#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ias s SER 172 N 0.00 4.73 0.62 4.38 1.04 -1.26 -5.01 113.70 118.21 1ias s SER 172 Ca 0.00 -0.22 -0.18 0.00 0.48 0.00 0.00 55.95 56.03 1ias s SER 172 Cb 0.00 -0.36 -0.04 0.00 0.10 0.00 0.00 66.02 65.71 1ias s SER 172 CO 0.00 -1.57 0.90 -0.62 0.98 0.00 0.00 173.24 172.93 1ias n GLU 173 N -2.64 0.77 0.00 4.02 4.71 -1.26 -2.40 120.64 123.84 1ias n GLU 173 Ca 0.12 0.31 0.00 0.00 -0.01 0.00 0.00 57.16 57.58 1ias n GLU 173 Cb 0.60 -2.11 0.00 0.00 -1.01 0.00 0.00 31.44 28.92 1ias n GLU 173 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1ias n GLY 174 N 1.35 2.15 3.78 0.62 0.00 -1.26 -4.98 105.19 106.85 1ias n GLY 174 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1ias n GLY 174 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ias s THR 175 N -1.35 2.28 0.25 2.61 2.01 -1.01 -5.01 115.64 115.42 1ias s THR 175 Ca 0.00 0.28 0.10 0.00 0.31 0.00 0.00 61.69 62.38 1ias s THR 175 Cb 0.00 -3.18 -0.05 0.00 0.01 0.00 0.00 72.50 69.28 1ias s THR 175 CO 0.00 0.07 -0.18 0.42 -0.69 0.00 0.00 174.62 174.24 1ias s THR 176 N -1.13 2.20 0.17 -0.82 -4.23 -1.26 -5.02 115.64 105.55 1ias s THR 176 Ca 0.51 -2.32 -0.15 0.00 -1.18 0.00 0.00 61.69 58.56 1ias s THR 176 Cb -0.44 -2.19 0.09 0.00 1.34 0.00 0.00 72.50 71.29 1ias s THR 176 CO 0.60 -0.46 1.70 0.25 -0.54 0.00 0.00 174.62 176.17 1ias h LEU 177 N 2.42 -0.15 -0.61 4.79 5.85 -1.93 -1.55 115.31 124.13 1ias h LEU 177 Ca -0.40 0.10 0.12 0.00 0.84 0.00 0.00 57.88 58.54 1ias h LEU 177 Cb 1.24 0.17 -0.12 0.00 0.37 0.00 0.00 40.66 42.32 1ias h LEU 177 CO 0.60 -0.04 -0.15 0.11 -0.34 0.00 0.00 178.44 178.62 1ias h LYS 178 N 0.12 0.00 -0.35 1.25 6.56 -1.99 -0.57 116.57 121.59 1ias h LYS 178 Ca 0.21 -0.00 0.07 0.00 -1.06 0.00 0.00 60.65 59.87 1ias h LYS 178 Cb 0.30 -0.00 -0.06 0.00 -0.57 0.00 0.00 32.23 31.90 1ias h LYS 178 CO -0.34 0.00 -0.04 -0.44 -2.06 0.00 0.00 179.45 176.56 1ias h ASP 179 N 0.00 -0.23 0.57 0.86 3.32 -1.70 0.18 116.42 119.41 1ias h ASP 179 Ca 0.30 0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.42 1ias h ASP 179 Cb 0.45 0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.17 1ias h ASP 179 CO -0.63 -0.08 -0.39 -0.07 -1.72 0.00 0.00 179.24 176.35 1ias h LEU 180 N 0.05 -0.99 -0.17 1.55 3.38 -0.75 -1.18 115.31 117.21 1ias h LEU 180 Ca 0.17 0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.26 1ias h LEU 180 Cb 0.25 0.30 -0.06 0.00 0.09 0.00 0.00 40.66 41.24 1ias h LEU 180 CO -0.33 -0.59 -0.21 0.40 0.09 0.00 0.00 178.44 177.81 1ias h ILE 181 N -0.92 0.47 -0.75 1.22 2.04 -0.93 -1.51 117.51 117.12 1ias h ILE 181 Ca -0.07 0.00 0.15 0.00 1.00 0.00 0.00 64.86 65.95 1ias h ILE 181 Cb 0.76 0.47 -0.10 0.00 -0.74 0.00 0.00 36.82 37.20 1ias h ILE 181 CO 0.05 0.00 0.26 0.22 0.00 0.00 0.00 178.15 178.67 1ias h TYR 182 N -0.25 0.43 -0.36 1.37 3.20 -0.53 0.10 116.97 120.94 1ias h TYR 182 Ca 0.11 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 1ias h TYR 182 Cb 0.42 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.60 1ias h TYR 182 CO -0.33 -0.01 0.13 -0.44 -1.64 0.00 0.00 178.16 175.87 1ias h ASP 183 N 0.37 0.50 -0.36 -2.11 3.32 -0.20 0.25 116.42 118.18 1ias h ASP 183 Ca 0.42 -0.18 -0.11 0.00 0.02 0.00 0.00 57.03 57.19 1ias h ASP 183 Cb 0.69 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 1ias h ASP 183 CO -0.46 0.54 -0.20 0.00 -1.72 0.00 0.00 179.24 177.41 1ias h MET 184 N 0.43 0.78 0.18 3.56 -0.00 -0.90 0.22 114.93 119.19 1ias h MET 184 Ca 0.12 -0.35 0.00 0.00 -0.00 0.00 0.00 59.70 59.47 1ias h MET 184 Cb 0.20 -0.02 -0.02 0.00 -0.00 0.00 0.00 31.60 31.77 1ias h MET 184 CO -0.01 0.97 -0.18 1.15 -0.00 0.00 0.00 176.91 178.84 1ias h THR 185 N 0.57 0.60 0.00 -0.10 2.02 -0.84 -2.02 112.91 113.14 1ias h THR 185 Ca 0.08 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.26 1ias h THR 185 Cb 0.75 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1ias h THR 185 CO 0.06 0.00 0.00 1.07 0.37 0.00 0.00 175.52 177.02 1ias n THR 186 N -5.31 0.19 -1.91 3.16 5.66 0.87 -4.79 114.28 112.16 1ias n THR 186 Ca -0.08 0.05 -0.43 0.00 -3.05 0.00 0.00 64.05 60.54 1ias n THR 186 Cb 0.22 -0.61 -0.03 0.00 -1.55 0.00 0.00 70.33 68.36 1ias n THR 186 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1ias s SER 187 N -2.73 6.02 0.29 1.09 0.15 0.77 -4.85 113.70 114.43 1ias s SER 187 Ca 0.20 1.69 0.02 0.00 0.70 0.00 0.00 55.95 58.57 1ias s SER 187 Cb 0.17 -2.52 0.61 0.00 -1.71 0.00 0.00 66.02 62.56 1ias s SER 187 CO 0.42 -1.54 1.81 1.23 1.20 0.00 0.00 173.24 176.36 1ias h GLY 188 N 13.00 1.68 -6.62 9.45 0.00 -1.86 -3.35 103.07 115.37 1ias h GLY 188 Ca -0.37 -0.40 -0.56 0.00 0.00 0.00 0.00 47.33 46.00 1ias h GLY 188 CO 0.99 0.08 0.98 -1.35 0.00 0.00 0.00 176.54 177.24 1ias s SER 189 N -5.59 6.55 0.00 0.19 1.04 -1.26 -4.90 113.70 109.72 1ias s SER 189 Ca -0.12 0.68 0.00 0.00 0.48 0.00 0.00 55.95 56.99 1ias s SER 189 Cb 0.23 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.81 1ias s SER 189 CO 0.81 -1.28 0.53 0.61 0.98 0.00 0.00 173.24 174.89 1ias n GLY 190 N 4.83 0.97 3.64 7.32 0.00 -1.26 -4.83 105.19 115.87 1ias n GLY 190 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 1ias n GLY 190 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ias s SER 191 N 3.00 4.68 0.10 1.61 0.01 -1.26 -4.76 113.70 117.08 1ias s SER 191 Ca 0.00 -0.40 0.00 0.00 1.31 0.00 0.00 55.95 56.86 1ias s SER 191 Cb 0.00 -0.97 0.00 0.00 0.21 0.00 0.00 66.02 65.26 1ias s SER 191 CO 0.00 0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.37 1ias n GLY 192 N 0.08 0.96 3.77 3.44 0.00 -1.26 -4.76 105.19 107.42 1ias n GLY 192 Ca -0.10 -1.92 -0.33 0.00 0.00 0.00 0.00 46.02 43.66 1ias n GLY 192 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ias s LEU 193 N 0.00 3.49 0.31 0.99 1.43 -1.26 -4.99 118.68 118.66 1ias s LEU 193 Ca 0.00 2.03 -0.29 0.00 -1.03 0.00 0.00 54.13 54.84 1ias s LEU 193 Cb 0.00 -4.56 -0.10 0.00 0.03 0.00 0.00 46.19 41.56 1ias s LEU 193 CO 0.00 -1.48 1.32 -2.84 0.23 0.00 0.00 176.35 173.58 1ias s PRO 194 N -3.88 4.35 0.29 1.29 0.02 -1.26 -4.78 135.00 131.03 1ias s PRO 194 Ca 0.68 2.21 0.04 0.00 0.02 0.00 0.00 61.00 63.95 1ias s PRO 194 Cb -0.21 -3.08 0.76 0.00 0.02 0.00 0.00 34.50 31.98 1ias s PRO 194 CO 0.37 -0.21 1.66 -0.07 -0.33 0.00 0.00 177.00 178.41 1ias h LEU 195 N 3.71 0.12 -1.26 -5.54 4.07 -1.98 0.44 115.31 114.88 1ias h LEU 195 Ca -0.48 0.19 0.02 0.00 0.08 0.00 0.00 57.88 57.69 1ias h LEU 195 Cb 1.22 0.23 -0.04 0.00 1.08 0.00 0.00 40.66 43.15 1ias h LEU 195 CO 0.68 -0.13 0.51 0.25 -1.08 0.00 0.00 178.44 178.67 1ias h LEU 196 N 0.26 0.85 -0.25 1.67 5.85 -1.99 0.53 115.31 122.22 1ias h LEU 196 Ca 0.57 -0.02 -0.13 0.00 0.84 0.00 0.00 57.88 59.15 1ias h LEU 196 Cb 1.17 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.99 1ias h LEU 196 CO -0.63 0.60 -0.35 0.58 -0.34 0.00 0.00 178.44 178.30 1ias h VAL 197 N 1.00 1.31 -0.28 1.05 2.07 -0.54 -1.94 116.25 118.91 1ias h VAL 197 Ca 0.29 -1.54 0.03 0.00 0.82 0.00 0.00 66.70 66.30 1ias h VAL 197 Cb -0.04 1.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 1ias h VAL 197 CO -0.08 0.49 0.09 1.56 0.02 0.00 0.00 177.57 179.66 1ias h GLN 198 N 0.41 0.21 -0.04 1.57 4.20 -0.48 0.41 115.11 121.39 1ias h GLN 198 Ca 0.03 -0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.76 1ias h GLN 198 Cb 0.94 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.63 1ias h GLN 198 CO 0.08 0.14 -0.19 -0.09 -0.67 0.00 0.00 178.83 178.10 1ias h ARG 199 N 0.21 -0.27 -0.57 1.46 9.65 -0.87 0.35 114.38 124.34 1ias h ARG 199 Ca 0.12 0.02 0.04 0.00 -1.10 0.00 0.00 59.98 59.07 1ias h ARG 199 Cb 0.10 0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 28.69 1ias h ARG 199 CO -0.13 -0.18 0.31 1.15 2.80 0.00 0.00 179.97 183.92 1ias h THR 200 N -0.28 0.99 0.86 0.20 2.02 -0.98 0.11 112.91 115.83 1ias h THR 200 Ca 0.07 -0.21 -0.04 0.00 0.77 0.00 0.00 66.41 67.00 1ias h THR 200 Cb 0.38 0.33 0.01 0.00 -1.74 0.00 0.00 68.15 67.13 1ias h THR 200 CO -0.21 0.11 -0.42 0.40 0.37 0.00 0.00 175.52 175.78 1ias h ILE 201 N 0.60 0.15 -0.42 3.11 2.04 -0.51 -2.46 117.51 120.02 1ias h ILE 201 Ca 0.25 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.17 1ias h ILE 201 Cb 0.12 0.15 -0.09 0.00 -0.74 0.00 0.00 36.82 36.26 1ias h ILE 201 CO -0.15 0.00 -0.50 0.00 0.00 0.00 0.00 178.15 177.49 1ias h ALA 202 N -1.02 -0.63 0.00 1.87 0.00 -0.54 -0.44 119.26 118.50 1ias h ALA 202 Ca -0.12 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1ias h ALA 202 Cb 0.89 1.03 0.00 0.00 0.00 0.00 0.00 17.79 19.72 1ias h ALA 202 CO 0.19 -0.97 0.00 0.54 0.00 0.00 0.00 179.25 179.01 1ias n ARG 203 N -5.39 0.74 0.00 0.00 1.74 0.36 -2.58 116.66 111.53 1ias n ARG 203 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 1ias n ARG 203 Cb 0.35 -1.05 0.00 0.00 -1.02 0.00 0.00 32.46 30.74 1ias n ARG 203 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 1ias n THR 204 N -0.42 0.04 -1.49 0.55 5.66 -0.26 -5.03 114.28 113.32 1ias n THR 204 Ca 0.00 -0.26 -0.31 0.00 -3.05 0.00 0.00 64.05 60.42 1ias n THR 204 Cb 0.02 1.46 0.07 0.00 -1.55 0.00 0.00 70.33 70.32 1ias n THR 204 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 1ias s ILE 205 N -0.04 3.58 -0.23 1.09 1.01 -0.66 -4.69 121.20 121.27 1ias s ILE 205 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 60.65 61.21 1ias s ILE 205 Cb 0.00 -3.13 0.06 0.00 0.01 0.00 0.00 42.46 39.40 1ias s ILE 205 CO 0.00 -0.63 -0.03 -0.69 0.00 0.00 0.00 174.94 173.59 1ias s VAL 206 N -2.84 1.37 0.34 2.92 1.01 0.57 -4.96 120.40 118.82 1ias s VAL 206 Ca 0.61 -1.14 -0.28 0.00 0.00 0.00 0.00 61.98 61.17 1ias s VAL 206 Cb -0.16 -1.69 -0.10 0.00 0.00 0.00 0.00 36.38 34.43 1ias s VAL 206 CO 0.52 -0.14 1.29 -0.76 0.00 0.00 0.00 175.10 176.02 1ias s LEU 207 N 1.46 4.39 0.00 3.92 1.43 -1.26 -0.80 118.68 127.82 1ias s LEU 207 Ca -0.05 2.66 0.00 0.00 -1.03 0.00 0.00 54.13 55.71 1ias s LEU 207 Cb -0.19 -3.70 0.00 0.00 0.03 0.00 0.00 46.19 42.33 1ias s LEU 207 CO -0.07 -0.57 0.00 0.00 0.23 0.00 0.00 176.35 175.94 1ias n GLN 208 N 0.68 0.00 -3.89 1.70 1.13 0.36 -4.90 117.38 112.46 1ias n GLN 208 Ca 0.01 0.02 -0.08 0.00 -1.94 0.00 0.00 57.00 55.01 1ias n GLN 208 Cb 0.42 -0.20 -0.03 0.00 0.11 0.00 0.00 30.24 30.55 1ias n GLN 208 CO 0.00 0.00 0.00 -1.83 -1.44 0.00 0.00 177.06 173.79 1ias s GLU 209 N -0.24 1.73 0.59 -1.09 4.04 -1.17 -5.00 118.70 117.56 1ias s GLU 209 Ca 0.00 -1.04 -0.19 0.00 0.04 0.00 0.00 54.97 53.78 1ias s GLU 209 Cb 0.00 0.58 -0.04 0.00 0.02 0.00 0.00 34.13 34.69 1ias s GLU 209 CO 0.00 -0.78 1.17 0.45 -1.84 0.00 0.00 175.26 174.27 1ias s SER 210 N -2.94 5.31 0.00 0.83 0.15 -1.26 -1.45 113.70 114.34 1ias s SER 210 Ca 0.14 2.29 0.00 0.00 0.70 0.00 0.00 55.95 59.07 1ias s SER 210 Cb -0.05 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.67 1ias s SER 210 CO 0.07 -1.51 0.00 -0.38 1.20 0.00 0.00 173.24 172.63 1ias n ILE 211 N -1.61 0.00 0.00 6.45 5.41 0.10 -4.78 119.36 124.93 1ias n ILE 211 Ca 0.13 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.88 1ias n ILE 211 Cb 0.50 -0.40 0.00 0.00 -0.71 0.00 0.00 39.64 39.03 1ias n ILE 211 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ias n GLY 212 N 2.44 0.45 0.00 7.39 0.00 -1.08 -4.97 105.19 109.42 1ias n GLY 212 Ca 