#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 2.27 -4.21 5.55 2.13 -1.26 -4.78 120.64 120.34 1s57 n GLU 84 Ca 0.00 0.80 -0.18 0.00 0.66 0.00 0.00 57.16 58.44 1s57 n GLU 84 Cb 0.00 -2.44 -0.12 0.00 0.27 0.00 0.00 31.44 29.16 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 -1.60 0.93 0.03 5.31 2.02 -1.26 -0.85 118.70 123.28 1s57 s GLU 85 Ca 0.57 -1.11 -0.02 0.00 0.02 0.00 0.00 54.97 54.44 1s57 s GLU 85 Cb -0.55 -0.88 -0.02 0.00 0.10 0.00 0.00 34.13 32.78 1s57 s GLU 85 CO 0.60 0.18 0.00 -0.08 0.02 0.00 0.00 175.26 175.98 1s57 s THR 86 N -1.73 0.15 -0.24 3.63 -1.32 0.22 -4.55 115.64 111.80 1s57 s THR 86 Ca 0.04 -1.24 -0.11 0.00 -1.21 0.00 0.00 61.69 59.17 1s57 s THR 86 Cb -0.07 -0.81 -0.05 0.00 -1.51 0.00 0.00 72.50 70.06 1s57 s THR 86 CO 0.03 -0.68 0.19 -0.47 -2.21 0.00 0.00 174.62 171.47 1s57 s TYR 87 N -2.51 3.32 -0.06 9.09 5.04 -1.26 -1.31 117.35 129.66 1s57 s TYR 87 Ca -0.06 0.27 0.04 0.00 -2.44 0.00 0.00 57.07 54.88 1s57 s TYR 87 Cb -0.02 -2.30 0.00 0.00 0.35 0.00 0.00 41.96 39.99 1s57 s TYR 87 CO -0.05 0.05 -0.18 0.42 -1.34 0.00 0.00 175.55 174.45 1s57 s ILE 88 N 1.11 1.55 -0.05 3.14 1.01 -0.52 -1.36 121.20 126.09 1s57 s ILE 88 Ca 0.09 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 59.99 1s57 s ILE 88 Cb -0.14 -1.35 0.02 0.00 0.01 0.00 0.00 42.46 41.01 1s57 s ILE 88 CO 0.05 0.45 -0.04 -0.32 0.00 0.00 0.00 174.94 175.08 1s57 s MET 89 N 0.22 0.83 -0.11 2.79 1.75 -0.15 -0.28 119.30 124.35 1s57 s MET 89 Ca -0.09 -0.08 -0.27 0.00 -1.25 0.00 0.00 55.69 53.99 1s57 s MET 89 Cb -0.14 -0.88 -0.02 0.00 2.84 0.00 0.00 34.83 36.63 1s57 s MET 89 CO 0.04 -0.11 0.89 0.08 -0.65 0.00 0.00 175.02 175.26 1s57 s VAL 90 N 1.07 4.88 0.77 10.11 1.01 -0.47 -0.72 120.40 137.05 1s57 s VAL 90 Ca -0.09 1.80 -0.12 0.00 0.00 0.00 0.00 61.98 63.57 1s57 s VAL 90 Cb -0.14 -4.20 0.05 0.00 0.00 0.00 0.00 36.38 32.09 1s57 s VAL 90 CO -0.01 0.08 1.11 -0.54 0.00 0.00 0.00 175.10 175.74 1s57 s LYS 91 N 1.71 2.32 0.35 2.72 1.02 0.32 -2.16 119.74 126.02 1s57 s LYS 91 Ca 0.43 0.44 0.15 0.00 0.02 0.00 0.00 55.97 57.01 1s57 s LYS 91 Cb -0.18 -1.96 1.06 0.00 -0.52 0.00 0.00 37.83 36.22 1s57 s LYS 91 CO 0.17 -1.41 1.70 -1.35 -0.92 0.00 0.00 175.35 173.55 1s57 h PRO 92 N -0.93 0.39 0.00 -1.68 0.11 -1.82 0.31 132.00 128.37 1s57 h PRO 92 Ca -0.46 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.57 1s57 h PRO 92 Cb 1.28 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1s57 h PRO 92 CO 0.63 0.26 -0.28 0.38 -0.21 0.00 0.00 178.00 178.77 1s57 h ASP 93 N 0.40 0.00 -0.23 -2.05 2.03 -1.89 -1.74 116.42 112.95 1s57 h ASP 93 Ca 0.69 0.00 -0.15 0.00 -0.73 0.00 0.00 57.03 56.83 1s57 h ASP 93 Cb 1.57 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 40.07 1s57 h ASP 93 CO -0.49 0.28 -0.42 1.23 -1.03 0.00 0.00 179.24 178.82 1s57 h GLY 94 N 1.25 0.85 0.76 7.15 0.00 -0.58 -1.53 103.07 110.96 1s57 h GLY 94 Ca -0.00 -0.88 -0.04 0.00 0.00 0.00 0.00 47.33 46.41 1s57 h GLY 94 CO 0.04 0.79 -0.06 -2.22 0.00 0.00 0.00 176.54 175.09 1s57 h ILE 95 N 0.63 1.30 -0.17 2.60 5.03 -1.25 -0.30 117.51 125.35 1s57 h ILE 95 Ca 0.05 -1.07 -0.02 0.00 -0.12 0.00 0.00 64.86 63.69 1s57 h ILE 95 Cb 0.98 1.69 -0.01 0.00 -3.03 0.00 0.00 36.82 36.45 1s57 h ILE 95 CO 0.09 0.32 0.02 1.56 -0.68 0.00 0.00 178.15 179.46 1s57 h GLN 96 N -0.00 0.24 -0.23 2.37 1.08 -1.28 -1.96 115.11 115.32 1s57 h GLN 96 Ca 0.04 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 1s57 h GLN 96 Cb 0.52 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.90 1s57 h GLN 96 CO 0.02 0.25 0.00 0.54 -0.95 0.00 0.00 178.83 178.69 1s57 n ARG 97 N -4.41 1.97 -3.27 1.46 1.74 -0.58 -4.96 116.66 108.61 1s57 n ARG 97 Ca -0.00 -1.46 -0.17 0.00 -0.77 0.00 0.00 57.85 55.45 1s57 n ARG 97 Cb 0.15 -1.43 0.07 0.00 -1.02 0.00 0.00 32.46 30.23 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 -0.22 0.74 -0.13 0.00 -0.74 -4.95 105.19 101.14 1s57 n GLY 98 Ca 0.17 0.03 0.07 0.00 0.00 0.00 0.00 46.02 46.29 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 -3.81 2.90 0.19 0.99 4.77 -0.16 -4.69 117.00 117.19 1s57 n LEU 99 Ca -0.10 -1.72 -0.15 0.00 -0.03 0.00 0.00 56.01 54.01 1s57 n LEU 99 Cb 0.59 -0.21 -0.07 0.00 -2.33 0.00 0.00 43.42 41.39 1s57 n LEU 99 CO 0.50 0.68 0.65 0.58 -1.33 0.00 0.00 177.39 178.47 1s57 h VAL 100 N 2.63 0.32 -0.56 4.08 2.07 -1.90 -1.15 116.25 121.73 1s57 h VAL 100 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1s57 h VAL 100 Cb 0.74 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1s57 h VAL 100 CO 0.00 0.00 0.37 1.23 0.02 0.00 0.00 177.57 179.19 1s57 h GLY 101 N -0.66 0.79 0.92 2.17 0.00 -1.96 -1.68 103.07 102.66 1s57 h GLY 101 Ca -0.01 -0.30 0.02 0.00 0.00 0.00 0.00 47.33 47.04 1s57 h GLY 101 CO -0.08 0.29 0.46 -2.09 0.00 0.00 0.00 176.54 175.12 1s57 h GLU 102 N 0.76 0.89 -0.27 4.80 4.81 -1.82 -0.04 114.58 123.72 1s57 h GLU 102 Ca 0.21 