#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a1l h PRO 104 N 0.00 0.08 -5.16 5.56 0.13 -1.81 -3.45 132.00 127.36 1a1l h PRO 104 Ca 0.00 -0.14 -0.66 0.00 -0.87 0.00 0.00 66.00 64.33 1a1l h PRO 104 Cb 0.00 0.05 -0.16 0.00 0.13 0.00 0.00 31.00 31.02 1a1l h PRO 104 CO 0.00 0.90 0.41 0.71 -0.23 0.00 0.00 178.00 179.79 1a1l s TYR 105 N -2.65 2.81 0.21 1.56 2.02 -1.09 -4.97 117.35 115.24 1a1l s TYR 105 Ca -0.04 -0.74 -0.07 0.00 -0.37 0.00 0.00 57.07 55.85 1a1l s TYR 105 Cb 0.08 -4.20 -0.06 0.00 -0.40 0.00 0.00 41.96 37.38 1a1l s TYR 105 CO 0.83 -1.52 0.50 0.00 -1.57 0.00 0.00 175.55 173.79 1a1l s ALA 106 N 3.51 3.64 -0.13 3.71 0.00 -1.26 -0.48 121.76 130.74 1a1l s ALA 106 Ca 0.19 -0.41 -0.29 0.00 0.00 0.00 0.00 51.96 51.45 1a1l s ALA 106 Cb -0.19 -2.32 -0.02 0.00 0.00 0.00 0.00 23.12 20.59 1a1l s ALA 106 CO 0.08 0.51 1.36 0.00 0.00 0.00 0.00 175.76 177.71 1a1l h PRO 108 N 8.50 0.05 -6.54 0.00 0.14 -1.91 -3.43 132.00 128.82 1a1l h PRO 108 Ca -0.30 -0.00 -0.52 0.00 0.14 0.00 0.00 66.00 65.31 1a1l h PRO 108 Cb 1.12 -0.01 0.04 0.00 0.14 0.00 0.00 31.00 32.29 1a1l h PRO 108 CO 0.96 0.04 1.09 0.08 0.14 0.00 0.00 178.00 180.31 1a1l s VAL 109 N -5.09 2.44 0.13 1.56 1.01 -1.26 -4.89 120.40 114.30 1a1l s VAL 109 Ca -0.05 0.04 -0.20 0.00 0.00 0.00 0.00 61.98 61.77 1a1l s VAL 109 Cb 0.18 -3.03 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 1a1l s VAL 109 CO 0.70 0.00 1.70 -0.08 0.00 0.00 0.00 175.10 177.42 1a1l h GLU 110 N 8.27 -0.01 0.00 2.72 4.22 -2.04 -2.42 114.58 125.32 1a1l h GLU 110 Ca -0.45 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 58.95 1a1l h GLU 110 Cb 1.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 1a1l h GLU 110 CO 0.95 -0.01 -0.17 0.66 -2.18 0.00 0.00 179.01 178.27 1a1l h SER 111 N -0.01 0.00 -3.35 1.04 4.64 -1.95 -3.41 113.55 110.51 1a1l h SER 111 Ca 0.10 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.85 1a1l h SER 111 Cb 0.17 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.19 1a1l h SER 111 CO -0.22 0.17 -0.03 0.00 -0.87 0.00 0.00 176.83 175.88 1a1l n ASP 113 N 3.82 2.23 -4.80 0.00 8.00 -1.26 -4.61 116.55 119.92 1a1l n ASP 113 Ca -0.04 -3.64 -0.34 0.00 0.71 0.00 0.00 54.79 51.48 1a1l n ASP 113 Cb 0.51 -0.54 -0.04 0.00 -0.02 0.00 0.00 41.12 41.03 1a1l n ASP 113 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1a1l s ARG 114 N -3.14 3.89 0.02 -1.24 1.81 -1.26 -4.90 118.95 114.13 1a1l s ARG 114 Ca 0.39 1.30 0.02 0.00 -1.72 0.00 0.00 55.73 55.72 1a1l s ARG 114 Cb 0.36 -2.11 -0.02 0.00 -0.45 0.00 0.00 34.95 32.73 1a1l s ARG 114 CO -0.02 -0.35 -0.07 1.03 -0.68 0.00 0.00 175.30 175.21 1a1l s ARG 115 N -3.25 0.53 0.14 3.54 0.52 -1.26 -1.04 118.95 118.12 1a1l s ARG 115 Ca 0.66 -0.54 