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.18 1ias n GLY 212 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ias n LYS 213 N -0.08 1.88 -3.80 1.61 5.02 -1.26 -0.48 118.16 121.05 1ias n LYS 213 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1ias n LYS 213 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1ias n LYS 213 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ias n GLY 214 N 4.00 -2.22 0.26 0.72 0.00 -1.04 -4.88 105.19 102.03 1ias n GLY 214 Ca 0.00 -1.23 -0.03 0.00 0.00 0.00 0.00 46.02 44.76 1ias n GLY 214 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1ias h ARG 215 N 0.00 0.75 0.56 1.61 0.11 -2.04 -3.17 114.38 112.21 1ias h ARG 215 Ca 0.00 -0.05 -0.02 0.00 0.10 0.00 0.00 59.98 60.02 1ias h ARG 215 Cb 0.00 -0.17 -0.02 0.00 1.11 0.00 0.00 29.97 30.89 1ias h ARG 215 CO 0.00 0.50 -0.47 0.27 0.10 0.00 0.00 179.97 180.37 1ias h PHE 216 N 0.78 -1.29 0.00 4.08 -5.15 -1.96 -3.48 116.94 109.92 1ias h PHE 216 Ca 0.27 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.04 1ias h PHE 216 Cb 0.05 0.49 0.00 0.00 0.22 0.00 0.00 35.95 36.71 1ias h PHE 216 CO -0.05 -0.66 0.00 0.41 -2.00 0.00 0.00 178.31 176.01 1ias n GLY 217 N -1.56 -0.35 3.09 6.09 0.00 -1.20 -2.87 105.19 108.38 1ias n GLY 217 Ca -0.12 0.49 -0.13 0.00 0.00 0.00 0.00 46.02 46.26 1ias n GLY 217 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ias s GLU 218 N 0.00 0.60 -0.12 1.61 2.02 -0.83 -2.50 118.70 119.49 1ias s GLU 218 Ca 0.00 -0.89 -0.01 0.00 0.02 0.00 0.00 54.97 54.09 1ias s GLU 218 Cb 0.00 -0.29 -0.02 0.00 0.10 0.00 0.00 34.13 33.92 1ias s GLU 218 CO 0.00 0.04 -0.09 0.08 0.02 0.00 0.00 175.26 175.31 1ias s VAL 219 N -1.86 3.46 0.22 2.63 1.01 0.37 -0.18 120.40 126.05 1ias s VAL 219 Ca -0.05 -0.53 0.10 0.00 0.00 0.00 0.00 61.98 61.50 1ias s VAL 219 Cb -0.07 -2.46 -0.05 0.00 0.00 0.00 0.00 36.38 33.81 1ias s VAL 219 CO -0.01 0.54 -0.19 0.26 0.00 0.00 0.00 175.10 175.70 1ias s TRP 220 N 0.01 2.04 -0.25 5.22 0.52 0.14 0.03 118.94 126.65 1ias s TRP 220 Ca -0.02 -0.43 -0.11 0.00 0.02 0.00 0.00 56.10 55.57 1ias s TRP 220 Cb -0.14 -0.95 -0.05 0.00 -1.15 0.00 0.00 33.47 31.18 1ias s TRP 220 CO 0.03 0.50 0.17 0.50 0.02 0.00 0.00 176.95 178.18 1ias s ARG 221 N -3.20 4.05 0.27 4.98 3.52 -0.53 -0.46 118.95 127.58 1ias s ARG 221 Ca 0.23 -0.27 0.02 0.00 -0.13 0.00 0.00 55.73 55.58 1ias s ARG 221 Cb -0.05 -3.57 -0.05 0.00 -1.56 0.00 0.00 34.95 29.72 1ias s ARG 221 CO 0.10 0.00 0.08 0.20 -0.81 0.00 0.00 175.30 174.87 1ias s GLY 222 N 1.22 1.81 -0.02 8.12 0.00 0.19 -0.49 107.32 118.16 1ias s GLY 222 Ca 0.08 -1.91 0.06 0.00 0.00 0.00 0.00 44.72 42.94 1ias s GLY 222 CO 0.06 -1.66 -0.18 0.54 0.00 0.00 0.00 173.10 171.86 1ias s LYS 223 N -3.98 1.50 -0.28 2.90 1.02 0.02 0.79 119.74 121.69 1ias s LYS 223 Ca 0.37 -0.65 0.01 0.00 0.02 0.00 0.00 55.97 55.71 1ias s LYS 223 Cb 0.08 -1.44 0.06 0.00 -0.52 0.00 0.00 37.83 36.01 1ias s LYS 223 CO 0.14 0.39 -0.05 -0.46 -0.92 0.00 0.00 175.35 174.45 1ias s TRP 224 N -0.41 3.29 -1.36 3.18 -0.00 0.64 -0.31 118.94 123.98 1ias s TRP 224 Ca 0.07 -2.16 -0.01 0.00 -0.00 0.00 0.00 56.10 54.00 1ias s TRP 224 Cb -0.07 -2.08 0.01 0.00 -0.00 0.00 0.00 33.47 31.33 1ias s TRP 224 CO -0.01 -0.85 0.63 0.54 -0.00 0.00 0.00 176.95 177.26 1ias n ARG 225 N 4.51 -4.42 0.00 5.86 1.74 -1.26 -2.33 116.66 120.76 1ias n ARG 225 Ca -0.13 0.55 0.00 0.00 -0.77 0.00 0.00 57.85 57.50 1ias n ARG 225 Cb 0.43 -4.99 0.00 0.00 -1.02 0.00 0.00 32.46 26.87 1ias n ARG 225 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ias n GLY 226 N -1.70 2.07 3.77 -0.13 0.00 -1.26 -4.96 105.19 102.97 1ias n GLY 226 Ca -0.28 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 44.99 1ias n GLY 226 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ias s GLU 227 N 0.00 4.31 0.54 1.61 2.02 -0.98 -4.89 118.70 121.31 1ias s GLU 227 Ca 0.00 2.27 -0.18 0.00 0.02 0.00 0.00 54.97 57.08 1ias s GLU 227 Cb 0.00 -3.06 -0.06 0.00 0.10 0.00 0.00 34.13 31.11 1ias s GLU 227 CO 0.00 -0.26 1.05 -1.21 0.02 0.00 0.00 175.26 174.86 1ias s GLU 228 N -1.70 3.57 0.03 1.61 2.02 -1.26 -0.26 118.70 122.71 1ias s GLU 228 Ca 0.50 1.27 -0.27 0.00 0.02 0.00 0.00 54.97 56.49 1ias s GLU 228 Cb -0.41 -2.07 0.08 0.00 0.10 0.00 0.00 34.13 31.84 1ias s GLU 228 CO 0.53 -0.61 0.71 0.54 0.02 0.00 0.00 175.26 176.45 1ias s VAL 229 N -2.24 0.00 -0.13 2.63 0.11 0.24 -4.51 120.40 116.49 1ias s VAL 229 Ca 0.65 0.00 -0.06 0.00 -2.93 0.00 0.00 61.98 59.64 1ias s VAL 229 Cb -0.16 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.65 1ias s VAL 229 CO 0.29 0.00 0.10 0.00 -3.33 0.00 0.00 175.10 172.16 1ias s ALA 230 N -2.50 3.67 -0.18 1.54 0.00 0.27 0.54 121.76 125.10 1ias s ALA 230 Ca -0.03 -0.69 0.01 0.00 0.00 0.00 0.00 51.96 51.24 1ias s ALA 230 Cb -0.01 -1.89 0.03 0.00 0.00 0.00 0.00 23.12 21.25 1ias s ALA 230 CO -0.03 0.49 -0.12 0.08 0.00 0.00 0.00 175.76 176.18 1ias s VAL 231 N -0.61 1.60 -0.42 0.00 1.01 0.39 -0.98 120.40 121.38 1ias s VAL 231 Ca 0.12 -0.86 -0.18 0.00 0.00 0.00 0.00 61.98 61.06 1ias s VAL 231 Cb -0.12 -1.61 0.02 0.00 0.00 0.00 0.00 36.38 34.67 1ias s VAL 231 CO 0.02 0.28 0.47 -0.75 0.00 0.00 0.00 175.10 175.12 1ias s LYS 232 N 1.44 3.12 -0.37 2.72 2.20 -0.17 0.27 119.74 128.95 1ias s LYS 232 Ca 0.01 -0.70 -0.15 0.00 -0.36 0.00 0.00 55.97 54.77 1ias s LYS 232 Cb -0.15 -3.97 -0.00 0.00 -1.51 0.00 0.00 37.83 32.20 1ias s LYS 232 CO -0.09 -0.88 0.32 0.42 -0.36 0.00 0.00 175.35 174.76 1ias s ILE 233 N 2.25 5.22 0.46 5.43 1.01 0.75 -2.20 121.20 134.12 1ias s ILE 233 Ca 0.14 -0.26 -0.10 0.00 0.00 0.00 0.00 60.65 60.43 1ias s ILE 233 Cb -0.17 -3.85 -0.06 0.00 0.01 0.00 0.00 42.46 38.40 1ias s ILE 233 CO 0.14 -0.17 0.83 -0.36 0.00 0.00 0.00 174.94 175.39 1ias s PHE 234 N 1.86 3.51 0.09 3.97 0.40 -0.05 -1.97 117.98 125.80 1ias s PHE 234 Ca 0.08 1.06 -0.24 0.00 -0.60 0.00 0.00 56.93 57.23 1ias s PHE 234 Cb -0.17 -2.48 -0.07 0.00 0.51 0.00 0.00 43.02 40.81 1ias s PHE 234 CO 0.11 -0.25 0.74 -1.12 0.70 0.00 0.00 175.22 175.40 1ias s SER 235 N -3.53 7.26 0.33 1.36 0.01 -1.14 -4.22 113.70 113.77 1ias s SER 235 Ca 0.51 1.50 0.09 0.00 1.31 0.00 0.00 55.95 59.36 1ias s SER 235 Cb -0.10 -2.46 0.97 0.00 0.21 0.00 0.00 66.02 64.64 1ias s SER 235 CO 0.38 0.13 1.59 0.28 0.41 0.00 0.00 173.24 176.02 1ias h SER 236 N 5.00 -0.10 0.16 2.44 0.02 -1.86 0.97 113.55 120.18 1ias h SER 236 Ca -0.46 0.26 0.00 0.00 -0.84 0.00 0.00 61.79 60.75 1ias h SER 236 Cb 1.21 0.37 0.00 0.00 0.14 0.00 0.00 62.40 64.12 1ias h SER 236 CO 0.68 -0.35 0.00 -1.14 -1.14 0.00 0.00 176.83 174.88 1ias n ARG 237 N -5.36 0.35 -0.62 3.45 0.63 -1.26 -2.62 116.66 111.23 1ias n ARG 237 Ca 0.29 0.08 0.01 0.00 -0.92 0.00 0.00 57.85 57.30 1ias n ARG 237 Cb 0.95 -1.50 0.21 0.00 0.45 0.00 0.00 32.46 32.57 1ias n ARG 237 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1ias n GLU 238 N -1.16 2.03 -0.10 -0.14 -0.58 0.33 -4.76 120.64 116.27 1ias n GLU 238 Ca 0.10 -3.05 0.16 0.00 -0.42 0.00 0.00 57.16 53.94 1ias n GLU 238 Cb 0.09 -1.78 0.56 0.00 -0.57 0.00 0.00 31.44 29.74 1ias n GLU 238 CO 0.00 0.00 0.00 1.05 -0.48 0.00 0.00 177.13 177.70 1ias h GLU 239 N 1.10 0.29 -0.63 3.49 4.11 -1.58 -1.90 114.58 119.46 1ias h GLU 239 Ca 0.13 -0.02 -0.04 0.00 0.07 0.00 0.00 59.36 59.50 1ias h GLU 239 Cb 1.48 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.64 1ias h GLU 239 CO 0.28 0.19 0.23 -0.09 0.07 0.00 0.00 179.01 179.68 1ias h ARG 240 N 0.30 0.93 -0.35 1.06 2.43 -1.89 -1.42 114.38 115.44 1ias h ARG 240 Ca 0.31 -0.16 -0.07 0.00 -0.81 0.00 0.00 59.98 59.24 1ias h ARG 240 Cb 0.81 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 1ias h ARG 240 CO -0.07 0.78 -0.07 0.77 -1.51 0.00 0.00 179.97 179.86 1ias h SER 241 N 0.91 0.67 0.37 -3.80 0.02 -1.66 -0.47 113.55 109.59 1ias h SER 241 Ca 0.21 -0.36 -0.01 0.00 -0.84 0.00 0.00 61.79 60.80 1ias h SER 241 Cb 0.21 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 1ias h SER 241 CO -0.01 0.87 -0.33 -0.25 -1.14 0.00 0.00 176.83 175.96 1ias h TRP 242 N 0.46 -0.89 0.39 3.45 7.01 -1.34 -1.26 115.95 123.77 1ias h TRP 242 Ca 0.09 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.08 1ias h TRP 242 Cb 0.57 0.34 -0.00 0.00 -2.10 0.00 0.00 29.16 27.97 1ias h TRP 242 CO 0.05 -0.48 -0.24 0.35 -2.79 0.00 0.00 178.44 175.34 1ias h PHE 243 N -0.72 -0.62 -0.55 2.65 3.57 -1.25 -1.82 116.94 118.20 1ias h PHE 243 Ca -0.03 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.57 1ias h PHE 243 Cb 0.63 0.22 -0.11 0.00 2.79 0.00 0.00 35.95 39.48 1ias h PHE 243 CO -0.17 -0.37 -0.25 -0.09 -2.23 0.00 0.00 178.31 175.20 1ias h ARG 244 N -0.60 -0.11 -0.30 1.11 1.12 -1.03 0.63 114.38 115.20 1ias h ARG 244 Ca -0.04 0.01 -0.03 0.00 -1.11 0.00 0.00 59.98 58.80 1ias h ARG 244 Cb 0.49 0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 30.46 1ias h ARG 244 CO 0.05 -0.07 0.06 1.49 -3.11 0.00 0.00 179.97 178.38 1ias h GLU 245 N -0.11 0.50 -0.67 0.20 4.81 -1.14 -0.96 114.58 117.21 1ias h GLU 245 Ca 0.25 -0.13 -0.04 0.00 -0.13 0.00 0.00 59.36 59.32 1ias h GLU 245 Cb 0.50 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.79 1ias h GLU 245 CO -0.62 0.59 0.28 0.00 -0.73 0.00 0.00 179.01 178.52 1ias h ALA 246 N 0.89 0.87 -0.06 2.92 0.00 -0.56 -2.11 119.26 121.21 1ias h ALA 246 Ca 0.09 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1ias h ALA 246 Cb 0.32 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1ias h ALA 246 CO 0.00 0.48 -0.11 1.49 0.00 0.00 0.00 179.25 181.11 1ias h GLU 247 N 0.95 -0.16 -0.83 0.00 4.57 0.46 -0.40 114.58 119.16 1ias h GLU 247 Ca 0.23 0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.42 1ias h GLU 247 Cb 0.19 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.78 1ias h GLU 247 CO -0.02 -0.11 0.52 0.82 -1.18 0.00 0.00 179.01 179.04 1ias h ILE 248 N -0.16 1.23 0.49 2.32 2.04 -1.01 -1.98 117.51 120.44 1ias h ILE 248 Ca 0.06 -0.47 -0.02 0.00 1.00 0.00 0.00 64.86 65.43 1ias h ILE 248 Cb 0.25 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.37 1ias h ILE 248 CO -0.15 0.23 -0.23 1.88 0.00 0.00 0.00 178.15 179.87 1ias h TYR 249 N 1.14 -0.61 0.93 1.37 -1.99 -0.96 -3.23 116.97 113.62 1ias h TYR 249 Ca 0.30 -0.01 -0.04 0.00 2.00 0.00 0.00 58.73 60.97 1ias h TYR 249 Cb -0.07 0.20 0.00 0.00 2.00 0.00 0.00 36.73 38.86 1ias h TYR 249 CO -0.01 -0.38 -0.49 1.96 -0.00 0.00 0.00 178.16 179.25 1ias h GLN 250 N -0.79 -1.25 0.00 4.88 4.20 -1.09 -2.39 115.11 118.66 1ias h GLN 250 Ca -0.07 0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1ias h GLN 250 Cb 0.50 0.28 0.00 0.00 0.30 0.00 0.00 27.48 28.57 1ias h GLN 250 CO 0.11 -0.84 0.27 1.79 -0.67 0.00 0.00 178.83 179.50 1ias h THR 251 N -1.30 0.00 0.00 -0.54 1.35 -1.54 -2.78 112.91 108.10 1ias h THR 251 Ca -0.13 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.73 1ias h THR 251 Cb 1.01 0.68 0.00 0.00 -1.73 0.00 0.00 68.15 68.11 1ias h THR 251 CO 0.18 0.00 -1.09 0.52 -0.25 0.00 0.00 175.52 174.88 1ias n VAL 252 N -2.83 0.00 -0.37 6.82 0.31 -1.14 -4.97 118.33 116.16 1ias n VAL 252 Ca -0.02 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 1ias n VAL 252 Cb 0.32 0.63 0.00 0.00 -0.91 0.00 0.00 33.84 33.88 1ias n VAL 252 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 1ias n MET 253 N -1.62 0.00 -0.93 5.55 1.56 -0.91 -4.73 117.12 116.03 