#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xyx n VAL 122 N 0.00 -4.74 0.00 2.52 0.31 -1.26 -1.03 118.33 114.13 1xyx n VAL 122 Ca 0.00 -0.83 0.00 0.00 -0.01 0.00 0.00 64.34 63.50 1xyx n VAL 122 Cb 0.00 -3.62 0.00 0.00 -0.91 0.00 0.00 33.84 29.31 1xyx n VAL 122 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xyx n GLY 123 N -1.83 1.43 0.00 2.92 0.00 -1.26 -2.70 105.19 103.75 1xyx n GLY 123 Ca -0.11 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1xyx n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyx n GLY 124 N 0.00 0.00 0.23 -0.02 0.00 -0.84 -5.03 105.19 99.53 1xyx n GLY 124 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1xyx n GLY 124 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1xyx h LEU 125 N 0.00 0.00 0.00 0.99 -0.00 -0.87 -3.47 115.31 111.96 1xyx h LEU 125 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1xyx h LEU 125 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1xyx h LEU 125 CO 0.00 0.23 0.00 0.61 -0.00 0.00 0.00 178.44 179.28 1xyx n GLY 126 N -0.11 3.08 0.00 0.83 0.00 -1.25 -4.51 105.19 103.22 1xyx n GLY 126 Ca -0.01 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1xyx n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyx n GLY 127 N 0.00 0.00 3.77 -0.02 0.00 -1.26 -4.94 105.19 102.74 1xyx n GLY 127 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1xyx n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xyx s TYR 128 N 0.00 2.93 0.64 1.61 1.51 -1.26 -4.98 117.35 117.80 1xyx s TYR 128 Ca 0.00 1.51 -0.18 0.00 -1.01 0.00 0.00 57.07 57.39 1xyx s TYR 128 Cb 0.00 -3.47 -0.01 0.00 -0.11 0.00 0.00 41.96 38.37 1xyx s TYR 128 CO 0.00 -1.60 1.28 -1.64 -1.11 0.00 0.00 175.55 172.48 1xyx s MET 129 N -2.41 2.58 -0.05 -0.62 -1.94 0.61 -4.84 119.30 112.64 1xyx s MET 129 Ca 0.59 2.03 0.03 0.00 -1.71 0.00 0.00 55.69 56.63 1xyx s MET 129 Cb -0.32 -1.85 0.00 0.00 2.01 0.00 0.00 34.83 34.67 1xyx s MET 129 CO 0.40 -1.56 -0.15 -1.17 -0.01 0.00 0.00 175.02 172.53 1xyx s LEU 130 N -4.36 1.81 0.00 -0.03 2.96 -1.26 -1.41 118.68 116.39 1xyx s LEU 130 Ca 0.82 -0.33 -0.09 0.00 -0.22 0.00 0.00 54.13 54.31 1xyx s LEU 130 Cb -0.36 -0.90 0.13 0.00 0.50 0.00 0.00 46.19 45.55 1xyx s LEU 130 CO 0.39 0.10 0.59 0.61 -1.32 0.00 0.00 176.35 176.72 1xyx n GLY 131 N 3.44 -1.97 3.90 7.98 0.00 -0.04 -4.97 105.19 113.53 1xyx n GLY 131 Ca -0.20 -1.58 -0.28 0.00 0.00 0.00 0.00 46.02 43.96 1xyx n GLY 131 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xyx s SER 132 N -3.15 6.25 0.69 1.61 0.01 -1.26 -4.74 113.70 113.11 1xyx s SER 132 Ca 0.36 0.97 -0.16 0.00 1.31 0.00 0.00 55.95 58.42 1xyx s SER 132 Cb -0.02 -2.26 0.02 0.00 0.21 0.00 0.00 66.02 63.97 1xyx s SER 132 CO 0.26 -0.61 1.21 0.00 0.41 0.00 0.00 173.24 174.51 1xyx s ALA 133 N -2.79 2.25 0.06 1.44 0.00 -1.26 -4.43 121.76 117.03 1xyx s ALA 133 Ca 0.48 0.92 -0.00 0.00 0.00 0.00 0.00 51.96 53.36 1xyx s ALA 133 Cb -0.10 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.51 1xyx s ALA 133 CO 0.46 -1.67 -0.04 -1.64 0.00 0.00 0.00 175.76 172.87 1xyx s MET 134 N -3.76 0.64 1.03 0.00 -1.94 -0.81 -4.97 119.30 109.50 1xyx s MET 134 Ca 0.75 -1.21 -0.15 0.00 -1.71 0.00 0.00 55.69 53.37 1xyx s MET 134 Cb -0.30 0.10 0.21 0.00 2.01 0.00 0.00 34.83 36.85 1xyx s MET 134 CO 0.42 -0.08 1.16 0.45 -0.01 0.00 0.00 175.02 176.95 1xyx s SER 135 N -2.85 2.41 0.36 3.03 0.15 -1.26 -4.92 113.70 110.62 1xyx s SER 135 Ca 0.07 0.75 -0.28 0.00 0.70 0.00 0.00 55.95 57.18 1xyx s SER 135 Cb 0.06 -1.12 -0.12 0.00 -1.71 0.00 0.00 66.02 63.13 1xyx s SER 135 CO -0.08 -3.22 1.35 -2.11 1.20 0.00 0.00 173.24 170.38 1xyx n ARG 136 N -4.17 2.27 0.00 5.44 0.00 -1.26 -5.03 116.66 113.91 1xyx n ARG 136 Ca 0.10 0.80 0.00 0.00 -0.00 0.00 0.00 57.85 58.75 1xyx n ARG 136 Cb 0.59 -2.43 0.00 0.00 -0.00 0.00 0.00 32.46 