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.32 1s57 h GLU 102 Cb -0.08 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.09 1s57 h GLU 102 CO -0.04 0.59 -0.06 0.82 -0.73 0.00 0.00 179.01 179.59 1s57 h ILE 103 N 0.92 1.28 -0.48 2.32 2.04 -0.97 -2.52 117.51 120.09 1s57 h ILE 103 Ca 0.28 -1.07 0.03 0.00 1.00 0.00 0.00 64.86 65.10 1s57 h ILE 103 Cb -0.03 1.43 -0.04 0.00 -0.74 0.00 0.00 36.82 37.44 1s57 h ILE 103 CO -0.09 0.34 0.27 0.40 0.00 0.00 0.00 178.15 179.07 1s57 h ILE 104 N 0.27 1.01 -0.81 -0.67 2.04 -0.97 -2.28 117.51 116.10 1s57 h ILE 104 Ca 0.07 -0.18 0.08 0.00 1.00 0.00 0.00 64.86 65.82 1s57 h ILE 104 Cb 0.53 0.44 -0.05 0.00 -0.74 0.00 0.00 36.82 36.99 1s57 h ILE 104 CO 0.03 0.10 0.53 0.28 0.00 0.00 0.00 178.15 179.08 1s57 h SER 105 N 0.53 0.74 -0.80 1.72 0.02 -0.87 -0.28 113.55 114.61 1s57 h SER 105 Ca 0.20 0.01 0.04 0.00 -0.84 0.00 0.00 61.79 61.20 1s57 h SER 105 Cb 0.06 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 62.40 1s57 h SER 105 CO -0.11 0.46 0.50 0.03 -1.14 0.00 0.00 176.83 176.57 1s57 h ARG 106 N 0.83 0.94 0.05 3.45 3.08 -0.96 0.31 114.38 122.08 1s57 h ARG 106 Ca 0.36 -0.06 -0.23 0.00 0.07 0.00 0.00 59.98 60.12 1s57 h ARG 106 Cb 0.31 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 1s57 h ARG 106 CO -0.13 0.62 -1.07 0.74 -1.07 0.00 0.00 179.97 179.06 1s57 h PHE 107 N 0.97 0.25 -0.03 3.04 0.04 -1.32 -2.36 116.94 117.52 1s57 h PHE 107 Ca 0.32 -0.17 -0.00 0.00 2.80 0.00 0.00 57.97 60.92 1s57 h PHE 107 Cb 0.04 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.18 1s57 h PHE 107 CO -0.03 1.10 0.01 0.93 -0.60 0.00 0.00 178.31 179.72 1s57 h GLU 108 N 0.05 0.05 -0.21 1.51 5.08 -0.60 -2.84 114.58 117.61 1s57 h GLU 108 Ca -0.06 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 1s57 h GLU 108 Cb 1.79 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 31.02 1s57 h GLU 108 CO 0.16 0.24 -0.05 0.87 -1.00 0.00 0.00 179.01 179.23 1s57 h LYS 109 N -0.15 0.32 -0.48 2.33 1.57 -0.46 -2.39 116.57 117.32 1s57 h LYS 109 Ca 0.01 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 1s57 h LYS 109 Cb 0.21 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 1s57 h LYS 109 CO -0.00 0.39 0.20 -0.22 -0.57 0.00 0.00 179.45 179.25 1s57 h LYS 110 N 0.31 0.68 0.00 3.15 1.63 -1.26 -3.47 116.57 117.62 1s57 h LYS 110 Ca 0.07 -0.09 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1s57 h LYS 110 Cb 0.29 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 31.79 1s57 h LYS 110 CO 0.01 0.56 0.00 0.41 -3.45 0.00 0.00 179.45 176.98 1s57 n GLY 111 N -1.15 1.25 3.90 5.01 0.00 -0.90 -5.10 105.19 108.21 1s57 n GLY 111 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 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 3.50 -0.25 1.61 0.08 -1.14 -5.04 117.98 114.74 1s57 s PHE 112 Ca 0.00 0.85 -0.11 0.00 0.12 0.00 0.00 56.93 57.80 1s57 s PHE 112 Cb 0.00 -2.48 -0.05 0.00 -0.57 0.00 0.00 43.02 39.92 1s57 s PHE 112 CO 0.00 -0.49 0.16 0.21 -0.10 0.00 0.00 175.22 175.01 1s57 s LYS 113 N -4.88 4.02 -0.26 0.44 2.20 -0.52 -4.67 119.74 116.07 1s57 s LYS 113 Ca 0.50 -0.29 -0.29 0.00 -0.36 0.00 0.00 55.97 55.53 1s57 s LYS 113 Cb -0.10 -3.56 0.01 0.00 -1.51 0.00 0.00 37.83 32.66 1s57 s LYS 113 CO 0.47 -0.01 1.05 -1.17 -0.36 0.00 0.00 175.35 175.33 1s57 s LEU 114 N 1.26 4.04 0.00 5.43 2.96 -1.26 -0.26 118.68 130.85 1s57 s LEU 114 Ca 0.07 1.27 0.00 0.00 -0.22 0.00 0.00 54.13 55.25 1s57 s LEU 114 Cb -0.14 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.01 1s57 s LEU 114 CO 0.06 -0.75 0.41 2.30 -1.32 0.00 0.00 176.35 177.05 1s57 n ILE 115 N 5.52 0.00 -3.67 6.68 -5.35 -0.38 -4.97 119.36 117.19 1s57 n ILE 115 Ca 0.12 -0.49 -0.11 0.00 -0.27 0.00 0.00 62.75 62.00 1s57 n ILE 115 Cb 0.46 1.01 -0.08 0.00 -1.74 0.00 0.00 39.64 39.29 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 -0.48 -0.25 3.28 0.00 -1.02 0.38 107.32 109.04 1s57 s GLY 116 Ca 0.00 1.90 -0.22 0.00 0.00 0.00 0.00 44.72 46.41 1s57 s GLY 116 CO 0.00 1.84 0.67 -2.27 0.00 0.00 0.00 173.10 173.34 1s57 s LEU 117 N 1.04 -0.62 -0.29 0.66 2.96 -1.26 -0.92 118.68 120.25 1s57 s LEU 117 Ca -0.06 1.37 -0.24 0.00 -0.22 0.00 0.00 54.13 54.98 1s57 s LEU 117 Cb -0.05 2.30 0.16 0.00 0.50 0.00 0.00 46.19 49.09 1s57 s LEU 117 CO -0.10 -0.23 1.24 -1.59 -1.32 0.00 0.00 176.35 174.35 1s57 s LYS 118 N 0.59 0.27 0.13 1.98 -2.85 -0.48 -4.98 119.74 114.40 1s57 s LYS 118 Ca -0.02 0.33 -0.27 0.00 -1.00 0.00 0.00 55.97 55.01 1s57 s LYS 118 Cb -0.05 0.13 -0.07 0.00 -2.06 0.00 0.00 37.83 35.78 1s57 s LYS 118 CO -0.03 -0.03 0.85 1.41 0.10 0.00 0.00 175.35 177.65 1s57 s MET 119 N 0.19 4.64 -0.08 1.78 -2.45 -1.26 -0.13 119.30 121.98 1s57 s MET 119 Ca 0.05 1.27 -0.11 0.00 -1.25 0.00 0.00 55.69 55.65 1s57 s MET 119 Cb -0.05 -3.32 0.02 0.00 1.25 0.00 0.00 34.83 32.73 1s57 s MET 119 CO -0.11 0.38 0.28 0.12 1.05 0.00 0.00 175.02 176.74 1s57 s PHE 120 N -0.54 -0.25 -0.44 4.11 5.36 0.18 -4.93 117.98 