#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dr1 n HIS 154 N 0.00 0.00 0.00 0.66 -0.00 -1.26 -5.18 115.22 109.44 3dr1 n HIS 154 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 3dr1 n HIS 154 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 3dr1 n HIS 154 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3dr1 n MET 155 N 0.00 0.00 -1.18 -0.41 -0.00 -1.26 -5.04 117.12 109.23 3dr1 n MET 155 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 57.70 57.33 3dr1 n MET 155 Cb 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 33.22 33.26 3dr1 n MET 155 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 3dr1 n LEU 156 N 0.00 -2.60 -4.92 3.17 4.77 -1.26 -4.97 117.00 111.19 3dr1 n LEU 156 Ca 0.00 0.51 -0.26 0.00 -0.03 0.00 0.00 56.01 56.23 3dr1 n LEU 156 Cb 0.00 -0.96 0.03 0.00 -2.33 0.00 0.00 43.42 40.16 3dr1 n LEU 156 CO 0.00 -4.49 0.50 -0.94 -1.33 0.00 0.00 177.39 171.13 3dr1 s SER 157 N -1.19 5.59 0.14 -1.43 1.04 -1.26 -4.92 113.70 111.66 3dr1 s SER 157 Ca 0.56 0.63 -0.18 0.00 0.48 0.00 0.00 55.95 57.43 3dr1 s SER 157 Cb -0.36 -1.64 0.01 0.00 0.10 0.00 0.00 66.02 64.13 3dr1 s SER 157 CO 0.68 -1.03 1.74 -0.78 0.98 0.00 0.00 173.24 174.82 3dr1 h ASP 158 N -0.10 0.07 -0.07 7.02 3.58 -1.99 -2.06 116.42 122.86 3dr1 h ASP 158 Ca -0.45 0.03 0.03 0.00 0.42 0.00 0.00 57.03 57.06 3dr1 h ASP 158 Cb 1.26 0.03 -0.03 0.00 1.72 0.00 0.00 39.33 42.31 3dr1 h ASP 158 CO 0.60 0.07 -0.11 -0.08 -2.88 0.00 0.00 179.24 176.84 3dr1 h GLU 159 N 0.19 -0.15 -0.64 0.28 4.81 -2.00 -1.17 114.58 115.91 3dr1 h GLU 159 Ca 0.12 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.43 3dr1 h GLU 159 Cb 0.11 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.46 3dr1 h GLU 159 CO -0.14 -0.10 0.33 1.96 -0.73 0.00 0.00 179.01 180.33 3dr1 h GLN 160 N -0.15 0.58 -0.77 1.92 4.20 -1.91 -2.22 115.11 116.76 3dr1 h GLN 160 Ca 0.06 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.70 3dr1 h GLN 160 Cb 0.24 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 27.86 3dr1 h GLN 160 CO -0.16 0.38 0.34 1.98 -0.67 0.00 0.00 178.83 180.70 3dr1 h MET 161 N 0.60 1.12 0.00 1.46 4.05 -0.91 -1.50 114.93 119.75 3dr1 h MET 161 Ca 0.30 -0.18 -0.05 0.00 -0.28 0.00 0.00 59.70 59.49 3dr1 h MET 161 Cb 0.25 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 30.84 3dr1 h MET 161 CO -0.21 0.89 -0.24 1.96 0.23 0.00 0.00 176.91 179.54 3dr1 h GLN 162 N 1.10 0.00 -0.33 0.39 4.20 -0.66 -1.23 115.11 118.59 3dr1 h GLN 162 Ca 0.26 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.85 3dr1 h GLN 162 Cb 0.16 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 3dr1 h GLN 162 CO -0.03 0.24 -0.28 0.82 -0.67 0.00 0.00 178.83 178.91 3dr1 h ILE 163 N 0.00 1.29 -0.67 2.54 2.04 -0.76 -2.07 117.51 119.87 3dr1 h ILE 163 Ca -0.00 -1.44 -0.08 0.00 1.00 0.00 0.00 64.86 64.34 3dr1 h ILE 163 Cb 0.48 1.48 -0.03 0.00 -0.74 0.00 0.00 36.82 38.01 3dr1 h ILE 163 CO 0.03 0.47 0.12 0.40 0.00 0.00 0.00 178.15 179.17 3dr1 h ILE 164 N 0.55 1.26 -0.42 -0.67 2.04 -0.74 -1.12 117.51 118.41 3dr1 h ILE 164 Ca 0.06 -1.03 -0.05 0.00 1.00 0.00 0.00 64.86 64.84 3dr1 h ILE 164 Cb 0.85 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 3dr1 h ILE 164 CO 0.07 0.39 0.06 0.78 0.00 0.00 0.00 178.15 179.45 3dr1 h ASN 165 N 1.04 0.60 -0.25 1.72 2.35 -1.14 -1.48 115.58 118.41 3dr1 h ASN 165 Ca 0.21 -0.11 -0.08 0.00 -0.55 0.00 0.00 56.30 55.77 3dr1 h ASN 165 Cb 0.43 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 3dr1 h ASN 165 CO 0.01 0.63 -0.17 0.28 -1.65 0.00 0.00 177.43 176.53 3dr1 h SER 166 N 0.62 0.57 -0.34 5.81 0.02 -0.80 -1.34 113.55 118.09 3dr1 h SER 166 Ca 0.14 -0.44 -0.08 0.00 -0.84 0.00 0.00 61.79 60.56 3dr1 h SER 166 Cb 0.30 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 3dr1 h SER 166 CO 0.00 0.89 -0.11 -0.07 -1.14 0.00 0.00 176.83 176.41 3dr1 h LEU 167 N 0.26 0.68 -0.48 5.07 3.38 -1.08 -0.34 115.31 122.81 3dr1 h LEU 167 Ca 0.05 -0.38 -0.05 0.00 0.09 0.00 0.00 57.88 57.59 3dr1 h LEU 167 Cb 0.70 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 3dr1 h LEU 167 CO 0.05 0.91 0.09 0.58 0.09 0.00 0.00 178.44 180.15 3dr1 h VAL 168 N 0.46 1.25 -0.40 1.22 2.07 -1.32 -0.02 116.25 119.51 3dr1 h VAL 168 Ca 0.08 -0.90 -0.05 0.00 0.82 0.00 0.00 66.70 66.65 3dr1 h VAL 168 Cb 0.62 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 3dr1 h VAL 168 CO 0.04 0.32 0.04 -0.08 0.02 0.00 0.00 177.57 177.91 3dr1 h GLU 169 N 0.66 0.68 -0.63 1.57 4.81 -1.22 -2.01 114.58 118.44 3dr1 h GLU 169 Ca 0.15 -0.20 0.07 0.00 -0.13 0.00 0.00 59.36 59.25 3dr1 h GLU 169 Cb 0.38 -0.07 -0.06 0.00 0.63 0.00 0.00 28.75 29.62 3dr1 h GLU 169 CO 0.01 0.75 0.30 0.00 -0.73 0.00 0.00 179.01 179.34 3dr1 h ALA 170 N 0.91 0.84 -0.48 2.92 0.00 -0.78 -0.89 119.26 121.77 3dr1 h ALA 170 Ca 0.12 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 3dr1 h ALA 170 Cb 0.42 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3dr1 h ALA 170 CO 0.01 -0.07 0.13 1.25 0.00 0.00 0.00 179.25 180.57 3dr1 h HIS 171 N 0.55 0.79 -0.51 0.00 -0.00 -0.83 -2.08 115.15 113.07 3dr1 h HIS 171 Ca 0.30 -0.09 -0.01 0.00 -0.00 0.00 0.00 60.37 60.57 3dr1 h HIS 171 Cb 0.28 -0.23 -0.03 0.00 -0.00 0.00 0.00 27.41 27.44 3dr1 h HIS 171 CO -0.12 0.71 0.27 0.45 -0.00 0.00 0.00 177.93 179.24 3dr1 h HIS 172 N 0.65 0.68 0.00 5.26 -0.00 -0.70 0.01 115.15 121.05 3dr1 h HIS 172 Ca 0.15 -0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.49 3dr1 h HIS 172 Cb 0.30 -0.22 -0.00 0.00 -0.00 0.00 0.00 27.41 27.49 3dr1 h HIS 172 CO 0.02 0.49 -0.10 -0.22 -0.00 0.00 0.00 177.93 178.12 3dr1 h LYS 173 N 0.71 0.00 0.00 2.45 3.64 -0.91 -3.29 116.57 119.16 3dr1 h LYS 173 Ca 0.18 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3dr1 h LYS 173 Cb 0.03 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 3dr1 h LYS 173 CO -0.03 0.10 -0.03 0.25 -2.27 0.00 0.00 179.45 177.47 3dr1 n THR 174 N -3.18 1.73 -3.58 1.00 -2.24 -0.53 -4.98 114.28 102.49 3dr1 n THR 174 Ca 0.01 -2.07 -0.10 0.00 -2.27 0.00 0.00 64.05 59.62 3dr1 n THR 174 Cb 0.43 -0.16 -0.10 0.00 -2.10 0.00 0.00 70.33 68.40 3dr1 n THR 174 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3dr1 s TYR 175 N -2.62 -0.68 -0.26 4.78 6.14 -0.12 -4.86 117.35 119.73 3dr1 s TYR 175 Ca 0.29 1.17 -0.08 0.00 0.64 0.00 0.00 57.07 59.08 3dr1 s TYR 175 Cb 0.25 0.12 -0.03 0.00 0.42 0.00 0.00 41.96 42.72 3dr1 s TYR 175 CO 0.03 -0.51 0.10 0.34 0.64 0.00 0.00 175.55 176.15 3dr1 s ASP 176 N 2.53 5.34 0.00 4.32 2.15 -1.26 -4.73 116.67 125.03 3dr1 s ASP 176 Ca 0.03 -0.20 0.19 0.00 0.43 0.00 0.00 52.55 52.99 3dr1 s ASP 176 Cb -0.13 -1.97 1.12 0.00 -0.30 0.00 0.00 42.92 41.65 3dr1 s ASP 176 CO -0.12 -0.05 1.54 0.47 -0.17 0.00 0.00 175.17 176.83 3dr1 n ASP 177 N 4.95 0.00 -0.01 -0.34 8.00 -1.26 -2.45 116.55 125.45 3dr1 n ASP 177 Ca -0.16 -0.74 0.11 0.00 0.71 0.00 0.00 54.79 54.72 3dr1 n ASP 177 Cb 0.51 0.00 -0.16 0.00 -0.02 0.00 0.00 41.12 41.45 3dr1 n ASP 177 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3dr1 n SER 178 N -0.94 0.12 -3.22 -2.24 3.41 -1.26 -4.98 113.62 104.51 3dr1 n SER 178 Ca 0.14 -0.10 -0.22 0.00 -0.26 0.00 0.00 58.87 58.43 3dr1 n SER 178 Cb 0.06 1.86 0.01 0.00 -0.26 0.00 0.00 64.21 65.88 3dr1 n SER 178 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3dr1 n TYR 179 N -2.19 -1.81 0.22 7.33 4.02 -1.02 -4.84 117.16 118.87 3dr1 n TYR 179 Ca -0.03 0.46 0.09 0.00 -0.01 0.00 0.00 57.90 58.41 3dr1 n TYR 179 Cb 0.54 -3.33 0.50 0.00 -0.02 0.00 0.00 39.34 37.04 3dr1 n TYR 179 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3dr1 h SER 180 N -1.02 0.00 0.77 7.72 4.64 -1.89 -2.96 113.55 120.80 3dr1 h SER 180 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3dr1 h SER 180 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3dr1 h SER 180 CO 0.53 0.23 0.00 0.47 -0.87 0.00 0.00 176.83 177.19 3dr1 n ASP 181 N -3.52 0.24 0.31 4.97 8.00 -1.26 -3.47 116.55 121.82 3dr1 n ASP 181 Ca -0.01 0.54 0.20 0.00 0.71 0.00 0.00 54.79 56.24 3dr1 n ASP 181 Cb 0.39 -0.60 1.00 0.00 -0.02 0.00 0.00 41.12 41.90 3dr1 n ASP 181 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 3dr1 h PHE 182 N 0.00 0.00 0.00 1.24 -1.00 -1.91 -1.99 116.94 113.28 3dr1 h PHE 182 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 3dr1 h PHE 182 Cb 0.38 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.94 3dr1 h PHE 182 CO 0.00 0.02 0.00 1.33 -1.61 0.00 0.00 178.31 178.05 3dr1 n VAL 183 N -3.21 0.99 1.08 -0.55 0.24 -1.23 -1.65 118.33 114.01 3dr1 n VAL 183 Ca -0.02 0.29 0.12 0.00 -2.04 0.00 0.00 64.34 62.69 3dr1 n VAL 183 Cb 0.15 -1.14 0.24 0.00 -1.47 0.00 0.00 33.84 31.61 3dr1 n VAL 183 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3dr1 n ARG 184 N -1.86 0.36 -1.78 7.34 1.74 -0.75 -4.90 116.66 116.82 3dr1 n ARG 184 Ca 0.02 -0.23 -0.31 0.00 -0.77 0.00 0.00 57.85 56.56 3dr1 n ARG 184 Cb 0.18 -1.50 0.03 0.00 -1.02 0.00 0.00 32.46 30.15 3dr1 n ARG 184 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3dr1 s PHE 185 N -2.80 3.44 0.19 -1.55 2.99 -0.66 -4.96 117.98 114.64 3dr1 s PHE 185 Ca 0.16 1.30 -0.31 0.00 0.00 0.00 0.00 56.93 58.08 3dr1 s PHE 185 Cb 0.18 -2.80 -0.11 0.00 0.00 0.00 0.00 43.02 40.29 3dr1 s PHE 185 CO 0.65 -0.91 1.60 1.03 -0.00 0.00 0.00 175.22 177.59 3dr1 s ARG 186 N -5.15 4.19 0.32 0.44 0.52 -1.26 -4.88 118.95 113.12 3dr1 s ARG 186 Ca 0.56 2.45 -0.29 0.00 -0.52 0.00 0.00 55.73 57.93 3dr1 s ARG 186 Cb -0.12 -3.12 -0.13 0.00 0.52 0.00 0.00 34.95 32.11 3dr1 s ARG 186 CO 0.54 -0.64 1.30 -0.35 0.02 0.00 0.00 175.30 176.17 3dr1 n PRO 187 N 3.70 2.06 -1.12 3.54 -0.04 -1.26 -3.87 135.00 138.01 3dr1 n PRO 187 Ca 0.13 0.73 -0.30 0.00 -0.04 0.00 0.00 63.50 64.02 3dr1 n PRO 187 Cb 0.38 -2.31 0.14 0.00 -0.04 0.00 0.00 33.50 31.67 3dr1 n PRO 187 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3dr1 s PRO 188 N -1.52 1.24 -0.20 0.54 0.04 -1.26 -4.59 135.00 129.24 3dr1 s PRO 188 Ca 0.58 0.94 -0.06 0.00 0.04 0.00 0.00 61.00 62.51 3dr1 s PRO 188 Cb -0.59 -1.80 0.10 0.00 0.04 0.00 0.00 34.50 32.25 3dr1 s PRO 188 CO 0.59 -2.29 0.39 0.08 0.04 0.00 0.00 177.00 175.82 3dr1 s VAL 189 N -2.87 -0.62 -0.46 -0.36 1.01 -1.26 -5.06 120.40 110.78 3dr1 s VAL 189 Ca 0.64 0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.76 3dr1 s VAL 189 Cb -0.19 -0.68 0.13 0.00 0.00 0.00 0.00 36.38 35.64 3dr1 s VAL 189 CO 0.57 0.03 0.24 0.00 0.00 0.00 0.00 175.10 175.94 3dr1 s ARG 190 N 2.58 1.52 0.00 2.72 1.70 -1.26 -3.65 118.95 122.55 3dr1 s ARG 190 Ca 0.02 -2.19 0.00 0.00 -0.47 0.00 0.00 55.73 53.09 3dr1 s ARG 190 Cb -0.13 -2.69 0.00 0.00 -0.57 0.00 0.00 34.95 31.56 3dr1 s ARG 190 CO -0.13 -1.13 0.00 0.54 -1.08 0.00 0.00 175.30 173.50 3dr1 n ARG 251 N 3.45 0.00 -2.70 3.89 5.12 -1.26 -5.08 116.66 120.08 3dr1 n ARG 251 Ca 0.07 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.55 3dr1 n ARG 251 Cb 0.34 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.64 3dr1 n ARG 251 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3dr1 n LEU 252 N 0.00 5.46 0.05 0.55 4.77 -1.26 -4.78 117.00 121.80 3dr1 n LEU 252 Ca 0.00 -4.34 -0.02 0.00 -0.03 0.00 0.00 56.01 51.62 3dr1 n LEU 252 Cb 0.00 -1.63 0.25 0.00 -2.33 0.00 0.00 43.42 39.71 3dr1 n LEU 252 CO 0.00 0.71 0.75 -1.28 -1.33 0.00 0.00 177.39 176.24 3dr1 h SER 253 N 6.96 0.38 0.37 -1.43 0.87 -1.25 -3.03 113.55 116.41 3dr1 h SER 253 Ca 0.38 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.82 3dr1 h SER 253 Cb 0.82 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 3dr1 h SER 253 CO 1.39 0.63 -0.34 0.23 -0.53 0.00 0.00 176.83 178.21 3dr1 n MET 254 N -4.13 0.46 -0.18 2.24 2.81 -0.23 -4.04 117.12 114.04 3dr1 n MET 254 Ca -0.01 -0.26 -0.00 0.00 -1.81 0.00 0.00 57.70 55.62 3dr1 n MET 254 Cb 0.39 -1.49 0.09 0.00 -0.71 0.00 0.00 33.22 31.49 3dr1 n MET 254 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 3dr1 h LEU 255 N 0.63 -0.12 -0.43 4.03 5.85 -1.48 -0.79 115.31 123.00 3dr1 h LEU 255 Ca 0.00 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.84 3dr1 h LEU 255 Cb 0.49 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.69 3dr1 h LEU 255 CO 0.00 -0.04 0.27 -0.65 -0.34 0.00 0.00 178.44 177.68 3dr1 h PRO 256 N 0.18 0.58 -0.03 5.25 0.11 -1.80 0.50 132.00 136.80 3dr1 h PRO 256 Ca 0.29 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.36 3dr1 h PRO 256 Cb 0.45 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.43 3dr1 h PRO 256 CO -0.43 0.40 -0.00 1.25 -0.21 0.00 0.00 178.00 179.01 3dr1 h HIS 257 N 0.58 0.06 -0.26 0.65 -0.00 -1.58 -2.63 115.15 111.97 3dr1 h HIS 257 Ca 0.16 -0.01 -0.07 0.00 -0.00 0.00 0.00 60.37 60.44 3dr1 h HIS 257 Cb -0.04 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 27.34 3dr1 h HIS 257 CO -0.04 0.39 -0.14 -0.07 -0.00 0.00 0.00 177.93 178.07 3dr1 h LEU 258 N -0.29 0.42 -0.80 0.26 3.38 -1.11 -0.73 115.31 116.44 3dr1 h LEU 258 Ca 0.01 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3dr1 h LEU 258 Cb 0.37 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 3dr1 h LEU 258 CO 0.00 0.60 0.51 0.00 0.09 0.00 0.00 178.44 179.64 3dr1 h ALA 259 N 1.45 1.01 -0.17 1.53 0.00 -0.86 0.49 119.26 122.71 3dr1 h ALA 259 Ca 0.07 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 3dr1 h ALA 259 Cb 0.49 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3dr1 h ALA 259 CO 0.03 0.45 -0.37 -0.44 0.00 0.00 0.00 179.25 178.92 3dr1 h ASP 260 N 1.09 0.39 0.05 0.00 3.32 -1.02 -0.54 116.42 119.70 3dr1 h ASP 260 Ca 0.29 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 3dr1 h ASP 260 Cb -0.09 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.35 3dr1 h ASP 260 CO -0.06 0.73 -0.02 0.25 -1.72 0.00 0.00 179.24 178.42 3dr1 h LEU 261 N 0.32 -0.05 -0.48 1.55 5.85 -0.27 -1.60 115.31 120.62 3dr1 h LEU 261 Ca 0.03 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.46 3dr1 h LEU 261 Cb 0.80 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 3dr1 h LEU 261 CO 0.06 0.27 0.32 0.58 -0.34 0.00 0.00 178.44 179.34 3dr1 h VAL 262 N -0.39 1.13 -0.42 1.05 2.07 -0.87 -1.26 116.25 117.55 3dr1 h VAL 262 Ca -0.01 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 67.29 3dr1 h VAL 262 Cb 0.35 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 3dr1 h VAL 262 CO 0.01 0.12 0.27 -1.28 0.02 0.00 0.00 177.57 176.72 3dr1 h SER 263 N 0.65 0.47 -0.78 0.57 0.87 -1.07 -0.33 113.55 113.93 3dr1 h SER 263 Ca 0.18 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.72 3dr1 h SER 263 Cb -0.07 -0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 61.74 3dr1 h SER 263 CO -0.04 0.34 0.48 0.22 -0.53 0.00 0.00 176.83 177.30 3dr1 h TYR 264 N 0.56 1.03 -0.69 2.24 3.20 -1.07 -2.35 116.97 119.88 3dr1 h TYR 264 Ca 0.16 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.98 3dr1 h TYR 264 Cb -0.05 -0.34 -0.03 0.00 1.54 0.00 0.00 36.73 37.85 3dr1 h TYR 264 CO -0.05 0.69 0.22 0.77 -1.64 0.00 0.00 178.16 178.15 3dr1 h SER 265 N 1.07 0.98 -0.75 -2.11 0.02 -0.37 -1.69 113.55 110.70 3dr1 h SER 265 Ca 0.28 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 3dr1 h SER 265 Cb -0.05 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.20 3dr1 h SER 265 CO -0.05 0.91 0.41 0.40 -1.14 0.00 0.00 176.83 177.36 3dr1 h ILE 266 N 1.02 1.23 -0.67 3.27 2.04 -0.67 0.67 117.51 124.39 3dr1 h ILE 266 Ca 0.23 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.52 3dr1 h ILE 266 Cb 0.28 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 36.56 3dr1 h ILE 266 CO -0.01 0.25 0.42 1.56 0.00 0.00 0.00 178.15 180.38 3dr1 h GLN 267 N 1.04 0.89 -0.01 2.37 4.20 -0.91 0.03 115.11 122.73 3dr1 h GLN 267 Ca 0.26 -0.06 -0.24 0.00 0.06 0.00 0.00 58.65 58.67 3dr1 h GLN 267 Cb 0.04 -0.20 0.01 0.00 0.30 0.00 0.00 27.48 27.63 3dr1 h GLN 267 CO -0.04 0.60 -0.97 0.87 -0.67 0.00 0.00 178.83 178.62 3dr1 h LYS 268 N 0.91 0.55 -0.14 1.46 1.79 -0.31 -2.71 116.57 118.11 3dr1 h LYS 268 Ca 0.24 -0.58 -0.08 0.00 -2.18 0.00 0.00 60.65 58.05 3dr1 h LYS 268 Cb -0.07 0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.72 3dr1 h LYS 268 CO -0.05 1.20 -0.29 0.28 -1.08 0.00 0.00 179.45 179.51 3dr1 h VAL 269 N 0.31 1.26 -0.38 0.50 2.07 0.91 -1.87 116.25 119.05 3dr1 h VAL 269 Ca -0.10 -1.23 -0.13 0.00 0.82 0.00 0.00 66.70 66.06 3dr1 h VAL 269 Cb 1.61 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 32.84 3dr1 h VAL 269 CO 0.18 0.37 -0.26 0.40 0.02 0.00 0.00 177.57 178.28 3dr1 h ILE 270 N 0.24 1.28 -0.74 4.57 2.04 -1.00 -0.68 117.51 123.23 3dr1 h ILE 270 Ca 0.04 -1.42 -0.02 0.00 1.00 0.00 0.00 64.86 64.46 3dr1 h ILE 270 Cb 0.64 1.36 -0.03 0.00 -0.74 0.00 0.00 36.82 38.05 3dr1 h ILE 270 CO 0.05 0.47 0.39 1.23 0.00 0.00 0.00 178.15 180.28 3dr1 h GLY 271 N 0.65 1.11 0.79 5.37 0.00 -1.14 -1.24 103.07 108.61 3dr1 h GLY 271 Ca 0.07 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.88 