#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1whr s SER 127 N 0.00 2.77 -0.22 1.61 1.04 -1.26 -5.11 113.70 112.53 1whr s SER 127 Ca 0.00 -0.46 -0.04 0.00 0.48 0.00 0.00 55.95 55.93 1whr s SER 127 Cb 0.00 -0.74 0.09 0.00 0.10 0.00 0.00 66.02 65.47 1whr s SER 127 CO 0.00 0.22 0.16 -0.94 0.98 0.00 0.00 173.24 173.66 1whr s SER 128 N -0.12 2.31 -0.10 7.02 1.04 -1.26 -5.14 113.70 117.44 1whr s SER 128 Ca -0.03 -0.69 -0.02 0.00 0.48 0.00 0.00 55.95 55.68 1whr s SER 128 Cb -0.13 -0.02 -0.03 0.00 0.10 0.00 0.00 66.02 65.94 1whr s SER 128 CO 0.03 -0.37 -0.00 -0.83 0.98 0.00 0.00 173.24 173.05 1whr s GLY 129 N 2.20 1.83 0.06 7.32 0.00 -1.26 -5.08 107.32 112.39 1whr s GLY 129 Ca 0.06 -0.81 -0.19 0.00 0.00 0.00 0.00 44.72 43.78 1whr s GLY 129 CO -0.19 -0.44 0.57 -1.35 0.00 0.00 0.00 173.10 171.69 1whr s SER 130 N -0.56 7.06 -0.67 1.64 1.04 -1.26 -4.99 113.70 115.96 1whr s SER 130 Ca 0.09 1.25 -0.01 0.00 0.48 0.00 0.00 55.95 57.76 1whr s SER 130 Cb -0.12 -2.36 0.43 0.00 0.10 0.00 0.00 66.02 64.07 1whr s SER 130 CO 0.02 0.25 1.94 -0.24 0.98 0.00 0.00 173.24 176.20 1whr n SER 131 N 1.84 7.37 -3.45 7.02 2.88 -1.26 -4.94 113.62 123.08 1whr n SER 131 Ca -0.10 -3.80 -0.37 0.00 -1.33 0.00 0.00 58.87 53.28 1whr n SER 131 Cb 0.51 -0.94 0.04 0.00 -0.75 0.00 0.00 64.21 63.07 1whr n SER 131 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1whr n GLY 132 N -0.80 0.05 3.18 0.46 0.00 -1.26 -4.91 105.19 101.90 1whr n GLY 132 Ca 0.59 1.17 -0.40 0.00 0.00 0.00 0.00 46.02 47.38 1whr n GLY 132 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1whr s THR 133 N -1.56 4.29 -1.49 2.61 -4.23 -1.26 -4.68 115.64 109.32 1whr s THR 133 Ca 0.37 -2.65 -0.10 0.00 -1.18 0.00 0.00 61.69 58.13 1whr s THR 133 Cb -0.04 -3.75 0.07 0.00 1.34 0.00 0.00 72.50 70.11 1whr s THR 133 CO 0.86 -0.90 0.88 0.47 -0.54 0.00 0.00 174.62 175.39 1whr n ASP 134 N 3.83 -3.65 -2.08 3.99 9.92 -1.26 -4.85 116.55 122.45 1whr n ASP 134 Ca 0.07 -0.82 -0.23 0.00 -0.53 0.00 0.00 54.79 53.28 1whr n ASP 134 Cb 0.41 -3.79 0.04 0.00 -0.64 0.00 0.00 41.12 37.14 1whr n ASP 134 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1whr n SER 135 N -2.88 6.82 -3.70 -2.24 3.41 -1.26 -4.82 113.62 108.95 1whr n SER 135 Ca -0.05 -3.28 -0.11 0.00 -0.26 0.00 0.00 58.87 55.17 1whr n SER 135 Cb 0.57 -1.06 -0.12 0.00 -0.26 0.00 0.00 64.21 63.34 1whr n SER 135 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1whr s THR 136 N -3.00 -0.18 0.00 6.66 -4.23 -1.26 -4.97 115.64 108.66 1whr s THR 136 Ca 0.43 0.15 0.00 0.00 -1.18 0.00 0.00 61.69 61.09 1whr s THR 136 Cb 0.33 -0.52 0.00 0.00 1.34 0.00 0.00 72.50 73.65 1whr s THR 136 CO -0.04 0.06 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 1whr n GLY 137 N 4.57 2.98 3.42 3.99 0.00 -1.26 -5.10 105.19 113.80 1whr n GLY 137 Ca -0.19 -0.45 -0.62 0.00 0.00 0.00 0.00 46.02 44.75 1whr n GLY 137 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1whr n ILE 138 N 0.00 0.00 -2.14 -0.61 5.41 -1.26 -4.77 119.36 115.99 1whr n ILE 138 Ca 0.00 0.00 -0.39 0.00 1.00 0.00 0.00 62.75 63.36 1whr n ILE 138 Cb 0.00 -0.46 -0.03 0.00 -0.71 0.00 0.00 39.64 38.44 1whr n ILE 138 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1whr s ASP 139 N 3.05 5.50 -0.18 4.38 1.01 -1.26 -4.81 116.67 124.36 1whr s ASP 139 Ca 0.98 0.27 -0.14 0.00 0.71 0.00 0.00 52.55 54.37 1whr s ASP 139 Cb -1.39 -2.54 -0.09 0.00 1.01 0.00 0.00 42.92 39.92 1whr s ASP 139 CO 0.74 -2.21 -0.11 0.18 0.21 0.00 0.00 175.17 173.98 1whr n LEU 140 N 11.87 1.86 -0.37 1.23 4.77 -1.26 -4.23 117.00 130.87 1whr n LEU 140 Ca 0.17 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.66 1whr n LEU 140 Cb 0.51 -0.87 0.06 0.00 -2.33 0.00 0.00 43.42 40.78 1whr n LEU 140 CO 0.71 -0.13 0.59 1.57 -1.33 0.00 0.00 177.39 178.80 1whr n HIS 141 N -4.50 0.08 -0.15 -1.77 -0.00 -1.26 -0.80 115.22 106.82 1whr n HIS 141 Ca -0.20 1.21 -0.13 0.00 0.46 0.00 0.00 57.72 59.06 1whr n HIS 141 Cb 0.48 -0.90 -0.09 0.00 -0.12 0.00 0.00 29.99 29.36 1whr n HIS 141 CO 0.00 0.00 0.00 0.93 0.46 0.00 0.00 176.34 177.73 1whr h GLU 142 N 0.00 -0.32 -0.05 1.57 5.08 -1.98 -0.22 114.58 118.65 1whr h GLU 142 Ca 0.36 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.78 1whr h GLU 142 Cb 0.61 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.89 