s VAL 63 Cb -0.17 -1.11 -0.00 0.00 0.00 0.00 0.00 36.38 35.09 1xvs s VAL 63 CO 0.07 0.38 0.40 -1.83 0.00 0.00 0.00 175.10 174.12 1xvs s GLU 64 N 0.94 1.37 0.00 2.72 -1.05 -1.26 -0.68 118.70 120.75 1xvs s GLU 64 Ca -0.09 -1.19 0.00 0.00 -0.15 0.00 0.00 54.97 53.54 1xvs s GLU 64 Cb -0.15 0.44 0.00 0.00 -0.44 0.00 0.00 34.13 33.98 1xvs s GLU 64 CO 0.00 -0.55 0.00 0.41 0.95 0.00 0.00 175.26 176.07 1xvs n GLY 65 N -0.31 -0.10 3.93 -3.83 0.00 -1.09 -5.01 105.19 98.78 1xvs n GLY 65 Ca -0.05 -1.24 -0.27 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 0.00 6.38 0.49 1.61 1.01 -1.26 -1.20 116.67 123.69 1xvs s ASP 66 Ca 0.00 0.36 0.00 0.00 0.71 0.00 0.00 52.55 53.62 1xvs s ASP 66 Cb 0.00 -1.99 0.00 0.00 1.01 0.00 0.00 42.92 41.94 1xvs s ASP 66 CO 0.00 -0.03 0.00 0.61 0.21 0.00 0.00 175.17 175.96 1xvs n GLY 67 N -0.64 -1.65 3.07 0.21 0.00 -1.25 -4.69 105.19 100.23 1xvs n GLY 67 Ca -0.05 -1.15 -0.24 0.00 0.00 0.00 0.00 46.02 44.58 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 -1.38 1.15 -1.03 1.61 -7.23 0.06 -4.19 120.40 109.38 1xvs s VAL 68 Ca 0.00 -0.55 -0.04 0.00 -1.81 0.00 0.00 61.98 59.58 1xvs s VAL 68 Cb 0.00 -1.00 0.03 0.00 0.56 0.00 0.00 36.38 35.97 1xvs s VAL 68 CO 0.00 0.34 0.20 1.33 -0.31 0.00 0.00 175.10 176.66 1xvs n VAL 69 N 3.29 -0.69 -0.07 1.32 0.24 -1.26 -1.31 118.33 119.85 1xvs n VAL 69 Ca -0.19 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.11 1xvs n VAL 69 Cb 0.53 -1.60 0.00 0.00 -1.47 0.00 0.00 33.84 31.30 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 -0.92 0.48 3.30 7.63 0.00 -1.26 -5.05 105.19 109.36 1xvs n GLY 70 Ca -0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 1xvs n GLY 70 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xvs s GLU 71 N -0.90 1.17 -0.76 1.61 2.02 -0.43 -4.93 118.70 116.48 1xvs s GLU 71 Ca 0.00 -1.27 -0.01 0.00 0.02 0.00 0.00 54.97 53.71 1xvs s GLU 71 Cb 0.00 -1.30 0.19 0.00 0.10 0.00 0.00 34.13 33.12 1xvs s GLU 71 CO 0.00 0.28 0.60 -0.65 0.02 0.00 0.00 175.26 175.51 1xvs s GLN 72 N -2.35 2.87 0.28 1.61 -0.21 -1.26 -0.76 119.66 119.84 1xvs s GLN 72 Ca 0.10 -3.01 -0.29 0.00 0.02 0.00 0.00 55.36 52.18 1xvs s GLN 72 Cb -0.08 -3.78 -0.10 0.00 1.00 0.00 0.00 33.01 30.05 1xvs s GLN 72 CO 0.05 -1.23 1.39 -1.25 -2.12 0.00 0.00 175.29 172.13 1xvs s PRO 73 N -0.88 4.30 -0.26 2.91 0.04 -1.24 -4.59 135.00 135.27 1xvs s PRO 73 Ca 0.23 2.27 -0.15 0.00 0.04 0.00 0.00 61.00 63.39 1xvs s PRO 73 Cb -0.12 -3.09 -0.04 0.00 0.04 0.00 0.00 34.50 31.29 1xvs s PRO 73 CO -0.09 -0.33 0.39 0.50 0.04 