30.62 1xyx n ARG 136 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 1xyx n PRO 137 N 0.47 -1.30 -3.45 2.89 -0.04 -1.26 -5.01 135.00 127.29 1xyx n PRO 137 Ca 0.04 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.23 1xyx n PRO 137 Cb 0.37 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.75 1xyx n PRO 137 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1xyx n MET 138 N -1.64 2.36 -2.01 0.54 2.81 -1.26 -5.08 117.12 112.85 1xyx n MET 138 Ca 0.00 -4.58 -0.37 0.00 -1.81 0.00 0.00 57.70 50.95 1xyx n MET 138 Cb 0.00 -2.20 0.03 0.00 -0.71 0.00 0.00 33.22 30.33 1xyx n MET 138 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1xyx s ILE 139 N -2.31 2.60 -0.48 2.02 -1.09 -1.26 -5.00 121.20 115.68 1xyx s ILE 139 Ca 0.38 0.40 0.07 0.00 -2.23 0.00 0.00 60.65 59.27 1xyx s ILE 139 Cb 0.13 -3.17 0.23 0.00 -1.58 0.00 0.00 42.46 38.07 1xyx s ILE 139 CO -0.03 -0.06 0.55 0.00 -1.23 0.00 0.00 174.94 174.17 1xyx n HIS 140 N -1.32 0.83 0.28 3.97 1.44 -1.26 -4.93 115.22 114.23 1xyx n HIS 140 Ca 0.12 -3.73 0.18 0.00 -2.01 0.00 0.00 57.72 52.29 1xyx n HIS 140 Cb 0.49 -0.33 0.92 0.00 0.12 0.00 0.00 29.99 31.19 1xyx n HIS 140 CO 0.00 0.00 0.00 0.74 -2.81 0.00 0.00 176.34 174.27 1xyx h PHE 141 N 4.39 0.00 -0.94 -1.40 -1.00 -1.99 -3.45 116.94 112.55 1xyx h PHE 141 Ca 0.14 0.00 -0.20 0.00 2.81 0.00 0.00 57.97 60.71 1xyx h PHE 141 Cb 0.82 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.33 1xyx h PHE 141 CO 0.47 0.00 -0.22 0.41 -1.61 0.00 0.00 178.31 177.35 1xyx n GLY 142 N -1.27 0.58 3.19 -1.45 0.00 -1.26 -5.01 105.19 99.97 1xyx n GLY 142 Ca -0.00 -0.52 -0.21 0.00 0.00 0.00 0.00 46.02 45.29 1xyx n GLY 142 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1xyx s ASN 143 N -2.73 1.93 -0.03 1.61 0.01 -1.26 -5.07 114.94 109.40 1xyx s ASN 143 Ca 0.00 -0.57 -0.16 0.00 -0.71 0.00 0.00 52.86 51.43 1xyx s ASN 143 Cb 0.00 -0.10 -0.09 0.00 0.41 0.00 0.00 41.25 41.47 1xyx s ASN 143 CO 0.00 0.01 0.68 0.44 -1.51 0.00 0.00 177.10 176.72 1xyx h ASP 144 N 4.52 -0.48 1.06 -1.22 5.19 -2.00 -3.07 116.42 120.42 1xyx h ASP 144 Ca -0.41 0.02 -0.08 0.00 -0.62 0.00 0.00 57.03 55.94 1xyx h ASP 144 Cb 1.18 0.12 -0.01 0.00 0.18 0.00 0.00 39.33 40.80 1xyx h ASP 144 CO 0.42 -0.08 -0.38 4.11 -3.12 0.00 0.00 179.24 180.18 1xyx h TRP 145 N -1.08 0.00 0.10 4.55 5.08 -1.98 -2.72 115.95 119.89 1xyx h TRP 145 Ca -0.06 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.91 1xyx h TRP 145 Cb 0.43 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.59 1xyx h TRP 145 CO 0.01 0.38 -0.05 0.93 -1.28 0.00 0.00 178.44 178.43 1xyx h GLU 146 N 0.00 -0.13 -0.36 0.12 5.08 -2.00 0.18 114.58 117.48 1xyx h GLU 146 Ca -0.00 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.43 1xyx h GLU 146 Cb 1.01 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.23 1xyx h GLU 146 CO 0.05 0.12 -0.01 -0.44 -1.00 0.00 0.00 179.01 177.73 1xyx h ASP 147 N -0.37 -0.17 -0.34 1.42 5.19 -1.44 -0.79 116.42 119.92 1xyx h ASP 147 Ca -0.01 0.09 0.04 0.00 -0.62 0.00 0.00 57.03 56.53 1xyx h ASP 147 Cb 0.31 0.16 -0.04 0.00 0.18 0.00 0.00 39.33 39.93 1xyx h ASP 147 CO 0.02 -0.05 0.09 -0.09 -3.12 0.00 0.00 179.24 176.10 1xyx h ARG 148 N 0.08 0.22 0.29 3.56 2.43 -1.37 -2.16 114.38 117.44 1xyx h ARG 148 Ca 0.17 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1xyx h ARG 148 Cb 0.25 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 1xyx h ARG 148 CO -0.30 0.14 -0.26 -0.92 -1.51 0.00 0.00 179.97 177.12 1xyx h TYR 149 N 0.22 -0.69 -0.26 2.20 3.20 0.69 -2.90 116.97 119.43 1xyx h TYR 149 Ca 0.15 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.07 1xyx h TYR 149 Cb 0.15 0.26 -0.04 0.00 1.54 0.00 0.00 36.73 38.65 1xyx h TYR 149 CO -0.16 -0.38 0.03 -0.92 -1.64 0.00 0.00 178.16 175.08 1xyx h TYR 150 N -0.57 0.04 -0.70 -3.82 