0.04 0.00 -0.52 0.00 0.00 55.73 55.37 1a1l s ARG 115 Cb -0.15 -0.40 -0.04 0.00 0.52 0.00 0.00 34.95 34.88 1a1l s ARG 115 CO 0.19 0.09 -0.10 -0.06 0.02 0.00 0.00 175.30 175.44 1a1l s PHE 116 N -0.84 1.23 0.00 -0.53 0.40 0.36 -4.99 117.98 113.61 1a1l s PHE 116 Ca -0.04 -0.74 0.00 0.00 -0.60 0.00 0.00 56.93 55.55 1a1l s PHE 116 Cb -0.07 -0.63 0.00 0.00 0.51 0.00 0.00 43.02 42.83 1a1l s PHE 116 CO 0.00 0.07 0.18 0.43 0.70 0.00 0.00 175.22 176.60 1a1l n SER 117 N -0.06 0.00 -4.82 1.36 7.64 -1.26 -2.66 113.62 113.82 1a1l n SER 117 Ca -0.11 0.54 -0.38 0.00 1.01 0.00 0.00 58.87 59.93 1a1l n SER 117 Cb 0.60 -0.45 -0.06 0.00 -1.01 0.00 0.00 64.21 63.29 1a1l n SER 117 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1a1l s ARG 118 N -1.26 4.11 0.46 1.43 1.70 -1.26 -4.57 118.95 119.56 1a1l s ARG 118 Ca 0.00 0.63 0.13 0.00 -0.47 0.00 0.00 55.73 56.02 1a1l s ARG 118 Cb 0.00 -3.16 1.07 0.00 -0.57 0.00 0.00 34.95 32.30 1a1l s ARG 118 CO 0.00 0.61 2.06 0.66 -1.08 0.00 0.00 175.30 177.55 1a1l h SER 119 N 4.31 0.26 -0.00 -2.89 4.64 -1.97 -1.48 113.55 116.42 1a1l h SER 119 Ca -0.50 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1a1l h SER 119 Cb 1.21 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1a1l h SER 119 CO 0.64 0.18 0.00 -2.24 -0.87 0.00 0.00 176.83 174.54 1a1l h ASP 120 N 0.30 0.00 0.24 4.97 2.03 -2.00 0.12 116.42 122.08 1a1l h ASP 120 Ca 0.15 0.00 -0.18 0.00 -0.73 0.00 0.00 57.03 56.26 1a1l h ASP 120 Cb 0.21 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.70 1a1l h ASP 120 CO -0.03 0.00 -0.73 -0.33 -1.03 0.00 0.00 179.24 177.12 1a1l h GLU 121 N 0.00 0.42 -0.23 4.15 5.08 -1.68 -2.51 114.58 119.81 1a1l h GLU 121 Ca 0.00 -0.34 -0.17 0.00 -1.00 0.00 0.00 59.36 57.85 1a1l h GLU 121 Cb 0.00 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 1a1l h GLU 121 CO -0.00 0.98 -0.52 1.25 -1.00 0.00 0.00 179.01 179.72 1a1l h LEU 122 N 0.29 0.74 -0.62 1.33 5.85 -1.06 -1.13 115.31 120.71 1a1l h LEU 122 Ca -0.03 -0.39 -0.04 0.00 0.84 0.00 0.00 57.88 58.27 1a1l h LEU 122 Cb 1.30 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 42.09 1a1l h LEU 122 CO 0.13 1.13 0.24 0.74 -0.34 0.00 0.00 178.44 180.34 1a1l h THR 123 N 0.52 1.23 0.01 1.05 2.02 -1.27 0.23 112.91 116.70 1a1l h THR 123 Ca 0.02 -0.73 -0.00 0.00 0.77 0.00 0.00 66.41 66.46 1a1l h THR 123 Cb 1.09 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 1a1l h THR 123 CO 0.11 0.29 -0.01 -0.09 0.37 0.00 0.00 175.52 176.19 1a1l h ARG 124 N 0.86 -0.01 -0.96 6.66 2.43 -1.40 -3.17 114.38 118.79 1a1l h ARG 124 Ca 0.21 0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.47 1a1l h ARG 124 Cb 0.21 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.69 1a1l h ARG 124 CO -0.02 0.37 0.61 1.25 -1.51 0.00 0.00 179.97 180.68 1a1l h HIS 125 N -0.40 1.09 -0.06 2.20 2.76 -1.02 -1.91 115.15 117.80 1a1l h HIS 125 Ca -0.00 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.22 1a1l h HIS 125 Cb 0.39 -0.35 -0.00 0.00 1.55 0.00 0.00 27.41 29.00 1a1l h HIS 125 CO 0.06 0.51 0.19 0.97 -1.30 0.00 0.00 177.93 178.35 1a1l h ILE 126 N 1.01 0.15 0.00 6.26 6.09 -0.52 -1.05 117.51 129.45 1a1l h ILE 126 Ca 0.44 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.93 1a1l h ILE 126 Cb 0.34 0.83 0.00 0.00 0.47 0.00 0.00 36.82 38.46 1a1l h ILE 126 CO -0.20 0.00 0.00 0.03 -3.07 0.00 0.00 178.15 174.91 1a1l h ARG 127 N 0.00 0.00 0.00 2.19 3.08 -1.44 -1.62 114.38 116.59 1a1l h ARG 127 Ca 0.03 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 1a1l h ARG 127 Cb 0.40 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 1a1l h ARG 127 CO -0.00 0.00 -0.25 -0.84 -1.07 0.00 0.00 179.97 177.81 1a1l h ILE 128 N 0.00 0.65 0.04 2.04 3.07 -1.37 0.82 117.51 122.76 1a1l h ILE 128 Ca 0.00 -1.16 -0.33 0.00 1.55 0.00 0.00 64.86 64.92 1a1l h ILE 128 Cb 0.41 1.76 -0.04 0.00 -0.27 0.00 0.00 36.82 38.68 1a1l h ILE 128 CO 0.00 0.25 -1.88 1.41 -1.05 0.00 0.00 178.15 176.88 1a1l n HIS 129 N -3.47 0.99 0.39 0.16 8.25 -0.66 -4.09 115.22 116.79 1a1l n HIS 129 Ca -0.00 0.29 0.12 0.00 -0.26 0.00 0.00 57.72 57.87 1a1l n HIS 129 Cb 0.43 -1.16 0.17 0.00 1.12 0.00 0.00 29.99 30.54 1a1l n HIS 129 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 1a1l h THR 130 N 0.03 0.00 -0.12 1.59 1.35 -1.36 -3.48 112.91 110.92 1a1l h THR 130 Ca -0.36 -0.72 -0.05 0.00 -0.55 0.00 0.00 66.41 64.73 1a1l h THR 130 Cb 2.03 1.43 -0.02 0.00 -1.73 0.00 0.00 68.15 69.87 1a1l h THR 130 CO 0.07 0.00 -0.05 0.61 -0.25 0.00 0.00 175.52 175.91 1a1l n GLY 131 N 1.24 0.54 3.70 5.82 0.00 0.27 -4.98 105.19 111.78 1a1l n GLY 131 Ca 0.03 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 1a1l n GLY 131 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1a1l s GLN 132 N -1.34 4.32 -0.50 1.61 0.74 -1.18 -4.98 119.66 118.33 1a1l s GLN 132 Ca 0.00 1.97 0.04 0.00 0.05 0.00 0.00 55.36 57.42 1a1l s GLN 132 Cb 0.00 -3.43 0.16 0.00 1.10 0.00 0.00 33.01 30.84 1a1l s GLN 132 CO 0.00 -0.48 0.36 0.15 -0.55 0.00 0.00 175.29 174.77 1a1l s LYS 133 N 1.78 1.41 0.00 1.67 1.02 -1.26 -4.55 119.74 119.80 1a1l s LYS 133 Ca 0.63 -2.42 0.22 0.00 0.02 0.00 0.00 55.97 54.42 1a1l s LYS 133 Cb -0.33 -2.15 1.30 0.00 -0.52 0.00 0.00 37.83 36.13 1a1l s LYS 133 CO 0.28 -1.31 1.68 -2.30 -0.92 0.00 0.00 175.35 172.78 1a1l n PRO 134 N 2.75 0.67 -4.04 -1.68 -0.02 -1.20 -4.30 135.00 127.19 1a1l n PRO 134 Ca 0.23 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.38 1a1l n PRO 134 Cb 0.41 -1.50 -0.15 0.00 -0.02 0.00 0.00 33.50 32.24 1a1l n PRO 134 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1a1l s PHE 135 N -2.02 3.16 -0.10 6.00 0.08 -0.85 -4.99 117.98 119.26 1a1l s PHE 135 Ca 0.32 -2.05 -0.03 0.00 0.12 0.00 0.00 56.93 55.29 1a1l s PHE 135 Cb 0.15 -1.97 -0.03 0.00 -0.57 0.00 0.00 43.02 40.60 1a1l s PHE 135 CO 0.25 -0.84 0.01 -1.14 -0.10 0.00 0.00 175.22 173.41 1a1l s GLN 136 N 1.18 3.15 -0.45 0.44 0.74 -1.26 0.47 119.66 123.93 1a1l s GLN 136 Ca -0.05 -0.39 -0.27 0.00 0.05 0.00 0.00 55.36 54.70 1a1l s GLN 136 Cb -0.18 -2.86 0.03 0.00 1.10 0.00 0.00 33.01 31.09 1a1l s GLN 136 CO -0.06 0.63 1.02 0.00 -0.55 0.00 0.00 175.29 176.34 1a1l n ARG 138 N 7.37 0.16 -0.12 0.00 1.85 -1.26 0.65 116.66 125.32 1a1l n ARG 138 Ca 0.09 0.16 -0.25 0.00 -1.00 0.00 0.00 57.85 56.85 1a1l n ARG 138 Cb 0.49 -1.50 -0.11 0.00 -1.05 0.00 0.00 32.46 30.29 1a1l n ARG 138 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 1a1l n ILE 139 N -1.22 1.54 0.34 8.89 5.41 -1.26 -4.58 119.36 128.47 1a1l n ILE 139 Ca 0.05 -0.16 0.05 0.00 1.00 0.00 0.00 62.75 63.69 1a1l n ILE 139 Cb 0.06 -1.98 0.06 0.00 -0.71 0.00 0.00 39.64 37.07 1a1l n ILE 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1a1l n MET 141 N 0.57 -1.15 -2.11 0.00 2.81 0.21 -4.99 117.12 112.47 1a1l n MET 141 Ca 0.07 0.29 -0.33 0.00 -1.81 0.00 0.00 57.70 55.91 1a1l n MET 141 Cb 0.29 -4.27 0.01 0.00 -0.71 0.00 0.00 33.22 28.54 1a1l n MET 141 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 1a1l s ARG 142 N -1.25 3.29 0.05 0.03 3.52 -1.25 -4.68 118.95 118.66 1a1l s ARG 142 Ca 0.00 1.35 0.03 0.00 -0.13 0.00 0.00 55.73 56.98 1a1l s ARG 142 Cb 0.00 -2.02 -0.04 0.00 -1.56 0.00 0.00 34.95 31.33 1a1l s ARG 142 CO 0.00 -0.86 0.03 -0.80 -0.81 0.00 0.00 175.30 172.86 1a1l s ASN 143 N -2.40 5.26 0.05 -2.12 0.02 -1.26 -0.78 114.94 113.71 1a1l s ASN 143 Ca 0.67 -0.05 0.03 0.00 -1.02 0.00 0.00 52.86 52.49 1a1l s ASN 143 Cb -0.19 -1.36 -0.03 0.00 0.02 0.00 0.00 41.25 39.70 1a1l s ASN 143 CO 0.33 0.22 -0.09 -0.36 0.02 0.00 0.00 177.10 177.22 1a1l s PHE 144 N -1.25 0.81 -0.21 2.20 0.08 0.18 -4.98 117.98 114.81 1a1l s PHE 144 Ca 0.24 -0.53 0.25 0.00 0.12 0.00 0.00 56.93 57.01 1a1l s PHE 144 Cb -0.12 -0.47 0.61 0.00 -0.57 0.00 0.00 43.02 42.47 1a1l s PHE 144 CO 0.16 -0.06 1.70 0.66 -0.10 0.00 0.00 175.22 177.59 1a1l h SER 145 N 4.30 0.00 -4.45 1.36 4.64 -1.84 -2.25 113.55 115.31 1a1l h SER 145 Ca -0.37 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 60.69 1a1l h SER 145 Cb 1.20 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 63.05 1a1l h SER 145 CO 0.43 0.10 -0.73 -0.13 -0.87 0.00 0.00 176.83 175.62 1a1l s ARG 146 N -3.33 0.39 0.27 4.77 0.52 -1.26 -4.64 118.95 115.66 1a1l s ARG 146 Ca 