#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wny s PRO 203 N 0.00 3.95 0.64 -0.67 0.04 -1.26 -5.01 135.00 132.68 1wny s PRO 203 Ca 0.00 1.06 -0.10 0.00 0.04 0.00 0.00 61.00 62.00 1wny s PRO 203 Cb 0.00 -2.13 -0.01 0.00 0.04 0.00 0.00 34.50 32.40 1wny s PRO 203 CO 0.00 -0.28 1.01 -1.54 0.04 0.00 0.00 177.00 176.23 1wny s SER 204 N -2.71 5.75 0.02 6.66 1.04 0.25 -4.85 113.70 119.85 1wny s SER 204 Ca 0.61 1.09 -0.00 0.00 0.48 0.00 0.00 55.95 58.13 1wny s SER 204 Cb -0.11 -2.05 -0.02 0.00 0.10 0.00 0.00 66.02 63.95 1wny s SER 204 CO 0.26 -1.09 -0.03 0.68 0.98 0.00 0.00 173.24 174.04 1wny s VAL 205 N -3.18 0.11 -0.22 5.02 -7.23 -0.50 -0.47 120.40 113.93 1wny s VAL 205 Ca 0.55 -0.92 -0.08 0.00 -1.81 0.00 0.00 61.98 59.72 1wny s VAL 205 Cb -0.11 -0.28 -0.04 0.00 0.56 0.00 0.00 36.38 36.51 1wny s VAL 205 CO 0.50 -0.51 0.08 -0.31 -0.31 0.00 0.00 175.10 174.56 1wny s TYR 206 N -1.50 3.18 0.03 2.82 2.02 -0.31 -1.35 117.35 122.24 1wny s TYR 206 Ca -0.16 -0.10 0.08 0.00 -0.37 0.00 0.00 57.07 56.53 1wny s TYR 206 Cb -0.10 -2.18 -0.02 0.00 -0.40 0.00 0.00 41.96 39.26 1wny s TYR 206 CO -0.01 -0.08 -0.24 0.08 -1.57 0.00 0.00 175.55 173.73 1wny s VAL 207 N 1.03 1.91 -0.07 0.71 1.01 0.34 -0.79 120.40 124.54 1wny s VAL 207 Ca 0.05 -1.22 -0.20 0.00 0.00 0.00 0.00 61.98 60.61 1wny s VAL 207 Cb -0.14 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 1wny s VAL 207 CO 0.03 0.36 0.57 -0.13 0.00 0.00 0.00 175.10 175.94 1wny s ARG 208 N -1.01 4.35 -0.48 2.72 0.52 -0.34 -1.23 118.95 123.47 1wny s ARG 208 Ca 0.10 0.66 0.01 0.00 -0.52 0.00 0.00 55.73 55.97 1wny s ARG 208 Cb -0.09 -3.41 0.13 0.00 0.52 0.00 0.00 34.95 32.10 1wny s ARG 208 CO 0.01 0.21 0.25 -0.06 0.02 0.00 0.00 175.30 175.73 1wny s PHE 209 N 0.39 3.46 0.31 -0.53 0.40 0.22 -4.84 117.98 117.39 1wny s PHE 209 Ca 0.31 -2.85 -0.30 0.00 -0.60 0.00 0.00 56.93 53.49 1wny s PHE 209 Cb -0.17 -3.04 -0.12 0.00 0.51 0.00 0.00 43.02 40.21 1wny s PHE 209 CO 0.15 -0.86 1.52 -2.30 0.70 0.00 0.00 175.22 174.43 1wny n PRO 210 N 3.78 2.57 -2.11 0.24 -0.02 -1.25 -0.88 135.00 137.33 1wny n PRO 210 Ca 0.04 0.91 -0.39 0.00 -2.02 0.00 0.00 63.50 62.04 1wny n PRO 210 Cb 0.38 -2.65 -0.01 0.00 -0.02 0.00 0.00 33.50 31.20 1wny n PRO 210 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1wny s LEU 211 N -0.81 4.22 0.17 2.45 1.43 -0.06 -0.11 118.68 125.97 1wny s LEU 211 Ca 0.61 2.58 0.08 0.00 -1.03 0.00 0.00 54.13 56.38 1wny s LEU 211 Cb -0.52 -3.92 -0.05 0.00 0.03 0.00 0.00 46.19 41.74 1wny s LEU 211 CO 0.53 -0.80 1.37 0.11 0.23 0.00 0.00 176.35 177.80 1wny h LYS 212 N 2.70 0.00 -2.10 1.70 1.57 -1.67 -3.38 116.57 115.39 1wny h LYS 212 Ca -0.49 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 57.73 1wny h LYS 212 Cb 1.24 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 33.15 1wny h LYS 212 CO 0.63 0.88 -0.91 0.39 -0.57 0.00 0.00 179.45 179.87 1wny n GLU 213 N -3.47 1.67 0.14 3.15 -0.58 -1.26 -4.95 120.64 115.34 1wny n GLU 213 Ca -0.00 -3.91 0.15 0.00 -0.42 0.00 0.00 57.16 52.97 1wny n GLU 213 Cb 0.85 -1.76 0.70 0.00 -0.57 0.00 0.00 31.44 30.65 1wny n GLU 213 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1wny h PRO 214 N 3.68 0.00 0.00 3.49 0.13 -1.84 -1.46 132.00 136.00 1wny h PRO 214 Ca 0.12 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.21 1wny h PRO 214 Cb 0.78 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.90 1wny h PRO 214 CO 0.63 0.00 -0.18 1.57 -0.23 0.00 0.00 178.00 179.79 1wny h LYS 215 N 0.00 0.00 0.00 0.86 2.10 -1.93 -0.77 116.57 116.83 1wny h LYS 215 Ca 0.12 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.77 1wny h LYS 215 Cb 0.51 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.84 1wny h LYS 215 CO -0.00 0.18 0.00 0.87 -2.00 0.00 0.00 179.45 178.50 1wny h LYS 216 N 0.00 0.00 -0.34 0.07 1.57 -1.60 0.24 116.57 116.51 1wny h LYS 216 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1wny h LYS 216 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1wny h LYS 216 CO 0.02 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.18 1wny n LEU 217 N -2.42 2.90 -3.53 2.94 4.77 -0.39 -4.98 117.00 116.30 1wny n LEU 217 Ca 0.01 -1.99 -0.21 0.00 -0.03 0.00 0.00 56.01 53.78 1wny n LEU 217 Cb 0.17 -0.23 0.08 0.00 -2.33 0.00 0.00 43.42 41.12 1wny n LEU 217 CO 0.18 0.73 0.20 0.61 -1.33 0.00 0.00 177.39 177.77 1wny n GLY 218 N 0.50 -0.48 3.29 -0.72 0.00 0.07 -5.00 105.19 102.85 1wny n GLY 218 Ca 0.11 0.20 -0.16 0.00 0.00 0.00 0.00 46.02 46.18 1wny n GLY 218 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wny s LEU 219 N -6.95 2.38 0.05 0.99 1.43 -0.65 -5.01 118.68 110.92 1wny s LEU 219 Ca 0.38 -1.11 0.07 0.00 -1.03 0.00 0.00 54.13 52.45 1wny s LEU 219 Cb -0.17 -0.34 -0.03 0.00 0.03 0.00 0.00 46.19 45.69 1wny s LEU 219 CO 0.73 -0.40 -0.21 -1.61 0.23 0.00 0.00 176.35 175.09 1wny s GLU 220 N -3.79 1.33 -1.32 1.70 2.02 -1.26 -3.67 118.70 113.71 1wny s GLU 220 Ca 0.22 -0.98 -0.16 0.00 0.02 0.00 0.00 54.97 54.07 1wny s GLU 220 Cb 0.04 -1.47 0.01 0.00 0.10 0.00 0.00 34.13 32.81 1wny s GLU 220 CO 0.05 0.37 0.49 1.63 0.02 0.00 0.00 175.26 177.82 1wny n LYS 221 N 1.71 -1.29 -3.82 1.61 5.02 -1.26 -3.22 118.16 116.92 1wny n LYS 221 Ca -0.18 0.23 -0.35 0.00 -2.02 0.00 0.00 58.31 55.99 1wny n LYS 221 Cb 0.53 -3.55 -0.05 0.00 -0.02 0.00 0.00 35.03 31.94 1wny n LYS 221 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wny s ALA 222 N -3.81 3.88 -0.00 7.82 0.00 -1.26 -1.82 121.76 126.57 1wny s ALA 222 Ca 0.27 -0.62 -0.02 0.00 0.00 0.00 0.00 51.96 51.59 1wny s ALA 222 Cb -0.13 -2.01 -0.01 0.00 0.00 0.00 0.00 23.12 20.98 1wny s ALA 222 CO 0.94 0.65 0.03 -1.12 0.00 0.00 0.00 175.76 176.26 1wny s SER 223 N -1.50 0.07 0.28 0.00 0.01 0.16 -0.88 113.70 111.85 1wny s SER 223 Ca 0.23 -0.17 -0.29 0.00 1.31 0.00 0.00 55.95 57.03 1wny s SER 223 Cb -0.13 0.11 -0.09 0.00 0.21 0.00 0.00 66.02 66.12 1wny s SER 223 CO 0.12 -0.17 0.99 -0.76 0.41 0.00 0.00 173.24 173.83 1wny s LEU 224 N -0.73 4.54 -0.20 2.44 1.43 -0.06 -0.84 118.68 125.24 1wny s LEU 224 Ca -0.08 2.02 -0.07 0.00 -1.03 0.00 0.00 54.13 54.97 1wny s LEU 224 Cb -0.05 -3.72 -0.04 0.00 0.03 0.00 0.00 46.19 42.41 1wny s LEU 224 CO -0.00 -0.01 