#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oy7 n GLY 72 N 0.00 1.40 3.78 0.00 0.00 -1.26 -5.07 105.19 104.05 1oy7 n GLY 72 Ca 0.00 -0.96 -0.34 0.00 0.00 0.00 0.00 46.02 44.72 1oy7 n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oy7 s ALA 73 N 0.00 2.66 0.00 4.61 0.00 -1.26 -5.06 121.76 122.71 1oy7 s ALA 73 Ca 0.00 0.58 0.03 0.00 0.00 0.00 0.00 51.96 52.57 1oy7 s ALA 73 Cb 0.00 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 1oy7 s ALA 73 CO 0.00 -0.88 -0.05 0.99 0.00 0.00 0.00 175.76 175.83 1oy7 s THR 74 N -2.18 3.81 0.26 0.00 2.01 -1.26 -5.09 115.64 113.19 1oy7 s THR 74 Ca 0.67 -0.71 -0.30 0.00 0.31 0.00 0.00 61.69 61.66 1oy7 s THR 74 Cb -0.19 -2.67 -0.11 0.00 0.01 0.00 0.00 72.50 69.54 1oy7 s THR 74 CO 0.33 0.39 1.57 -0.22 -0.69 0.00 0.00 174.62 176.00 1oy7 s LEU 75 N -1.44 4.36 0.57 4.42 2.96 -1.26 -4.98 118.68 123.30 1oy7 s LEU 75 Ca 0.18 2.83 -0.18 0.00 -0.22 0.00 0.00 54.13 56.73 1oy7 s LEU 75 Cb -0.11 -3.62 -0.05 0.00 0.50 0.00 0.00 46.19 42.91 1oy7 s LEU 75 CO 0.08 -0.86 1.12 -0.44 -1.32 0.00 0.00 176.35 174.93 1oy7 s SER 76 N 0.61 5.63 0.00 3.68 0.01 -1.26 -4.96 113.70 117.41 1oy7 s SER 76 Ca 0.64 2.12 0.24 0.00 1.31 0.00 0.00 55.95 60.26 1oy7 s SER 76 Cb -0.46 -2.57 0.20 0.00 0.21 0.00 0.00 66.02 63.40 1oy7 s SER 76 CO 0.43 -1.28 1.21 0.54 0.41 0.00 0.00 173.24 174.55 1oy7 n ARG 77 N -1.54 0.70 -2.88 12.44 1.74 -1.26 -4.91 116.66 120.94 1oy7 n ARG 77 Ca 0.11 -0.52 -0.41 0.00 -0.77 0.00 0.00 57.85 56.26 1oy7 n ARG 77 Cb 0.51 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.43 1oy7 n ARG 77 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1oy7 s GLY 78 N -2.66 2.75 0.46 -0.13 0.00 -1.26 -5.04 107.32 101.45 1oy7 s GLY 78 Ca 0.17 0.33 -0.24 0.00 0.00 0.00 0.00 44.72 44.97 1oy7 s GLY 78 CO 0.64 1.43 1.24 -1.05 0.00 0.00 0.00 173.10 175.36 1oy7 n PRO 79 N 3.85 1.75 -0.09 2.90 -0.02 -1.26 -4.92 135.00 137.21 1oy7 n PRO 79 Ca 0.02 0.63 0.02 0.00 -2.02 0.00 0.00 63.50 62.15 1oy7 n PRO 79 Cb 0.51 -2.38 0.34 0.00 -0.02 0.00 0.00 33.50 31.95 1oy7 n PRO 79 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oy7 h ALA 80 N 1.77 1.57 -2.19 3.55 0.00 -0.85 -3.36 119.26 119.74 1oy7 h ALA 80 Ca -0.48 -0.06 -0.53 0.00 0.00 0.00 0.00 54.91 53.84 1oy7 h ALA 80 Cb 1.31 -0.22 -0.35 0.00 0.00 0.00 0.00 17.79 18.52 1oy7 h ALA 80 CO 0.58 0.38 -0.90 0.12 0.00 0.00 0.00 179.25 179.44 1oy7 s PHE 81 N -5.59 0.67 0.44 0.00 2.19 -0.24 -5.03 117.98 110.42 1oy7 s PHE 81 Ca -0.09 -2.01 0.17 0.00 0.33 0.00 0.00 56.93 55.33 1oy7 s PHE 81 Cb 0.17 -0.74 1.11 0.00 -1.31 0.00 0.00 43.02 42.25 1oy7 s PHE 81 CO 0.76 -0.89 1.94 -1.35 1.83 0.00 0.00 175.22 177.50 1oy7 h PRO 82 N 5.70 0.33 -0.75 10.12 0.11 -1.79 -2.18 132.00 143.54 1oy7 h PRO 82 Ca 0.22 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.30 1oy7 h PRO 82 Cb 0.94 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 31.94 1oy7 h PRO 82 CO 0.31 0.22 0.40 0.78 -0.21 0.00 0.00 178.00 179.51 1oy7 h GLY 83 N 0.34 1.11 0.07 -0.55 0.00 -1.96 -1.08 103.07 101.00 1oy7 h GLY 83 Ca 0.35 -0.49 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1oy7 h GLY 83 CO -0.10 0.47 0.00 1.03 0.00 0.00 0.00 176.54 177.95 1oy7 n MET 84 N -4.36 0.91 0.33 4.80 2.81 -0.82 -3.86 117.12 116.93 1oy7 n MET 84 