3.20 -1.11 -1.51 116.97 112.50 1xyx h TYR 150 Ca -0.02 0.02 0.20 0.00 3.14 0.00 0.00 58.73 62.07 1xyx h TYR 150 Cb 0.52 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.78 1xyx h TYR 150 CO -0.15 -0.01 0.51 0.00 -1.64 0.00 0.00 178.16 176.87 1xyx h ARG 151 N 0.12 0.00 -0.02 1.82 3.08 -1.25 0.64 114.38 118.76 1xyx h ARG 151 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1xyx h ARG 151 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1xyx h ARG 151 CO -0.19 0.00 -0.07 0.39 -1.07 0.00 0.00 179.97 179.03 1xyx n GLU 152 N -4.28 1.78 0.00 0.04 1.02 -0.62 -4.58 120.64 114.00 1xyx n GLU 152 Ca 0.14 -1.58 0.00 0.00 -0.02 0.00 0.00 57.16 55.70 1xyx n GLU 152 Cb 0.78 -1.39 0.00 0.00 -0.02 0.00 0.00 31.44 30.81 1xyx n GLU 152 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1xyx n ASN 153 N 0.94 0.03 0.26 1.62 3.02 -0.34 -4.91 115.26 115.87 1xyx n ASN 153 Ca 0.11 -0.35 0.14 0.00 -0.03 0.00 0.00 54.58 54.46 1xyx n ASN 153 Cb 0.49 0.07 0.77 0.00 -0.61 0.00 0.00 39.78 40.50 1xyx n ASN 153 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xyx h MET 154 N 0.00 0.00 -0.01 3.52 -0.00 -1.19 -0.68 114.93 116.57 1xyx h MET 154 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1xyx h MET 154 Cb 0.14 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.74 1xyx h MET 154 CO 0.00 0.00 0.03 0.10 -0.00 0.00 0.00 176.91 177.04 1xyx h TYR 155 N 0.00 0.00 0.00 -0.10 -0.00 -1.91 -1.55 116.97 113.41 1xyx h TYR 155 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 58.73 1xyx h TYR 155 Cb 0.32 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.05 1xyx h TYR 155 CO 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 178.16 178.15 1xyx h ARG 156 N 0.00 0.00 -6.15 0.10 3.08 -1.54 -3.45 114.38 106.43 1xyx h ARG 156 Ca 0.01 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.50 1xyx h ARG 156 Cb 0.06 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.02 1xyx h ARG 156 CO -0.00 0.01 -0.60 0.71 -1.07 0.00 0.00 179.97 179.03 1xyx s TYR 157 N -3.90 2.71 1.07 3.04 2.02 -0.58 -5.12 117.35 116.59 1xyx s TYR 157 Ca -0.02 -0.29 -0.14 0.00 -0.37 0.00 0.00 57.07 56.26 1xyx s TYR 157 Cb 0.11 -1.39 0.23 0.00 -0.40 0.00 0.00 41.96 40.51 1xyx s TYR 157 CO 0.50 0.50 1.08 -1.25 -1.57 0.00 0.00 175.55 174.81 1xyx s PRO 158 N -3.75 -0.18 0.00 -1.71 0.04 -1.26 -5.00 135.00 123.13 1xyx s PRO 158 Ca 0.34 0.46 0.00 0.00 0.04 0.00 0.00 61.00 61.84 1xyx s PRO 158 Cb -0.04 -1.67 0.00 0.00 0.04 0.00 0.00 34.50 32.82 1xyx s PRO 158 CO 0.21 -3.13 0.00 -1.71 0.04 0.00 0.00 177.00 172.41 1xyx n ASN 159 N -4.45 3.16 -4.41 6.66 5.15 -1.26 -5.02 115.26 115.09 1xyx n ASN 159 Ca 0.06 -0.00 -0.21 0.00 -0.60 0.00 0.00 54.58 53.82 1xyx n ASN 159 Cb 0.57 0.63 -0.10 0.00 -0.53 0.00 0.00 39.78 40.36 1xyx n ASN 159 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1xyx s GLN 160 N -1.27 1.51 0.10 1.20 -0.21 -1.26 -1.93 119.66 117.81 1xyx s GLN 160 Ca 0.00 -1.70 0.00 0.00 0.02 0.00 0.00 55.36 53.68 1xyx s GLN 160 Cb 0.00 -1.39 -0.04 0.00 1.00 0.00 0.00 33.01 32.58 1xyx s GLN 160 CO 0.00 0.21 -0.01 0.14 -2.12 0.00 0.00 175.29 173.51 1xyx s VAL 161 N -2.79 0.39 0.04 1.09 -7.23 -1.26 -4.92 120.40 105.71 1xyx s VAL 161 Ca 0.27 -1.90 0.02 0.00 -1.81 0.00 0.00 61.98 58.56 1xyx s VAL 161 Cb -0.01 -1.79 -0.04 0.00 0.56 0.00 0.00 36.38 35.10 1xyx s VAL 161 CO 0.11 -0.75 0.06 -0.31 -0.31 0.00 0.00 175.10 173.90 1xyx s TYR 162 N -3.83 3.18 0.16 2.82 2.02 -1.26 -0.87 117.35 119.58 1xyx s TYR 162 Ca 0.15 0.11 -0.08 0.00 -0.37 0.00 0.00 57.07 56.88 1xyx s TYR 162 Cb 0.07 -1.66 0.03 0.00 -0.40 0.00 0.00 41.96 40.00 1xyx s TYR 162 CO -0.03 0.52 0.42 2.48 -1.57 0.00 0.00 175.55 177.37 1xyx n TYR 163 N 0.90 -1.45 -4.13 2.71 4.11 -0.50 -4.72 117.16 114.07 1xyx n TYR 163 Ca -0.11 -0.82 -0.22 0.00 -0.00 0.00 0.00 57.90 