#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s57 n GLU 84 N 0.00 1.74 -4.25 5.55 2.13 -1.26 -4.74 120.64 119.80 1s57 n GLU 84 Ca 0.00 0.61 -0.17 0.00 0.66 0.00 0.00 57.16 58.26 1s57 n GLU 84 Cb 0.00 -2.09 -0.11 0.00 0.27 0.00 0.00 31.44 29.51 1s57 n GLU 84 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 1s57 s GLU 85 N -1.64 1.05 0.03 5.31 2.02 -1.26 -1.11 118.70 123.10 1s57 s GLU 85 Ca 0.58 -1.31 -0.02 0.00 0.02 0.00 0.00 54.97 54.24 1s57 s GLU 85 Cb -0.64 -0.85 -0.02 0.00 0.10 0.00 0.00 34.13 32.71 1s57 s GLU 85 CO 0.61 0.15 0.00 -0.08 0.02 0.00 0.00 175.26 175.96 1s57 s THR 86 N -2.47 0.15 -0.23 3.63 -1.32 0.02 -4.57 115.64 110.86 1s57 s THR 86 Ca 0.12 -1.27 -0.11 0.00 -1.21 0.00 0.00 61.69 59.22 1s57 s THR 86 Cb -0.03 -0.86 -0.05 0.00 -1.51 0.00 0.00 72.50 70.05 1s57 s THR 86 CO 0.03 -0.70 0.17 -0.47 -2.21 0.00 0.00 174.62 171.43 1s57 s TYR 87 N -2.60 3.34 -0.07 9.09 5.04 -1.26 -1.59 117.35 129.30 1s57 s TYR 87 Ca -0.05 0.27 0.03 0.00 -2.44 0.00 0.00 57.07 54.88 1s57 s TYR 87 Cb -0.01 -2.26 0.00 0.00 0.35 0.00 0.00 41.96 40.04 1s57 s TYR 87 CO -0.05 0.11 -0.17 0.42 -1.34 0.00 0.00 175.55 174.52 1s57 s ILE 88 N 0.92 1.45 -0.05 3.14 1.01 -0.31 -1.48 121.20 125.88 1s57 s ILE 88 Ca 0.08 -0.68 0.01 0.00 0.00 0.00 0.00 60.65 60.06 1s57 s ILE 88 Cb -0.13 -1.28 0.02 0.00 0.01 0.00 0.00 42.46 41.08 1s57 s ILE 88 CO 0.03 0.42 -0.07 -0.32 0.00 0.00 0.00 174.94 175.01 1s57 s MET 89 N 0.39 1.09 -0.23 2.79 1.75 -0.23 -0.33 119.30 124.53 1s57 s MET 89 Ca -0.12 -0.20 -0.23 0.00 -1.25 0.00 0.00 55.69 53.89 1s57 s MET 89 Cb -0.15 -1.01 -0.01 0.00 2.84 0.00 0.00 34.83 36.50 1s57 s MET 89 CO 0.05 -0.05 0.76 0.08 -0.65 0.00 0.00 175.02 175.21 1s57 s VAL 90 N 0.83 4.90 0.84 10.11 1.01 -0.28 -0.67 120.40 137.14 1s57 s VAL 90 Ca -0.12 1.43 -0.12 0.00 0.00 0.00 0.00 61.98 63.17 1s57 s VAL 90 Cb -0.15 -4.06 0.10 0.00 0.00 0.00 0.00 36.38 32.27 1s57 s VAL 90 CO 0.01 -0.01 1.10 -0.54 0.00 0.00 0.00 175.10 175.66 1s57 s LYS 91 N 2.54 1.71 0.35 2.72 1.02 0.12 -1.85 119.74 126.34 1s57 s LYS 91 Ca 0.33 0.61 0.15 0.00 0.02 0.00 0.00 55.97 57.08 1s57 s LYS 91 Cb -0.16 -1.88 1.05 0.00 -0.52 0.00 0.00 37.83 36.33 1s57 s LYS 91 CO 0.09 -1.88 1.70 -1.35 -0.92 0.00 0.00 175.35 172.99 1s57 h PRO 92 N -1.27 0.39 0.00 -1.68 0.11 -1.83 0.13 132.00 127.85 1s57 h PRO 92 Ca -0.48 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 1s57 h PRO 92 Cb 1.28 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1s57 h PRO 92 CO 0.59 0.26 -0.30 0.38 -0.21 0.00 0.00 178.00 178.72 1s57 h ASP 93 N 0.41 0.00 -0.51 -2.05 2.03 -1.89 -1.83 116.42 112.58 1s57 h ASP 93 Ca 0.69 0.00 -0.09 0.00 -0.73 0.00 0.00 57.03 56.89 1s57 h ASP 93 Cb 1.56 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 40.04 1s57 h ASP 93 CO -0.49 0.30 -0.04 1.23 -1.03 0.00 0.00 179.24 179.21 1s57 h GLY 94 N 0.92 1.04 0.65 7.15 0.00 -0.93 -1.27 103.07 110.64 1s57 h GLY 94 Ca -0.00 -0.77 -0.03 0.00 0.00 0.00 0.00 47.33 46.53 1s57 h GLY 94 CO 0.04 0.70 -0.07 -2.22 0.00 0.00 0.00 176.54 175.00 1s57 h ILE 95 N 0.88 1.35 -0.07 2.60 5.03 -1.38 -0.39 117.51 125.53 1s57 h ILE 95 Ca 0.15 -1.18 0.02 0.00 -0.12 0.00 0.00 64.86 63.74 1s57 h ILE 95 Cb 0.57 1.95 -0.00 0.00 -3.03 0.00 0.00 36.82 36.31 1s57 h ILE 95 CO 0.03 0.33 0.05 1.56 -0.68 0.00 0.00 178.15 179.45 1s57 h GLN 96 N -0.21 0.00 -0.12 2.37 1.08 -1.25 -1.43 115.11 115.55 1s57 h GLN 96 Ca 0.02 -0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 1s57 h GLN 96 Cb 0.56 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.99 1s57 h GLN 96 CO 0.02 0.00 0.00 0.54 -0.95 0.00 0.00 178.83 178.44 1s57 n ARG 97 N -4.52 1.92 -3.31 1.46 1.74 -0.49 -4.96 116.66 108.50 1s57 n ARG 97 Ca -0.01 -1.35 -0.18 0.00 -0.77 0.00 0.00 57.85 55.54 1s57 n ARG 97 Cb 0.16 -1.45 0.06 0.00 -1.02 0.00 0.00 32.46 30.21 1s57 n ARG 97 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1s57 n GLY 98 N 1.24 -0.21 0.86 -0.13 0.00 -0.54 -4.95 105.19 101.47 1s57 n GLY 98 Ca 0.17 0.03 0.09 0.00 0.00 0.00 0.00 46.02 46.32 1s57 n GLY 98 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1s57 n LEU 99 N -3.90 2.98 0.19 0.99 4.77 -0.19 -4.69 117.00 117.15 1s57 n LEU 99 Ca -0.04 -1.51 -0.15 0.00 -0.03 0.00 0.00 56.01 54.28 1s57 n LEU 99 Cb 0.56 -0.19 -0.07 0.00 -2.33 0.00 0.00 43.42 41.40 1s57 n LEU 99 CO 0.50 0.66 0.66 0.58 -1.33 0.00 0.00 177.39 178.46 1s57 h VAL 100 N 3.33 0.37 -0.74 4.08 2.07 -1.90 -1.24 116.25 122.21 1s57 h VAL 100 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1s57 h VAL 100 Cb 0.80 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1s57 h VAL 100 CO 0.00 0.00 0.44 1.23 0.02 0.00 0.00 177.57 179.26 1s57 h GLY 101 N -0.62 1.08 1.01 2.17 0.00 -1.97 -1.73 103.07 103.02 1s57 h GLY 101 Ca -0.01 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 46.85 1s57 h GLY 101 CO -0.07 0.44 0.45 -2.09 0.00 0.00 0.00 176.54 175.27 1s57 h GLU 102 N 1.01 1.06 -0.33 4.80 4.81 -1.83 0.41 114.58 124.52 1s57 h GLU 102 Ca 0.26 -0.11 -0.12 0.00 -0.13 0.00 0.00 59.36 59.27 1s57 h GLU 102 Cb -0.02 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.14 1s57 h GLU 102 CO -0.05 0.76 -0.28 0.82 -0.73 0.00 0.00 179.01 179.54 1s57 h ILE 103 N 1.06 1.29 -0.69 2.32 2.04 -1.01 -2.70 117.51 119.83 1s57 h ILE 103 Ca 0.28 -1.44 -0.01 0.00 1.00 0.00 0.00 64.86 64.69 1s57 h ILE 103 Cb -0.01 1.49 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 1s57 h ILE 103 CO -0.05 0.47 0.40 0.40 0.00 0.00 0.00 178.15 179.37 1s57 h ILE 104 N 0.53 1.20 -0.52 -0.67 2.04 -1.02 -2.58 117.51 116.50 1s57 h ILE 104 Ca 0.06 -0.47 0.03 0.00 1.00 0.00 0.00 64.86 65.48 1s57 h ILE 104 Cb 0.84 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 1s57 h ILE 104 CO 0.07 0.21 0.34 0.28 0.00 0.00 0.00 178.15 179.06 1s57 h SER 105 N 0.94 0.51 -0.81 1.72 0.02 -0.80 -1.28 113.55 113.84 1s57 h SER 105 Ca 0.24 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.17 1s57 h SER 105 Cb -0.01 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.38 1s57 h SER 105 CO -0.04 0.35 0.43 0.03 -1.14 0.00 0.00 176.83 176.46 1s57 h ARG 106 N 0.59 1.15 0.01 3.45 3.08 -1.13 0.96 114.38 122.50 1s57 h ARG 106 Ca 0.21 -0.15 -0.20 0.00 0.07 0.00 0.00 59.98 59.91 1s57 h ARG 106 Cb 0.09 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 29.90 1s57 h ARG 106 CO -0.05 0.86 -0.97 0.74 -1.07 0.00 0.00 179.97 179.48 1s57 h PHE 107 N 1.14 0.04 -0.12 3.04 0.04 -1.45 -2.35 116.94 117.28 1s57 h PHE 107 Ca 0.28 -0.03 -0.03 0.00 2.80 0.00 0.00 57.97 61.00 1s57 h PHE 107 Cb 0.06 -0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.21 1s57 h PHE 107 CO 0.01 0.97 -0.03 0.93 -0.60 0.00 0.00 178.31 179.60 1s57 h GLU 108 N 0.01 0.23 -0.00 1.51 5.08 -0.94 -2.91 114.58 117.56 1s57 h GLU 108 Ca -0.02 -0.09 -0.07 0.00 -1.00 0.00 0.00 59.36 58.18 1s57 h GLU 108 Cb 1.69 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.92 1s57 h GLU 108 CO 0.13 0.52 -0.33 0.87 -1.00 0.00 0.00 179.01 179.21 1s57 h LYS 109 N -0.07 0.00 -0.67 2.33 1.57 -0.87 -2.58 116.57 116.28 1s57 h LYS 109 Ca 0.03 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1s57 h LYS 109 Cb 0.44 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.71 1s57 h LYS 109 CO 0.01 0.33 0.33 -0.22 -0.57 0.00 0.00 179.45 179.33 1s57 h LYS 110 N 0.00 0.95 0.00 3.15 1.63 -1.31 -3.47 116.57 117.52 1s57 h LYS 110 Ca -0.00 -0.12 0.00 0.00 -0.85 0.00 0.00 60.65 59.67 1s57 h LYS 110 Cb 0.58 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 32.03 1s57 h LYS 110 CO 0.04 0.73 0.00 0.41 -3.45 0.00 0.00 179.45 177.18 1s57 n GLY 111 N -1.13 1.29 3.89 5.01 0.00 -0.97 -5.10 105.19 108.19 1s57 n GLY 111 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 1s57 n GLY 111 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1s57 s PHE 112 N -2.00 3.54 -0.24 1.61 0.08 -1.15 -5.03 117.98 114.79 1s57 s PHE 112 Ca 0.00 0.93 -0.14 0.00 0.12 0.00 0.00 56.93 57.84 1s57 s PHE 112 Cb 0.00 -2.39 -0.04 0.00 -0.57 0.00 0.00 43.02 40.02 1s57 s PHE 112 CO 0.00 -0.26 0.34 0.21 -0.10 0.00 0.00 175.22 175.41 1s57 s LYS 113 N -4.49 4.08 -0.15 0.44 2.20 -0.64 -4.68 119.74 116.50 1s57 s LYS 113 Ca 0.49 0.04 -0.29 0.00 -0.36 0.00 0.00 55.97 55.85 1s57 s LYS 113 Cb -0.10 -3.59 -0.01 0.00 -1.51 0.00 0.00 37.83 32.62 1s57 s LYS 113 CO 0.41 -0.12 1.04 -1.17 -0.36 0.00 0.00 175.35 175.15 1s57 s LEU 114 N 1.59 4.20 0.00 5.43 2.96 -1.26 0.01 118.68 131.60 1s57 s LEU 114 Ca 0.15 1.51 0.00 0.00 -0.22 0.00 0.00 54.13 55.57 1s57 s LEU 114 Cb -0.15 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 42.99 1s57 s LEU 114 CO 0.08 -0.55 0.34 2.30 -1.32 0.00 0.00 176.35 177.20 1s57 n ILE 115 N 4.86 0.00 -3.68 6.68 -5.35 -0.18 -4.96 119.36 116.73 1s57 n ILE 115 Ca 0.10 -0.42 -0.10 0.00 -0.27 0.00 0.00 62.75 62.06 1s57 n ILE 115 Cb 0.47 1.13 -0.09 0.00 -1.74 0.00 0.00 39.64 39.41 1s57 n ILE 115 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1s57 s GLY 116 N -0.17 -0.43 -0.22 3.28 0.00 -1.03 0.28 107.32 109.02 1s57 s GLY 116 Ca 0.00 1.77 -0.16 0.00 0.00 0.00 0.00 44.72 46.34 1s57 s GLY 116 CO 0.00 1.80 0.57 -2.27 0.00 0.00 0.00 173.10 173.19 1s57 s LEU 117 N 1.22 -0.42 -0.29 0.66 2.96 -1.26 -1.00 118.68 120.56 1s57 s LEU 117 Ca -0.08 1.21 -0.24 0.00 -0.22 0.00 0.00 54.13 54.80 1s57 s LEU 117 Cb -0.06 1.94 0.14 0.00 0.50 0.00 0.00 46.19 48.70 1s57 s LEU 117 CO -0.12 -0.21 1.10 -1.59 -1.32 0.00 0.00 176.35 174.21 1s57 s LYS 118 N 1.07 0.41 0.02 1.98 -2.85 -0.60 -4.99 119.74 114.79 1s57 s LYS 118 Ca -0.06 0.50 -0.26 0.00 -1.00 0.00 0.00 55.97 55.15 1s57 s LYS 118 Cb -0.06 0.19 -0.05 0.00 -2.06 0.00 0.00 37.83 35.86 1s57 s LYS 118 CO -0.10 -0.05 0.82 1.41 0.10 0.00 0.00 175.35 177.53 1s57 s MET 119 N 0.29 4.53 -0.03 1.78 -2.45 -1.26 -0.20 119.30 121.95 1s57 s MET 119 Ca 0.03 1.15 -0.03 0.00 -1.25 0.00 0.00 55.69 55.59 1s57 s MET 119 Cb -0.05 -3.40 0.01 0.00 1.25 0.00 0.00 34.83 32.64 1s57 s MET 119 CO -0.09 0.16 0.09 0.12 1.05 0.00 0.00 175.02 176.35 1s57 s PHE 120 N 0.34 -0.10 -0.46 4.11 5.36 0.73 -4.95 