Ca 0.08 0.00 0.21 0.00 -1.81 0.00 0.00 57.70 56.18 1oy7 n MET 84 Cb 0.10 -1.03 1.12 0.00 -0.71 0.00 0.00 33.22 32.70 1oy7 n MET 84 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1oy7 h GLY 85 N 5.38 0.00 -5.96 3.03 0.00 -1.27 -3.42 103.07 100.84 1oy7 h GLY 85 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.74 1oy7 h GLY 85 CO 0.00 0.00 0.09 -0.45 0.00 0.00 0.00 176.54 176.18 1oy7 s SER 86 N -5.31 6.68 0.20 0.19 0.15 -1.25 -4.97 113.70 109.39 1oy7 s SER 86 Ca -0.04 0.83 -0.11 0.00 0.70 0.00 0.00 55.95 57.33 1oy7 s SER 86 Cb 0.12 -2.34 0.23 0.00 -1.71 0.00 0.00 66.02 62.32 1oy7 s SER 86 CO 0.44 -0.25 1.72 -0.08 1.20 0.00 0.00 173.24 176.28 1oy7 h GLU 87 N 7.43 0.29 -0.49 5.44 4.81 -1.88 0.74 114.58 130.92 1oy7 h GLU 87 Ca -0.32 -0.02 0.08 0.00 -0.13 0.00 0.00 59.36 58.97 1oy7 h GLU 87 Cb 1.15 -0.06 -0.07 0.00 0.63 0.00 0.00 28.75 30.40 1oy7 h GLU 87 CO 0.77 0.19 0.10 1.49 -0.73 0.00 0.00 179.01 180.83 1oy7 h GLU 88 N 0.30 0.23 -0.65 1.92 4.57 -1.94 0.11 114.58 119.12 1oy7 h GLU 88 Ca 0.27 -0.01 -0.06 0.00 -1.18 0.00 0.00 59.36 58.38 1oy7 h GLU 88 Cb 0.36 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 1oy7 h GLU 88 CO -0.32 0.15 0.16 -0.07 -1.18 0.00 0.00 179.01 177.76 1oy7 h LEU 89 N 0.24 0.99 -1.19 1.64 3.38 -1.75 -2.57 115.31 116.06 1oy7 h LEU 89 Ca 0.24 -0.23 0.05 0.00 0.09 0.00 0.00 57.88 58.04 1oy7 h LEU 89 Cb 0.32 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 1oy7 h LEU 89 CO -0.31 0.96 0.57 0.03 0.09 0.00 0.00 178.44 179.77 1oy7 h ARG 90 N 0.97 0.98 -0.66 1.13 3.08 -0.06 -2.25 114.38 117.58 1oy7 h ARG 90 Ca 0.21 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.16 1oy7 h ARG 90 Cb 0.36 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.15 1oy7 h ARG 90 CO 0.00 0.65 0.29 -0.07 -1.07 0.00 0.00 179.97 179.77 1oy7 h LEU 91 N 1.01 0.89 -0.97 3.04 3.38 -0.47 -2.99 115.31 119.20 1oy7 h LEU 91 Ca 0.36 -0.15 0.12 0.00 0.09 0.00 0.00 57.88 58.30 1oy7 h LEU 91 Cb 0.15 -0.23 -0.09 0.00 0.09 0.00 0.00 40.66 40.58 1oy7 h LEU 91 CO -0.12 0.80 0.60 0.00 0.09 0.00 0.00 178.44 179.80 1oy7 h ALA 92 N 1.13 1.46 -0.06 1.53 0.00 -1.02 -1.26 119.26 121.03 1oy7 h ALA 92 Ca 0.22 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.18 1oy7 h ALA 92 Cb 0.17 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1oy7 h ALA 92 CO -0.02 0.17 0.13 0.66 0.00 0.00 0.00 179.25 180.19 1oy7 h SER 93 N 0.93 0.00 -0.26 0.00 4.64 -1.44 -1.61 113.55 115.81 1oy7 h SER 93 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 1oy7 h SER 93 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1oy7 h SER 93 CO -0.28 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.17 1oy7 n PHE 94 N -3.39 0.40 0.17 4.77 3.72 -0.48 -4.28 117.46 118.37 1oy7 n PHE 94 Ca -0.01 -0.19 0.19 0.00 -0.05 0.00 0.00 57.45 57.39 1oy7 n PHE 94 Cb 0.22 -0.03 0.79 0.00 -0.94 0.00 0.00 39.48 39.52 1oy7 n PHE 94 CO 0.00 0.00 0.00 0.10 -0.05 0.00 0.00 176.76 176.81 1oy7 h TYR 95 N 1.54 0.00 0.00 1.38 -0.00 -1.43 -0.91 116.97 117.55 1oy7 h TYR 95 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 58.73 58.70 1oy7 h TYR 95 Cb 0.43 0.00 -0.06 0.00 -0.00 0.00 0.00 36.73 37.10 1oy7 h TYR 95 CO 0.20 0.00 -0.43 -0.40 -0.00 0.00 0.00 178.16 177.53 1oy7 n ASP 96 N -3.53 1.64 -4.64 0.10 