1ias n MET 253 Ca 0.00 0.00 -0.22 0.00 -0.27 0.00 0.00 57.70 57.21 1ias n MET 253 Cb 0.28 -2.50 -0.11 0.00 2.15 0.00 0.00 33.22 33.04 1ias n MET 253 CO 0.00 0.00 0.00 -0.11 -0.73 0.00 0.00 175.97 175.13 1ias n LEU 254 N 0.00 -0.13 -3.90 -0.89 7.94 -1.24 -4.85 117.00 113.93 1ias n LEU 254 Ca 0.00 -0.01 -0.25 0.00 -1.11 0.00 0.00 56.01 54.64 1ias n LEU 254 Cb 0.00 -0.50 -0.17 0.00 0.53 0.00 0.00 43.42 43.28 1ias n LEU 254 CO 0.00 -0.57 -0.43 -0.13 -1.11 0.00 0.00 177.39 175.15 1ias s ARG 255 N 5.25 1.31 -0.24 1.96 1.81 -1.26 -4.89 118.95 122.89 1ias s ARG 255 Ca 0.84 -0.20 -0.22 0.00 -1.72 0.00 0.00 55.73 54.43 1ias s ARG 255 Cb -0.71 -1.35 0.06 0.00 -0.45 0.00 0.00 34.95 32.51 1ias s ARG 255 CO 0.32 -0.19 0.65 -1.58 -0.68 0.00 0.00 175.30 173.82 1ias s HIS 256 N 1.44 -0.74 0.40 -0.53 2.46 -1.26 -5.03 115.29 112.04 1ias s HIS 256 Ca -0.01 1.76 0.22 0.00 0.47 0.00 0.00 55.06 57.51 1ias s HIS 256 Cb -0.13 0.27 1.24 0.00 -0.13 0.00 0.00 32.58 33.83 1ias s HIS 256 CO -0.04 -0.36 1.68 1.49 -2.47 0.00 0.00 174.74 175.04 1ias h GLU 257 N 5.30 0.24 -0.84 2.88 4.81 -2.00 0.37 114.58 125.34 1ias h GLU 257 Ca -0.29 -0.01 -0.45 0.00 -0.13 0.00 0.00 59.36 58.48 1ias h GLU 257 Cb 1.17 -0.05 -0.26 0.00 0.63 0.00 0.00 28.75 30.23 1ias h GLU 257 CO 0.10 0.16 0.47 0.09 -0.73 0.00 0.00 179.01 179.11 1ias n ASN 258 N -4.75 3.75 -3.80 1.04 3.02 -1.26 -4.82 115.26 108.44 1ias n ASN 258 Ca 0.32 -3.67 -0.18 0.00 -0.03 0.00 0.00 54.58 51.01 1ias n ASN 258 Cb 1.13 -0.79 -0.17 0.00 -0.61 0.00 0.00 39.78 39.34 1ias n ASN 258 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1ias s ILE 259 N -3.43 0.20 -0.24 2.41 1.01 0.12 -1.31 121.20 119.96 1ias s ILE 259 Ca 0.55 0.11 -0.42 0.00 0.00 0.00 0.00 60.65 60.88 1ias s ILE 259 Cb 0.46 -0.31 -0.19 0.00 0.01 0.00 0.00 42.46 42.43 1ias s ILE 259 CO 0.07 0.17 1.43 -0.11 0.00 0.00 0.00 174.94 176.50 1ias n LEU 260 N 4.38 1.11 -4.61 2.97 7.94 0.32 -4.54 117.00 124.58 1ias n LEU 260 Ca -0.21 1.15 -0.43 0.00 -1.11 0.00 0.00 56.01 55.41 1ias n LEU 260 Cb 0.50 -0.98 -0.02 0.00 0.53 0.00 0.00 43.42 43.45 1ias n LEU 260 CO 0.19 -1.12 1.21 -0.83 -1.11 0.00 0.00 177.39 175.74 1ias s GLY 261 N 1.87 1.15 0.23 -3.96 0.00 -1.26 -4.97 107.32 100.38 1ias s GLY 261 Ca 0.97 -0.13 -0.30 0.00 0.00 0.00 0.00 44.72 45.26 1ias s GLY 261 CO 0.67 2.73 1.18 -0.12 0.00 0.00 0.00 173.10 177.56 1ias s PHE 262 N 5.23 3.43 -0.02 1.90 5.36 -1.26 -1.70 117.98 130.91 1ias s PHE 262 Ca 0.60 1.50 -0.01 0.00 -0.96 0.00 0.00 56.93 58.07 1ias s PHE 262 Cb -0.14 -3.42 -0.01 0.00 -0.34 0.00 0.00 43.02 39.11 1ias s PHE 262 CO 0.31 -1.09 -0.03 -0.89 -1.46 0.00 0.00 175.22 172.06 1ias n ILE 263 N 1.88 0.11 -3.54 3.12 5.41 0.22 -4.93 119.36 121.64 1ias n ILE 263 Ca 0.02 -0.03 -0.10 0.00 1.00 0.00 0.00 62.75 63.64 1ias n ILE 263 Cb 0.44 -1.38 -0.02 0.00 -0.71 0.00 0.00 39.64 37.98 1ias n ILE 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ias s ALA 264 N -2.04 -1.58 0.04 -1.39 0.00 -0.80 -4.67 121.76 111.33 1ias s ALA 264 Ca -0.03 0.42 0.03 0.00 0.00 0.00 0.00 51.96 52.38 1ias s ALA 264 Cb 0.01 0.78 -0.02 0.00 0.00 0.00 0.00 23.12 23.89 1ias s ALA 264 CO 0.04 -0.82 -0.09 0.00 0.00 0.00 0.00 175.76 174.89 1ias s ALA 265 N -3.63 0.66 0.04 0.00 0.00 -1.26 0.10 121.76 117.66 1ias s ALA 265 Ca 0.04 -0.76 -0.27 0.00 0.00 0.00 0.00 51.96 50.97 1ias s ALA 265 Cb -0.02 0.01 0.09 0.00 0.00 0.00 0.00 23.12 23.20 1ias s ALA 265 CO -0.08 0.02 0.77 0.34 0.00 0.00 0.00 175.76 176.81 1ias s ASP 266 N -1.49 -0.47 0.12 0.00 3.68 -0.79 -4.50 116.67 113.23 1ias s ASP 266 Ca -0.08 0.10 0.04 0.00 2.13 0.00 0.00 52.55 54.74 1ias s ASP 266 Cb -0.09 0.48 -0.04 0.00 -1.45 0.00 0.00 42.92 41.81 1ias s ASP 266 CO 0.01 -0.73 -0.10 0.54 0.13 0.00 0.00 175.17 175.01 1ias s ASN 267 N -2.35 1.63 0.14 -0.34 6.03 -1.26 -0.96 114.94 117.83 1ias s ASN 267 Ca 0.01 -0.91 0.00 0.00 -1.03 0.00 0.00 52.86 50.94 1ias s ASN 267 Cb -0.01 -0.00 0.00 0.00 -3.03 0.00 0.00 41.25 38.21 1ias s ASN 267 CO -0.08 -0.29 0.00 0.29 -2.03 0.00 0.00 177.10 174.99 1ias n LYS 268 N 0.20 0.00 0.00 3.55 5.02 -0.74 -4.96 118.16 121.23 1ias n LYS 268 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 1ias n LYS 268 Cb 0.59 -0.16 0.00 0.00 -0.02 0.00 0.00 35.03 35.44 1ias n LYS 268 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1ias n ASP 269 N -3.16 0.00 -4.50 4.39 8.00 -1.26 -4.86 116.55 115.16 1ias n ASP 269 Ca 0.00 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.24 1ias n ASP 269 Cb 0.06 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.07 1ias n ASP 269 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1ias s ASN 270 N -1.00 3.15 0.00 -2.24 0.01 -1.26 -4.66 114.94 108.94 1ias s ASN 270 Ca 0.00 -1.46 0.00 0.00 -0.71 0.00 0.00 52.86 50.69 1ias s ASN 270 Cb 0.00 0.01 0.00 0.00 0.41 0.00 0.00 41.25 41.67 1ias s ASN 270 CO 0.00 -0.65 0.00 0.61 -1.51 0.00 0.00 177.10 175.55 1ias n GLY 271 N -0.89 0.37 0.37 0.66 0.00 -1.26 -1.37 105.19 103.07 1ias n GLY 271 Ca -0.06 0.02 0.20 0.00 0.00 0.00 0.00 46.02 46.19 1ias n GLY 271 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1ias h THR 272 N 0.00 0.51 -0.55 2.61 2.02 -2.00 -2.07 112.91 113.44 1ias h THR 272 Ca 0.00 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1ias h THR 272 Cb 0.00 -0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.40 1ias h THR 272 CO 0.00 0.09 0.00 0.79 0.37 0.00 0.00 175.52 176.77 1ias n TRP 273 N -4.78 1.75 -1.67 3.16 7.02 -0.47 -4.76 117.44 117.69 1ias n TRP 273 Ca 0.27 -0.63 -0.44 0.00 -1.02 0.00 0.00 57.50 55.68 1ias n TRP 273 Cb 0.82 -0.40 -0.02 0.00 -2.42 0.00 0.00 31.31 29.29 1ias n TRP 273 CO 0.00 0.00 0.00 2.41 -2.02 0.00 0.00 177.69 178.08 1ias n THR 274 N 0.72 1.19 -3.88 -0.99 -1.04 -0.71 -4.31 114.28 105.26 1ias n THR 274 Ca 0.25 -0.30 -0.36 0.00 -2.04 0.00 0.00 64.05 61.61 1ias n THR 274 Cb 1.03 -1.49 -0.13 0.00 -1.82 0.00 0.00 70.33 67.92 1ias n THR 274 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1ias s GLN 275 N -0.73 2.60 -0.24 -2.82 -0.21 -1.26 -4.33 119.66 112.67 1ias s GLN 275 Ca 0.65 -1.16 -0.08 0.00 0.02 0.00 0.00 55.36 54.80 1ias s GLN 275 Cb -0.63 -3.21 -0.04 0.00 1.00 0.00 0.00 33.01 30.13 1ias s GLN 275 CO 0.52 -0.57 0.09 -0.51 -2.12 0.00 0.00 175.29 172.71 1ias s LEU 276 N 1.32 3.63 0.23 2.90 1.43 -1.26 -1.79 118.68 125.13 1ias s LEU 276 Ca -0.03 -0.11 0.11 0.00 -1.03 0.00 0.00 54.13 53.08 1ias s LEU 276 Cb -0.19 -1.97 -0.05 0.00 0.03 0.00 0.00 46.19 44.02 1ias s LEU 276 CO -0.01 0.01 -0.22 0.26 0.23 0.00 0.00 176.35 176.62 1ias s TRP 277 N 1.38 2.25 -0.00 0.29 0.52 -0.13 -0.87 118.94 122.37 1ias s TRP 277 Ca 0.06 -0.36 -0.01 0.00 0.02 0.00 0.00 56.10 55.81 1ias s TRP 277 Cb -0.15 -1.05 0.00 0.00 -1.15 0.00 0.00 33.47 31.12 1ias s TRP 277 CO 0.05 0.59 0.01 -0.51 0.02 0.00 0.00 176.95 177.11 1ias s LEU 278 N -3.07 1.95 -0.03 2.99 1.02 -0.94 -1.88 118.68 118.72 1ias s LEU 278 Ca 0.25 0.02 0.04 0.00 0.02 0.00 0.00 54.13 54.46 1ias s LEU 278 Cb -0.06 0.05 -0.01 0.00 0.02 0.00 0.00 46.19 46.19 1ias s LEU 278 CO 0.12 -0.01 -0.16 -0.69 0.02 0.00 0.00 176.35 175.62 1ias s VAL 279 N -0.03 1.35 0.35 -1.59 1.01 0.29 -1.00 120.40 120.78 1ias s VAL 279 Ca -0.00 -0.69 0.01 0.00 0.00 0.00 0.00 61.98 61.29 1ias s VAL 279 Cb -0.00 -1.16 -0.01 0.00 0.00 0.00 0.00 36.38 35.21 1ias s VAL 279 CO -0.00 0.39 0.43 -0.94 0.00 0.00 0.00 175.10 174.98 1ias s SER 280 N -0.05 1.20 0.79 3.32 1.04 -0.15 0.70 113.70 120.54 1ias s SER 280 Ca -0.01 -1.59 -0.14 0.00 0.48 0.00 0.00 55.95 54.69 1ias s SER 280 Cb -0.10 0.65 0.07 0.00 0.10 0.00 0.00 66.02 66.74 1ias s SER 280 CO 0.01 -1.25 1.22 -1.81 0.98 0.00 0.00 173.24 172.39 1ias s ASP 281 N -3.29 3.66 -0.12 7.02 1.01 -0.69 -0.57 116.67 123.69 1ias s ASP 281 Ca 0.33 2.41 -0.02 0.00 0.71 0.00 0.00 52.55 55.98 1ias s ASP 281 Cb 0.00 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.31 1ias s ASP 281 CO 0.23 -2.63 -0.03 -0.47 0.21 0.00 0.00 175.17 172.48 1ias s TYR 282 N -2.05 3.04 -0.31 4.23 5.04 -1.26 -3.89 117.35 122.15 1ias s TYR 282 Ca 0.75 -0.11 0.02 0.00 -2.44 0.00 0.00 57.07 55.29 1ias s TYR 282 Cb -0.30 -1.87 0.09 0.00 0.35 0.00 0.00 41.96 40.23 1ias s TYR 282 CO 0.50 0.17 0.04 -1.01 -1.34 0.00 0.00 175.55 173.90 1ias s HIS 283 N -0.18 2.83 0.66 4.97 3.76 -1.26 -4.96 115.29 121.12 1ias s HIS 283 Ca 0.04 -2.33 0.26 0.00 -0.15 0.00 0.00 55.06 52.88 1ias s HIS 283 Cb -0.13 -2.24 1.44 0.00 1.11 0.00 0.00 32.58 32.76 1ias s HIS 283 CO 0.02 -0.89 1.81 1.49 -0.85 0.00 0.00 174.74 176.33 1ias h GLU 284 N 7.83 0.00 0.00 1.40 4.81 -1.98 -1.24 114.58 125.41 1ias h GLU 284 Ca -0.10 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.08 1ias h GLU 284 Cb 1.03 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 1ias h GLU 284 CO 0.48 0.00 -0.21 0.45 -0.73 0.00 0.00 179.01 179.00 1ias h HIS 285 N 0.00 0.00 0.00 0.92 3.86 -1.92 -3.50 115.15 114.51 1ias h HIS 285 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1ias h HIS 285 Cb 0.83 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.30 1ias h HIS 285 CO 0.00 0.21 0.00 0.41 0.86 0.00 0.00 177.93 179.41 1ias n GLY 286 N 0.62 -1.36 3.83 2.45 0.00 -0.47 -4.45 105.19 105.81 1ias n GLY 286 Ca 0.02 -1.32 -0.32 0.00 0.00 0.00 0.00 46.02 44.39 1ias n GLY 286 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ias s SER 287 N -4.00 6.51 0.35 1.61 1.04 -1.26 -1.95 113.70 116.00 1ias s SER 287 Ca 0.00 1.63 0.11 0.00 0.48 0.00 0.00 55.95 58.17 1ias s SER 287 Cb 0.00 -2.52 0.88 0.00 0.10 0.00 0.00 66.02 64.49 1ias s SER 287 CO 0.00 -0.66 1.81 0.25 0.98 0.00 0.00 173.24 175.61 1ias h LEU 288 N 0.96 0.63 -0.12 2.42 5.85 0.54 0.12 115.31 125.71 1ias h LEU 288 Ca -0.47 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.35 1ias h LEU 288 Cb 1.19 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.15 1ias h LEU 288 CO 0.61 0.23 -0.06 0.15 -0.34 0.00 0.00 178.44 179.03 1ias h PHE 289 N 0.62 -0.14 -0.55 1.25 3.57 -1.30 0.75 116.94 121.14 1ias h PHE 289 Ca 0.54 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.95 1ias h PHE 289 Cb 1.03 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.83 1ias h PHE 289 CO -0.00 -0.10 -0.07 -0.44 -2.23 0.00 0.00 178.31 175.47 1ias h ASP 290 N -0.05 1.02 -0.57 0.41 3.32 -1.17 -2.40 116.42 116.98 1ias h ASP 290 Ca 0.07 -0.34 0.02 0.00 0.02 0.00 0.00 57.03 56.80 1ias h ASP 290 Cb 0.15 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.39 1ias h ASP 290 CO -0.16 1.11 0.36 0.22 -1.72 0.00 0.00 179.24 179.05 1ias h TYR 291 N 0.90 0.67 -0.06 4.55 3.20 -0.44 -0.70 116.97 125.09 1ias h TYR 291 Ca 0.15 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.90 1ias h TYR 291 Cb 0.64 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 1ias h TYR 291 CO 0.04 0.40 -0.59 -0.07 -1.64 0.00 0.00 178.16 176.30 1ias h LEU 292 N 0.71 0.23 -0.91 2.82 4.07 -0.82 0.85 115.31 122.26 1ias h LEU 292 Ca 0.22 -0.13 -0.11 0.00 0.08 0.00 0.00 57.88 57.94 1ias h LEU 292 Cb -0.02 -0.07 -0.02 0.00 1.08 0.00 0.00 40.66 41.64 1ias h LEU 292 CO -0.08 0.76 -0.54 0.78 -1.08 0.00 0.00 178.44 178.29 1ias h ASN 293 N 0.15 0.03 0.75 -0.43 2.35 -1.04 -3.19 115.58 114.20 1ias h ASN 293 Ca -0.00 -0.01 -0.21 0.00 -0.55 0.00 0.00 56.30 55.52 1ias h ASN 293 Cb 1.08 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 