3dr1 h GLY 271 CO 0.07 0.50 -0.07 -2.75 0.00 0.00 0.00 176.54 174.29 3dr1 h PHE 272 N 1.02 -0.18 -0.66 5.60 3.57 -1.21 -3.15 116.94 121.94 3dr1 h PHE 272 Ca 0.26 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.88 3dr1 h PHE 272 Cb 0.06 0.06 -0.09 0.00 2.79 0.00 0.00 35.95 38.77 3dr1 h PHE 272 CO 0.00 0.07 0.17 0.00 -2.23 0.00 0.00 178.31 176.31 3dr1 h ALA 273 N 0.42 0.82 0.00 2.41 0.00 -0.90 0.19 119.26 122.20 3dr1 h ALA 273 Ca -0.02 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3dr1 h ALA 273 Cb 0.32 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3dr1 h ALA 273 CO 0.03 -0.30 0.00 0.87 0.00 0.00 0.00 179.25 179.86 3dr1 h LYS 274 N 0.29 0.00 -0.17 0.00 1.57 -1.19 -0.74 116.57 116.34 3dr1 h LYS 274 Ca 0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 3dr1 h LYS 274 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 3dr1 h LYS 274 CO -0.43 0.00 0.00 -1.33 -0.57 0.00 0.00 179.45 177.12 3dr1 n MET 275 N -2.49 1.76 -2.45 3.15 2.81 0.65 -4.58 117.12 115.97 3dr1 n MET 275 Ca -0.02 -1.74 -0.42 0.00 -1.81 0.00 0.00 57.70 53.71 3dr1 n MET 275 Cb 0.06 -1.35 -0.03 0.00 -0.71 0.00 0.00 33.22 31.20 3dr1 n MET 275 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3dr1 s ILE 276 N -1.29 4.25 -0.20 2.02 1.01 -0.28 -4.72 121.20 121.98 3dr1 s ILE 276 Ca 0.24 1.57 -0.32 0.00 0.00 0.00 0.00 60.65 62.15 3dr1 s ILE 276 Cb 0.15 -4.01 -0.09 0.00 0.01 0.00 0.00 42.46 38.53 3dr1 s ILE 276 CO 0.22 -0.02 2.12 -0.81 0.00 0.00 0.00 174.94 176.45 3dr1 n PRO 277 N 5.36 1.85 0.00 2.79 -0.04 -1.26 -2.20 135.00 141.49 3dr1 n PRO 277 Ca 0.11 0.57 0.00 0.00 -0.04 0.00 0.00 63.50 64.14 3dr1 n PRO 277 Cb 0.46 -2.88 0.00 0.00 -0.04 0.00 0.00 33.50 31.04 3dr1 n PRO 277 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dr1 n GLY 278 N 5.58 3.09 0.22 0.55 0.00 -1.26 -4.97 105.19 108.41 3dr1 n GLY 278 Ca 0.31 -1.08 -0.01 0.00 0.00 0.00 0.00 46.02 45.23 3dr1 n GLY 278 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3dr1 h PHE 279 N 0.00 -0.17 -0.16 1.61 3.57 -1.73 -1.11 116.94 118.95 3dr1 h PHE 279 Ca 0.00 0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.59 3dr1 h PHE 279 Cb 0.00 0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 3dr1 h PHE 279 CO 0.00 -0.20 0.22 0.00 -2.23 0.00 0.00 178.31 176.10 3dr1 h ARG 280 N 0.05 0.00 -0.20 1.11 -0.00 -1.81 -0.53 114.38 113.01 3dr1 h ARG 280 Ca 0.28 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.76 3dr1 h ARG 280 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.42 3dr1 h ARG 280 CO -0.54 0.00 0.00 -0.25 0.00 0.00 0.00 179.97 179.18 3dr1 n ASP 281 N -3.61 1.41 -4.76 7.04 8.00 -0.42 -4.87 116.55 119.34 3dr1 n ASP 281 Ca 0.01 -1.79 -0.25 0.00 0.71 0.00 0.00 54.79 53.47 3dr1 n ASP 281 Cb 0.34 -0.13 0.09 0.00 -0.02 0.00 0.00 41.12 41.40 3dr1 n ASP 281 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3dr1 s LEU 282 N -1.33 2.90 0.14 0.64 1.43 -0.21 -5.03 118.68 117.22 3dr1 s LEU 282 Ca 0.26 0.17 -0.30 0.00 -1.03 0.00 0.00 54.13 53.23 3dr1 s LEU 282 Cb 0.14 -2.69 -0.07 0.00 0.03 0.00 0.00 46.19 43.60 3dr1 s LEU 282 CO 0.20 -1.76 0.98 0.42 0.23 0.00 0.00 176.35 176.41 3dr1 s THR 283 N -3.25 4.35 0.37 5.49 -4.23 -1.26 -4.86 115.64 112.25 3dr1 s THR 283 Ca 0.63 2.02 0.20 0.00 -1.18 0.00 0.00 61.69 63.36 3dr1 s THR 283 Cb -0.08 -4.29 0.35 0.00 1.34 0.00 0.00 72.50 69.82 3dr1 s THR 283 CO 0.45 0.34 1.58 0.00 -0.54 0.00 0.00 174.62 176.45 3dr1 h ALA 284 N 5.30 2.13 -0.79 3.99 0.00 -1.95 0.96 119.26 128.89 3dr1 h ALA 284 Ca -0.43 0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 3dr1 h ALA 284 Cb 1.21 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 19.30 3dr1 h ALA 284 CO 0.71 -0.94 0.48 0.93 0.00 0.00 0.00 179.25 180.44 3dr1 h GLU 285 N 0.01 1.06 -0.01 0.00 3.07 -1.99 0.19 114.58 116.91 3dr1 h GLU 285 Ca 0.84 -0.09 -0.18 0.00 -0.50 0.00 0.00 59.36 59.43 3dr1 h GLU 285 Cb 2.20 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 29.87 3dr1 h GLU 285 CO -0.77 0.74 -0.78 -0.44 -1.40 0.00 0.00 179.01 176.36 3dr1 h ASP 286 N 1.08 0.20 0.02 1.42 3.32 0.53 0.24 116.42 123.22 3dr1 h ASP 286 Ca 0.28 -0.15 -0.00 0.00 0.02 0.00 0.00 57.03 57.19 3dr1 h ASP 286 Cb -0.05 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.44 3dr1 h ASP 286 CO -0.05 0.90 -0.01 1.56 -1.72 0.00 0.00 179.24 179.92 3dr1 h GLN 287 N 0.10 -0.02 0.36 3.56 4.20 -0.60 0.16 115.11 122.88 3dr1 h GLN 287 Ca -0.03 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 3dr1 h GLN 287 Cb 1.37 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.14 3dr1 h GLN 287 CO 0.12 0.15 -0.24 0.82 -0.67 0.00 0.00 178.83 179.01 3dr1 h ILE 288 N -0.19 0.50 -0.71 2.54 2.04 -0.56 0.20 117.51 121.34 3dr1 h ILE 288 Ca -0.00 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.00 3dr1 h ILE 288 Cb 0.18 0.50 -0.10 0.00 -0.74 0.00 0.00 36.82 36.67 3dr1 h ILE 288 CO 0.00 0.00 0.21 0.00 0.00 0.00 0.00 178.15 178.36 3dr1 h ALA 289 N 0.02 0.93 -0.12 1.87 0.00 -0.34 0.46 119.26 122.07 3dr1 h ALA 289 Ca -0.04 0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3dr1 h ALA 289 Cb 0.49 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 3dr1 h ALA 289 CO 0.03 -0.28 -0.03 -0.07 0.00 0.00 0.00 179.25 178.90 3dr1 h LEU 290 N 0.33 0.23 0.27 0.00 3.38 -0.38 -2.04 115.31 117.10 3dr1 h LEU 290 Ca 0.39 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3dr1 h LEU 290 Cb 0.62 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3dr1 h LEU 290 CO -0.44 0.54 -0.21 -0.07 0.09 0.00 0.00 178.44 178.34 3dr1 h LEU 291 N -0.09 -0.55 -0.40 1.67 -0.00 0.39 -0.30 115.31 116.04 3dr1 h LEU 291 Ca 0.03 0.04 0.08 0.00 -0.00 0.00 0.00 57.88 58.04 3dr1 h LEU 291 Cb 0.44 0.18 -0.08 0.00 -0.00 0.00 0.00 40.66 41.19 3dr1 h LEU 291 CO 0.01 -0.32 -0.15 0.11 -0.00 0.00 0.00 178.44 178.09 3dr1 h LYS 292 N -0.49 -0.06 -0.12 1.13 1.57 -0.13 0.59 116.57 119.06 3dr1 h LYS 292 Ca -0.02 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.59 3dr1 h LYS 292 Cb 0.43 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.75 3dr1 h LYS 292 CO -0.01 -0.04 -0.67 0.66 -0.57 0.00 0.00 179.45 178.82 3dr1 h SER 293 N -0.06 0.55 0.52 0.86 4.64 -1.27 -3.34 113.55 115.45 3dr1 h SER 293 Ca 0.19 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 3dr1 h SER 293 Cb 0.36 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 3dr1 h SER 293 CO -0.44 1.06 -1.33 -1.54 -0.87 0.00 0.00 176.83 173.71 3dr1 n SER 294 N -3.89 0.51 -0.11 4.97 3.41 -0.13 -4.62 113.62 113.77 3dr1 n SER 294 Ca -0.04 0.07 -0.03 0.00 -0.26 0.00 0.00 58.87 58.61 3dr1 n SER 294 Cb 0.67 1.05 -0.03 0.00 -0.26 0.00 0.00 64.21 65.64 3dr1 n SER 294 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dr1 n ALA 295 N -2.11 -0.16 -0.15 7.33 0.00 0.20 0.77 120.51 126.39 3dr1 n ALA 295 Ca -0.01 0.21 0.18 0.00 0.00 0.00 0.00 53.44 53.82 3dr1 n ALA 295 Cb 0.53 0.14 0.55 0.00 0.00 0.00 0.00 19.45 20.67 3dr1 n ALA 295 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 3dr1 h ILE 296 N 0.00 0.75 -0.16 0.00 -0.00 -1.84 -1.28 117.51 114.98 3dr1 h ILE 296 Ca 0.04 -0.11 -0.17 0.00 -0.00 0.00 0.00 64.86 64.63 3dr1 h ILE 296 Cb 0.10 0.41 0.01 0.00 -0.00 0.00 0.00 36.82 37.34 3dr1 h ILE 296 CO -0.24 0.06 -0.55 -0.33 -0.00 0.00 0.00 178.15 177.09 3dr1 h GLU 297 N 0.31 0.65 -0.77 2.19 5.08 0.06 -2.23 114.58 119.87 3dr1 h GLU 297 Ca 0.37 -0.49 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 3dr1 h GLU 297 Cb 0.98 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.29 3dr1 h GLU 297 CO -0.10 1.11 0.41 0.82 -1.00 0.00 0.00 179.01 180.26 3dr1 h ILE 298 N 0.33 1.23 -0.27 3.13 1.08 -0.15 -0.72 117.51 122.14 3dr1 h ILE 298 Ca -0.02 -0.59 -0.10 0.00 -0.39 0.00 0.00 64.86 63.76 3dr1 h ILE 298 Cb 1.18 0.20 -0.01 0.00 -3.07 0.00 0.00 36.82 35.11 3dr1 h ILE 298 CO 0.12 0.26 -0.24 0.40 -0.69 0.00 0.00 178.15 178.00 3dr1 h ILE 299 N 1.08 1.26 -0.20 -0.67 2.04 -1.22 -0.98 117.51 118.83 3dr1 h ILE 299 Ca 0.27 -1.26 -0.19 0.00 1.00 0.00 0.00 64.86 64.68 3dr1 h ILE 299 Cb 0.04 1.