0.00 0.00 177.00 177.50 1xvs s ARG 74 N -0.98 4.04 -0.17 4.56 3.52 -1.26 -0.68 118.95 127.97 1xvs s ARG 74 Ca 0.55 0.09 0.01 0.00 -0.13 0.00 0.00 55.73 56.24 1xvs s ARG 74 Cb -0.41 -3.64 0.03 0.00 -1.56 0.00 0.00 34.95 29.37 1xvs s ARG 74 CO 0.48 -0.26 -0.14 0.42 -0.81 0.00 0.00 175.30 174.99 1xvs s ILE 75 N 2.02 1.68 0.78 4.11 -1.09 0.81 -4.97 121.20 124.54 1xvs s ILE 75 Ca 0.16 -0.83 -0.12 0.00 -2.23 0.00 0.00 60.65 57.63 1xvs s ILE 75 Cb -0.16 -1.64 0.06 0.00 -1.58 0.00 0.00 42.46 39.15 1xvs s ILE 75 CO 0.10 0.35 1.10 -0.54 -1.23 0.00 0.00 174.94 174.72 1xvs s LYS 76 N 1.42 2.21 0.29 2.79 1.02 -1.26 -1.24 119.74 124.96 1xvs s LYS 76 Ca 0.02 0.57 -0.30 0.00 0.02 0.00 0.00 55.97 56.28 1xvs s LYS 76 Cb -0.14 -1.94 -0.11 0.00 -0.52 0.00 0.00 37.83 35.12 1xvs s LYS 76 CO -0.10 -1.52 1.60 0.00 -0.92 0.00 0.00 175.35 174.41 1xvs s ALA 77 N -3.22 3.75 -1.14 5.17 0.00 -1.26 -0.89 121.76 124.17 1xvs s ALA 77 Ca 0.60 1.57 0.00 0.00 0.00 0.00 0.00 51.96 54.13 1xvs s ALA 77 Cb -0.14 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.34 1xvs s ALA 77 CO 0.53 -0.98 0.00 0.09 0.00 0.00 0.00 175.76 175.40 1xvs n ASN 78 N 2.22 -4.91 -5.00 0.00 3.02 0.22 -4.99 115.26 105.82 1xvs n ASN 78 Ca 0.08 0.27 -0.19 0.00 -0.03 0.00 0.00 54.58 54.71 1xvs n ASN 78 Cb 0.37 -3.78 0.02 0.00 -0.61 0.00 0.00 39.78 35.78 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 -2.20 5.34 0.04 6.41 1.11 -0.07 -4.93 116.67 122.36 1xvs s ASP 79 Ca 0.00 -0.65 -0.04 0.00 0.18 0.00 0.00 52.55 52.04 1xvs s ASP 79 Cb 0.00 -0.26 -0.02 0.00 1.07 0.00 0.00 42.92 43.71 1xvs s ASP 79 CO 0.00 -0.96 0.06 -1.83 1.18 0.00 0.00 175.17 173.61 1xvs s GLU 80 N -4.43 0.58 -0.05 8.23 -1.05 -1.26 -1.72 118.70 119.00 1xvs s GLU 80 Ca 0.55 -0.87 0.05 0.00 -0.15 0.00 0.00 54.97 54.55 1xvs s GLU 80 Cb -0.07 0.22 -0.00 0.00 -0.44 0.00 0.00 34.13 33.83 1xvs s GLU 80 CO 0.34 -0.14 -0.20 -0.47 0.95 0.00 0.00 175.26 175.74 1xvs s TYR 81 N -2.91 1.98 -0.05 4.83 5.04 0.53 -4.97 117.35 121.82 1xvs s TYR 81 Ca -0.02 -0.61 0.06 0.00 -2.44 0.00 0.00 57.07 54.05 1xvs s TYR 81 Cb 0.01 -1.33 -0.02 0.00 0.35 0.00 0.00 41.96 40.97 1xvs s TYR 81 CO -0.06 -0.21 -0.23 0.99 -1.34 0.00 0.00 175.55 174.70 1xvs s THR 82 N 0.04 2.28 0.16 4.34 2.01 -1.26 -0.25 115.64 122.96 1xvs s THR 82 Ca -0.06 -1.00 -0.05 0.00 0.31 0.00 0.00 61.69 60.90 1xvs s THR 82 Cb -0.13 -1.83 -0.03 0.00 0.01 0.00 0.00 72.50 70.52 1xvs s THR 82 CO 0.03 0.57 0.17 -0.72 -0.69 0.00 0.00 174.62 173.99 1xvs s TYR 83 N -0.37 0.70 0.17 4.92 1.13 -0.20 -4.98 