39.41 1ias h ASN 293 CO 0.09 0.56 -1.37 -0.09 -1.65 0.00 0.00 177.43 174.97 1ias h ARG 294 N 0.02 0.00 -5.00 0.81 1.12 -0.89 -3.48 114.38 106.95 1ias h ARG 294 Ca -0.00 0.00 -0.56 0.00 -1.11 0.00 0.00 59.98 58.31 1ias h ARG 294 Cb 0.95 0.00 -0.13 0.00 -0.01 0.00 0.00 29.97 30.78 1ias h ARG 294 CO 0.07 0.48 -0.50 0.71 -3.11 0.00 0.00 179.97 177.62 1ias s TYR 295 N -2.78 1.78 0.29 2.20 2.02 0.27 -5.09 117.35 116.04 1ias s TYR 295 Ca -0.02 -1.39 0.06 0.00 -0.37 0.00 0.00 57.07 55.34 1ias s TYR 295 Cb 0.08 -1.07 -0.06 0.00 -0.40 0.00 0.00 41.96 40.51 1ias s TYR 295 CO 0.81 -0.43 -0.02 0.95 -1.57 0.00 0.00 175.55 175.29 1ias s THR 296 N -3.23 1.50 0.05 -0.71 -4.23 -1.26 -4.63 115.64 103.13 1ias s THR 296 Ca 0.25 -2.08 -0.03 0.00 -1.18 0.00 0.00 61.69 58.66 1ias s THR 296 Cb 0.02 -2.56 -0.03 0.00 1.34 0.00 0.00 72.50 71.27 1ias s THR 296 CO 0.17 -0.21 0.03 0.54 -0.54 0.00 0.00 174.62 174.61 1ias s VAL 297 N -3.10 0.18 0.85 2.29 0.11 0.10 -4.93 120.40 115.90 1ias s VAL 297 Ca 0.31 -1.44 -0.11 0.00 -2.93 0.00 0.00 61.98 57.81 1ias s VAL 297 Cb 0.06 -1.18 0.10 0.00 -1.53 0.00 0.00 36.38 33.82 1ias s VAL 297 CO 0.13 -0.80 1.10 -0.89 -3.33 0.00 0.00 175.10 171.31 1ias s THR 298 N -3.28 2.84 0.24 5.04 2.01 -1.26 -1.94 115.64 119.28 1ias s THR 298 Ca 0.01 0.27 -0.04 0.00 0.31 0.00 0.00 61.69 62.24 1ias s THR 298 Cb 0.03 -2.63 0.12 0.00 0.01 0.00 0.00 72.50 70.04 1ias s THR 298 CO -0.08 -0.36 1.75 0.58 -0.69 0.00 0.00 174.62 175.83 1ias h VAL 299 N -1.45 1.25 -0.30 3.82 2.07 -1.94 0.24 116.25 119.93 1ias h VAL 299 Ca -0.45 -0.97 -0.06 0.00 0.82 0.00 0.00 66.70 66.04 1ias h VAL 299 Cb 1.25 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 1ias h VAL 299 CO 0.49 0.36 -0.03 -0.08 0.02 0.00 0.00 177.57 178.33 1ias h GLU 300 N 0.88 0.55 -0.27 1.57 4.81 -2.00 -2.30 114.58 117.83 1ias h GLU 300 Ca 0.18 -0.19 0.05 0.00 -0.13 0.00 0.00 59.36 59.27 1ias h GLU 300 Cb 0.40 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.70 1ias h GLU 300 CO 0.01 0.71 -0.01 0.78 -0.73 0.00 0.00 179.01 179.78 1ias h GLY 301 N 0.34 0.25 0.57 1.92 0.00 -1.72 -1.14 103.07 103.29 1ias h GLY 301 Ca 0.08 0.04 0.08 0.00 0.00 0.00 0.00 47.33 47.53 1ias h GLY 301 CO 0.02 -0.06 0.43 1.98 0.00 0.00 0.00 176.54 178.91 1ias h MET 302 N 0.07 0.72 -0.25 4.80 1.85 -0.44 -2.02 114.93 119.67 1ias h MET 302 Ca 0.13 -0.04 -0.01 0.00 -0.61 0.00 0.00 59.70 59.17 1ias h MET 302 Cb 0.17 -0.16 -0.01 0.00 0.43 0.00 0.00 31.60 32.03 1ias h MET 302 CO -0.22 0.48 0.12 0.82 -0.40 0.00 0.00 176.91 177.71 1ias h ILE 303 N 0.74 1.14 -0.26 1.77 2.04 -0.79 -1.52 117.51 120.64 1ias h ILE 303 Ca 0.36 -0.39 0.06 0.00 1.00 0.00 0.00 64.86 65.89 1ias h ILE 303 Cb 0.31 0.95 -0.08 0.00 -0.74 0.00 0.00 36.82 37.26 1ias h ILE 303 CO -0.23 0.14 -0.29 0.11 0.00 0.00 0.00 178.15 177.88 1ias h LYS 304 N 0.27 -0.28 0.26 2.37 1.79 -0.56 0.41 116.57 120.84 1ias h LYS 304 Ca 0.09 0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.57 1ias h LYS 304 Cb 0.11 0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 1ias h LYS 304 CO -0.01 -0.19 -0.19 -0.07 -1.08 0.00 0.00 179.45 177.92 1ias h LEU 305 N -0.29 -0.47 -0.52 2.94 3.38 -1.25 -0.95 115.31 118.14 1ias h LEU 305 Ca 0.14 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 1ias h LEU 305 Cb 0.51 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1ias h LEU 305 CO -0.43 -0.29 0.24 0.00 0.09 0.00 0.00 178.44 178.06 1ias h ALA 306 N 0.26 0.67 0.34 1.53 0.00 -0.94 -1.09 119.26 120.04 1ias h ALA 306 Ca -0.02 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1ias h ALA 306 Cb 0.39 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1ias h ALA 306 CO 0.00 0.24 -0.16 1.25 0.00 0.00 0.00 179.25 180.58 1ias h LEU 307 N 0.69 -0.39 -0.12 0.00 6.46 -0.09 -1.15 115.31 120.71 1ias h LEU 307 Ca 0.18 -0.01 0.04 0.00 -0.12 0.00 0.00 57.88 57.97 1ias h LEU 307 Cb 0.13 0.10 -0.04 0.00 -0.73 0.00 0.00 40.66 40.12 1ias h LEU 307 CO -0.02 -0.25 -0.14 0.77 -0.62 0.00 0.00 178.44 178.18 1ias h SER 308 N -0.49 -0.43 -0.66 1.25 4.64 -1.10 0.21 113.55 116.97 1ias h SER 308 Ca -0.05 0.08 0.10 0.00 -0.47 0.00 0.00 61.79 61.45 1ias h SER 308 Cb 0.37 0.21 -0.07 0.00 -0.31 0.00 0.00 62.40 62.60 1ias h SER 308 CO 0.08 -0.18 0.28 0.74 -0.87 0.00 0.00 176.83 176.87 1ias h THR 309 N -0.18 0.78 -0.55 2.95 2.02 -1.07 -0.02 112.91 116.85 1ias h THR 309 Ca 0.09 -0.16 -0.04 0.00 0.77 0.00 0.00 66.41 67.07 1ias h THR 309 Cb 0.30 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 1ias h THR 309 CO -0.22 0.09 0.19 0.00 0.37 0.00 0.00 175.52 175.95 1ias h ALA 310 N 1.44 0.71 -0.68 6.16 0.00 -0.49 -1.35 119.26 125.05 1ias h ALA 310 Ca 0.33 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.15 1ias h ALA 310 Cb 0.40 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 1ias h ALA 310 CO -0.31 0.35 0.34 0.77 0.00 0.00 0.00 179.25 180.40 1ias h SER 311 N 0.75 0.45 0.13 0.00 0.02 0.10 0.16 113.55 115.16 1ias h SER 311 Ca 0.18 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.18 1ias h SER 311 Cb 0.24 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1ias h SER 311 CO -0.01 0.27 -0.06 1.23 -1.14 0.00 0.00 176.83 177.12 1ias h GLY 312 N 0.60 -0.18 1.60 -3.77 0.00 -0.76 -1.28 103.07 99.29 1ias h GLY 312 Ca 0.33 0.07 0.04 0.00 0.00 0.00 0.00 47.33 47.76 1ias h GLY 312 CO -0.24 -0.06 0.18 -2.00 0.00 0.00 0.00 176.54 174.41 1ias h LEU 313 N -0.49 0.17 -0.18 3.11 5.85 -0.93 -0.07 115.31 122.78 1ias h LEU 313 Ca -0.02 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 1ias h LEU 313 Cb 0.39 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 1ias h LEU 313 CO 0.03 0.12 -0.00 0.00 -0.34 0.00 0.00 178.44 178.24 1ias h ALA 314 N 1.85 0.24 -0.56 1.25 0.00 -0.53 -1.97 119.26 119.54 1ias h ALA 314 Ca 0.12 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1ias h ALA 314 Cb 0.21 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1ias h ALA 314 CO -0.02 -0.04 0.17 1.25 0.00 0.00 0.00 179.25 180.61 1ias h HIS 315 N 0.07 0.86 -0.18 0.00 -0.00 0.11 -0.27 115.15 115.74 1ias h HIS 315 Ca 0.05 -0.07 -0.02 0.00 -0.00 0.00 0.00 60.37 60.34 1ias h HIS 315 Cb 0.39 -0.26 -0.01 0.00 -0.00 0.00 0.00 27.41 27.53 1ias h HIS 315 CO 0.03 0.70 0.05 -0.07 -0.00 0.00 0.00 177.93 178.64 1ias h LEU 316 N 0.82 0.27 -1.18 0.26 3.38 -0.93 -3.02 115.31 114.90 1ias h LEU 316 Ca 0.19 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1ias h LEU 316 Cb 0.24 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1ias h LEU 316 CO -0.01 0.41 -0.32 0.45 0.09 0.00 0.00 178.44 179.07 1ias h HIS 317 N 0.11 0.00 -3.24 1.13 3.86 -1.15 0.82 115.15 116.69 1ias h HIS 317 Ca 0.06 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.74 1ias h HIS 317 Cb 0.24 0.00 0.03 0.00 1.06 0.00 0.00 27.41 28.74 1ias h HIS 317 CO 0.00 0.32 0.69 1.41 0.86 0.00 0.00 177.93 181.21 1ias s MET 318 N -3.81 4.35 -0.04 2.45 -2.45 -0.13 -4.29 119.30 115.38 1ias s MET 318 Ca -0.01 2.09 -0.03 0.00 -1.25 0.00 0.00 55.69 56.49 1ias s MET 318 Cb 0.12 -3.20 -0.04 0.00 1.25 0.00 0.00 34.83 32.96 1ias s MET 318 CO 0.67 -0.34 0.13 -2.00 1.05 0.00 0.00 175.02 174.53 1ias s GLU 319 N 0.31 3.31 -0.06 4.11 2.12 -1.26 -4.18 118.70 123.05 1ias s GLU 319 Ca 0.60 -0.32 -0.02 0.00 0.36 0.00 0.00 54.97 55.58 1ias s GLU 319 Cb -0.37 -3.04 0.03 0.00 0.26 0.00 0.00 34.13 31.01 1ias s GLU 319 CO 0.36 0.70 0.06 0.42 -0.54 0.00 0.00 175.26 176.25 1ias s ILE 320 N -1.19 -0.08 -0.24 -3.70 1.01 -0.10 -4.95 121.20 111.94 1ias s ILE 320 Ca 0.22 0.33 -0.16 0.00 0.00 0.00 0.00 60.65 61.04 1ias s ILE 320 Cb -0.12 -0.23 -0.03 0.00 0.01 0.00 0.00 42.46 42.09 1ias s ILE 320 CO 0.13 0.12 0.43 0.68 0.00 0.00 0.00 174.94 176.29 1ias s VAL 321 N 2.16 5.15 0.00 2.92 -7.23 -1.26 -1.90 120.40 120.23 1ias s VAL 321 Ca 0.05 0.72 0.00 0.00 -1.81 0.00 0.00 61.98 60.93 1ias s VAL 321 Cb -0.13 -3.75 0.00 0.00 0.56 0.00 0.00 36.38 33.06 1ias s VAL 321 CO -0.04 0.17 0.00 0.61 -0.31 0.00 0.00 175.10 175.53 1ias n GLY 322 N 4.32 2.34 0.00 2.32 0.00 -1.26 -4.87 105.19 108.04 1ias n GLY 322 Ca -0.07 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.71 1ias n GLY 322 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ias n THR 323 N -1.22 0.00 0.66 2.61 -1.04 -1.26 -0.58 114.28 113.45 1ias n THR 323 Ca 0.00 1.40 0.00 0.00 -2.04 0.00 0.00 64.05 63.41 1ias n THR 323 Cb 0.00 -2.13 0.00 0.00 -1.82 0.00 0.00 70.33 66.38 1ias n THR 323 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ias n GLN 324 N -2.19 0.66 -2.64 -2.82 1.13 -1.26 -4.79 117.38 105.47 1ias n GLN 324 Ca 0.00 0.00 -0.23 0.00 -1.94 0.00 0.00 57.00 54.83 1ias n GLN 324 Cb 0.00 -1.24 0.03 0.00 0.11 0.00 0.00 30.24 29.14 1ias n GLN 324 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1ias s GLY 325 N 0.39 1.71 0.01 1.08 0.00 0.25 -5.08 107.32 105.68 1ias s GLY 325 Ca 0.00 -1.12 -0.03 0.00 0.00 0.00 0.00 44.72 43.56 1ias s GLY 325 CO 0.00 -0.85 0.05 -1.59 0.00 0.00 0.00 173.10 170.71 1ias s LYS 326 N -4.80 0.36 1.00 2.90 -2.85 -0.80 -4.85 119.74 110.70 1ias s LYS 326 Ca 0.55 -0.45 -0.14 0.00 -1.00 0.00 0.00 55.97 54.93 1ias s LYS 326 Cb -0.10 0.14 0.19 0.00 -2.06 0.00 0.00 37.83 36.00 1ias s LYS 326 CO 0.40 -0.07 1.12 -1.25 0.10 0.00 0.00 175.35 175.65 1ias s PRO 327 N -1.28 0.41 0.42 1.78 0.04 -1.26 -0.92 135.00 134.20 1ias s PRO 327 Ca -0.14 0.28 -0.22 0.00 0.04 0.00 0.00 61.00 60.97 1ias s PRO 327 Cb -0.08 -1.76 -0.10 0.00 0.04 0.00 0.00 34.50 32.60 1ias s PRO 327 CO 0.00 -2.69 0.96 0.00 0.04 0.00 0.00 177.00 175.31 1ias s ALA 328 N -3.14 3.04 -0.01 8.56 0.00 -1.19 -4.64 121.76 124.39 1ias s ALA 328 Ca 0.66 0.45 0.01 0.00 0.00 0.00 0.00 51.96 53.08 1ias s ALA 328 Cb -0.15 -3.17 0.01 0.00 0.00 0.00 0.00 23.12 19.80 1ias s ALA 328 CO 0.56 0.07 -0.03 0.42 0.00 0.00 0.00 175.76 176.77 1ias s ILE 329 N -2.07 0.29 -0.14 0.00 1.01 0.29 -2.06 121.20 118.51 1ias s ILE 329 Ca 0.61 -0.11 -0.02 0.00 0.00 0.00 0.00 60.65 61.13 1ias s ILE 329 Cb -0.11 -0.28 -0.02 0.00 0.01 0.00 0.00 42.46 42.06 1ias s ILE 329 CO 0.16 0.11 -0.08 0.00 0.00 0.00 0.00 174.94 175.12 1ias s ALA 330 N 0.21 2.81 0.05 9.38 0.00 -0.60 -2.99 121.76 130.62 1ias s ALA 330 Ca -0.02 -0.86 -0.24 0.00 0.00 0.00 0.00 51.96 50.84 1ias s ALA 330 Cb -0.05 -1.39 -0.17 0.00 0.00 0.00 0.00 23.12 21.51 1ias s ALA 330 CO -0.00 0.22 1.58 1.25 0.00 0.00 0.00 175.76 178.81 1ias h HIS 331 N 6.73 -0.04 0.00 0.00 2.76 -1.89 -1.56 115.15 121.15 1ias h HIS 331 Ca -0.29 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.88 1ias h HIS 331 Cb 1.20 0.01 0.00 0.00 1.55 0.00 0.00 27.41 30.17 1ias h HIS 331 CO 0.52 0.12 0.00 0.54 -1.30 0.00 0.00 177.93 177.81 1ias n ARG 332 N -5.04 -0.80 -2.50 5.26 1.74 -1.26 -3.15 116.66 110.92 1ias n ARG 332 Ca -0.08 0.20 -0.04 0.00 -0.77 0.00 0.00 57.85 57.17 1ias n ARG 332 Cb 0.11 -3.81 0.08 0.00 -1.02 0.00 0.00 32.46 27.82 1ias n ARG 332 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1ias n ASP 333 N -0.40 -1.31 -4.77 0.55 2.03 -1.26 -4.42 116.55 106.96 1ias n ASP 333 Ca 0.00 -1.99 -0.37 0.00 0.52 0.00 0.00 54.79 52.96 1ias n ASP 333 Cb 0.20 0.76 -0.02 0.00 -0.72 0.00 0.00 41.12 41.34 1ias n ASP 333 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1ias s LEU 334 N -2.77 4.05 0.00 -2.67 1.43 -1.26 -4.86 118.68 