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 3dr1 h ILE 299 CO -0.04 0.40 -0.65 0.24 0.00 0.00 0.00 178.15 178.11 3dr1 h MET 300 N 0.46 0.72 0.12 2.37 2.86 -0.76 -1.67 114.93 119.02 3dr1 h MET 300 Ca 0.07 -0.51 -0.01 0.00 -2.06 0.00 0.00 59.70 57.19 3dr1 h MET 300 Cb 0.67 0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.41 3dr1 h MET 300 CO 0.05 1.13 -0.06 -0.07 1.06 0.00 0.00 176.91 179.02 3dr1 h LEU 301 N 0.52 -0.13 -1.58 1.22 3.38 -0.91 -3.06 115.31 114.75 3dr1 h LEU 301 Ca -0.01 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 3dr1 h LEU 301 Cb 1.24 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.02 3dr1 h LEU 301 CO 0.13 0.16 -0.18 0.08 0.09 0.00 0.00 178.44 178.72 3dr1 h ARG 302 N -0.43 0.00 0.00 1.13 0.11 -1.23 -2.46 114.38 111.50 3dr1 h ARG 302 Ca -0.02 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.03 3dr1 h ARG 302 Cb 0.35 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.43 3dr1 h ARG 302 CO 0.03 0.18 -0.18 0.66 0.10 0.00 0.00 179.97 180.76 3dr1 h SER 303 N 0.00 0.00 -0.96 0.08 4.64 -1.19 -2.53 113.55 113.59 3dr1 h SER 303 Ca -0.00 0.00 0.21 0.00 -0.47 0.00 0.00 61.79 61.53 3dr1 h SER 303 Cb 0.51 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.52 3dr1 h SER 303 CO 0.02 0.18 0.62 -1.13 -0.87 0.00 0.00 176.83 175.65 3dr1 h ASN 304 N 0.00 0.51 -0.79 4.97 -0.73 -1.42 0.33 115.58 118.45 3dr1 h ASN 304 Ca -0.00 0.06 0.22 0.00 1.87 0.00 0.00 56.30 58.45 3dr1 h ASN 304 Cb 0.42 -0.03 -0.04 0.00 0.27 0.00 0.00 38.32 38.94 3dr1 h ASN 304 CO 0.02 0.18 0.56 -0.61 -0.37 0.00 0.00 177.43 177.21 3dr1 h GLN 305 N 0.50 0.09 0.00 6.67 5.75 -1.64 -0.93 115.11 125.54 3dr1 h GLN 305 Ca 0.52 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 59.02 3dr1 h GLN 305 Cb 1.17 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.70 3dr1 h GLN 305 CO -0.25 0.06 -1.06 -1.13 -2.65 0.00 0.00 178.83 173.80 3dr1 n SER 306 N -4.35 0.83 -4.77 -0.69 3.41 0.11 -4.97 113.62 103.19 3dr1 n SER 306 Ca 0.16 -0.79 -0.40 0.00 -0.26 0.00 0.00 58.87 57.58 3dr1 n SER 306 Cb 0.80 1.15 -0.01 0.00 -0.26 0.00 0.00 64.21 65.89 3dr1 n SER 306 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3dr1 s PHE 307 N -2.89 2.84 -0.20 7.33 5.36 -0.36 -1.24 117.98 128.83 3dr1 s PHE 307 Ca 0.05 1.39 0.01 0.00 -0.96 0.00 0.00 56.93 57.42 3dr1 s PHE 307 Cb 0.14 -3.71 0.03 0.00 -0.34 0.00 0.00 43.02 39.14 3dr1 s PHE 307 CO 0.79 -2.13 -0.17 0.45 -1.46 0.00 0.00 175.22 172.69 3dr1 s SER 308 N -0.63 3.40 0.45 6.13 0.15 0.28 -4.89 113.70 118.60 3dr1 s SER 308 Ca 0.55 -0.81 0.15 0.00 0.70 0.00 0.00 55.95 56.53 3dr1 s SER 308 Cb -0.39 -1.47 1.03 0.00 -1.71 0.00 0.00 66.02 63.48 3dr1 s SER 308 CO 0.51 -0.05 2.00 -0.07 1.20 0.00 0.00 173.24 176.83 3dr1 h LEU 309 N 7.91 0.00 0.00 3.45 3.38 -1.95 0.31 115.31 128.41 3dr1 h LEU 309 Ca -0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.58 3dr1 h LEU 309 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 3dr1 h LEU 309 CO 0.59 0.18 0.00 -0.62 0.09 0.00 0.00 178.44 178.67 3dr1 n GLU 310 N -4.29 0.00 -0.58 1.13 4.71 -1.26 -3.21 120.64 117.14 3dr1 n GLU 310 Ca -0.02 0.69 0.09 0.00 -0.01 0.00 0.00 57.16 57.91 3dr1 n GLU 310 Cb 0.24 -1.45 0.34 0.00 -1.01 0.00 0.00 31.44 29.56 3dr1 n GLU 310 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 3dr1 n ASP 311 N -2.32 4.53 -3.95 1.62 5.68 -1.20 -4.96 116.55 115.96 3dr1 n ASP 311 Ca 0.00 -2.40 -0.26 0.00 -0.50 0.00 0.00 54.79 51.63 3dr1 n ASP 311 Cb 0.00 -0.56 -0.02 0.00 -1.14 0.00 0.00 41.12 39.40 3dr1 n ASP 311 CO 0.00 0.00 0.00 0.23 -1.33 0.00 0.00 177.20 176.10 3dr1 n MET 312 N 1.12 -3.03 -3.97 0.11 2.81 0.11 -4.96 117.12 109.31 3dr1 n MET 312 Ca 0.25 0.39 -0.09 0.00 -1.81 0.00 0.00 57.70 56.44 3dr1 n MET 312 Cb 0.84 -4.44 -0.04 0.00 -0.71 0.00 0.00 33.22 28.87 3dr1 n MET 312 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3dr1 s SER 313 N -4.31 -0.09 -0.35 7.83 1.04 -1.05 -4.73 113.70 112.05 3dr1 s SER 313 Ca 0.04 -0.89 -0.18 0.00 0.48 0.00 0.00 55.95 55.40 3dr1 s SER 313 Cb -0.02 0.63 -0.00 0.00 0.10 0.00 0.00 66.02 66.73 3dr1 s SER 313 CO 0.89 -1.21 0.53 0.26 0.98 0.00 0.00 173.24 174.69 3dr1 s TRP 314 N -3.91 3.18 -0.44 5.02 0.51 -0.94 0.10 118.94 122.46 3dr1 s TRP 314 Ca 0.20 0.19 -0.07 0.00 -2.12 0.00 0.00 56.10 54.30 3dr1 s TRP 314 Cb -0.02 -2.95 0.11 0.00 -0.81 0.00 0.00 33.47 29.80 3dr1 s TRP 314 CO 0.09 -0.55 0.28 -1.12 -0.51 0.00 0.00 176.95 175.14 3dr1 s SER 315 N 1.76 5.56 -0.18 2.95 0.01 -0.37 -0.04 113.70 123.39 3dr1 s SER 315 Ca 0.19 -1.85 0.17 0.00 1.31 0.00 0.00 55.95 55.77 3dr1 s SER 315 Cb -0.15 -1.95 0.52 0.00 0.21 0.00 0.00 66.02 64.64 3dr1 s SER 315 CO 0.13 -0.61 1.41 0.00 0.41 0.00 0.00 173.24 174.58 3dr1 n GLY 317 N -0.57 -0.90 0.00 0.00 0.00 -1.22 -4.69 105.19 97.81 3dr1 n GLY 317 Ca 0.21 0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.55 3dr1 n GLY 317 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dr1 n GLY 318 N 0.00 2.47 0.00 -0.02 0.00 -1.26 -4.69 105.19 101.68 3dr1 n GLY 318 Ca 0.00 -1.73 0.10 0.00 0.00 0.00 0.00 46.02 44.39 3dr1 n GLY 318 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dr1 n PRO 319 N 1.33 0.23 -0.17 1.61 -0.04 -1.26 -4.67 135.00 132.02 3dr1 n PRO 319 Ca 0.00 0.11 -0.11 0.00 -0.04 0.00 0.00 63.50 63.46 3dr1 n PRO 319 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 3dr1 n PRO 319 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3dr1 h ASP 320 N 0.00 0.99 -0.59 3.54 5.19 -2.00 -3.27 116.42 120.28 3dr1 h ASP 320 Ca 0.00 -0.36 -0.36 0.00 -0.62 0.00 0.00 57.03 55.69 3dr1 h ASP 320 Cb 0.23 -0.27 -0.22 0.00 0.18 0.00 0.00 39.33 39.25 3dr1 h ASP 320 CO 0.00 1.12 0.00 0.49 -3.12 0.00 0.00 179.24 177.73 3dr1 n PHE 321 N -4.18 1.92 -3.77 4.55 3.72 -1.26 -4.85 117.46 113.59 3dr1 n PHE 321 Ca 0.01 -1.97 -0.36 0.00 -0.05 0.00 0.00 57.45 55.08 3dr1 n PHE 321 Cb 0.41 -0.66 -0.13 0.00 -0.94 0.00 0.00 39.48 38.16 3dr1 n PHE 321 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 3dr1 s LYS 322 N -3.41 3.64 -0.31 -1.08 2.20 -1.24 -0.66 119.74 118.88 3dr1 s LYS 322 Ca 0.50 -0.49 -0.07 0.00 -0.36 0.00 0.00 55.97 55.55 3dr1 s LYS 322 Cb 0.43 -3.30 0.02 0.00 -1.51 0.00 0.00 37.83 33.46 3dr1 s LYS 322 CO 0.01 -0.19 0.10 0.71 -0.36 0.00 0.00 175.35 175.63 3dr1 s TYR 323 N 1.60 3.18 0.51 4.03 1.51 0.94 -4.96 117.35 124.16 3dr1 s TYR 323 Ca 0.06 -1.05 0.05 0.00 -1.01 0.00 0.00 57.07 55.13 3dr1 s TYR 323 Cb -0.15 -2.28 0.04 0.00 -0.11 0.00 0.00 41.96 39.45 3dr1 s TYR 323 CO 0.03 -0.61 0.70 0.00 -1.11 0.00 0.00 175.55 174.57 3dr1 h ILE 325 N 0.29 1.17 -0.62 0.00 2.04 -1.97 -2.46 117.51 115.96 3dr1 h ILE 325 Ca -0.39 -0.34 0.11 0.00 1.00 0.00 0.00 64.86 65.23 3dr1 h ILE 325 Cb 1.29 0.08 -0.08 0.00 -0.74 0.00 0.00 36.82 37.36 3dr1 h ILE 325 CO 0.47 0.18 0.17 -1.13 0.00 0.00 0.00 178.15 177.85 3dr1 h ASN 326 N 1.00 0.09 -0.32 1.72 -1.24 -2.00 -2.15 115.58 112.69 3dr1 h ASN 326 Ca 0.29 0.10 0.04 0.00 0.71 0.00 0.00 56.30 57.44 3dr1 h ASN 326 Cb -0.08 0.12 -0.04 0.00 0.73 0.00 0.00 38.32 39.05 3dr1 h ASN 326 CO -0.07 0.05 0.07 0.44 -1.29 0.00 0.00 177.43 176.62 3dr1 h ASP 327 N 0.32 0.03 0.13 1.15 3.32 -1.83 -0.57 116.42 118.97 3dr1 h ASP 327 Ca 0.33 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.42 3dr1 h ASP 327 Cb 0.47 0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.08 3dr1 h ASP 327 CO -0.38 0.05 -0.03 0.58 -1.72 0.00 0.00 179.24 177.74 3dr1 h VAL 328 N 0.18 0.39 -0.05 -1.35 2.07 -1.31 0.24 116.25 116.43 3dr1 h VAL 328 Ca 0.15 -0.15 -0.16 0.00 0.82 0.00 0.00 66.70 67.35 3dr1 h VAL 328 Cb 0.16 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 3dr1 h VAL 328 CO -0.19 0.03 -0.68 0.74 0.02 0.00 0.00 177.57 177.49 3dr1 h THR 329 N 0.00 1.41 0.00 2.57 2.02 -0.59 -2.38 112.91 115.94 3dr1 h THR 329 Ca -0.00 -2.14 0.00 0.00 0.77 0.00 0.00 66.41 65.04 3dr1 h THR 329 Cb 0.10 2.11 0.00 0.00 -1.74 0.00 0.00 68.15 68.63 3dr1 h THR 329 CO 0.00 0.63 0.00 0.29 0.37 0.00 0.00 175.52 176.81 3dr1 n LYS 330 N -3.82 0.87 -0.07 6.66 5.02 0.07 -1.85 118.16 125.03 3dr1 n LYS 330 Ca -0.03 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.30 3dr1 n LYS 330 Cb 0.67 -1.21 0.07 0.00 -0.02 0.00 0.00 35.03 34.55 3dr1 n LYS 330 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dr1 n ALA 331 N -0.71 2.25 -0.28 7.82 0.00 -0.91 -0.83 120.51 127.85 3dr1 n ALA 331 Ca 0.09 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.63 3dr1 n ALA 331 Cb 0.04 -0.27 0.00 0.00 0.00 0.00 0.00 19.45 19.22 3dr1 n ALA 331 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dr1 n GLY 332 N 0.26 0.95 3.48 0.00 0.00 -0.77 -4.66 105.19 104.44 3dr1 n GLY 332 Ca 0.06 -0.26 -0.26 0.00 0.00 0.00 0.00 46.02 45.56 3dr1 n GLY 332 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3dr1 