#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 1.16 -0.26 1.61 0.01 -1.26 -5.13 113.70 109.83 1whr s SER 127 Ca 0.00 -0.12 -0.16 0.00 1.31 0.00 0.00 55.95 56.98 1whr s SER 127 Cb 0.00 -0.45 0.07 0.00 0.21 0.00 0.00 66.02 65.85 1whr s SER 127 CO 0.00 -0.10 0.64 -0.94 0.41 0.00 0.00 173.24 173.25 1whr s SER 128 N 1.25 -0.85 0.00 2.44 1.04 -1.26 -5.02 113.70 111.30 1whr s SER 128 Ca -0.06 1.40 0.00 0.00 0.48 0.00 0.00 55.95 57.77 1whr s SER 128 Cb -0.14 1.28 0.00 0.00 0.10 0.00 0.00 66.02 67.27 1whr s SER 128 CO -0.02 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.58 1whr n GLY 129 N 4.14 0.74 3.52 7.32 0.00 -1.26 -5.13 105.19 114.53 1whr n GLY 129 Ca -0.20 -0.67 -0.27 0.00 0.00 0.00 0.00 46.02 44.88 1whr n GLY 129 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1whr s SER 130 N -2.10 4.00 0.04 1.61 1.04 -1.26 -5.15 113.70 111.89 1whr s SER 130 Ca 0.00 -0.66 -0.02 0.00 0.48 0.00 0.00 55.95 55.75 1whr s SER 130 Cb 0.00 -0.58 -0.03 0.00 0.10 0.00 0.00 66.02 65.52 1whr s SER 130 CO 0.00 0.11 0.01 -0.55 0.98 0.00 0.00 173.24 173.79 1whr s SER 131 N -2.75 0.34 0.00 7.02 0.15 -1.26 -5.14 113.70 112.06 1whr s SER 131 Ca 0.23 -0.76 0.00 0.00 0.70 0.00 0.00 55.95 56.12 1whr s SER 131 Cb -0.09 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.41 1whr s SER 131 CO 0.13 -0.52 0.00 0.61 1.20 0.00 0.00 173.24 174.67 1whr n GLY 132 N 0.59 2.92 2.96 9.45 0.00 -1.26 -5.06 105.19 114.79 1whr n GLY 132 Ca -0.17 -2.05 -0.29 0.00 0.00 0.00 0.00 46.02 43.50 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 -2.46 1.37 -0.19 2.61 -4.23 -1.26 -5.09 115.64 106.40 1whr s THR 133 Ca 0.00 -0.62 -0.28 0.00 -1.18 0.00 0.00 61.69 59.61 1whr s THR 133 Cb 0.00 -1.38 -0.05 0.00 1.34 0.00 0.00 72.50 72.40 1whr s THR 133 CO 0.00 0.33 2.15 -1.81 -0.54 0.00 0.00 174.62 174.74 1whr s ASP 134 N 1.55 5.64 0.21 3.99 1.01 -1.26 -4.88 116.67 122.94 1whr s ASP 134 Ca 0.03 1.97 -0.29 0.00 0.71 0.00 0.00 52.55 54.97 1whr s ASP 134 Cb -0.14 -2.51 -0.16 0.00 1.01 0.00 0.00 42.92 41.12 1whr s ASP 134 CO -0.09 -1.80 0.80 -1.54 0.21 0.00 0.00 175.17 172.75 1whr n SER 135 N 10.94 0.04 -4.74 0.27 3.41 -1.26 -4.92 113.62 117.36 1whr n SER 135 Ca 0.28 1.15 -0.38 0.00 -0.26 0.00 0.00 58.87 59.66 1whr n SER 135 Cb 0.44 -1.10 -0.06 0.00 -0.26 0.00 0.00 64.21 63.24 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 -0.85 5.17 0.00 6.66 -4.23 -1.26 -4.68 115.64 116.45 1whr s THR 136 Ca 0.65 0.92 0.00 0.00 -1.18 0.00 0.00 61.69 62.08 1whr s THR 136 Cb -0.86 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 69.18 1whr s THR 136 CO 0.57 0.36 0.00 0.61 -0.54 0.00 0.00 174.62 175.62 1whr n GLY 137 N 3.09 -0.10 3.45 3.99 0.00 -1.26 -5.09 105.19 109.26 1whr n GLY 137 Ca -0.08 0.15 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 1whr n GLY 137 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1whr s ILE 138 N 0.00 4.71 -0.63 -0.61 1.01 -1.26 -5.01 121.20 119.41 1whr s ILE 138 Ca 0.00 -0.38 -0.16 0.00 0.00 0.00 0.00 60.65 60.12 1whr s ILE 138 Cb 0.00 -4.41 0.15 0.00 0.01 0.00 0.00 42.46 38.22 1whr s ILE 138 CO 0.00 -0.97 0.60 1.51 0.00 0.00 0.00 174.94 176.09 1whr s ASP 139 N 2.93 6.36 -0.04 3.58 1.47 -1.26 -4.90 116.67 124.81 1whr s ASP 139 Ca 0.19 -2.03 -0.03 0.00 1.18 0.00 0.00 52.55 51.86 1whr s ASP 139 Cb -0.18 -2.22 -0.01 0.00 -0.34 0.00 0.00 42.92 40.17 1whr s ASP 139 CO 0.13 -0.80 -0.06 0.18 0.68 0.00 0.00 175.17 175.30 1whr n LEU 140 N 4.98 0.48 -0.30 2.11 4.77 -1.26 -3.91 117.00 123.86 1whr n LEU 140 Ca -0.05 0.27 0.09 0.00 -0.03 0.00 0.00 56.01 56.29 1whr n LEU 140 Cb 0.42 -0.59 0.21 0.00 -2.33 0.00 0.00 43.42 41.14 1whr n LEU 140 CO 0.48 -0.48 0.80 -0.74 -1.33 0.00 0.00 177.39 176.12 1whr h HIS 141 N -0.26 -0.10 -0.01 -1.77 2.76 -1.99 0.74 115.15 114.53 1whr h HIS 141 Ca 0.00 0.07 0.03 0.00 -2.20 0.00 0.00 60.37 58.27 1whr h HIS 141 Cb 0.17 0.18 -0.05 0.00 1.55 0.00 0.00 27.41 29.26 1whr h HIS 141 CO -0.07 -0.34 -0.34 0.93 -1.30 0.00 0.00 177.93 176.81 1whr h GLU 142 N 0.06 -0.47 0.02 5.26 5.08 -1.97 0.11 114.58 122.66 1whr h GLU 142 Ca 0.49 0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.91 1whr h GLU 142 Cb 0.93 0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.25 1whr h GLU 142 CO -0.81 -0.31 -0.16 