0.04 -0.48 0.01 0.00 -0.52 0.00 0.00 55.73 54.78 1a1l s ARG 146 Cb 0.07 -0.20 0.38 0.00 0.52 0.00 0.00 34.95 35.71 1a1l s ARG 146 CO 0.65 0.04 1.72 0.66 0.02 0.00 0.00 175.30 178.38 1a1l h SER 147 N 5.14 0.55 0.22 0.23 4.64 -1.95 -2.72 113.55 119.66 1a1l h SER 147 Ca -0.31 -0.18 -0.14 0.00 -0.47 0.00 0.00 61.79 60.69 1a1l h SER 147 Cb 1.20 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 63.13 1a1l h SER 147 CO 0.45 0.77 -0.52 -2.24 -0.87 0.00 0.00 176.83 174.42 1a1l h ASP 148 N 0.49 0.36 1.60 4.97 2.03 -2.00 -2.23 116.42 121.65 1a1l h ASP 148 Ca 0.08 -0.18 -0.01 0.00 -0.73 0.00 0.00 57.03 56.18 1a1l h ASP 148 Cb 0.65 -0.10 -0.00 0.00 -0.83 0.00 0.00 39.33 39.04 1a1l h ASP 148 CO 0.05 0.82 -0.04 0.45 -1.03 0.00 0.00 179.24 179.48 1a1l h HIS 149 N 0.26 0.00 0.12 4.15 3.86 -1.95 -2.92 115.15 118.66 1a1l h HIS 149 Ca 0.01 0.00 -0.29 0.00 -1.16 0.00 0.00 60.37 58.93 1a1l h HIS 149 Cb 1.00 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.50 1a1l h HIS 149 CO 0.03 0.04 -1.23 1.25 0.86 0.00 0.00 177.93 178.87 1a1l h LEU 150 N 0.00 0.79 -0.27 2.43 5.85 -1.22 -2.32 115.31 120.56 1a1l h LEU 150 Ca -0.00 -0.74 0.00 0.00 0.84 0.00 0.00 57.88 57.99 1a1l h LEU 150 Cb 0.86 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1a1l h LEU 150 CO 0.01 1.55 0.17 0.74 -0.34 0.00 0.00 178.44 180.57 1a1l h THR 151 N 0.24 1.06 0.00 1.05 2.02 -1.31 -1.10 112.91 114.87 1a1l h THR 151 Ca -0.18 -0.12 -0.12 0.00 0.77 0.00 0.00 66.41 66.76 1a1l h THR 151 Cb 1.91 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 68.98 1a1l h THR 151 CO 0.23 0.06 -0.58 0.71 0.37 0.00 0.00 175.52 176.32 1a1l h THR 152 N 0.35 1.38 -0.20 3.16 1.35 -1.61 -3.13 112.91 114.22 1a1l h THR 152 Ca 0.10 -2.00 -0.01 0.00 -0.55 0.00 0.00 66.41 63.94 1a1l h THR 152 Cb -0.03 2.09 -0.01 0.00 -1.73 0.00 0.00 68.15 68.47 1a1l h THR 152 CO -0.03 0.57 0.07 -0.74 -0.25 0.00 0.00 175.52 175.14 1a1l h HIS 153 N 0.00 0.31 -0.40 4.73 6.17 -1.00 -2.77 115.15 122.18 1a1l h HIS 153 Ca -0.01 -0.03 0.11 0.00 0.71 0.00 0.00 60.37 61.16 1a1l h HIS 153 Cb 1.04 -0.09 -0.02 0.00 2.52 0.00 0.00 27.41 30.87 1a1l h HIS 153 CO 0.00 0.37 0.30 0.82 0.71 0.00 0.00 177.93 180.13 1a1l h ILE 154 N 0.16 0.72 0.00 6.26 2.04 -1.16 -0.03 117.51 125.50 1a1l h ILE 154 Ca 0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.92 1a1l h ILE 154 Cb 0.20 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1a1l h ILE 154 CO -0.00 0.00 0.00 0.03 0.00 0.00 0.00 178.15 178.18 1a1l h ARG 155 N 0.00 0.00 0.00 2.37 3.08 -1.49 -0.03 114.38 118.31 1a1l h ARG 155 Ca 0.19 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.21 1a1l h ARG 155 Cb 0.79 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.84 1a1l h ARG 155 