s HIS 333 N -2.00 2.39 0.47 1.61 3.76 -1.12 -4.95 115.29 115.46 3dr1 s HIS 333 Ca 0.00 -0.32 0.06 0.00 -0.15 0.00 0.00 55.06 54.65 3dr1 s HIS 333 Cb 0.00 -1.14 -0.01 0.00 1.11 0.00 0.00 32.58 32.54 3dr1 s HIS 333 CO 0.00 0.56 0.28 0.95 -0.85 0.00 0.00 174.74 175.68 3dr1 s THR 334 N -1.90 2.03 -0.14 1.30 -4.23 -1.26 -4.10 115.64 107.34 3dr1 s THR 334 Ca 0.24 -1.59 0.28 0.00 -1.18 0.00 0.00 61.69 59.45 3dr1 s THR 334 Cb -0.07 -2.62 0.30 0.00 1.34 0.00 0.00 72.50 71.45 3dr1 s THR 334 CO 0.13 0.00 1.85 -0.07 -0.54 0.00 0.00 174.62 175.99 3dr1 h LEU 335 N 1.11 0.00 -2.29 4.79 3.38 -1.97 -1.30 115.31 119.03 3dr1 h LEU 335 Ca -0.40 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.56 3dr1 h LEU 335 Cb 1.28 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.03 3dr1 h LEU 335 CO 0.64 0.00 -0.01 -0.08 0.09 0.00 0.00 178.44 179.07 3dr1 h GLU 336 N 0.00 0.00 0.00 1.13 4.57 -1.99 0.18 114.58 118.47 3dr1 h GLU 336 Ca 0.00 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 57.98 3dr1 h GLU 336 Cb 0.28 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.84 3dr1 h GLU 336 CO 0.00 0.01 -1.55 -0.11 -1.18 0.00 0.00 179.01 176.18 3dr1 n LEU 337 N -3.16 1.39 -0.06 1.64 7.94 -0.59 -4.55 117.00 119.61 3dr1 n LEU 337 Ca -0.02 0.23 0.07 0.00 -1.11 0.00 0.00 56.01 55.18 3dr1 n LEU 337 Cb 0.18 -0.55 0.43 0.00 0.53 0.00 0.00 43.42 44.01 3dr1 n LEU 337 CO 0.24 0.10 1.18 -0.07 -1.11 0.00 0.00 177.39 177.73 3dr1 h LEU 338 N -0.64 0.48 0.84 -1.96 3.38 -1.29 -1.07 115.31 115.04 3dr1 h LEU 338 Ca -0.30 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.62 3dr1 h LEU 338 Cb 1.15 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.79 3dr1 h LEU 338 CO -0.18 0.33 -0.44 -0.08 0.09 0.00 0.00 178.44 178.16 3dr1 h GLU 339 N 0.55 -1.13 0.00 1.13 4.22 -0.87 -1.90 114.58 116.58 3dr1 h GLU 339 Ca 0.22 0.08 -0.03 0.00 0.08 0.00 0.00 59.36 59.70 3dr1 h GLU 339 Cb 0.17 0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 3dr1 h GLU 339 CO -0.06 -0.75 -0.16 -1.35 -2.18 0.00 0.00 179.01 174.51 3dr1 h PRO 340 N -1.17 0.00 0.62 0.92 0.11 -1.72 -2.69 132.00 128.06 3dr1 h PRO 340 Ca -0.11 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.97 3dr1 h PRO 340 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 3dr1 h PRO 340 CO 0.17 0.16 -0.33 1.25 -0.21 0.00 0.00 178.00 179.04 3dr1 h LEU 341 N 0.00 -0.81 -1.06 2.35 6.46 -0.91 0.24 115.31 121.57 3dr1 h LEU 341 Ca -0.00 0.04 0.11 0.00 -0.12 0.00 0.00 57.88 57.91 3dr1 h LEU 341 Cb 0.29 0.22 -0.08 0.00 -0.73 0.00 0.00 40.66 40.36 3dr1 h LEU 341 CO 0.02 -0.54 0.62 0.58 -0.62 0.00 0.00 178.44 178.51 3dr1 h VAL 342 N -0.87 0.94 -0.47 1.05 2.07 -1.34 0.31 116.25 117.94 3dr1 h VAL 342 Ca -0.08 -0.34 0.04 0.00 0.82 0.00 0.00 66.70 67.14 3dr1 h VAL 342 Cb 0.68 -0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.29 3dr1 h VAL 342 CO 0.11 0.18 0.23 0.50 0.02 0.00 0.00 177.57 178.62 3dr1 h LYS 343 N 0.98 0.45 -0.31 1.57 3.64 -1.22 0.23 116.57 121.90 3dr1 h LYS 343 Ca 0.47 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.81 3dr1 h LYS 343 Cb 0.45 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 3dr1 h LYS 343 CO -0.23 0.30 0.12 0.35 -2.27 0.00 0.00 179.45 177.71 3dr1 h PHE 344 N 0.46 0.49 -0.66 1.91 3.57 0.18 -1.40 116.94 121.49 3dr1 h PHE 344 Ca 0.20 -0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.70 3dr1 h PHE 344 Cb 0.11 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.66 3dr1 h PHE 344 CO -0.10 0.48 0.40 1.96 -2.23 0.00 0.00 178.31 178.81 3dr1 h GLN 345 N 0.36 0.75 0.83 1.11 1.08 0.21 0.11 115.11 119.55 3dr1 h GLN 345 Ca 0.10 -0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 57.22 3dr1 h GLN 345 Cb 0.20 -0.17 0.01 0.00 -0.05 0.00 0.00 27.48 27.47 3dr1 h GLN 345 CO -0.01 0.49 -0.40 0.28 -0.95 0.00 0.00 178.83 178.25 3dr1 h VAL 346 N 0.77 0.09 -0.98 -0.54 2.07 -0.38 0.15 116.25 117.43 3dr1 h VAL 346 Ca 0.27 -0.13 0.16 0.00 0.82 0.00 0.00 66.70 67.82 3dr1 h VAL 346 Cb 0.06 0.11 -0.10 0.00 -1.52 0.00 0.00 31.29 29.84 3dr1 h VAL 346 CO -0.12 0.01 0.59 1.23 0.02 0.00 0.00 177.57 179.29 3dr1 h GLY 347 N -1.23 1.67 1.06 2.17 0.00 -1.12 -0.92 103.07 104.70 3dr1 h GLY 347 Ca -0.11 -0.37 -0.11 0.00 0.00 0.00 0.00 47.33 46.74 3dr1 h GLY 347 CO 0.19 0.02 -0.11 -2.00 0.00 0.00 0.00 176.54 174.64 3dr1 h LEU 348 N 0.83 0.95 -0.60 3.11 5.85 -0.85 -3.03 115.31 121.57 3dr1 h LEU 348 Ca 0.53 -0.36 -0.02 0.00 0.84 0.00 0.00 57.88 58.87 3dr1 h LEU 348 Cb 0.70 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 3dr1 h LEU 348 CO -0.34 1.08 0.30 0.50 -0.34 0.00 0.00 178.44 179.65 3dr1 h LYS 349 N 0.80 0.87 -0.06 1.25 1.63 0.17 -2.21 116.57 119.01 3dr1 h LYS 349 Ca 0.13 -0.12 0.02 0.00 -0.85 0.00 0.00 60.65 59.82 3dr1 h LYS 349 Cb 0.66 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 32.13 3dr1 h LYS 349 CO 0.05 0.69 0.14 0.87 -3.45 0.00 0.00 179.45 177.75 3dr1 h LYS 350 N 0.83 0.00 0.00 1.90 1.57 -1.09 -1.09 116.57 118.68 3dr1 h LYS 350 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3dr1 h LYS 350 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 3dr1 h LYS 350 CO -0.03 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.13 3dr1 n LEU 351 N -3.39 0.05 -4.15 2.94 4.77 -0.83 -4.90 117.00 111.48 3dr1 n LEU 351 Ca -0.01 0.51 -0.41 0.00 -0.03 0.00 0.00 56.01 56.06 3dr1 n LEU 351 Cb 0.22 -0.50 -0.02 0.00 -2.33 0.00 0.00 43.42 40.79 3dr1 n LEU 351 CO 0.22 -0.21 -0.27 0.29 -1.33 0.00 0.00 177.39 176.09 3dr1 n LYS 352 N -1.55 -0.53 -2.06 3.23 5.02 -0.42 -4.85 118.16 117.00 3dr1 n LYS 352 Ca 0.04 0.08 -0.38 0.00 -2.02 0.00 0.00 58.31 56.04 3dr1 n LYS 352 Cb 0.22 -2.91 0.01 0.00 -0.02 0.00 0.00 35.03 32.32 3dr1 n LYS 352 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3dr1 s LEU 353 N -7.44 4.04 0.49 -0.35 1.43 -1.26 -4.99 118.68 110.60 3dr1 s LEU 353 Ca 0.32 2.54 -0.20 0.00 -1.03 0.00 0.00 54.13 55.77 3dr1 s LEU 353 Cb -0.18 -4.14 -0.08 0.00 0.03 0.00 0.00 46.19 41.82 3dr1 s LEU 353 CO 0.98 -1.07 1.03 -1.00 0.23 0.00 0.00 176.35 176.53 3dr1 s HIS 354 N -1.39 3.01 0.27 0.29 3.76 -1.26 -4.81 115.29 115.17 3dr1 s HIS 354 Ca 0.63 1.57 0.00 0.00 -0.15 0.00 0.00 55.06 57.12 3dr1 s HIS 354 Cb -0.35 -3.05 0.63 0.00 1.11 0.00 0.00 32.58 30.92 3dr1 s HIS 354 CO 0.43 -0.81 1.69 1.49 -0.85 0.00 0.00 174.74 176.69 3dr1 h GLU 355 N 1.51 0.32 -0.85 1.40 4.81 -1.99 0.16 114.58 119.95 3dr1 h GLU 355 Ca -0.49 -0.02 0.09 0.00 -0.13 0.00 0.00 59.36 58.80 3dr1 h GLU 355 Cb 1.22 -0.07 -0.07 0.00 0.63 0.00 0.00 28.75 30.46 3dr1 h GLU 355 CO 0.59 0.21 0.50 0.93 -0.73 0.00 0.00 179.01 180.51 3dr1 h GLU 356 N 0.33 0.84 -0.01 1.92 3.07 -1.96 -0.12 114.58 118.64 3dr1 h GLU 356 Ca 0.51 -0.05 -0.15 0.00 -0.50 0.00 0.00 59.36 59.17 3dr1 h GLU 356 Cb 0.94 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 28.64 3dr1 h GLU 356 CO -0.54 0.55 -0.69 0.93 -1.40 0.00 0.00 179.01 177.86 3dr1 h GLU 357 N 0.86 0.04 -0.46 2.33 5.08 -1.11 -2.56 114.58 118.77 3dr1 h GLU 357 Ca 0.40 -0.03 -0.14 0.00 -1.00 0.00 0.00 59.36 58.59 3dr1 h GLU 357 Cb 0.32 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 3dr1 h GLU 357 CO -0.23 0.71 -0.25 1.25 -1.00 0.00 0.00 179.01 179.49 3dr1 h HIS 358 N 0.03 1.13 -0.05 4.33 2.76 0.24 -1.76 115.15 121.83 3dr1 h HIS 358 Ca -0.01 -0.29 -0.16 0.00 -2.20 0.00 0.00 60.37 57.71 3dr1 h HIS 358 Cb 1.21 -0.26 -0.01 0.00 1.55 0.00 0.00 27.41 29.91 3dr1 h HIS 358 CO 0.00 1.12 -0.67 -0.24 -1.30 0.00 0.00 177.93 176.84 3dr1 h VAL 359 N 0.82 1.42 -0.12 5.26 3.04 -1.05 -2.95 116.25 122.67 3dr1 h VAL 359 Ca 0.10 -2.15 -0.05 0.00 -1.01 0.00 0.00 66.70 63.60 3dr1 h VAL 359 Cb 0.83 2.12 -0.00 0.00 -2.01 0.00 0.00 31.29 32.23 3dr1 h VAL 359 CO 0.07 0.63 -0.10 -0.07 -1.01 0.00 0.00 177.57 177.09 3dr1 h LEU 360 N 0.16 0.30 -1.00 3.16 3.38 -1.34 -1.94 115.31 118.02 3dr1 h LEU 360 Ca -0.02 -0.46 0.14 0.00 0.09 0.00 0.00 57.88 57.63 3dr1 h LEU 360 Cb 1.21 -0.08 -0.09 0.00 0.09 0.00 0.00 40.66 41.78 3dr1 h LEU 360 CO 0.10 0.70 0.62 0.25 0.09 0.00 0.00 178.44 180.20 3dr1 h LEU 361 N -0.10 0.88 -0.16 1.67 5.85 -1.33 0.26 115.31 122.39 3dr1 h LEU 361 Ca 0.02 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 3dr1 h LEU 361 Cb 0.60 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.52 3dr1 h LEU 361 CO 0.03 0.43 -0.03 0.24 -0.34 0.00 0.00 178.44 178.76 3dr1 h MET 362 N 0.93 0.30 -0.21 