112.59 1ias s LEU 334 Ca 0.11 2.25 0.00 0.00 -1.03 0.00 0.00 54.13 55.45 1ias s LEU 334 Cb 0.28 -4.22 0.00 0.00 0.03 0.00 0.00 46.19 42.28 1ias s LEU 334 CO -0.07 -0.81 0.00 2.29 0.23 0.00 0.00 176.35 177.99 1ias n LYS 335 N -0.37 0.00 0.11 1.70 2.85 -1.26 -4.87 118.16 116.32 1ias n LYS 335 Ca 0.07 0.00 0.20 0.00 -1.05 0.00 0.00 58.31 57.53 1ias n LYS 335 Cb 0.48 0.00 0.73 0.00 -0.65 0.00 0.00 35.03 35.59 1ias n LYS 335 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1ias h SER 336 N 0.00 0.00 1.09 -5.58 4.64 -1.94 0.29 113.55 112.06 1ias h SER 336 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ias h SER 336 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ias h SER 336 CO 0.00 0.00 -0.26 0.29 -0.87 0.00 0.00 176.83 175.99 1ias n LYS 337 N -3.55 0.20 -0.50 4.77 5.02 -1.26 -1.01 118.16 121.84 1ias n LYS 337 Ca 0.07 0.11 0.08 0.00 -2.02 0.00 0.00 58.31 56.56 1ias n LYS 337 Cb 0.65 -1.68 0.29 0.00 -0.02 0.00 0.00 35.03 34.27 1ias n LYS 337 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1ias n ASN 338 N -2.01 4.21 -4.24 4.39 3.02 0.10 -4.87 115.26 115.86 1ias n ASN 338 Ca 0.05 -2.54 -0.29 0.00 -0.03 0.00 0.00 54.58 51.77 1ias n ASN 338 Cb 0.41 -0.50 -0.16 0.00 -0.61 0.00 0.00 39.78 38.92 1ias n ASN 338 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1ias s ILE 339 N -1.99 1.80 0.09 2.41 1.01 -1.16 -1.08 121.20 122.29 1ias s ILE 339 Ca 0.43 -0.96 0.08 0.00 0.00 0.00 0.00 60.65 60.20 1ias s ILE 339 Cb 0.29 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 41.22 1ias s ILE 339 CO 0.18 0.51 -0.18 -0.76 0.00 0.00 0.00 174.94 174.68 1ias s LEU 340 N -0.40 2.65 -0.15 2.97 1.43 -0.74 0.67 118.68 125.11 1ias s LEU 340 Ca 0.05 -0.52 -0.01 0.00 -1.03 0.00 0.00 54.13 52.62 1ias s LEU 340 Cb -0.10 -1.53 -0.01 0.00 0.03 0.00 0.00 46.19 44.58 1ias s LEU 340 CO 0.00 0.20 -0.12 0.54 0.23 0.00 0.00 176.35 177.21 1ias s VAL 341 N -1.06 3.05 0.90 -1.59 0.11 -0.82 -1.38 120.40 119.60 1ias s VAL 341 Ca 0.17 -0.64 -0.14 0.00 -2.93 0.00 0.00 61.98 58.43 1ias s VAL 341 Cb -0.11 -2.31 0.15 0.00 -1.53 0.00 0.00 36.38 32.58 1ias s VAL 341 CO 0.08 0.50 1.26 -0.54 -3.33 0.00 0.00 175.10 173.08 1ias s LYS 342 N 0.68 1.21 0.32 1.54 1.02 -0.06 -4.07 119.74 120.37 1ias s LYS 342 Ca -0.06 -0.18 0.01 0.00 0.02 0.00 0.00 55.97 55.76 1ias s LYS 342 Cb -0.15 -1.89 0.56 0.00 -0.52 0.00 0.00 37.83 35.83 1ias s LYS 342 CO 0.02 -2.07 1.97 0.87 -0.92 0.00 0.00 175.35 175.23 1ias h LYS 343 N -1.39 0.94 -0.94 1.68 1.57 -1.98 -2.27 116.57 114.18 1ias h LYS 343 Ca -0.45 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.20 1ias h LYS 343 Cb 1.28 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 33.33 1ias h LYS 343 CO 0.50 0.62 0.10 0.27 -0.57 0.00 0.00 179.45 180.37 1ias n ASN 344 N -4.44 2.82 -2.78 0.86 6.94 -1.26 -4.87 115.26 112.53 1ias n ASN 344 Ca 0.09 -2.38 -0.21 0.00 -0.02 0.00 0.00 54.58 52.06 1ias n ASN 344 Cb 0.09 -0.58 0.01 0.00 -2.36 0.00 0.00 39.78 36.94 1ias n ASN 344 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ias n GLY 345 N 0.10 -0.51 3.82 4.83 0.00 -0.85 -5.00 105.19 107.58 1ias n GLY 345 Ca 0.13 0.07 -0.25 0.00 0.00 0.00 0.00 46.02 45.97 1ias n GLY 345 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ias s THR 346 N -3.07 2.04 0.34 2.61 2.01 -1.26 -3.90 115.64 114.42 1ias s THR 346 Ca 0.18 -1.58 0.05 0.00 0.31 0.00 0.00 61.69 60.64 1ias s THR 346 Cb -0.08 -2.62 -0.07 0.00 0.01 0.00 0.00 72.50 69.74 1ias s THR 346 CO 0.22 0.00 0.04 0.00 -0.69 0.00 0.00 174.62 174.19 1ias s ILE 349 N 1.67 2.65 0.17 0.00 -1.09 -0.43 -1.79 121.20 122.39 1ias s ILE 349 Ca -0.09 0.29 -0.12 0.00 -2.23 0.00 0.00 60.65 58.50 1ias s ILE 349 Cb -0.07 -2.77 0.00 0.00 -1.58 0.00 0.00 42.46 38.05 1ias s ILE 349 CO -0.16 -0.20 0.36 0.00 -1.23 0.00 0.00 174.94 173.71 1ias s ALA 350 N -2.26 -0.34 -0.14 9.38 0.00 -0.24 -0.52 121.76 127.65 1ias s ALA 350 Ca 0.70 -0.64 -0.01 0.00 0.00 0.00 0.00 51.96 52.01 1ias s ALA 350 Cb -0.25 0.83 0.00 0.00 0.00 0.00 0.00 23.12 23.71 1ias s ALA 350 CO 0.47 -0.69 0.02 -3.47 0.00 0.00 0.00 175.76 172.09 1ias n ASP 351 N -0.25 -4.61 -1.40 0.00 -0.08 -1.26 -4.80 116.55 104.16 1ias n ASP 351 Ca -0.09 0.59 0.01 0.00 -1.51 0.00 0.00 54.79 53.79 1ias n ASP 351 Cb 0.63 -2.88 0.28 0.00 2.34 0.00 0.00 41.12 41.48 1ias n ASP 351 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1ias n LEU 352 N 0.24 4.84 0.28 -2.67 4.77 -1.26 -4.66 117.00 118.54 1ias n LEU 352 Ca 0.00 -3.22 0.14 0.00 -0.03 0.00 0.00 56.01 52.90 1ias n LEU 352 Cb 0.02 -0.64 0.84 0.00 -2.33 0.00 0.00 43.42 41.30 1ias n LEU 352 CO 0.19 0.82 1.08 1.23 -1.33 0.00 0.00 177.39 179.39 1ias h GLY 353 N 2.11 0.00 -0.57 -0.72 0.00 -1.90 -2.64 103.07 99.35 1ias h GLY 353 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1ias h GLY 353 CO 0.45 0.00 -0.30 1.04 0.00 0.00 0.00 176.54 177.73 1ias n LEU 354 N -3.86 1.38 -4.41 3.11 4.77 -1.26 -4.57 117.00 112.15 1ias n LEU 354 Ca -0.03 -0.75 -0.38 0.00 -0.03 0.00 0.00 56.01 54.83 1ias n LEU 354 Cb 0.13 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.26 1ias n LEU 354 CO 0.29 0.27 -0.11 0.00 -1.33 0.00 0.00 177.39 176.51 1ias n ALA 355 N -0.26 -1.76 -2.58 -1.18 0.00 -0.99 -4.78 120.51 108.96 1ias n ALA 355 Ca 0.05 -0.13 -0.25 0.00 0.00 0.00 0.00 53.44 53.11 1ias n ALA 355 Cb 0.28 -1.74 -0.16 0.00 0.00 0.00 0.00 19.45 17.83 1ias n ALA 355 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1ias s VAL 356 N -1.84 1.43 0.13 0.00 -7.23 -0.59 -4.83 120.40 107.48 1ias s VAL 356 Ca 0.65 -0.76 0.04 0.00 -1.81 0.00 0.00 61.98 60.09 1ias s VAL 356 Cb -0.41 -1.20 -0.04 0.00 0.56 0.00 0.00 36.38 35.29 1ias s VAL 356 CO 0.59 0.41 0.14 -0.13 -0.31 0.00 0.00 175.10 175.79 1ias s ARG 357 N -0.32 2.99 -0.11 4.82 0.52 -1.26 -1.56 118.95 124.03 1ias s ARG 357 Ca 0.04 -0.76 -0.02 0.00 -0.52 0.00 0.00 55.73 54.48 1ias s ARG 357 Cb -0.08 -2.73 0.04 0.00 0.52 0.00 0.00 34.95 32.70 1ias s ARG 357 CO -0.00 0.52 0.01 -1.58 0.02 0.00 0.00 175.30 174.27 1ias s HIS 358 N -1.63 0.80 -0.48 -0.53 5.65 -0.87 -1.97 115.29 116.26 1ias s HIS 358 Ca 0.31 -0.39 -0.16 0.00 0.25 0.00 0.00 55.06 55.07 1ias s HIS 358 Cb -0.11 -0.88 0.07 0.00 -1.18 0.00 0.00 32.58 30.48 1ias s HIS 358 CO 0.24 -0.42 0.45 0.34 -0.65 0.00 0.00 174.74 174.70 1ias s ASP 359 N 1.93 6.16 0.14 9.88 2.15 -0.59 -3.16 116.67 133.18 1ias s ASP 359 Ca 0.03 -1.27 -0.18 0.00 0.43 0.00 0.00 52.55 51.57 1ias s ASP 359 Cb -0.14 -2.21 -0.03 0.00 -0.30 0.00 0.00 42.92 40.24 1ias s ASP 359 CO -0.06 -0.71 1.79 0.77 -0.17 0.00 0.00 175.17 176.79 1ias h SER 360 N 8.81 0.32 0.00 -0.34 4.64 -1.96 0.44 113.55 125.47 1ias h SER 360 Ca -0.28 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1ias h SER 360 Cb 1.11 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1ias h SER 360 CO 0.90 0.23 0.02 0.00 -0.87 0.00 0.00 176.83 177.12 1ias n ALA 361 N -2.18 1.16 -0.45 5.18 0.00 -1.26 -1.17 120.51 121.80 1ias n ALA 361 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1ias n ALA 361 Cb 0.03 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.63 1ias n ALA 361 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1ias n THR 362 N -1.06 0.00 -3.88 0.00 -1.04 -0.96 -5.04 114.28 102.30 1ias n THR 362 Ca 0.00 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.65 1ias n THR 362 Cb 0.02 1.25 0.02 0.00 -1.82 0.00 0.00 70.33 69.80 1ias n THR 362 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1ias n ASP 363 N 0.00 -3.94 -4.17 8.00 2.03 0.15 -4.97 116.55 113.65 1ias n ASP 363 Ca 0.00 -1.13 -0.21 0.00 0.52 0.00 0.00 54.79 53.97 1ias n ASP 363 Cb 0.09 -2.68 -0.13 0.00 -0.72 0.00 0.00 41.12 37.68 1ias n ASP 363 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1ias s THR 364 N -3.60 1.24 0.57 5.18 -4.23 -0.89 -4.99 115.64 108.93 1ias s THR 364 Ca 0.40 -1.05 0.04 0.00 -1.18 0.00 0.00 61.69 59.90 1ias s THR 364 Cb -0.17 -1.11 0.06 0.00 1.34 0.00 0.00 72.50 72.62 1ias s THR 364 CO 0.91 0.05 0.79 -0.63 -0.54 0.00 0.00 174.62 175.20 1ias s ILE 365 N -0.84 2.49 0.00 2.99 1.01 -1.26 -1.54 121.20 124.06 1ias s ILE 365 Ca 0.03 -0.80 0.00 0.00 0.00 0.00 0.00 60.65 59.88 1ias s ILE 365 Cb -0.08 -2.70 0.00 0.00 0.01 0.00 0.00 42.46 39.69 1ias s ILE 365 CO 0.01 0.00 0.00 0.47 0.00 0.00 0.00 174.94 175.42 1ias n ASP 366 N -2.33 0.00 -4.56 3.58 10.43 -0.83 -4.73 116.55 118.11 1ias n ASP 366 Ca 0.11 0.01 -0.39 0.00 2.57 0.00 0.00 54.79 57.10 1ias n ASP 366 Cb 0.60 -0.06 -0.03 0.00 1.84 0.00 0.00 41.12 43.47 1ias n ASP 366 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1ias s ILE 367 N -0.12 3.36 0.00 0.53 1.01 -1.26 -4.87 121.20 119.86 1ias s ILE 367 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.89 1ias s ILE 367 Cb 0.00 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.58 1ias s ILE 367 CO 0.00 -0.83 0.58 0.00 0.00 0.00 0.00 174.94 174.69 1ias n ALA 368 N 12.55 -0.23 -2.83 9.38 0.00 -1.26 -4.48 120.51 133.65 1ias n ALA 368 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.22 1ias n ALA 368 Cb 0.52 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.92 1ias n ALA 368 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ias s PRO 369 N -1.81 3.15 0.14 0.00 0.04 -1.26 -5.02 135.00 130.24 1ias s PRO 369 Ca 0.00 -0.80 0.10 0.00 0.04 0.00 0.00 61.00 60.33 1ias s PRO 369 Cb 0.00 -4.16 -0.04 0.00 0.04 0.00 0.00 34.50 30.34 1ias s PRO 369 CO 0.00 -1.52 -0.19 0.54 0.04 0.00 0.00 177.00 175.87 1ias s ASN 370 N 3.18 3.78 0.00 6.66 2.20 -1.26 -5.13 114.94 124.37 1ias s ASN 370 Ca 0.20 -0.64 0.00 0.00 -0.94 0.00 0.00 52.86 51.49 1ias s ASN 370 Cb -0.18 -0.47 0.00 0.00 -2.00 0.00 0.00 41.25 38.60 1ias s ASN 370 CO 0.12 0.16 0.00 1.57 -2.94 0.00 0.00 177.10 176.01 1ias n HIS 371 N 0.64 0.00 -3.84 1.54 -0.00 -1.26 -5.06 115.22 107.24 1ias n HIS 371 Ca -0.15 0.00 -0.36 0.00 0.46 0.00 0.00 57.72 57.67 1ias n HIS 371 Cb 0.54 0.00 -0.13 0.00 -0.12 0.00 0.00 29.99 30.27 1ias n HIS 371 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1ias s ARG 372 N 3.10 3.47 0.41 1.57 0.52 -1.26 -5.09 118.95 121.67 1ias s ARG 372 Ca 0.00 -0.58 0.07 0.00 -0.52 0.00 0.00 55.73 54.70 1ias s ARG 372 Cb 0.00 -3.14 -0.08 0.00 0.52 0.00 0.00 34.95 32.25 1ias s ARG 372 CO 0.00 -0.20 0.02 0.14 0.02 0.00 0.00 175.30 175.27 1ias s VAL 373 N 1.53 1.99 0.00 3.52 -7.23 -1.26 -5.10 120.40 113.85 1ias s VAL 373 Ca 0.06 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.24 1ias s VAL 373 Cb -0.15 -2.98 0.00 0.00 0.56 0.00 0.00 36.38 33.81 1ias s VAL 373 CO -0.00 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 1ias n GLY 374 N -0.99 1.61 3.67 2.32 0.00 -1.26 -4.93 105.19 105.61 1ias n GLY 374 Ca -0.05 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.57 1ias n GLY 374 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ias s THR 375 N -2.27 3.19 0.14 2.61 2.01 -1.26 -4.92 115.64 115.14 1ias s THR 375 Ca 0.00 0.37 -0.27 0.00 0.31 0.00 0.00 61.69 62.10 1ias s THR 375 Cb 0.00 -3.24 -0.02 0.00 0.01 0.00 0.00 72.50 69.25 1ias s THR 375 CO 0.00 -0.02 1.59 0.11 -0.69 0.00 0.00 174.62 175.60 1ias h LYS 376 N 9.56 -0.39 -1.53 4.92 6.56 -1.92 -2.07 116.57 131.70 1ias h LYS 376 Ca -0.44 0.03 0.45 0.00 -1.06 0.00 0.00 60.65 59.62 1ias h LYS 376 Cb 1.21 0.09 -0.07 0.00 -0.57 0.00 0.00 32.23 32.89 1ias h LYS 