5.75 -1.26 -5.03 116.55 109.57 1oy7 n ASP 96 Ca 0.04 -3.20 -0.43 0.00 -0.01 0.00 0.00 54.79 51.19 1oy7 n ASP 96 Cb 0.50 -0.43 -0.03 0.00 -1.03 0.00 0.00 41.12 40.12 1oy7 n ASP 96 CO 0.00 0.00 0.00 1.87 -0.11 0.00 0.00 177.20 178.96 1oy7 n TRP 97 N -0.87 2.35 -1.07 2.11 -0.00 -0.35 -4.89 117.44 114.71 1oy7 n TRP 97 Ca 0.14 -0.29 -0.34 0.00 -0.00 0.00 0.00 57.50 57.01 1oy7 n TRP 97 Cb 0.74 -2.78 0.12 0.00 -0.00 0.00 0.00 31.31 29.39 1oy7 n TRP 97 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 177.69 175.39 1oy7 n PRO 98 N 7.85 0.12 -0.16 5.87 -0.02 -1.26 -4.93 135.00 142.47 1oy7 n PRO 98 Ca 0.23 0.11 -0.10 0.00 -2.02 0.00 0.00 63.50 61.72 1oy7 n PRO 98 Cb 0.41 -2.27 -0.00 0.00 -0.02 0.00 0.00 33.50 31.62 1oy7 n PRO 98 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1oy7 h LEU 99 N -0.94 0.79 -0.37 2.45 4.07 -2.00 -2.82 115.31 116.49 1oy7 h LEU 99 Ca -0.46 -0.29 0.00 0.00 0.08 0.00 0.00 57.88 57.21 1oy7 h LEU 99 Cb 1.30 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 42.83 1oy7 h LEU 99 CO 0.44 0.88 0.00 0.35 -1.08 0.00 0.00 178.44 179.03 1oy7 n THR 100 N -4.39 0.75 -1.90 0.22 -2.24 -1.26 -4.79 114.28 100.67 1oy7 n THR 100 Ca 0.01 0.11 -0.37 0.00 -2.27 0.00 0.00 64.05 61.52 1oy7 n THR 100 Cb 0.29 -0.96 0.04 0.00 -2.10 0.00 0.00 70.33 67.59 1oy7 n THR 100 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oy7 s ALA 101 N -3.19 2.70 -0.28 6.98 0.00 -1.07 -4.97 121.76 121.94 1oy7 s ALA 101 Ca 0.07 1.18 0.04 0.00 0.00 0.00 0.00 51.96 53.25 1oy7 s ALA 101 Cb 0.11 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.70 1oy7 s ALA 101 CO 0.42 -1.26 0.29 0.39 0.00 0.00 0.00 175.76 175.60 1oy7 n GLU 102 N -1.23 4.10 -4.99 0.00 1.02 -1.26 -4.97 120.64 113.31 1oy7 n GLU 102 Ca 0.12 -0.20 -0.32 0.00 -0.02 0.00 0.00 57.16 56.73 1oy7 n GLU 102 Cb 0.47 -0.79 -0.14 0.00 -0.02 0.00 0.00 31.44 30.96 1oy7 n GLU 102 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1oy7 s VAL 103 N -1.10 2.78 0.09 2.62 1.01 -1.26 -4.27 120.40 120.28 1oy7 s VAL 103 Ca 0.02 -0.82 -0.30 0.00 0.00 0.00 0.00 61.98 60.88 1oy7 s VAL 103 Cb 0.03 -2.08 -0.06 0.00 0.00 0.00 0.00 36.38 34.28 1oy7 s VAL 103 CO 0.13 0.58 1.14 -2.16 0.00 0.00 0.00 175.10 174.78 1oy7 s PRO 104 N -0.50 4.50 0.47 2.72 0.04 -1.26 -4.94 135.00 136.03 1oy7 s PRO 104 Ca 0.06 1.70 0.27 0.00 0.04 0.00 0.00 61.00 63.08 1oy7 s PRO 104 Cb -0.12 -3.34 1.33 0.00 0.04 0.00 0.00 34.50 32.41 1oy7 s PRO 104 CO 0.01 -0.12 1.78 -1.35 0.04 0.00 0.00 177.00 177.37 1oy7 h PRO 105 N 6.25 0.19 -0.37 0.56 0.11 -1.99 -1.74 132.00 135.00 1oy7 h PRO 105 Ca -0.42 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.69 1oy7 h PRO 105 Cb 1.21 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 1oy7 h PRO 105 CO 0.77 0.12 0.21 0.93 -0.21 0.00 0.00 178.00 179.83 1oy7 h GLU 106 N 0.19 0.41 -0.65 1.05 3.07 -1.97 0.43 114.58 117.11 1oy7 h GLU 106 Ca 0.58 -0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 59.37 1oy7 h GLU 106 Cb 1.89 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 29.68 1oy7 h GLU 106 CO -0.17 0.27 0.20 -0.07 -1.40 0.00 0.00 179.01 177.84 1oy7 h LEU 107 N 0.42 0.96 0.07 1.33 3.38 -1.72 -1.70 115.31 118.05 1oy7 h LEU 107 Ca 0.15 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1oy7 h LEU 107 Cb 