56.74 1xyx n TYR 163 Cb 0.52 0.41 -0.06 0.00 -0.00 0.00 0.00 39.34 40.22 1xyx n TYR 163 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.86 177.89 1xyx s ARG 164 N -2.04 2.60 0.46 -3.48 3.00 -1.26 -0.28 118.95 117.95 1xyx s ARG 164 Ca 0.09 -1.29 -0.21 0.00 0.00 0.00 0.00 55.73 54.33 1xyx s ARG 164 Cb -0.02 -2.36 -0.09 0.00 0.00 0.00 0.00 34.95 32.48 1xyx s ARG 164 CO 0.05 0.30 1.00 -1.25 0.00 0.00 0.00 175.30 175.41 1xyx s PRO 165 N -3.81 3.97 0.66 3.54 0.04 -1.26 -4.91 135.00 133.22 1xyx s PRO 165 Ca 0.34 1.27 0.33 0.00 0.04 0.00 0.00 61.00 62.98 1xyx s PRO 165 Cb -0.06 -2.13 1.78 0.00 0.04 0.00 0.00 34.50 34.13 1xyx s PRO 165 CO 0.23 -0.28 2.02 -0.24 0.04 0.00 0.00 177.00 178.77 1xyx h VAL 166 N 1.70 0.05 -0.70 -0.36 3.04 -1.96 -2.86 116.25 115.17 1xyx h VAL 166 Ca -0.49 0.00 0.08 0.00 -1.01 0.00 0.00 66.70 65.27 1xyx h VAL 166 Cb 1.20 0.74 -0.04 0.00 -2.01 0.00 0.00 31.29 31.18 1xyx h VAL 166 CO 0.60 0.00 0.46 -0.78 -1.01 0.00 0.00 177.57 176.84 1xyx h ASP 167 N 0.00 0.59 -2.11 3.17 3.58 -2.00 -3.41 116.42 116.24 1xyx h ASP 167 Ca 0.02 0.01 -0.06 0.00 0.42 0.00 0.00 57.03 57.42 1xyx h ASP 167 Cb 0.56 -0.12 -0.26 0.00 1.72 0.00 0.00 39.33 41.23 1xyx h ASP 167 CO -0.00 0.37 -0.34 -1.58 -2.88 0.00 0.00 179.24 174.81 1xyx s GLN 168 N -5.60 0.40 0.27 0.28 0.74 -1.08 -5.16 119.66 109.51 1xyx s GLN 168 Ca -0.09 0.99 -0.12 0.00 0.05 0.00 0.00 55.36 56.19 1xyx s GLN 168 Cb 0.20 0.26 0.00 0.00 1.10 0.00 0.00 33.01 34.57 1xyx s GLN 168 CO 0.77 -0.37 0.52 1.52 -0.55 0.00 0.00 175.29 177.17 1xyx s TYR 169 N 2.67 0.41 0.00 1.67 1.13 -1.26 -4.74 117.35 117.23 1xyx s TYR 169 Ca 0.03 -0.78 0.00 0.00 -1.41 0.00 0.00 57.07 54.91 1xyx s TYR 169 Cb -0.13 0.24 0.00 0.00 -1.10 0.00 0.00 41.96 40.97 1xyx s TYR 169 CO -0.15 -1.08 0.00 0.43 -2.51 0.00 0.00 175.55 172.24 1xyx n SER 170 N -0.62 0.00 -4.25 -0.18 7.64 -1.26 -5.04 113.62 109.91 1xyx n SER 170 Ca -0.02 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.54 1xyx n SER 170 Cb 0.61 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.65 1xyx n SER 170 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1xyx s ASN 171 N -0.84 3.37 0.42 6.43 0.01 -1.26 -5.01 114.94 118.06 1xyx s ASN 171 Ca 0.00 -0.50 0.08 0.00 -0.71 0.00 0.00 52.86 51.73 1xyx s ASN 171 Cb 0.00 -1.48 0.89 0.00 0.41 0.00 0.00 41.25 41.07 1xyx s ASN 171 CO 0.00 0.14 2.05 0.06 -1.51 0.00 0.00 177.10 177.83 1xyx h GLN 172 N 6.90 0.44 0.08 -0.60 -0.00 -1.98 -0.05 115.11 119.90 1xyx h GLN 172 Ca -0.25 -0.04 -0.00 0.00 -0.00 0.00 0.00 58.65 58.36 1xyx h GLN 172 Cb 1.22 -0.09 0.00 0.00 -0.00 0.00 0.00 27.48 28.61 1xyx h GLN 172 CO 0.52 0.32 -0.04 -0.97 -0.00 0.00 0.00 178.83 178.66 1xyx h ASN 173 N 0.44 -0.09 -0.56 0.06 -1.24 -1.99 0.79 115.58 112.99 1xyx h ASN 173 Ca 0.12 -0.14 -0.03 0.00 0.71 0.00 0.00 56.30 56.96 1xyx h ASN 173 Cb 0.01 0.02 -0.03 0.00 0.73 0.00 0.00 38.32 39.06 1xyx h ASN 173 CO -0.02 0.09 0.24 0.78 -1.29 0.00 0.00 177.43 177.23 1xyx h ASN 174 N -0.27 0.76 -1.01 1.15 2.35 -1.90 -2.41 115.58 114.26 1xyx h ASN 174 Ca -0.01 -0.15 0.06 0.00 -0.55 0.00 0.00 56.30 55.64 1xyx h ASN 174 Cb 0.23 -0.20 -0.06 0.00 0.05 0.00 0.00 38.32 38.34 1xyx h ASN 174 CO 0.02 0.71 0.65 0.15 -1.65 0.00 0.00 177.43 177.31 1xyx h PHE 175 N 0.77 1.22 0.47 1.19 3.04 -0.89 0.18 116.94 122.90 1xyx h PHE 175 Ca 0.19 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 62.15 1xyx h PHE 175 Cb 0.17 -0.40 -0.01 0.00 2.56 0.00 0.00 35.95 38.27 1xyx h PHE 175 CO 0.00 0.65 -0.34 0.28 -2.02 0.00 0.00 178.31 176.88 1xyx h VAL 176 N 1.21 0.00 -0.65 1.41 2.07 -0.59 -1.43 116.25 118.26 1xyx h VAL 176 Ca 0.42 0.00 0.07 0.00 0.82 0.00 0.00 66.70 68.01 1xyx h VAL 176 Cb 0.12 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.83 1xyx h VAL 176 CO -0.16 0.00 0.34 -0.74 0.02 