1.25 2.86 -1.36 -0.87 114.93 117.82 3dr1 h MET 362 Ca 0.52 -0.11 -0.04 0.00 -2.06 0.00 0.00 59.70 58.01 3dr1 h MET 362 Cb 0.60 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 3dr1 h MET 362 CO -0.30 0.57 -0.06 0.00 1.06 0.00 0.00 176.91 178.18 3dr1 h ALA 363 N 0.72 1.52 -0.17 6.32 0.00 -0.50 -2.10 119.26 125.05 3dr1 h ALA 363 Ca 0.04 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.62 3dr1 h ALA 363 Cb 0.45 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3dr1 h ALA 363 CO 0.01 0.34 -0.49 0.82 0.00 0.00 0.00 179.25 179.94 3dr1 h ILE 364 N 0.31 1.33 -0.79 0.00 2.04 -0.40 -2.90 117.51 117.10 3dr1 h ILE 364 Ca 0.07 -1.74 -0.02 0.00 1.00 0.00 0.00 64.86 64.17 3dr1 h ILE 364 Cb 0.30 1.95 -0.04 0.00 -0.74 0.00 0.00 36.82 38.30 3dr1 h ILE 364 CO 0.01 0.54 0.42 0.00 0.00 0.00 0.00 178.15 179.12 3dr1 h LEU 366 N 1.11 0.54 -3.01 0.00 5.85 -1.39 -3.09 115.31 115.32 3dr1 h LEU 366 Ca 0.28 -0.23 -0.24 0.00 0.84 0.00 0.00 57.88 58.54 3dr1 h LEU 366 Cb 0.04 -0.15 -0.14 0.00 0.37 0.00 0.00 40.66 40.78 3dr1 h LEU 366 CO -0.04 0.86 0.30 0.18 -0.34 0.00 0.00 178.44 179.40 3dr1 n LEU 367 N -4.05 4.87 -4.64 2.25 4.77 -1.06 -4.83 117.00 114.31 3dr1 n LEU 367 Ca -0.01 -2.55 -0.43 0.00 -0.03 0.00 0.00 56.01 52.99 3dr1 n LEU 367 Cb 0.49 -0.68 -0.02 0.00 -2.33 0.00 0.00 43.42 40.87 3dr1 n LEU 367 CO 0.44 0.74 1.23 -0.44 -1.33 0.00 0.00 177.39 178.03 3dr1 s SER 368 N -0.36 6.64 0.56 -1.43 0.01 -1.17 -4.42 113.70 113.54 3dr1 s SER 368 Ca 0.33 1.58 0.35 0.00 1.31 0.00 0.00 55.95 59.52 3dr1 s SER 368 Cb 0.27 -2.54 1.53 0.00 0.21 0.00 0.00 66.02 65.50 3dr1 s SER 368 CO 0.07 -1.04 2.05 1.55 0.41 0.00 0.00 173.24 176.28 3dr1 h PRO 369 N 9.52 0.00 -2.37 12.44 0.13 -1.90 -3.33 132.00 146.49 3dr1 h PRO 369 Ca -0.30 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.56 3dr1 h PRO 369 Cb 1.13 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.22 3dr1 h PRO 369 CO 1.00 0.03 0.64 -0.40 -0.23 0.00 0.00 178.00 179.04 3dr1 n ASP 370 N -3.15 5.32 -4.30 1.44 5.68 -1.26 -4.86 116.55 115.41 3dr1 n ASP 370 Ca -0.00 -2.39 -0.32 0.00 -0.50 0.00 0.00 54.79 51.58 3dr1 n ASP 370 Cb 0.27 -1.28 -0.16 0.00 -1.14 0.00 0.00 41.12 38.81 3dr1 n ASP 370 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 3dr1 s ARG 371 N 1.57 2.73 0.12 0.11 1.81 -1.25 -5.09 118.95 118.95 3dr1 s ARG 371 Ca 0.59 -0.84 -0.31 0.00 -1.72 0.00 0.00 55.73 53.45 3dr1 s ARG 371 Cb 0.25 -2.28 -0.10 0.00 -0.45 0.00 0.00 34.95 32.37 3dr1 s ARG 371 CO -0.01 0.36 1.69 -1.25 -0.68 0.00 0.00 175.30 175.41 3dr1 s PRO 372 N -0.10 4.17 0.00 3.54 0.04 -1.26 -1.94 135.00 139.46 3dr1 s PRO 372 Ca -0.05 2.45 0.00 0.00 0.04 0.00 0.00 61.00 63.44 3dr1 s PRO 372 Cb -0.14 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 30.96 3dr1 s PRO 372 CO 0.04 -0.74 0.00 0.41 0.04 0.00 0.00 177.00 176.75 3dr1 n GLY 373 N 4.01 1.76 3.75 0.56 0.00 -1.26 -4.88 105.19 109.13 3dr1 n GLY 373 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3dr1 n GLY 373 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3dr1 s VAL 374 N -2.29 3.13 0.00 1.61 -7.23 -0.82 -4.88 120.40 109.93 3dr1 s VAL 374 Ca 0.00 1.00 0.00 0.00 -1.81 0.00 0.00 61.98 61.17 3dr1 s VAL 374 Cb 0.00 -3.64 0.00 0.00 0.56 0.00 0.00 36.38 33.30 3dr1 s VAL 374 CO 0.00 0.18 0.00 0.00 -0.31 0.00 0.00 175.10 174.97 3dr1 n GLN 375 N 2.02 0.00 -0.41 4.82 1.13 -1.26 -4.67 117.38 119.01 3dr1 n GLN 375 Ca 0.04 0.00 -0.37 0.00 -1.94 0.00 0.00 57.00 54.73 3dr1 n GLN 375 Cb 0.43 0.00 -0.10 0.00 0.11 0.00 0.00 30.24 30.68 3dr1 n GLN 375 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 3dr1 n ASP 376 N 0.00 0.82 0.00 1.08 -0.08 -1.26 -4.61 116.55 112.51 3dr1 n ASP 376 Ca 0.00 -2.41 0.05 0.00 -1.51 0.00 0.00 54.79 50.92 3dr1 n ASP 376 Cb 0.00 -0.50 0.31 0.00 2.34 0.00 0.00 41.12 43.27 3dr1 n ASP 376 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3dr1 n HIS 377 N 8.28 0.00 -0.09 -0.67 1.44 -1.26 -2.60 115.22 120.33 3dr1 n HIS 377 Ca 0.39 0.00 -0.18 0.00 -2.01 0.00 0.00 57.72 55.92 3dr1 n HIS 377 Cb 0.34 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.32 3dr1 n HIS 377 CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81 3dr1 n VAL 378 N -0.81 1.57 0.16 0.61 0.31 -1.26 -3.24 118.33 115.66 3dr1 n VAL 378 Ca 0.08 -0.63 0.02 0.00 -0.01 0.00 0.00 64.34 63.79 3dr1 n VAL 378 Cb 0.04 -1.39 0.25 0.00 -0.91 0.00 0.00 33.84 31.82 3dr1 n VAL 378 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 3dr1 h ARG 379 N 0.02 0.00 -0.16 5.55 2.43 -1.90 -2.17 114.38 118.15 3dr1 h ARG 379 Ca -0.52 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 58.52 3dr1 h ARG 379 Cb 1.98 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.53 3dr1 h ARG 379 CO -0.02 0.51 -0.39 0.82 -1.51 0.00 0.00 179.97 179.37 3dr1 h ILE 380 N 0.00 1.35 -0.94 1.20 2.04 -1.72 -2.47 117.51 116.97 3dr1 h ILE 380 Ca -0.01 -1.66 0.05 0.00 1.00 0.00 0.00 64.86 64.25 3dr1 h ILE 380 Cb 0.99 1.99 -0.06 0.00 -0.74 0.00 0.00 36.82 39.00 3dr1 h ILE 380 CO 0.07 0.50 0.61 -0.08 0.00 0.00 0.00 178.15 179.25 3dr1 h GLU 381 N 0.19 1.09 0.57 2.37 4.57 -1.50 -1.55 114.58 120.33 3dr1 h GLU 381 Ca -0.00 -0.07 -0.03 0.00 -1.18 0.00 0.00 59.36 58.08 3dr1 h GLU 381 Cb 1.00 -0.25 0.01 0.00 -0.16 0.00 0.00 28.75 29.35 3dr1 h GLU 381 CO 0.09 0.72 -0.27 0.00 -1.18 0.00 0.00 179.01 178.36 3dr1 h ALA 382 N 1.47 -0.77 -0.74 2.92 0.00 -1.25 -2.30 119.26 118.59 3dr1 h ALA 382 Ca 0.39 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.16 3dr1 h ALA 382 Cb 0.11 0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 3dr1 h ALA 382 CO -0.14 -0.87 0.44 -0.07 0.00 0.00 0.00 179.25 178.61 3dr1 h LEU 383 N -0.89 0.68 -1.35 0.00 3.38 -1.26 -0.33 115.31 115.55 3dr1 h LEU 383 Ca -0.08 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3dr1 h LEU 383 Cb 0.63 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 3dr1 h LEU 383 CO 0.13 0.45 0.17 -0.61 0.09 0.00 0.00 178.44 178.67 3dr1 h GLN 384 N 0.82 0.62 -0.40 1.13 4.15 -1.27 -1.98 115.11 118.18 3dr1 h GLN 384 Ca 0.32 -0.08 -0.15 0.00 0.77 0.00 0.00 58.65 59.51 3dr1 h GLN 384 Cb 0.15 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 3dr1 h GLN 384 CO -0.16 0.51 -0.33 -0.44 -1.93 0.00 0.00 178.83 176.48 3dr1 h ASP 385 N 0.61 0.96 -0.63 -0.69 3.32 -0.55 0.73 116.42 120.18 3dr1 h ASP 385 Ca 0.15 -0.41 0.03 0.00 0.02 0.00 0.00 57.03 56.82 3dr1 h ASP 385 Cb 0.13 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.37 3dr1 h ASP 385 CO -0.01 1.20 0.38 -0.09 -1.72 0.00 0.00 179.24 179.00 3dr1 h ARG 386 N 0.76 0.73 -0.36 3.56 2.43 -0.51 -1.30 114.38 119.68 3dr1 h ARG 386 Ca 0.07 -0.04 -0.16 0.00 -0.81 0.00 0.00 59.98 59.04 3dr1 h ARG 386 Cb 0.91 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.29 3dr1 h ARG 386 CO 0.08 0.48 -0.40 -0.07 -1.51 0.00 0.00 179.97 178.56 3dr1 h LEU 387 N 0.75 0.95 -1.95 3.80 4.07 -1.22 -2.62 115.31 119.08 3dr1 h LEU 387 Ca 0.26 -0.44 -0.00 0.00 0.08 0.00 0.00 57.88 57.78 3dr1 h LEU 387 Cb 0.04 -0.27 -0.00 0.00 1.08 0.00 0.00 40.66 41.51 3dr1 h LEU 387 CO -0.11 1.22 0.00 0.00 -1.08 0.00 0.00 178.44 178.47 3dr1 h ASP 389 N 0.03 -0.73 -0.93 0.00 5.19 -0.89 -1.38 116.42 117.72 3dr1 h ASP 389 Ca 0.01 -0.01 0.19 0.00 -0.62 0.00 0.00 57.03 56.59 3dr1 h ASP 389 Cb 0.02 0.19 -0.08 0.00 0.18 0.00 0.00 39.33 39.64 3dr1 h ASP 389 CO -0.00 -0.36 0.60 0.58 -3.12 0.00 0.00 179.24 176.94 3dr1 h VAL 390 N -1.15 0.72 -0.17 -1.35 2.07 -1.20 0.44 116.25 115.61 3dr1 h VAL 390 Ca -0.09 -0.19 -0.07 0.00 0.82 0.00 0.00 66.70 67.17 3dr1 h VAL 390 Cb 0.69 0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 30.57 3dr1 h VAL 390 CO 0.14 0.10 -0.15 0.25 0.02 0.00 0.00 177.57 177.93 3dr1 h LEU 391 N 0.56 0.43 0.07 2.57 5.85 -1.21 0.03 115.31 123.62 3dr1 h LEU 391 Ca 0.49 -0.47 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 3dr1 h LEU 391 Cb 1.00 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.91 3dr1 h LEU 391 CO -0.23 0.81 -0.03 -0.61 -0.34 0.00 0.00 178.44 178.04 3dr1 h GLN 392 N 0.06 -0.09 0.12 1.25 4.15 0.02 -1.87 115.11 118.75 3dr1 h GLN 392 Ca 0.03 0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.47 3dr1 h GLN 392 Cb 0.68 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.36 3dr1 h GLN 392 CO 0.04 0.10 -0.25 0.00 -1.93 0.00 0.00 178.83 176.79 3dr1 h ALA 393 N 0.64 -0.42 -0.61 3.38 0.00 -0.23 -2.20 119.26 119.81 3dr1 h ALA 393 Ca -0.01 -0.04 0.12 0.00 0.00 0.00 0.00 54.91 54.98 3dr1 h ALA 393 Cb 0.24 0.40 -0.10 0.00 0.00 0.00 0.00 17.79 18.33 3dr1 h ALA 393 CO 0.02 -0.78 0.06 -0.92 0.00 0.00 0.00 179.25 177.63 3dr1 h TYR 394 N -0.46 0.08 -0.48 0.00 5.03 -0.90 -0.19 116.97 120.06 3dr1 h TYR 394 Ca 0.03 0.04 -0.05 0.00 2.58 0.00 0.00 58.73 61.33 3dr1 h TYR 394 Cb 0.48 0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.80 3dr1 h TYR 394 CO -0.23 -0.11 0.10 0.82 -1.32 0.00 0.00 178.16 177.42 3dr1 h ILE 395 N 0.18 1.21 -0.44 1.81 2.04 -1.08 0.62 117.51 121.85 3dr1 h ILE 395 Ca 0.32 -0.78 -0.11 0.00 1.00 0.00 0.00 64.86 65.30 3dr1 h ILE 395 Cb 0.51 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 3dr1 h ILE 395 CO -0.47 0.28 -0.15 -0.09 0.00 0.00 0.00 178.15 177.72 3dr1 h ARG 396 N 0.70 0.88 0.00 2.37 2.43 -0.56 -2.45 114.38 117.75 3dr1 h ARG 396 Ca 0.16 -0.36 -0.10 0.00 -0.81 0.00 0.00 59.98 58.87 3dr1 h ARG 396 Cb 0.29 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 3dr1 h ARG 396 CO 0.00 1.00 -0.66 0.82 -1.51 0.00 0.00 179.97 179.62 3dr1 h ILE 397 N 0.71 0.80 -0.00 1.20 2.04 -0.78 -3.41 117.51 118.06 3dr1 h ILE 397 Ca 0.11 -1.81 0.00 0.00 1.00 0.00 0.00 64.86 64.15 3dr1 h ILE 397 Cb 0.71 1.72 0.00 0.00 -0.74 0.00 0.00 36.82 38.50 3dr1 h ILE 397 CO 0.05 0.27 -0.49 0.00 0.00 0.00 0.00 178.15 177.98 3dr1 n GLN 398 N -4.56 0.46 -3.59 2.37 1.13 0.21 -4.79 117.38 108.62 3dr1 n GLN 398 Ca -0.18 -0.31 -0.40 0.00 -1.94 0.00 0.00 57.00 54.17 3dr1 n GLN 398 Cb 0.46 -1.49 -0.07 0.00 0.11 0.00 0.00 30.24 29.24 3dr1 n GLN 398 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 3dr1 s HIS 399 N -2.75 3.51 -0.01 1.08 2.46 -0.92 -4.99 115.29 113.66 3dr1 s HIS 399 Ca 0.16 -2.37 -0.30 0.00 0.47 0.00 0.00 55.06 53.03 3dr1 s HIS 399 Cb 0.18 -3.42 -0.07 0.00 -0.13 0.00 0.00 32.58 29.14 3dr1 s HIS 399 CO 0.65 -0.91 1.76 -2.14 -2.47 0.00 0.00 174.74 171.62 3dr1 s PRO 400 N 0.29 4.17 0.00 2.88 0.02 -1.26 -1.82 135.00 139.28 3dr1 s PRO 400 Ca 0.15 2.35 0.00 0.00 0.02 0.00 0.00 61.00 63.51 3dr1 s PRO 400 Cb -0.19 -4.01 0.00 0.00 0.02 0.00 0.00 34.50 30.33 3dr1 s PRO 400 CO -0.04 -0.87 0.00 0.41 -0.33 0.00 0.00 177.00 176.16 3dr1 n GLY 401 N 4.26 0.73 3.27 0.52 0.00 -1.26 -5.02 105.19 107.69 3dr1 n GLY 401 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 3dr1 n GLY 401 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dr1 s GLY 402 N -1.57 2.68 -0.09 -0.02 0.00 -0.75 -4.76 107.32 102.80 3dr1 s GLY 402 Ca 0.00 -3.36 0.08 0.00 0.00 0.00 0.00 44.72 41.44 3dr1 s GLY 402 CO 0.00 1.22 0.03 0.54 0.00 0.00 0.00 173.10 174.89 3dr1 n ARG 403 N 3.72 2.46 -0.05 2.90 3.00 -1.26 -4.56 116.66 122.87 3dr1 n ARG 403 Ca 0.13 -0.00 0.08 0.00 -0.01 0.00 0.00 57.85 58.05 3dr1 n ARG 403 Cb 0.44 -1.23 0.09 0.00 0.00 0.00 0.00 32.46 31.76 3dr1 n ARG 403 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 3dr1 n LEU 404 N -2.35 2.49 0.20 0.55 4.32 -1.26 -4.61 117.00 116.33 3dr1 n LEU 404 Ca -0.15 -1.21 -0.15 0.00 -0.02 0.00 0.00 56.01 54.48 3dr1 n LEU 404 Cb 0.80 -0.07 -0.07 0.00 -1.62 0.00 0.00 43.42 42.46 3dr1 n LEU 404 CO 0.19 0.50 0.67 0.25 -1.22 0.00 0.00 177.39 177.78 3dr1 h LEU 405 N 2.96 -0.78 -0.73 2.23 5.85 -1.91 -1.41 115.31 121.52 3dr1 h LEU 405 Ca 0.00 0.07 0.16 0.00 0.84 0.00 0.00 57.88 58.94 3dr1 h LEU 405 Cb 0.68 0.26 -0.13 0.00 0.37 0.00 0.00 40.66 41.84 3dr1 h LEU 405 CO 0.00 -0.42 -0.09 0.22 -0.34 0.00 0.00 178.44 177.81 3dr1 h TYR 406 N -0.62 -0.23 -0.28 1.25 3.20 -1.89 0.35 116.97 118.75 3dr1 h TYR 406 Ca -0.02 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.92 3dr1 h TYR 406 Cb 0.57 0.21 -0.01 0.00 1.54 0.00 0.00 36.73 39.04 3dr1 h TYR 406 CO -0.17 -0.28 0.18 0.00 -1.64 0.00 0.00 178.16 176.25 3dr1 h ALA 407 N 1.71 0.35 -0.51 1.82 0.00 -1.80 -0.83 119.26 120.00 3dr1 h ALA 407 Ca 0.37 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.28 3dr1 h ALA 407 Cb 0.62 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 3dr1 h ALA 407 CO -0.70 -0.19 0.34 0.87 0.00 0.00 0.00 179.25 179.57 3dr1 h LYS 408 N 0.37 0.66 -0.08 0.00 1.57 0.37 -1.66 116.57 117.80 3dr1 h LYS 408 Ca 0.10 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.78 3dr1 h LYS 408 Cb -0.03 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.13 3dr1 h LYS 408 CO -0.03 0.43 -0.19 0.52 -0.57 0.00 0.00 179.45 179.61 3dr1 h MET 409 N 0.68 0.26 -0.09 3.15 2.86 0.25 -2.63 114.93 119.42 3dr1 h MET 409 Ca 0.19 -0.18 -0.03 0.00 -2.06 0.00 0.00 59.70 57.62 3dr1 h MET 409 Cb -0.05 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 3dr1 h MET 409 CO -0.04 0.79 -0.08 0.82 1.06 0.00 0.00 176.91 179.46 3dr1 h ILE 410 N -0.22 1.11 -0.45 -1.22 1.08 -0.99 -1.14 117.51 115.68 3dr1 h ILE 410 Ca -0.00 -0.49 -0.07 0.00 -0.39 0.00 0.00 64.86 63.91 3dr1 h ILE 410 Cb 0.80 1.14 -0.02 0.00 -3.07 0.00 0.00 36.82 35.67 3dr1 h ILE 410 CO 0.04 0.15 -0.02 -0.61 -0.69 0.00 0.00 178.15 177.03 3dr1 h GLN 411 N 0.12 0.74 -0.77 2.37 5.75 -1.23 -2.26 115.11 119.83 3dr1 h GLN 411 Ca 0.03 -0.20 0.01 0.00 -0.15 0.00 0.00 58.65 58.34 3dr1 h GLN 411 Cb 0.23 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 28.65 3dr1 h GLN 411 CO 0.01 0.76 0.51 0.87 -2.65 0.00 0.00 178.83 178.34 3dr1 h LYS 412 N 0.69 1.01 -0.93 1.69 1.79 -0.83 -1.09 116.57 118.92 3dr1 h LYS 412 Ca 0.14 -0.06 0.03 0.00 -2.18 0.00 0.00 60.65 58.57 3dr1 h LYS 412 Cb 0.45 -0.23 -0.05 0.00 -1.58 0.00 0.00 32.23 30.82 3dr1 h LYS 412 CO 0.02 0.67 0.60 -0.07 -1.08 0.00 0.00 179.45 179.59 3dr1 h LEU 413 N 1.04 1.01 -0.76 2.94 3.38 -1.21 -0.60 115.31 121.10 3dr1 h LEU 413 Ca 0.28 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.16 3dr1 h LEU 413 Cb -0.12 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.38 3dr1 h LEU 413 CO -0.06 0.70 0.06 0.00 0.09 0.00 0.00 178.44 179.23 3dr1 h ALA 414 N 1.37 0.97 0.00 1.53 0.00 -1.12 -1.91 119.26 120.11 3dr1 h ALA 414 Ca 0.36 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3dr1 h ALA 414 Cb -0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3dr1 h ALA 414 CO -0.11 0.64 -0.24 -0.44 0.00 0.00 0.00 179.25 179.10 3dr1 h ASP 415 N 0.94 0.00 -0.61 0.00 3.32 -0.55 -2.72 116.42 116.80 3dr1 h ASP 415 Ca 0.18 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.13 3dr1 h ASP 415 Cb 0.46 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 3dr1 h ASP 415 CO 0.02 0.24 -0.01 -0.07 -1.72 0.00 0.00 179.24 177.69 3dr1 h LEU 416 N 0.00 1.06 -0.92 1.55 3.38 -0.32 -2.66 115.31 117.40 3dr1 h LEU 416 Ca -0.00 -0.31 0.04 0.00 0.09 0.00 0.00 57.88 57.69 3dr1 h LEU 416 Cb 0.55 -0.29 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 3dr1 h LEU 416 CO 0.03 1.12 0.60 0.03 0.09 0.00 0.00 178.44 180.30 3dr1 h ARG 417 N 0.98 1.12 -0.55 1.13 2.47 -1.27 0.43 114.38 118.69 3dr1 h ARG 417 Ca 0.17 -0.07 -0.08 0.00 -1.26 0.00 0.00 59.98 58.74 3dr1 h ARG 417 Cb 0.58 -0.25 -0.02 0.00 -1.65 0.00 0.00 29.97 28.63 3dr1 h ARG 417 CO 0.03 0.74 0.03 0.77 0.56 0.00 0.00 179.97 182.10 3dr1 h SER 418 N 1.15 0.92 -0.47 7.04 0.02 -1.55 0.70 113.55 121.37 3dr1 h SER 418 Ca 0.37 -0.29 -0.10 0.00 -0.84 0.00 0.00 61.79 60.92 3dr1 h SER 418 Cb 0.02 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.29 3dr1 h SER 418 CO -0.13 0.99 -0.09 -0.07 -1.14 0.00 0.00 176.83 176.39 3dr1 h LEU 419 N 0.83 0.92 0.55 5.07 3.38 -1.00 -0.90 115.31 124.16 3dr1 h LEU 419 Ca 0.16 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 3dr1 h LEU 419 Cb 0.50 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 41.01 3dr1 h LEU 419 CO 0.02 1.03 -0.26 -1.13 0.09 0.00 0.00 178.44 178.19 3dr1 h ASN 420 N 0.84 -0.63 -0.44 -0.43 -0.73 0.15 -0.20 115.58 114.15 3dr1 h ASN 420 Ca 0.14 -0.02 0.09 0.00 1.87 0.00 0.00 56.30 58.37 3dr1 h ASN 420 Cb 0.62 0.16 -0.08 0.00 0.27 0.00 0.00 38.32 39.29 3dr1 h ASN 420 CO 0.04 -0.37 -0.10 -0.08 -0.37 0.00 0.00 177.43 176.55 3dr1 h GLU 421 N -0.86 0.01 -0.01 6.67 4.57 -0.79 0.23 114.58 124.40 3dr1 h GLU 421 Ca -0.08 -0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.12 3dr1 h GLU 421 Cb 0.61 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.18 3dr1 h GLU 421 CO 0.12 0.01 -0.06 1.49 -1.18 0.00 0.00 179.01 179.39 3dr1 h GLU 422 N 0.01 -0.10 -0.72 1.92 4.57 -1.07 -1.92 114.58 117.26 3dr1 h GLU 422 Ca 0.21 0.01 0.09 0.00 -1.18 0.00 0.00 59.36 58.49 3dr1 h GLU 422 Cb 0.32 0.02 -0.07 0.00 -0.16 0.00 0.00 28.75 28.86 3dr1 h GLU 422 CO -0.44 -0.07 0.37 1.25 -1.18 0.00 0.00 179.01 178.94 3dr1 h HIS 423 N -0.11 0.66 -0.59 0.92 2.76 0.00 -0.77 115.15 118.02 3dr1 h HIS 423 Ca 0.03 0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.26 3dr1 h HIS 423 Cb 0.15 -0.19 -0.04 0.00 1.55 0.00 0.00 27.41 28.88 3dr1 h HIS 423 CO -0.14 0.24 0.35 0.77 -1.30 0.00 0.00 177.93 177.85 3dr1 h SER 424 N 0.62 0.57 -0.11 3.26 0.02 -0.04 0.63 113.55 118.49 3dr1 h SER 424 Ca 0.36 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.30 3dr1 h SER 424 Cb 0.37 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.79 3dr1 h SER 424 CO -0.27 0.39 0.01 0.11 -1.14 0.00 0.00 176.83 175.94 3dr1 h LYS 425 N 0.69 0.19 -0.26 3.45 1.57 -0.66 0.54 116.57 122.10 3dr1 h LYS 425 Ca 0.24 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.92 3dr1 h LYS 425 Cb 0.04 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 3dr1 h LYS 425 CO -0.11 0.40 -0.03 1.96 -0.57 0.00 0.00 179.45 181.10 3dr1 h GLN 426 N -0.05 0.40 -0.26 3.15 4.20 -0.87 -2.66 115.11 119.01 3dr1 h GLN 426 Ca 0.03 -0.08 -0.12 0.00 0.06 0.00 0.00 58.65 58.55 3dr1 h GLN 426 Cb 0.31 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.03 3dr1 h GLN 426 CO 0.00 0.45 -0.29 -0.92 -0.67 0.00 0.00 178.83 177.40 3dr1 h TYR 427 N 0.38 0.80 -0.79 2.96 3.20 0.53 -2.91 116.97 121.14 3dr1 h TYR 427 Ca 0.08 -0.25 0.08 0.00 3.14 0.00 0.00 58.73 61.79 3dr1 h TYR 427 Cb 0.31 -0.16 -0.07 0.00 1.54 0.00 0.00 36.73 38.34 3dr1 h TYR 427 CO 0.01 0.98 0.45 -0.09 -1.64 0.00 0.00 178.16 177.87 3dr1 h ARG 428 N 0.38 0.76 -0.31 1.82 2.43 -0.57 0.44 114.38 119.34 3dr1 h ARG 428 Ca 0.04 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 3dr1 h ARG 428 Cb 0.86 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.23 3dr1 h ARG 428 CO 0.07 0.50 0.08 0.77 -1.51 0.00 0.00 179.97 179.88 3dr1 h SER 429 N 0.78 0.46 -0.39 -3.80 0.02 -1.48 -1.77 113.55 107.37 3dr1 h SER 429 Ca 0.37 -0.22 -0.03 0.00 -0.84 0.00 0.00 61.79 61.07 3dr1 h SER 429 Cb 0.30 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 3dr1 h SER 429 CO -0.23 0.56 0.13 0.25 -1.14 0.00 0.00 176.83 176.41 3dr1 h LEU 430 N 0.34 0.57 -1.27 5.07 5.85 -1.22 -3.01 115.31 121.64 3dr1 h LEU 430 Ca 0.10 -0.20 0.11 0.00 0.84 0.00 0.00 57.88 58.73 3dr1 h LEU 430 Cb 0.28 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.10 3dr1 h LEU 430 CO -0.00 0.61 0.56 -1.28 -0.34 0.00 0.00 178.44 177.99 3dr1 h SER 431 N 0.49 0.72 1.23 1.25 0.87 0.10 -2.16 113.55 116.06 3dr1 h SER 431 Ca 0.13 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 3dr1 h SER 431 Cb 0.24 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 3dr1 h SER 431 CO -0.01 0.41 0.00 0.49 -0.53 0.00 0.00 176.83 177.20 3dr1 n PHE 432 N -4.53 0.74 -3.06 2.24 3.72 -0.69 -4.53 117.46 111.36 3dr1 n PHE 432 Ca 0.15 0.23 -0.44 0.00 -0.05 0.00 0.00 57.45 57.34 3dr1 n PHE 432 Cb 0.35 -0.88 -0.05 0.00 -0.94 0.00 0.00 39.48 37.97 3dr1 n PHE 432 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3dr1 s GLN 433 N -3.12 3.09 0.50 -1.08 -0.21 -0.81 -4.93 119.66 113.09 3dr1 s GLN 433 Ca 0.10 -1.08 0.29 0.00 0.02 0.00 0.00 55.36 54.69 3dr1 s GLN 433 Cb 0.13 -4.21 1.39 0.00 1.00 0.00 0.00 33.01 31.31 3dr1 s GLN 433 CO 0.54 -1.52 1.83 -1.00 -2.12 0.00 0.00 175.29 173.02 3dr1 h PRO 434 N 9.22 0.12 0.00 2.91 0.13 -1.83 0.22 132.00 142.78 3dr1 h PRO 434 Ca -0.29 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.83 3dr1 h PRO 434 Cb 1.08 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.19 3dr1 h PRO 434 CO 1.09 0.08 -0.03 1.05 -0.23 0.00 0.00 178.00 179.96 3dr1 h GLU 435 N 0.12 0.00 0.01 0.86 9.09 -1.92 -1.82 114.58 120.91 3dr1 h GLU 435 Ca 0.51 0.00 -0.41 0.00 0.05 0.00 0.00 59.36 59.51 3dr1 h GLU 435 Cb 1.80 0.00 -0.07 0.00 -1.65 0.00 0.00 28.75 28.84 3dr1 h GLU 435 CO -0.09 0.03 -2.44 0.72 0.05 0.00 0.00 179.01 177.28 3dr1 n HIS 436 N -3.15 0.11 0.30 2.06 8.25 0.59 -4.29 115.22 119.09 3dr1 n HIS 436 Ca 0.00 0.03 0.16 0.00 -0.26 0.00 0.00 57.72 57.65 3dr1 n HIS 436 Cb 0.29 -1.01 0.96 0.00 1.12 0.00 0.00 29.99 31.34 3dr1 n HIS 436 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3dr1 h SER 437 N -0.35 0.00 0.61 0.41 4.64 -0.95 0.63 113.55 118.54 3dr1 h SER 437 Ca -0.61 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.71 3dr1 h SER 437 Cb 1.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.89 3dr1 h SER 437 CO -0.19 0.01 0.00 1.15 -0.87 0.00 0.00 176.83 176.92 3dr1 n MET 438 N -3.72 0.03 0.08 4.77 0.00 -0.69 -2.05 117.12 115.55 3dr1 n MET 438 Ca -0.03 0.25 0.11 0.00 0.00 0.00 0.00 57.70 58.03 3dr1 n MET 438 Cb 0.09 -1.56 0.00 0.00 0.00 0.00 0.00 33.22 31.75 3dr1 n MET 438 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 3dr1 n GLN 439 N -1.62 0.55 -1.13 3.17 1.13 0.21 -4.93 117.38 114.76 3dr1 n GLN 439 Ca 0.04 0.08 -0.30 0.00 -1.94 0.00 0.00 57.00 54.88 3dr1 n GLN 439 Cb 0.20 -1.77 0.24 0.00 0.11 0.00 0.00 30.24 29.03 3dr1 n GLN 439 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3dr1 n LEU 440 N -2.52 0.00 -4.57 1.08 4.77 -0.87 -4.67 117.00 110.22 3dr1 n LEU 440 Ca 0.00 -1.19 -0.25 0.00 -0.03 0.00 0.00 56.01 54.54 3dr1 n LEU 440 Cb 0.53 -1.00 -0.09 0.00 -2.33 0.00 0.00 43.42 40.53 3dr1 n LEU 440 CO 0.40 -2.09 -0.40 0.42 -1.33 0.00 0.00 177.39 174.39 3dr1 s THR 441 N -3.07 3.13 0.26 -5.08 -4.23 -1.26 -5.02 115.64 100.36 3dr1 s THR 441 Ca 0.71 -1.84 -0.02 0.00 -1.18 0.00 0.00 61.69 59.36 3dr1 s THR 441 Cb -0.06 -2.59 0.23 0.00 1.34 0.00 0.00 72.50 71.41 3dr1 s THR 441 CO 0.54 -0.22 1.78 -0.65 -0.54 0.00 0.00 174.62 175.53 3dr1 h PRO 442 N 2.56 0.68 -0.64 3.99 0.11 -1.97 -1.31 132.00 135.42 3dr1 h PRO 442 Ca -0.45 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 3dr1 h PRO 442 Cb 1.22 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 3dr1 h PRO 442 CO 0.56 0.45 0.10 1.25 -0.21 0.00 0.00 178.00 180.15 3dr1 h LEU 443 N 0.70 1.01 -0.56 2.35 5.85 -1.97 -0.88 115.31 121.81 3dr1 h LEU 443 Ca 0.44 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 3dr1 h LEU 443 Cb 0.53 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 3dr1 h LEU 443 CO -0.31 1.02 0.23 0.58 -0.34 0.00 0.00 178.44 179.61 3dr1 h VAL 444 N 0.97 1.22 -0.73 1.05 2.07 -1.80 0.92 116.25 119.96 3dr1 h VAL 444 Ca 0.19 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 3dr1 h VAL 444 Cb 0.44 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 3dr1 h VAL 444 CO 0.01 0.27 0.38 -0.07 0.02 0.00 0.00 177.57 178.18 3dr1 h LEU 445 N 0.77 0.91 -0.02 2.57 3.38 -1.02 -0.66 115.31 121.25 3dr1 h LEU 445 Ca 0.19 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 3dr1 h LEU 445 Cb 0.20 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3dr1 h LEU 445 CO -0.02 0.75 -0.05 -0.08 0.09 0.00 0.00 178.44 179.13 3dr1 h GLU 446 N 1.02 0.07 -0.49 1.13 4.81 -0.72 -0.50 114.58 119.90 3dr1 h GLU 446 Ca 0.26 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.36 3dr1 h GLU 446 Cb 0.06 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 3dr1 h GLU 446 CO -0.04 0.67 -0.01 0.28 -0.73 0.00 0.00 179.01 179.18 3dr1 h VAL 447 N -0.52 1.26 -0.02 0.32 2.07 -0.73 -3.20 116.25 115.43 3dr1 h VAL 447 Ca -0.00 -1.09 0.00 0.00 0.82 0.00 0.00 66.70 66.43 3dr1 h VAL 447 Cb 0.67 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 3dr1 h VAL 447 CO 0.01 0.38 -0.20 0.49 0.02 0.00 0.00 177.57 178.27 3dr1 n PHE 448 N -4.32 0.00 -1.35 1.57 0.99 -0.26 -4.71 117.46 109.38 3dr1 n PHE 448 Ca 0.01 0.00 -0.31 0.00 -0.00 0.00 0.00 57.45 57.15 3dr1 n PHE 448 Cb 0.32 -0.02 0.08 0.00 -1.00 0.00 0.00 39.48 38.86 3dr1 n PHE 448 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 3dr1 s GLY 449 N -2.25 1.67 0.00 1.37 0.00 -0.20 -4.93 107.32 102.99 3dr1 s GLY 449 Ca 0.26 0.21 0.28 0.00 0.00 0.00 0.00 44.72 45.48 3dr1 s GLY 449 CO 0.44 0.55 1.98 -1.14 0.00 0.00 0.00 173.10 174.93 3dr1 n SER 450 N -3.41 0.00 -4.62 1.64 3.41 -1.26 -4.89 113.62 104.49 3dr1 n SER 450 Ca 0.09 -0.15 -0.62 0.00 -0.26 0.00 0.00 58.87 57.93 3dr1 n SER 450 Cb 0.53 -0.27 -0.09 0.00 -0.26 0.00 0.00 64.21 64.12 3dr1 n SER 450 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 3dr1 n GLU 451 N -1.27 0.17 0.00 4.33 4.07 -1.26 -5.25 120.64 121.43 3dr1 n GLU 451 Ca 0.14 0.06 0.00 0.00 -0.06 0.00 0.00 57.16 57.30 3dr1 n GLU 451 Cb 0.22 -1.59 0.03 0.00 -0.06 0.00 0.00 31.44 30.04 3dr1 n GLU 451 CO 0.00 0.00 0.00 1.55 -0.06 0.00 0.00 177.13 178.62