117.98 123.01 1s57 s PHE 120 Ca 0.42 0.24 -0.15 0.00 -0.96 0.00 0.00 56.93 56.48 1s57 s PHE 120 Cb -0.20 0.03 0.06 0.00 -0.34 0.00 0.00 43.02 42.56 1s57 s PHE 120 CO 0.24 -0.05 0.37 -1.14 -1.46 0.00 0.00 175.22 173.18 1s57 s GLN 121 N 0.08 2.97 -0.17 10.12 2.00 -1.26 -0.45 119.66 132.95 1s57 s GLN 121 Ca -0.00 -1.27 -0.29 0.00 -2.00 0.00 0.00 55.36 51.80 1s57 s GLN 121 Cb -0.01 -4.09 -0.02 0.00 0.80 0.00 0.00 33.01 29.69 1s57 s GLN 121 CO -0.00 -0.96 1.45 0.00 -0.50 0.00 0.00 175.29 175.28 1s57 s PRO 123 N 4.02 3.38 0.24 0.00 0.04 -1.26 -4.71 135.00 136.71 1s57 s PRO 123 Ca 0.64 1.71 -0.05 0.00 0.04 0.00 0.00 61.00 63.34 1s57 s PRO 123 Cb -0.24 -2.10 0.46 0.00 0.04 0.00 0.00 34.50 32.66 1s57 s PRO 123 CO 0.23 -0.85 1.69 0.87 0.04 0.00 0.00 177.00 178.98 1s57 h LYS 124 N 1.36 0.29 -0.41 4.56 1.57 -1.95 -1.88 116.57 120.11 1s57 h LYS 124 Ca -0.50 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.24 1s57 h LYS 124 Cb 1.27 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.49 1s57 h LYS 124 CO 0.57 0.19 0.17 0.93 -0.57 0.00 0.00 179.45 180.74 1s57 h GLU 125 N 0.30 0.57 -0.22 3.15 5.08 -1.99 -0.37 114.58 121.10 1s57 h GLU 125 Ca 0.42 -0.07 -0.20 0.00 -1.00 0.00 0.00 59.36 58.50 1s57 h GLU 125 Cb 0.70 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1s57 h GLU 125 CO -0.49 0.47 -0.65 1.25 -1.00 0.00 0.00 179.01 178.58 1s57 h LEU 126 N 0.57 0.93 -0.49 1.33 5.85 -1.73 -1.94 115.31 119.84 1s57 h LEU 126 Ca 0.14 -0.55 -0.04 0.00 0.84 0.00 0.00 57.88 58.27 1s57 h LEU 126 Cb 0.11 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 1s57 h LEU 126 CO -0.02 1.34 0.16 0.00 -0.34 0.00 0.00 178.44 179.58 1s57 h ALA 127 N 0.66 0.64 0.00 1.25 0.00 -1.05 -1.47 119.26 119.29 1s57 h ALA 127 Ca -0.02 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 1s57 h ALA 127 Cb 1.27 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1s57 h ALA 127 CO 0.14 0.29 -0.25 0.93 0.00 0.00 0.00 179.25 180.36 1s57 h GLU 128 N 0.66 0.00 -0.04 0.00 5.08 -1.01 -1.37 114.58 117.89 1s57 h GLU 128 Ca 0.16 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.30 1s57 h GLU 128 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1s57 h GLU 128 CO -0.01 0.25 -0.88 1.49 -1.00 0.00 0.00 179.01 178.86 1s57 h GLU 129 N 0.00 0.50 -0.59 2.33 4.81 -0.97 -0.65 114.58 120.01 1s57 h GLU 129 Ca -0.00 -0.48 -0.03 0.00 -0.13 0.00 0.00 59.36 58.71 1s57 h GLU 129 Cb 0.44 0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 1s57 h GLU 129 CO 0.03 1.12 0.24 1.25 -0.73 0.00 0.00 179.01 180.92 1s57 h HIS 130 N 0.31 0.89 -0.73 0.92 2.76 -0.62 -2.64 115.15 116.04 1s57 h HIS 130 Ca -0.07 -0.07 -0.21 0.00 -2.20 0.00 0.00 60.37 57.82 1s57 h HIS 130 Cb 1.50 -0.27 -0.13 0.00 1.55 0.00 0.00 27.41 30.07 1s57 h HIS 130 CO 0.07 0.71 0.27 0.66 -1.30 0.00 0.00 177.93 178.34 1s57 n TYR 131 N -4.48 2.42 -0.31 5.26 4.01 -0.58 -4.69 117.16 118.79 1s57 n TYR 131 Ca 0.03 -1.16 0.14 0.00 -0.16 0.00 0.00 57.90 56.75 1s57 n TYR 131 Cb 0.16 -0.68 0.30 0.00 -0.31 0.00 0.00 39.34 38.81 1s57 n TYR 131 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1s57 h LYS 132 N 2.66 0.12 0.00 -0.72 3.64 -0.73 0.47 116.57 122.01 1s57 h LYS 132 Ca 0.26 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1s57 h LYS 132 Cb 2.31 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 34.10 1s57 h LYS 132 CO 0.73 0.08 0.00 -0.44 -2.27 0.00 0.00 179.45 177.55 1s57 h ASP 133 N 0.13 0.00 -0.54 4.20 3.45 -1.85 -2.51 116.42 119.29 1s57 h ASP 133 Ca 0.57 0.00 0.00 0.00 0.43 0.00 0.00 57.03 58.03 1s57 h ASP 133 Cb 1.18 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.95 1s57 h ASP 133 CO -0.74 0.00 0.00 0.18 -1.57 0.00 0.00 179.24 177.11 1s57 n LEU 134 N -2.45 3.47 -0.16 1.55 4.77 0.15 -4.63 117.00 119.71 1s57 n LEU 134 Ca -0.01 -1.95 0.25 0.00 -0.03 0.00 0.00 56.01 54.26 1s57 n LEU 134 Cb 0.09 -0.36 0.67 0.00 -2.33 0.00 0.00 43.42 41.49 1s57 n LEU 134 CO 0.14 0.86 1.24 -1.28 -1.33 0.00 0.00 177.39 177.02 1s57 h SER 135 N 3.33 0.10 0.34 -1.43 0.87 -1.51 0.06 113.55 115.31 1s57 h SER 135 Ca 0.00 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1s57 h SER 135 Cb 0.87 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 1s57 h SER 135 CO 0.00 0.04 -0.34 0.00 -0.53 0.00 0.00 176.83 176.00 1s57 n ALA 136 N -2.65 3.23 -1.80 6.23 0.00 -1.26 -4.90 120.51 119.36 1s57 n ALA 136 Ca 0.17 -0.38 -0.35 0.00 0.00 0.00 0.00 53.44 52.89 1s57 n ALA 136 Cb 0.84 -1.14 -0.05 0.00 0.00 0.00 0.00 19.45 19.09 1s57 n ALA 136 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1s57 s LYS 137 N -2.69 4.16 0.53 0.00 -0.14 0.01 -4.95 119.74 116.66 1s57 s LYS 137 Ca 0.20 1.31 0.24 0.00 -1.36 0.00 0.00 55.97 56.36 1s57 s LYS 137 Cb 0.19 -2.35 1.47 0.00 -1.68 0.00 0.00 37.83 35.46 1s57 s LYS 137 CO 0.58 -0.11 2.13 0.66 -0.76 0.00 0.00 175.35 177.86 1s57 h SER 138 N 2.17 0.00 -0.07 2.83 4.64 -1.91 -2.52 113.55 118.68 1s57 h SER 138 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1s57 h SER 138 