117.35 118.72 1xvs s TYR 83 Ca 0.03 -1.05 0.07 0.00 -1.41 0.00 0.00 57.07 54.70 1xvs s TYR 83 Cb -0.12 -0.30 -0.04 0.00 -1.10 0.00 0.00 41.96 40.39 1xvs s TYR 83 CO 0.02 -0.63 -0.13 -1.54 -2.51 0.00 0.00 175.55 170.75 1xvs s SER 84 N -3.03 2.28 0.00 -0.18 1.04 -1.26 -1.15 113.70 111.40 1xvs s SER 84 Ca 0.23 -0.98 0.00 0.00 0.48 0.00 0.00 55.95 55.68 1xvs s SER 84 Cb 0.05 -0.09 0.00 0.00 0.10 0.00 0.00 66.02 66.08 1xvs s SER 84 CO 0.03 -0.20 0.00 -0.24 0.98 0.00 0.00 173.24 173.80 1xvs n SER 85 N -0.16 0.00 -3.50 7.02 2.88 -0.49 -4.95 113.62 114.42 1xvs n SER 85 Ca -0.10 -0.10 -0.13 0.00 -1.33 0.00 0.00 58.87 57.21 1xvs n SER 85 Cb 0.60 0.00 -0.04 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 -0.10 -0.52 -0.03 0.46 0.00 -1.26 0.25 107.32 106.11 1xvs s GLY 86 Ca 0.00 0.55 -0.15 0.00 0.00 0.00 0.00 44.72 45.12 1xvs s GLY 86 CO 0.00 0.23 0.32 -1.08 0.00 0.00 0.00 173.10 172.57 1xvs s THR 87 N -3.13 0.05 -0.03 0.90 -1.32 -0.01 -4.95 115.64 107.14 1xvs s THR 87 Ca -0.02 -0.39 0.03 0.00 -1.21 0.00 0.00 61.69 60.11 1xvs s THR 87 Cb -0.00 -0.60 -0.03 0.00 -1.51 0.00 0.00 72.50 70.36 1xvs s THR 87 CO -0.07 -0.21 -0.12 0.00 -2.21 0.00 0.00 174.62 172.01 1xvs s ALA 88 N -1.08 2.79 0.22 11.08 0.00 -1.26 -0.71 121.76 132.80 1xvs s ALA 88 Ca -0.11 -1.00 0.05 0.00 0.00 0.00 0.00 51.96 50.90 1xvs s ALA 88 Cb -0.05 -1.02 -0.05 0.00 0.00 0.00 0.00 23.12 22.00 1xvs s ALA 88 CO 0.04 0.57 -0.05 -0.51 0.00 0.00 0.00 175.76 175.81 1xvs s LEU 89 N -0.98 2.38 0.00 0.00 1.43 0.21 -4.96 118.68 116.76 1xvs s LEU 89 Ca 0.13 -1.14 0.19 0.00 -1.03 0.00 0.00 54.13 52.28 1xvs s LEU 89 Cb -0.11 -0.42 1.01 0.00 0.03 0.00 0.00 46.19 46.70 1xvs s LEU 89 CO 0.03 -0.39 1.57 0.47 0.23 0.00 0.00 176.35 178.26 1xvs n ASP 90 N -0.41 0.00 -4.05 2.29 8.00 -1.26 -0.60 116.55 120.52 1xvs n ASP 90 Ca -0.07 -0.16 -0.08 0.00 0.71 0.00 0.00 54.79 55.20 1xvs n ASP 90 Cb 0.63 -0.21 -0.10 0.00 -0.02 0.00 0.00 41.12 41.42 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 -2.41 0.19 -1.38 -3.53 -4.23 -1.26 -4.63 115.64 98.39 1xvs s THR 91 Ca 0.21 -1.47 0.19 0.00 -1.18 0.00 0.00 61.69 59.44 1xvs s THR 91 Cb 0.13 -1.05 0.31 0.00 1.34 0.00 0.00 72.50 73.23 1xvs s THR 91 CO 0.27 -0.81 1.59 -0.81 -0.54 0.00 0.00 174.62 174.32 1xvs n PRO 92 N 0.67 0.24 -3.84 3.99 -0.04 -1.26 -4.59 135.00 130.17 1xvs n PRO 92 Ca -0.18 0.11 -0.12 0.00 -0.04 0.00 0.00 63.50 63.28 1xvs n PRO 92 Cb 0.59 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.44 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 -2.62 