0.35 -1.00 0.00 0.00 179.01 177.08 1whr h PHE 143 N -0.49 -0.40 -0.05 4.33 3.04 -1.05 0.17 116.94 122.49 1whr h PHE 143 Ca 0.06 0.01 0.04 0.00 3.98 0.00 0.00 57.97 62.06 1whr h PHE 143 Cb 0.58 0.18 -0.06 0.00 2.56 0.00 0.00 35.95 39.21 1whr h PHE 143 CO -0.36 -0.23 -0.35 -0.07 -2.02 0.00 0.00 178.31 175.27 1whr h LEU 144 N -0.27 -1.08 0.78 0.59 3.38 -0.75 -2.07 115.31 115.89 1whr h LEU 144 Ca 0.05 0.14 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 1whr h LEU 144 Cb 0.32 0.44 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 1whr h LEU 144 CO -0.14 -0.40 -0.46 0.58 0.09 0.00 0.00 178.44 178.11 1whr h VAL 145 N -0.48 0.00 -0.84 1.22 2.07 -0.59 -1.63 116.25 116.00 1whr h VAL 145 Ca 0.07 0.00 0.29 0.00 0.82 0.00 0.00 66.70 67.88 1whr h VAL 145 Cb 0.59 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.20 1whr h VAL 145 CO -0.32 0.00 0.23 -3.20 0.02 0.00 0.00 177.57 174.30 1whr n ASN 146 N -5.37 0.09 -0.05 0.57 2.85 0.58 0.23 115.26 114.17 1whr n ASN 146 Ca -0.14 1.41 -0.13 0.00 -0.11 0.00 0.00 54.58 55.61 1whr n ASN 146 Cb 0.48 -0.60 -0.02 0.00 1.24 0.00 0.00 39.78 40.88 1whr n ASN 146 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 1whr h THR 147 N 0.00 1.29 -0.64 -0.44 2.02 -1.03 0.88 112.91 114.99 1whr h THR 147 Ca 0.61 -1.79 0.08 0.00 0.77 0.00 0.00 66.41 66.09 1whr h THR 147 Cb 1.46 1.72 -0.07 0.00 -1.74 0.00 0.00 68.15 69.52 1whr h THR 147 CO -0.72 0.57 0.29 -0.07 0.37 0.00 0.00 175.52 175.97 1whr h LEU 148 N 0.58 0.37 0.00 2.58 3.38 0.39 0.63 115.31 123.24 1whr h LEU 148 Ca 0.00 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1whr h LEU 148 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1whr h LEU 148 CO 0.12 0.22 -0.15 0.11 0.09 0.00 0.00 178.44 178.83 1whr h LYS 149 N 0.52 0.00 -0.87 1.13 1.57 -1.32 -3.29 116.57 114.31 1whr h LYS 149 Ca 0.31 0.00 0.20 0.00 -1.87 0.00 0.00 60.65 59.29 1whr h LYS 149 Cb 0.33 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 32.52 1whr h LYS 149 CO -0.26 0.00 0.39 0.87 -0.57 0.00 0.00 179.45 179.87 1whr h LYS 150 N -0.98 0.43 -3.26 3.15 1.79 -0.85 -3.11 116.57 113.75 1whr h LYS 150 Ca 0.00 -0.03 -0.67 0.00 -2.18 0.00 0.00 60.65 57.77 1whr h LYS 150 Cb 0.15 -0.10 -0.38 0.00 -1.58 0.00 0.00 32.23 30.32 1whr h LYS 150 CO 0.00 0.28 -0.32 -0.80 -1.08 0.00 0.00 179.45 177.53 1whr s ASN 151 N -5.24 5.41 0.20 0.86 0.01 0.22 -4.89 114.94 111.51 1whr s ASN 151 Ca -0.12 -3.66 0.21 0.00 -0.71 0.00 0.00 52.86 48.58 1whr s ASN 151 Cb 0.24 -1.79 0.89 0.00 0.41 0.00 0.00 41.25 41.00 1whr s ASN 151 CO 0.78 -0.16 1.65 -0.81 -1.51 0.00 0.00 177.10 177.04 1whr n PRO 152 N 2.34 0.15 -0.11 -0.60 -0.04 -1.18 -2.37 135.00 133.19 1whr n PRO 152 Ca 0.19 0.39 -0.20 0.00 -0.04 0.00 0.00 63.50 63.83 1whr n PRO 152 Cb 0.36 -1.78 -0.10 0.00 -0.04 0.00 0.00 33.50 31.94 1whr n PRO 152 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1whr n ARG 153 N -2.06 0.55 -0.13 0.54 1.74 -1.26 -4.42 116.66 111.61 1whr n ARG 153 Ca 0.02 0.50 -0.05 0.00 -0.77 0.00 0.00 57.85 57.55 1whr n ARG 153 Cb 0.21 -1.68 0.03 0.00 -1.02 0.00 0.00 32.46 30.00 1whr n ARG 153 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1whr h ASP 154 N -1.00 0.23 -0.96 0.55 3.32 -1.91 -2.21 116.42 114.43 1whr h ASP 154 Ca -0.35 0.04 0.34 0.00 0.02 0.00 0.00 57.03 57.08 1whr h ASP 154 Cb 1.24 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.68 1whr h ASP 154 CO -0.21 0.17 0.61 -2.11 -1.72 0.00 0.00 179.24 175.97 1whr n ARG 155 N -4.97 -0.03 -0.37 3.56 1.85 -1.00 0.22 116.66 115.92 1whr n ARG 155 Ca 0.03 0.93 0.01 0.00 -1.00 0.00 0.00 57.85 57.82 1whr n ARG 155 Cb 0.14 -1.80 0.07 0.00 -1.05 0.00 0.00 32.46 29.81 1whr n ARG 155 CO 0.00 0.00 0.00 0.52 -0.01 0.00 0.00 177.63 178.14 1whr h MET 156 N 0.00 -0.01 0.28 2.89 2.86 -1.63 0.25 114.93 119.58 1whr h MET 156 Ca 0.64 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 58.27 1whr h MET 156 Cb 2.