1whr h GLU 142 CO -0.98 -0.22 -0.23 0.35 -1.00 0.00 0.00 179.01 176.93 1whr h PHE 143 N -0.34 -0.61 -0.31 4.33 3.04 -1.14 -1.49 116.94 120.42 1whr h PHE 143 Ca 0.07 0.02 0.03 0.00 3.98 0.00 0.00 57.97 62.08 1whr h PHE 143 Cb 0.53 0.28 -0.05 0.00 2.56 0.00 0.00 35.95 39.27 1whr h PHE 143 CO -0.75 -0.32 -0.35 -0.07 -2.02 0.00 0.00 178.31 174.81 1whr h LEU 144 N -0.34 -1.19 -0.59 0.59 3.38 -0.28 0.18 115.31 117.05 1whr h LEU 144 Ca 0.08 0.16 0.12 0.00 0.09 0.00 0.00 57.88 58.33 1whr h LEU 144 Cb 0.44 0.50 -0.10 0.00 0.09 0.00 0.00 40.66 41.58 1whr h LEU 144 CO -0.24 -0.24 -0.04 0.58 0.09 0.00 0.00 178.44 178.59 1whr h VAL 145 N -0.21 0.48 -0.48 1.22 2.07 -0.90 -0.82 116.25 117.61 1whr h VAL 145 Ca 0.05 -0.03 0.09 0.00 0.82 0.00 0.00 66.70 67.64 1whr h VAL 145 Cb 0.35 0.39 -0.08 0.00 -1.52 0.00 0.00 31.29 30.43 1whr h VAL 145 CO -0.40 0.01 -0.05 0.78 0.02 0.00 0.00 177.57 177.93 1whr h ASN 146 N 0.08 -0.31 -1.01 0.57 2.35 -0.11 0.33 115.58 117.48 1whr h ASN 146 Ca 0.30 0.13 0.05 0.00 -0.55 0.00 0.00 56.30 56.24 1whr h ASN 146 Cb 0.48 0.24 -0.06 0.00 0.05 0.00 0.00 38.32 39.03 1whr h ASN 146 CO -0.54 -0.11 0.65 0.74 -1.65 0.00 0.00 177.43 176.53 1whr h THR 147 N 0.06 1.12 0.00 2.81 2.02 0.39 0.11 112.91 119.42 1whr h THR 147 Ca 0.24 -0.42 0.00 0.00 0.77 0.00 0.00 66.41 67.00 1whr h THR 147 Cb 0.36 -0.20 0.00 0.00 -1.74 0.00 0.00 68.15 66.57 1whr h THR 147 CO -0.44 0.22 0.00 -0.07 0.37 0.00 0.00 175.52 175.60 1whr h LEU 148 N 1.22 0.00 0.00 2.58 3.38 -0.36 0.39 115.31 122.52 1whr h LEU 148 Ca 0.42 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.36 1whr h LEU 148 Cb 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1whr h LEU 148 CO -0.16 0.00 -0.32 0.11 0.09 0.00 0.00 178.44 178.16 1whr h LYS 149 N 0.00 0.00 -0.07 1.13 1.79 0.15 -3.29 116.57 116.27 1whr h LYS 149 Ca 0.00 0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 58.24 1whr h LYS 149 Cb 0.72 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.38 1whr h LYS 149 CO 0.00 0.31 -0.86 0.87 -1.08 0.00 0.00 179.45 178.69 1whr h LYS 150 N -1.00 0.62 -3.22 3.15 1.57 -0.98 -3.38 116.57 113.33 1whr h LYS 150 Ca -0.05 -0.57 -0.65 0.00 -1.87 0.00 0.00 60.65 57.51 1whr h LYS 150 Cb 0.50 0.14 -0.39 0.00 0.08 0.00 0.00 32.23 32.55 1whr h LYS 150 CO -0.03 1.18 -0.43 -0.80 -0.57 0.00 0.00 179.45 178.81 1whr s ASN 151 N -7.12 5.13 0.20 0.86 -0.87 0.13 -4.90 114.94 108.38 1whr s ASN 151 Ca -0.08 -3.65 0.22 0.00 -1.57 0.00 0.00 52.86 47.77 1whr s ASN 151 Cb 0.09 -1.73 0.90 0.00 -0.02 0.00 0.00 41.25 40.49 1whr s ASN 151 CO 0.89 -0.15 1.66 -0.81 -2.57 0.00 0.00 177.10 176.11 1whr n PRO 152 N 2.32 0.15 0.00 -0.60 -0.04 -1.24 -2.43 135.00 133.17 1whr n PRO 152 Ca 0.18 0.39 -0.02 0.00 -0.04 0.00 0.00 63.50 64.01 1whr n PRO 152 Cb 0.35 -1.79 -0.11 0.00 -0.04 0.00 0.00 33.50 31.91 1whr n PRO 152 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1whr n ARG 153 N -2.08 0.63 -0.12 0.54 1.85 -1.26 -4.11 116.66 112.12 1whr n ARG 153 Ca 0.02 0.18 -0.01 0.00 -1.00 0.00 0.00 57.85 57.05 1whr n ARG 153 Cb 0.21 -1.75 0.25 0.00 -1.05 0.00 0.00 32.46 30.13 1whr n ARG 153 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 1whr h ASP 154 N 0.00 0.72 -0.76 2.89 5.19 -1.79 -2.98 116.42 119.69 1whr h ASP 154 Ca -0.22 -0.08 0.21 0.00 -0.62 0.00 0.00 57.03 56.31 1whr h ASP 154 Cb 1.70 -0.18 -0.14 0.00 0.18 0.00 0.00 39.33 40.89 1whr h ASP 154 CO 0.05 0.64 0.02 -2.11 -3.12 0.00 0.00 179.24 174.71 1whr n ARG 155 N -4.34 -0.06 -0.29 3.56 1.85 -1.24 -0.26 116.66 115.88 1whr n ARG 155 Ca 0.05 1.13 -0.05 0.00 -1.00 0.00 0.00 57.85 57.98 1whr n ARG 155 Cb 0.15 -1.80 -0.03 0.00 -1.05 0.00 0.00 32.46 29.73 1whr n ARG 155 CO 0.00 0.00 0.00 -1.33 -0.01 0.00 0.00 177.63 176.29 1whr n MET 156 N -5.05 -0.25 0.11 2.89 2.81 -1.13 0.24 117.12 116.75 1whr n MET 156 Ca 0.18 1.07 -0.13 0.00 -1.81 0.00 0.00 57.70 57.01 1whr n MET 156 Cb 0.58 -1.58 -0.08 0.00 -0.71 0.00 0.00 33.22 31.43 1whr n MET 156 CO 0.00 0.00 0.00 1.98 1.51 0.00 0.00 175.97 179.46 1whr h MET 157 N 0.00 -0.26 -0.17 0.03 1.85 -0.88 -2.28 114.93 113.22 1whr h MET 157 Ca 0.17 0.02 0.03 0.00 -0.61 0.00 0.00 59.70 59.30 1whr h MET 157 Cb 0.34 0.06 -0.05 0.00 0.43 0.00 0.00 31.60 32.39 1whr h MET 157 