0.00 0.00 177.57 177.03 1xyx h HIS 177 N -0.78 0.62 -0.00 1.57 -0.00 -0.98 -0.84 115.15 114.74 1xyx h HIS 177 Ca -0.06 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.33 1xyx h HIS 177 Cb 0.64 -0.18 0.00 0.00 -0.00 0.00 0.00 27.41 27.87 1xyx h HIS 177 CO -0.10 0.27 0.00 -0.25 -0.00 0.00 0.00 177.93 177.85 1xyx n ASP 178 N -4.84 0.12 -0.07 3.26 8.00 0.59 -0.70 116.55 122.91 1xyx n ASP 178 Ca 0.09 -1.18 -0.08 0.00 0.71 0.00 0.00 54.79 54.32 1xyx n ASP 178 Cb 0.20 -0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.24 1xyx n ASP 178 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xyx h VAL 180 N -1.00 0.67 -0.59 0.00 2.07 0.05 0.12 116.25 117.56 1xyx h VAL 180 Ca -0.05 -0.12 -0.10 0.00 0.82 0.00 0.00 66.70 67.24 1xyx h VAL 180 Cb 0.59 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1xyx h VAL 180 CO -0.03 0.06 -0.02 -1.13 0.02 0.00 0.00 177.57 176.47 1xyx h ASN 181 N 0.35 1.05 -0.34 0.57 -1.24 -1.18 -0.80 115.58 113.99 1xyx h ASN 181 Ca 0.35 -0.32 -0.17 0.00 0.71 0.00 0.00 56.30 56.87 1xyx h ASN 181 Cb 0.52 -0.28 -0.00 0.00 0.73 0.00 0.00 38.32 39.28 1xyx h ASN 181 CO -0.39 1.11 -0.46 0.40 -1.29 0.00 0.00 177.43 176.80 1xyx h ILE 182 N 0.96 1.27 -0.11 2.57 1.08 -1.06 0.39 117.51 122.61 1xyx h ILE 182 Ca 0.16 -1.64 -0.12 0.00 -0.39 0.00 0.00 64.86 62.88 1xyx h ILE 182 Cb 0.59 1.49 0.00 0.00 -3.07 0.00 0.00 36.82 35.83 1xyx h ILE 182 CO 0.04 0.54 -0.41 0.74 -0.69 0.00 0.00 178.15 178.37 1xyx h THR 183 N 0.73 1.38 -0.36 -0.27 2.02 -0.85 0.34 112.91 115.89 1xyx h THR 183 Ca 0.04 -1.73 0.03 0.00 0.77 0.00 0.00 66.41 65.52 1xyx h THR 183 Cb 1.06 2.16 -0.03 0.00 -1.74 0.00 0.00 68.15 69.60 1xyx h THR 183 CO 0.11 0.52 0.16 0.40 0.37 0.00 0.00 175.52 177.07 1xyx h ILE 184 N 0.06 0.95 -0.14 3.11 2.04 -1.08 -0.00 117.51 122.44 1xyx h ILE 184 Ca -0.02 -0.11 0.05 0.00 1.00 0.00 0.00 64.86 65.77 1xyx h ILE 184 Cb 1.04 0.59 -0.07 0.00 -0.74 0.00 0.00 36.82 37.65 1xyx h ILE 184 CO 0.09 0.06 -0.38 0.50 0.00 0.00 0.00 178.15 178.42 1xyx h LYS 185 N 0.33 -0.43 0.03 2.37 3.64 -0.21 0.16 116.57 122.46 1xyx h LYS 185 Ca 0.16 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.59 1xyx h LYS 185 Cb 0.10 0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.97 1xyx h LYS 185 CO -0.13 -0.29 -0.26 1.96 -2.27 0.00 0.00 179.45 178.46 1xyx h GLN 186 N -0.45 -0.40 -0.65 1.90 1.08 -0.00 0.40 115.11 116.99 1xyx h GLN 186 Ca 0.09 0.03 0.08 0.00 -1.45 0.00 0.00 58.65 57.40 1xyx h GLN 186 Cb 0.60 0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 28.08 1xyx h GLN 186 CO -0.39 -0.27 0.43 0.45 -0.95 0.00 0.00 178.83 178.11 1xyx h HIS 187 N -0.42 0.59 -0.09 2.96 3.86 -0.72 0.53 115.15 121.87 1xyx h HIS 187 Ca 0.05 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1xyx h HIS 187 Cb 0.49 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 28.76 1xyx h HIS 187 CO -0.28 0.30 0.00 2.41 0.86 0.00 0.00 177.93 181.22 1xyx n THR 188 N -4.48 0.11 0.00 2.45 -1.04 0.55 -3.75 114.28 108.12 1xyx n THR 188 Ca 0.10 -0.22 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 1xyx n THR 188 Cb 0.30 0.15 0.00 0.00 -1.82 0.00 0.00 70.33 68.95 1xyx n THR 188 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1xyx n VAL 189 N -0.09 0.00 0.12 12.58 0.31 0.13 -4.48 118.33 126.89 1xyx n VAL 189 Ca 0.16 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.57 1xyx n VAL 189 Cb 0.24 -0.17 0.38 0.00 -0.91 0.00 0.00 33.84 33.38 1xyx n VAL 189 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1xyx n THR 190 N -1.73 1.17 -0.08 2.52 5.66 0.17 -0.23 114.28 121.77 1xyx n THR 190 Ca 0.00 0.67 -0.09 0.00 -3.05 0.00 0.00 64.05 61.58 1xyx n THR 190 Cb 0.00 -1.67 -0.10 0.00 -1.55 0.00 0.00 70.33 67.01 1xyx n THR 190 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1xyx n THR 191 N -2.00 0.96 0.18 