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1s57 h SER 138 CO 0.61 0.07 0.00 2.22 -0.87 0.00 0.00 176.83 178.87 1s57 n PHE 139 N -4.00 0.08 -0.12 4.77 1.16 -1.26 -4.43 117.46 113.66 1s57 n PHE 139 Ca -0.03 -0.04 -0.05 0.00 -1.87 0.00 0.00 57.45 55.46 1s57 n PHE 139 Cb 0.16 0.00 0.01 0.00 -1.61 0.00 0.00 39.48 38.04 1s57 n PHE 139 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 1s57 h PHE 140 N 2.62 -0.45 -0.74 2.97 3.57 -1.68 0.23 116.94 123.46 1s57 h PHE 140 Ca 0.00 0.04 0.08 0.00 3.53 0.00 0.00 57.97 61.62 1s57 h PHE 140 Cb 0.56 0.26 -0.06 0.00 2.79 0.00 0.00 35.95 39.50 1s57 h PHE 140 CO 0.04 -0.26 0.41 -1.35 -2.23 0.00 0.00 178.31 174.92 1s57 h PRO 141 N -0.11 0.70 -0.62 6.41 0.11 -1.83 -1.35 132.00 135.31 1s57 h PRO 141 Ca 0.20 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.19 1s57 h PRO 141 Cb 0.41 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 31.34 1s57 h PRO 141 CO -0.47 0.46 0.10 -0.91 -0.21 0.00 0.00 178.00 176.97 1s57 h ASN 142 N 0.72 0.99 -0.40 -2.05 -0.26 -1.63 -2.18 115.58 110.77 1s57 h ASN 142 Ca 0.35 -0.26 -0.00 0.00 -0.56 0.00 0.00 56.30 55.82 1s57 h ASN 142 Cb 0.28 -0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 37.26 1s57 h ASN 142 CO -0.22 1.00 0.24 0.25 -1.06 0.00 0.00 177.43 177.63 1s57 h LEU 143 N 0.94 0.49 -0.47 1.61 5.85 -0.26 -0.61 115.31 122.85 1s57 h LEU 143 Ca 0.19 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.77 1s57 h LEU 143 Cb 0.43 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1s57 h LEU 143 CO 0.01 0.41 -0.00 0.40 -0.34 0.00 0.00 178.44 178.92 1s57 h ILE 144 N 0.53 1.26 -0.61 4.05 1.08 -1.21 -1.25 117.51 121.36 1s57 h ILE 144 Ca 0.14 -1.06 0.00 0.00 -0.39 0.00 0.00 64.86 63.56 1s57 h ILE 144 Cb 0.01 1.01 -0.03 0.00 -3.07 0.00 0.00 36.82 34.74 1s57 h ILE 144 CO -0.03 0.37 0.40 -0.08 -0.69 0.00 0.00 178.15 178.12 1s57 h GLU 145 N 0.69 0.81 0.20 2.37 4.57 -1.22 -2.12 114.58 119.88 1s57 h GLU 145 Ca 0.13 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.25 1s57 h GLU 145 Cb 0.51 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 28.92 1s57 h GLU 145 CO 0.02 0.55 -0.10 -0.92 -1.18 0.00 0.00 179.01 177.39 1s57 h TYR 146 N 0.83 -0.25 0.00 0.92 3.20 -0.91 -0.12 116.97 120.64 1s57 h TYR 146 Ca 0.22 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.09 1s57 h TYR 146 Cb -0.08 0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.27 1s57 h TYR 146 CO -0.03 -0.05 0.00 0.97 -1.64 0.00 0.00 178.16 177.42 1s57 h ILE 147 N -0.41 0.00 -0.27 1.81 6.09 -1.12 -2.01 117.51 121.60 1s57 h ILE 147 Ca -0.03 -0.29 0.00 0.00 -1.37 0.00 0.00 64.86 63.18 1s57 h ILE 147 Cb 0.31 1.29 0.00 0.00 0.47 0.00 0.00 36.82 38.89 1s57 h ILE 147 CO 0.04 0.00 0.00 0.35 -3.07 0.00 0.00 178.15 175.47 1s57 n THR 148 N -3.09 0.65 0.96 2.19 -2.24 -0.81 -4.56 114.28 107.38 1s57 n THR 148 Ca -0.01 -0.82 0.10 0.00 -2.27 0.00 0.00 64.05 61.05 1s57 n THR 148 Cb 0.20 0.77 0.51 0.00 -2.10 0.00 0.00 70.33 69.72 1s57 n THR 148 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1s57 n SER 149 N 0.72 0.00 -3.62 3.42 3.41 -0.07 -4.85 113.62 112.62 1s57 n SER 149 Ca 0.12 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.74 1s57 n SER 149 Cb 0.41 -0.29 -0.00 0.00 -0.26 0.00 0.00 64.21 64.07 1s57 n SER 149 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1s57 s GLY 150 N -2.58 -0.41 0.62 5.00 0.00 -1.26 -5.09 107.32 103.61 1s57 s GLY 150 Ca 0.19 0.68 -0.17 0.00 0.00 0.00 0.00 44.72 45.42 1s57 s GLY 150 CO 0.31 0.27 1.15 2.56 0.00 0.00 0.00 173.10 177.40 1s57 s PRO 151 N -2.41 2.88 0.40 2.90 0.04 -1.26 -4.66 135.00 132.90 1s57 s PRO 151 Ca 0.15 1.60 0.07 0.00 0.04 0.00 0.00 61.00 62.86 1s57 s PRO 151 Cb 0.05 -1.94 -0.07 0.00 0.04 0.00 0.00 34.50 32.58 1s57 s PRO 151 CO -0.04 -1.22 0.08 0.14 0.04 0.00 0.00 177.00 176.00 1s57 s VAL 152 N -1.97 2.19 -0.23 -0.36 -7.23 0.41 -4.08 120.40 109.13 1s57 s VAL 152 Ca 0.72 -1.87 0.02 0.00 -1.81 0.00 0.00 61.98 59.04 1s57 s VAL 152 Cb -0.25 -2.97 0.05 0.00 0.56 0.00 0.00 36.38 33.76 1s57 s VAL 152 CO 0.36 -0.02 -0.13 -0.69 -0.31 0.00 0.00 175.10 174.31 1s57 s VAL 153 N -2.64 2.05 0.10 1.32 1.01 -0.77 -0.20 120.40 121.27 1s57 s VAL 153 Ca 0.38 -1.34 -0.22 0.00 0.00 0.00 0.00 61.98 60.80 1s57 s VAL 153 Cb 0.06 -2.07 -0.07 0.00 0.00 0.00 0.00 36.38 34.30 1s57 s VAL 153 CO 0.20 0.16 0.66 0.00 0.00 0.00 0.00 175.10 176.12 1s57 s MET 155 N -1.03 0.39 -0.08 0.00 -1.94 0.55 -1.55 119.30 115.64 1s57 s MET 155 Ca 0.32 -0.43 0.02 0.00 -1.71 0.00 0.00 55.69 53.89 1s57 s MET 155 Cb -0.21 0.16 0.02 0.00 2.01 0.00 0.00 34.83 36.80 1s57 s MET 155 CO 0.22 -0.08 -0.12 0.00 -0.01 0.00 0.00 175.02 175.03 1s57 s ALA 156 N -1.29 1.33 0.03 3.03 0.00 -0.17 -1.16 121.76 123.54 1s57 s ALA 156 Ca -0.14 -0.48 0.07 0.00 0.00 0.00 0.00 51.96 51.41 1s57 s ALA 156 Cb -0.08 -0.67 -0.02 0.00 0.00 0.00 0.00 23.12 22.34 1s57 s ALA 156 CO 0.01 -0.02 -0.22 -1.58 0.00 0.00 0.00 175.76 173.95 1s57 s TRP 157 N 0.92 1.91 0.09 0.00 0.52 -0.62 -1.01 118.94 120.75 1s57 s TRP 157 