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.67 1whr h MET 156 CO -0.38 -0.00 -0.14 1.98 1.06 0.00 0.00 176.91 179.43 1whr h MET 157 N -0.01 -0.37 -0.40 1.72 1.85 -0.46 -2.44 114.93 114.82 1whr h MET 157 Ca 0.38 0.02 0.07 0.00 -0.61 0.00 0.00 59.70 59.57 1whr h MET 157 Cb 0.63 0.08 -0.09 0.00 0.43 0.00 0.00 31.60 32.65 1whr h MET 157 CO -0.98 -0.13 -0.39 -0.07 -0.40 0.00 0.00 176.91 174.94 1whr h LEU 158 N -0.56 -1.30 -0.15 3.39 3.38 -1.03 -1.73 115.31 117.32 1whr h LEU 158 Ca -0.04 0.21 0.05 0.00 0.09 0.00 0.00 57.88 58.19 1whr h LEU 158 Cb 0.41 0.58 -0.06 0.00 0.09 0.00 0.00 40.66 41.68 1whr h LEU 158 CO 0.06 -0.35 -0.31 -0.07 0.09 0.00 0.00 178.44 177.86 1whr h LEU 159 N -0.30 -0.98 -0.89 1.67 3.38 -0.60 -1.57 115.31 116.02 1whr h LEU 159 Ca 0.15 0.15 0.20 0.00 0.09 0.00 0.00 57.88 58.47 1whr h LEU 159 Cb 0.57 0.42 -0.16 0.00 0.09 0.00 0.00 40.66 41.58 1whr h LEU 159 CO -0.56 -0.35 -0.11 0.50 0.09 0.00 0.00 178.44 178.01 1whr h LYS 160 N -0.38 0.02 0.31 1.13 1.63 -0.82 0.78 116.57 119.24 1whr h LYS 160 Ca 0.10 -0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.89 1whr h LYS 160 Cb 0.54 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 32.16 1whr h LYS 160 CO -0.36 0.02 -0.17 -0.07 -3.45 0.00 0.00 179.45 175.41 1whr h LEU 161 N 0.03 -0.42 -1.00 5.20 3.38 -0.73 -2.31 115.31 119.46 1whr h LEU 161 Ca 0.47 0.02 0.29 0.00 0.09 0.00 0.00 57.88 58.75 1whr h LEU 161 Cb 0.82 0.12 -0.14 0.00 0.09 0.00 0.00 40.66 41.55 1whr h LEU 161 CO -0.86 -0.28 0.57 -0.08 0.09 0.00 0.00 178.44 177.87 1whr h GLU 162 N -0.45 0.40 0.25 1.13 4.57 -0.23 0.19 114.58 120.44 1whr h GLU 162 Ca -0.03 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.11 1whr h GLU 162 Cb 0.36 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.87 1whr h GLU 162 CO 0.05 0.27 -0.12 0.37 -1.18 0.00 0.00 179.01 178.39 1whr h GLN 163 N 0.42 -0.32 -0.21 1.92 5.75 -0.87 -0.25 115.11 121.55 1whr h GLN 163 Ca 0.69 0.02 0.03 0.00 -0.15 0.00 0.00 58.65 59.25 1whr h GLN 163 Cb 1.48 0.07 -0.03 0.00 1.07 0.00 0.00 27.48 30.08 1whr h GLN 163 CO -0.56 -0.04 0.02 0.93 -2.65 0.00 0.00 178.83 176.53 1whr h GLU 164 N -0.60 0.10 -0.12 1.69 3.07 -0.50 -2.27 114.58 115.94 1whr h GLU 164 Ca -0.03 -0.01 0.01 0.00 -0.50 0.00 0.00 59.36 58.83 1whr h GLU 164 Cb 0.43 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 1whr h GLU 164 CO 0.06 0.06 0.05 0.82 -1.40 0.00 0.00 179.01 178.60 1whr h ILE 165 N 0.10 0.98 -0.39 3.13 2.04 -0.73 -1.79 117.51 120.85 1whr h ILE 165 Ca 0.10 -0.04 0.08 0.00 1.00 0.00 0.00 64.86 66.00 1whr h ILE 165 Cb 0.11 0.86 -0.09 0.00 -0.74 0.00 0.00 36.82 36.96 1whr h ILE 165 CO -0.15 0.02 -0.31 -0.07 0.00 0.00 0.00 178.15 177.65 1whr h LEU 166 N 0.11 -1.02 -0.99 1.44 3.38 -0.74 0.14 115.31 117.62 1whr h LEU 166 Ca 0.05 0.18 0.04 0.00 0.09 0.00 0.00 57.88 58.24 1whr h LEU 166 Cb 0.02 0.48 -0.06 0.00 0.09 0.00 0.00 40.66 41.20 1whr h LEU 166 CO -0.05 -0.31 0.64 -0.33 0.09 0.00 0.00 178.44 178.49 1whr h GLU 167 N -0.24 1.20 0.82 1.13 5.08 -1.23 -2.34 114.58 119.00 1whr h GLU 167 Ca 0.17 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.42 1whr h GLU 167 Cb 0.53 -0.27 0.01 0.00 0.50 0.00 0.00 28.75 29.51 1whr h GLU 167 CO -0.52 0.80 -0.39 0.35 -1.00 0.00 0.00 179.01 178.24 1whr h PHE 168 N 1.24 -1.02 -0.55 4.33 3.57 -0.12 0.35 116.94 124.73 1whr h PHE 168 Ca 0.40 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.98 1whr h PHE 168 Cb 0.01 0.34 -0.11 0.00 2.79 0.00 0.00 35.95 38.98 1whr h PHE 168 CO -0.00 -0.63 -0.25 0.82 -2.23 0.00 0.00 178.31 176.02 1whr h ILE 169 N -1.14 0.27 -0.60 1.41 2.04 -0.66 0.17 117.51 119.01 1whr h ILE 169 Ca -0.11 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.67 1whr h ILE 169 Cb 0.85 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1whr h ILE 169 CO 0.18 0.00 0.07 -1.13 0.00 0.00 0.00 178.15 177.28 1whr h ASN 170 N -0.12 0.95 -2.86 1.72 -1.24 -1.36 -3.41 115.58 109.26 1whr h ASN 170 Ca 0.25 -0.23 -0.57 0.00 0.71 0.00 0.00 56.30 56.46 1whr h ASN 170 Cb 0.51 -0.25 -0.03 0.00 0.73 0.00 0.00 38.32 39.27 1whr h ASN 170 CO -0.63 0.97 1.13 -0.62 -1.29 0.00 0.00 177.43 176.99 1whr s ASP 171 N -6.56 6.30 0.04 1.15 -1.08 0.12 -4.88 116.67 111.77 1whr s ASP 171 Ca -0.11 1.39 -0.16 0.00 -0.52 0.00 0.00 52.55 53.15 1whr s ASP 171 Cb 0.15 -2.53 -0.30 0.00 -1.46 0.00 0.00 42.92 38.77 1whr s ASP 171 CO 0.84 -1.36 1.08 0.78 0.52 0.00 0.00 175.17 177.02 1whr h ASN 172 N 11.03 0.86 -0.95 -0.34 2.35 -1.80 -3.30 115.58 123.43 1whr h ASN 172 Ca -0.32 -0.84 0.30 0.00 -0.55 0.00 0.00 56.30 54.89 1whr h ASN 172 Cb 1.14 -0.27 -0.16 0.00 0.05 0.00 0.00 