1.09 -1.04 -1.20 -4.61 114.28 107.66 1xyx n THR 191 Ca -0.01 -0.49 0.02 0.00 -2.04 0.00 0.00 64.05 61.53 1xyx n THR 191 Cb 0.09 -0.84 0.32 0.00 -1.82 0.00 0.00 70.33 68.08 1xyx n THR 191 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1xyx h THR 192 N 0.00 1.28 0.00 12.58 2.02 -0.49 -1.82 112.91 126.48 1xyx h THR 192 Ca -0.38 -1.47 0.00 0.00 0.77 0.00 0.00 66.41 65.33 1xyx h THR 192 Cb 1.74 1.80 0.00 0.00 -1.74 0.00 0.00 68.15 69.95 1xyx h THR 192 CO -0.01 0.42 0.00 1.07 0.37 0.00 0.00 175.52 177.36 1xyx n THR 193 N -3.99 0.00 0.02 3.16 5.66 0.69 -2.80 114.28 117.02 1xyx n THR 193 Ca -0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 1xyx n THR 193 Cb 0.46 -0.89 0.00 0.00 -1.55 0.00 0.00 70.33 68.35 1xyx n THR 193 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1xyx n LYS 194 N -0.94 0.00 0.00 1.09 5.02 -0.94 -5.04 118.16 117.35 1xyx n LYS 194 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 1xyx n LYS 194 Cb 0.01 -0.21 0.00 0.00 -0.02 0.00 0.00 35.03 34.81 1xyx n LYS 194 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xyx n GLY 195 N 3.42 0.00 3.18 0.72 0.00 -1.05 -5.15 105.19 106.31 1xyx n GLY 195 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1xyx n GLY 195 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xyx s GLU 196 N 0.00 2.56 0.00 1.61 2.12 -0.73 -4.94 118.70 119.32 1xyx s GLU 196 Ca 0.00 -1.17 0.00 0.00 0.36 0.00 0.00 54.97 54.16 1xyx s GLU 196 Cb 0.00 -3.11 -0.00 0.00 0.26 0.00 0.00 34.13 31.28 1xyx s GLU 196 CO 0.00 -0.54 0.00 -1.71 -0.54 0.00 0.00 175.26 172.47 1xyx n ASN 197 N 4.63 -0.00 -0.01 -1.70 2.85 -1.26 -2.20 115.26 117.57 1xyx n ASN 197 Ca -0.14 -1.01 0.00 0.00 -0.11 0.00 0.00 54.58 53.32 1xyx n ASN 197 Cb 0.44 0.01 0.00 0.00 1.24 0.00 0.00 39.78 41.47 1xyx n ASN 197 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 1xyx n PHE 198 N -0.00 0.00 -4.19 1.20 3.72 -1.26 -5.12 117.46 111.80 1xyx n PHE 198 Ca 0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.28 1xyx n PHE 198 Cb 0.00 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.44 1xyx n PHE 198 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1xyx s THR 199 N -0.65 0.20 0.40 4.37 -4.23 -1.26 -4.99 115.64 109.47 1xyx s THR 199 Ca 0.00 -1.96 0.16 0.00 -1.18 0.00 0.00 61.69 58.71 1xyx s THR 199 Cb 0.00 -2.25 0.37 0.00 1.34 0.00 0.00 72.50 71.95 1xyx s THR 199 CO 0.00 -0.28 1.83 -0.08 -0.54 0.00 0.00 174.62 175.56 1xyx h GLU 200 N 2.72 0.46 0.09 3.99 4.81 -2.03 0.24 114.58 124.86 1xyx h GLU 200 Ca -0.36 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 58.84 1xyx h GLU 200 Cb 1.22 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1xyx h GLU 200 CO 0.58 0.30 -0.04 1.15 -0.73 0.00 0.00 179.01 180.27 1xyx h THR 201 N 0.47 1.14 -0.80 0.32 2.02 -1.98 0.00 112.91 114.08 1xyx h THR 201 Ca 0.50 -1.01 0.01 0.00 0.77 0.00 0.00 66.41 66.68 1xyx h THR 201 Cb 1.16 1.77 -0.04 0.00 -1.74 0.00 0.00 68.15 69.30 1xyx h THR 201 CO -0.22 0.24 0.52 0.44 0.37 0.00 0.00 175.52 176.87 1xyx h ASP 202 N -0.60 0.92 -0.52 4.18 5.19 -1.53 0.13 116.42 124.20 1xyx h ASP 202 Ca -0.01 -0.03 -0.04 0.00 -0.62 0.00 0.00 57.03 56.33 1xyx h ASP 202 Cb 0.49 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 39.75 1xyx h ASP 202 CO 0.02 0.67 0.15 0.58 -3.12 0.00 0.00 179.24 177.55 1xyx h VAL 203 N 1.09 1.23 -0.01 -1.35 2.07 -0.55 0.16 116.25 118.89 1xyx h VAL 203 Ca 0.29 -0.79 -0.19 0.00 0.82 0.00 0.00 66.70 66.83 1xyx h VAL 203 Cb -0.11 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 1xyx h VAL 203 CO -0.06 0.29 -0.83 0.07 0.02 0.00 0.00 177.57 177.06 1xyx h LYS 204 N 0.71 0.23 -0.77 1.57 2.10 -0.48 -1.07 116.57 118.86 1xyx h LYS 204 Ca 0.17 -0.23 -0.04 0.00 -2.00 0.00 0.00 60.65 58.54 1xyx h LYS 204 Cb 0.29 0.06 -0.03 0.00 -0.90 0.00 0.00 32.23 31.64 1xyx h