0.05 0.00 0.52 1.01 -1.26 -0.08 120.40 118.02 1xvs s VAL 93 Ca 0.17 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.72 1xvs s VAL 93 Cb 0.13 -0.39 0.00 0.00 0.00 0.00 0.00 36.38 36.11 1xvs s VAL 93 CO 0.30 -0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.77 1xvs n GLY 94 N 1.96 2.11 0.94 4.51 0.00 0.21 -1.87 105.19 113.05 1xvs n GLY 94 Ca -0.19 -0.62 -0.05 0.00 0.00 0.00 0.00 46.02 45.16 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 0.26 -0.08 118.33 120.43 1xvs n VAL 95 Ca 0.00 -0.67 0.00 0.00 -0.01 0.00 0.00 64.34 63.66 1xvs n VAL 95 Cb 0.00 0.35 0.00 0.00 -0.91 0.00 0.00 33.84 33.28 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 -0.18 0.00 -2.55 5.55 10.64 -1.03 -0.40 117.38 129.41 1xvs n GLN 97 Ca 0.02 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.19 1xvs n GLN 97 Cb 0.18 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.56 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 -1.14 -0.56 3.05 2.61 0.00 -0.37 -0.66 105.19 108.12 1xvs n GLY 98 Ca 0.00 -0.78 -0.12 0.00 0.00 0.00 0.00 46.02 45.11 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 -1.08 0.20 -0.12 1.61 0.00 -0.22 0.42 119.66 120.49 1xvs s GLN 99 Ca 0.00 0.24 -0.07 0.00 -0.00 0.00 0.00 55.36 55.54 1xvs s GLN 99 Cb 0.00 0.10 -0.04 0.00 0.00 0.00 0.00 33.01 33.07 1xvs s GLN 99 CO 0.00 -0.02 0.13 0.71 0.00 0.00 0.00 175.29 176.11 1xvs s TYR 100 N 0.09 3.57 0.29 9.60 2.02 0.03 -0.51 117.35 132.45 1xvs s TYR 100 Ca -0.00 0.50 0.06 0.00 -0.37 0.00 0.00 57.07 57.26 1xvs s TYR 100 Cb -0.01 -1.93 -0.02 0.00 -0.40 0.00 0.00 41.96 39.60 1xvs s TYR 100 CO 0.00 0.72 0.42 -1.17 -1.57 0.00 0.00 175.55 173.95 1xvs s LEU 101 N -1.04 4.13 0.04 -1.29 0.20 -0.62 -0.14 118.68 119.96 1xvs s LEU 101 Ca 0.15 -0.05 0.03 0.00 0.69 0.00 0.00 54.13 54.95 1xvs s LEU 101 Cb -0.12 -2.82 -0.02 0.00 -0.43 0.00 0.00 46.19 42.80 1xvs s LEU 101 CO 0.04 -0.27 -0.09 0.27 -0.29 0.00 0.00 176.35 176.02 1xvs s ILE 103 N -2.09 0.66 0.06 6.68 -4.36 -0.33 -2.87 121.20 118.95 1xvs s ILE 103 Ca 0.40 -0.93 -0.00 0.00 -0.26 0.00 0.00 60.65 59.85 1xvs s ILE 103 Cb -0.09 -0.67 0.01 0.00 1.25 0.00 0.00 42.46 42.96 1xvs s ILE 103 CO 0.30 -0.21 0.08 -0.90 0.24 0.00 0.00 174.94 174.45 1xvs n ASP 104 N 1.78 0.06 0.20 4.36 5.68 0.20 -0.99 116.55 127.84 1xvs n ASP 104 Ca -0.20 -1.07 0.07 0.00 -0.50 0.00 0.00 54.79 53.09 1xvs n ASP 104 Cb 0.55 -0.06 0.37 0.00 -1.14 0.00 0.00 41.12 40.84 1xvs n ASP 104 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1xvs h GLU 105 N 0.00 0.00 -0.00 0.11 