CO -0.68 0.01 -0.36 -0.07 -0.40 0.00 0.00 176.91 175.42 1whr h LEU 158 N -0.52 -1.17 -0.08 3.39 3.38 -0.40 -1.40 115.31 118.51 1whr h LEU 158 Ca -0.03 0.15 0.02 0.00 0.09 0.00 0.00 57.88 58.11 1whr h LEU 158 Cb 0.39 0.47 -0.05 0.00 0.09 0.00 0.00 40.66 41.56 1whr h LEU 158 CO 0.05 -0.29 -0.43 -0.07 0.09 0.00 0.00 178.44 177.79 1whr h LEU 159 N -0.33 -1.34 -0.90 1.67 3.38 -0.28 -0.88 115.31 116.63 1whr h LEU 159 Ca 0.03 0.16 0.28 0.00 0.09 0.00 0.00 57.88 58.44 1whr h LEU 159 Cb 0.42 0.52 -0.17 0.00 0.09 0.00 0.00 40.66 41.52 1whr h LEU 159 CO -0.33 -0.39 0.14 0.29 0.09 0.00 0.00 178.44 178.24 1whr n LYS 160 N -4.81 -0.07 -0.21 1.13 5.02 -0.86 0.23 118.16 118.59 1whr n LYS 160 Ca -0.05 1.33 -0.06 0.00 -2.02 0.00 0.00 58.31 57.51 1whr n LYS 160 Cb 0.30 -2.18 0.10 0.00 -0.02 0.00 0.00 35.03 33.23 1whr n LYS 160 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1whr h LEU 161 N 0.00 0.97 0.12 -0.35 3.38 -0.06 -0.84 115.31 118.54 1whr h LEU 161 Ca 0.61 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.38 1whr h LEU 161 Cb 1.37 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1whr h LEU 161 CO -0.81 0.94 -0.06 -0.08 0.09 0.00 0.00 178.44 178.52 1whr h GLU 162 N 0.99 -0.16 -1.01 1.13 4.57 0.36 -2.27 114.58 118.19 1whr h GLU 162 Ca 0.21 0.01 0.07 0.00 -1.18 0.00 0.00 59.36 58.47 1whr h GLU 162 Cb 0.34 0.04 -0.07 0.00 -0.16 0.00 0.00 28.75 28.90 1whr h GLU 162 CO 0.00 0.26 0.65 -0.56 -1.18 0.00 0.00 179.01 178.18 1whr h GLN 163 N -0.64 1.12 -0.26 1.92 3.07 -0.68 0.11 115.11 119.75 1whr h GLN 163 Ca -0.02 -0.07 -0.02 0.00 0.09 0.00 0.00 58.65 58.64 1whr h GLN 163 Cb 0.49 -0.25 -0.01 0.00 0.08 0.00 0.00 27.48 27.79 1whr h GLN 163 CO 0.03 0.74 0.10 0.93 0.09 0.00 0.00 178.83 180.72 1whr h GLU 164 N 1.15 0.39 -0.17 0.06 5.08 -1.15 -2.44 114.58 117.50 1whr h GLU 164 Ca 0.44 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.71 1whr h GLU 164 Cb 0.22 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1whr h GLU 164 CO -0.19 0.43 0.02 0.82 -1.00 0.00 0.00 179.01 179.09 1whr h ILE 165 N 0.27 1.23 -0.02 3.13 2.04 -0.78 -2.06 117.51 121.32 1whr h ILE 165 Ca 0.09 -0.74 0.02 0.00 1.00 0.00 0.00 64.86 65.22 1whr h ILE 165 Cb 0.18 1.39 -0.05 0.00 -0.74 0.00 0.00 36.82 37.60 1whr h ILE 165 CO -0.01 0.22 -0.48 -0.07 0.00 0.00 0.00 178.15 177.82 1whr h LEU 166 N 0.07 -1.50 -1.02 1.44 3.38 -0.75 0.89 115.31 117.82 1whr h LEU 166 Ca 0.05 0.17 0.11 0.00 0.09 0.00 0.00 57.88 58.30 1whr h LEU 166 Cb 0.32 0.57 -0.08 0.00 0.09 0.00 0.00 40.66 41.56 1whr h LEU 166 CO 0.00 -0.46 0.64 -0.33 0.09 0.00 0.00 178.44 178.38 1whr h GLU 167 N -0.59 0.99 -0.14 1.13 5.08 -1.48 -1.85 114.58 117.73 1whr h GLU 167 Ca 0.01 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1whr h GLU 167 Cb 0.64 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 1whr h GLU 167 CO -0.33 0.66 0.01 0.35 -1.00 0.00 0.00 179.01 178.69 1whr h PHE 168 N 1.02 0.02 -0.40 4.33 3.57 -0.49 -2.18 116.94 122.81 1whr h PHE 168 Ca 0.49 0.01 0.03 0.00 3.53 0.00 0.00 57.97 62.02 1whr h PHE 168 Cb 0.44 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.16 1whr h PHE 168 CO -0.00 -0.00 0.21 0.82 -2.23 0.00 0.00 178.31 177.11 1whr h ILE 169 N 0.06 0.99 -0.78 1.41 2.04 -0.10 -2.40 117.51 118.75 1whr h ILE 169 Ca 0.06 -0.15 0.12 0.00 1.00 0.00 0.00 64.86 65.89 1whr h ILE 169 Cb 0.07 0.53 -0.08 0.00 -0.74 0.00 0.00 36.82 36.59 1whr h ILE 169 CO -0.10 0.08 0.39 -1.13 0.00 0.00 0.00 178.15 177.39 1whr h ASN 170 N 0.43 0.48 -3.21 1.72 -1.24 -1.07 -3.40 115.58 109.29 1whr h ASN 170 Ca 0.17 0.08 -0.54 0.00 0.71 0.00 0.00 56.30 56.72 1whr h ASN 170 Cb 0.06 -0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.10 1whr h ASN 170 CO -0.11 0.24 0.55 -0.62 -1.29 0.00 0.00 177.43 176.20 1whr s ASP 171 N -5.47 7.12 -0.12 1.15 2.15 -0.85 -4.94 116.67 115.71 1whr s ASP 171 Ca -0.12 1.94 -0.05 0.00 0.43 0.00 0.00 52.55 54.75 1whr s ASP 171 Cb 0.20 -2.57 -0.26 0.00 -0.30 0.00 0.00 42.92 39.99 1whr s ASP 171 CO 0.77 -0.45 0.35 -0.46 -0.17 0.00 0.00 175.17 175.21 1whr n ASN 172 N 4.08 2.06 -0.33 -0.34 6.94 -1.26 -4.18 115.26 122.22 1whr n ASN 172 Ca 0.09 0.20 0.27 0.00 -0.02 0.00 0.00 54.58 55.12 1whr n ASN 172 Cb 0.47 -0.80 0.52 0.00 -2.36 0.00 0.00 39.78 37.61 1whr n ASN 172 CO 