376 CO 0.94 -0.26 1.09 -0.09 -2.06 0.00 0.00 179.45 179.07 1ias h ARG 377 N -0.41 0.02 -0.02 3.15 2.43 -1.91 0.20 114.38 117.84 1ias h ARG 377 Ca 0.11 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1ias h ARG 377 Cb 0.59 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1ias h ARG 377 CO -0.45 0.01 -0.01 0.66 -1.51 0.00 0.00 179.97 178.67 1ias n TYR 378 N -4.13 0.00 -1.72 2.20 4.02 -0.81 -4.95 117.16 111.77 1ias n TYR 378 Ca 0.34 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.81 1ias n TYR 378 Cb 1.58 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 40.88 1ias n TYR 378 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 176.86 174.52 1ias n MET 379 N 1.02 2.44 -1.37 -0.72 2.81 0.71 -4.50 117.12 117.51 1ias n MET 379 Ca 0.11 0.86 -0.30 0.00 -1.81 0.00 0.00 57.70 56.56 1ias n MET 379 Cb 0.46 -2.58 0.11 0.00 -0.71 0.00 0.00 33.22 30.50 1ias n MET 379 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1ias s ALA 380 N -0.36 1.99 0.11 3.04 0.00 -1.26 -4.80 121.76 120.48 1ias s ALA 380 Ca 0.62 -0.07 -0.26 0.00 0.00 0.00 0.00 51.96 52.26 1ias s ALA 380 Cb -0.54 -3.17 -0.08 0.00 0.00 0.00 0.00 23.12 19.33 1ias s ALA 380 CO 0.53 -1.95 1.66 -1.35 0.00 0.00 0.00 175.76 174.65 1ias h PRO 381 N -1.26 -0.36 -0.89 0.00 0.11 -1.93 -0.45 132.00 127.24 1ias h PRO 381 Ca -0.47 0.02 0.16 0.00 0.11 0.00 0.00 66.00 65.82 1ias h PRO 381 Cb 1.27 0.08 -0.07 0.00 0.11 0.00 0.00 31.00 32.39 1ias h PRO 381 CO 0.56 -0.24 0.58 0.93 -0.21 0.00 0.00 178.00 179.62 1ias h GLU 382 N -0.37 0.57 -0.20 1.05 3.07 -1.94 -1.01 114.58 115.76 1ias h GLU 382 Ca 0.04 -0.03 -0.12 0.00 -0.50 0.00 0.00 59.36 58.75 1ias h GLU 382 Cb 0.41 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 28.19 1ias h GLU 382 CO -0.14 0.38 -0.33 0.28 -1.40 0.00 0.00 179.01 177.81 1ias h VAL 383 N 0.59 1.33 0.23 3.13 2.07 -1.78 -0.51 116.25 121.32 1ias h VAL 383 Ca 0.46 -1.55 -0.01 0.00 0.82 0.00 0.00 66.70 66.42 1ias h VAL 383 Cb 0.87 1.84 0.00 0.00 -1.52 0.00 0.00 31.29 32.48 1ias h VAL 383 CO -0.20 0.48 -0.11 -0.07 0.02 0.00 0.00 177.57 177.68 1ias h LEU 384 N 0.25 -0.26 0.00 2.57 3.38 0.19 -2.79 115.31 118.65 1ias h LEU 384 Ca 0.02 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1ias h LEU 384 Cb 0.91 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1ias h LEU 384 CO 0.07 -0.09 0.00 -0.90 0.09 0.00 0.00 178.44 177.61 1ias n ASP 385 N -5.18 0.00 -0.77 -0.43 5.68 -0.77 -4.90 116.55 110.18 1ias n ASP 385 Ca -0.09 0.47 -0.07 0.00 -0.50 0.00 0.00 54.79 54.59 1ias n ASP 385 Cb 0.18 -0.49 -0.01 0.00 -1.14 0.00 0.00 41.12 39.66 1ias n ASP 385 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 1ias n ASP 386 N -1.49 -3.13 -0.44 -1.12 -0.08 -0.81 -4.92 116.55 104.57 1ias n ASP 386 Ca 0.07 0.05 0.13 0.00 -1.51 0.00 0.00 54.79 53.53 1ias n ASP 386 Cb 0.30 -2.08 0.40 0.00 2.34 0.00 0.00 41.12 42.08 1ias n ASP 386 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1ias n SER 387 N 0.64 1.50 -4.77 1.67 3.41 -0.26 -4.94 113.62 110.87 1ias n SER 387 Ca -0.08 -1.33 -0.40 0.00 -0.26 0.00 0.00 58.87 56.79 1ias n SER 387 Cb 0.46 0.08 -0.01 0.00 -0.26 0.00 0.00 64.21 64.48 1ias n SER 387 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 1ias s ILE 388 N -2.21 2.59 -0.66 -1.33 2.07 -0.86 -4.97 121.20 115.83 1ias s ILE 388 Ca 0.31 0.58 -0.17 0.00 -1.41 0.00 0.00 60.65 59.96 1ias s ILE 388 Cb 0.20 -3.37 0.14 0.00 0.13 0.00 0.00 42.46 39.56 1ias s ILE 388 CO 0.41 0.13 0.71 0.21 -1.91 0.00 0.00 174.94 174.50 1ias s ASN 389 N -0.47 6.35 0.00 4.50 3.04 -1.26 -4.91 114.94 122.18 1ias s ASN 389 Ca 0.51 -1.83 0.00 0.00 0.04 0.00 0.00 52.86 51.57 1ias s ASN 389 Cb -0.41 -2.27 0.00 0.00 -1.54 0.00 0.00 41.25 37.03 1ias s ASN 389 CO 0.54 -0.94 0.57 0.23 -3.04 0.00 0.00 177.10 174.46 1ias n MET 390 N 5.63 0.92 -0.05 0.43 2.81 -1.26 -2.43 117.12 123.16 1ias n MET 390 Ca -0.03 0.00 -0.00 0.00 -1.81 0.00 0.00 57.70 55.86 1ias n MET 390 Cb 0.43 -1.35 -0.15 0.00 -0.71 0.00 0.00 33.22 31.44 1ias n MET 390 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1ias n LYS 391 N 0.17 0.78 -3.57 0.03 4.81 -1.26 -4.83 118.16 114.29 1ias n LYS 391 Ca 0.00 -0.09 -0.40 0.00 -0.87 0.00 0.00 58.31 56.95 1ias n LYS 391 Cb 0.29 -1.48 -0.11 0.00 0.02 0.00 0.00 35.03 33.75 1ias n LYS 391 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 1ias s HIS 392 N -2.90 3.22 0.42 5.64 3.76 -1.02 -4.96 115.29 119.45 1ias s HIS 392 Ca -0.08 -0.47 0.19 0.00 -0.15 0.00 0.00 55.06 54.55 1ias s HIS 392 Cb 0.09 -2.45 1.12 0.00 1.11 0.00 0.00 32.58 32.45 1ias s HIS 392 CO 0.80 -0.45 1.82 0.35 -0.85 0.00 0.00 174.74 176.41 1ias h PHE 393 N 8.45 0.55 -0.83 1.40 3.57 -1.88 -0.35 116.94 127.85 1ias h PHE 393 Ca -0.30 0.02 0.18 0.00 3.53 0.00 0.00 57.97 61.40 1ias h PHE 393 Cb 1.14 -0.16 -0.06 0.00 2.79 0.00 0.00 35.95 39.66 1ias h PHE 393 CO 0.63 0.11 0.55 0.93 -2.23 0.00 0.00 178.31 178.30 1ias h GLU 394 N 0.38 0.36 -0.80 1.11 4.39 -1.93 -1.19 114.58 116.90 1ias h GLU 394 Ca 0.52 -0.02 0.15 0.00 0.34 0.00 0.00 59.36 60.35 1ias h GLU 394 Cb 1.36 -0.08 -0.10 0.00 -0.10 0.00 0.00 28.75 29.83 1ias h GLU 394 CO -0.21 0.24 0.36 0.77 -1.16 0.00 0.00 179.01 179.01 1ias h SER 395 N 0.37 0.38 -0.27 1.42 0.02 -1.31 -1.29 113.55 112.86 1ias h SER 395 Ca 0.42 0.11 -0.07 0.00 -0.84 0.00 0.00 61.79 61.40 1ias h SER 395 Cb 1.06 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.66 1ias h SER 395 CO -0.14 0.14 -0.11 -0.26 -1.14 0.00 0.00 176.83 175.33 1ias h PHE 396 N 0.51 0.63 -0.71 3.45 -1.00 -1.38 -2.11 116.94 116.32 1ias h PHE 396 Ca 0.44 -0.15 0.08 0.00 2.81 0.00 0.00 57.97 61.15 1ias h PHE 396 Cb 0.68 -0.15 -0.06 0.00 3.61 0.00 0.00 35.95 40.02 1ias h PHE 396 CO -0.14 0.78 0.38 0.87 -1.61 0.00 0.00 178.31 178.60 1ias h LYS 397 N 0.29 0.66 -0.50 1.51 1.57 -1.32 -1.74 116.57 117.04 1ias h LYS 397 Ca 0.06 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1ias h LYS 397 Cb 0.61 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 1ias h LYS 397 CO 0.03 0.43 0.24 0.00 -0.57 0.00 0.00 179.45 179.59 1ias h ARG 398 N 0.68 0.72 -0.42 3.15 3.08 -1.14 -2.07 114.38 118.38 1ias h ARG 398 Ca 0.33 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 60.27 1ias h ARG 398 Cb 0.27 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 1ias h ARG 398 CO -0.22 0.61 0.24 0.00 -1.07 0.00 0.00 179.97 179.53 1ias h ALA 399 N 1.08 1.63 -0.57 0.04 0.00 -0.82 -1.88 119.26 118.74 1ias h ALA 399 Ca 0.17 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1ias h ALA 399 Cb 0.13 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1ias h ALA 399 CO -0.02 0.32 0.30 -0.44 0.00 0.00 0.00 179.25 179.40 1ias h ASP 400 N 0.58 0.73 -0.35 0.00 3.32 -0.66 -2.77 116.42 117.27 1ias h ASP 400 Ca 0.15 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 1ias h ASP 400 Cb -0.00 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 1ias h ASP 400 CO -0.03 0.63 0.20 0.40 -1.72 0.00 0.00 179.24 178.73 1ias h ILE 401 N 0.77 1.13 -0.65 0.35 1.08 -0.83 0.07 117.51 119.43 1ias h ILE 401 Ca 0.20 -0.33 0.10 0.00 -0.39 0.00 0.00 64.86 64.44 1ias h ILE 401 Cb 0.08 0.71 -0.08 0.00 -3.07 0.00 0.00 36.82 34.46 1ias h ILE 401 CO -0.03 0.13 0.26 0.22 -0.69 0.00 0.00 178.15 178.05 1ias h TYR 402 N 0.45 0.46 -0.22 1.37 5.03 -1.27 0.76 116.97 123.55 1ias h TYR 402 Ca 0.13 0.03 -0.16 0.00 2.58 0.00 0.00 58.73 61.31 1ias h TYR 402 Cb 0.04 -0.11 -0.01 0.00 1.55 0.00 0.00 36.73 38.20 1ias h TYR 402 CO -0.03 0.12 -0.50 0.00 -1.32 0.00 0.00 178.16 176.43 1ias h ALA 403 N 1.44 0.71 0.00 1.82 0.00 -1.20 -2.38 119.26 119.65 1ias h ALA 403 Ca 0.33 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1ias h ALA 403 Cb 0.41 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1ias h ALA 403 CO -0.31 0.68 -0.11 1.98 0.00 0.00 0.00 179.25 181.48 1ias h MET 404 N 0.49 0.00 -0.18 0.00 1.85 0.25 -0.88 114.93 116.46 1ias h MET 404 Ca 0.02 0.00 -0.05 0.00 -0.61 0.00 0.00 59.70 59.06 1ias h MET 404 Cb 1.04 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 33.06 1ias h MET 404 CO 0.10 0.11 -0.09 0.78 -0.40 0.00 0.00 176.91 177.41 1ias h GLY 405 N 0.46 0.40 1.36 1.39 0.00 -0.41 -1.08 103.07 105.20 1ias h GLY 405 Ca -0.00 -0.37 0.05 0.00 0.00 0.00 0.00 47.33 47.01 1ias h GLY 405 CO 0.01 0.34 0.31 1.41 0.00 0.00 0.00 176.54 178.61 1ias h LEU 406 N 0.05 0.36 -0.14 3.11 3.38 -0.80 -1.02 115.31 120.25 1ias h LEU 406 Ca 0.04 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1ias h LEU 406 Cb 0.58 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 1ias h LEU 406 CO 0.03 0.24 -0.12 0.58 0.09 0.00 0.00 178.44 179.25 1ias h VAL 407 N 0.41 1.34 -0.72 1.22 2.07 -0.92 -2.13 116.25 117.52 1ias h VAL 407 Ca 0.20 -1.25 0.11 0.00 0.82 0.00 0.00 66.70 66.57 1ias h VAL 407 Cb 0.26 1.84 -0.05 0.00 -1.52 0.00 0.00 31.29 31.83 1ias h VAL 407 CO -0.05 0.37 0.48 -0.26 0.02 0.00 0.00 177.57 178.13 1ias h PHE 408 N -0.03 0.60 -0.05 1.57 0.05 -0.17 -0.36 116.94 118.56 1ias h PHE 408 Ca 0.03 0.02 -0.00 0.00 3.82 0.00 0.00 57.97 61.83 1ias h PHE 408 Cb 0.64 -0.19 -0.00 0.00 2.00 0.00 0.00 35.95 38.39 1ias h PHE 408 CO 0.08 0.27 0.03 2.35 -0.18 0.00 0.00 178.31 180.85 1ias h TRP 409 N 0.55 0.07 -0.31 -0.55 7.01 -0.87 -0.40 115.95 121.44 1ias h TRP 409 Ca 0.34 -0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.38 1ias h TRP 409 Cb 0.58 -0.02 -0.02 0.00 -2.10 0.00 0.00 29.16 27.60 1ias h TRP 409 CO -0.00 0.12 0.21 0.93 -2.79 0.00 0.00 178.44 176.91 1ias h GLU 410 N -0.01 0.22 0.29 2.65 5.08 -0.45 -2.25 114.58 120.11 1ias h GLU 410 Ca 0.02 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1ias h GLU 410 Cb 0.07 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1ias h GLU 410 CO -0.00 0.15 -0.14 0.82 -1.00 0.00 0.00 179.01 178.83 1ias h ILE 411 N 0.23 0.19 -0.83 3.13 2.04 -0.55 -3.32 117.51 118.40 1ias h ILE 411 Ca 0.14 -0.78 0.18 0.00 1.00 0.00 0.00 64.86 65.39 1ias h ILE 411 Cb 0.26 0.32 -0.06 0.00 -0.74 0.00 0.00 36.82 36.61 1ias h ILE 411 CO -0.03 0.05 0.56 0.00 0.00 0.00 0.00 178.15 178.73 1ias h ALA 412 N -0.94 2.19 -0.62 1.87 0.00 -0.99 0.15 119.26 120.92 1ias h ALA 412 Ca -0.04 0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.01 1ias h ALA 412 Cb 0.38 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1ias h ALA 412 CO 0.07 -0.44 0.42 -0.09 0.00 0.00 0.00 179.25 179.21 1ias h ARG 413 N 0.39 0.28 -0.66 0.00 2.43 -1.50 0.06 114.38 115.39 1ias h ARG 413 Ca 0.42 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.58 1ias h ARG 413 Cb 1.04 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1ias h ARG 413 CO -0.14 0.19 0.00 0.54 -1.51 0.00 0.00 179.97 179.04 1ias n ARG 414 N -4.45 3.53 -2.68 0.20 5.12 0.03 -1.96 116.66 116.46 1ias n ARG 414 Ca 0.11 -2.84 -0.42 0.00 -1.93 0.00 0.00 57.85 52.77 1ias n ARG 414 Cb 0.48 -1.82 -0.03 0.00 -1.16 0.00 0.00 32.46 29.93 1ias n ARG 414 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ias s SER 416 N 4.06 6.70 -0.32 0.00 0.15 -0.82 -4.76 113.70 118.71 1ias s SER 416 Ca 0.35 0.61 -0.03 0.00 0.70 0.00 0.00 55.95 57.58 1ias s SER 416 Cb -0.07 -2.48 0.05 0.00 -1.71 0.00 0.00 66.02 61.81 1ias s SER 416 CO 0.03 -0.91 0.04 -0.63 1.20 0.00 0.00 173.24 172.97 1ias s ILE 417 N 3.62 3.17 -0.79 6.45 1.01 -1.05 -4.66 121.20 128.95 1ias s ILE 