0.06 -0.22 0.23 0.00 0.00 176.35 176.42 1wny s LEU 225 N -1.50 3.68 0.19 1.79 2.96 -0.73 -0.61 118.68 124.45 1wny s LEU 225 Ca 0.45 -0.02 0.11 0.00 -0.22 0.00 0.00 54.13 54.45 1wny s LEU 225 Cb -0.26 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.44 1wny s LEU 225 CO 0.33 0.11 -0.23 0.27 -1.32 0.00 0.00 176.35 175.50 1wny s ILE 226 N 0.78 2.43 -0.06 6.68 -5.25 -0.37 -4.48 121.20 120.93 1wny s ILE 226 Ca 0.03 -1.99 0.06 0.00 -0.99 0.00 0.00 60.65 57.77 1wny s ILE 226 Cb -0.13 -2.16 -0.01 0.00 2.95 0.00 0.00 42.46 43.10 1wny s ILE 226 CO 0.02 -0.11 -0.25 0.86 -1.79 0.00 0.00 174.94 173.68 1wny s TRP 227 N -1.65 2.45 -0.05 1.37 -0.00 -1.26 -0.50 118.94 119.31 1wny s TRP 227 Ca 0.21 -0.75 -0.11 0.00 -0.00 0.00 0.00 56.10 55.45 1wny s TRP 227 Cb -0.08 -1.61 0.02 0.00 -0.00 0.00 0.00 33.47 31.80 1wny s TRP 227 CO 0.10 -0.23 0.26 -0.08 -0.00 0.00 0.00 176.95 177.00 1wny s THR 228 N -0.13 0.04 -1.55 5.86 -1.32 -0.45 -4.77 115.64 113.32 1wny s THR 228 Ca -0.05 -0.34 0.24 0.00 -1.21 0.00 0.00 61.69 60.33 1wny s THR 228 Cb -0.14 -0.49 0.04 0.00 -1.51 0.00 0.00 72.50 70.39 1wny s THR 228 CO 0.04 -0.18 1.26 0.35 -2.21 0.00 0.00 174.62 173.88 1wny n THR 229 N 1.95 0.00 -3.62 5.08 -2.24 -1.26 -1.42 114.28 112.78 1wny n THR 229 Ca -0.18 -0.12 -0.27 0.00 -2.27 0.00 0.00 64.05 61.20 1wny n THR 229 Cb 0.57 0.75 -0.11 0.00 -2.10 0.00 0.00 70.33 69.44 1wny n THR 229 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1wny n THR 230 N -0.78 0.18 0.04 4.28 -2.24 -1.26 -4.79 114.28 109.70 1wny n THR 230 Ca 0.08 -4.14 0.19 0.00 -2.27 0.00 0.00 64.05 57.92 1wny n THR 230 Cb 0.38 -1.91 0.69 0.00 -2.10 0.00 0.00 70.33 67.39 1wny n THR 230 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1wny h PRO 231 N 5.43 0.00 0.00 -0.78 0.11 -1.92 -1.69 132.00 133.15 1wny h PRO 231 Ca 0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.32 1wny h PRO 231 Cb 0.83 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1wny h PRO 231 CO 0.54 0.00 0.00 -2.67 -0.21 0.00 0.00 178.00 175.66 1wny n TRP 232 N -4.34 0.50 1.27 0.65 4.27 -1.26 -0.93 117.44 117.60 1wny n TRP 232 Ca 0.08 0.24 0.13 0.00 -3.89 0.00 0.00 57.50 54.06 1wny n TRP 232 Cb 0.55 -0.89 0.36 0.00 -1.36 0.00 0.00 31.31 29.96 1wny n TRP 232 CO 0.00 0.00 0.00 0.25 -2.29 0.00 0.00 177.69 175.65 1wny n THR 233 N -2.00 0.00 -0.21 -1.67 -2.24 -0.63 -4.32 114.28 103.21 1wny n THR 233 Ca -0.00 -0.21 0.08 0.00 -2.27 0.00 0.00 64.05 61.65 1wny n THR 233 Cb 0.06 0.61 0.36 0.00 -2.10 0.00 0.00 70.33 69.26 1wny n THR 233 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1wny h LEU 234 N 1.94 0.66 -2.71 3.22 3.38 -1.21 0.64 115.31 121.22 1wny h LEU 234 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1wny h LEU 234 Cb 0.57 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1wny h LEU 234 CO 0.00 0.40 0.00 -0.65 0.09 0.00 0.00 178.44 178.28 1wny h PRO 235 N 0.74 0.00 -0.39 1.13 0.11 -1.80 -0.87 132.00 130.92 1wny h PRO 235 Ca 0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.46 1wny h PRO 235 Cb 0.40 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.51 1wny h PRO 235 CO -0.13 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.07 1wny n GLY 236 N -0.95 1.03 3.77 -0.55 0.00 0.21 -4.91 105.19 103.79 1wny n GLY 236 Ca -0.02 -0.51 -0.40 0.00 0.00 0.00 0.00 46.02 45.09 1wny n GLY 236 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1wny s ASN 237 N -1.16 6.13 0.00 1.61 2.47 -0.33 -4.35 114.94 119.31 1wny s ASN 237 Ca 0.32 2.89 0.00 0.00 0.42 0.00 0.00 52.86 56.49 1wny s ASN 237 Cb 0.17 -2.65 0.00 0.00 -1.45 0.00 0.00 41.25 37.32 1wny s ASN 237 CO 0.23 -1.00 0.00 1.33 -3.72 0.00 0.00 177.10 173.94 1wny n VAL 238 N 0.10 0.00 -3.79 -5.21 0.24 -0.20 -4.94 118.33 104.53 1wny n VAL 238 Ca 0.03 -0.13 -0.04 0.00 -2.04 0.00 0.00 64.34 62.16 1wny n VAL 238 Cb 0.41 0.73 -0.01 0.00 -1.47 0.00 0.00 33.84 33.51 1wny n VAL 238 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1wny s ALA 239 N -0.53 -1.55 -0.10 2.33 0.00 -1.24 -0.50 121.76 120.17 1wny s ALA 239 Ca 0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 51.96 51.91 1wny s ALA 239 Cb 0.00 0.68 0.02 0.00 0.00 0.00 0.00 23.12 23.83 1wny s ALA 239 CO 0.00 -1.04 -0.07 0.00 0.00 0.00 0.00 175.76 174.64 1wny s ALA 240 N -3.13 1.24 -0.07 0.00 0.00 -1.03 -1.16 121.76 117.60 1wny s ALA 240 Ca 0.14 -0.48 -0.09 0.00 0.00 0.00 0.00 51.96 51.54 1wny s ALA 240 Cb -0.02 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.21 1wny s ALA 240 CO 0.04 -0.36 0.22 0.00 0.00 0.00 0.00 175.76 175.66 1wny s ALA 241 N 1.61 3.84 0.17 0.00 0.00 0.24 -0.50 121.76 127.12 1wny s ALA 241 Ca 0.03 -0.54 0.06 0.00 0.00 0.00 0.00 51.96 51.50 1wny s ALA 241 Cb -0.13 -2.07 -0.05 0.00 0.00 0.00 0.00 23.12 20.87 1wny s ALA 241 CO -0.06 0.60 -0.12 0.14 0.00 0.00 0.00 175.76 176.31 1wny s VAL 242 N -1.08 1.39 -0.09 0.00 -7.23 0.04 -0.59 120.40 112.83 1wny s VAL 242 Ca 0.19 -2.11 -0.26 0.00 -1.81 0.00 0.00 61.98 57.99 1wny s VAL 242 Cb -0.13 -1.91 -0.02 0.00 0.56 0.00 0.00 36.38 34.87 1wny s VAL 242 CO 0.08 -0.68 0.83 -2.28 -0.31 0.00 0.00 175.10 172.74 1wny s HIS 243 N -3.17 3.53 0.60 2.82 2.46 -1.26 -1.22 115.29 119.05 1wny s HIS 243 Ca 0.19 1.37 0.29 0.00 0.47 0.00 0.00 55.06 57.38 1wny s HIS 243 Cb 0.01 -2.98 1.66 0.00 -0.13 0.00 0.00 32.58 31.14 1wny s HIS 243 CO 0.03 -0.08 2.07 -1.00 -2.47 0.00 0.00 174.74 173.29 1wny h PRO 244 N 7.01 0.00 0.00 2.88 0.13 -1.86 -3.09 132.00 137.07 1wny h PRO 244 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1wny h PRO 244 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1wny h PRO 244 CO 0.79 0.00 -1.18 0.39 -0.23 0.00 0.00 178.00 177.78 1wny n GLU 245 N -3.70 1.04 -1.47 0.86 1.02 -1.26 -0.80 120.64 116.33 1wny n GLU 245 Ca 0.02 -0.06 -0.30 0.00 -0.02 0.00 0.00 57.16 56.80 1wny n GLU 245 Cb 0.37 -1.35 0.09 0.00 -0.02 0.00 0.00 31.44 30.52 1wny n GLU 245 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1wny s TYR 246 N -2.84 2.78 -0.23 -0.32 2.02 -1.17 -4.73 117.35 112.85 1wny s TYR 246 Ca 0.02 1.26 -0.12 0.00 -0.37 0.00 0.00 57.07 57.86 1wny s TYR 246 Cb 0.12 -3.07 -0.05 0.00 -0.40 0.00 0.00 41.96 38.56 1wny s TYR 246 CO 0.72 -1.77 0.22 0.99 -1.57 0.00 0.00 175.55 174.14 1wny s THR 247 N -3.07 5.31 0.22 -0.71 2.01 -1.26 -1.18 115.64 116.96 1wny s THR 247 Ca 0.61 0.32 0.06 0.00 0.31 0.00 0.00 61.69 62.99 1wny s THR 247 Cb -0.15 -3.56 -0.04 0.00 0.01 0.00 0.00 72.50 68.76 1wny s THR 247 CO 0.55 0.31 0.20 -0.31 -0.69 0.00 0.00 174.62 174.69 1wny s TYR 248 N 1.16 3.18 0.04 4.92 2.02 0.50 -0.65 117.35 128.53 1wny s TYR 248 Ca 0.11 -0.06 -0.05 0.00 -0.37 0.00 0.00 57.07 56.69 1wny s TYR 248 Cb -0.14 -1.46 -0.01 0.00 -0.40 0.00 0.00 41.96 39.95 1wny s TYR 248 CO 0.06 0.51 0.08 0.00 -1.57 0.00 0.00 175.55 174.63 1wny s ALA 249 N -1.99 -0.02 -0.24 3.71 0.00 -0.45 -0.62 121.76 122.14 1wny s ALA 249 Ca 0.33 -0.60 -0.10 0.00 0.00 0.00 0.00 51.96 51.59 1wny s ALA 249 Cb -0.09 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.24 1wny s ALA 249 CO 0.25 -0.32 0.14 0.00 0.00 0.00 0.00 175.76 175.83 1wny s ALA 250 N -2.69 3.47 -0.09 0.00 0.00 -0.50 -2.33 121.76 119.62 1wny s ALA 250 Ca -0.04 -0.97 -0.01 0.00 0.00 0.00 0.00 51.96 50.93 1wny s ALA 250 Cb -0.01 -2.26 -0.03 0.00 0.00 0.00 0.00 23.12 20.82 1wny s ALA 250 CO -0.05 -0.29 -0.02 -0.06 0.00 0.00 0.00 175.76 175.34 1wny s PHE 251 N 1.26 3.09 -0.34 0.00 0.40 0.51 -0.22 117.98 122.68 1wny s PHE 251 Ca 0.06 0.10 -0.20 0.00 -0.60 0.00 0.00 56.93 56.29 1wny s PHE 251 Cb -0.14 -1.79 -0.00 0.00 0.51 0.00 0.00 43.02 41.60 1wny s PHE 251 CO 0.06 0.38 0.64 -1.14 0.70 0.00 0.00 175.22 175.86 1wny s GLN 252 N -0.73 3.77 -0.37 0.44 2.00 -0.34 -0.85 119.66 123.58 1wny s GLN 252 Ca 0.11 0.16 0.03 0.00 -2.00 0.00 0.00 55.36 53.66 1wny s GLN 252 Cb -0.11 -3.78 0.11 0.00 0.80 0.00 0.00 33.01 30.02 1wny s GLN 252 CO 0.02 -0.68 0.10 0.08 -0.50 0.00 0.00 175.29 174.32 1wny s VAL 253 N 2.68 2.04 0.00 1.34 1.01 0.16 -4.21 120.40 123.43 1wny s VAL 253 Ca 0.25 -2.36 0.00 0.00 0.00 0.00 0.00 61.98 59.87 1wny s VAL 253 Cb -0.15 -2.49 0.00 0.00 0.00 0.00 0.00 36.38 33.74 1wny s VAL 253 CO 0.14 -0.66 0.00 0.61 0.00 0.00 0.00 175.10 175.18 1wny n GLY 254 N 4.12 3.74 0.92 4.51 0.00 -1.26 -2.10 105.19 115.12 1wny n GLY 254 Ca 0.03 -0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1wny n GLY 254 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1wny n ASP 255 N 6.74 2.65 -4.23 1.61 3.85 -1.26 -4.91 116.55 121.01 1wny n ASP 255 Ca 0.00 -2.13 -0.15 0.00 -0.71 0.00 0.00 54.79 51.79 1wny n ASP 255 Cb 0.00 -0.37 -0.11 0.00 -1.35 0.00 0.00 41.12 39.30 1wny n ASP 255 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.20 174.36 1wny s GLU 256 N -1.58 0.99 -0.20 0.11 -1.05 -0.89 -4.69 118.70 111.39 1wny s GLU 256 Ca 0.29 -1.29 -0.05 0.00 -0.15 0.00 0.00 54.97 53.77 1wny s GLU 256 Cb 0.17 -0.69 -0.02 0.00 -0.44 0.00 0.00 34.13 33.15 1wny s GLU 256 CO 0.17 0.11 -0.00 0.00 0.95 0.00 0.00 175.26 176.49 1wny s ALA 257 N -2.67 3.02 -0.11 -0.84 0.00 -0.76 -0.66 121.76 119.74 1wny s ALA 257 Ca 0.11 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 51.09 1wny s ALA 257 Cb -0.02 -1.76 -0.02 0.00 0.00 0.00 0.00 23.12 21.32 1wny s ALA 257 CO 0.01 -0.14 -0.13 -0.51 0.00 0.00 0.00 175.76 174.99 1wny s LEU 258 N 0.99 2.75 -0.18 0.00 1.43 -0.03 -0.66 118.68 122.98 1wny s LEU 258 Ca 0.02 -0.28 -0.05 0.00 -1.03 0.00 0.00 54.13 52.78 1wny s LEU 258 Cb -0.14 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.44 1wny s LEU 258 CO 0.02 0.22 0.01 -0.63 0.23 0.00 0.00 176.35 176.20 1wny s ILE 259 N 0.02 4.21 0.32 -0.59 1.01 -0.02 -0.36 121.20 125.78 1wny s ILE 259 Ca -0.04 -0.23 -0.18 0.00 0.00 0.00 0.00 60.65 60.20 1wny s ILE 259 Cb -0.14 -2.89 0.03 0.00 0.01 0.00 0.00 42.46 39.47 1wny s ILE 259 CO 0.04 0.45 0.71 -1.48 0.00 0.00 0.00 174.94 174.66 1wny s LEU 260 N 0.66 -0.07 0.36 2.97 2.34 -0.98 -1.77 118.68 122.20 1wny s LEU 260 Ca 0.00 -0.86 -0.28 0.00 0.06 0.00 0.00 54.13 53.05 1wny s LEU 260 Cb -0.14 2.63 -0.11 0.00 -0.56 0.00 0.00 46.19 48.01 1wny s LEU 260 CO 0.02 -1.44 1.49 1.21 -1.06 0.00 0.00 176.35 176.56 1wny n GLU 261 N -0.48 2.62 -0.29 1.48 0.00 0.12 -1.34 120.64 122.75 1wny n GLU 261 Ca -0.05 0.92 -0.01 0.00 0.00 0.00 0.00 57.16 58.02 1wny n GLU 261 Cb 0.60 -2.65 0.11 0.00 0.00 0.00 0.00 31.44 29.50 1wny n GLU 261 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.13 178.18 1wny h GLU 262 N 3.25 0.91 -0.42 5.31 -0.00 -1.17 0.38 114.58 122.84 1wny h GLU 262 Ca -0.50 -0.05 -0.06 0.00 -0.00 0.00 0.00 59.36 58.75 1wny h GLU 262 Cb 1.24 -0.21 -0.02 0.00 -0.00 0.00 0.00 28.75 29.77 1wny h GLU 262 CO 0.67 0.60 0.04 0.78 -0.00 0.00 0.00 179.01 181.10 1wny h GLY 263 N 0.94 0.77 1.51 1.06 0.00 -1.90 -1.48 103.07 103.97 1wny h GLY 263 Ca 0.33 -0.54 -0.07 0.00 0.00 0.00 0.00 47.33 47.05 1wny h GLY 263 CO -0.14 0.50 -0.09 1.41 0.00 0.00 0.00 176.54 178.21 1wny h LEU 264 N 0.56 0.58 -0.42 3.11 3.38 -1.76 -2.23 115.31 118.53 1wny h LEU 264 Ca 0.12 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1wny h LEU 264 Cb 0.42 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1wny h LEU 264 CO 0.01 0.71 0.06 1.23 0.09 0.00 0.00 178.44 180.55 1wny h GLY 265 N 0.94 0.75 1.36 0.83 0.00 -0.73 -0.36 103.07 105.86 1wny h GLY 265 Ca 0.10 -0.50 -0.05 0.00 0.00 0.00 0.00 47.33 46.88 1wny h GLY 265 CO 0.03 0.47 0.10 3.21 0.00 0.00 0.00 176.54 180.34 1wny h ARG 266 N 0.55 0.80 -0.19 4.80 3.08 -1.01 0.16 114.38 122.56 1wny h ARG 266 Ca 0.13 -0.17 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 1wny h ARG 266 Cb 0.38 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1wny h ARG 266 CO 0.01 0.74 -0.05 -0.22 -1.07 0.00 0.00 179.97 179.38 1wny h LYS 267 N 0.76 0.38 -0.15 0.04 3.64 -1.26 0.46 116.57 120.45 1wny h LYS 267 Ca 0.16 -0.15 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 1wny h LYS 267 Cb 0.33 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1wny h LYS 267 CO 0.00 0.64 -0.08 1.25 -2.27 0.00 0.00 179.45 179.00 1wny h LEU 268 N 0.09 0.32 0.00 5.20 5.85 -0.93 -3.36 115.31 122.49 1wny h LEU 268 Ca 0.05 -0.42 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1wny h LEU 268 Cb 0.50 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.44 1wny h LEU 268 CO 0.02 0.67 -1.43 0.18 -0.34 0.00 0.00 178.44 177.54 1wny n LEU 269 N -4.64 0.44 0.00 2.25 4.77 0.54 -5.08 117.00 