0.00 0.00 0.00 -1.13 -1.03 0.00 0.00 177.26 175.10 1whr h ASN 173 N 0.07 0.41 -3.43 0.53 -1.24 -1.94 -3.35 115.58 106.62 1whr h ASN 173 Ca -0.42 0.22 -0.59 0.00 0.71 0.00 0.00 56.30 56.22 1whr h ASN 173 Cb 2.03 0.20 -0.10 0.00 0.73 0.00 0.00 38.32 41.19 1whr h ASN 173 CO 0.08 -0.28 0.03 0.20 -1.29 0.00 0.00 177.43 176.17 1whr s ASN 174 N -4.73 6.65 -0.09 1.15 -0.87 -1.26 -4.93 114.94 110.86 1whr s ASN 174 Ca -0.10 0.78 0.16 0.00 -1.57 0.00 0.00 52.86 52.13 1whr s ASN 174 Cb 0.32 -2.32 -0.23 0.00 -0.02 0.00 0.00 41.25 38.99 1whr s ASN 174 CO 0.78 -0.21 0.23 0.00 -2.57 0.00 0.00 177.10 175.34 1whr n GLN 175 N 4.78 0.93 -4.11 -0.60 6.02 -1.26 -4.91 117.38 118.23 1whr n GLN 175 Ca -0.03 -0.09 -0.14 0.00 -0.01 0.00 0.00 57.00 56.73 1whr n GLN 175 Cb 0.50 -1.41 -0.11 0.00 1.02 0.00 0.00 30.24 30.24 1whr n GLN 175 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1whr s PHE 176 N -2.82 0.86 -0.04 1.08 0.40 -1.26 -3.00 117.98 113.20 1whr s PHE 176 Ca -0.07 -0.55 -0.01 0.00 -0.60 0.00 0.00 56.93 55.70 1whr s PHE 176 Cb 0.08 -0.50 0.03 0.00 0.51 0.00 0.00 43.02 43.14 1whr s PHE 176 CO 0.69 -0.05 0.02 0.21 0.70 0.00 0.00 175.22 176.79 1whr s LYS 177 N -1.98 0.26 -0.20 0.44 2.20 -0.93 -5.02 119.74 114.51 1whr s LYS 177 Ca -0.04 0.18 -0.04 0.00 -0.36 0.00 0.00 55.97 55.70 1whr s LYS 177 Cb -0.08 -0.61 -0.02 0.00 -1.51 0.00 0.00 37.83 35.61 1whr s LYS 177 CO 0.00 -0.24 -0.02 0.21 -0.36 0.00 0.00 175.35 174.95 1whr s LYS 178 N 1.60 3.54 0.36 4.03 2.20 -1.26 -1.65 119.74 128.57 1whr s LYS 178 Ca -0.02 -0.56 -0.08 0.00 -0.36 0.00 0.00 55.97 54.96 1whr s LYS 178 Cb -0.13 -3.03 -0.06 0.00 -1.51 0.00 0.00 37.83 33.11 1whr s LYS 178 CO -0.03 -0.02 0.68 -0.06 -0.36 0.00 0.00 175.35 175.56 1whr s PHE 179 N 1.07 3.48 0.71 4.03 0.08 -1.14 -5.05 117.98 121.16 1whr s PHE 179 Ca 0.02 0.85 -0.13 0.00 0.12 0.00 0.00 56.93 57.79 1whr s PHE 179 Cb -0.14 -2.28 0.03 0.00 -0.57 0.00 0.00 43.02 40.05 1whr s PHE 179 CO 0.01 -0.00 1.10 -1.25 -0.10 0.00 0.00 175.22 174.98 1whr s PRO 180 N -3.80 2.53 0.08 0.24 0.04 -1.26 -4.48 135.00 128.35 1whr s PRO 180 Ca 0.48 1.28 -0.28 0.00 0.04 0.00 0.00 61.00 62.52 1whr s PRO 180 Cb -0.10 -1.92 -0.15 0.00 0.04 0.00 0.00 34.50 32.36 1whr s PRO 180 CO 0.32 -1.44 0.66 1.04 0.04 0.00 0.00 177.00 177.62 1whr n GLN 181 N -2.95 0.00 -4.33 4.56 6.02 -1.26 -4.85 117.38 114.57 1whr n GLN 181 Ca 0.10 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.91 1whr n GLN 181 Cb 0.52 -1.03 -0.10 0.00 1.02 0.00 0.00 30.24 30.65 1whr n GLN 181 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1whr s MET 182 N -0.39 1.28 0.44 -1.09 -1.94 -1.26 -5.10 119.30 111.24 1whr s MET 182 Ca 0.64 -1.59 0.08 0.00 -1.71 0.00 0.00 55.69 53.11 1whr s MET 182 Cb -0.91 -0.90 0.00 0.00 2.01 0.00 0.00 34.83 35.04 1whr s MET 182 CO 0.46 0.09 0.48 0.95 -0.01 0.00 0.00 175.02 176.99 1whr s THR 183 N -3.15 2.64 0.05 2.05 -4.23 -1.26 -4.85 115.64 106.88 1whr s THR 183 Ca 0.23 -1.22 -0.10 0.00 -1.18 0.00 0.00 61.69 59.42 1whr s THR 183 Cb 0.02 -2.86 -0.02 0.00 1.34 0.00 0.00 72.50 70.98 1whr s THR 183 CO 0.06 0.00 1.17 0.77 -0.54 0.00 0.00 174.62 176.08 1whr h SER 184 N 0.81 -0.66 -0.58 3.99 4.64 -2.02 0.43 113.55 120.17 1whr h SER 184 Ca -0.40 0.10 0.11 0.00 -0.47 0.00 0.00 61.79 61.13 1whr h SER 184 Cb 1.28 0.29 -0.11 0.00 -0.31 0.00 0.00 62.40 63.54 1whr h SER 184 CO 0.52 -0.08 -0.24 0.22 -0.87 0.00 0.00 176.83 176.38 1whr h TYR 185 N -0.02 -0.60 -0.00 4.77 5.03 -2.00 -2.42 116.97 121.72 1whr h TYR 185 Ca 0.04 0.06 0.00 0.00 2.58 0.00 0.00 58.73 61.42 1whr h TYR 185 Cb 0.14 0.35 -0.00 0.00 1.55 0.00 0.00 36.73 38.77 1whr h TYR 185 CO -0.90 -0.33 -0.01 0.45 -1.32 0.00 0.00 178.16 176.05 1whr h HIS 186 N -0.09 -0.03 -0.78 -3.82 3.86 -1.47 -2.06 115.15 110.76 1whr h HIS 186 Ca 0.26 0.00 0.10 0.00 -1.16 0.00 0.00 60.37 59.58 1whr h HIS 186 Cb 0.51 0.01 -0.11 0.00 1.06 0.00 0.00 27.41 28.87 1whr h HIS 186 CO -0.56 -0.01 -0.36 0.54 0.86 0.00 0.00 177.93 178.41 1whr n ARG 187 N -2.60 -0.24 -0.07 2.45 1.74 -0.03 -0.47 116.66 117.44 1whr n ARG 187 Ca -0.00 1.19 -0.10 0.00 -0.77 0.00 0.00 57.85 58.17 1whr n ARG 187 Cb 0.01 -1.76 -0.07 0.00 -1.02 0.00 0.00 32.46 29.62 1whr n ARG 187 CO 0.00 0.00 0.00 1.98 -1.52 0.00 0.00 177.63 178.09 1whr