5.08 -1.85 0.14 114.58 118.06 1xvs h GLU 105 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1xvs h GLU 105 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1xvs h GLU 105 CO 0.02 0.33 -0.03 0.94 -1.00 0.00 0.00 179.01 179.28 1xvs n GLN 106 N -3.50 0.86 -1.19 2.33 -0.06 -1.26 -4.91 117.38 109.65 1xvs n GLN 106 Ca -0.00 -0.16 -0.03 0.00 -2.00 0.00 0.00 57.00 54.81 1xvs n GLN 106 Cb 0.49 -1.50 -0.01 0.00 -4.06 0.00 0.00 30.24 25.16 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 1.15 0.59 3.76 1.69 0.00 0.04 -5.03 105.19 107.40 1xvs n GLY 107 Ca 0.19 -0.91 -0.40 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.46 4.63 0.41 1.61 2.56 -1.26 -4.75 118.70 119.45 1xvs s GLU 108 Ca 0.00 1.24 -0.25 0.00 0.00 0.00 0.00 54.97 55.96 1xvs s GLU 108 Cb 0.00 -3.29 -0.08 0.00 2.00 0.00 0.00 34.13 32.76 1xvs s GLU 108 CO 0.00 0.50 1.20 -1.12 -0.56 0.00 0.00 175.26 175.28 1xvs s SER 109 N -0.92 6.43 -0.15 -1.70 0.01 -1.26 0.62 113.70 116.72 1xvs s SER 109 Ca 0.38 2.42 -0.20 0.00 1.31 0.00 0.00 55.95 59.86 1xvs s SER 109 Cb -0.23 -2.62 0.05 0.00 0.21 0.00 0.00 66.02 63.43 1xvs s SER 109 CO 0.27 -0.75 0.52 0.72 0.41 0.00 0.00 173.24 174.41 1xvs s PHE 110 N -1.38 -0.53 -0.14 2.43 -0.71 -1.26 -4.91 117.98 111.48 1xvs s PHE 110 Ca 0.58 1.19 -0.14 0.00 -1.04 0.00 0.00 56.93 57.52 1xvs s PHE 110 Cb -0.32 0.21 -0.05 0.00 -1.21 0.00 0.00 43.02 41.65 1xvs s PHE 110 CO 0.41 -0.35 0.31 0.99 -1.34 0.00 0.00 175.22 175.24 1xvs s THR 111 N -0.20 5.28 -0.16 -4.49 2.01 -1.26 -4.46 115.64 112.36 1xvs s THR 111 Ca -0.04 0.58 -0.03 0.00 0.31 0.00 0.00 61.69 62.51 1xvs s THR 111 Cb -0.03 -3.64 -0.02 0.00 0.01 0.00 0.00 72.50 68.82 1xvs s THR 111 CO 0.03 0.42 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.63 1xvs s VAL 112 N 0.20 3.59 -0.04 3.82 1.01 0.80 -4.98 120.40 124.79 1xvs s VAL 112 Ca 0.18 -0.46 -0.19 0.00 0.00 0.00 0.00 61.98 61.51 1xvs s VAL 112 Cb -0.13 -2.57 -0.05 0.00 0.00 0.00 0.00 36.38 33.62 1xvs s VAL 112 CO 0.05 0.48 0.55 -1.61 0.00 0.00 0.00 175.10 174.57 1xvs s GLU 113 N 0.60 4.29 -0.40 2.72 0.41 -1.26 -0.79 118.70 124.27 1xvs s GLU 113 Ca -0.04 0.62 -0.15 0.00 -0.41 0.00 0.00 54.97 55.00 1xvs s GLU 113 Cb -0.15 -3.36 0.02 0.00 -1.78 0.00 0.00 34.13 28.86 1xvs s GLU 113 CO 0.03 0.33 0.29 0.42 -0.49 0.00 0.00 175.26 175.83 1xvs s ILE 114 N 0.01 5.20 0.73 -1.63 -1.09 0.17 -4.93 121.20 119.64 1xvs s ILE 114 Ca 0.29 -0.65 -0.13 0.00 -2.23 0.00 0.00 60.65 57.92 1xvs s ILE 114 Cb -0.17 -3.88 0.04 0.00 -1.58 0.00 0.00 42.46 36.86 1xvs s ILE 