115.28 1wny n LEU 269 Ca -0.06 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1wny n LEU 269 Cb 0.30 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1wny n LEU 269 CO 0.38 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1wny n GLY 270 N 1.28 2.89 0.30 -0.72 0.00 0.15 -4.60 105.19 104.49 1wny n GLY 270 Ca -0.01 -1.50 0.17 0.00 0.00 0.00 0.00 46.02 44.68 1wny n GLY 270 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1wny h GLU 271 N 0.00 0.00 -0.01 1.61 4.39 -1.90 -2.07 114.58 116.60 1wny h GLU 271 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1wny h GLU 271 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1wny h GLU 271 CO 0.00 0.01 -0.13 0.41 -1.16 0.00 0.00 179.01 178.13 1wny n GLY 272 N -1.22 -0.76 3.72 -3.84 0.00 -1.26 -4.89 105.19 96.94 1wny n GLY 272 Ca -0.03 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 1wny n GLY 272 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wny s THR 273 N -2.42 3.41 0.39 2.61 2.01 -0.78 -4.95 115.64 115.91 1wny s THR 273 Ca 0.29 1.06 -0.28 0.00 0.31 0.00 0.00 61.69 63.08 1wny s THR 273 Cb 0.20 -3.68 -0.11 0.00 0.01 0.00 0.00 72.50 68.92 1wny s THR 273 CO 0.47 0.11 1.48 -2.65 -0.69 0.00 0.00 174.62 173.34 1wny n PRO 274 N 3.49 2.64 -4.49 4.92 -0.02 -1.26 -4.87 135.00 135.41 1wny n PRO 274 Ca 0.09 0.93 -0.34 0.00 -2.02 0.00 0.00 63.50 62.16 1wny n PRO 274 Cb 0.43 -2.67 -0.12 0.00 -0.02 0.00 0.00 33.50 31.13 1wny n PRO 274 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1wny s VAL 275 N -1.13 3.83 -0.23 -1.45 1.01 -1.26 -1.20 120.40 119.97 1wny s VAL 275 Ca 0.54 -0.40 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 1wny s VAL 275 Cb -0.47 -2.63 -0.19 0.00 0.00 0.00 0.00 36.38 33.09 1wny s VAL 275 CO 0.63 0.54 -0.11 0.18 0.00 0.00 0.00 175.10 176.35 1wny n LEU 276 N 2.95 2.79 -3.60 3.92 4.77 0.69 -4.94 117.00 123.59 1wny n LEU 276 Ca -0.18 -0.01 -0.11 0.00 -0.03 0.00 0.00 56.01 55.68 1wny n LEU 276 Cb 0.53 -0.95 -0.04 0.00 -2.33 0.00 0.00 43.42 40.63 1wny n LEU 276 CO 0.30 0.88 0.22 -0.54 -1.33 0.00 0.00 177.39 176.92 1wny s LYS 277 N -2.52 1.15 0.07 3.23 1.02 -1.24 -4.99 119.74 116.45 1wny s LYS 277 Ca -0.33 -0.68 0.04 0.00 0.02 0.00 0.00 55.97 55.03 1wny s LYS 277 Cb 0.09 0.50 -0.03 0.00 -0.52 0.00 0.00 37.83 37.87 1wny s LYS 277 CO 0.63 -0.47 -0.11 0.95 -0.92 0.00 0.00 175.35 175.42 1wny s THR 278 N -3.80 0.91 -0.17 2.17 -4.23 -1.26 -1.42 115.64 107.84 1wny s THR 278 Ca 0.03 -1.30 -0.28 0.00 -1.18 0.00 0.00 61.69 58.96 1wny s THR 278 Cb 0.01 -0.99 0.07 0.00 1.34 0.00 0.00 72.50 72.93 1wny s THR 278 CO -0.11 -0.34 0.70 0.72 -0.54 0.00 0.00 174.62 175.05 1wny s PHE 279 N -1.53 -0.73 0.62 3.99 -0.12 0.21 -4.98 117.98 115.44 1wny s PHE 279 Ca -0.03 1.55 -0.14 0.00 -0.05 0.00 0.00 56.93 58.26 1wny s PHE 279 Cb -0.09 0.33 -0.03 0.00 -0.63 0.00 0.00 43.02 42.61 1wny s PHE 279 CO 0.01 -0.49 1.05 -1.25 -0.05 0.00 0.00 175.22 174.50 1wny s PRO 280 N -0.35 3.28 0.31 1.99 0.04 -1.26 -0.37 135.00 138.64 1wny s PRO 280 Ca -0.05 1.08 0.07 0.00 0.04 0.00 0.00 61.00 62.14 1wny s PRO 280 Cb -0.03 -2.03 0.78 0.00 0.04 0.00 0.00 34.50 33.26 1wny s PRO 280 CO 0.05 -0.83 1.75 0.78 0.04 0.00 0.00 177.00 178.80 1wny h GLY 281 N 0.11 1.80 0.65 0.56 0.00 -1.09 0.23 103.07 105.32 1wny h GLY 281 Ca -0.46 -0.33 0.13 0.00 0.00 0.00 0.00 47.33 46.68 1wny h GLY 281 CO 0.58 -0.14 0.54 1.70 0.00 0.00 0.00 176.54 179.22 1wny h LYS 282 N 0.67 0.64 0.00 4.80 3.64 -1.16 0.37 116.57 125.53 1wny h LYS 282 Ca 0.60 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.94 1wny h LYS 282 Cb 1.01 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.68 1wny h LYS 282 CO -0.42 0.42 0.00 0.00 -2.27 0.00 0.00 179.45 177.18 1wny h ALA 283 N 1.61 1.00 -0.00 5.00 0.00 -1.23 -2.77 119.26 122.86 1wny h ALA 283 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1wny h ALA 283 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1wny h ALA 283 CO -0.17 0.00 -0.47 1.28 0.00 0.00 0.00 179.25 179.89 1wny n LEU 284 N -2.70 0.85 -4.64 0.00 4.77 0.11 -4.95 117.00 110.44 1wny n LEU 284 Ca 0.00 -0.20 -0.48 0.00 -0.03 0.00 0.00 56.01 55.30 1wny n LEU 284 Cb 0.20 -0.16 -0.05 0.00 -2.33 0.00 0.00 43.42 41.08 1wny n LEU 284 CO 0.21 0.18 1.09 1.21 -1.33 0.00 0.00 177.39 178.75 1wny n GLU 285 N -1.09 1.81 -0.24 3.23 2.13 -1.05 -1.37 120.64 124.06 1wny n GLU 285 Ca 0.08 0.65 0.00 0.00 0.66 0.00 0.00 57.16 58.55 1wny n GLU 285 Cb 0.35 -2.37 0.00 0.00 0.27 0.00 0.00 31.44 29.69 1wny n GLU 285 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1wny n GLY 286 N 3.06 1.14 3.66 8.31 0.00 0.63 -4.94 105.19 117.04 1wny n GLY 286 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1wny n GLY 286 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wny s LEU 287 N 0.00 4.39 0.25 0.99 2.96 -0.47 -4.54 118.68 122.26 1wny s LEU 287 Ca 0.00 2.53 -0.25 0.00 -0.22 0.00 0.00 54.13 56.19 1wny s LEU 287 Cb 0.00 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 43.06 1wny s LEU 287 CO 0.00 -1.00 0.86 -2.16 -1.32 0.00 0.00 176.35 172.73 1wny s PRO 288 N 4.07 4.57 0.19 0.98 0.04 -1.26 -0.93 135.00 142.65 1wny s PRO 288 Ca 0.82 1.23 0.00 0.00 0.04 0.00 0.00 61.00 63.09 1wny s PRO 288 Cb -0.40 -3.03 -0.04 0.00 0.04 0.00 0.00 34.50 31.07 1wny s PRO 288 CO 0.37 0.42 0.06 1.52 0.04 0.00 0.00 177.00 179.42 1wny s TYR 289 N -1.39 1.18 -0.30 0.56 -0.85 -0.59 -1.86 117.35 114.10 1wny s TYR 289 Ca 0.43 -1.19 -0.14 0.00 -0.52 0.00 0.00 57.07 55.66 1wny s TYR 289 Cb -0.21 -0.66 -0.03 0.00 0.38 0.00 0.00 41.96 41.44 1wny s TYR 289 CO 0.25 -0.41 0.31 0.99 -1.52 0.00 0.00 175.55 175.17 1wny s THR 290 N -3.89 5.22 0.61 -3.49 2.01 0.84 -4.78 115.64 112.17 1wny s THR 290 Ca 0.30 0.23 -0.13 0.00 0.31 0.00 0.00 61.69 62.41 1wny s THR 290 Cb 0.07 -3.69 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 1wny s THR 290 CO 0.07 0.10 1.03 -2.16 -0.69 0.00 0.00 174.62 172.97 1wny s PRO 291 N 1.94 3.50 0.38 4.92 0.04 -1.26 -3.77 135.00 140.75 1wny s PRO 291 Ca 0.11 0.90 0.11 0.00 0.04 0.00 0.00 61.00 62.16 1wny s PRO 291 Cb -0.16 -2.07 0.75 0.00 0.04 0.00 0.00 34.50 33.06 1wny s PRO 291 CO 0.11 -0.64 1.86 -1.00 0.04 0.00 0.00 177.00 177.37 1wny h PRO 292 