h MET 188 N 0.00 -0.31 -0.78 5.56 4.05 -1.02 0.11 114.93 122.54 1whr h MET 188 Ca 0.22 0.02 0.12 0.00 -0.28 0.00 0.00 59.70 59.78 1whr h MET 188 Cb 0.41 0.07 -0.13 0.00 -0.80 0.00 0.00 31.60 31.15 1whr h MET 188 CO -0.76 -0.21 -0.41 -0.07 0.23 0.00 0.00 176.91 175.70 1whr h LEU 189 N -0.32 -1.45 0.03 3.39 3.38 -0.08 -0.30 115.31 119.96 1whr h LEU 189 Ca 0.04 0.27 0.03 0.00 0.09 0.00 0.00 57.88 58.32 1whr h LEU 189 Cb 0.44 0.71 -0.04 0.00 0.09 0.00 0.00 40.66 41.86 1whr h LEU 189 CO -0.39 -0.30 -0.27 0.25 0.09 0.00 0.00 178.44 177.82 1whr h LEU 190 N -0.10 -0.79 -1.21 1.67 5.85 -0.62 -1.22 115.31 118.89 1whr h LEU 190 Ca 0.26 0.10 0.37 0.00 0.84 0.00 0.00 57.88 59.44 1whr h LEU 190 Cb 0.56 0.32 -0.14 0.00 0.37 0.00 0.00 40.66 41.77 1whr h LEU 190 CO -0.83 -0.34 0.69 0.45 -0.34 0.00 0.00 178.44 178.07 1whr h HIS 191 N -0.43 0.73 0.29 1.25 3.86 0.91 0.26 115.15 122.02 1whr h HIS 191 Ca 0.06 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 1whr h HIS 191 Cb 0.50 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 28.78 1whr h HIS 191 CO -0.29 -0.18 -0.14 0.00 0.86 0.00 0.00 177.93 178.18 1whr h ARG 192 N 0.21 -0.37 0.07 2.45 2.47 -0.46 -2.26 114.38 116.49 1whr h ARG 192 Ca 0.76 0.03 0.02 0.00 -1.26 0.00 0.00 59.98 59.52 1whr h ARG 192 Cb 2.04 0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 30.42 1whr h ARG 192 CO -0.51 -0.03 -0.16 0.28 0.56 0.00 0.00 179.97 180.11 1whr h VAL 193 N -0.81 0.62 -0.42 2.04 2.07 -0.34 -0.91 116.25 118.50 1whr h VAL 193 Ca -0.04 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.57 1whr h VAL 193 Cb 0.51 0.62 -0.08 0.00 -1.52 0.00 0.00 31.29 30.82 1whr h VAL 193 CO 0.07 0.00 -0.13 0.00 0.02 0.00 0.00 177.57 177.53 1whr h ALA 194 N 0.56 0.24 -0.55 1.67 0.00 -0.69 0.01 119.26 120.50 1whr h ALA 194 Ca 0.03 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1whr h ALA 194 Cb 0.34 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1whr h ALA 194 CO -0.11 -0.48 0.36 0.00 0.00 0.00 0.00 179.25 179.03 1whr h ALA 195 N 1.36 1.60 -0.70 0.00 0.00 -1.11 0.26 119.26 120.67 1whr h ALA 195 Ca 0.20 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1whr h ALA 195 Cb 0.34 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1whr h ALA 195 CO -0.44 0.37 0.42 -0.92 0.00 0.00 0.00 179.25 178.67 1whr h TYR 196 N 0.74 0.93 0.00 0.00 5.03 0.41 -2.40 116.97 121.68 1whr h TYR 196 Ca 0.20 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.50 1whr h TYR 196 Cb -0.08 -0.30 -0.00 0.00 1.55 0.00 0.00 36.73 37.90 1whr h TYR 196 CO 0.00 0.63 -0.44 0.74 -1.32 0.00 0.00 178.16 177.77 1whr h PHE 197 N 0.95 0.00 -1.32 -3.82 -1.00 -0.78 -3.48 116.94 107.50 1whr h PHE 197 Ca 0.25 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.03 1whr h PHE 197 Cb -0.02 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.54 1whr h PHE 197 CO -0.01 0.03 0.00 0.41 -1.61 0.00 0.00 178.31 177.13 1whr n GLY 198 N 1.14 0.48 3.99 -1.45 0.00 0.80 -3.96 105.19 106.19 1whr n GLY 198 Ca 0.02 -0.32 -0.18 0.00 0.00 0.00 0.00 46.02 45.53 1whr n GLY 198 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1whr s MET 199 N -2.37 2.92 -0.29 1.61 -1.94 -0.44 -4.34 119.30 114.45 1whr s MET 199 Ca 0.00 -1.17 0.00 0.00 -1.71 0.00 0.00 55.69 52.81 1whr s MET 199 Cb 0.00 -2.75 0.06 0.00 2.01 0.00 0.00 34.83 34.15 1whr s MET 199 CO 0.00 -0.12 -0.03 -0.51 -0.01 0.00 0.00 175.02 174.35 1whr s ASP 200 N -4.25 4.74 0.24 3.03 1.11 -1.26 -4.71 116.67 115.57 1whr s ASP 200 Ca 0.50 -1.41 -0.03 0.00 0.18 0.00 0.00 52.55 51.79 1whr s ASP 200 Cb -0.09 -1.65 -0.05 0.00 1.07 0.00 0.00 42.92 42.20 1whr s ASP 200 CO 0.32 -0.25 0.47 -1.38 1.18 0.00 0.00 175.17 175.50 1whr s HIS 201 N 1.17 3.48 0.07 4.23 -3.43 -1.26 -3.63 115.29 115.92 1whr s HIS 201 Ca -0.05 0.50 -0.14 0.00 -0.80 0.00 0.00 55.06 54.57 1whr s HIS 201 Cb -0.20 -1.99 0.02 0.00 -1.43 0.00 0.00 32.58 28.99 1whr s HIS 201 CO -0.03 0.28 0.32 0.54 -2.00 0.00 0.00 174.74 173.85 1whr s ASN 202 N -3.13 -0.12 0.35 7.38 2.20 -0.55 -5.00 114.94 116.07 1whr s ASN 202 Ca 0.41 -0.28 -0.02 0.00 -0.94 0.00 0.00 52.86 52.03 1whr s ASN 202 Cb -0.11 0.39 -0.04 0.00 -2.00 0.00 0.00 41.25 39.49 1whr s ASN 202 CO 0.29 -0.70 0.59 0.68 -2.94 0.00 0.00 177.10 175.02 1whr s VAL 203 N -3.09 5.05 