CO -0.00 0.00 -0.14 1.79 -1.07 0.00 0.00 179.97 180.55 1a1l h THR 156 N 0.00 0.27 0.00 2.04 1.35 -1.12 0.43 112.91 115.89 1a1l h THR 156 Ca 0.00 -1.15 -0.14 0.00 -0.55 0.00 0.00 66.41 64.57 1a1l h THR 156 Cb 0.17 1.93 -0.02 0.00 -1.73 0.00 0.00 68.15 68.49 1a1l h THR 156 CO 0.00 0.14 -0.89 0.45 -0.25 0.00 0.00 175.52 174.97 1a1l h HIS 157 N 0.00 0.00 0.00 4.73 3.86 -1.16 -3.40 115.15 119.18 1a1l h HIS 157 Ca -0.00 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.13 1a1l h HIS 157 Cb 0.92 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.38 1a1l h HIS 157 CO 0.00 1.06 -0.37 1.79 0.86 0.00 0.00 177.93 181.27 1a1l h THR 158 N -1.00 0.72 0.00 2.45 1.35 -1.50 -3.47 112.91 111.45 1a1l h THR 158 Ca -0.22 -1.73 0.00 0.00 -0.55 0.00 0.00 66.41 63.91 1a1l h THR 158 Cb 1.05 2.14 0.00 0.00 -1.73 0.00 0.00 68.15 69.61 1a1l h THR 158 CO -0.13 0.36 0.00 0.61 -0.25 0.00 0.00 175.52 176.11 1a1l n GLY 159 N 0.78 0.58 3.72 5.82 0.00 0.14 -4.99 105.19 111.23 1a1l n GLY 159 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1a1l n GLY 159 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1a1l s GLU 160 N -0.02 4.22 -0.38 1.61 2.12 -1.23 -4.97 118.70 120.04 1a1l s GLU 160 Ca 0.00 2.36 0.01 0.00 0.36 0.00 0.00 54.97 57.71 1a1l s GLU 160 Cb 0.00 -3.15 0.15 0.00 0.26 0.00 0.00 34.13 31.39 1a1l s GLU 160 CO 0.00 -0.60 0.25 0.15 -0.54 0.00 0.00 175.26 174.52 1a1l s LYS 161 N 1.01 0.72 0.00 4.30 1.02 -1.26 -4.43 119.74 121.10 1a1l s LYS 161 Ca 0.69 -1.60 0.23 0.00 0.02 0.00 0.00 55.97 55.31 1a1l s LYS 161 Cb -0.44 -1.45 1.11 0.00 -0.52 0.00 0.00 37.83 36.53 1a1l s LYS 161 CO 0.32 -1.25 1.75 -0.35 -0.92 0.00 0.00 175.35 174.90 1a1l n PRO 162 N 3.69 0.24 -3.83 -1.68 -0.05 -1.11 -4.37 135.00 127.89 1a1l n PRO 162 Ca 0.16 0.08 -0.36 0.00 -0.05 0.00 0.00 63.50 63.33 1a1l n PRO 162 Cb 0.39 -1.50 -0.13 0.00 -0.05 0.00 0.00 33.50 32.21 1a1l n PRO 162 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 175.50 175.39 1a1l s PHE 163 N -2.69 3.25 -0.11 0.54 0.08 -0.50 -4.96 117.98 113.58 1a1l s PHE 163 Ca 0.19 -1.61 -0.05 0.00 0.12 0.00 0.00 56.93 55.59 1a1l s PHE 163 Cb 0.15 -2.19 -0.04 0.00 -0.57 0.00 0.00 43.02 40.37 1a1l s PHE 163 CO 0.37 -0.76 0.07 0.00 -0.10 0.00 0.00 175.22 174.80 1a1l s ALA 164 N 1.34 3.56 0.18 5.36 0.00 -1.26 0.42 121.76 131.35 1a1l s ALA 164 Ca -0.03 -0.73 -0.31 0.00 0.00 0.00 0.00 51.96 50.90 1a1l s ALA 164 Cb -0.19 -1.75 -0.09 0.00 0.00 0.00 0.00 23.12 21.09 1a1l s ALA 164 CO 0.01 0.55 1.40 0.00 0.00 0.00 0.00 175.76 177.72 1a1l h ASP 166 N 5.98 0.00 0.00 0.00 3.32 -1.95 0.26 116.42 124.03 1a1l h ASP 166 Ca -0.44 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.49 1a1l h ASP 166 Cb 1.21 