N -0.02 0.10 -2.60 0.56 0.13 -1.88 -3.35 132.00 124.94 1wny h PRO 292 Ca -0.45 -0.03 -0.60 0.00 -0.87 0.00 0.00 66.00 64.05 1wny h PRO 292 Cb 1.20 -0.01 -0.39 0.00 0.13 0.00 0.00 31.00 31.93 1wny h PRO 292 CO 0.60 0.37 -0.85 0.71 -0.23 0.00 0.00 178.00 178.60 1wny s TYR 293 N -4.41 1.79 0.20 1.56 1.51 -1.26 -5.09 117.35 111.65 1wny s TYR 293 Ca -0.04 -2.58 -0.33 0.00 -1.01 0.00 0.00 57.07 53.11 1wny s TYR 293 Cb 0.15 -1.45 -0.14 0.00 -0.11 0.00 0.00 41.96 40.41 1wny s TYR 293 CO 0.73 -0.75 1.42 -2.30 -1.11 0.00 0.00 175.55 173.54 1wny n PRO 294 N 2.68 1.90 -4.49 -1.71 -0.02 -1.26 -4.86 135.00 127.24 1wny n PRO 294 Ca 0.25 0.68 -0.25 0.00 -2.02 0.00 0.00 63.50 62.16 1wny n PRO 294 Cb 0.43 -2.35 -0.10 0.00 -0.02 0.00 0.00 33.50 31.46 1wny n PRO 294 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1wny s GLN 295 N 0.04 1.79 -1.52 -0.52 -1.52 -1.26 -4.98 119.66 111.69 1wny s GLN 295 Ca 0.73 -1.84 -0.11 0.00 -1.95 0.00 0.00 55.36 52.19 1wny s GLN 295 Cb -0.70 -1.76 -0.06 0.00 -0.22 0.00 0.00 33.01 30.27 1wny s GLN 295 CO 0.46 0.23 2.73 0.00 -0.25 0.00 0.00 175.29 178.46 1wny n ALA 296 N -0.73 6.85 -1.80 6.09 0.00 -1.26 -4.94 120.51 124.72 1wny n ALA 296 Ca -0.05 -3.46 -0.40 0.00 0.00 0.00 0.00 53.44 49.52 1wny n ALA 296 Cb 0.62 -3.38 -0.04 0.00 0.00 0.00 0.00 19.45 16.65 1wny n ALA 296 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1wny s LEU 297 N 0.58 4.53 0.31 0.00 1.43 -1.26 -4.93 118.68 119.34 1wny s LEU 297 Ca 0.63 2.31 0.06 0.00 -1.03 0.00 0.00 54.13 56.10 1wny s LEU 297 Cb 0.16 -3.63 0.50 0.00 0.03 0.00 0.00 46.19 43.26 1wny s LEU 297 CO -0.06 -0.21 1.74 -0.33 0.23 0.00 0.00 176.35 177.72 1wny h GLU 298 N 3.93 0.28 -2.68 1.70 4.39 -1.98 -3.44 114.58 116.79 1wny h GLU 298 Ca -0.47 -0.12 -0.10 0.00 0.34 0.00 0.00 59.36 59.02 1wny h GLU 298 Cb 1.21 -0.01 -0.21 0.00 -0.10 0.00 0.00 28.75 29.64 1wny h GLU 298 CO 0.68 0.59 -0.14 0.21 -1.16 0.00 0.00 179.01 179.19 1wny s LYS 299 N -4.30 0.72 0.00 2.33 2.20 -1.26 -5.12 119.74 114.30 1wny s LYS 299 Ca -0.05 0.16 0.00 0.00 -0.36 0.00 0.00 55.97 55.72 1wny s LYS 299 Cb 0.14 0.33 0.00 0.00 -1.51 0.00 0.00 37.83 36.79 1wny s LYS 299 CO 0.77 -0.18 0.00 0.41 -0.36 0.00 0.00 175.35 175.99 1wny n GLY 300 N 1.65 0.77 3.43 5.54 0.00 -1.26 -4.36 105.19 110.96 1wny n GLY 300 Ca -0.19 -1.84 -0.21 0.00 0.00 0.00 0.00 46.02 43.78 1wny n GLY 300 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1wny n TYR 301 N 9.00 -2.61 -4.24 1.61 4.01 0.34 -4.96 117.16 120.31 1wny n TYR 301 Ca 0.00 0.94 -0.14 0.00 -0.16 0.00 0.00 57.90 58.54 1wny n TYR 301 Cb 0.00 -4.77 -0.10 0.00 -0.31 0.00 0.00 39.34 34.16 1wny n TYR 301 CO 0.00 0.00 0.00 -0.59 -0.46 0.00 0.00 176.86 175.81 1wny s PHE 302 N -3.30 1.33 0.03 -0.72 -0.12 -1.26 -1.54 117.98 112.40 1wny s PHE 302 Ca 0.48 -1.40 -0.30 0.00 -0.05 0.00 0.00 56.93 55.66 1wny s PHE 302 Cb -0.21 -0.65 -0.04 0.00 -0.63 0.00 0.00 43.02 41.49 1wny s PHE 302 CO 0.68 -0.63 0.99 0.08 -0.05 0.00 0.00 175.22 176.29 1wny s VAL 303 N -3.96 4.73 0.30 -2.49 1.01 -0.10 -2.46 120.40 117.42 1wny s VAL 303 Ca 0.39 2.03 0.11 0.00 0.00 0.00 0.00 61.98 64.51 1wny s VAL 303 Cb 0.06 -4.30 -0.05 0.00 0.00 0.00 0.00 36.38 32.09 1wny s VAL 303 CO 0.15 0.20 -0.14 0.68 0.00 0.00 0.00 175.10 175.99 1wny s VAL 304 N 0.76 2.57 -0.09 2.92 -7.23 0.35 -0.27 120.40 119.41 1wny s VAL 304 Ca 0.51 -2.27 -0.04 0.00 -1.81 0.00 0.00 61.98 58.37 1wny s VAL 304 Cb -0.22 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 1wny s VAL 304 CO 0.29 -0.34 0.09 -0.76 -0.31 0.00 0.00 175.10 174.06 1wny s LEU 305 N -3.57 4.05 -0.15 1.32 1.43 -1.26 -0.78 118.68 119.72 1wny s LEU 305 Ca 0.31 0.32 -0.08 0.00 -1.03 0.00 0.00 54.13 53.65 1wny s LEU 305 Cb -0.03 -2.03 0.06 0.00 0.03 0.00 0.00 46.19 44.22 1wny s LEU 305 CO 0.16 0.38 0.36 0.00 0.23 0.00 0.00 176.35 177.48 1wny s ALA 306 N -1.01 -0.90 -0.12 4.21 0.00 -0.36 -4.89 121.76 118.69 1wny s ALA 306 Ca 0.16 1.36 0.30 0.00 0.00 0.00 0.00 51.96 53.78 1wny s ALA 306 Cb -0.12 -0.85 1.26 0.00 0.00 0.00 0.00 23.12 23.41 1wny s ALA 306 CO 0.05 -0.26 1.88 -0.44 0.00 0.00 0.00 175.76 176.99 1wny h ASP 307 N 7.19 0.00 0.95 0.00 3.32 -1.98 -2.98 116.42 122.91 1wny h ASP 307 Ca -0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.68 1wny h ASP 307 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 1wny h ASP 307 CO 0.31 0.00 -0.22 0.00 -1.72 0.00 0.00 179.24 177.62 1wny n TYR 308 N -2.70 0.26 -1.74 4.55 4.11 -1.26 -4.89 117.16 115.49 1wny n TYR 308 Ca 0.01 0.08 -0.42 0.00 -0.00 0.00 0.00 57.90 57.57 1wny n TYR 308 Cb 0.25 -0.54 -0.01 0.00 -0.00 0.00 0.00 39.34 39.03 1wny n TYR 308 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.86 177.14 1wny n VAL 309 N -1.73 1.13 -2.72 -3.48 0.31 -1.12 -4.96 118.33 105.75 1wny n VAL 309 Ca 0.06 -0.28 -0.32 0.00 -0.01 0.00 0.00 64.34 63.78 1wny n VAL 309 Cb 0.37 -1.94 -0.05 0.00 -0.91 0.00 0.00 33.84 31.30 1wny n VAL 309 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1wny s SER 310 N 0.41 6.78 0.00 4.52 0.15 -1.26 -4.82 113.70 119.48 1wny s SER 310 Ca 0.63 1.55 0.02 0.00 0.70 0.00 0.00 55.95 58.85 1wny s SER 310 Cb -0.50 -2.49 0.05 0.00 -1.71 0.00 0.00 66.02 61.37 1wny s SER 310 CO 0.50 -0.42 0.95 0.00 1.20 0.00 0.00 173.24 175.48 1wny n GLN 311 N -0.97 2.26 -0.02 5.44 10.64 -1.26 -4.13 117.38 129.33 1wny n GLN 311 Ca 0.06 -1.41 -0.00 0.00 -1.83 0.00 0.00 57.00 53.82 1wny n GLN 311 Cb 0.54 -1.05 -0.05 0.00 -0.86 0.00 0.00 30.24 28.82 1wny n GLN 311 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1wny n GLU 312 N -0.23 1.80 -4.44 2.61 4.71 -1.26 -4.78 120.64 119.04 1wny n GLU 312 Ca 0.02 -0.03 -0.31 0.00 -0.01 0.00 0.00 57.16 56.84 1wny n GLU 312 Cb 0.24 -1.16 -0.11 0.00 -1.01 0.00 0.00 31.44 29.40 1wny n GLU 312 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1wny s ASP 313 N -3.33 4.18 1.59 1.62 1.01 -1.26 -5.03 116.67 115.45 1wny s ASP 313 Ca -0.03 -0.36 0.00 0.00 0.71 0.00 0.00 52.55 52.87 1wny s ASP 313 Cb 0.03 -0.78 0.00 0.00 1.01 0.00 0.00 42.92 43.18 1wny s ASP 313 CO 0.26 0.23 0.00 0.61 0.21 0.00 0.00 175.17 176.48 1wny n GLY 314 N 1.21 2.79 0.00 0.21 0.00 -1.26 -4.00 105.19 104.14 1wny n GLY 314 Ca -0.15 