0.48 3.54 -7.23 -1.26 -1.89 120.40 116.00 1whr s VAL 203 Ca -0.01 -0.20 0.03 0.00 -1.81 0.00 0.00 61.98 59.98 1whr s VAL 203 Cb 0.01 -3.82 0.01 0.00 0.56 0.00 0.00 36.38 33.14 1whr s VAL 203 CO -0.07 -0.54 0.68 -0.62 -0.31 0.00 0.00 175.10 174.25 1whr s ASP 204 N -3.79 5.58 0.62 4.85 2.15 -1.25 -4.84 116.67 119.99 1whr s ASP 204 Ca 0.42 0.00 0.23 0.00 0.43 0.00 0.00 52.55 53.64 1whr s ASP 204 Cb -0.10 -1.08 1.02 0.00 -0.30 0.00 0.00 42.92 42.46 1whr s ASP 204 CO 0.36 -0.88 1.50 0.06 -0.17 0.00 0.00 175.17 176.05 1whr h GLN 205 N 0.34 0.00 0.00 4.34 -0.00 -1.99 0.86 115.11 118.66 1whr h GLN 205 Ca -0.43 0.00 -0.13 0.00 -0.00 0.00 0.00 58.65 58.09 1whr h GLN 205 Cb 1.28 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.73 1whr h GLN 205 CO 0.53 0.00 -1.88 -2.37 -0.00 0.00 0.00 178.83 175.11 1whr n THR 206 N -3.19 0.48 -2.39 1.86 5.66 -1.26 -5.01 114.28 110.43 1whr n THR 206 Ca 0.12 -0.50 -0.13 0.00 -3.05 0.00 0.00 64.05 60.49 1whr n THR 206 Cb 1.04 -0.21 0.00 0.00 -1.55 0.00 0.00 70.33 69.61 1whr n THR 206 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1whr n GLY 207 N 1.80 -0.13 0.05 1.09 0.00 0.30 -4.91 105.19 103.39 1whr n GLY 207 Ca -0.13 -0.31 0.02 0.00 0.00 0.00 0.00 46.02 45.60 1whr n GLY 207 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1whr n LYS 208 N -2.40 0.67 -4.34 1.61 4.81 -1.26 -4.86 118.16 112.39 1whr n LYS 208 Ca -0.13 -0.10 -0.19 0.00 -0.87 0.00 0.00 58.31 57.02 1whr n LYS 208 Cb 0.60 -1.53 -0.14 0.00 0.02 0.00 0.00 35.03 33.98 1whr n LYS 208 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1whr s ALA 209 N -3.06 0.93 -0.06 3.14 0.00 -1.26 -4.29 121.76 117.16 1whr s ALA 209 Ca -0.09 -0.63 -0.19 0.00 0.00 0.00 0.00 51.96 51.06 1whr s ALA 209 Cb 0.10 -0.16 -0.05 0.00 0.00 0.00 0.00 23.12 23.01 1whr s ALA 209 CO 0.87 0.18 0.51 0.08 0.00 0.00 0.00 175.76 177.40 1whr s VAL 210 N -0.63 5.06 -0.08 0.00 1.01 -1.26 -3.82 120.40 120.67 1whr s VAL 210 Ca 0.01 1.05 0.05 0.00 0.00 0.00 0.00 61.98 63.09 1whr s VAL 210 Cb -0.06 -3.84 -0.00 0.00 0.00 0.00 0.00 36.38 32.47 1whr s VAL 210 CO 0.00 0.40 -0.24 -0.63 0.00 0.00 0.00 175.10 174.63 1whr s ILE 211 N 0.07 2.07 0.48 2.22 1.01 -0.79 -2.89 121.20 123.35 1whr s ILE 211 Ca 0.28 -1.04 0.06 0.00 0.00 0.00 0.00 60.65 59.94 1whr s ILE 211 Cb -0.16 -1.77 -0.01 0.00 0.01 0.00 0.00 42.46 40.53 1whr s ILE 211 CO 0.13 0.56 0.24 0.27 0.00 0.00 0.00 174.94 176.15 1whr s ILE 212 N 0.11 1.90 0.08 2.92 -4.36 -0.66 -1.48 121.20 119.72 1whr s ILE 212 Ca -0.12 -1.65 -0.07 0.00 -0.26 0.00 0.00 60.65 58.55 1whr s ILE 212 Cb -0.16 -2.56 -0.01 0.00 1.25 0.00 0.00 42.46 40.98 1whr s ILE 212 CO 0.07 0.00 0.14 0.21 0.24 0.00 0.00 174.94 175.60 1whr s ASN 213 N -4.05 0.19 -0.13 4.36 2.47 -1.24 -2.18 114.94 114.36 1whr s ASN 213 Ca 0.33 -0.71 -0.17 0.00 0.42 0.00 0.00 52.86 52.73 1whr s ASN 213 Cb 0.01 0.31 -0.04 0.00 -1.45 0.00 0.00 41.25 40.07 1whr s ASN 213 CO 0.19 -0.69 0.42 -0.75 -3.72 0.00 0.00 177.10 172.55 1whr s LYS 214 N -3.81 4.31 0.15 0.43 2.20 -1.16 -4.47 119.74 117.38 1whr s LYS 214 Ca 0.05 0.34 0.02 0.00 -0.36 0.00 0.00 55.97 56.02 1whr s LYS 214 Cb 0.05 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.89 1whr s LYS 214 CO -0.11 0.17 -0.03 0.95 -0.36 0.00 0.00 175.35 175.97 1whr s THR 215 N 0.62 0.77 0.10 3.43 -4.23 -1.26 -5.04 115.64 110.04 1whr s THR 215 Ca 0.23 -1.98 -0.19 0.00 -1.18 0.00 0.00 61.69 58.57 1whr s THR 215 Cb -0.14 -1.96 -0.06 0.00 1.34 0.00 0.00 72.50 71.67 1whr s THR 215 CO 0.08 -0.62 1.64 -1.28 -0.54 0.00 0.00 174.62 173.90 1whr h SER 216 N 2.78 0.37 0.00 3.99 0.87 -1.97 -2.15 113.55 117.43 1whr h SER 216 Ca -0.36 -0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.02 1whr h SER 216 Cb 1.19 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 1whr h SER 216 CO 0.63 0.45 0.50 0.78 -0.53 0.00 0.00 176.83 178.66 1whr h ASN 217 N 0.27 0.00 -2.67 6.23 4.21 -1.96 -3.36 115.58 118.29 1whr h ASN 217 Ca 0.09 0.00 -0.54 0.00 1.21 0.00 0.00 56.30 57.06 1whr h ASN 217 Cb 0.20 0.00 -0.07 0.00 -1.12 0.00 0.00 38.32 37.33 1whr h ASN 217 CO -0.01 0.00 1.07 -0.89 -1.29 0.00 0.00 177.43 176.31 1whr s THR 218 N -3.91 3.79 0.36 2.81 2.01 -0.81 -4.87 115.64 115.01 1whr s THR 218 Ca -0.02 0.59 0.06 0.00 0.31 0.00 0.00 61.69 