0.02 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.52 1oy7 h LEU 107 CO -0.08 0.92 -0.03 -0.07 0.09 0.00 0.00 178.44 179.27 1oy7 h LEU 108 N 0.95 -0.08 -1.13 1.67 3.38 -1.15 -2.63 115.31 116.32 1oy7 h LEU 108 Ca 0.21 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 1oy7 h LEU 108 Cb 0.31 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1oy7 h LEU 108 CO -0.00 0.04 -0.08 0.00 0.09 0.00 0.00 178.44 178.48 1oy7 h ALA 109 N 0.73 1.28 -0.71 1.53 0.00 -0.11 -2.26 119.26 119.72 1oy7 h ALA 109 Ca -0.01 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.58 1oy7 h ALA 109 Cb 0.17 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1oy7 h ALA 109 CO 0.02 0.48 0.17 0.00 0.00 0.00 0.00 179.25 179.92 1oy7 h ALA 110 N 1.44 0.96 0.00 0.00 0.00 -1.24 -2.40 119.26 118.01 1oy7 h ALA 110 Ca 0.09 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1oy7 h ALA 110 Cb 0.44 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1oy7 h ALA 110 CO 0.02 0.67 0.00 0.00 0.00 0.00 0.00 179.25 179.94 1oy7 n ALA 111 N -2.46 2.47 -0.13 0.00 0.00 -1.00 -4.87 120.51 114.53 1oy7 n ALA 111 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1oy7 n ALA 111 Cb 0.26 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.69 1oy7 n ALA 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oy7 n GLY 112 N 0.48 0.66 3.83 0.00 0.00 -0.90 -4.90 105.19 104.35 1oy7 n GLY 112 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 1oy7 n GLY 112 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1oy7 s PHE 113 N -2.36 3.48 0.14 1.61 0.08 -0.88 -1.55 117.98 118.50 1oy7 s PHE 113 Ca 0.00 1.35 0.06 0.00 0.12 0.00 0.00 56.93 58.46 1oy7 s PHE 113 Cb 0.00 -2.62 -0.04 0.00 -0.57 0.00 0.00 43.02 39.79 1oy7 s PHE 113 CO 0.00 0.16 -0.13 -0.59 -0.10 0.00 0.00 175.22 174.56 1oy7 s PHE 114 N -1.83 1.41 -0.04 0.36 -0.12 -0.52 -3.79 117.98 113.45 1oy7 s PHE 114 Ca 0.51 -0.60 -0.24 0.00 -0.05 0.00 0.00 56.93 56.54 1oy7 s PHE 114 Cb -0.13 -0.72 -0.04 0.00 -0.63 0.00 0.00 43.02 41.50 1oy7 s PHE 114 CO 0.19 0.16 0.74 -1.58 -0.05 0.00 0.00 175.22 174.68 1oy7 s HIS 115 N -2.51 3.61 0.28 3.49 5.65 -1.26 -1.74 115.29 122.81 1oy7 s HIS 115 Ca 0.12 1.34 0.11 0.00 0.25 0.00 0.00 55.06 56.88 1oy7 s HIS 115 Cb -0.03 -2.84 -0.05 0.00 -1.18 0.00 0.00 32.58 28.48 1oy7 s HIS 115 CO 0.03 0.11 -0.17 0.95 -0.65 0.00 0.00 174.74 175.01 1oy7 s THR 116 N 0.68 2.27 0.00 0.89 -4.23 -0.87 -4.87 115.64 109.51 1oy7 s THR 116 Ca 0.39 -2.33 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 1oy7 s THR 116 Cb -0.19 -2.32 0.00 0.00 1.34 0.00 0.00 72.50 71.33 1oy7 s THR 116 CO 0.20 -0.39 0.00 0.61 -0.54 0.00 0.00 174.62 174.50 1oy7 n GLY 117 N -0.61 0.25 0.00 3.99 0.00 -1.26 -4.18 105.19 103.38 1oy7 n GLY 117 Ca -0.06 -0.97 0.01 0.00 0.00 0.00 0.00 46.02 45.01 1oy7 n GLY 117 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1oy7 n HIS 118 N -0.01 0.00 0.00 1.61 8.25 -1.26 -4.99 115.22 118.82 1oy7 n HIS 118 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1oy7 n HIS 118 Cb 0.00 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.09 1oy7 n HIS 118 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1oy7 n GLN 119 N -1.21 0.06 -0.43 -0.41 3.00 -1.26 -4.76 117.38 112.37 1oy7 n GLN 119 Ca 