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1wny n GLY 314 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1wny n THR 315 N 0.00 0.00 -0.38 2.61 -2.24 -1.26 -4.95 114.28 108.06 1wny n THR 315 Ca 0.00 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 1wny n THR 315 Cb 0.00 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 1wny n THR 315 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wny n GLY 316 N 0.56 0.76 2.98 3.38 0.00 -1.26 -0.70 105.19 110.91 1wny n GLY 316 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1wny n GLY 316 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wny s ILE 317 N -2.81 1.26 -0.19 -0.61 1.01 -1.26 -4.32 121.20 114.27 1wny s ILE 317 Ca 0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 60.65 60.17 1wny s ILE 317 Cb 0.00 -1.20 -0.00 0.00 0.01 0.00 0.00 42.46 41.27 1wny s ILE 317 CO 0.00 0.40 -0.11 -0.69 0.00 0.00 0.00 174.94 174.54 1wny s VAL 318 N 1.35 2.89 0.09 2.92 1.01 0.24 -4.06 120.40 124.84 1wny s VAL 318 Ca -0.00 -0.67 -0.31 0.00 0.00 0.00 0.00 61.98 61.00 1wny s VAL 318 Cb -0.14 -2.27 -0.09 0.00 0.00 0.00 0.00 36.38 33.88 1wny s VAL 318 CO -0.06 0.48 1.66 -2.28 0.00 0.00 0.00 175.10 174.91 1wny s HIS 319 N 1.24 2.48 -0.18 5.22 2.46 -1.26 -0.59 115.29 124.66 1wny s HIS 319 Ca 0.03 0.32 -0.07 0.00 0.47 0.00 0.00 55.06 55.81 1wny s HIS 319 Cb -0.14 -3.99 -0.04 0.00 -0.13 0.00 0.00 32.58 28.28 1wny s HIS 319 CO -0.05 -3.94 0.05 -0.65 -2.47 0.00 0.00 174.74 167.69 1wny s GLN 320 N 2.43 3.94 -0.31 2.88 -1.52 -0.31 -4.94 119.66 121.84 1wny s GLN 320 Ca 0.74 -0.36 -0.03 0.00 -1.95 0.00 0.00 55.36 53.77 1wny s GLN 320 Cb -0.41 -3.18 0.11 0.00 -0.22 0.00 0.00 33.01 29.30 1wny s GLN 320 CO 0.33 0.28 0.14 0.00 -0.25 0.00 0.00 175.29 175.78 1wny s ALA 321 N 0.35 0.91 -0.12 6.09 0.00 -1.26 -1.03 121.76 126.69 1wny s ALA 321 Ca 0.02 -1.38 0.23 0.00 0.00 0.00 0.00 51.96 50.83 1wny s ALA 321 Cb -0.12 -1.49 1.23 0.00 0.00 0.00 0.00 23.12 22.73 1wny s ALA 321 CO 0.00 -1.74 1.68 -1.00 0.00 0.00 0.00 175.76 174.71 1wny h PRO 322 N 8.07 0.00 0.00 0.00 0.13 -1.78 -1.41 132.00 137.01 1wny h PRO 322 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1wny h PRO 322 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1wny h PRO 322 CO 0.42 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.19 1wny n ALA 323 N -1.78 2.29 -2.00 -0.56 0.00 -1.26 -4.21 120.51 112.99 1wny n ALA 323 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1wny n ALA 323 Cb 0.06 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.10 1wny n ALA 323 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1wny n PHE 324 N -1.24 0.00 -1.70 0.00 3.72 -0.53 -4.97 117.46 112.75 1wny n PHE 324 Ca 0.13 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.10 1wny n PHE 324 Cb 0.18 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.71 1wny n PHE 324 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wny n GLY 325 N 4.78 0.68 0.24 1.37 0.00 -1.25 -4.89 105.19 106.12 1wny n GLY 325 Ca 0.00 0.36 0.03 0.00 0.00 0.00 0.00 46.02 46.41 1wny n GLY 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wny h ALA 326 N 3.01 1.54 -0.58 4.61 0.00 -1.93 -1.61 119.26 124.29 1wny h ALA 326 Ca -0.46 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.20 1wny h ALA 326 Cb 1.28 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1wny h ALA 326 CO 0.66 0.33 0.14 0.93 0.00 0.00 0.00 179.25 181.31 1wny h GLU 327 N 0.21 0.93 -0.85 0.00 5.08 -1.97 -0.76 114.58 117.21 1wny h GLU 327 Ca 0.04 -0.23 0.02 0.00 -1.00 0.00 0.00 59.36 58.20 1wny h GLU 327 Cb 0.35 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.44 1wny h GLU 327 CO 0.02 0.87 0.55 -0.44 -1.00 0.00 0.00 179.01 179.01 1wny h ASP 328 N 0.84 0.93 -0.39 1.42 5.19 -1.74 -0.44 116.42 122.24 1wny h ASP 328 Ca 0.18 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.56 1wny h ASP 328 Cb 0.36 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 39.63 1wny h ASP 328 CO 0.00 0.66 0.19 0.25 -3.12 0.00 0.00 179.24 177.22 1wny h LEU 329 N 1.10 0.50 -0.36 1.55 5.85 -0.86 -0.94 115.31 122.14 1wny h LEU 329 Ca 0.33 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.92 1wny h LEU 329 Cb -0.05 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 1wny h LEU 329 CO -0.10 0.49 0.24 -0.33 -0.34 0.00 0.00 178.44 178.40 1wny h GLU 330 N 0.48 0.48 -0.69 1.25 3.07 -0.62 -0.55 114.58 118.00 1wny h GLU 330 Ca 0.13 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 58.94 1wny h GLU 330 Cb 0.12 -0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 27.89 1wny h GLU 330 CO -0.02 0.32 0.33 1.15 -1.40 0.00 0.00 179.01 179.39 1wny h THR 331 N 0.49 1.23 -0.80 1.13 2.02 -0.94 -1.02 112.91 115.01 1wny h THR 331 Ca 0.13 -0.66 0.00 0.00 0.77 0.00 0.00 66.41 66.66 1wny h THR 331 Cb -0.05 0.39 -0.04 0.00 -1.74 0.00 0.00 68.15 66.71 1wny h THR 331 CO -0.03 0.27 0.50 0.00 0.37 0.00 0.00 175.52 176.64 1wny h ALA 332 N 1.15 1.38 -0.41 6.16 0.00 -0.64 -1.50 119.26 125.41 1wny h ALA 332 Ca 0.24 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 1wny h ALA 332 Cb 0.13 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1wny h ALA 332 CO -0.03 0.55 -0.09 0.00 0.00 0.00 0.00 179.25 179.69 1wny h ARG 333 N 1.10 0.79 -0.45 0.00 2.47 -0.44 0.15 114.38 117.99 1wny h ARG 333 Ca 0.29 -0.30 0.05 0.00 -1.26 0.00 0.00 59.98 58.76 1wny h ARG 333 Cb -0.08 -0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 28.15 1wny h ARG 333 CO -0.06 0.91 0.19 0.28 0.56 0.00 0.00 179.97 181.86 1wny h VAL 334 N 0.61 0.91 -0.16 2.04 2.07 -0.59 -2.57 116.25 118.55 1wny h VAL 334 Ca 0.11 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1wny h VAL 334 Cb 0.61 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1wny h VAL 334 CO 0.04 0.07 0.00 -1.22 0.02 0.00 0.00 177.57 176.48 1wny n TYR 335 N -4.95 0.21 -2.37 1.57 4.02 -0.62 -4.94 117.16 110.07 1wny n TYR 335 Ca 0.03 -0.10 -0.15 0.00 -0.01 0.00 0.00 57.90 57.67 1wny n TYR 335 Cb 0.15 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.46 1wny n TYR 335 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1wny n GLY 336 N 1.12 -0.22 3.87 2.72 0.00 -0.23 -5.01 105.19 107.44 1wny n