38.32 39.08 1whr h ASN 172 CO 1.02 1.61 0.33 -1.13 -1.65 0.00 0.00 177.43 177.61 1whr h ASN 173 N 0.22 0.08 -3.36 5.81 -0.73 -1.93 -3.37 115.58 112.31 1whr h ASN 173 Ca -0.19 0.22 -0.56 0.00 1.87 0.00 0.00 56.30 57.64 1whr h ASN 173 Cb 1.92 0.28 -0.05 0.00 0.27 0.00 0.00 38.32 40.74 1whr h ASN 173 CO 0.24 -0.24 0.05 0.20 -0.37 0.00 0.00 177.43 177.31 1whr s ASN 174 N -4.93 7.01 0.00 1.15 0.01 -1.24 -4.93 114.94 112.01 1whr s ASN 174 Ca -0.11 1.21 0.00 0.00 -0.71 0.00 0.00 52.86 53.24 1whr s ASN 174 Cb 0.29 -2.40 0.00 0.00 0.41 0.00 0.00 41.25 39.55 1whr s ASN 174 CO 0.78 -0.01 0.00 0.00 -1.51 0.00 0.00 177.10 176.36 1whr n GLN 175 N 3.24 2.58 -3.87 -0.60 0.00 -1.26 -4.88 117.38 112.59 1whr n GLN 175 Ca -0.04 0.00 -0.11 0.00 0.00 0.00 0.00 57.00 56.85 1whr n GLN 175 Cb 0.51 -0.76 -0.12 0.00 0.00 0.00 0.00 30.24 29.86 1whr n GLN 175 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 1whr s PHE 176 N -1.44 -0.00 -0.07 2.61 0.08 -1.26 -2.62 117.98 115.28 1whr s PHE 176 Ca 0.00 0.02 -0.03 0.00 0.12 0.00 0.00 56.93 57.04 1whr s PHE 176 Cb 0.00 -0.02 0.04 0.00 -0.57 0.00 0.00 43.02 42.47 1whr s PHE 176 CO 0.00 -0.10 0.13 0.21 -0.10 0.00 0.00 175.22 175.36 1whr s LYS 177 N -0.42 0.02 -0.39 0.44 2.20 -0.61 -5.02 119.74 115.94 1whr s LYS 177 Ca -0.05 0.45 -0.09 0.00 -0.36 0.00 0.00 55.97 55.92 1whr s LYS 177 Cb -0.03 -0.30 0.06 0.00 -1.51 0.00 0.00 37.83 36.05 1whr s LYS 177 CO 0.00 -0.27 0.22 0.21 -0.36 0.00 0.00 175.35 175.15 1whr s LYS 178 N 1.93 2.66 0.61 4.03 2.20 -1.26 -1.63 119.74 128.27 1whr s LYS 178 Ca -0.00 -1.32 -0.17 0.00 -0.36 0.00 0.00 55.97 54.12 1whr s LYS 178 Cb -0.12 -3.72 -0.03 0.00 -1.51 0.00 0.00 37.83 32.46 1whr s LYS 178 CO -0.05 -0.84 1.14 -0.06 -0.36 0.00 0.00 175.35 175.18 1whr s PHE 179 N 1.45 2.55 1.21 4.03 0.08 -1.17 -5.02 117.98 121.11 1whr s PHE 179 Ca 0.02 1.55 -0.19 0.00 0.12 0.00 0.00 56.93 58.42 1whr s PHE 179 Cb -0.21 -3.29 0.29 0.00 -0.57 0.00 0.00 43.02 39.23 1whr s PHE 179 CO 0.03 -1.81 1.11 -1.25 -0.10 0.00 0.00 175.22 173.20 1whr s PRO 180 N -3.63 -1.31 0.16 0.24 0.04 -1.26 -4.54 135.00 124.70 1whr s PRO 180 Ca 0.72 -0.09 -0.32 0.00 0.04 0.00 0.00 61.00 61.35 1whr s PRO 180 Cb -0.24 -1.59 -0.12 0.00 0.04 0.00 0.00 34.50 32.59 1whr s PRO 180 CO 0.34 -3.76 1.73 1.04 0.04 0.00 0.00 177.00 176.39 1whr n GLN 181 N -4.79 2.60 -4.49 4.56 6.02 -1.26 -4.85 117.38 115.17 1whr n GLN 181 Ca 0.13 0.94 -0.23 0.00 -0.01 0.00 0.00 57.00 57.84 1whr n GLN 181 Cb 0.60 -2.78 -0.11 0.00 1.02 0.00 0.00 30.24 28.97 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 1.73 1.70 0.74 -1.09 -1.94 -1.26 -5.13 119.30 114.05 1whr s MET 182 Ca 0.79 -1.92 -0.05 0.00 -1.71 0.00 0.00 55.69 52.80 1whr s MET 182 Cb -0.55 -1.15 0.11 0.00 2.01 0.00 0.00 34.83 35.24 1whr s MET 182 CO 0.36 -0.08 1.03 0.95 -0.01 0.00 0.00 175.02 177.27 1whr s THR 183 N -3.06 2.23 0.10 2.05 -4.23 -1.26 -4.83 115.64 106.64 1whr s THR 183 Ca 0.34 -0.39 -0.29 0.00 -1.18 0.00 0.00 61.69 60.17 1whr s THR 183 Cb 0.07 -2.84 -0.11 0.00 1.34 0.00 0.00 72.50 70.96 1whr s THR 183 CO 0.15 0.00 1.63 -1.28 -0.54 0.00 0.00 174.62 174.58 1whr h SER 184 N -0.67 -0.77 0.83 3.99 0.87 -2.01 -0.77 113.55 115.01 1whr h SER 184 Ca -0.41 0.07 -0.04 0.00 -1.23 0.00 0.00 61.79 60.18 1whr h SER 184 Cb 1.28 0.27 0.01 0.00 -0.44 0.00 0.00 62.40 63.52 1whr h SER 184 CO 0.48 -0.40 -0.42 0.22 -0.53 0.00 0.00 176.83 176.18 1whr h TYR 185 N -0.58 -1.10 -0.37 2.24 3.20 -2.01 -2.99 116.97 115.37 1whr h TYR 185 Ca -0.00 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.89 1whr h TYR 185 Cb 0.55 0.37 -0.06 0.00 1.54 0.00 0.00 36.73 39.13 1whr h TYR 185 CO -0.20 -0.67 -0.36 0.45 -1.64 0.00 0.00 178.16 175.74 1whr h HIS 186 N -1.15 -1.13 -0.83 -3.82 3.86 -1.94 -1.15 115.15 108.99 1whr h HIS 186 Ca -0.11 0.06 0.11 0.00 -1.16 0.00 0.00 60.37 59.27 1whr h HIS 186 Cb 0.89 0.54 -0.12 0.00 1.06 0.00 0.00 27.41 29.78 1whr h HIS 186 CO -0.04 -0.29 -0.37 -2.13 0.86 0.00 0.00 177.93 175.96 1whr n ARG 187 N -4.43 -0.24 0.11 2.45 0.63 -0.30 -0.36 116.66 114.52 1whr n ARG 187 Ca -0.01 1.27 -0.16 0.00 -0.92 0.00 0.00 57.85 58.03 1whr n ARG 187 Cb 0.20 -1.88 -0.09 0.00 0.45 0.00 0.00 32.46 31.14 1whr n ARG 187 CO 0.00 0.00 0.00 1.98 -2.51 0.00 0.00 177.63 177.10 1whr h