LYS 204 CO -0.00 0.94 0.32 0.52 -2.00 0.00 0.00 179.45 179.22 1xyx h MET 205 N 0.14 1.14 0.14 0.07 2.86 -0.54 -1.84 114.93 116.91 1xyx h MET 205 Ca -0.04 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.39 1xyx h MET 205 Cb 1.43 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 32.90 1xyx h MET 205 CO 0.13 0.92 -0.07 0.52 1.06 0.00 0.00 176.91 179.47 1xyx h MET 206 N 1.11 -0.20 -0.73 1.72 2.86 -0.90 -3.02 114.93 115.77 1xyx h MET 206 Ca 0.26 0.01 0.21 0.00 -2.06 0.00 0.00 59.70 58.12 1xyx h MET 206 Cb 0.20 0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.88 1xyx h MET 206 CO -0.02 -0.13 0.56 1.49 1.06 0.00 0.00 176.91 179.87 1xyx h GLU 207 N -0.20 0.00 0.60 1.72 4.81 -0.37 0.49 114.58 121.63 1xyx h GLU 207 Ca -0.02 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 1xyx h GLU 207 Cb 0.16 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.55 1xyx h GLU 207 CO 0.03 0.00 -0.29 0.00 -0.73 0.00 0.00 179.01 178.02 1xyx h ARG 208 N 0.00 -0.78 -0.28 1.92 2.47 -1.36 -2.58 114.38 113.77 1xyx h ARG 208 Ca 0.35 0.05 -0.17 0.00 -1.26 0.00 0.00 59.98 58.95 1xyx h ARG 208 Cb 1.46 0.18 -0.00 0.00 -1.65 0.00 0.00 29.97 29.96 1xyx h ARG 208 CO -0.00 -0.49 -0.48 -0.39 0.56 0.00 0.00 179.97 179.16 1xyx h VAL 209 N -1.17 1.28 0.00 2.04 -1.51 -0.97 0.82 116.25 116.74 1xyx h VAL 209 Ca -0.08 -1.67 0.00 0.00 -1.23 0.00 0.00 66.70 63.72 1xyx h VAL 209 Cb 0.65 1.64 0.00 0.00 -2.13 0.00 0.00 31.29 31.45 1xyx h VAL 209 CO 0.14 0.54 0.00 0.52 -1.23 0.00 0.00 177.57 177.54 1xyx n VAL 210 N -4.08 0.92 0.00 7.19 0.31 0.16 -0.59 118.33 122.23 1xyx n VAL 210 Ca -0.04 0.43 0.00 0.00 -0.01 0.00 0.00 64.34 64.72 1xyx n VAL 210 Cb 0.59 -1.39 0.00 0.00 -0.91 0.00 0.00 33.84 32.13 1xyx n VAL 210 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1xyx n GLU 211 N -2.25 0.00 -0.30 5.55 2.13 -0.97 -4.21 120.64 120.58 1xyx n GLU 211 Ca 0.01 0.34 0.04 0.00 0.66 0.00 0.00 57.16 58.21 1xyx n GLU 211 Cb 0.15 -0.84 0.24 0.00 0.27 0.00 0.00 31.44 31.27 1xyx n GLU 211 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 1xyx h GLN 212 N 0.00 1.00 -0.31 5.31 1.08 -0.25 0.85 115.11 122.79 1xyx h GLN 212 Ca 0.00 -0.06 0.06 0.00 -1.45 0.00 0.00 58.65 57.20 1xyx h GLN 212 Cb 0.00 -0.22 -0.06 0.00 -0.05 0.00 0.00 27.48 27.15 1xyx h GLN 212 CO 0.00 0.66 -0.05 0.52 -0.95 0.00 0.00 178.83 179.01 1xyx h MET 213 N 1.03 0.02 0.00 1.46 2.86 -1.10 -0.75 114.93 118.45 1xyx h MET 213 Ca 0.39 -0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.87 1xyx h MET 213 Cb 0.20 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.84 1xyx h MET 213 CO -0.15 0.02 -0.77 0.00 1.06 0.00 0.00 176.91 177.06 1xyx h VAL 215 N 0.00 0.47 0.17 0.00 2.07 -1.04 0.46 116.25 118.39 1xyx h VAL 215 Ca -0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1xyx h VAL 215 Cb 1.54 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 1xyx h VAL 215 CO 0.10 0.00 -0.08 0.74 0.02 0.00 0.00 177.57 178.35 1xyx h THR 216 N -0.36 0.85 -0.65 2.57 2.02 -0.86 -1.09 112.91 115.39 1xyx h THR 216 Ca 0.06 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 1xyx h THR 216 Cb 0.44 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 67.73 1xyx h THR 216 CO -0.20 0.02 0.38 -0.61 0.37 0.00 0.00 175.52 175.49 1xyx h GLN 217 N -0.28 0.88 0.00 6.66 5.75 -0.52 0.22 115.11 127.82 1xyx h GLN 217 Ca -0.02 -0.08 0.01 0.00 -0.15 0.00 0.00 58.65 58.40 1xyx h GLN 217 Cb 0.22 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.57 1xyx h GLN 217 CO 0.04 0.64 -0.06 -0.92 -2.65 0.00 0.00 178.83 175.88 1xyx h TYR 218 N 0.88 -0.16 -0.32 3.99 3.20 -0.86 -2.52 116.97 121.17 1xyx h TYR 218 Ca 0.23 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.14 1xyx h TYR 218 Cb -0.01 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 1xyx h TYR 218 CO -0.01 -0.10 0.22 1.96 -1.64 0.00 0.00 178.16 178.58 1xyx h GLN 219 N -0.11 0.31 0.41 1.82 4.20 -0.35 0.06 115.11 121.44 1xyx h GLN 219 Ca 0.03 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 1xyx h GLN 219 Cb 0.14 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.86 1xyx h GLN 219 CO -0.07 0.20 -0.19 0.87 -0.67 0.00 0.00 178.83 178.97 1xyx h LYS 220 N 0.32 -0.52 -0.44 1.46 1.57 -0.23 0.13 116.57 118.84 1xyx h LYS 220 Ca 0.13 0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.83 1xyx h LYS 220 Cb 0.14 0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1xyx h LYS 220 CO -0.03 -0.33 -0.21 0.93 -0.57 0.00 0.00 179.45 179.24 1xyx h GLU 221 N -0.57 0.88 -0.27 3.15 4.39 -0.99 -2.27 114.58 118.91 1xyx h GLU 221 Ca -0.06 -0.36 -0.07 0.00 0.34 0.00 0.00 59.36 59.22 1xyx h GLU 221 Cb 0.43 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 1xyx h GLU 221 CO 0.09 1.01 -0.10 0.66 -1.16 0.00 0.00 179.01 179.51 1xyx h SER 222 N 0.77 0.55 0.20 1.42 4.64 -0.93 -2.23 113.55 117.97 1xyx h SER 222 Ca 0.11 -0.39 -0.03 0.00 -0.47 0.00 0.00 61.79 61.00 1xyx h SER 222 Cb 0.75 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1xyx h SER 222 CO 0.06 0.82 -0.16 -0.61 -0.87 0.00 0.00 176.83 176.07 1xyx h GLN 223 N 0.29 0.00 0.14 4.77 4.15 -0.92 0.13 115.11 123.66 1xyx h GLN 223 Ca 0.06 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.49 1xyx h GLN 223 Cb 0.59 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.27 1xyx h GLN 223 CO 0.03 0.16 -0.13 0.00 -1.93 0.00 0.00 178.83 176.96 1xyx h ALA 224 N 1.84 -0.25 -0.20 3.38 0.00 -1.06 -0.73 119.26 122.25 1xyx h ALA 224 Ca -0.00 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.91 1xyx h ALA 224 Cb 0.30 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1xyx h ALA 224 CO 0.02 -0.66 -0.03 -0.92 0.00 0.00 0.00 179.25 177.66 1xyx h TYR 225 N -0.28 -0.06 -0.14 0.00 5.03 -0.64 -1.60 116.97 119.26 1xyx h TYR 225 Ca 0.00 0.02 -0.08 0.00 2.58 0.00 0.00 58.73 61.25 1xyx h TYR 225 Cb 0.27 0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.59 1xyx h TYR 225 CO -0.12 -0.06 -0.27 1.88 -1.32 0.00 0.00 178.16 178.27 1xyx h TYR 226 N 0.03 0.30 -0.06 -3.82 0.05 -0.68 -2.09 116.97 110.69 1xyx h TYR 226 Ca 0.09 -0.06 -0.18 0.00 0.05 0.00 0.00 58.73 58.64 1xyx h TYR 226 Cb 0.13 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 37.79 1xyx h TYR 226 CO -0.20 0.52 -0.74 -0.44 -1.05 0.00 0.00 178.16 176.26 1xyx h ASP 227 N 0.24 0.42 0.00 3.88 3.32 -0.99 -3.37 116.42 119.91 1xyx h ASP 227 Ca 0.04 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 56.81 1xyx h ASP 227 Cb 0.61 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1xyx h ASP 227 CO 0.04 1.02 0.00 0.61 -1.72 0.00 0.00 179.24 179.19 1xyx n GLY 228 N 0.57 0.09 0.06 2.75 0.00 -0.62 -1.62 105.19 106.42 1xyx n GLY 228 Ca -0.04 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.02 1xyx n GLY 228 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1xyx n ARG 229 N -0.06 1.89 -3.79 1.61 -4.01 -1.26 -4.86 116.66 106.18 1xyx n ARG 229 Ca 0.00 -1.77 -0.31 0.00 -1.04 0.00 0.00 57.85 54.73 1xyx n ARG 229 Cb 0.04 -1.10 -0.10 0.00 -3.04 0.00 0.00 32.46 28.26 1xyx n ARG 229 CO 0.00 0.00 0.00 1.03 -3.04 0.00 0.00 177.63 175.62 1xyx s ARG 230 N -1.52 2.79 0.00 2.89 1.81 -0.64 -4.94 118.95 119.34 1xyx s ARG 230 Ca 0.12 -3.31 0.00 0.00 -1.72 0.00 0.00 55.73 50.82 1xyx s ARG 230 Cb 0.10 -3.65 0.00 0.00 -0.45 0.00 0.00 34.95 30.96 1xyx s ARG 230 CO 0.01 -1.27 0.44 -1.13 -0.68 0.00 0.00 175.30 172.67 1xyx n SER 231 N 2.14 1.07 0.00 0.23 3.41 -1.26 -5.13 113.62 114.08 1xyx n SER 231 Ca 0.20 -1.41 0.00 0.00 -0.26 0.00 0.00 58.87 57.40 1xyx n SER 231 Cb 0.36 -0.35 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 1xyx n SER 231 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68