121.47 1s57 s PHE 120 Ca 0.41 0.56 -0.14 0.00 -0.96 0.00 0.00 56.93 56.80 1s57 s PHE 120 Cb -0.23 0.09 0.06 0.00 -0.34 0.00 0.00 43.02 42.60 1s57 s PHE 120 CO 0.27 -0.22 0.34 -1.14 -1.46 0.00 0.00 175.22 173.01 1s57 s GLN 121 N -0.34 2.90 -0.10 10.12 2.00 -1.26 -0.26 119.66 132.72 1s57 s GLN 121 Ca -0.05 -1.28 -0.30 0.00 -2.00 0.00 0.00 55.36 51.74 1s57 s GLN 121 Cb -0.03 -4.01 -0.03 0.00 0.80 0.00 0.00 33.01 29.73 1s57 s GLN 121 CO 0.01 -0.94 1.35 0.00 -0.50 0.00 0.00 175.29 175.22 1s57 s PRO 123 N 3.23 3.37 0.18 0.00 0.04 -1.26 -4.69 135.00 135.87 1s57 s PRO 123 Ca 0.60 1.34 -0.18 0.00 0.04 0.00 0.00 61.00 62.79 1s57 s PRO 123 Cb -0.26 -2.03 0.12 0.00 0.04 0.00 0.00 34.50 32.37 1s57 s PRO 123 CO 0.20 -0.78 1.63 0.87 0.04 0.00 0.00 177.00 178.96 1s57 h LYS 124 N 0.79 -0.10 -0.90 4.56 1.79 -1.95 -2.02 116.57 118.74 1s57 h LYS 124 Ca -0.48 0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.05 1s57 h LYS 124 Cb 1.23 0.02 -0.06 0.00 -1.58 0.00 0.00 32.23 31.85 1s57 h LYS 124 CO 0.57 -0.06 0.59 1.49 -1.08 0.00 0.00 179.45 180.96 1s57 h GLU 125 N -0.10 1.05 -0.19 3.15 4.81 -1.99 -1.36 114.58 119.95 1s57 h GLU 125 Ca 0.21 -0.06 -0.14 0.00 -0.13 0.00 0.00 59.36 59.24 1s57 h GLU 125 Cb 0.42 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1s57 h GLU 125 CO -0.50 0.69 -0.47 1.25 -0.73 0.00 0.00 179.01 179.25 1s57 h LEU 126 N 1.08 0.53 -0.06 1.64 5.85 -1.80 -1.93 115.31 120.62 1s57 h LEU 126 Ca 0.37 -0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 1s57 h LEU 126 Cb 0.11 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 40.98 1s57 h LEU 126 CO -0.13 0.92 0.02 0.00 -0.34 0.00 0.00 178.44 178.92 1s57 h ALA 127 N 1.10 0.08 -0.07 1.25 0.00 -0.68 -0.02 119.26 120.91 1s57 h ALA 127 Ca 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1s57 h ALA 127 Cb 0.97 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 1s57 h ALA 127 CO 0.09 -0.33 -0.01 0.93 0.00 0.00 0.00 179.25 179.93 1s57 h GLU 128 N -0.08 0.10 -0.09 0.00 5.08 -1.22 -0.84 114.58 117.53 1s57 h GLU 128 Ca 0.02 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 1s57 h GLU 128 Cb 0.19 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 1s57 h GLU 128 CO -0.00 0.12 -0.07 1.49 -1.00 0.00 0.00 179.01 179.55 1s57 h GLU 129 N 0.10 0.21 -0.81 2.33 4.22 -0.85 -2.32 114.58 117.46 1s57 h GLU 129 Ca 0.03 -0.10 0.07 0.00 0.08 0.00 0.00 59.36 59.43 1s57 h GLU 129 Cb 0.09 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.27 1s57 h GLU 129 CO 0.00 0.61 0.48 1.25 -2.18 0.00 0.00 179.01 179.17 1s57 h HIS 130 N -0.19 0.88 -1.33 0.92 2.76 -0.06 -1.48 115.15 116.65 1s57 h HIS 130 Ca 0.02 0.03 -0.71 0.00 -2.20 0.00 0.00 60.37 57.51 1s57 h HIS 130 Cb 0.56 -0.28 -0.29 0.00 1.55 0.00 0.00 27.41 28.96 1s57 h HIS 130 CO 0.08 0.42 0.88 0.66 -1.30 0.00 0.00 177.93 178.67 1s57 n TYR 131 N -4.69 3.14 0.07 5.26 4.01 -0.41 -4.77 117.16 119.77 1s57 n TYR 131 Ca 0.12 -2.78 -0.14 0.00 -0.16 0.00 0.00 57.90 54.93 1s57 n TYR 131 Cb 0.20 -1.33 -0.09 0.00 -0.31 0.00 0.00 39.34 37.82 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 2.34 -0.60 0.00 -0.72 3.64 -0.68 -2.31 116.57 118.23 1s57 h LYS 132 Ca 0.59 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 60.01 1s57 h LYS 132 Cb 0.57 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1s57 h LYS 132 CO 1.52 -0.40 0.00 -0.40 -2.27 0.00 0.00 179.45 177.89 1s57 n ASP 133 N -5.13 0.00 -0.62 4.20 5.75 -1.26 -2.07 116.55 117.42 1s57 n ASP 133 Ca -0.07 0.22 0.06 0.00 -0.01 0.00 0.00 54.79 54.99 1s57 n ASP 133 Cb 0.36 -0.30 0.16 0.00 -1.03 0.00 0.00 41.12 40.31 1s57 n ASP 133 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1s57 n LEU 134 N -1.30 3.02 0.33 -2.12 4.77 -0.88 -4.63 117.00 116.19 1s57 n LEU 134 Ca 0.03 -2.21 0.21 0.00 -0.03 0.00 0.00 56.01 54.01 1s57 n LEU 134 Cb 0.05 -0.27 1.14 0.00 -2.33 0.00 0.00 43.42 42.01 1s57 n LEU 134 CO 0.05 0.70 1.17 0.77 -1.33 0.00 0.00 177.39 178.75 1s57 h SER 135 N 1.78 0.00 0.18 -1.43 4.64 -1.35 -0.41 113.55 116.97 1s57 h SER 135 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1s57 h SER 135 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1s57 h SER 135 CO 0.04 0.00 -0.40 0.00 -0.87 0.00 0.00 176.83 175.60 1s57 n ALA 136 N -2.13 3.39 -1.70 5.18 0.00 -1.26 -4.92 120.51 119.07 1s57 n ALA 136 Ca -0.03 -0.48 -0.34 0.00 0.00 0.00 0.00 53.44 52.60 1s57 n ALA 136 Cb 0.08 -1.01 0.01 0.00 0.00 0.00 0.00 19.45 18.52 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 -2.59 3.32 0.28 0.00 -0.14 -0.16 -4.96 119.74 115.49 1s57 s LYS 137 Ca 0.20 1.41 0.04 0.00 -1.36 0.00 0.00 55.97 56.26 1s57 s LYS 137 Cb 0.18 -2.02 0.42 0.00 -1.68 0.00 0.00 37.83 34.73 1s57 s LYS 137 CO 0.58 -0.84 1.70 1.03 -0.76 0.00 0.00 175.35 177.07 1s57 h SER 138 N 0.84 0.40 -0.15 2.83 0.87 -1.92 -2.87 113.55 113.54 1s57 h SER 138 Ca -0.48 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 59.93 