MET 188 N 0.00 -0.70 -0.94 -0.14 4.05 -1.08 -1.88 114.93 114.25 1whr h MET 188 Ca 0.25 0.05 0.20 0.00 -0.28 0.00 0.00 59.70 59.91 1whr h MET 188 Cb 0.45 0.16 -0.18 0.00 -0.80 0.00 0.00 31.60 31.24 1whr h MET 188 CO -0.81 -0.47 -0.19 -0.07 0.23 0.00 0.00 176.91 175.60 1whr h LEU 189 N -0.73 -0.80 0.45 3.39 3.38 -0.03 0.46 115.31 121.44 1whr h LEU 189 Ca 0.00 0.28 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 1whr h LEU 189 Cb 0.74 0.56 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 1whr h LEU 189 CO -0.29 -0.31 -0.39 0.25 0.09 0.00 0.00 178.44 177.78 1whr h LEU 190 N 0.01 -1.06 -1.33 1.67 5.85 -0.60 -1.79 115.31 118.06 1whr h LEU 190 Ca 0.47 0.08 0.37 0.00 0.84 0.00 0.00 57.88 59.65 1whr h LEU 190 Cb 0.77 0.35 -0.12 0.00 0.37 0.00 0.00 40.66 42.02 1whr h LEU 190 CO -0.95 -0.56 0.75 0.45 -0.34 0.00 0.00 178.44 177.80 1whr h HIS 191 N -0.84 0.62 -0.21 1.25 3.86 -0.21 0.51 115.15 120.13 1whr h HIS 191 Ca -0.04 0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.10 1whr h HIS 191 Cb 0.74 -0.16 -0.00 0.00 1.06 0.00 0.00 27.41 29.04 1whr h HIS 191 CO -0.19 -0.14 -0.22 0.00 0.86 0.00 0.00 177.93 178.24 1whr h ARG 192 N 0.20 0.52 0.01 2.45 2.47 -0.60 -2.33 114.38 117.09 1whr h ARG 192 Ca 0.75 -0.28 0.03 0.00 -1.26 0.00 0.00 59.98 59.22 1whr h ARG 192 Cb 2.15 0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 30.44 1whr h ARG 192 CO -0.42 0.86 -0.25 0.28 0.56 0.00 0.00 179.97 181.00 1whr h VAL 193 N 0.20 0.43 0.77 2.04 2.07 0.76 -1.33 116.25 121.18 1whr h VAL 193 Ca 0.03 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 1whr h VAL 193 Cb 0.77 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1whr h VAL 193 CO 0.05 0.00 -0.44 0.00 0.02 0.00 0.00 177.57 177.20 1whr h ALA 194 N 0.43 -1.15 -1.28 1.67 0.00 -1.43 -1.64 119.26 115.86 1whr h ALA 194 Ca 0.06 -0.24 0.38 0.00 0.00 0.00 0.00 54.91 55.11 1whr h ALA 194 Cb 0.47 0.52 -0.10 0.00 0.00 0.00 0.00 17.79 18.69 1whr h ALA 194 CO -0.21 -1.16 0.86 0.00 0.00 0.00 0.00 179.25 178.74 1whr h ALA 195 N -0.97 2.79 0.09 0.00 0.00 -1.30 0.14 119.26 120.02 1whr h ALA 195 Ca -0.10 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1whr h ALA 195 Cb 0.89 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1whr h ALA 195 CO 0.12 -1.29 -0.05 -0.92 0.00 0.00 0.00 179.25 177.12 1whr h TYR 196 N 0.15 -0.12 0.00 0.00 5.03 -0.70 -3.09 116.97 118.25 1whr h TYR 196 Ca 0.71 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 62.02 1whr h TYR 196 Cb 2.32 0.04 0.00 0.00 1.55 0.00 0.00 36.73 40.64 1whr h TYR 196 CO -0.00 0.38 0.00 0.74 -1.32 0.00 0.00 178.16 177.96 1whr h PHE 197 N -0.72 0.00 -0.39 -3.82 -1.00 0.10 -3.46 116.94 107.65 1whr h PHE 197 Ca -0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.77 1whr h PHE 197 Cb 0.55 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.11 1whr h PHE 197 CO 0.10 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.21 1whr n GLY 198 N -0.91 1.01 3.36 -1.45 0.00 0.12 -3.08 105.19 104.25 1whr n GLY 198 Ca -0.01 -0.30 -0.29 0.00 0.00 0.00 0.00 46.02 45.42 1whr n GLY 198 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1whr s MET 199 N -2.16 1.51 -0.15 1.61 0.23 -0.79 -2.60 119.30 116.96 1whr s MET 199 Ca 0.00 -1.24 -0.07 0.00 -1.03 0.00 0.00 55.69 53.35 1whr s MET 199 Cb 0.00 -1.87 -0.04 0.00 -1.53 0.00 0.00 34.83 31.39 1whr s MET 199 CO 0.00 0.46 0.10 0.34 -2.03 0.00 0.00 175.02 173.89 1whr s ASP 200 N -1.73 5.99 0.21 -1.18 2.15 -1.26 -3.73 116.67 117.12 1whr s ASP 200 Ca 0.12 0.27 0.10 0.00 0.43 0.00 0.00 52.55 53.47 1whr s ASP 200 Cb -0.10 -1.96 -0.05 0.00 -0.30 0.00 0.00 42.92 40.51 1whr s ASP 200 CO 0.04 0.29 -0.18 -1.38 -0.17 0.00 0.00 175.17 173.77 1whr s HIS 201 N -0.33 1.98 0.08 -5.34 -3.43 -1.26 -3.77 115.29 103.21 1whr s HIS 201 Ca 0.10 -0.45 -0.07 0.00 -0.80 0.00 0.00 55.06 53.85 1whr s HIS 201 Cb -0.12 -0.93 -0.01 0.00 -1.43 0.00 0.00 32.58 30.09 1whr s HIS 201 CO 0.01 0.46 0.14 -0.80 -2.00 0.00 0.00 174.74 172.56 1whr s ASN 202 N -3.07 0.20 0.37 7.38 -0.87 -0.88 -5.02 114.94 113.06 1whr s ASN 202 Ca 0.22 -0.71 -0.08 0.00 -1.57 0.00 0.00 52.86 50.72 1whr s ASN 202 Cb -0.04 0.30 -0.06 0.00 -0.02 0.00 0.00 41.25 41.43 1whr s ASN 202 CO 0.09 -0.68 0.70 0.68 -2.57 0.00 0.00 177.10 175.32 1whr s