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.74 1a1l h ASP 166 CO 0.82 0.20 -0.73 0.40 -1.72 0.00 0.00 179.24 178.21 1a1l h ILE 167 N 0.00 0.94 -0.00 0.35 1.08 -1.96 -3.42 117.51 114.50 1a1l h ILE 167 Ca -0.00 -1.97 0.00 0.00 -0.39 0.00 0.00 64.86 62.50 1a1l h ILE 167 Cb 0.53 2.04 0.00 0.00 -3.07 0.00 0.00 36.82 36.32 1a1l h ILE 167 CO 0.03 0.32 -0.39 0.00 -0.69 0.00 0.00 178.15 177.42 1a1l n GLY 169 N 1.13 0.66 3.74 0.00 0.00 0.08 -4.97 105.19 105.82 1a1l n GLY 169 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1a1l n GLY 169 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1a1l s ARG 170 N -0.05 4.26 0.17 1.61 3.52 -1.26 -4.35 118.95 122.86 1a1l s ARG 170 Ca 0.00 2.29 -0.08 0.00 -0.13 0.00 0.00 55.73 57.81 1a1l s ARG 170 Cb 0.00 -3.13 -0.06 0.00 -1.56 0.00 0.00 34.95 30.20 1a1l s ARG 170 CO 0.00 -0.46 0.47 0.15 -0.81 0.00 0.00 175.30 174.65 1a1l s LYS 171 N 0.05 3.74 0.04 5.12 1.02 -1.26 -0.92 119.74 127.52 1a1l s LYS 171 Ca 0.62 0.14 0.01 0.00 0.02 0.00 0.00 55.97 56.76 1a1l s LYS 171 Cb -0.42 -2.78 -0.02 0.00 -0.52 0.00 0.00 37.83 34.09 1a1l s LYS 171 CO 0.40 0.41 -0.05 -0.06 -0.92 0.00 0.00 175.35 175.13 1a1l s PHE 172 N -1.69 0.48 -0.08 3.18 0.08 0.17 -4.97 117.98 115.15 1a1l s PHE 172 Ca 0.43 -0.59 0.19 0.00 0.12 0.00 0.00 56.93 57.07 1a1l s PHE 172 Cb -0.12 -0.31 0.39 0.00 -0.57 0.00 0.00 43.02 42.41 1a1l s PHE 172 CO 0.22 -0.16 1.59 0.00 -0.10 0.00 0.00 175.22 176.77 1a1l h ALA 173 N 4.35 0.83 -3.55 5.36 0.00 -1.86 -1.28 119.26 123.11 1a1l h ALA 173 Ca -0.34 -0.33 -0.47 0.00 0.00 0.00 0.00 54.91 53.78 1a1l h ALA 173 Cb 1.20 -0.06 -0.22 0.00 0.00 0.00 0.00 17.79 18.71 1a1l h ALA 173 CO 0.45 0.45 -0.80 1.03 0.00 0.00 0.00 179.25 180.38 1a1l s ARG 174 N -3.24 0.94 0.33 0.00 0.52 -1.26 -4.68 118.95 111.56 1a1l s ARG 174 Ca 0.03 -1.00 0.11 0.00 -0.52 0.00 0.00 55.73 54.35 1a1l s ARG 174 Cb 0.08 -1.04 0.56 0.00 0.52 0.00 0.00 34.95 35.08 1a1l s ARG 174 CO 0.70 0.24 1.74 0.66 0.02 0.00 0.00 175.30 178.66 1a1l h SER 175 N 4.31 0.04 0.58 0.23 4.64 -1.95 -2.88 113.55 118.51 1a1l h SER 175 Ca -0.42 -0.02 -0.11 0.00 -0.47 0.00 0.00 61.79 60.77 1a1l h SER 175 Cb 1.19 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 63.25 1a1l h SER 175 CO 0.40 0.49 -0.54 -2.24 -0.87 0.00 0.00 176.83 174.08 1a1l h ASP 176 N 0.03 0.00 -0.37 4.97 2.03 -1.98 0.22 116.42 121.32 1a1l h ASP 176 Ca -0.00 0.00 -0.13 0.00 -0.73 0.00 0.00 57.03 56.16 1a1l h ASP 176 Cb 0.82 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.31 1a1l h ASP 176 CO 0.06 0.54 -0.28 -0.33 -1.03 0.00 0.00 179.24 178.20 1a1l h GLU 177 N 0.00 0.89 -0.40 4.15 5.08 -1.94 -0.57 114.58 121.79 1a1l h GLU 177 Ca -0.01 -0.40 -0.12 0.00 -1.00 0.00 0.00 59.36 57.84 1a1l h GLU 177 Cb 0.97 