1s57 h SER 138 Cb 1.24 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 1s57 h SER 138 CO 0.57 0.71 0.00 2.22 -0.53 0.00 0.00 176.83 179.80 1s57 n PHE 139 N -4.08 0.19 -0.02 2.24 1.16 -1.26 -4.40 117.46 111.29 1s57 n PHE 139 Ca -0.01 -0.10 -0.09 0.00 -1.87 0.00 0.00 57.45 55.39 1s57 n PHE 139 Cb 0.44 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.29 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 1.96 -0.48 -0.44 2.97 3.57 -1.74 0.03 116.94 122.82 1s57 h PHE 140 Ca 0.00 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 1s57 h PHE 140 Cb 0.43 0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.39 1s57 h PHE 140 CO 0.10 -0.26 0.26 -1.00 -2.23 0.00 0.00 178.31 175.17 1s57 h PRO 141 N -0.21 0.59 -0.24 6.41 0.13 -1.82 -1.03 132.00 135.82 1s57 h PRO 141 Ca 0.12 -0.05 -0.12 0.00 -0.87 0.00 0.00 66.00 65.08 1s57 h PRO 141 Cb 0.38 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 31.39 1s57 h PRO 141 CO -0.31 0.42 -0.31 -0.91 -0.23 0.00 0.00 178.00 176.66 1s57 h ASN 142 N 0.60 0.69 -0.85 1.44 2.35 -1.73 -2.12 115.58 115.97 1s57 h ASN 142 Ca 0.16 -0.50 0.04 0.00 -0.55 0.00 0.00 56.30 55.45 1s57 h ASN 142 Cb -0.01 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.11 1s57 h ASN 142 CO -0.03 1.06 0.56 0.25 -1.65 0.00 0.00 177.43 177.61 1s57 h LEU 143 N 0.34 0.89 -0.19 1.61 5.85 -0.45 -1.00 115.31 122.36 1s57 h LEU 143 Ca 0.03 -0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.61 1s57 h LEU 143 Cb 0.89 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.72 1s57 h LEU 143 CO 0.07 0.60 -0.42 0.40 -0.34 0.00 0.00 178.44 178.75 1s57 h ILE 144 N 1.02 1.33 -0.45 4.05 1.08 -1.07 -2.93 117.51 120.54 1s57 h ILE 144 Ca 0.34 -1.65 -0.03 0.00 -0.39 0.00 0.00 64.86 63.13 1s57 h ILE 144 Cb 0.08 1.89 -0.02 0.00 -3.07 0.00 0.00 36.82 35.71 1s57 h ILE 144 CO -0.11 0.51 0.16 -0.33 -0.69 0.00 0.00 178.15 177.70 1s57 h GLU 145 N 0.30 0.68 -0.11 2.37 5.08 -1.01 -2.85 114.58 119.04 1s57 h GLU 145 Ca 0.00 -0.13 0.04 0.00 -1.00 0.00 0.00 59.36 58.27 1s57 h GLU 145 Cb 1.02 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.12 1s57 h GLU 145 CO 0.09 0.64 -0.16 -0.92 -1.00 0.00 0.00 179.01 177.66 1s57 h TYR 146 N 0.58 -0.40 0.00 4.33 3.20 -1.22 0.19 116.97 123.65 1s57 h TYR 146 Ca 0.15 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.04 1s57 h TYR 146 Cb 0.23 0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.69 1s57 h TYR 146 CO 0.01 -0.23 0.00 0.44 -1.64 0.00 0.00 178.16 176.74 1s57 n ILE 147 N -5.30 0.65 0.27 1.81 -5.35 -1.11 -2.43 119.36 107.90 1s57 n ILE 147 Ca -0.03 0.15 0.06 0.00 -0.27 0.00 0.00 62.75 62.66 1s57 n ILE 147 Cb 0.22 -0.83 0.08 0.00 -1.74 0.00 0.00 39.64 37.37 1s57 n ILE 147 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1s57 n THR 148 N -1.55 0.30 1.07 7.28 -2.24 -0.79 -4.53 114.28 113.82 1s57 n THR 148 Ca 0.05 -0.65 0.11 0.00 -2.27 0.00 0.00 64.05 61.29 1s57 n THR 148 Cb 0.24 1.01 0.56 0.00 -2.10 0.00 0.00 70.33 70.04 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 0.59 0.00 -3.63 3.42 3.41 0.59 -4.87 113.62 113.12 1s57 n SER 149 Ca 0.08 -0.10 0.03 0.00 -0.26 0.00 0.00 58.87 58.63 1s57 n SER 149 Cb 0.32 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 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 -2.51 -0.43 0.68 5.00 0.00 -1.26 -5.08 107.32 103.72 1s57 s GLY 150 Ca 0.22 0.75 -0.15 0.00 0.00 0.00 0.00 44.72 45.53 1s57 s GLY 150 CO 0.33 1.18 1.15 2.56 0.00 0.00 0.00 173.10 178.32 1s57 s PRO 151 N -2.13 2.58 0.32 2.90 0.04 -1.26 -4.64 135.00 132.79 1s57 s PRO 151 Ca 0.17 1.56 0.07 0.00 0.04 0.00 0.00 61.00 62.84 1s57 s PRO 151 Cb 0.06 -1.91 -0.06 0.00 0.04 0.00 0.00 34.50 32.63 1s57 s PRO 151 CO -0.05 -1.46 -0.04 0.14 0.04 0.00 0.00 177.00 175.64 1s57 s VAL 152 N -2.14 1.74 -0.26 -0.36 -7.23 0.65 -3.97 120.40 108.82 1s57 s VAL 152 Ca 0.70 -2.10 0.01 0.00 -1.81 0.00 0.00 61.98 58.78 1s57 s VAL 152 Cb -0.24 -2.62 0.05 0.00 0.56 0.00 0.00 36.38 34.13 1s57 s VAL 152 CO 0.42 -0.19 -0.08 -0.69 -0.31 0.00 0.00 175.10 174.25 1s57 s VAL 153 N -2.94 2.50 0.12 1.32 1.01 -0.92 0.51 120.40 122.00 1s57 s VAL 153 Ca 0.32 -1.44 -0.25 0.00 0.00 0.00 0.00 61.98 60.62 1s57 s VAL 153 Cb 0.05 -2.40 -0.07 0.00 0.00 0.00 0.00 36.38 33.96 1s57 s VAL 153 CO 0.14 0.02 0.75 0.00 0.00 0.00 0.00 175.10 176.01 1s57 s MET 155 N -0.82 0.38 -0.11 0.00 -1.94 0.61 -1.39 119.30 116.03 1s57 s MET 155 Ca 0.36 -0.62 0.00 0.00 -1.71 0.00 0.00 55.69 53.72 1s57 s MET 155 Cb -0.22 0.14 0.02 0.00 2.01 0.00 0.00 34.83 36.78 1s57 s MET 155 CO 0.24 -0.07 -0.09 0.00 -0.01 0.00 0.00 175.02 175.09 1s57 s ALA 156 N -1.66 1.37 0.01 3.03 0.00 -0.10 -1.43 121.76 122.98 1s57 s ALA 156 Ca -0.14 -0.56 0.07 0.00 0.00 0.00 0.00 51.96 51.34 1s57 s ALA 156 Cb -0.08 -0.86 -0.03 0.00 0.00 0.00 0.00 23.12 22.15 1s57 s ALA 156 CO -0.01 -0.31 -0.21 -1.58 0.00 0.00 0.00 175.76 173.65 1s57 s TRP 157 N 1.47 2.47 