Ca -0.10 -0.38 0.08 0.00 0.02 0.00 0.00 56.10 55.73 1s57 s TRP 157 Cb -0.15 -1.16 -0.04 0.00 -1.15 0.00 0.00 33.47 30.97 1s57 s TRP 157 CO 0.01 0.07 -0.18 -2.00 0.02 0.00 0.00 176.95 174.86 1s57 s GLU 158 N -1.03 1.87 0.00 4.98 2.12 0.10 -0.80 118.70 125.94 1s57 s GLU 158 Ca 0.08 -1.12 0.00 0.00 0.36 0.00 0.00 54.97 54.29 1s57 s GLU 158 Cb -0.09 -2.13 0.00 0.00 0.26 0.00 0.00 34.13 32.17 1s57 s GLU 158 CO 0.01 0.50 0.00 0.41 -0.54 0.00 0.00 175.26 175.64 1s57 n GLY 159 N 1.07 3.87 3.70 -1.50 0.00 -0.26 -1.62 105.19 110.44 1s57 n GLY 159 Ca -0.16 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.66 1s57 n GLY 159 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s57 s VAL 160 N -2.00 3.27 -0.13 1.61 0.11 -1.26 -1.92 120.40 120.09 1s57 s VAL 160 Ca 0.00 0.79 0.00 0.00 -2.93 0.00 0.00 61.98 59.84 1s57 s VAL 160 Cb 0.00 -3.51 0.00 0.00 -1.53 0.00 0.00 36.38 31.34 1s57 s VAL 160 CO 0.00 0.02 0.00 0.61 -3.33 0.00 0.00 175.10 172.40 1s57 n GLY 161 N 3.72 0.43 0.32 6.54 0.00 -1.26 -4.91 105.19 110.04 1s57 n GLY 161 Ca 0.14 -0.12 0.04 0.00 0.00 0.00 0.00 46.02 46.08 1s57 n GLY 161 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1s57 h VAL 162 N 0.00 1.09 0.59 1.61 3.04 -1.70 -1.72 116.25 119.16 1s57 h VAL 162 Ca -0.02 -0.22 -0.03 0.00 -1.01 0.00 0.00 66.70 65.42 1s57 h VAL 162 Cb 0.36 0.39 0.01 0.00 -2.01 0.00 0.00 31.29 30.04 1s57 h VAL 162 CO 0.04 0.12 -0.28 0.58 -1.01 0.00 0.00 177.57 177.01 1s57 h VAL 163 N 0.64 0.40 -0.73 1.51 2.07 -1.86 0.63 116.25 118.90 1s57 h VAL 163 Ca 0.20 -0.11 -0.06 0.00 0.82 0.00 0.00 66.70 67.55 1s57 h VAL 163 Cb 0.03 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.21 1s57 h VAL 163 CO -0.05 0.02 0.23 0.00 0.02 0.00 0.00 177.57 177.78 1s57 h ALA 164 N -0.48 1.01 -0.46 1.67 0.00 -1.87 -2.46 119.26 116.67 1s57 h ALA 164 Ca -0.08 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.56 1s57 h ALA 164 Cb 0.63 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1s57 h ALA 164 CO 0.13 0.66 0.10 1.03 0.00 0.00 0.00 179.25 181.18 1s57 h SER 165 N 1.09 0.71 -0.61 0.00 0.87 -1.25 -1.70 113.55 112.66 1s57 h SER 165 Ca 0.24 -0.24 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 1s57 h SER 165 Cb 0.31 -0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.05 1s57 h SER 165 CO -0.01 0.76 0.35 0.00 -0.53 0.00 0.00 176.83 177.41 1s57 h ALA 166 N 0.97 0.77 -1.00 6.23 0.00 -0.75 0.31 119.26 125.80 1s57 h ALA 166 Ca 0.14 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1s57 h ALA 166 Cb 0.34 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 1s57 h ALA 166 CO 0.00 0.27 0.65 0.00 0.00 0.00 0.00 179.25 180.17 1s57 h ARG 167 N 0.82 1.20 -0.26 0.00 2.47 -1.22 -0.17 114.38 117.22 1s57 h ARG 167 Ca 0.22 -0.07 -0.07 0.00 -1.26 0.00 0.00 59.98 58.79 1s57 h ARG 167 Cb 0.00 -0.27 -0.01 0.00 -1.65 0.00 0.00 29.97 28.04 1s57 h ARG 167 CO -0.04 0.80 -0.11 -0.22 0.56 0.00 0.00 179.97 180.96 1s57 h LYS 168 N 1.24 0.53 -0.10 0.04 3.64 -0.51 -2.02 116.57 119.39 1s57 h LYS 168 Ca 0.40 -0.23 -0.06 0.00 -1.27 0.00 0.00 60.65 59.50 1s57 h LYS 168 Cb 0.04 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1s57 h LYS 168 CO -0.13 0.78 -0.20 -0.07 -2.27 0.00 0.00 179.45 177.55 1s57 h LEU 169 N 0.27 0.16 -0.09 5.20 3.38 -0.44 -2.95 115.31 120.84 1s57 h LEU 169 Ca 0.06 -0.04 -0.23 0.00 0.09 0.00 0.00 57.88 57.76 1s57 h LEU 169 Cb 0.61 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.33 1s57 h LEU 169 CO 0.03 0.38 -0.84 0.40 0.09 0.00 0.00 178.44 178.51 1s57 h ILE 170 N 0.16 1.29 0.00 1.22 2.04 -0.96 0.49 117.51 121.75 1s57 h ILE 170 Ca 0.03 -2.06 0.00 0.00 1.00 0.00 0.00 64.86 63.83 1s57 h ILE 170 Cb 0.45 2.18 0.00 0.00 -0.74 0.00 0.00 36.82 38.71 1s57 h ILE 170 CO 0.03 0.64 0.00 0.61 0.00 0.00 0.00 178.15 179.43 1s57 n GLY 171 N 0.86 0.31 3.67 5.37 0.00 -0.77 -1.40 105.19 113.23 1s57 n GLY 171 Ca -0.09 -1.90 -0.36 0.00 0.00 0.00 0.00 46.02 43.67 1s57 n GLY 171 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1s57 n LYS 172 N 0.47 0.81 -0.27 1.61 5.02 -1.26 -4.91 118.16 119.62 1s57 n LYS 172 Ca 0.00 0.33 0.07 0.00 -2.02 0.00 0.00 58.31 56.69 1s57 n LYS 172 Cb 0.00 -2.35 0.22 0.00 -0.02 0.00 0.00 35.03 32.88 1s57 n LYS 172 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1s57 h THR 173 N 0.17 0.64 -3.55 -0.18 2.02 -1.98 -3.36 112.91 106.66 1s57 h THR 173 Ca -0.49 -0.16 -0.62 0.00 0.77 0.00 0.00 66.41 65.91 1s57 h THR 173 Cb 1.34 0.12 -0.12 0.00 -1.74 0.00 0.00 68.15 67.75 1s57 h THR 173 CO 0.50 0.09 0.34 -0.62 0.37 0.00 0.00 175.52 176.20 1s57 s ASP 174 N -5.33 6.51 0.57 4.18 -1.08 -1.26 -4.54 116.67 115.71 1s57 s ASP 174 Ca -0.12 0.23 0.27 0.00 -0.52 0.00 0.00 52.55 52.41 1s57 s ASP 174 Cb 0.22 -2.38 1.54 0.00 -1.46 0.00 0.00 42.92 40.83 1s57 s ASP 174 CO 0.77 -0.75 2.06 -0.65 0.52 0.00 0.00 175.17 177.12 1s57 h PRO 175 N 8.57 0.00 -0.06 4.34 0.11 -1.82 0.21 132.00 143.35 1s57 h PRO 175 Ca -0.25 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.75 1s57 h PRO 175 