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 57.00 57.06 1oy7 n GLN 119 Cb 0.04 0.00 0.19 0.00 0.00 0.00 0.00 30.24 30.47 1oy7 n GLN 119 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.06 176.66 1oy7 n ASP 120 N 0.00 2.15 -4.73 1.08 5.75 -1.26 -4.52 116.55 115.02 1oy7 n ASP 120 Ca 0.00 -3.55 -0.41 0.00 -0.01 0.00 0.00 54.79 50.82 1oy7 n ASP 120 Cb 0.00 -0.51 -0.04 0.00 -1.03 0.00 0.00 41.12 39.54 1oy7 n ASP 120 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1oy7 s LYS 121 N -3.09 4.58 0.21 0.11 1.02 -1.26 -4.41 119.74 116.91 1oy7 s LYS 121 Ca 0.37 1.67 0.06 0.00 0.02 0.00 0.00 55.97 58.09 1oy7 s LYS 121 Cb 0.34 -3.31 -0.05 0.00 -0.52 0.00 0.00 37.83 34.29 1oy7 s LYS 121 CO -0.02 0.04 -0.08 0.14 -0.92 0.00 0.00 175.35 174.51 1oy7 s VAL 122 N 0.03 1.44 0.02 3.17 -7.23 0.10 -2.05 120.40 115.88 1oy7 s VAL 122 Ca 0.50 -2.12 0.00 0.00 -1.81 0.00 0.00 61.98 58.56 1oy7 s VAL 122 Cb -0.28 -2.16 -0.02 0.00 0.56 0.00 0.00 36.38 34.48 1oy7 s VAL 122 CO 0.33 -0.50 -0.03 -0.13 -0.31 0.00 0.00 175.10 174.46 1oy7 s ARG 123 N -3.73 0.28 0.09 4.82 0.52 -0.71 -1.57 118.95 118.64 1oy7 s ARG 123 Ca 0.24 -0.47 -0.30 0.00 -0.52 0.00 0.00 55.73 54.68 1oy7 s ARG 123 Cb 0.02 -0.00 -0.05 0.00 0.52 0.00 0.00 34.95 35.44 1oy7 s ARG 123 CO 0.07 -0.02 1.01 0.00 0.02 0.00 0.00 175.30 176.38 1oy7 h PHE 125 N 5.93 0.00 0.00 0.00 -5.15 -1.60 0.90 116.94 117.02 1oy7 h PHE 125 Ca -0.42 0.00 -0.10 0.00 -0.20 0.00 0.00 57.97 57.25 1oy7 h PHE 125 Cb 1.21 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.37 1oy7 h PHE 125 CO 0.65 0.01 -1.07 0.34 -2.00 0.00 0.00 178.31 176.25 1oy7 n PHE 126 N -3.88 0.47 0.52 6.09 -0.00 -1.26 -1.08 117.46 118.32 1oy7 n PHE 126 Ca -0.03 0.20 0.12 0.00 -0.00 0.00 0.00 57.45 57.74 1oy7 n PHE 126 Cb 0.10 -0.75 0.12 0.00 -0.00 0.00 0.00 39.48 38.96 1oy7 n PHE 126 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1oy7 n TYR 128 N -2.14 0.00 -1.69 0.00 9.36 0.31 -4.95 117.16 118.06 1oy7 n TYR 128 Ca 0.03 0.00 -0.44 0.00 3.32 0.00 0.00 57.90 60.81 1oy7 n TYR 128 Cb 0.45 -2.85 -0.04 0.00 -0.63 0.00 0.00 39.34 36.27 1oy7 n TYR 128 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1oy7 n GLY 129 N -0.90 1.53 3.47 2.98 0.00 -1.26 -4.53 105.19 106.48 1oy7 n GLY 129 Ca -0.16 0.72 -0.35 0.00 0.00 0.00 0.00 46.02 46.23 1oy7 n GLY 129 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1oy7 s GLY 130 N 2.48 1.73 0.04 -0.02 0.00 -1.26 -1.09 107.32 109.21 1oy7 s GLY 130 Ca 0.82 -0.95 0.04 0.00 0.00 0.00 0.00 44.72 44.64 1oy7 s GLY 130 CO 0.39 0.17 -0.12 1.08 0.00 0.00 0.00 173.10 174.62 1oy7 s LEU 131 N 0.85 2.20 0.00 0.66 1.43 -0.61 -4.99 118.68 118.22 1oy7 s LEU 131 Ca 0.01 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 52.62 1oy7 s LEU 131 Cb -0.14 -0.47 -0.00 0.00 0.03 0.00 0.00 46.19 45.60 1oy7 s LEU 131 CO 0.02 -0.04 0.02 0.00 0.23 0.00 0.00 176.35 176.58 1oy7 n GLN 132 N 1.75 0.03 -3.67 1.70 10.64 -1.26 -0.72 117.38 125.85 1oy7 n GLN 132 Ca -0.19 -0.16 -0.22 0.00 -1.83 0.00 0.00 57.00 54.60 1oy7 n GLN 132 Cb 0.55 0.14 0.05 0.00 -0.86 0.00 0.00 30.24 30.12 1oy7 n GLN 132 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 1oy7 n SER 133 N -2.44 -2.48 -4.77 2.61 7.64 -1.26 -4.96 113.62 107.97 1oy7 n SER 133 Ca 0.00 -0.74 -0.41 0.00 1.01 0.00 0.00 58.87 