0.00 0.00 0.52 -0.43 -1.24 118.94 121.74 1s57 s TRP 157 Ca 0.01 -0.32 0.07 0.00 0.02 0.00 0.00 56.10 55.88 1s57 s TRP 157 Cb -0.13 -1.48 -0.03 0.00 -1.15 0.00 0.00 33.47 30.68 1s57 s TRP 157 CO -0.06 0.15 -0.20 -2.00 0.02 0.00 0.00 176.95 174.85 1s57 s GLU 158 N -1.09 2.16 0.00 4.98 2.12 0.64 -0.61 118.70 126.90 1s57 s GLU 158 Ca 0.12 -0.91 0.00 0.00 0.36 0.00 0.00 54.97 54.54 1s57 s GLU 158 Cb -0.10 -2.18 0.00 0.00 0.26 0.00 0.00 34.13 32.11 1s57 s GLU 158 CO 0.02 0.56 0.00 0.41 -0.54 0.00 0.00 175.26 175.72 1s57 n GLY 159 N 1.99 3.44 3.68 -1.50 0.00 -0.03 -1.44 105.19 111.32 1s57 n GLY 159 Ca -0.16 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 1s57 n GLY 159 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s57 s VAL 160 N -2.00 3.19 -1.28 1.61 1.01 -1.26 -1.81 120.40 119.86 1s57 s VAL 160 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 61.98 62.51 1s57 s VAL 160 Cb 0.00 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 33.04 1s57 s VAL 160 CO 0.00 -0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.69 1s57 n GLY 161 N 4.06 1.31 0.25 4.51 0.00 -1.26 -4.90 105.19 109.15 1s57 n GLY 161 Ca 0.16 -0.45 0.03 0.00 0.00 0.00 0.00 46.02 45.76 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 1.16 0.73 1.61 3.04 -1.67 -2.00 116.25 119.12 1s57 h VAL 162 Ca -0.25 -0.68 -0.04 0.00 -1.01 0.00 0.00 66.70 64.73 1s57 h VAL 162 Cb 0.80 1.14 0.01 0.00 -2.01 0.00 0.00 31.29 31.23 1s57 h VAL 162 CO 0.36 0.21 -0.35 0.58 -1.01 0.00 0.00 177.57 177.37 1s57 h VAL 163 N 0.23 0.23 -0.58 1.51 2.07 -1.87 0.72 116.25 118.57 1s57 h VAL 163 Ca 0.05 -0.11 -0.07 0.00 0.82 0.00 0.00 66.70 67.39 1s57 h VAL 163 Cb 0.31 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 1s57 h VAL 163 CO 0.02 0.01 0.10 0.00 0.02 0.00 0.00 177.57 177.71 1s57 h ALA 164 N -0.85 1.08 -0.47 1.67 0.00 -1.88 -2.34 119.26 116.47 1s57 h ALA 164 Ca -0.10 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.52 1s57 h ALA 164 Cb 0.77 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1s57 h ALA 164 CO 0.16 0.60 0.12 1.03 0.00 0.00 0.00 179.25 181.16 1s57 h SER 165 N 0.87 0.71 -1.00 0.00 0.87 -1.31 -1.45 113.55 112.24 1s57 h SER 165 Ca 0.18 -0.23 0.01 0.00 -1.23 0.00 0.00 61.79 60.52 1s57 h SER 165 Cb 0.38 -0.19 -0.05 0.00 -0.44 0.00 0.00 62.40 62.10 1s57 h SER 165 CO 0.01 0.76 0.67 0.00 -0.53 0.00 0.00 176.83 177.73 1s57 h ALA 166 N 0.98 1.28 -0.75 6.23 0.00 -0.61 0.09 119.26 126.48 1s57 h ALA 166 Ca 0.15 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1s57 h ALA 166 Cb 0.32 -0.41 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1s57 h ALA 166 CO 0.00 0.66 0.27 0.00 0.00 0.00 0.00 179.25 180.18 1s57 h ARG 167 N 1.36 1.14 -0.37 0.00 2.47 -1.06 -0.98 114.38 116.94 1s57 h ARG 167 Ca 0.37 -0.23 -0.06 0.00 -1.26 0.00 0.00 59.98 58.81 1s57 h ARG 167 Cb -0.15 -0.18 -0.01 0.00 -1.65 0.00 0.00 29.97 27.98 1s57 h ARG 167 CO -0.08 0.95 0.01 -0.22 0.56 0.00 0.00 179.97 181.19 1s57 h LYS 168 N 1.09 0.64 -0.45 0.04 3.64 -0.39 -1.88 116.57 119.26 1s57 h LYS 168 Ca 0.25 -0.20 -0.03 0.00 -1.27 0.00 0.00 60.65 59.40 1s57 h LYS 168 Cb 0.26 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1s57 h LYS 168 CO -0.01 0.74 0.17 -0.07 -2.27 0.00 0.00 179.45 178.01 1s57 h LEU 169 N 0.46 0.58 -0.18 5.20 3.38 -0.78 -3.00 115.31 120.97 1s57 h LEU 169 Ca 0.11 -0.07 -0.16 0.00 0.09 0.00 0.00 57.88 57.85 1s57 h LEU 169 Cb 0.44 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1s57 h LEU 169 CO 0.02 0.54 -0.51 0.40 0.09 0.00 0.00 178.44 178.97 1s57 h ILE 170 N 0.64 1.32 0.00 1.22 2.04 -0.99 0.12 117.51 121.86 1s57 h ILE 170 Ca 0.16 -1.75 0.00 0.00 1.00 0.00 0.00 64.86 64.26 1s57 h ILE 170 Cb 0.14 1.94 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 1s57 h ILE 170 CO -0.01 0.55 0.00 0.61 0.00 0.00 0.00 178.15 179.29 1s57 n GLY 171 N 0.53 0.32 3.44 5.37 0.00 -0.72 -1.33 105.19 112.80 1s57 n GLY 171 Ca -0.06 -1.93 -0.36 0.00 0.00 0.00 0.00 46.02 43.66 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 0.41 0.27 -0.30 1.61 4.76 -1.26 -4.89 118.16 118.76 1s57 n LYS 172 Ca 0.00 0.13 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 1s57 n LYS 172 Cb 0.00 -1.75 0.13 0.00 -1.84 0.00 0.00 35.03 31.57 1s57 n LYS 172 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 1s57 h THR 173 N -0.37 1.04 -3.58 -0.18 1.35 -1.97 -3.38 112.91 105.82 1s57 h THR 173 Ca -0.45 -0.33 -0.63 0.00 -0.55 0.00 0.00 66.41 64.45 1s57 h THR 173 Cb 1.35 0.01 -0.13 0.00 -1.73 0.00 0.00 68.15 67.65 1s57 h THR 173 CO 0.42 0.17 0.22 -0.62 -0.25 0.00 0.00 175.52 175.46 1s57 s ASP 174 N -5.76 6.41 0.55 5.36 3.68 -1.26 -4.53 116.67 121.13 1s57 s ASP 174 Ca -0.13 -0.01 0.29 0.00 2.13 0.00 0.00 52.55 54.84 1s57 s ASP 174 Cb 0.18 -2.35 1.46 0.00 -1.45 0.00 0.00 42.92 40.76 1s57 s ASP 174 CO 0.79 -0.74 1.92 -0.65 0.13 0.00 0.00 175.17 176.62 1s57 h PRO 175 N 8.69 0.00 -0.14 4.34 0.11 -1.82 0.12 132.00 143.31 1s57 h PRO 175 Ca -0.25 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.76 1s57 h PRO 175 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1s57 h PRO 175 CO 0.89 0.00 -0.34 -0.07 -0.21 0.00 0.00 178.00 178.27 1s57 h LEU 176 N 0.00 0.28 0.00 2.35 3.38 -1.80 -3.13 115.31 116.39 1s57 h LEU 176 Ca 0.32 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 58.04 1s57 h LEU 176 Cb 1.36 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 1s57 h LEU 176 CO -0.00 0.61 -1.39 0.00 0.09 0.00 0.00 178.44 177.74 1s57 n GLN 177 N -4.08 0.62 -1.76 1.13 1.13 0.27 -4.91 117.38 109.78 1s57 n GLN 177 Ca -0.01 0.19 -0.41 0.00 -1.94 0.00 0.00 57.00 54.83 1s57 n GLN 177 Cb 0.43 -1.80 0.01 0.00 0.11 0.00 0.00 30.24 28.99 1s57 n GLN 177 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1s57 n ALA 178 N -2.37 2.10 -1.79 -1.58 0.00 -0.32 -4.84 120.51 111.71 1s57 n ALA 178 Ca -0.09 0.29 -0.36 0.00 0.00 0.00 0.00 53.44 53.29 1s57 n ALA 178 Cb 0.80 -2.39 -0.05 0.00 0.00 0.00 0.00 19.45 17.81 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 -2.26 4.17 0.35 0.00 0.41 -1.26 -4.35 118.70 115.76 1s57 s GLU 179 Ca 0.57 1.41 -0.28 0.00 -0.41 0.00 0.00 54.97 56.26 1s57 s GLU 179 Cb -0.47 -2.45 -0.12 0.00 -1.78 0.00 0.00 34.13 29.32 1s57 s GLU 179 CO 0.60 -0.12 1.46 -2.30 -0.49 0.00 0.00 175.26 174.42 1s57 n PRO 180 N -0.22 2.53 0.00 0.39 -0.02 -1.26 -1.73 135.00 134.69 1s57 n PRO 180 Ca 0.06 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.43 1s57 n PRO 180 Cb 0.51 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 1s57 n PRO 180 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s57 n GLY 181 N 0.88 1.60 3.92 -1.23 0.00 -1.26 -4.97 105.19 104.13 1s57 n GLY 181 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.91 4.14 0.09 2.61 -4.23 -0.71 -4.91 115.64 110.72 1s57 s THR 182 Ca 0.00 0.04 -0.25 0.00 -1.18 0.00 0.00 61.69 60.29 1s57 s THR 182 Cb 0.00 -3.61 -0.16 0.00 1.34 0.00 0.00 72.50 70.08 1s57 s THR 182 CO 0.00 -0.60 1.71 0.40 -0.54 0.00 0.00 174.62 175.59 1s57 h ILE 183 N 0.02 0.84 -0.18 2.99 2.04 -0.73 -0.72 117.51 121.76 1s57 h ILE 183 Ca -0.46 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.26 1s57 h ILE 183 Cb 1.24 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1s57 h ILE 183 CO 0.61 0.00 -0.48 0.03 0.00 0.00 0.00 178.15 178.30 1s57 h ARG 184 N -0.21 0.49 0.00 2.37 3.08 -1.46 0.05 114.38 118.69 1s57 h ARG 184 Ca -0.02 -0.28 -0.07 0.00 0.07 0.00 0.00 59.98 59.69 1s57 h ARG 184 Cb 0.17 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1s57 h ARG 184 CO 0.03 0.86 -0.33 0.78 -1.07 0.00 0.00 179.97 180.24 1s57 h GLY 185 N 1.13 0.00 0.58 0.04 0.00 -1.67 -2.49 103.07 100.66 1s57 h GLY 185 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.02 1s57 h GLY 185 CO 0.09 0.00 -1.99 1.22 0.00 0.00 0.00 176.54 175.86 1s57 n ASP 186 N -4.13 0.64 0.00 0.19 8.00 -0.29 -4.54 116.55 116.43 1s57 n ASP 186 Ca -0.02 0.24 0.00 0.00 0.71 0.00 0.00 54.79 55.72 1s57 n ASP 186 Cb 0.37 0.28 0.00 0.00 -0.02 0.00 0.00 41.12 41.75 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 -2.96 1.75 -4.07 0.64 4.77 -0.01 -5.06 117.00 112.06 1s57 n LEU 187 Ca -0.24 -1.75 -0.09 0.00 -0.03 0.00 0.00 56.01 53.89 1s57 n LEU 187 Cb 1.09 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 42.09 1s57 n LEU 187 CO 0.44 0.44 -0.20 0.00 -1.33 0.00 0.00 177.39 176.74 1s57 s ALA 188 N -0.86 0.52 0.00 -1.18 0.00 -0.94 -4.99 121.76 114.32 1s57 s ALA 188 Ca 0.00 -1.23 0.00 0.00 0.00 0.00 0.00 51.96 50.73 1s57 s ALA 188 Cb 0.00 0.83 0.00 0.00 0.00 0.00 0.00 23.12 23.95 1s57 s ALA 188 CO 0.00 -0.54 0.10 1.33 0.00 0.00 0.00 175.76 176.65 1s57 n VAL 189 N -0.12 0.00 -3.79 0.00 0.24 -1.26 -4.56 118.33 108.83 1s57 n VAL 189 Ca -0.07 -0.27 -0.13 0.00 -2.04 0.00 0.00 64.34 61.84 1s57 n VAL 189 Cb 0.63 1.16 -0.10 0.00 -1.47 0.00 0.00 33.84 34.06 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 -0.35 0.44 0.26 7.34 0.74 -1.26 -4.37 119.66 122.46 1s57 s GLN 190 Ca 0.00 0.06 -0.02 0.00 0.05 0.00 0.00 55.36 55.45 1s57 s GLN 190 Cb 0.00 0.20 0.46 0.00 1.10 0.00 0.00 33.01 34.77 1s57 s GLN 190 CO 0.00 -0.09 1.82 1.15 -0.55 0.00 0.00 175.29 177.61 1s57 h THR 191 N 4.40 0.90 0.00 -0.34 2.02 -1.93 -0.74 112.91 117.22 1s57 h THR 191 Ca -0.28 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.61 1s57 h THR 191 Cb 1.19 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.57 1s57 h THR 191 CO 0.37 0.16 0.00 0.61 0.37 0.00 0.00 175.52 177.02 1s57 n GLY 192 N -1.33 -0.89 2.30 2.16 0.00 -1.26 -3.28 105.19 102.89 1s57 n GLY 192 Ca 0.16 -0.07 -0.17 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 -1.37 0.93 -1.09 1.61 5.12 -0.32 -4.98 116.66 116.56 1s57 n ARG 193 Ca 0.06 -3.05 -0.22 0.00 -1.93 0.00 0.00 57.85 52.70 1s57 n ARG 193 Cb 0.15 -1.51 0.14 0.00 -1.16 0.00 0.00 32.46 30.08 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 