VAL 203 N -3.76 4.87 1.18 1.60 -7.23 -1.26 -1.29 120.40 114.51 1whr s VAL 203 Ca 0.04 0.41 -0.14 0.00 -1.81 0.00 0.00 61.98 60.49 1whr s VAL 203 Cb 0.05 -3.74 0.27 0.00 0.56 0.00 0.00 36.38 33.52 1whr s VAL 203 CO -0.10 -0.48 0.84 -0.67 -0.31 0.00 0.00 175.10 174.38 1whr n ASP 204 N -1.25 -1.94 0.08 4.85 2.03 -0.92 -4.78 116.55 114.63 1whr n ASP 204 Ca 0.01 -0.18 0.05 0.00 0.52 0.00 0.00 54.79 55.19 1whr n ASP 204 Cb 0.54 -1.20 0.27 0.00 -0.72 0.00 0.00 41.12 40.00 1whr n ASP 204 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1whr n GLN 205 N -4.54 0.06 -0.03 -0.67 10.64 -1.26 -2.10 117.38 119.49 1whr n GLN 205 Ca 0.02 0.54 -0.03 0.00 -1.83 0.00 0.00 57.00 55.70 1whr n GLN 205 Cb 0.55 -1.75 -0.03 0.00 -0.86 0.00 0.00 30.24 28.15 1whr n GLN 205 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 1whr n THR 206 N -1.83 0.33 0.00 -0.39 -2.24 -1.26 -5.05 114.28 103.84 1whr n THR 206 Ca -0.01 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1whr n THR 206 Cb 0.06 -0.78 0.00 0.00 -2.10 0.00 0.00 70.33 67.51 1whr n THR 206 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1whr n GLY 207 N 3.01 1.74 0.13 3.38 0.00 -0.89 -5.03 105.19 107.52 1whr n GLY 207 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 1whr n GLY 207 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1whr h LYS 208 N 0.00 0.17 -4.67 1.61 1.57 -1.96 -3.47 116.57 109.82 1whr h LYS 208 Ca 0.00 -0.30 -0.25 0.00 -1.87 0.00 0.00 60.65 58.23 1whr h LYS 208 Cb 0.00 0.11 -0.17 0.00 0.08 0.00 0.00 32.23 32.25 1whr h LYS 208 CO 0.00 1.14 -0.71 0.00 -0.57 0.00 0.00 179.45 179.31 1whr s ALA 209 N -2.48 0.88 -0.18 3.86 0.00 -1.26 -4.84 121.76 117.74 1whr s ALA 209 Ca -0.24 -1.15 -0.13 0.00 0.00 0.00 0.00 51.96 50.44 1whr s ALA 209 Cb 0.06 0.10 -0.05 0.00 0.00 0.00 0.00 23.12 23.24 1whr s ALA 209 CO 0.71 -0.14 0.25 0.54 0.00 0.00 0.00 175.76 177.12 1whr s VAL 210 N -2.77 5.33 -0.09 0.00 0.11 -1.26 -2.16 120.40 119.55 1whr s VAL 210 Ca 0.04 0.44 0.03 0.00 -2.93 0.00 0.00 61.98 59.55 1whr s VAL 210 Cb -0.01 -3.59 -0.01 0.00 -1.53 0.00 0.00 36.38 31.24 1whr s VAL 210 CO -0.02 0.39 -0.18 -0.63 -3.33 0.00 0.00 175.10 171.33 1whr s ILE 211 N 0.57 2.69 0.05 7.04 1.09 -0.41 -3.07 121.20 129.16 1whr s ILE 211 Ca 0.14 -0.81 0.06 0.00 -1.10 0.00 0.00 60.65 58.93 1whr s ILE 211 Cb -0.13 -2.07 -0.03 0.00 -1.06 0.00 0.00 42.46 39.17 1whr s ILE 211 CO 0.03 0.55 -0.13 0.27 -0.10 0.00 0.00 174.94 175.56 1whr s ILE 212 N 0.03 3.20 0.51 2.92 -4.36 -0.65 -2.06 121.20 120.80 1whr s ILE 212 Ca -0.06 -1.10 0.00 0.00 -0.26 0.00 0.00 60.65 59.23 1whr s ILE 212 Cb -0.15 -2.41 0.00 0.00 1.25 0.00 0.00 42.46 41.16 1whr s ILE 212 CO 0.05 0.29 0.03 -0.46 0.24 0.00 0.00 174.94 175.09 1whr n ASN 213 N 1.30 3.36 -4.51 4.36 2.04 -1.25 -1.58 115.26 118.98 1whr n ASN 213 Ca -0.15 -3.20 -0.34 0.00 -0.44 0.00 0.00 54.58 50.45 1whr n ASN 213 Cb 0.52 0.32 -0.12 0.00 -2.53 0.00 0.00 39.78 37.98 1whr n ASN 213 CO 0.00 0.00 0.00 -0.75 -0.44 0.00 0.00 177.26 176.07 1whr s LYS 214 N -3.87 3.58 0.02 -3.83 2.47 -1.08 -4.68 119.74 112.36 1whr s LYS 214 Ca 0.03 -0.52 0.01 0.00 -1.56 0.00 0.00 55.97 53.92 1whr s LYS 214 Cb -0.00 -2.88 -0.02 0.00 -1.46 0.00 0.00 37.83 33.47 1whr s LYS 214 CO 0.02 0.29 -0.05 0.95 0.16 0.00 0.00 175.35 176.72 1whr s THR 215 N 0.24 0.28 0.26 3.43 -4.23 -1.26 -5.05 115.64 109.31 1whr s THR 215 Ca -0.03 -0.80 -0.10 0.00 -1.18 0.00 0.00 61.69 59.58 1whr s THR 215 Cb -0.14 -0.36 0.38 0.00 1.34 0.00 0.00 72.50 73.71 1whr s THR 215 CO 0.03 -0.34 1.58 -1.28 -0.54 0.00 0.00 174.62 174.07 1whr h SER 216 N 4.89 -0.79 -1.18 3.99 0.87 -1.99 0.72 113.55 120.06 1whr h SER 216 Ca -0.32 0.26 0.37 0.00 -1.23 0.00 0.00 61.79 60.87 1whr h SER 216 Cb 1.21 0.53 -0.13 0.00 -0.44 0.00 0.00 62.40 63.57 1whr h SER 216 CO 0.43 -0.29 0.74 0.78 -0.53 0.00 0.00 176.83 177.96 1whr h ASN 217 N 0.00 0.34 -2.32 6.23 4.21 -1.97 -3.38 115.58 118.71 1whr h ASN 217 Ca 0.42 0.14 -0.56 0.00 1.21 0.00 0.00 56.30 57.51 1whr h ASN 217 Cb 0.65 0.11 -0.00 0.00 -1.12 0.00 0.00 38.32 37.96 1whr h ASN 217 CO -0.89 -0.12 1.32 -0.89 -1.29 0.00 0.00 177.43 175.55 1whr s THR 218 N -5.42 3.18 0.23 2.81 2.01 0.25 -4.86 115.64 113.85 1whr s THR 218 Ca -0.08 0.21 0.01 0.00 0.31 0.00 0.00 61.69 62.13 1whr s