58.73 1oy7 n SER 133 Cb 0.03 -4.36 -0.02 0.00 -1.01 0.00 0.00 64.21 58.84 1oy7 n SER 133 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1oy7 s TRP 134 N -3.51 3.10 0.05 1.43 0.52 -1.26 -5.04 118.94 114.23 1oy7 s TRP 134 Ca 0.17 1.45 0.02 0.00 0.02 0.00 0.00 56.10 57.76 1oy7 s TRP 134 Cb -0.08 -3.64 -0.03 0.00 -1.15 0.00 0.00 33.47 28.57 1oy7 s TRP 134 CO 0.79 -1.72 -0.08 0.15 0.02 0.00 0.00 176.95 176.10 1oy7 s LYS 135 N -1.76 0.59 -0.14 4.98 1.02 -1.26 -4.32 119.74 118.85 1oy7 s LYS 135 Ca 0.48 -0.83 -0.38 0.00 0.02 0.00 0.00 55.97 55.26 1oy7 s LYS 135 Cb -0.39 -0.34 -0.15 0.00 -0.52 0.00 0.00 37.83 36.43 1oy7 s LYS 135 CO 0.52 0.06 1.66 -2.13 -0.92 0.00 0.00 175.35 174.53 1oy7 n ARG 136 N 1.30 1.37 0.00 1.68 0.63 -1.26 -1.18 116.66 119.19 1oy7 n ARG 136 Ca -0.22 0.50 0.00 0.00 -0.92 0.00 0.00 57.85 57.21 1oy7 n ARG 136 Cb 0.55 -2.20 0.00 0.00 0.45 0.00 0.00 32.46 31.26 1oy7 n ARG 136 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1oy7 n GLY 137 N 3.79 2.83 3.58 5.14 0.00 -1.26 -5.05 105.19 114.22 1oy7 n GLY 137 Ca 0.23 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.74 1oy7 n GLY 137 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1oy7 n ASP 138 N 0.00 1.49 -4.46 1.61 8.00 -0.33 -4.95 116.55 117.91 1oy7 n ASP 138 Ca 0.00 1.13 -0.39 0.00 0.71 0.00 0.00 54.79 56.24 1oy7 n ASP 138 Cb 0.00 -1.19 -0.11 0.00 -0.02 0.00 0.00 41.12 39.80 1oy7 n ASP 138 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1oy7 s ASP 139 N 0.30 5.72 0.17 -2.24 2.15 -1.26 -4.96 116.67 116.54 1oy7 s ASP 139 Ca 0.81 -0.52 -0.16 0.00 0.43 0.00 0.00 52.55 53.11 1oy7 s ASP 139 Cb -0.93 -2.05 0.11 0.00 -0.30 0.00 0.00 42.92 39.75 1oy7 s ASP 139 CO 0.49 -0.22 1.69 -0.65 -0.17 0.00 0.00 175.17 176.31 1oy7 h PRO 140 N 8.40 0.09 -0.93 4.34 0.11 -1.92 0.32 132.00 142.40 1oy7 h PRO 140 Ca -0.32 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.80 1oy7 h PRO 140 Cb 1.15 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 32.19 1oy7 h PRO 140 CO 0.62 0.06 0.61 -1.49 -0.21 0.00 0.00 178.00 177.59 1oy7 h TRP 141 N 0.09 1.17 0.19 0.65 -0.00 -1.90 -0.33 115.95 115.81 1oy7 h TRP 141 Ca 0.19 0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 59.10 1oy7 h TRP 141 Cb 0.28 -0.40 0.00 0.00 -0.00 0.00 0.00 29.16 29.05 1oy7 h TRP 141 CO -0.28 0.74 -0.09 1.15 -0.00 0.00 0.00 178.44 179.96 1oy7 h THR 142 N 1.26 0.92 -1.00 1.49 2.02 -1.77 -2.25 112.91 113.58 1oy7 h THR 142 Ca 0.34 -0.73 0.20 0.00 0.77 0.00 0.00 66.41 66.99 1oy7 h THR 142 Cb -0.14 1.34 -0.11 0.00 -1.74 0.00 0.00 68.15 67.51 1oy7 h THR 142 CO -0.07 0.16 0.61 -0.33 0.37 0.00 0.00 175.52 176.26 1oy7 h GLU 143 N -0.62 0.70 0.20 6.66 4.39 -0.29 0.12 114.58 125.73 1oy7 h GLU 143 Ca -0.03 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1oy7 h GLU 143 Cb 0.46 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 1oy7 h GLU 143 CO 0.04 0.47 -0.19 1.25 -1.16 0.00 0.00 179.01 179.42 1oy7 h HIS 144 N 0.73 -0.49 0.00 4.33 2.76 -0.89 -1.46 115.15 120.12 1oy7 h HIS 144 Ca 0.58 0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.68 1oy7 h HIS 144 Cb 0.96 0.19 -0.01 0.00 1.55 0.00 0.00 27.41 30.10 1oy7 h HIS 144 CO -0.00 -0.28 -0.37 0.00 -1.30 0.00 0.00 177.93 175.97 1oy7 h ALA 145 N 0.34 1.26 -0.17 5.26 0.00 -0.72 0.95 119.26 126.18 1oy7 h ALA 145 Ca -0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 1oy7 h ALA 145 Cb 0.39 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1oy7 h ALA 145 CO -0.04 0.46 0.02 -0.22 0.00 0.00 0.00 179.25 179.47 1oy7 h LYS 146 N 0.00 0.29 0.00 0.00 3.64 -0.54 -3.34 116.57 116.62 1oy7 h LYS 146 Ca -0.00 -0.08 -0.36 0.00 -1.27 0.00 0.00 60.65 58.93 1oy7 h LYS 146 Cb 0.71 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.43 1oy7 h LYS 146 CO 0.05 0.47 -2.30 0.91 -2.27 0.00 0.00 179.45 176.31 1oy7 n TRP 147 N -4.76 0.15 -3.09 1.91 7.02 -0.57 -4.68 117.44 113.41 1oy7 n TRP 147 Ca -0.05 0.05 -0.22 0.00 -1.02 0.00 0.00 57.50 56.26 1oy7 n TRP 147 Cb 0.19 -1.03 -0.04 0.00 -2.42 0.00 0.00 31.31 28.02 1oy7 n TRP 147 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1oy7 n PHE 148 N -2.83 1.84 0.06 -5.99 3.72 0.31 -4.95 117.46 109.62 1oy7 n PHE 148 Ca -0.32 -3.90 0.19 0.00 -0.05 0.00 0.00 57.45 53.38 1oy7 n PHE 148 Cb 1.13 -0.45 0.72 0.00 -0.94 0.00 0.00 39.48 39.95 1oy7 n PHE 148 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1oy7 h PRO 149 N 3.01 0.00 -0.02 -1.08 0.13 -1.71 -1.83 132.00 130.50 1oy7 h PRO 149 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1oy7 h PRO 149 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1oy7 h PRO 149 CO 0.64 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.28 1oy7 n SER 150 N -4.18 1.95 -4.64 1.44 3.41 -1.26 -4.87 113.62 105.47 1oy7 n SER 150 Ca 0.08 -1.65 -0.47 0.00 -0.26 0.00 0.00 58.87 56.57 1oy7 n SER 150 Cb 0.55 -0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.45 1oy7 n SER 150 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1oy7 h GLN 152 N 10.66 0.00 -0.39 0.00 4.20 -1.91 -1.71 115.11 125.96 1oy7 h GLN 152 Ca -0.46 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.17 1oy7 h GLN 152 Cb 1.27 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.03 1oy7 h GLN 152 CO 0.96 0.17 -0.10 0.35 -0.67 0.00 0.00 178.83 179.54 1oy7 h PHE 153 N 0.00 0.84 -0.62 2.96 3.57 -1.96 -2.14 116.94 119.59 1oy7 h PHE 153 Ca -0.00 -0.18 -0.03 0.00 3.53 0.00 0.00 57.97 61.29 1oy7 h PHE 153 Cb 0.36 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.87 1oy7 h PHE 153 CO 0.00 0.89 0.26 1.25 -2.23 0.00 0.00 178.31 178.48 1oy7 h LEU 154 N 0.55 0.81 -0.01 0.59 5.85 -1.71 -2.44 115.31 118.96 1oy7 h LEU 154 Ca 0.10 -0.10 -0.26 0.00 0.84 0.00 0.00 57.88 58.45 1oy7 h LEU 154 Cb 0.62 -0.21 0.02 0.00 0.37 0.00 0.00 40.66 41.46 1oy7 h LEU 154 CO 0.04 0.72 -1.10 -0.07 -0.34 0.00 0.00 178.44 177.69 1oy7 h LEU 155 N 0.89 0.72 -1.09 2.25 3.38 -1.31 -1.40 115.31 118.74 1oy7 h LEU 155 Ca 0.21 -0.62 -0.07 0.00 0.09 0.00 0.00 57.88 57.49 1oy7 h LEU 155 Cb 0.15 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1oy7 h LEU 155 CO -0.02 1.43 -0.06 0.03 0.09 0.00 0.00 178.44 179.92 1oy7 h ARG 156 N 0.26 0.58 0.14 1.13 -0.00 -1.36 -0.44 114.38 114.70 1oy7 h ARG 156 Ca -0.13 -0.15 -0.32 0.00 -0.50 0.00 0.00 59.98 58.87 1oy7 h ARG 156 Cb 1.76 -0.07 -0.00 0.00 0.00 0.00 0.00 29.97 31.66 1oy7 h ARG 156 CO 0.20 0.65 -1.60 0.77 0.00 0.00 0.00 179.97 179.98 1oy7 h SER 157 N 0.54 0.47 0.00 7.04 0.02 -1.42 -3.40 113.55 116.80 1oy7 h SER 157 Ca 0.11 -0.67 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 