GLY 336 Ca 0.16 -0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 1wny n GLY 336 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wny s LEU 337 N -4.30 3.93 0.47 0.99 1.43 0.35 -4.88 118.68 116.66 1wny s LEU 337 Ca 0.04 1.12 -0.24 0.00 -1.03 0.00 0.00 54.13 54.02 1wny s LEU 337 Cb -0.02 -3.97 -0.07 0.00 0.03 0.00 0.00 46.19 42.16 1wny s LEU 337 CO 0.05 -0.31 1.32 -2.84 0.23 0.00 0.00 176.35 174.79 1wny s PRO 338 N -3.54 3.60 -1.12 1.29 0.02 -1.26 -4.68 135.00 129.32 1wny s PRO 338 Ca 0.51 2.16 -0.14 0.00 0.02 0.00 0.00 61.00 63.55 1wny s PRO 338 Cb -0.10 -2.51 0.18 0.00 0.02 0.00 0.00 34.50 32.09 1wny s PRO 338 CO 0.27 -0.79 1.29 -1.17 -0.33 0.00 0.00 177.00 176.26 1wny s LEU 339 N -2.95 5.36 -0.61 -5.54 0.20 -1.26 -4.84 118.68 109.04 1wny s LEU 339 Ca 0.64 -2.91 -0.26 0.00 0.69 0.00 0.00 54.13 52.29 1wny s LEU 339 Cb -0.38 -2.36 -0.04 0.00 -0.43 0.00 0.00 46.19 42.98 1wny s LEU 339 CO 0.47 -0.72 2.03 -0.22 -0.29 0.00 0.00 176.35 177.62 1wny s LEU 340 N 1.23 3.30 0.19 -0.68 2.96 -1.26 -4.91 118.68 119.51 1wny s LEU 340 Ca 0.37 0.45 -0.31 0.00 -0.22 0.00 0.00 54.13 54.42 1wny s LEU 340 Cb -0.05 -2.52 -0.10 0.00 0.50 0.00 0.00 46.19 44.02 1wny s LEU 340 CO -0.04 -2.58 1.53 -0.75 -1.32 0.00 0.00 176.35 173.19 1wny s LYS 341 N 7.42 4.22 -0.03 1.98 2.20 -1.26 -4.35 119.74 129.91 1wny s LYS 341 Ca 0.76 2.35 0.01 0.00 -0.36 0.00 0.00 55.97 58.73 1wny s LYS 341 Cb -0.13 -3.14 -0.03 0.00 -1.51 0.00 0.00 37.83 33.02 1wny s LYS 341 CO 0.20 -0.55 -0.02 2.41 -0.36 0.00 0.00 175.35 177.03 1wny n THR 342 N 3.41 0.20 -4.20 3.43 -1.04 -1.26 -4.69 114.28 110.13 1wny n THR 342 Ca 0.12 -0.10 -0.16 0.00 -2.04 0.00 0.00 64.05 61.87 1wny n THR 342 Cb 0.39 -0.74 -0.13 0.00 -1.82 0.00 0.00 70.33 68.02 1wny n THR 342 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1wny s VAL 343 N -2.07 0.63 0.49 12.58 0.11 -1.26 -0.40 120.40 130.48 1wny s VAL 343 Ca -0.04 -0.65 -0.04 0.00 -2.93 0.00 0.00 61.98 58.32 1wny s VAL 343 Cb 0.01 -0.59 0.10 0.00 -1.53 0.00 0.00 36.38 34.37 1wny s VAL 343 CO 0.10 -0.04 0.67 -0.90 -3.33 0.00 0.00 175.10 171.59 1wny n ASP 344 N 2.30 0.46 0.30 3.54 5.68 -0.18 -4.91 116.55 123.74 1wny n ASP 344 Ca -0.17 -1.49 0.18 0.00 -0.50 0.00 0.00 54.79 52.81 1wny n ASP 344 Cb 0.56 -0.47 0.92 0.00 -1.14 0.00 0.00 41.12 41.00 1wny n ASP 344 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1wny h GLU 345 N 0.00 0.00 -0.25 0.11 4.11 -2.02 -0.99 114.58 115.54 1wny h GLU 345 Ca -0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.21 1wny h GLU 345 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1wny h GLU 345 CO 0.19 0.04 0.00 0.39 0.07 0.00 0.00 179.01 179.70 1wny n GLU 346 N -3.34 1.92 -1.07 1.06 4.71 -1.26 -4.91 120.64 117.76 1wny n GLU 346 Ca -0.02 -1.40 -0.02 0.00 -0.01 0.00 0.00 57.16 55.71 1wny n GLU 346 Cb 0.17 -1.41 -0.01 0.00 -1.01 0.00 0.00 31.44 29.19 1wny n GLU 346 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1wny n GLY 347 N 1.21 0.56 3.81 0.62 0.00 -0.37 -4.91 105.19 106.11 1wny n GLY 347 Ca 0.16 -0.94 -0.37 0.00 0.00 0.00 0.00 46.02 44.87 1wny n GLY 347 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wny s LYS 348 N -2.15 3.82 0.59 1.61 -0.14 -1.26 -0.41 119.74 121.80 1wny s LYS 348 Ca 0.00 -0.03 -0.20 0.00 -1.36 0.00 0.00 55.97 54.38 1wny s LYS 348 Cb 0.00 -3.29 -0.03 0.00 -1.68 0.00 0.00 37.83 32.83 1wny s LYS 348 CO 0.00 0.57 1.29 -0.51 -0.76 0.00 0.00 175.35 175.93 1wny s LEU 349 N -0.47 3.71 0.00 3.17 2.01 0.49 -1.01 118.68 126.58 1wny s LEU 349 Ca 0.15 2.60 0.10 0.00 0.01 0.00 0.00 54.13 56.99 1wny s LEU 349 Cb -0.13 -4.48 0.03 0.00 0.01 0.00 0.00 46.19 41.62 1wny s LEU 349 CO 0.04 -1.71 0.71 0.18 1.01 0.00 0.00 176.35 176.58 1wny n LEU 350 N -1.47 1.46 -4.36 1.79 4.77 0.47 -1.11 117.00 118.56 1wny n LEU 350 Ca 0.13 -0.86 -0.28 0.00 -0.03 0.00 0.00 56.01 54.98 1wny n LEU 350 Cb 0.47 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.44 1wny n LEU 350 CO 0.48 0.29 -0.55 0.68 -1.33 0.00 0.00 177.39 176.96 1wny s VAL 351 N -1.15 2.09 0.57 4.08 -7.23 -1.26 -4.84 120.40 112.66 1wny s VAL 351 Ca 0.10 -1.68 -0.20 0.00 -1.81 0.00 0.00 61.98 58.40 1wny s VAL 351 Cb 0.08 -1.86 -0.04 0.00 0.56 0.00 0.00 36.38 35.12 1wny s VAL 351 CO 0.20 0.06 1.22 -1.83 -0.31 0.00 0.00 175.10 174.44 1wny s GLU 352 N -1.97 3.08 -0.26 4.82 -1.05 -1.26 -1.71 118.70 120.35 1wny s GLU 352 Ca 0.12 1.87 0.05 0.00 -0.15 0.00 0.00 54.97 56.86 1wny s GLU 352 Cb -0.10 -2.02 0.50 0.00 -0.44 0.00 0.00 34.13 32.06 1wny s GLU 352 CO 0.05 -1.13 1.54 -0.35 0.95 0.00 0.00 175.26 176.32 1wny n PRO 353 N -1.39 2.49 -0.16 -4.83 -0.04 -1.26 -4.87 135.00 124.93 1wny n PRO 353 Ca 0.13 -2.10 0.09 0.00 -0.04 0.00 0.00 63.50 61.58 1wny n PRO 353 Cb 0.49 -1.88 0.15 0.00 -0.04 0.00 0.00 33.50 32.21 1wny n PRO 353 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1wny n PHE 354 N -0.27 0.00 -1.67 0.54 3.01 -0.69 -5.06 117.46 113.33 1wny n PHE 354 Ca 0.34 -1.08 -0.46 0.00 1.01 0.00 0.00 57.45 57.26 1wny n PHE 354 Cb 1.17 -0.17 -0.04 0.00 -0.01 0.00 0.00 39.48 40.43 1wny n PHE 354 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1wny n LYS 355 N -1.38 2.14 -0.21 -1.08 5.02 -1.10 -1.59 118.16 119.96 1wny n LYS 355 Ca 0.16 0.77 0.00 0.00 -2.02 0.00 0.00 58.31 57.22 1wny n LYS 355 Cb 0.65 -2.