114 CO 0.15 -0.29 1.13 -1.61 -1.23 0.00 0.00 174.94 173.09 1xvs s GLU 115 N 1.67 2.36 0.18 2.79 0.41 -1.26 -1.24 118.70 123.60 1xvs s GLU 115 Ca 0.05 1.43 -0.33 0.00 -0.41 0.00 0.00 54.97 55.70 1xvs s GLU 115 Cb -0.19 -1.89 -0.13 0.00 -1.78 0.00 0.00 34.13 30.14 1xvs s GLU 115 CO 0.10 -1.60 1.61 -2.30 -0.49 0.00 0.00 175.26 172.57 1xvs n PRO 116 N -2.92 2.31 -4.21 0.39 -0.02 -1.26 -4.66 135.00 124.63 1xvs n PRO 116 Ca 0.11 0.83 -0.16 0.00 -2.02 0.00 0.00 63.50 62.26 1xvs n PRO 116 Cb 0.52 -2.62 -0.11 0.00 -0.02 0.00 0.00 33.50 31.27 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 0.92 1.23 -0.02 6.00 -0.71 -1.26 -5.00 117.98 119.14 1xvs s PHE 117 Ca 0.77 -0.59 -0.06 0.00 -1.04 0.00 0.00 56.93 56.01 1xvs s PHE 117 Cb -0.63 -0.66 -0.04 0.00 -1.21 0.00 0.00 43.02 40.48 1xvs s PHE 117 CO 0.37 0.07 0.22 1.03 -1.34 0.00 0.00 175.22 175.58 1xvs s ARG 118 N -2.66 3.52 -0.13 1.99 0.52 -1.26 -4.26 118.95 116.66 1xvs s ARG 118 Ca 0.07 -0.14 -0.02 0.00 -0.52 0.00 0.00 55.73 55.11 1xvs s ARG 118 Cb -0.04 -3.11 -0.03 0.00 0.52 0.00 0.00 34.95 32.29 1xvs s ARG 118 CO 0.02 0.68 -0.05 -0.51 0.02 0.00 0.00 175.30 175.46 1xvs s LEU 119 N -1.66 3.23 -0.24 2.53 1.43 0.89 -4.86 118.68 119.99 1xvs s LEU 119 Ca 0.25 -0.10 -0.18 0.00 -1.03 0.00 0.00 54.13 53.08 1xvs s LEU 119 Cb -0.13 -1.76 0.07 0.00 0.03 0.00 0.00 46.19 44.40 1xvs s LEU 119 CO 0.15 0.23 0.61 0.00 0.23 0.00 0.00 176.35 177.56 1xvs s ALA 120 N 0.02 -1.57 0.56 4.21 0.00 -1.26 -0.62 121.76 123.11 1xvs s ALA 120 Ca 0.00 1.93 -0.18 0.00 0.00 0.00 0.00 51.96 53.71 1xvs s ALA 120 Cb -0.13 -1.13 -0.12 0.00 0.00 0.00 0.00 23.12 21.73 1xvs s ALA 120 CO 0.03 -0.32 0.10 1.55 0.00 0.00 0.00 175.76 177.12 1xvs n VAL 121 N 3.47 0.85 -2.04 0.00 3.14 0.88 -4.39 118.33 120.25 1xvs n VAL 121 Ca -0.17 -0.49 -0.41 0.00 -2.96 0.00 0.00 64.34 60.31 1xvs n VAL 121 Cb 0.57 -0.27 -0.02 0.00 -1.06 0.00 0.00 33.84 33.06 1xvs n VAL 121 CO 0.00 0.00 0.00 -2.84 -6.46 0.00 0.00 176.83 167.53 1xvs s PRO 122 N -1.52 4.29 -0.39 1.45 0.02 -1.26 -4.92 135.00 132.67 1xvs s PRO 122 Ca 0.61 2.31 0.11 0.00 0.02 0.00 0.00 61.00 64.04 1xvs s PRO 122 Cb -0.46 -3.05 0.39 0.00 0.02 0.00 0.00 34.50 31.41 1xvs s PRO 122 CO 0.63 -0.28 1.13 -2.39 -0.33 0.00 0.00 177.00 175.76 1xvs n HIS 123 N 0.73 -1.30 1.41 6.54 1.44 -1.26 -5.20 115.22 117.58 1xvs n HIS 123 Ca 0.00 -2.41 0.14 0.00 -2.01 0.00 0.00 57.72 53.44 1xvs n HIS 123 Cb 0.41 0.86 0.45 0.00 0.12 0.00 0.00 29.99 31.83 1xvs n HIS 123 CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81