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 1a1l h GLU 177 CO 0.07 1.05 -0.21 -0.09 -1.00 0.00 0.00 179.01 178.83 1a1l h ARG 178 N 0.75 0.84 -0.55 2.33 2.43 -1.24 -1.50 114.38 117.44 1a1l h ARG 178 Ca 0.09 -0.38 -0.01 0.00 -0.81 0.00 0.00 59.98 58.87 1a1l h ARG 178 Cb 0.83 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.34 1a1l h ARG 178 CO 0.07 1.01 0.31 -0.22 -1.51 0.00 0.00 179.97 179.64 1a1l h LYS 179 N 0.65 0.76 -0.00 0.20 3.64 -0.38 0.81 116.57 122.25 1a1l h LYS 179 Ca 0.09 -0.08 -0.08 0.00 -1.27 0.00 0.00 60.65 59.31 1a1l h LYS 179 Cb 0.77 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 1a1l h LYS 179 CO 0.06 0.57 -0.37 -0.09 -2.27 0.00 0.00 179.45 177.36 1a1l h ARG 180 N 0.74 0.01 0.03 1.90 2.43 -1.02 -3.21 114.38 115.25 1a1l h ARG 180 Ca 0.19 -0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.29 1a1l h ARG 180 Cb 0.03 -0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.58 1a1l h ARG 180 CO -0.03 0.38 -0.31 1.25 -1.51 0.00 0.00 179.97 179.75 1a1l h HIS 181 N 0.01 0.26 -1.20 2.20 2.76 -0.62 -3.36 115.15 115.19 1a1l h HIS 181 Ca -0.00 -0.16 0.36 0.00 -2.20 0.00 0.00 60.37 58.36 1a1l h HIS 181 Cb 0.66 -0.02 -0.10 0.00 1.55 0.00 0.00 27.41 29.49 1a1l h HIS 181 CO 0.00 1.03 0.78 1.15 -1.30 0.00 0.00 177.93 179.60 1a1l h THR 182 N -0.59 0.32 0.00 6.26 2.02 -0.85 0.01 112.91 120.07 1a1l h THR 182 Ca -0.05 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.06 1a1l h THR 182 Cb 1.14 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1a1l h THR 182 CO 0.06 0.04 0.00 2.29 0.37 0.00 0.00 175.52 178.28 1a1l n LYS 183 N -4.60 0.04 0.11 6.66 2.85 -1.25 -2.52 118.16 119.44 1a1l n LYS 183 Ca 0.31 0.29 0.12 0.00 -1.05 0.00 0.00 58.31 57.98 1a1l n LYS 183 Cb 1.18 -1.57 0.46 0.00 -0.65 0.00 0.00 35.03 34.45 1a1l n LYS 183 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 177.40 177.79 1a1l n ILE 184 N -1.64 0.78 1.42 0.58 -5.35 -0.01 -2.62 119.36 112.52 1a1l n ILE 184 Ca 0.03 0.14 0.15 0.00 -0.27 0.00 0.00 62.75 62.79 1a1l n ILE 184 Cb 0.17 -1.02 0.71 0.00 -1.74 0.00 0.00 39.64 37.76 1a1l n ILE 184 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1a1l n HIS 185 N -2.13 0.00 -3.81 4.28 8.25 -1.05 -4.81 115.22 115.96 1a1l n HIS 185 Ca 0.03 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.20 1a1l n HIS 185 Cb 0.26 -0.25 -0.04 0.00 1.12 0.00 0.00 29.99 31.08 1a1l n HIS 185 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1a1l s LEU 186 N -2.55 4.30 0.00 2.41 1.43 -1.08 -5.22 118.68 117.98 1a1l s LEU 186 Ca 0.29 0.36 0.00 0.00 -1.03 0.00 0.00 54.13 53.75 1a1l s LEU 186 Cb 0.20 -3.09 0.00 0.00 0.03 0.00 0.00 46.19 43.33 1a1l s LEU 186 CO 0.47 0.07 0.00 -2.11 0.23 0.00 0.00 176.35 175.01