417 Ca 0.40 -1.40 -0.02 0.00 0.00 0.00 0.00 60.65 59.63 1ias s ILE 417 Cb -0.11 -2.85 -0.02 0.00 0.01 0.00 0.00 42.46 39.49 1ias s ILE 417 CO 0.20 -0.18 0.67 0.61 0.00 0.00 0.00 174.94 176.24 1ias n GLY 418 N 4.65 -0.28 4.62 6.18 0.00 -1.26 -3.15 105.19 115.95 1ias n GLY 418 Ca -0.12 0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1ias n GLY 418 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ias n GLY 419 N -1.18 0.65 3.67 -0.02 0.00 -1.26 -4.93 105.19 102.11 1ias n GLY 419 Ca -0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.49 1ias n GLY 419 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ias s ILE 420 N -1.16 5.08 -0.12 -0.61 -4.36 -1.19 -5.03 121.20 113.82 1ias s ILE 420 Ca 0.00 1.04 -0.30 0.00 -0.26 0.00 0.00 60.65 61.13 1ias s ILE 420 Cb 0.00 -3.88 0.12 0.00 1.25 0.00 0.00 42.46 39.95 1ias s ILE 420 CO 0.00 0.17 0.97 -1.38 0.24 0.00 0.00 174.94 174.94 1ias s HIS 421 N 1.62 -0.36 0.63 1.37 -3.43 -1.26 -2.53 115.29 111.33 1ias s HIS 421 Ca 0.26 0.51 -0.06 0.00 -0.80 0.00 0.00 55.06 54.96 1ias s HIS 421 Cb -0.16 0.48 0.03 0.00 -1.43 0.00 0.00 32.58 31.50 1ias s HIS 421 CO 0.10 -0.40 0.95 -1.21 -2.00 0.00 0.00 174.74 172.18 1ias s GLU 422 N -1.71 2.65 0.39 -0.38 8.01 -0.83 -5.05 118.70 121.77 1ias s GLU 422 Ca 0.00 -0.10 -0.19 0.00 0.01 0.00 0.00 54.97 54.69 1ias s GLU 422 Cb -0.01 -2.23 -0.10 0.00 -4.31 0.00 0.00 34.13 27.48 1ias s GLU 422 CO -0.01 -0.91 0.88 -0.51 0.01 0.00 0.00 175.26 174.72 1ias s ASP 423 N -4.39 6.91 0.31 -0.19 1.01 -1.26 -4.58 116.67 114.48 1ias s ASP 423 Ca 0.56 1.57 -0.29 0.00 0.71 0.00 0.00 52.55 55.10 1ias s ASP 423 Cb -0.11 -2.49 -0.12 0.00 1.01 0.00 0.00 42.92 41.21 1ias s ASP 423 CO 0.45 -0.29 1.38 0.00 0.21 0.00 0.00 175.17 176.92 1ias n TYR 424 N -0.47 2.39 -3.71 4.23 9.36 -1.26 -4.95 117.16 122.75 1ias n TYR 424 Ca 0.05 0.47 -0.13 0.00 3.32 0.00 0.00 57.90 61.61 1ias n TYR 424 Cb 0.53 -2.46 -0.09 0.00 -0.63 0.00 0.00 39.34 36.69 1ias n TYR 424 CO 0.00 0.00 0.00 -0.65 0.22 0.00 0.00 176.86 176.43 1ias s GLN 425 N -1.28 0.55 0.61 2.98 -1.52 -1.26 -5.08 119.66 114.65 1ias s GLN 425 Ca 0.60 0.66 -0.14 0.00 -1.95 0.00 0.00 55.36 54.53 1ias s GLN 425 Cb -0.57 0.26 -0.03 0.00 -0.22 0.00 0.00 33.01 32.44 1ias s GLN 425 CO 0.57 -0.07 1.05 -0.51 -0.25 0.00 0.00 175.29 176.07 1ias s LEU 426 N 0.30 3.41 0.52 2.90 1.43 -1.26 -4.76 118.68 121.22 1ias s LEU 426 Ca -0.00 1.71 -0.23 0.00 -1.03 0.00 0.00 54.13 54.58 1ias s LEU 426 Cb -0.03 -4.52 -0.06 0.00 0.03 0.00 0.00 46.19 41.61 1ias s LEU 426 CO -0.00 -1.14 1.39 -2.84 0.23 0.00 0.00 176.35 173.98 1ias s PRO 427 N -4.38 3.26 -1.58 1.29 0.02 -1.26 -2.27 135.00 130.09 1ias s PRO 427 Ca 0.61 2.31 -0.01 0.00 0.02 0.00 0.00 61.00 63.92 1ias s PRO 427 Cb -0.14 -2.36 0.00 0.00 0.02 0.00 0.00 34.50 32.02 1ias s PRO 427 CO 0.42 -1.12 0.16 0.66 -0.33 0.00 0.00 177.00 176.79 1ias n TYR 428 N -0.83 -1.33 0.27 6.54 0.53 -1.26 -4.86 117.16 116.23 1ias n TYR 428 Ca 0.09 0.14 0.16 0.00 -1.02 0.00 0.00 57.90 57.27 1ias n TYR 428 Cb 0.44 -3.82 0.70 0.00 -1.03 0.00 0.00 39.34 35.63 1ias n TYR 428 CO 0.00 0.00 0.00 0.10 -1.02 0.00 0.00 176.86 175.94 1ias h TYR 429 N -0.35 0.00 -0.01 -0.72 -0.00 -1.74 -2.98 116.97 111.18 1ias h TYR 429 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.27 1ias h TYR 429 Cb 1.34 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.07 1ias h TYR 429 CO 0.59 0.05 -0.58 -0.40 -0.00 0.00 0.00 178.16 177.82 1ias n ASP 430 N -3.19 1.30 -0.38 0.10 5.68 -1.26 -4.47 116.55 114.33 1ias n ASP 430 Ca -0.00 -1.15 0.05 0.00 -0.50 0.00 0.00 54.79 53.19 1ias n ASP 430 Cb 0.30 0.72 0.04 0.00 -1.14 0.00 0.00 41.12 41.04 1ias n ASP 430 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1ias n LEU 431 N -0.71 1.77 -3.59 -2.12 4.77 -1.15 -5.03 117.00 110.95 1ias n LEU 431 Ca 0.05 -0.98 -0.15 0.00 -0.03 0.00 0.00 56.01 54.91 1ias n LEU 431 Cb 0.32 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.35 1ias n LEU 431 CO 0.28 0.34 0.47 0.54 -1.33 0.00 0.00 177.39 177.69 1ias s VAL 432 N -0.88 0.00 0.89 4.08 0.11 -1.14 -4.97 120.40 118.50 1ias s VAL 432 Ca 0.11 0.00 -0.11 0.00 -2.93 0.00 0.00 61.98 59.06 1ias s VAL 432 Cb 0.08 -1.00 0.13 0.00 -1.53 0.00 0.00 36.38 34.07 1ias s VAL 432 CO 0.14 0.00 1.16 -2.84 -3.33 0.00 0.00 175.10 170.22 1ias s PRO 433 N -0.26 1.14 0.32 1.54 0.02 -1.26 -4.71 135.00 131.78 1ias s PRO 433 Ca -0.04 1.59 -0.29 0.00 0.02 0.00 0.00 61.00 62.28 1ias s PRO 433 Cb -0.03 -1.74 -0.11 0.00 0.02 0.00 0.00 34.50 32.64 1ias s PRO 433 CO 0.04 -2.55 1.57 -1.12 -0.33 0.00 0.00 177.00 174.61 1ias s SER 434 N -2.59 6.34 -0.74 2.53 0.01 -1.26 -2.65 113.70 115.35 1ias s SER 434 Ca 0.68 3.00 -0.04 0.00 1.31 0.00 0.00 55.95 60.90 1ias s SER 434 Cb -0.24 -2.65 -0.04 0.00 0.21 0.00 0.00 66.02 63.30 1ias s SER 434 CO 0.57 -0.92 0.66 -0.67 0.41 0.00 0.00 173.24 173.28 1ias n ASP 435 N 1.63 -5.66 -4.73 2.44 -0.08 -1.26 -4.95 116.55 103.94 1ias n ASP 435 Ca 0.06 -0.44 -0.36 0.00 -1.51 0.00 0.00 54.79 52.54 1ias n ASP 435 Cb 0.38 -4.07 0.07 0.00 2.34 0.00 0.00 41.12 39.83 1ias n ASP 435 CO 0.00 0.00 0.00 -2.84 0.12 0.00 0.00 177.20 174.48 1ias s PRO 436 N -3.83 2.51 0.38 -0.67 0.02 -1.08 -5.02 135.00 127.31 1ias s PRO 436 Ca 0.28 2.01 -0.01 0.00 0.02 0.00 0.00 61.00 63.30 1ias s PRO 436 Cb -0.04 -1.85 -0.03 0.00 0.02 0.00 0.00 34.50 32.61 1ias s PRO 436 CO 0.56 -1.61 0.61 -1.54 -0.33 0.00 0.00 177.00 174.68 1ias s SER 437 N -1.49 6.24 0.40 2.53 1.04 -1.26 -4.78 113.70 116.39 1ias s SER 437 Ca 0.81 0.53 0.09 0.00 0.48 0.00 0.00 55.95 57.86 1ias s SER 437 Cb -0.36 -2.03 0.88 0.00 0.10 0.00 0.00 66.02 64.61 1ias s SER 437 CO 0.40 -0.39 1.99 0.58 0.98 0.00 0.00 173.24 176.80 1ias h VAL 438 N 0.61 1.00 -0.05 5.02 2.07 -1.96 -1.95 116.25 120.98 1ias h VAL 438 Ca -0.49 -0.20 -0.11 0.00 0.82 0.00 0.00 66.70 66.72 1ias h VAL 438 Cb 1.22 0.37 0.01 0.00 -1.52 0.00 0.00 31.29 31.36 1ias h VAL 438 CO 0.61 0.11 -0.40 -0.08 0.02 0.00 0.00 177.57 177.82 1ias h GLU 439 N 0.58 0.37 -0.71 1.57 4.81 -1.95 -1.89 114.58 117.35 1ias h GLU 439 Ca 0.26 -0.32 0.06 0.00 -0.13 0.00 0.00 59.36 59.22 1ias h GLU 439 Cb 0.28 0.07 -0.06 0.00 0.63 0.00 0.00 28.75 29.68 1ias h GLU 439 CO -0.08 0.98 0.41 0.93 -0.73 0.00 0.00 179.01 180.52 1ias h GLU 440 N -0.13 0.73 -0.22 1.92 5.08 -1.84 -2.25 114.58 117.87 1ias h GLU 440 Ca -0.03 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 1ias h GLU 440 Cb 1.08 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.15 1ias h GLU 440 CO 0.08 0.48 -0.05 0.52 -1.00 0.00 0.00 179.01 179.05 1ias h MET 441 N 0.75 0.43 -0.86 2.33 2.86 -1.42 -3.18 114.93 115.86 1ias h MET 441 Ca 0.32 -0.16 0.08 0.00 -2.06 0.00 0.00 59.70 57.88 1ias h MET 441 Cb 0.18 -0.03 -0.06 0.00 0.06 0.00 0.00 31.60 31.75 1ias h MET 441 CO -0.18 0.66 0.56 -0.09 1.06 0.00 0.00 176.91 178.92 1ias h ARG 442 N 0.16 0.86 -0.22 1.72 2.43 -0.96 -0.05 114.38 118.32 1ias h ARG 442 Ca 0.06 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 1ias h ARG 442 Cb 0.50 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 1ias h ARG 442 CO 0.02 0.57 0.02 -0.22 -1.51 0.00 0.00 179.97 178.85 1ias h LYS 443 N 0.88 0.37 -0.21 0.20 3.64 -1.42 0.21 116.57 120.24 1ias h LYS 443 Ca 0.38 -0.11 -0.20 0.00 -1.27 0.00 0.00 60.65 59.46 1ias h LYS 443 Cb 0.33 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1ias h LYS 443 CO -0.15 0.54 -0.65 0.28 -2.27 0.00 0.00 179.45 177.19 1ias h VAL 444 N 0.16 1.29 0.00 2.00 2.07 -1.45 0.25 116.25 120.57 1ias h VAL 444 Ca 0.06 -1.86 -0.14 0.00 0.82 0.00 0.00 66.70 65.59 1ias h VAL 444 Cb 0.35 1.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.92 1ias h VAL 444 CO 0.01 0.59 -0.75 0.58 0.02 0.00 0.00 177.57 178.02 1ias h VAL 445 N 0.57 1.22 0.05 2.57 2.07 -1.06 0.69 116.25 122.36 1ias h VAL 445 Ca -0.02 -2.20 -0.00 0.00 0.82 0.00 0.00 66.70 65.30 1ias h VAL 445 Cb 1.26 2.59 0.00 0.00 -1.52 0.00 0.00 31.29 33.62 1ias h VAL 445 CO 0.14 0.41 -0.02 0.00 0.02 0.00 0.00 177.57 178.11 1ias n GLU 447 N -4.81 0.00 0.00 0.00 1.02 -0.99 -3.59 120.64 112.27 1ias n GLU 447 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1ias n GLU 447 Cb 0.07 -0.69 0.00 0.00 -0.02 0.00 0.00 31.44 30.80 1ias n GLU 447 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1ias n GLN 448 N -0.37 0.00 -4.12 3.49 6.02 0.85 -4.78 117.38 118.47 1ias n GLN 448 Ca 0.00 0.21 -0.29 0.00 -0.01 0.00 0.00 57.00 56.91 1ias n GLN 448 Cb 0.00 -1.65 -0.05 0.00 1.02 0.00 0.00 30.24 29.56 1ias n GLN 448 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1ias n LYS 449 N -1.15 -2.36 -3.92 -1.09 5.02 -1.19 -4.95 118.16 108.52 1ias n LYS 449 Ca 0.00 0.28 -0.29 0.00 -2.02 0.00 0.00 58.31 56.28 1ias n LYS 449 Cb 0.15 -4.24 -0.04 0.00 -0.02 0.00 0.00 35.03 30.89 1ias n LYS 449 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ias s LEU 450 N -7.15 4.35 0.17 -0.35 1.43 0.23 -5.01 118.68 112.34 1ias s LEU 450 Ca 0.08 0.24 0.01 0.00 -1.03 0.00 0.00 54.13 53.43 1ias s LEU 450 Cb -0.05 -2.95 -0.04 0.00 0.03 0.00 0.00 46.19 43.18 1ias s LEU 450 CO 0.94 0.11 0.02 -0.13 0.23 0.00 0.00 176.35 177.51 1ias s ARG 451 N -2.85 1.08 0.54 1.70 3.00 -1.26 -4.47 118.95 116.68 1ias s ARG 451 Ca 0.35 -1.52 -0.21 0.00 0.00 0.00 0.00 55.73 54.35 1ias s ARG 451 Cb -0.12 -0.15 -0.06 0.00 0.00 0.00 0.00 34.95 34.62 1ias s ARG 451 CO 0.28 -0.17 1.11 -2.30 0.00 0.00 0.00 175.30 174.23 1ias n PRO 452 N -0.22 1.29 -2.37 3.54 -0.02 -1.26 -4.87 135.00 131.09 1ias n PRO 452 Ca -0.06 0.48 -0.43 0.00 -2.02 0.00 0.00 63.50 61.47 1ias n PRO 452 Cb 0.63 -2.28 -0.02 0.00 -0.02 0.00 0.00 33.50 31.81 1ias n PRO 452 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1ias s ASN 453 N -1.00 6.91 -0.73 2.55 2.47 -1.26 -4.97 114.94 118.91 1ias s ASN 453 Ca 0.71 1.77 -0.23 0.00 0.42 0.00 0.00 52.86 55.53 1ias s ASN 453 Cb -0.45 -2.54 0.07 0.00 -1.45 0.00 0.00 41.25 36.88 1ias s ASN 453 CO 0.50 -0.78 1.07 -0.63 -3.72 0.00 0.00 177.10 173.54 1ias s ILE 454 N 3.53 4.25 0.43 -5.21 1.01 -1.26 -5.01 121.20 118.94 1ias s ILE 454 Ca 0.57 -0.40 -0.17 0.00 0.00 0.00 0.00 60.65 60.65 1ias s ILE 454 Cb -0.23 -4.76 -0.14 0.00 0.01 0.00 0.00 42.46 37.34 1ias s ILE 454 CO 0.17 -1.56 -0.06 -2.65 0.00 0.00 0.00 174.94 170.84 1ias n PRO 455 N 7.92 0.00 -0.05 2.79 -0.02 -1.26 -4.91 135.00 139.47 1ias n PRO 455 Ca 0.03 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.38 1ias n PRO 455 Cb 0.47 -0.90 -0.07 0.00 -0.02 0.00 0.00 33.50 32.97 1ias n PRO 455 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 1ias h ASN 456 N 0.07 0.33 -0.35 2.55 -1.24 -2.05 -3.13 115.58 111.77 1ias h ASN 456 Ca -0.36 -0.46 0.10 0.00 0.71 0.00 0.00 56.30 56.29 1ias h ASN 456 Cb 1.31 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 40.25 1ias h ASN 456 CO 0.39 0.73 0.36 0.08 -1.29 0.00 0.00 177.43 177.70 1ias h ARG 457 N -0.05 0.00 0.00 6.67 0.11 -2.04 -2.33 114.38 116.73 1ias h ARG 457 Ca 0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.10 1ias h ARG 457 Cb 0.62 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.70 1ias h ARG 457 CO 0.03 0.00 0.00 0.91 0.10 0.00 0.00 179.97 181.01 1ias n TRP 458 N -3.81 0.00 1.05 4.08 7.02 -1.18 0.92 117.44 125.52 1ias n TRP 458 Ca 0.06 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.65 1ias