0.52 4.26 0.00 0.55 0.23 -0.98 -4.29 115.26 115.55 1s57 n ASN 194 Ca 0.21 -3.43 0.00 0.00 -0.53 0.00 0.00 54.58 50.82 1s57 n ASN 194 Cb 0.65 -0.83 0.00 0.00 -2.08 0.00 0.00 39.78 37.52 1s57 n ASN 194 CO 0.00 0.00 0.00 2.30 -0.93 0.00 0.00 177.26 178.63 1s57 n ILE 195 N -0.88 0.00 -3.74 1.53 -5.35 -1.26 -4.77 119.36 104.88 1s57 n ILE 195 Ca 0.53 0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.90 1s57 n ILE 195 Cb 1.38 0.00 -0.06 0.00 -1.74 0.00 0.00 39.64 39.22 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 0.09 0.03 7.28 0.11 -1.26 -0.52 120.40 126.13 1s57 s VAL 196 Ca 0.00 -0.78 0.04 0.00 -2.93 0.00 0.00 61.98 58.31 1s57 s VAL 196 Cb 0.00 -1.13 -0.02 0.00 -1.53 0.00 0.00 36.38 33.70 1s57 s VAL 196 CO 0.00 -0.43 -0.11 -2.28 -3.33 0.00 0.00 175.10 168.95 1s57 s HIS 197 N -3.32 0.94 -0.01 1.54 2.46 0.10 -4.91 115.29 112.10 1s57 s HIS 197 Ca 0.00 -0.36 -0.01 0.00 0.47 0.00 0.00 55.06 55.17 1s57 s HIS 197 Cb 0.02 -0.56 0.01 0.00 -0.13 0.00 0.00 32.58 31.92 1s57 s HIS 197 CO -0.08 -0.01 0.02 0.20 -2.47 0.00 0.00 174.74 172.41 1s57 s GLY 198 N -1.12 0.01 0.35 1.59 0.00 -1.26 -0.97 107.32 105.91 1s57 s GLY 198 Ca -0.02 0.11 -0.27 0.00 0.00 0.00 0.00 44.72 44.55 1s57 s GLY 198 CO 0.01 0.18 1.05 1.44 0.00 0.00 0.00 173.10 175.77 1s57 n SER 199 N 3.29 1.48 -0.74 1.64 7.64 -0.46 -4.89 113.62 121.57 1s57 n SER 199 Ca -0.15 1.13 0.12 0.00 1.01 0.00 0.00 58.87 60.97 1s57 n SER 199 Cb 0.58 -1.34 0.33 0.00 -1.01 0.00 0.00 64.21 62.76 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 0.89 2.27 -3.55 6.43 5.75 -1.26 -4.78 116.55 122.30 1s57 n ASP 200 Ca 0.09 -1.78 -0.10 0.00 -0.01 0.00 0.00 54.79 52.99 1s57 n ASP 200 Cb 0.35 -0.09 -0.04 0.00 -1.03 0.00 0.00 41.12 40.31 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 -1.74 -0.39 0.45 -1.12 1.04 -1.26 -5.00 113.70 105.69 1s57 s SER 201 Ca 0.34 0.28 0.16 0.00 0.48 0.00 0.00 55.95 57.22 1s57 s SER 201 Cb 0.20 0.35 1.10 0.00 0.10 0.00 0.00 66.02 67.77 1s57 s SER 201 CO 0.30 -0.46 1.98 -0.65 0.98 0.00 0.00 173.24 175.39 1s57 h PRO 202 N 2.39 0.32 0.11 4.02 0.11 -1.92 0.21 132.00 137.24 1s57 h PRO 202 Ca -0.20 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.88 1s57 h PRO 202 Cb 1.19 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1s57 h PRO 202 CO 0.32 0.21 -0.05 0.93 -0.21 0.00 0.00 178.00 179.20 1s57 h GLU 203 N 0.33 -0.14 0.00 1.05 3.07 -1.95 -2.11 114.58 114.83 1s57 h GLU 203 Ca 0.28 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 1s57 h GLU 203 Cb 0.66 0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.60 1s57 h GLU 203 CO -0.07 0.14 0.00 -0.91 -1.40 0.00 0.00 179.01 176.77 1s57 h ASN 204 N -0.41 0.00 -0.04 1.42 2.35 -1.67 -1.07 115.58 116.17 1s57 h ASN 204 Ca -0.01 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 1s57 h ASN 204 Cb 0.34 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.71 1s57 h ASN 204 CO 0.02 0.00 -0.05 1.23 -1.65 0.00 0.00 177.43 176.98 1s57 h GLY 205 N 1.81 0.11 1.02 2.83 0.00 -0.28 0.64 103.07 109.21 1s57 h GLY 205 Ca 0.00 -0.12 -0.07 0.00 0.00 0.00 0.00 47.33 47.14 1s57 h GLY 205 CO 0.00 0.11 0.09 0.50 0.00 0.00 0.00 176.54 177.24 1s57 h LYS 206 N -0.39 0.96 0.22 4.80 1.57 -1.07 -1.32 116.57 121.33 1s57 h LYS 206 Ca 0.00 -0.26 -0.01 0.00 -1.87 0.00 0.00 60.65 58.52 1s57 h LYS 206 Cb 0.59 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.79 1s57 h LYS 206 CO 0.01 0.91 -0.10 -0.09 -0.57 0.00 0.00 179.45 179.61 1s57 h ARG 207 N 0.85 -0.28 -0.79 3.15 2.43 -1.19 -1.44 114.38 117.12 1s57 h ARG 207 Ca 0.17 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.32 1s57 h ARG 207 Cb 0.42 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.00 1s57 h ARG 207 CO 0.01 -0.12 0.34 0.93 -1.51 0.00 0.00 179.97 179.61 1s57 h GLU 208 N -0.37 1.17 -0.32 0.20 5.08 -0.81 -1.04 114.58 118.50 1s57 h GLU 208 Ca -0.03 -0.20 -0.08 0.00 -1.00 0.00 0.00 59.36 58.05 1s57 h GLU 208 Cb 0.29 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1s57 h GLU 208 CO 0.05 0.93 -0.16 0.82 -1.00 0.00 0.00 179.01 179.66 1s57 h ILE 209 N 1.14 1.25 0.00 3.13 2.04 -1.21 -1.03 117.51 122.82 1s57 h ILE 209 Ca 0.27 -1.12 -0.07 0.00 1.00 0.00 0.00 64.86 64.93 1s57 h ILE 209 Cb 0.19 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1s57 h ILE 209 CO -0.03 0.37 -0.34 1.23 0.00 0.00 0.00 178.15 179.38 1s57 h GLY 210 N 0.97 0.00 0.52 5.37 0.00 -0.65 -1.97 103.07 107.30 1s57 h GLY 210 Ca 0.09 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.21 1s57 h GLY 210 CO 0.04 0.00 -1.02 -2.00 0.00 0.00 0.00 176.54 173.56 1s57 h LEU 211 N 0.00 0.35 0.00 3.11 5.85 -0.61 -3.40 115.31 120.61 1s57 h LEU 211 Ca -0.00 -0.88 -0.23 0.00 0.84 0.00 0.00 57.88 57.60 1s57 h LEU 211 Cb 0.80 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.67 1s57 h LEU 211 CO 0.04 1.46 -1.28 -0.50 -0.34 0.00 0.00 178.44 177.82 1s57 h TRP 212 N -0.45 0.00 -2.97 1.25 4.06 -1.26 -3.46 115.95 113.11 1s57 h TRP 212 Ca -0.21 0.00 -0.67 0.00 2.06 0.00 0.00 58.89 60.07 1s57 h TRP 212 Cb 1.61 0.00 -0.11 0.00 -1.00 0.00 0.00 29.16 29.66 1s57 h TRP 212 CO 0.17 0.94 -0.54 -0.06 -3.56 0.00 0.00 178.44 175.39 1s57 s PHE 213 N -2.70 3.40 0.55 0.49 0.40 -0.74 -5.10 117.98 114.28 1s57 s PHE 213 Ca -0.01 0.35 0.02 0.00 -0.60 0.00 0.00 56.93 56.69 1s57 s PHE 213 Cb 0.09 -1.90 0.04 0.00 0.51 0.00 0.00 43.02 41.75 1s57 s PHE 213 CO 0.82 0.57 0.77 0.15 0.70 0.00 0.00 175.22 178.23 1s57 s LYS 214 N -0.80 2.51 0.22 0.44 1.02 -1.26 -4.68 119.74 117.19 1s57 s LYS 214 Ca 0.13 -0.84 -0.32 0.00 0.02 0.00 0.00 55.97 54.96 1s57 s LYS 214 Cb -0.12 -2.50 -0.13 0.00 -0.52 0.00 0.00 37.83 34.56 1s57 s LYS 214 CO 0.03 -0.73 1.47 0.39 -0.92 0.00 0.00 175.35 175.59 1s57 n GLU 215 N -2.34 2.13 -0.87 1.68 -0.58 -1.26 -1.99 120.64 117.41 1s57 n GLU 215 Ca 0.08 0.76 0.00 0.00 -0.42 0.00 0.00 57.16 57.58 1s57 n GLU 215 Cb 0.60 -2.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.01 1s57 n GLU 215 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1s57 n GLY 216 N 2.49 1.15 0.16 0.62 0.00 -1.26 -4.88 105.19 103.47 1s57 n GLY 216 Ca 0.13 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.21 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 2.75 0.00 -6.82 1.61 5.08 -1.79 -3.45 114.58 111.96 1s57 h GLU 217 Ca 0.00 0.00 -0.48 0.00 -1.00 0.00 0.00 59.36 57.88 1s57 h GLU 217 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1s57 h GLU 217 CO 0.00 0.28 0.27 -0.51 -1.00 0.00 0.00 179.01 178.05 1s57 s LEU 218 N -6.24 4.27 -0.13 1.33 1.43 -1.26 -4.69 118.68 113.39 1s57 s LEU 218 Ca 0.04 1.68 0.02 0.00 -1.03 0.00 0.00 54.13 54.84 1s57 s LEU 218 Cb 0.07 -3.98 0.01 0.00 0.03 0.00 0.00 46.19 42.32 1s57 s LEU 218 CO 0.73 -0.09 -0.17 0.00 0.23 0.00 0.00 176.35 177.05 1s57 s LYS 220 N 1.03 3.45 0.15 0.00 2.47 -1.26 -4.53 119.74 121.05 1s57 s LYS 220 Ca -0.04 -0.33 -0.24 0.00 -1.56 0.00 0.00 55.97 53.80 1s57 s LYS 220 Cb -0.15 -3.09 0.07 0.00 -1.46 0.00 0.00 37.83 33.21 1s57 s LYS 220 CO -0.04 0.66 0.67 1.67 0.16 0.00 0.00 175.35 178.48 1s57 s TRP 221 N -1.36 -0.45 -0.33 4.03 1.48 -1.26 -5.14 118.94 115.91 1s57 s TRP 221 Ca 0.29 0.22 -0.12 0.00 -1.06 0.00 0.00 56.10 55.43 1s57 s TRP 221 Cb -0.13 0.58 -0.02 0.00 -1.16 0.00 0.00 33.47 32.74 1s57 s TRP 221 CO 0.20 -0.84 0.21 -0.51 -4.06 0.00 0.00 176.95 171.95 1s57 s ASP 222 N -2.73 5.93 0.02 -2.66 1.01 -1.26 -5.06 116.67 111.93 1s57 s ASP 222 Ca 0.03 -0.41 -0.30 0.00 0.71 0.00 0.00 52.55 52.58 1s57 s ASP 222 Cb -0.02 -2.10 -0.05 0.00 1.01 0.00 0.00 42.92 41.76 1s57 s ASP 222 CO -0.10 -0.21 1.26 -0.55 0.21 0.00 0.00 175.17 175.78 1s57 s SER 223 N 1.70 7.00 0.44 0.27 0.15 -1.26 -4.93 113.70 117.07 1s57 s SER 223 Ca 0.06 2.00 0.10 0.00 0.70 0.00 0.00 55.95 58.81 1s57 s SER 223 Cb -0.17 -2.57 0.97 0.00 -1.71 0.00 0.00 66.02 62.54 1s57 s SER 223 CO 0.10 -0.57 2.07 0.00 1.20 0.00 0.00 173.24 176.04 1s57 h ALA 224 N 7.19 1.82 -0.45 5.45 0.00 -2.06 -1.99 119.26 129.22 1s57 h ALA 224 Ca -0.39 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1s57 h ALA 224 Cb 1.19 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1s57 h ALA 224 CO 0.85 0.15 0.00 1.28 0.00 0.00 0.00 179.25 181.53 1s57 n LEU 225 N -4.49 2.92 -0.25 0.00 4.77 -1.26 -4.54 117.00 114.15 1s57 n LEU 225 Ca 0.03 -1.47 0.05 0.00 -0.03 0.00 0.00 56.01 54.59 1s57 n LEU 225 Cb 0.11 -0.39 0.18 0.00 -2.33 0.00 0.00 43.42 40.99 1s57 n LEU 225 CO 0.35 0.60 0.97 0.00 -1.33 0.00 0.00 177.39 177.98 1s57 h ALA 226 N 3.73 0.99 0.00 -1.18 0.00 -1.76 0.62 119.26 121.66 1s57 h ALA 226 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1s57 h ALA 226 Cb 0.84 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1s57 h ALA 226 CO 0.08 -0.28 0.00 0.25 0.00 0.00 0.00 179.25 179.30 1s57 n THR 227 N -5.08 0.89 0.85 0.00 -2.24 -1.26 -1.92 114.28 105.52 1s57 n THR 227 Ca 0.14 0.23 0.10 0.00 -2.27 0.00 0.00 64.05 62.24 1s57 n THR 227 Cb 0.43 -1.08 0.05 0.00 -2.10 0.00 0.00 70.33 67.63 1s57 n THR 227 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 1s57 n TRP 228 N -1.92 0.00 -0.03 4.78 7.02 0.16 -4.24 117.44 123.21 1s57 n TRP 228 Ca 0.03 0.00 0.01 0.00 -1.02 0.00 0.00 57.50 56.51 1s57 n TRP 228 Cb 0.21 0.00 -0.10 0.00 -2.42 0.00 0.00 31.31 29.00 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 0.63 0.00 -3.81 -0.99 7.99 -0.91 -5.00 117.00 114.90 1s57 n LEU 229 Ca 0.10 0.00 -0.13 0.00 -0.01 0.00 0.00 56.01 55.98 1s57 n LEU 229 Cb 0.46 0.14 -0.13 0.00 -0.11 0.00 0.00 43.42 43.78 1s57 n LEU 229 CO 0.18 0.14 -0.21 -0.13 -1.51 0.00 0.00 177.39 175.85 1s57 s ARG 230 N -2.62 0.15 0.00 3.23 0.52 -0.81 -5.11 118.95 114.31 1s57 s ARG 230 Ca -0.05 0.23 0.00 0.00 -0.52 0.00 0.00 55.73 55.38 1s57 s ARG 230 Cb 0.06 0.03 0.00 0.00 0.52 0.00 0.00 34.95 35.56 1s57 s ARG 230 CO 0.52 -0.05 0.41 0.39 0.02 0.00 0.00 175.30 176.59