62.64 1whr s THR 218 Cb 0.06 -4.68 -0.07 0.00 0.01 0.00 0.00 72.50 67.82 1whr s THR 218 CO 0.18 -1.48 0.00 -0.13 -0.69 0.00 0.00 174.62 172.50 1whr s ARG 219 N 5.56 1.79 0.18 4.92 0.52 -1.25 -4.92 118.95 125.74 1whr s ARG 219 Ca 0.44 -1.98 -0.30 0.00 -0.52 0.00 0.00 55.73 53.37 1whr s ARG 219 Cb -0.09 -1.34 -0.08 0.00 0.52 0.00 0.00 34.95 33.96 1whr s ARG 219 CO 0.21 -0.05 1.23 0.42 0.02 0.00 0.00 175.30 177.12 1whr s ILE 220 N -2.92 3.51 0.00 1.52 1.01 -1.26 -4.89 121.20 118.17 1whr s ILE 220 Ca 0.34 1.25 0.00 0.00 0.00 0.00 0.00 60.65 62.24 1whr s ILE 220 Cb 0.08 -3.80 0.00 0.00 0.01 0.00 0.00 42.46 38.75 1whr s ILE 220 CO 0.16 0.19 0.00 -0.81 0.00 0.00 0.00 174.94 174.48 1whr n PRO 221 N 2.64 0.09 -0.02 2.79 -0.04 -1.26 -5.01 135.00 134.20 1whr n PRO 221 Ca 0.05 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.31 1whr n PRO 221 Cb 0.44 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.77 1whr n PRO 221 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1whr n GLU 222 N -0.68 0.74 -3.83 0.54 -0.58 -1.26 -4.97 120.64 110.60 1whr n GLU 222 Ca 0.00 0.25 -0.12 0.00 -0.42 0.00 0.00 57.16 56.87 1whr n GLU 222 Cb 0.00 -1.69 -0.12 0.00 -0.57 0.00 0.00 31.44 29.07 1whr n GLU 222 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1whr s GLN 223 N -2.56 0.29 0.37 3.49 -1.52 -1.26 -5.17 119.66 113.31 1whr s GLN 223 Ca -0.23 0.02 0.08 0.00 -1.95 0.00 0.00 55.36 53.28 1whr s GLN 223 Cb 0.07 0.13 -0.04 0.00 -0.22 0.00 0.00 33.01 32.95 1whr s GLN 223 CO 0.75 -0.05 0.22 1.03 -0.25 0.00 0.00 175.29 176.99 1whr s ARG 224 N -0.39 2.40 0.19 2.91 0.52 -1.26 -5.04 118.95 118.29 1whr s ARG 224 Ca -0.05 -1.59 -0.03 0.00 -0.52 0.00 0.00 55.73 53.54 1whr s ARG 224 Cb -0.03 -2.20 0.11 0.00 0.52 0.00 0.00 34.95 33.35 1whr s ARG 224 CO 0.01 -0.01 1.51 0.74 0.02 0.00 0.00 175.30 177.56 1whr h PHE 225 N 1.38 0.70 -0.42 -0.53 0.04 -2.02 -2.96 116.94 113.13 1whr h PHE 225 Ca -0.43 -0.25 0.12 0.00 2.80 0.00 0.00 57.97 60.21 1whr h PHE 225 Cb 1.26 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 39.25 1whr h PHE 225 CO 0.59 0.98 0.52 1.03 -0.60 0.00 0.00 178.31 180.83 1whr h SER 226 N 0.43 0.00 -0.07 2.17 0.87 -1.96 0.33 113.55 115.33 1whr h SER 226 Ca 0.01 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.39 1whr h SER 226 Cb 1.08 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.04 1whr h SER 226 CO 0.10 0.00 -0.60 -0.33 -0.53 0.00 0.00 176.83 175.47 1whr h GLU 227 N 0.00 0.67 -0.70 2.24 5.08 -1.91 -0.80 114.58 119.16 1whr h GLU 227 Ca 0.20 -0.46 0.15 0.00 -1.00 0.00 0.00 59.36 58.25 1whr h GLU 227 Cb 1.23 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.51 1whr h GLU 227 CO -0.00 1.08 0.48 0.45 -1.00 0.00 0.00 179.01 180.01 1whr h HIS 228 N 0.50 0.38 -0.18 4.33 3.86 -0.47 -1.79 115.15 121.79 1whr h HIS 228 Ca -0.00 0.01 -0.16 0.00 -1.16 0.00 0.00 60.37 59.06 1whr h HIS 228 Cb 1.18 -0.12 -0.17 0.00 1.06 0.00 0.00 27.41 29.37 1whr h HIS 228 CO 0.06 0.15 -0.67 0.44 0.86 0.00 0.00 177.93 178.76 1whr n ILE 229 N -4.45 1.93 -3.29 2.45 -0.00 -1.16 -5.06 119.36 109.78 1whr n ILE 229 Ca 0.13 -3.13 -0.34 0.00 -0.00 0.00 0.00 62.75 59.41 1whr n ILE 229 Cb 0.54 -0.19 -0.06 0.00 -0.00 0.00 0.00 39.64 39.94 1whr n ILE 229 CO 0.00 0.00 0.00 -0.75 -0.00 0.00 0.00 176.55 175.80 1whr s LYS 230 N -2.90 3.99 -0.29 6.28 2.20 -0.32 -5.01 119.74 123.70 1whr s LYS 230 Ca 0.40 0.54 0.16 0.00 -0.36 0.00 0.00 55.97 56.71 1whr s LYS 230 Cb 0.38 -2.78 0.48 0.00 -1.51 0.00 0.00 37.83 34.40 1whr s LYS 230 CO -0.06 0.38 1.11 -0.40 -0.36 0.00 0.00 175.35 176.02 1whr n ASP 231 N 0.41 2.80 -3.54 1.43 5.75 -1.26 -4.96 116.55 117.18 1whr n ASP 231 Ca -0.02 -2.77 -0.25 0.00 -0.01 0.00 0.00 54.79 51.74 1whr n ASP 231 Cb 0.52 -0.44 -0.02 0.00 -1.03 0.00 0.00 41.12 40.14 1whr n ASP 231 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1whr n GLU 232 N -0.55 -2.76 -3.69 0.11 1.02 -1.26 -4.90 120.64 108.61 1whr n GLU 232 Ca 0.21 0.33 -0.11 0.00 -0.02 0.00 0.00 57.16 57.56 1whr n GLU 232 Cb 0.84 -4.98 -0.10 0.00 -0.02 0.00 0.00 31.44 27.19 1whr n GLU 232 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1whr s LYS 233 N -6.18 0.50 -0.15 3.49 2.20 -1.26 -5.15 119.74 113.18 1whr s LYS 233 Ca 0.46 0.80 -0.03 0.00 -0.36 0.00 0.00 55.97 56.84 