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.13 1wny n LYS 355 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wny n GLY 356 N 3.34 1.71 3.77 0.72 0.00 -0.26 -4.96 105.19 109.51 1wny n GLY 356 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1wny n GLY 356 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wny s LEU 357 N 0.00 4.43 0.44 0.99 1.43 -0.62 -4.77 118.68 120.58 1wny s LEU 357 Ca 0.00 1.18 -0.25 0.00 -1.03 0.00 0.00 54.13 54.03 1wny s LEU 357 Cb 0.00 -2.92 -0.08 0.00 0.03 0.00 0.00 46.19 43.22 1wny s LEU 357 CO 0.00 0.13 1.37 -0.47 0.23 0.00 0.00 176.35 177.61 1wny s TYR 358 N -0.34 2.61 0.39 0.29 5.04 -1.26 -0.38 117.35 123.71 1wny s TYR 358 Ca 0.31 1.33 0.11 0.00 -2.44 0.00 0.00 57.07 56.38 1wny s TYR 358 Cb -0.18 -3.80 0.91 0.00 0.35 0.00 0.00 41.96 39.24 1wny s TYR 358 CO 0.17 -2.55 1.93 0.27 -1.34 0.00 0.00 175.55 174.04 1wny h PHE 359 N 2.43 0.62 -0.40 4.97 -5.15 -1.09 -0.08 116.94 118.25 1wny h PHE 359 Ca -0.50 0.02 -0.09 0.00 -0.20 0.00 0.00 57.97 57.20 1wny h PHE 359 Cb 1.26 -0.20 -0.02 0.00 0.22 0.00 0.00 35.95 37.21 1wny h PHE 359 CO 0.51 0.28 -0.11 0.00 -2.00 0.00 0.00 178.31 176.99 1wny h ARG 360 N 0.57 0.71 -0.14 6.09 2.47 -1.91 0.19 114.38 122.36 1wny h ARG 360 Ca 0.35 -0.23 -0.21 0.00 -1.26 0.00 0.00 59.98 58.63 1wny h ARG 360 Cb 0.59 -0.06 0.01 0.00 -1.65 0.00 0.00 29.97 28.86 1wny h ARG 360 CO -0.12 0.80 -0.74 1.49 0.56 0.00 0.00 179.97 181.96 1wny h GLU 361 N 0.65 0.75 -0.46 0.04 4.81 -1.46 -3.01 114.58 115.89 1wny h GLU 361 Ca 0.11 -0.62 -0.04 0.00 -0.13 0.00 0.00 59.36 58.68 1wny h GLU 361 Cb 0.57 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.06 1wny h GLU 361 CO 0.04 1.23 0.11 0.00 -0.73 0.00 0.00 179.01 179.65 1wny h ALA 362 N 0.53 1.33 -0.32 2.92 0.00 -0.88 -1.44 119.26 121.39 1wny h ALA 362 Ca -0.05 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.71 1wny h ALA 362 Cb 1.37 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1wny h ALA 362 CO 0.15 0.47 0.13 -0.97 0.00 0.00 0.00 179.25 179.04 1wny h ASN 363 N 0.67 0.16 -0.55 0.00 -1.24 -0.88 0.23 115.58 113.98 1wny h ASN 363 Ca 0.15 0.03 -0.08 0.00 0.71 0.00 0.00 56.30 57.11 1wny h ASN 363 Cb 0.25 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.29 1wny h ASN 363 CO -0.00 0.13 0.02 0.03 -1.29 0.00 0.00 177.43 176.31 1wny h ARG 364 N 0.28 0.95 -0.75 6.67 3.08 -1.37 -2.30 114.38 120.94 1wny h ARG 364 Ca 0.14 -0.29 -0.03 0.00 0.07 0.00 0.00 59.98 59.87 1wny h ARG 364 Cb 0.10 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 1wny h ARG 364 CO -0.13 0.95 0.36 0.00 -1.07 0.00 0.00 179.97 180.09 1wny h ALA 365 N 0.96 0.96 -0.42 0.04 0.00 -0.78 -2.75 119.26 117.28 1wny h ALA 365 Ca 0.16 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1wny h ALA 365 Cb 0.51 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1wny h ALA 365 CO 0.02 0.52 0.25 0.82 0.00 0.00 0.00 179.25 180.87 1wny h ILE 366 N 1.05 1.13 -0.52 0.00 2.04 -0.39 0.12 117.51 120.94 1wny h ILE 366 Ca 0.26 -0.31 0.08 0.00 1.00 0.00 0.00 64.86 65.88 1wny h ILE 366 Cb 0.11 0.58 -0.06 0.00 -0.74 0.00 0.00 36.82 36.71 1wny h ILE 366 CO -0.03 0.14 0.18 -0.07 0.00 0.00 0.00 178.15 178.36 1wny h LEU 367 N 0.56 0.16 -0.39 1.44 3.38 -1.23 0.11 115.31 119.34 1wny h LEU 367 Ca 0.15 0.07 -0.13 0.00 0.09 0.00 0.00 57.88 58.06 1wny h LEU 367 Cb -0.00 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1wny h LEU 367 CO -0.03 0.12 -0.25 -0.09 0.09 0.00 0.00 178.44 178.28 1wny h ARG 368 N 0.35 0.86 -0.04 1.13 2.43 -1.16 -1.02 114.38 116.92 1wny h ARG 368 Ca 0.25 -0.40 0.01 0.00 -0.81 0.00 0.00 59.98 59.03 1wny h ARG 368 Cb 0.29 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1wny h ARG 368 CO -0.27 1.04 0.00 0.22 -1.51 0.00 0.00 179.97 179.46 1wny h ASP 369 N 0.66 -0.01 -0.63 -3.80 3.58 -0.40 -1.31 116.42 114.51 1wny h ASP 369 Ca 0.08 0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.50 1wny h ASP 369 Cb 0.82 0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.86 1wny h ASP 369 CO 0.07 0.00 0.25 -0.07 -2.88 0.00 0.00 179.24 176.61 1wny h LEU 370 N 0.02 0.88 0.13 2.28 3.38 -0.72 -2.02 115.31 119.25 1wny h LEU 370 Ca 0.02 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.83 1wny h LEU 370 Cb 0.02 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1wny h LEU 370 CO -0.03 0.81 -0.18 -0.09 0.09 0.00 0.00 178.44 179.05 1wny h ARG 371 N 0.89 -0.35 0.00 1.13 2.43 -0.97 -0.07 114.38 117.45 1wny h ARG 371 Ca 0.21 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.37 1wny h ARG 371 Cb 0.21 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 1wny h ARG 371 CO -0.02 -0.23 -0.18 0.78 -1.51 0.00 0.00 179.97 178.81 1wny h GLY 372 N -0.36 0.00 -0.25 2.80 0.00 -1.13 -2.41 103.07 101.72 1wny h GLY 372 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1wny h GLY 372 CO -0.08 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.00 1wny n ARG 373 N -3.97 1.51 -1.05 4.80 1.74 -0.77 -4.92 116.66 114.01 1wny n ARG 373 Ca -0.02 -0.75 -0.02 0.00 -0.77 0.00 0.00 57.85 56.29 1wny n ARG 373 Cb 0.27 -1.43 -0.01 0.00 -1.02 0.00 0.00 32.46 30.27 1wny n ARG 373 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wny n GLY 374 N 1.08 0.53 0.30 -0.13 0.00 -0.91 -4.92 105.19 101.14 1wny n GLY 374 Ca 0.18 -0.49 0.12 0.00 0.00 0.00 0.00 46.02 45.82 1wny n GLY 374 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wny n LEU 375 N -0.19 1.41 -4.50 0.99 4.32 -0.08 -4.80 117.00 114.15 1wny n LEU 375 Ca -0.02 -0.48 -0.43 0.00 -0.02 0.00 0.00 56.01 55.06 1wny n LEU 375 Cb 0.09 -0.07 -0.07 0.00 -1.62 0.00 0.00 43.42 41.75 1wny n LEU 375 CO 0.03 0.27 0.29 -0.22 -1.22 0.00 0.00 177.39 176.54 1wny s LEU 376 N -2.59 4.64 -0.05 2.23 2.96 -1.13 -1.20 118.68 123.54 1wny s LEU 376 Ca 0.19 -0.47 -0.23 0.00 -0.22 0.00 0.00 54.13 53.39 1wny s LEU 376 Cb 0.18 -2.61 -0.18 0.00 0.50 0.00 0.00 46.19 44.08 1wny s LEU 376 CO 0.60 -0.73 0.95 0.15 -1.32 0.00 0.00 176.35 176.00 1wny h PHE 377 N 8.84 -0.13 -1.76 5.38 3.04 -1.27 -3.48 116.94 127.55 1wny h PHE 377 Ca -0.26 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 61.71 1wny h PHE 377 Cb 1.10 0.04 -0.21 0.00 2.56 0.00 0.00 35.95 39.44 1wny h PHE 377 CO 0.69 0.37 0.38 0.21 -2.02 0.00 0.00 178.31 177.95 1wny s LYS 378 N -3.48 0.80 0.18 1.11 2.20 -1.16 -5.00 119.74 114.39 1wny s LYS 378 Ca -0.14 0.22 -0.02 0.00 -0.36 0.00 0.00 55.97 55.67 1wny s LYS 378 Cb 0.00 0.38 -0.04 0.00 -1.51 0.00 0.00 37.83 36.66 1wny s LYS 378 CO 0.54 -0.25 0.38 -1.21 -0.36 0.00 0.00 175.35 174.46 1wny s GLU 379 N -1.09 3.54 -0.12 4.03 2.02 -1.26 -1.16 118.70 124.65 1wny s GLU 379 Ca -0.06 -0.29 -0.00 0.00 0.02 0.00 0.00 54.97 54.64 1wny s GLU 379 Cb -0.00 -2.85 0.02 0.00 0.10 0.00 0.00 34.13 31.40 1wny s GLU 379 CO 0.05 0.42 -0.09 -2.00 0.02 0.00 0.00 175.26 173.66 1wny s GLU 380 N -3.15 1.72 0.00 1.61 2.56 0.38 -4.98 118.70 116.84 1wny s GLU 380 Ca 0.39 -0.33 0.00 0.00 0.00 0.00 0.00 54.97 55.03 1wny s GLU 380 Cb -0.11 -1.71 0.00 0.00 2.00 0.00 0.00 34.13 34.30 1wny s GLU 380 CO 0.28 -0.26 0.00 0.45 -0.56 0.00 0.00 175.26 175.18