THR 218 Cb 0.29 -3.19 -0.05 0.00 0.01 0.00 0.00 72.50 69.56 1whr s THR 218 CO 0.81 -0.09 0.07 -0.60 -0.69 0.00 0.00 174.62 174.12 1whr s ARG 219 N 5.34 1.31 0.08 4.92 3.52 -1.18 -4.89 118.95 128.05 1whr s ARG 219 Ca 0.89 -1.69 -0.31 0.00 -0.13 0.00 0.00 55.73 54.50 1whr s ARG 219 Cb -0.34 -0.23 -0.06 0.00 -1.56 0.00 0.00 34.95 32.75 1whr s ARG 219 CO 0.36 -0.25 1.27 0.42 -0.81 0.00 0.00 175.30 176.28 1whr s ILE 220 N -3.75 3.76 0.00 4.11 1.01 -1.26 -4.71 121.20 120.36 1whr s ILE 220 Ca 0.34 1.27 0.00 0.00 0.00 0.00 0.00 60.65 62.26 1whr s ILE 220 Cb 0.07 -3.81 0.00 0.00 0.01 0.00 0.00 42.46 38.73 1whr s ILE 220 CO 0.11 0.10 0.00 -0.81 0.00 0.00 0.00 174.94 174.34 1whr n PRO 221 N 3.92 -0.40 -0.03 2.79 -0.04 -1.26 -4.99 135.00 134.99 1whr n PRO 221 Ca 0.10 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.42 1whr n PRO 221 Cb 0.45 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.80 1whr n PRO 221 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1whr h GLU 222 N 0.00 0.11 -4.01 0.54 3.07 -1.98 -3.48 114.58 108.82 1whr h GLU 222 Ca 0.00 -0.10 -0.13 0.00 -0.50 0.00 0.00 59.36 58.64 1whr h GLU 222 Cb 0.00 0.02 -0.12 0.00 -0.84 0.00 0.00 28.75 27.81 1whr h GLU 222 CO 0.00 0.81 -0.36 -0.65 -1.40 0.00 0.00 179.01 177.41 1whr s GLN 223 N -3.31 1.24 0.16 2.33 -0.21 -1.26 -5.17 119.66 113.44 1whr s GLN 223 Ca -0.16 -1.30 0.07 0.00 0.02 0.00 0.00 55.36 53.98 1whr s GLN 223 Cb 0.01 0.37 -0.04 0.00 1.00 0.00 0.00 33.01 34.34 1whr s GLN 223 CO 0.71 -0.46 -0.02 -0.98 -2.12 0.00 0.00 175.29 172.43 1whr s ARG 224 N -4.02 2.36 0.60 2.91 1.70 -1.26 -4.99 118.95 116.24 1whr s ARG 224 Ca 0.23 -1.10 0.38 0.00 -0.47 0.00 0.00 55.73 54.77 1whr s ARG 224 Cb 0.03 -2.35 2.06 0.00 -0.57 0.00 0.00 34.95 34.13 1whr s ARG 224 CO 0.05 0.46 2.16 0.74 -1.08 0.00 0.00 175.30 177.63 1whr h PHE 225 N 2.83 0.00 0.00 5.89 0.04 -2.00 0.18 116.94 123.87 1whr h PHE 225 Ca -0.47 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.30 1whr h PHE 225 Cb 1.20 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.35 1whr h PHE 225 CO 0.62 0.00 0.00 0.45 -0.60 0.00 0.00 178.31 178.78 1whr n SER 226 N -2.88 0.43 0.16 2.17 2.88 -1.26 -2.75 113.62 112.36 1whr n SER 226 Ca -0.03 0.57 0.13 0.00 -1.33 0.00 0.00 58.87 58.21 1whr n SER 226 Cb 0.12 -0.67 0.53 0.00 -0.75 0.00 0.00 64.21 63.44 1whr n SER 226 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1whr h GLU 227 N 0.00 0.00 0.00 -1.46 4.57 -1.05 -2.09 114.58 114.55 1whr h GLU 227 Ca 0.00 0.00 -0.27 0.00 -1.18 0.00 0.00 59.36 57.91 1whr h GLU 227 Cb 0.48 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.02 1whr h GLU 227 CO 0.00 0.00 -1.80 0.72 -1.18 0.00 0.00 179.01 176.75 1whr n HIS 228 N -2.38 0.74 -1.39 0.92 8.25 -1.11 -4.17 115.22 116.07 1whr n HIS 228 Ca 0.02 0.26 -0.12 0.00 -0.26 0.00 0.00 57.72 57.62 1whr n HIS 228 Cb 0.23 -1.09 0.19 0.00 1.12 0.00 0.00 29.99 30.44 1whr n HIS 228 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 1whr n ILE 229 N -2.91 2.80 -1.53 1.59 -6.64 -1.00 -5.00 119.36 106.67 1whr n ILE 229 Ca -0.18 -2.52 -0.44 0.00 -1.77 0.00 0.00 62.75 57.84 1whr n ILE 229 Cb 1.01 -0.40 -0.05 0.00 -1.44 0.00 0.00 39.64 38.75 1whr n ILE 229 CO 0.00 0.00 0.00 1.17 -1.77 0.00 0.00 176.55 175.95 1whr n LYS 230 N -1.13 1.37 -3.58 6.28 4.81 -0.82 -4.89 118.16 120.20 1whr n LYS 230 Ca 0.43 0.31 -0.14 0.00 -0.87 0.00 0.00 58.31 58.04 1whr n LYS 230 Cb 1.25 -2.94 -0.06 0.00 0.02 0.00 0.00 35.03 33.29 1whr n LYS 230 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1whr s ASP 231 N 8.89 -0.59 -0.20 3.14 -1.08 -1.26 -5.12 116.67 120.46 1whr s ASP 231 Ca 1.05 0.89 -0.11 0.00 -0.52 0.00 0.00 52.55 53.86 1whr s ASP 231 Cb -0.52 0.81 -0.05 0.00 -1.46 0.00 0.00 42.92 41.70 1whr s ASP 231 CO 0.38 -0.37 0.18 -0.70 0.52 0.00 0.00 175.17 175.19 1whr s GLU 232 N -0.47 4.19 -0.19 4.34 2.12 -1.26 -5.07 118.70 122.36 1whr s GLU 232 Ca -0.03 -0.14 -0.04 0.00 0.36 0.00 0.00 54.97 55.12 1whr s GLU 232 Cb -0.02 -3.44 0.10 0.00 0.26 0.00 0.00 34.13 31.02 1whr s GLU 232 CO 0.03 0.24 0.28 0.21 -0.54 0.00 0.00 175.26 175.48 1whr s LYS 233 N 0.53 0.23 -0.27 4.30 2.36 -1.26 -5.10 119.74 120.52 1whr s LYS 233 Ca 0.10 0.47 -0.28 0.00 -2.55 0.00 0.00 55.97 53.71 1whr s LYS 233 Cb -0.12 -0.65 -0.06 0.00 -1.05 0.00 0.00 37.83 35.95 1whr s LYS 233 CO 0.01 -0.54 2.26 -1.71 1.55 0.00 0.00 175.35 176.91 1whr n ASN 234 N 5.34 3.01 -3.72 1.43 4.05 -1.26 -4.93 115.26 119.18 1whr n ASN 234 Ca -0.05 0.11 -0.16 0.00 0.45 0.00 0.00 54.58 54.93 1whr n ASN 234 Cb 0.50 -1.53 -0.16 0.00 1.23 0.00 0.00 39.78 39.82 1whr n ASN 234 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 177.26 174.49 1whr s THR 235 N 8.83 -0.11 -0.41 -0.44 -1.32 -1.26 -5.12 115.64 115.82 1whr s THR 235 Ca 1.02 0.28 -0.23 0.00 -1.21 0.00 0.00 61.69 61.55 1whr s THR 235 Cb -0.36 -0.20 0.02 0.00 -1.51 0.00 0.00 72.50 70.45 1whr s THR 235 CO 0.35 0.12 0.76 -0.70 -2.21 0.00 0.00 174.62 172.93 1whr s GLU 236 N 1.60 3.56 0.25 7.08 2.12 -1.26 -5.04 118.70 127.01 1whr s GLU 236 Ca -0.04 0.05 0.09 0.00 0.36 0.00 0.00 54.97 55.44 1whr s GLU 236 Cb -0.12 -3.87 -0.04 0.00 0.26 0.00 0.00 34.13 30.35 1whr s GLU 236 CO -0.05 -0.96 0.03 -0.59 -0.54 0.00 0.00 175.26 173.15 1whr s PHE 237 N 3.12 2.79 -0.22 5.30 -0.12 -1.26 -5.07 117.98 122.52 1whr s PHE 237 Ca 0.29 -0.19 -0.16 0.00 -0.05 0.00 0.00 56.93 56.82 1whr s PHE 237 Cb -0.13 -1.26 -0.09 0.00 -0.63 0.00 0.00 43.02 40.92 1whr s PHE 237 CO 0.19 0.59 -0.32 1.04 -0.05 0.00 0.00 175.22 176.67 1whr n GLN 238 N -0.84 0.55 -3.37 1.99 6.02 -1.26 -5.02 117.38 115.45 1whr n GLN 238 Ca -0.07 0.26 -0.19 0.00 -0.01 0.00 0.00 57.00 56.99 1whr n GLN 238 Cb 0.58 -1.48 0.07 0.00 1.02 0.00 0.00 30.24 30.43 1whr n GLN 238 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1whr n GLN 239 N -4.39 -6.39 -3.70 -1.09 7.27 -1.26 -5.00 117.38 102.81 1whr n GLN 239 Ca -0.29 0.68 -0.31 0.00 0.07 0.00 0.00 57.00 57.14 1whr n GLN 239 Cb 0.65 -5.26 -0.04 0.00 2.41 0.00 0.00 30.24 27.99 1whr n GLN 239 CO 0.00 0.00 0.00 -0.98 0.07 0.00 0.00 177.06 176.15 1whr s ARG 240 N -5.96 3.59 -0.30 3.69 1.70 -1.26 -5.09 118.95 115.32 1whr s ARG 240 Ca 0.42 -0.15 -0.17 0.00 -0.47 0.00 0.00 55.73 55.37 1whr s ARG 240 Cb -0.19 -2.87 0.18 0.00 -0.57 0.00 0.00 34.95 31.50 1whr s ARG 240 CO 0.59 0.48 1.14 -0.59 -1.08 0.00 0.00 175.30 175.84 1whr s PHE 241 N -1.66 -0.36 -0.21 5.89 -0.71 -1.26 -5.15 117.98 114.52 1whr s PHE 241 Ca 0.40 0.53 -0.10 0.00 -1.04 0.00 0.00 56.93 56.72 1whr s PHE 241 Cb -0.12 0.18 -0.05 0.00 -1.21 0.00 0.00 43.02 41.82 1whr s PHE 241 CO 0.25 -0.18 0.13 0.96 -1.34 0.00 0.00 175.22 175.04 1whr s ILE 242 N 2.47 5.31 0.11 -4.49 -4.36 -1.26 -5.07 121.20 113.90 1whr s ILE 242 Ca -0.02 0.16 -0.25 0.00 -0.26 0.00 0.00 60.65 60.28 1whr s ILE 242 Cb -0.05 -3.44 0.08 0.00 1.25 0.00 0.00 42.46 40.29 1whr s ILE 242 CO -0.14 0.41 0.65 -1.48 0.24 0.00 0.00 174.94 174.62 1whr s LEU 243 N 0.63 -0.55 -0.15 0.37 -0.00 -1.26 -5.09 118.68 112.63 1whr s LEU 243 Ca 0.07 0.10 -0.08 0.00 -0.00 0.00 0.00 54.13 54.22 1whr s LEU 243 Cb -0.12 2.51 -0.07 0.00 -0.00 0.00 0.00 46.19 48.51 1whr s LEU 243 CO 0.01 -0.87 -0.20 -0.24 -0.00 0.00 0.00 176.35 175.04 1whr n SER 244 N -0.17 1.14 0.00 1.48 2.88 -1.26 -5.15 113.62 112.54 1whr n SER 244 Ca -0.16 0.20 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1whr n SER 244 Cb 0.63 -0.47 0.00 0.00 -0.75 0.00 0.00 64.21 63.62 1whr n SER 244 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1whr n GLY 245 N 2.02 -0.56 3.77 0.46 0.00 -1.26 -5.01 105.19 104.61 1whr n GLY 245 Ca -0.30 -1.44 -0.33 0.00 0.00 0.00 0.00 46.02 43.95 1whr n GLY 245 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1whr s PRO 246 N -4.62 2.75 -0.52 1.61 0.04 -1.26 -5.03 135.00 127.97 1whr s PRO 246 Ca 0.00 1.37 0.03 0.00 0.04 0.00 0.00 61.00 62.44 1whr s PRO 246 Cb 0.00 -1.95 0.15 0.00 0.04 0.00 0.00 34.50 32.74 1whr s PRO 246 CO 0.00 -1.28 0.31 -1.54 0.04 0.00 0.00 177.00 174.53 1whr s SER 247 N -2.66 3.85 -1.58 6.66 1.04 -1.26 -4.83 113.70 114.93 1whr s SER 247 Ca 0.66 -3.06 -0.15 0.00 0.48 0.00 0.00 55.95 53.89 1whr s SER 247 Cb -0.20 -1.26 0.10 0.00 0.10 0.00 0.00 66.02 64.76 1whr s SER 247 CO 0.43 -0.20 0.92 -1.20 0.98 0.00 0.00 173.24 174.16 1whr n SER 248 N 2.99 -4.23 0.00 7.02 7.64 -1.26 -5.34 113.62 120.43 1whr n SER 248 Ca 0.13 -0.85 0.00 0.00 1.01 0.00 0.00 58.87 59.16 1whr n SER 248 Cb 0.35 -3.55 0.00 0.00 -1.01 0.00 0.00 64.21 60.00 1whr n SER 248 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64