n TRP 458 Cb 0.53 0.00 0.09 0.00 -2.42 0.00 0.00 31.31 29.51 1ias n TRP 458 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 1ias n GLN 459 N -0.76 0.49 0.00 -0.99 1.13 -0.88 -2.85 117.38 113.52 1ias n GLN 459 Ca 0.00 -0.36 0.00 0.00 -1.94 0.00 0.00 57.00 54.70 1ias n GLN 459 Cb 0.00 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 28.86 1ias n GLN 459 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1ias n SER 460 N -0.94 0.00 -4.90 1.08 7.64 0.26 -4.79 113.62 111.98 1ias n SER 460 Ca 0.07 0.64 -0.20 0.00 1.01 0.00 0.00 58.87 60.39 1ias n SER 460 Cb 0.37 -0.14 -0.02 0.00 -1.01 0.00 0.00 64.21 63.40 1ias n SER 460 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ias h GLU 462 N 1.02 -0.52 -0.22 0.00 4.57 -1.93 -2.47 114.58 115.04 1ias h GLU 462 Ca -0.42 0.04 0.03 0.00 -1.18 0.00 0.00 59.36 57.82 1ias h GLU 462 Cb 1.26 0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 29.91 1ias h GLU 462 CO 0.55 -0.35 -0.45 0.00 -1.18 0.00 0.00 179.01 177.58 1ias h ALA 463 N 0.10 -0.76 -0.91 2.92 0.00 -1.96 0.61 119.26 119.25 1ias h ALA 463 Ca 0.04 -0.03 0.22 0.00 0.00 0.00 0.00 54.91 55.15 1ias h ALA 463 Cb 0.60 0.99 -0.06 0.00 0.00 0.00 0.00 17.79 19.32 1ias h ALA 463 CO -0.25 -0.95 0.61 -0.07 0.00 0.00 0.00 179.25 178.60 1ias h LEU 464 N -0.41 0.29 0.05 0.00 -0.00 -1.77 -1.16 115.31 112.31 1ias h LEU 464 Ca 0.04 0.03 -0.00 0.00 -0.00 0.00 0.00 57.88 57.95 1ias h LEU 464 Cb 0.53 -0.02 0.00 0.00 -0.00 0.00 0.00 40.66 41.17 1ias h LEU 464 CO -0.42 0.11 -0.02 0.03 -0.00 0.00 0.00 178.44 178.13 1ias h ARG 465 N 0.29 -0.06 -0.58 1.13 3.08 -0.66 -1.63 114.38 115.95 1ias h ARG 465 Ca 0.47 0.00 0.12 0.00 0.07 0.00 0.00 59.98 60.64 1ias h ARG 465 Cb 1.35 0.01 -0.10 0.00 0.08 0.00 0.00 29.97 31.32 1ias h ARG 465 CO -0.14 0.48 -0.01 0.28 -1.07 0.00 0.00 179.97 179.51 1ias h VAL 466 N -0.66 0.52 0.20 2.04 2.07 -0.00 0.26 116.25 120.68 1ias h VAL 466 Ca -0.01 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1ias h VAL 466 Cb 0.57 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1ias h VAL 466 CO 0.01 0.02 -0.13 0.24 0.02 0.00 0.00 177.57 177.74 1ias h MET 467 N 0.11 -0.31 -0.88 1.57 2.86 -1.28 -1.54 114.93 115.47 1ias h MET 467 Ca 0.30 0.02 0.08 0.00 -2.06 0.00 0.00 59.70 58.04 1ias h MET 467 Cb 0.47 0.07 -0.06 0.00 0.06 0.00 0.00 31.60 32.14 1ias h MET 467 CO -0.50 -0.20 0.57 0.00 1.06 0.00 0.00 176.91 177.84 1ias h ALA 468 N 0.47 1.60 0.61 6.32 0.00 -0.33 -0.78 119.26 127.15 1ias h ALA 468 Ca -0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1ias h ALA 468 Cb 0.27 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1ias h ALA 468 CO 0.02 0.24 -0.45 -0.22 0.00 0.00 0.00 179.25 178.84 1ias h LYS 469 N 0.92 -0.99 -0.17 0.00 1.63 -0.11 -2.61 116.57 115.24 1ias h LYS 469 Ca 0.39 0.07 0.05 0.00 -0.85 0.00 0.00 60.65 60.31 1ias h LYS 469 Cb 0.31 0.22 -0.07 0.00 -0.60 0.00 0.00 32.23 32.10 1ias h LYS 469 CO -0.16 -0.66 -0.29 0.82 -3.45 0.00 0.00 179.45 175.72 1ias h ILE 470 N -1.03 0.33 -0.96 2.00 2.04 -0.66 -1.86 117.51 117.38 1ias h ILE 470 Ca -0.07 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.05 1ias h ILE 470 Cb 0.86 0.33 -0.14 0.00 -0.74 0.00 0.00 36.82 37.13 1ias h ILE 470 CO 0.02 0.00 0.48 0.24 0.00 0.00 0.00 178.15 178.89 1ias h MET 471 N -0.34 0.37 -0.19 2.37 2.86 -1.08 0.94 114.93 119.87 1ias h MET 471 Ca 0.11 -0.02 -0.10 0.00 -2.06 0.00 0.00 59.70 57.63 1ias h MET 471 Cb 0.51 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.08 1ias h MET 471 CO -0.36 0.25 -0.26 0.00 1.06 0.00 0.00 176.91 177.60 1ias h ARG 472 N 0.38 0.51 -0.02 1.72 3.08 -0.98 -1.69 114.38 117.39 1ias h ARG 472 Ca 0.64 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 60.40 1ias h ARG 472 Cb 1.33 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.40 1ias h ARG 472 CO -0.57 0.89 0.00 0.39 -1.07 0.00 0.00 179.97 179.61 1ias n GLU 473 N -4.39 0.72 -0.02 0.04 1.02 0.18 -2.05 120.64 116.14 1ias n GLU 473 Ca -0.06 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.06 1ias n GLU 473 Cb 0.44 -1.01 -0.04 0.00 -0.02 0.00 0.00 31.44 30.82 1ias n GLU 473 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ias n TRP 475 N -2.19 0.05 -1.51 0.00 8.01 -0.66 -3.99 117.44 117.14 1ias n TRP 475 Ca -0.07 -0.02 -0.44 0.00 -1.31 0.00 0.00 57.50 55.65 1ias n TRP 475 Cb 0.64 0.00 -0.01 0.00 -2.01 0.00 0.00 31.31 29.94 1ias n TRP 475 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1ias n TYR 476 N -0.12 0.32 0.00 -5.99 0.53 -1.20 -4.86 117.16 105.85 1ias n TYR 476 Ca 0.19 0.71 -0.05 0.00 -1.02 0.00 0.00 57.90 57.72 1ias n TYR 476 Cb 0.27 -2.10 0.16 0.00 -1.03 0.00 0.00 39.34 36.64 1ias n TYR 476 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1ias h ALA 477 N 1.36 0.99 -2.27 -0.72 0.00 -1.95 -3.40 119.26 113.27 1ias h ALA 477 Ca -0.38 -0.39 -0.62 0.00 0.00 0.00 0.00 54.91 53.52 1ias h ALA 477 Cb 1.38 -0.12 -0.12 0.00 0.00 0.00 0.00 17.79 18.93 1ias h ALA 477 CO 0.56 0.60 0.24 1.21 0.00 0.00 0.00 179.25 181.86 1ias s ASN 478 N -6.82 6.49 0.17 0.00 3.84 -1.26 -4.67 114.94 112.69 1ias s ASN 478 Ca -0.07 0.27 -0.14 0.00 0.21 0.00 0.00 52.86 53.13 1ias s ASN 478 Cb 0.13 -2.35 0.12 0.00 -0.55 0.00 0.00 41.25 38.60 1ias s ASN 478 CO 0.81 -0.63 1.76 1.23 -2.79 0.00 0.00 177.10 177.47 1ias h GLY 479 N 9.48 0.59 1.81 1.21 0.00 -1.97 -1.91 103.07 112.28 1ias h GLY 479 Ca -0.26 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1ias h GLY 479 CO 0.86 0.04 0.06 0.00 0.00 0.00 0.00 176.54 177.50 1ias n ALA 480 N -2.37 0.93 0.12 3.60 0.00 -1.26 -0.94 120.51 120.59 1ias n ALA 480 Ca 0.03 0.13 0.09 0.00 0.00 0.00 0.00 53.44 53.70 1ias n ALA 480 Cb 0.16 -1.11 0.02 0.00 0.00 0.00 0.00 19.45 18.52 1ias n ALA 480 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ias h ALA 481 N 1.81 0.64 -2.35 0.00 0.00 -1.74 -3.48 119.26 114.14 1ias h ALA 481 Ca 0.00 -0.19 -0.51 0.00 0.00 0.00 0.00 54.91 54.21 1ias h ALA 481 Cb 0.13 0.04 0.13 0.00 0.00 0.00 0.00 17.79 18.09 1ias h ALA 481 CO 0.00 0.22 0.33 1.03 0.00 0.00 0.00 179.25 180.82 1ias s ARG 482 N -3.22 2.30 0.83 0.00 0.52 -0.11 -4.98 118.95 114.28 1ias s ARG 482 Ca 0.01 1.25 -0.11 0.00 -0.52 0.00 0.00 55.73 56.36 1ias s ARG 482 Cb 0.08 -1.90 0.09 0.00 0.52 0.00 0.00 34.95 33.74 1ias s ARG 482 CO 0.77 -1.62 1.09 -0.51 0.02 0.00 0.00 175.30 175.05 1ias s LEU 483 N -5.72 2.71 0.24 2.53 1.43 -0.26 -5.03 118.68 114.58 1ias s LEU 483 Ca 0.63 1.70 0.05 0.00 -1.03 0.00 0.00 54.13 55.48 1ias s LEU 483 Cb -0.18 -4.28 -0.03 0.00 0.03 0.00 0.00 46.19 41.73 1ias s LEU 483 CO 0.53 -2.32 0.33 0.42 0.23 0.00 0.00 176.35 175.54 1ias s THR 484 N -2.90 5.13 0.15 5.49 -4.23 -1.26 -4.94 115.64 113.07 1ias s THR 484 Ca 0.62 -1.06 -0.17 0.00 -1.18 0.00 0.00 61.69 59.91 1ias s THR 484 Cb -0.18 -3.79 0.00 0.00 1.34 0.00 0.00 72.50 69.88 1ias s THR 484 CO 0.57 -0.33 1.77 0.00 -0.54 0.00 0.00 174.62 176.08 1ias h ALA 485 N 1.22 0.41 -0.63 3.99 0.00 -1.93 -0.76 119.26 121.57 1ias h ALA 485 Ca -0.51 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1ias h ALA 485 Cb 1.23 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1ias h ALA 485 CO 0.61 -0.22 0.40 1.25 0.00 0.00 0.00 179.25 181.29 1ias h LEU 486 N 0.33 0.72 0.66 0.00 6.46 -1.89 0.50 115.31 122.09 1ias h LEU 486 Ca 0.14 -0.02 -0.03 0.00 -0.12 0.00 0.00 57.88 57.85 1ias h LEU 486 Cb 0.07 -0.18 0.01 0.00 -0.73 0.00 0.00 40.66 39.83 1ias h LEU 486 CO -0.11 0.53 -0.32 -0.09 -0.62 0.00 0.00 178.44 177.84 1ias h ARG 487 N 0.85 -0.85 -1.00 1.25 9.65 -1.71 -0.41 114.38 122.16 1ias h ARG 487 Ca 0.23 0.06 0.05 0.00 -1.10 0.00 0.00 59.98 59.21 1ias h ARG 487 Cb -0.08 0.19 -0.06 0.00 -1.39 0.00 0.00 29.97 28.63 1ias h ARG 487 CO -0.05 -0.55 0.65 0.82 2.80 0.00 0.00 179.97 183.65 1ias h ILE 488 N -0.94 1.14 -0.84 1.20 2.04 -0.77 -0.99 117.51 118.35 1ias h ILE 488 Ca -0.09 -0.43 0.02 0.00 1.00 0.00 0.00 64.86 65.36 1ias h ILE 488 Cb 0.70 -0.20 -0.05 0.00 -0.74 0.00 0.00 36.82 36.53 1ias h ILE 488 CO 0.15 0.23 0.55 0.50 0.00 0.00 0.00 178.15 179.58 1ias h LYS 489 N 1.24 1.07 0.45 2.37 3.64 -0.68 0.20 116.57 124.86 1ias h LYS 489 Ca 0.41 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.70 1ias h LYS 489 Cb 0.06 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 1ias h LYS 489 CO -0.14 0.71 -0.22 -0.22 -2.27 0.00 0.00 179.45 177.31 1ias h LYS 490 N 1.10 -0.58 0.00 1.90 3.64 0.18 0.07 116.57 122.89 1ias h LYS 490 Ca 0.32 0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.68 1ias h LYS 490 Cb -0.07 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1ias h LYS 490 CO -0.09 -0.28 -0.29 1.79 -2.27 0.00 0.00 179.45 178.31 1ias h THR 491 N -0.88 1.16 0.00 1.00 1.35 -1.24 -0.98 112.91 113.32 1ias h THR 491 Ca -0.06 -0.99 -0.16 0.00 -0.55 0.00 0.00 66.41 64.64 1ias h THR 491 Cb 0.57 1.54 -0.02 0.00 -1.73 0.00 0.00 68.15 68.51 1ias h THR 491 CO 0.10 0.28 -0.78 0.25 -0.25 0.00 0.00 175.52 175.12 1ias h LEU 492 N 0.00 0.00 -0.74 3.87 5.85 -0.96 -2.31 115.31 121.01 1ias h LEU 492 Ca -0.00 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.58 1ias h LEU 492 Cb 0.52 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1ias h LEU 492 CO 0.04 0.78 -0.62 -1.28 -0.34 0.00 0.00 178.44 177.02 1ias h SER 493 N 0.00 0.05 0.28 1.25 0.87 -0.28 -2.20 113.55 113.51 1ias h SER 493 Ca -0.01 -0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.51 1ias h SER 493 Cb 1.54 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.49 1ias h SER 493 CO 0.10 0.66 -0.13 -0.61 -0.53 0.00 0.00 176.83 176.31 1ias h GLN 494 N 0.03 -0.36 -0.83 2.24 5.75 -1.00 -2.31 115.11 118.63 1ias h GLN 494 Ca -0.01 0.02 0.13 0.00 -0.15 0.00 0.00 58.65 58.65 1ias h GLN 494 Cb 1.10 0.08 -0.09 0.00 1.07 0.00 0.00 27.48 29.65 1ias h GLN 494 CO 0.08 -0.01 0.43 1.25 -2.65 0.00 0.00 178.83 177.93 1ias h LEU 495 N -0.84 0.55 -1.39 -2.39 5.85 -1.40 0.44 115.31 116.12 1ias h LEU 495 Ca -0.04 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1ias h LEU 495 Cb 0.51 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.53 1ias h LEU 495 CO 0.06 0.26 0.00 -1.28 -0.34 0.00 0.00 178.44 177.14 1ias h SER 496 N 0.65 0.00 1.02 1.25 0.87 -1.41 -1.90 113.55 114.03 1ias h SER 496 Ca 0.44 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.81 1ias h SER 496 Cb 0.56 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.49 1ias h SER 496 CO -0.33 0.00 -1.03 -0.61 -0.53 0.00 0.00 176.83 174.32 1ias h GLN 497 N 0.00 0.00 -0.99 2.24 4.15 0.42 -3.26 115.11 117.66 1ias h GLN 497 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1ias h GLN 497 Cb 0.41 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.10 1ias h GLN 497 CO 0.00 0.64 0.00 1.04 -1.93 0.00 0.00 178.83 178.58 1ias n GLN 498 N -3.18 0.95 0.00 1.69 6.02 -0.45 -3.11 117.38 119.30 1ias n GLN 498 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 1ias n GLN 498 Cb 0.88 -1.29 0.00 0.00 1.02 0.00 0.00 30.24 30.85 1ias n GLN 498 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1ias n GLU 499 N 0.23 0.00 -0.13 -1.09 1.02 -1.24 -5.08 120.64 114.36 1ias n GLU 499 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1ias n GLU 499 Cb 0.34 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.76 1ias n GLU 499 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72