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1s57 h PRO 175 CO 0.91 0.00 -0.45 -0.07 -0.21 0.00 0.00 178.00 178.18 1s57 h LEU 176 N 0.00 0.16 0.00 2.35 3.38 -1.81 -3.15 115.31 116.25 1s57 h LEU 176 Ca 0.13 -0.07 -0.27 0.00 0.09 0.00 0.00 57.88 57.76 1s57 h LEU 176 Cb 0.63 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 41.29 1s57 h LEU 176 CO -0.00 0.60 -1.63 1.56 0.09 0.00 0.00 178.44 179.06 1s57 h GLN 177 N 0.12 0.00 -6.66 1.13 1.08 -1.45 -3.47 115.11 105.86 1s57 h GLN 177 Ca 0.01 0.00 -0.58 0.00 -1.45 0.00 0.00 58.65 56.63 1s57 h GLN 177 Cb 0.85 0.00 0.10 0.00 -0.05 0.00 0.00 27.48 28.39 1s57 h GLN 177 CO 0.07 0.50 0.50 0.00 -0.95 0.00 0.00 178.83 178.95 1s57 n ALA 178 N -2.52 1.05 -1.79 3.87 0.00 -0.11 -4.88 120.51 116.13 1s57 n ALA 178 Ca -0.15 0.38 -0.35 0.00 0.00 0.00 0.00 53.44 53.32 1s57 n ALA 178 Cb 1.02 -2.23 -0.04 0.00 0.00 0.00 0.00 19.45 18.20 1s57 n ALA 178 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1s57 s GLU 179 N -1.36 3.99 0.38 0.00 0.41 -1.26 -4.39 118.70 116.46 1s57 s GLU 179 Ca 0.60 1.44 -0.28 0.00 -0.41 0.00 0.00 54.97 56.32 1s57 s GLU 179 Cb -0.61 -2.32 -0.11 0.00 -1.78 0.00 0.00 34.13 29.31 1s57 s GLU 179 CO 0.58 -0.28 1.49 -2.14 -0.49 0.00 0.00 175.26 174.42 1s57 s PRO 180 N -2.86 4.08 0.00 0.39 0.02 -1.26 -1.86 135.00 133.51 1s57 s PRO 180 Ca 0.62 2.59 0.00 0.00 0.02 0.00 0.00 61.00 64.23 1s57 s PRO 180 Cb -0.19 -2.95 0.00 0.00 0.02 0.00 0.00 34.50 31.38 1s57 s PRO 180 CO 0.24 -0.56 0.00 0.41 -0.33 0.00 0.00 177.00 176.75 1s57 n GLY 181 N 0.44 1.71 3.92 0.52 0.00 -1.26 -4.97 105.19 105.56 1s57 n GLY 181 Ca 0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.77 1s57 n GLY 181 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1s57 s THR 182 N -1.95 4.57 0.10 2.61 -4.23 -0.78 -4.92 115.64 111.05 1s57 s THR 182 Ca 0.00 -0.08 -0.26 0.00 -1.18 0.00 0.00 61.69 60.18 1s57 s THR 182 Cb 0.00 -3.73 -0.12 0.00 1.34 0.00 0.00 72.50 69.99 1s57 s THR 182 CO 0.00 -0.64 1.68 0.40 -0.54 0.00 0.00 174.62 175.52 1s57 h ILE 183 N 0.28 0.68 -0.03 2.99 2.04 -0.85 0.16 117.51 122.78 1s57 h ILE 183 Ca -0.47 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.25 1s57 h ILE 183 Cb 1.22 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.97 1s57 h ILE 183 CO 0.61 0.00 -0.62 0.03 0.00 0.00 0.00 178.15 178.17 1s57 h ARG 184 N -0.31 0.12 -0.03 2.37 3.08 -1.50 0.84 114.38 118.95 1s57 h ARG 184 Ca 0.01 -0.09 -0.09 0.00 0.07 0.00 0.00 59.98 59.88 1s57 h ARG 184 Cb 0.30 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 1s57 h ARG 184 CO -0.04 0.70 -0.42 0.78 -1.07 0.00 0.00 179.97 179.93 1s57 h GLY 185 N 1.67 0.06 0.60 0.04 0.00 -1.66 -2.22 103.07 101.56 1s57 h GLY 185 Ca -0.01 -0.05 -0.33 0.00 0.00 0.00 0.00 47.33 46.94 1s57 h GLY 185 CO 0.09 0.05 -1.98 1.22 0.00 0.00 0.00 176.54 175.92 1s57 n ASP 186 N -4.04 0.70 -0.02 0.19 8.00 0.02 -4.55 116.55 116.86 1s57 n ASP 186 Ca -0.02 0.25 0.02 0.00 0.71 0.00 0.00 54.79 55.75 1s57 n ASP 186 Cb 0.45 0.23 0.02 0.00 -0.02 0.00 0.00 41.12 41.80 1s57 n ASP 186 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1s57 n LEU 187 N -2.98 1.97 -4.01 0.64 4.77 0.27 -5.06 117.00 112.60 1s57 n LEU 187 Ca -0.24 -2.10 -0.09 0.00 -0.03 0.00 0.00 56.01 53.55 1s57 n LEU 187 Cb 1.09 -0.07 -0.08 0.00 -2.33 0.00 0.00 43.42 42.02 1s57 n LEU 187 CO 0.44 0.51 -0.17 0.00 -1.33 0.00 0.00 177.39 176.84 1s57 s ALA 188 N -1.26 0.27 0.00 -1.18 0.00 -0.84 -4.97 121.76 113.78 1s57 s ALA 188 Ca 0.05 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 50.97 1s57 s ALA 188 Cb 0.05 0.67 0.00 0.00 0.00 0.00 0.00 23.12 23.84 1s57 s ALA 188 CO 0.00 -0.52 0.00 1.33 0.00 0.00 0.00 175.76 176.57 1s57 n VAL 189 N -0.09 0.00 -3.94 0.00 0.24 -1.26 -4.57 118.33 108.71 1s57 n VAL 189 Ca -0.10 -0.21 -0.11 0.00 -2.04 0.00 0.00 64.34 61.87 1s57 n VAL 189 Cb 0.63 0.78 -0.13 0.00 -1.47 0.00 0.00 33.84 33.65 1s57 n VAL 189 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1s57 s GLN 190 N -0.83 0.17 0.27 7.34 0.74 -1.26 -4.28 119.66 121.81 1s57 s GLN 190 Ca 0.00 -0.26 -0.02 0.00 0.05 0.00 0.00 55.36 55.13 1s57 s GLN 190 Cb 0.00 -0.01 0.44 0.00 1.10 0.00 0.00 33.01 34.54 1s57 s GLN 190 CO 0.00 -0.01 1.88 1.15 -0.55 0.00 0.00 175.29 177.76 1s57 h THR 191 N 4.94 1.06 0.00 -0.34 2.02 -1.94 -1.27 112.91 117.38 1s57 h THR 191 Ca -0.28 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.51 1s57 h THR 191 Cb 1.21 -0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 1s57 h THR 191 CO 0.47 0.21 0.00 0.61 0.37 0.00 0.00 175.52 177.18 1s57 n GLY 192 N -1.36 -0.83 2.40 2.16 0.00 -1.26 -3.13 105.19 103.16 1s57 n GLY 192 Ca 0.16 -0.10 -0.14 0.00 0.00 0.00 0.00 46.02 45.94 1s57 n GLY 192 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s57 n ARG 193 N -1.20 1.02 -1.02 1.61 5.12 -0.51 -4.98 116.66 116.70 1s57 n ARG 193 Ca 0.11 -2.98 -0.21 0.00 -1.93 0.00 0.00 57.85 52.84 1s57 n ARG 193 Cb 0.13 -1.41 0.12 0.00 -1.16 0.00 0.00 32.46 30.15 1s57 n ARG 193 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1s57 