1oy7 h SER 157 Cb 0.43 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.82 1oy7 h SER 157 CO 0.02 1.56 -0.71 0.29 -1.14 0.00 0.00 176.83 176.85 1oy7 n LYS 158 N -3.50 2.69 0.00 3.45 4.76 -0.53 -5.10 118.16 119.93 1oy7 n LYS 158 Ca -0.19 -0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.23 1oy7 n LYS 158 Cb 1.06 -0.89 0.00 0.00 -1.84 0.00 0.00 35.03 33.36 1oy7 n LYS 158 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1oy7 n GLY 159 N 1.76 -1.09 0.29 0.72 0.00 -0.17 -4.25 105.19 102.45 1oy7 n GLY 159 Ca -0.00 -1.59 -0.00 0.00 0.00 0.00 0.00 46.02 44.42 1oy7 n GLY 159 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1oy7 h ARG 160 N 0.00 0.79 -0.12 1.61 9.65 -1.94 -3.08 114.38 121.29 1oy7 h ARG 160 Ca 0.00 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 58.83 1oy7 h ARG 160 Cb 0.00 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 28.40 1oy7 h ARG 160 CO 0.00 0.52 0.05 -0.44 2.80 0.00 0.00 179.97 182.90 1oy7 h ASP 161 N 0.81 0.16 -0.27 -3.80 3.32 -1.98 -2.00 116.42 112.66 1oy7 h ASP 161 Ca 0.33 -0.15 0.05 0.00 0.02 0.00 0.00 57.03 57.29 1oy7 h ASP 161 Cb 0.18 -0.04 -0.05 0.00 0.22 0.00 0.00 39.33 39.64 1oy7 h ASP 161 CO -0.18 0.26 -0.06 0.15 -1.72 0.00 0.00 179.24 177.69 1oy7 h PHE 162 N 0.04 -0.14 0.20 4.55 3.57 -1.71 0.14 116.94 123.59 1oy7 h PHE 162 Ca 0.04 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 1oy7 h PHE 162 Cb 0.15 0.10 0.00 0.00 2.79 0.00 0.00 35.95 38.99 1oy7 h PHE 162 CO -0.02 -0.11 -0.09 0.28 -2.23 0.00 0.00 178.31 176.13 1oy7 h VAL 163 N 0.00 0.84 -1.00 1.41 2.07 -1.52 -2.06 116.25 115.99 1oy7 h VAL 163 Ca 0.13 -0.18 0.15 0.00 0.82 0.00 0.00 66.70 67.62 1oy7 h VAL 163 Cb 0.20 0.95 -0.09 0.00 -1.52 0.00 0.00 31.29 30.83 1oy7 h VAL 163 CO -0.28 0.04 0.63 -0.74 0.02 0.00 0.00 177.57 177.24 1oy7 h HIS 164 N -0.35 1.11 -0.81 1.57 -0.00 -1.12 -0.71 115.15 114.84 1oy7 h HIS 164 Ca -0.03 0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.35 1oy7 h HIS 164 Cb 0.27 -0.35 -0.04 0.00 -0.00 0.00 0.00 27.41 27.30 1oy7 h HIS 164 CO -0.04 0.37 0.41 1.03 -0.00 0.00 0.00 177.93 179.70 1oy7 h SER 165 N 0.90 1.03 0.63 3.26 0.87 -0.32 -1.53 113.55 118.39 1oy7 h SER 165 Ca 0.53 -0.10 -0.25 0.00 -1.23 0.00 0.00 61.79 60.73 1oy7 h SER 165 Cb 0.66 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.35 1oy7 h SER 165 CO -0.31 0.85 -1.13 0.58 -0.53 0.00 0.00 176.83 176.29 1oy7 h VAL 166 N 1.14 1.51 -0.46 2.23 2.07 -0.55 -3.30 116.25 118.90 1oy7 h VAL 166 Ca 0.28 -2.97 -0.12 0.00 0.82 0.00 0.00 66.70 64.71 1oy7 h VAL 166 Cb 0.07 2.81 -0.01 0.00 -1.52 0.00 0.00 31.29 32.64 1oy7 h VAL 166 CO -0.04 0.87 -0.19 1.56 0.02 0.00 0.00 177.57 179.78 1oy7 h GLN 167 N 0.09 0.91 0.00 1.57 1.08 -1.04 -3.11 115.11 114.61 1oy7 h GLN 167 Ca -0.10 -0.36 0.00 0.00 -1.45 0.00 0.00 58.65 56.73 1oy7 h GLN 167 Cb 1.84 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 29.23 1oy7 h GLN 167 CO 0.18 1.02 0.00 0.39 -0.95 0.00 0.00 178.83 179.47 1oy7 n GLU 168 N -4.12 0.03 0.00 1.46 1.02 -0.59 -5.10 120.64 113.34 1oy7 n GLU 168 Ca 0.00 0.17 0.06 0.00 -0.02 0.00 0.00 57.16 57.38 1oy7 n GLU 168 Cb 0.43 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 30.41 1oy7 n GLU 168 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56