1whr s LYS 233 Cb -0.25 0.11 -0.02 0.00 -1.51 0.00 0.00 37.83 36.15 1whr s LYS 233 CO 0.56 -0.12 -0.06 1.21 -0.36 0.00 0.00 175.35 176.58 1whr s ASN 234 N 1.01 4.59 -0.30 1.43 3.84 -1.26 -5.06 114.94 119.19 1whr s ASN 234 Ca -0.06 -0.19 -0.13 0.00 0.21 0.00 0.00 52.86 52.69 1whr s ASN 234 Cb -0.06 -1.74 0.16 0.00 -0.55 0.00 0.00 41.25 39.06 1whr s ASN 234 CO -0.09 0.16 0.89 0.28 -2.79 0.00 0.00 177.10 175.55 1whr s THR 235 N 0.44 -0.63 -0.24 -5.21 -1.32 -1.26 -5.17 115.64 102.25 1whr s THR 235 Ca -0.05 0.00 -0.27 0.00 -1.21 0.00 0.00 61.69 60.16 1whr s THR 235 Cb -0.15 -1.00 0.14 0.00 -1.51 0.00 0.00 72.50 69.98 1whr s THR 235 CO 0.03 0.00 1.11 -0.70 -2.21 0.00 0.00 174.62 172.85 1whr s GLU 236 N 2.62 0.44 0.23 7.08 2.12 -1.26 -5.18 118.70 124.75 1whr s GLU 236 Ca -0.02 0.31 0.09 0.00 0.36 0.00 0.00 54.97 55.71 1whr s GLU 236 Cb -0.08 0.21 -0.04 0.00 0.26 0.00 0.00 34.13 34.48 1whr s GLU 236 CO -0.18 -0.09 0.01 -0.59 -0.54 0.00 0.00 175.26 173.87 1whr s PHE 237 N -0.39 2.78 -0.03 5.30 -0.71 -1.26 -5.13 117.98 118.54 1whr s PHE 237 Ca 0.02 -0.18 -0.09 0.00 -1.04 0.00 0.00 56.93 55.64 1whr s PHE 237 Cb -0.03 -1.28 -0.05 0.00 -1.21 0.00 0.00 43.02 40.46 1whr s PHE 237 CO -0.05 0.57 0.28 -0.65 -1.34 0.00 0.00 175.22 174.03 1whr s GLN 238 N -3.41 3.64 -0.18 1.99 -1.52 -1.26 -5.08 119.66 113.83 1whr s GLN 238 Ca 0.30 0.06 -0.04 0.00 -1.95 0.00 0.00 55.36 53.72 1whr s GLN 238 Cb -0.08 -3.15 0.09 0.00 -0.22 0.00 0.00 33.01 29.66 1whr s GLN 238 CO 0.20 0.69 0.26 -1.14 -0.25 0.00 0.00 175.29 175.05 1whr s GLN 239 N -1.36 0.20 0.05 2.91 2.00 -1.26 -5.15 119.66 117.05 1whr s GLN 239 Ca 0.23 0.44 0.03 0.00 -2.00 0.00 0.00 55.36 54.06 1whr s GLN 239 Cb -0.14 -0.70 -0.04 0.00 0.80 0.00 0.00 33.01 32.93 1whr s GLN 239 CO 0.12 -0.53 0.03 0.50 -0.50 0.00 0.00 175.29 174.91 1whr s ARG 240 N 2.39 2.76 0.30 1.67 6.06 -1.26 -5.13 118.95 125.74 1whr s ARG 240 Ca 0.06 -0.70 0.05 0.00 -2.50 0.00 0.00 55.73 52.64 1whr s ARG 240 Cb -0.14 -2.66 -0.06 0.00 0.06 0.00 0.00 34.95 32.14 1whr s ARG 240 CO -0.11 0.58 0.01 0.12 -2.50 0.00 0.00 175.30 173.40 1whr s PHE 241 N -1.26 1.92 -0.04 5.12 5.36 -1.26 -5.16 117.98 122.66 1whr s PHE 241 Ca 0.25 -0.87 -0.02 0.00 -0.96 0.00 0.00 56.93 55.33 1whr s PHE 241 Cb -0.12 -1.20 0.02 0.00 -0.34 0.00 0.00 43.02 41.39 1whr s PHE 241 CO 0.17 0.09 0.09 0.42 -1.46 0.00 0.00 175.22 174.53 1whr s ILE 242 N -3.22 -0.03 0.55 3.12 -1.09 -1.26 -5.16 121.20 114.11 1whr s ILE 242 Ca 0.33 0.11 0.09 0.00 -2.23 0.00 0.00 60.65 58.95 1whr s ILE 242 Cb 0.07 -0.15 0.07 0.00 -1.58 0.00 0.00 42.46 40.88 1whr s ILE 242 CO 0.14 0.04 0.73 -1.48 -1.23 0.00 0.00 174.94 173.14 1whr s LEU 243 N 0.65 3.14 -0.09 2.97 2.34 -1.26 -5.12 118.68 121.30 1whr s LEU 243 Ca -0.05 -0.83 0.01 0.00 0.06 0.00 0.00 54.13 53.32 1whr s LEU 243 Cb -0.07 -1.72 0.02 0.00 -0.56 0.00 0.00 46.19 43.86 1whr s LEU 243 CO -0.03 -1.25 -0.12 -0.44 -1.06 0.00 0.00 176.35 173.45 1whr s SER 244 N -4.60 2.11 -0.69 1.48 0.01 -1.26 -5.08 113.70 105.67 1whr s SER 244 Ca 0.59 -0.35 0.03 0.00 1.31 0.00 0.00 55.95 57.54 1whr s SER 244 Cb -0.06 -0.92 0.17 0.00 0.21 0.00 0.00 66.02 65.42 1whr s SER 244 CO 0.37 -0.01 0.49 -0.83 0.41 0.00 0.00 173.24 173.66 1whr s GLY 245 N 1.06 2.85 1.25 3.44 0.00 -1.26 -5.09 107.32 109.56 1whr s GLY 245 Ca -0.06 -3.71 -0.21 0.00 0.00 0.00 0.00 44.72 40.74 1whr s GLY 245 CO -0.01 1.08 1.11 -1.55 0.00 0.00 0.00 173.10 173.73 1whr n PRO 246 N 2.32 -3.18 -1.58 2.90 -0.04 -1.26 -5.03 135.00 129.12 1whr n PRO 246 Ca 0.16 -1.77 -0.30 0.00 -0.04 0.00 0.00 63.50 61.55 1whr n PRO 246 Cb 0.35 -1.66 0.08 0.00 -0.04 0.00 0.00 33.50 32.22 1whr n PRO 246 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1whr s SER 247 N -4.49 4.82 0.44 3.54 0.15 -1.26 -5.08 113.70 111.83 1whr s SER 247 Ca 0.72 1.38 0.08 0.00 0.70 0.00 0.00 55.95 58.83 1whr s SER 247 Cb -0.07 -2.17 0.02 0.00 -1.71 0.00 0.00 66.02 62.09 1whr s SER 247 CO 0.55 -1.77 0.56 -0.55 1.20 0.00 0.00 173.24 173.23 1whr s SER 248 N -3.91 5.45 0.00 5.45 0.15 -1.26 -5.32 113.70 114.27 1whr s SER 248 Ca 0.60 -0.56 0.00 0.00 0.70 0.00 0.00 55.95 56.69 1whr s SER 248 Cb -0.14 -0.49 0.00 0.00 -1.71 0.00 0.00 66.02 63.68 1whr s SER 248 CO 0.54 -0.83 0.00 0.61 1.20 0.00 0.00 173.24 174.76