n ASN 194 N 0.19 4.44 0.00 0.55 6.94 -1.00 -4.40 115.26 121.98 1s57 n ASN 194 Ca 0.17 -3.33 0.00 0.00 -0.02 0.00 0.00 54.58 51.40 1s57 n ASN 194 Cb 0.70 -0.83 0.00 0.00 -2.36 0.00 0.00 39.78 37.30 1s57 n ASN 194 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 1s57 n ILE 195 N -0.72 0.00 -3.68 1.53 -5.35 -1.26 -4.76 119.36 105.11 1s57 n ILE 195 Ca 0.48 0.00 -0.11 0.00 -0.27 0.00 0.00 62.75 62.85 1s57 n ILE 195 Cb 1.25 0.00 -0.06 0.00 -1.74 0.00 0.00 39.64 39.09 1s57 n ILE 195 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1s57 s VAL 196 N 0.00 0.07 0.04 7.28 0.11 -1.26 -0.71 120.40 125.93 1s57 s VAL 196 Ca 0.00 -0.59 0.04 0.00 -2.93 0.00 0.00 61.98 58.50 1s57 s VAL 196 Cb 0.00 -1.06 -0.02 0.00 -1.53 0.00 0.00 36.38 33.77 1s57 s VAL 196 CO 0.00 -0.32 -0.11 -2.28 -3.33 0.00 0.00 175.10 169.05 1s57 s HIS 197 N -3.09 1.00 0.00 1.54 2.46 0.15 -4.91 115.29 112.45 1s57 s HIS 197 Ca -0.01 -0.38 0.00 0.00 0.47 0.00 0.00 55.06 55.14 1s57 s HIS 197 Cb 0.01 -0.59 -0.00 0.00 -0.13 0.00 0.00 32.58 31.86 1s57 s HIS 197 CO -0.07 0.00 -0.02 0.20 -2.47 0.00 0.00 174.74 172.39 1s57 s GLY 198 N -1.23 0.09 0.34 1.59 0.00 -1.26 -1.07 107.32 105.78 1s57 s GLY 198 Ca -0.02 -0.10 -0.27 0.00 0.00 0.00 0.00 44.72 44.32 1s57 s GLY 198 CO 0.01 -0.10 1.20 1.44 0.00 0.00 0.00 173.10 175.66 1s57 n SER 199 N 2.94 2.31 -0.35 1.64 7.64 -0.55 -4.89 113.62 122.35 1s57 n SER 199 Ca -0.13 1.18 0.13 0.00 1.01 0.00 0.00 58.87 61.06 1s57 n SER 199 Cb 0.59 -1.43 0.41 0.00 -1.01 0.00 0.00 64.21 62.77 1s57 n SER 199 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1s57 n ASP 200 N 0.79 1.27 -3.50 6.43 5.75 -1.26 -4.75 116.55 121.28 1s57 n ASP 200 Ca 0.06 -1.15 -0.11 0.00 -0.01 0.00 0.00 54.79 53.57 1s57 n ASP 200 Cb 0.36 0.09 -0.03 0.00 -1.03 0.00 0.00 41.12 40.51 1s57 n ASP 200 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1s57 s SER 201 N -2.31 -0.47 0.41 -1.12 1.04 -1.26 -4.98 113.70 105.01 1s57 s SER 201 Ca 0.29 0.19 0.10 0.00 0.48 0.00 0.00 55.95 57.02 1s57 s SER 201 Cb 0.20 0.46 0.91 0.00 0.10 0.00 0.00 66.02 67.68 1s57 s SER 201 CO 0.45 -0.67 2.00 1.55 0.98 0.00 0.00 173.24 177.55 1s57 h PRO 202 N 2.27 0.52 -0.32 4.02 0.13 -1.91 0.26 132.00 136.97 1s57 h PRO 202 Ca -0.26 -0.03 -0.05 0.00 -0.87 0.00 0.00 66.00 64.79 1s57 h PRO 202 Cb 1.23 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 1s57 h PRO 202 CO 0.34 0.34 -0.01 1.05 -0.23 0.00 0.00 178.00 179.50 1s57 h GLU 203 N 0.53 0.57 0.00 0.86 4.11 -1.96 -1.40 114.58 117.30 1s57 h GLU 203 Ca 0.24 -0.19 -0.04 0.00 0.07 0.00 0.00 59.36 59.44 1s57 h GLU 203 Cb 0.28 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1s57 h GLU 203 CO -0.07 0.71 -0.21 -0.91 0.07 0.00 0.00 179.01 178.60 1s57 h ASN 204 N 0.37 0.00 -0.16 3.06 -0.26 -1.76 -0.95 115.58 115.88 1s57 h ASN 204 Ca 0.09 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.81 1s57 h ASN 204 Cb 0.46 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.71 1s57 h ASN 204 CO 0.02 0.21 0.04 1.23 -1.06 0.00 0.00 177.43 177.87 1s57 h GLY 205 N 1.73 0.28 1.00 2.83 0.00 0.19 0.15 103.07 109.26 1s57 h GLY 205 Ca -0.00 -0.17 -0.09 0.00 0.00 0.00 0.00 47.33 47.06 1s57 h GLY 205 CO 0.03 0.16 -0.10 0.50 0.00 0.00 0.00 176.54 177.13 1s57 h LYS 206 N 0.07 0.82 -0.05 4.80 1.57 -0.93 -1.93 116.57 120.93 1s57 h LYS 206 Ca 0.05 -0.31 0.01 0.00 -1.87 0.00 0.00 60.65 58.53 1s57 h LYS 206 Cb 0.25 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 1s57 h LYS 206 CO 0.00 0.94 -0.03 -0.09 -0.57 0.00 0.00 179.45 179.70 1s57 h ARG 207 N 0.64 -0.02 -0.47 3.15 2.43 -1.03 -1.31 114.38 117.77 1s57 h ARG 207 Ca 0.11 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.20 1s57 h ARG 207 Cb 0.63 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.17 1s57 h ARG 207 CO 0.04 -0.02 -0.02 0.93 -1.51 0.00 0.00 179.97 179.40 1s57 h GLU 208 N -0.02 0.85 -0.86 0.20 5.08 -0.68 -1.24 114.58 117.90 1s57 h GLU 208 Ca 0.03 -0.28 -0.02 0.00 -1.00 0.00 0.00 59.36 58.09 1s57 h GLU 208 Cb 0.07 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 1s57 h GLU 208 CO -0.07 0.90 0.45 0.82 -1.00 0.00 0.00 179.01 180.12 1s57 h ILE 209 N 0.70 1.26 0.00 3.13 2.04 -1.26 0.10 117.51 123.48 1s57 h ILE 209 Ca 0.13 -0.67 -0.07 0.00 1.00 0.00 0.00 64.86 65.25 1s57 h ILE 209 Cb 0.53 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 1s57 h ILE 209 CO 0.03 0.30 -0.34 1.23 0.00 0.00 0.00 178.15 179.37 1s57 h GLY 210 N 1.22 0.00 0.27 5.37 0.00 -0.97 -1.16 103.07 107.80 1s57 h GLY 210 Ca 0.30 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.50 1s57 h GLY 210 CO -0.04 0.00 -0.65 -2.00 0.00 0.00 0.00 176.54 173.84 1s57 h LEU 211 N 0.00 0.18 0.06 3.11 5.85 -0.53 -3.39 115.31 120.59 1s57 h LEU 211 Ca -0.00 -0.88 -0.24 0.00 0.84 0.00 0.00 57.88 57.59 1s57 h LEU 211 Cb 0.68 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.63 1s57 h LEU 211 CO 0.04 1.28 -1.13 -0.50 -0.34 0.00 0.00 178.44 177.80 1s57 h TRP 212 N -0.72 0.22 -2.33 1.25 4.06 -1.05 -3.46 115.95 113.91 1s57 h TRP 212 Ca -0.14 -0.16 -0.51 0.00 2.06 0.00 0.00 58.89 60.14 1s57 h TRP 212 Cb 1.34 -0.01 -0.04 0.00 -1.00 0.00 0.00 29.16 29.45 1s57 h TRP 212 CO 0.20 1.13 -0.51 -0.06 -3.56 0.00 0.00 178.44 175.64 1s57 s PHE 213 N -2.68 3.21 -0.23 0.49 0.40 -0.44 -5.09 117.98 113.64 1s57 s PHE 213 Ca -0.01 -0.06 -0.08 0.00 -0.60 0.00 0.00 56.93 56.18 1s57 s PHE 213 Cb 0.09 -1.48 -0.03 0.00 0.51 0.00 0.00 43.02 42.10 1s57 s PHE 213 CO 0.85 0.50 0.08 0.15 0.70 0.00 0.00 175.22 177.50 1s57 s LYS 214 N -3.67 3.78 0.10 0.44 1.02 -1.26 -4.65 119.74 115.49 1s57 s LYS 214 Ca 0.33 -0.42 -0.05 0.00 0.02 0.00 0.00 55.97 55.84 1s57 s LYS 214 Cb -0.09 -3.32 0.13 0.00 -0.52 0.00 0.00 37.83 34.04 1s57 s LYS 214 CO 0.26 -0.04 0.60 -1.91 -0.92 0.00 0.00 175.35 173.34 1s57 n GLU 215 N 4.49 -0.06 0.00 1.68 4.07 -1.26 0.14 120.64 129.70 1s57 n GLU 215 Ca -0.16 0.60 0.02 0.00 -0.06 0.00 0.00 57.16 57.56 1s57 n GLU 215 Cb 0.52 -0.89 0.11 0.00 -0.06 0.00 0.00 31.44 31.12 1s57 n GLU 215 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1s57 n GLY 216 N -1.21 -0.55 0.14 8.31 0.00 -1.26 -2.37 105.19 108.25 1s57 n GLY 216 Ca 0.05 -0.02 0.03 0.00 0.00 0.00 0.00 46.02 46.08 1s57 n GLY 216 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1s57 h GLU 217 N 0.00 0.00 -6.94 1.61 5.08 0.84 -3.45 114.58 111.72 1s57 h GLU 217 Ca 0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.87 1s57 h GLU 217 Cb 0.06 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.33 1s57 h GLU 217 CO 0.00 0.46 0.42 -0.51 -1.00 0.00 0.00 179.01 178.38 1s57 s LEU 218 N -6.40 4.21 -0.09 1.33 1.02 -1.00 -4.72 118.68 113.02 1s57 s LEU 218 Ca 0.04 2.08 0.04 0.00 0.02 0.00 0.00 54.13 56.30 1s57 s LEU 218 Cb 0.07 -4.09 0.00 0.00 0.02 0.00 0.00 46.19 42.19 1s57 s LEU 218 CO 0.75 -0.44 -0.22 0.00 0.02 0.00 0.00 176.35 176.45 1s57 s LYS 220 N 0.38 3.47 0.06 0.00 -0.14 -1.26 -4.60 119.74 117.66 1s57 s LYS 220 Ca -0.18 -0.20 -0.26 0.00 -1.36 0.00 0.00 55.97 53.96 1s57 s LYS 220 Cb -0.18 -3.13 0.08 0.00 -1.68 0.00 0.00 37.83 32.93 1s57 s LYS 220 CO 0.08 0.70 0.73 1.67 -0.76 0.00 0.00 175.35 177.78 1s57 s TRP 221 N -1.22 -0.48 -0.34 3.18 1.48 -1.26 -5.14 118.94 115.16 1s57 s TRP 221 Ca 0.23 0.38 -0.12 0.00 -1.06 0.00 0.00 56.10 55.54 1s57 s TRP 221 Cb -0.13 0.53 -0.01 0.00 -1.16 0.00 0.00 33.47 32.71 1s57 s TRP 221 CO 0.13 -0.69 0.22 -0.51 -4.06 0.00 0.00 176.95 172.04 1s57 s ASP 222 N -2.42 5.91 0.01 -2.66 1.01 -1.26 -5.06 116.67 112.21 1s57 s ASP 222 Ca 0.01 -0.54 -0.30 0.00 0.71 0.00 0.00 52.55 52.43 1s57 s ASP 222 Cb -0.01 -2.10 -0.05 0.00 1.01 0.00 0.00 42.92 41.78 1s57 s ASP 222 CO -0.09 -0.26 1.22 -0.55 0.21 0.00 0.00 175.17 175.71 1s57 s SER 223 N 1.68 7.04 0.47 0.27 0.15 -1.26 -4.93 113.70 117.12 1s57 s SER 223 Ca 0.05 1.95 0.13 0.00 0.70 0.00 0.00 55.95 58.78 1s57 s SER 223 Cb -0.18 -2.57 1.09 0.00 -1.71 0.00 0.00 66.02 62.65 1s57 s SER 223 CO 0.09 -0.54 2.09 0.00 1.20 0.00 0.00 173.24 176.08 1s57 h ALA 224 N 7.16 1.85 -0.29 5.45 0.00 -2.06 -2.17 119.26 129.19 1s57 h ALA 224 Ca -0.38 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1s57 h ALA 224 Cb 1.19 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1s57 h ALA 224 CO 0.85 0.13 0.00 1.28 0.00 0.00 0.00 179.25 181.50 1s57 n LEU 225 N -4.48 2.09 -0.25 0.00 4.77 -1.26 -4.51 117.00 113.36 1s57 n LEU 225 Ca -0.01 -0.95 0.02 0.00 -0.03 0.00 0.00 56.01 55.04 1s57 n LEU 225 Cb 0.11 -0.19 0.10 0.00 -2.33 0.00 0.00 43.42 41.11 1s57 n LEU 225 CO 0.35 0.48 0.75 0.00 -1.33 0.00 0.00 177.39 177.64 1s57 h ALA 226 N 3.99 0.56 0.00 -1.18 0.00 -1.79 0.25 119.26 121.10 1s57 h ALA 226 Ca 0.00 0.26 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1s57 h ALA 226 Cb 0.57 0.50 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1s57 h ALA 226 CO 0.00 -0.42 -0.03 1.15 0.00 0.00 0.00 179.25 179.95 1s57 h THR 227 N 0.03 0.28 -0.01 0.00 2.02 -1.79 -1.83 112.91 111.62 1s57 h THR 227 Ca 0.36 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.37 1s57 h THR 227 Cb 0.58 1.13 0.00 0.00 -1.74 0.00 0.00 68.15 68.12 1s57 h THR 227 CO -0.70 0.03 -0.53 0.79 0.37 0.00 0.00 175.52 175.48 1s57 n TRP 228 N -3.43 0.00 -0.09 3.16 7.02 0.83 -4.15 117.44 120.77 1s57 n TRP 228 Ca -0.02 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.37 1s57 n TRP 228 Cb 0.13 -0.06 -0.16 0.00 -2.42 0.00 0.00 31.31 28.80 1s57 n TRP 228 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 1s57 n LEU 229 N -0.65 0.00 -3.77 -0.99 7.99 -0.76 -4.98 117.00 113.84 1s57 n LEU 229 Ca 0.09 0.00 -0.13 0.00 -0.01 0.00 0.00 56.01 55.96 1s57 n LEU 229 Cb 0.39 0.46 -0.12 0.00 -0.11 0.00 0.00 43.42 44.04 1s57 n LEU 229 CO 0.31 0.46 -0.11 -0.13 -1.51 0.00 0.00 177.39 176.41 1s57 s ARG 230 N -2.56 0.25 0.00 3.23 0.52 -0.78 -5.11 118.95 114.49 1s57 s ARG 230 Ca -0.10 0.39 0.30 0.00 -0.52 0.00 0.00 55.73 55.80 1s57 s ARG 230 Cb 0.07 0.05 1.78 0.00 0.52 0.00 0.00 34.95 37.36 1s57 s ARG 230 CO 0.83 -0.08 2.11 -0.85 0.02 0.00 0.00 175.30 177.34