#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1buq s ASN 202 N 0.00 5.25 -0.47 3.17 4.22 -1.26 -5.05 114.94 120.80 1buq s ASN 202 Ca 0.00 -2.03 -0.22 0.00 -2.14 0.00 0.00 52.86 48.48 1buq s ASN 202 Cb 0.00 -1.83 0.03 0.00 1.28 0.00 0.00 41.25 40.74 1buq s ASN 202 CO 0.00 -0.54 0.73 0.28 -2.04 0.00 0.00 177.10 175.53 1buq s THR 203 N 1.14 4.71 -1.80 0.54 -1.32 -1.26 -4.88 115.64 112.77 1buq s THR 203 Ca 0.08 0.12 0.19 0.00 -1.21 0.00 0.00 61.69 60.87 1buq s THR 203 Cb -0.23 -4.31 0.47 0.00 -1.51 0.00 0.00 72.50 66.92 1buq s THR 203 CO -0.04 -0.76 1.55 -0.81 -2.21 0.00 0.00 174.62 172.35 1buq n PRO 204 N 6.59 0.49 -0.06 7.08 -0.04 -1.26 -3.40 135.00 144.40 1buq n PRO 204 Ca -0.01 0.04 -0.10 0.00 -0.04 0.00 0.00 63.50 63.39 1buq n PRO 204 Cb 0.47 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.40 1buq n PRO 204 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1buq h GLU 205 N 0.00 0.32 0.38 0.54 5.08 -1.96 1.43 114.58 120.37 1buq h GLU 205 Ca 0.00 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1buq h GLU 205 Cb 0.06 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1buq h GLU 205 CO 0.00 0.35 -0.18 1.25 -1.00 0.00 0.00 179.01 179.43 1buq h HIS 206 N 0.21 -0.47 -0.80 4.33 2.76 -1.99 0.26 115.15 119.44 1buq h HIS 206 Ca 0.07 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.22 1buq h HIS 206 Cb 0.15 0.16 -0.04 0.00 1.55 0.00 0.00 27.41 29.22 1buq h HIS 206 CO -0.02 -0.17 0.45 0.52 -1.30 0.00 0.00 177.93 177.41 1buq h MET 207 N -0.75 1.11 -0.44 5.26 2.86 -1.72 -1.94 114.93 119.31 1buq h MET 207 Ca -0.05 -0.12 -0.06 0.00 -2.06 0.00 0.00 59.70 57.41 1buq h MET 207 Cb 0.51 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 1buq h MET 207 CO 0.09 0.81 0.05 1.15 1.06 0.00 0.00 176.91 180.06 1buq h THR 208 N 1.11 1.22 -0.88 2.22 2.02 0.21 -2.32 112.91 116.48 1buq h THR 208 Ca 0.28 -0.85 0.19 0.00 0.77 0.00 0.00 66.41 66.80 1buq h THR 208 Cb 0.01 0.83 -0.11 0.00 -1.74 0.00 0.00 68.15 67.15 1buq h THR 208 CO -0.05 0.30 0.43 0.00 0.37 0.00 0.00 175.52 176.58 1buq h ALA 209 N 1.39 1.39 0.00 6.16 0.00 0.33 2.19 119.26 130.73 1buq h ALA 209 Ca 0.14 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1buq h ALA 209 Cb 0.35 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1buq h ALA 209 CO 0.01 -0.21 -0.00 0.28 0.00 0.00 0.00 179.25 179.33 1buq h VAL 210 N 0.53 0.07 0.14 0.00 2.07 -1.38 -1.31 116.25 116.37 1buq h VAL 210 Ca 0.52 -0.00 -0.35 0.00 0.82 0.00 0.00 66.70 67.69 1buq h VAL 210 Cb 0.87 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1buq h VAL 210 CO -0.44 0.00 -1.85 0.58 0.02 0.00 0.00 177.57 175.88 1buq h VAL 211 N 0.00 0.77 0.00 2.57 2.07 0.35 -2.92 116.25 119.08 1buq h VAL 211 Ca -0.00 -2.40 0.00 0.00 0.82 0.00 0.00 66.70 65.12 1buq h VAL 211 Cb 0.00 2.60 0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1buq h VAL 211 CO 0.00 0.86 0.00 1.67 0.02 0.00 0.00 177.57 180.12 1buq n GLN 212 N -3.59 0.00 -0.31 1.57 7.27 0.12 -1.22 117.38 121.23 1buq n GLN 212 Ca -0.29 0.28 0.13 0.00 0.07 0.00 0.00 57.00 57.19 1buq n GLN 212 Cb 1.04 -1.24 0.28 0.00 2.41 0.00 0.00 30.24 32.72 1buq n GLN 212 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1buq h ARG 213 N 0.00 0.11 -0.86 3.69 3.08 -1.53 1.84 114.38 120.71 1buq h ARG 213 Ca 0.00 -0.01 0.18 0.00 0.07 0.00 0.00 59.98 60.23 1buq h ARG 213 Cb 0.00 -0.02 -0.11 0.00 0.08 0.00 0.00 29.97 29.92 1buq h ARG 213 CO 0.00 0.07 0.39 -0.92 -1.07 0.00 0.00 179.97 178.45 1buq h TYR 214 N 0.11 0.67 0.10 3.04 5.03 -1.38 0.13 116.97 124.68 1buq h TYR 214 Ca 0.56 0.04 -0.35 0.00 2.58 0.00 0.00 58.73 61.56 1buq h TYR 214 Cb 1.14 -0.16 -0.02 0.00 1.55 0.00 0.00 36.73 39.23 1buq h TYR 214 CO -0.36 0.05 -1.91 0.28 -1.32 0.00 0.00 178.16 174.90 1buq h VAL 215 N 0.48 0.70 -1.03 1.81 2.07 0.29 -3.12 116.25 117.46 1buq h VAL 215 Ca 0.51 -2.44 0.26 0.00 0.82 0.00 0.00 66.70 65.85 1buq h VAL 215 Cb 0.86 2.51 -0.08 0.00 -1.52 0.00 0.00 31.29 33.06 1buq h VAL 215 CO -0.46 0.82 0.67 0.00 0.02 0.00 0.00 177.57 178.62 1buq h ALA 216 N 0.28 2.30 -0.01 1.67 0.00 0.30 2.33 119.26 126.13 1buq h ALA 216 Ca -0.39 0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.41 1buq h ALA 216 Cb 2.03 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.83 1buq h ALA 216 CO 0.10 -0.68 -0.75 0.00 0.00 0.00 0.00 179.25 177.92 1buq h ALA 217 N 1.60 0.73 0.54 0.00 0.00 -0.86 -2.06 119.26 119.22 1buq h ALA 217 Ca 0.57 -0.67 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1buq h ALA 217 Cb 1.50 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 19.19 1buq h ALA 217 CO -0.25 0.90 -0.26 -0.07 0.00 0.00 0.00 179.25 179.56 1buq h LEU 218 N 0.04 -0.62 -0.71 0.00 3.38 0.36 2.25 115.31 120.01 1buq h LEU 218 Ca -0.02 -0.04 0.14 0.00 0.09 0.00 0.00 57.88 58.05 1buq h LEU 218 Cb 1.32 0.16 -0.10 0.00 0.09 0.00 0.00 40.66 42.14 1buq h LEU 218 CO 0.10 -0.24 0.23 -1.13 0.09 0.00 0.00 178.44 177.49 1buq h ASN 219 N -1.07 0.14 -0.06 -0.43 -0.00 0.14 0.51 115.58 114.81 1buq h ASN 219 Ca -0.07 0.12 0.00 0.00 -0.00 0.00 0.00 56.30 56.35 1buq h ASN 219 Cb 0.62 0.13 0.00 0.00 -0.00 0.00 0.00 38.32 39.08 1buq h ASN 219 CO 0.12 0.04 0.00 0.00 -0.00 0.00 0.00 177.43 177.59 1buq n ALA 220 N -2.57 2.56 -3.82 1.57 0.00 -0.78 -4.84 120.51 112.63 1buq n ALA 220 Ca 0.13 -0.45 -0.26 0.00 0.00 0.00 0.00 53.44 52.85 1buq n ALA 220 Cb 0.41 -1.16 0.03 0.00 0.00 0.00 0.00 19.45 18.73 1buq n ALA 220 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1buq n GLY 221 N 1.15 -0.41 3.28 0.00 0.00 0.55 -4.90 105.19 104.85 1buq n GLY 221 Ca 0.18 0.17 -0.43 0.00 0.00 0.00 0.00 46.02 45.94 1buq n GLY 221 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1buq s ASP 222 N -3.74 6.76 0.56 1.61 2.15 0.63 -4.86 116.67 119.77 1buq s ASP 222 Ca 0.39 -3.30 0.25 0.00 0.43 0.00 0.00 52.55 50.32 1buq s ASP 222 Cb -0.19 -2.13 1.34 0.00 -0.30 0.00 0.00 42.92 41.64 1buq s ASP 222 CO 0.82 -0.36 1.73 -0.07 -0.17 0.00 0.00 175.17 177.12 1buq h LEU 223 N 6.90 0.00 0.58 -1.34 -0.00 -1.91 -1.85 115.31 117.70 1buq h LEU 223 Ca 0.14 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 57.99 1buq h LEU 223 Cb 0.92 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.58 1buq h LEU 223 CO 0.88 0.00 -0.28 -0.78 -0.00 0.00 0.00 178.44 178.26 1buq h ASP 224 N 0.00 -0.66 0.18 -0.43 1.82 -1.95 0.32 116.42 115.70 1buq h ASP 224 Ca 0.00 -0.03 -0.02 0.00 -0.39 0.00 0.00 57.03 56.58 1buq h ASP 224 Cb 0.64 0.17 -0.00 0.00 0.68 0.00 0.00 39.33 40.82 1buq h ASP 224 CO 0.00 -0.34 -0.11 1.23 -1.61 0.00 0.00 179.24 178.40 1buq h GLY 225 N -0.98 0.00 0.53 -0.78 0.00 -1.73 0.65 103.07 100.76 1buq h GLY 225 Ca -0.08 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.22 1buq h GLY 225 CO 0.13 0.00 -0.25 -2.22 0.00 0.00 0.00 176.54 174.20 1buq h ILE 226 N 0.00 0.00 -0.98 2.60 2.04 -1.29 0.40 117.51 120.29 1buq h ILE 226 Ca -0.00 -0.34 0.02 0.00 1.00 0.00 0.00 64.86 65.54 1buq h ILE 226 Cb 0.23 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.26 1buq h ILE 226 CO 0.01 0.00 0.64 0.58 0.00 0.00 0.00 178.15 179.39 1buq h VAL 227 N -1.05 1.22 0.01 1.67 2.07 -0.74 0.24 116.25 119.67 1buq h VAL 227 Ca -0.07 -0.44 0.03 0.00 0.82 0.00 0.00 66.70 67.03 1buq h VAL 227 Cb 0.54 -0.18 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 1buq h VAL 227 CO 0.12 0.24 -0.22 0.00 0.02 0.00 0.00 177.57 177.72 1buq h ALA 228 N 1.37 -0.29 0.00 1.67 0.00 0.37 0.34 119.26 122.72 1buq h ALA 228 Ca 0.37 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1buq h ALA 228 Cb -0.10 0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1buq h ALA 228 CO -0.10 -0.72 -0.02 1.25 0.00 0.00 0.00 179.25 179.66 1buq h LEU 229 N -0.35 0.00 -9.65 0.00 5.85 0.76 -3.41 115.31 108.51 1buq h LEU 229 Ca 0.06 0.00 -0.60 0.00 0.84 0.00 0.00 57.88 58.18 1buq h LEU 229 Cb 0.43 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 1buq h LEU 229 CO -0.20 0.02 -0.18 -0.36 -0.34 0.00 0.00 178.44 177.39 1buq s PHE 230 N -4.15 3.72 0.63 1.25 0.40 0.12 -1.68 117.98 118.27 1buq s PHE 230 Ca -0.03 1.02 -0.08 0.00 -0.60 0.00 0.00 56.93 57.23 1buq s PHE 230 Cb 0.13 -2.34 0.13 0.00 0.51 0.00 0.00 43.02 41.45 1buq s PHE 230 CO 0.49 0.60 0.28 0.00 0.70 0.00 0.00 175.22 177.29 1buq n ALA 231 N 1.97 -1.73 0.23 5.36 0.00 -0.33 -4.79 120.51 121.20 1buq n ALA 231 Ca -0.13 -0.50 0.10 0.00 0.00 0.00 0.00 53.44 52.90 1buq n ALA 231 Cb 0.52 -0.05 0.54 0.00 0.00 0.00 0.00 19.45 20.46 1buq n ALA 231 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1buq h ASP 232 N -2.36 0.00 -0.99 0.00 5.19 -1.88 -3.29 116.42 113.08 1buq h ASP 232 Ca -0.13 0.00 -0.36 0.00 -0.62 0.00 0.00 57.03 55.92 1buq h ASP 232 Cb 0.44 0.00 -0.35 0.00 0.18 0.00 0.00 39.33 39.60 1buq h ASP 232 CO 0.08 0.22 -1.03 -0.90 -3.12 0.00 0.00 179.24 174.49 1buq n ASP 233 N -3.57 0.60 -4.73 6.45 5.75 -1.26 0.72 116.55 120.50 1buq n ASP 233 Ca -0.01 -2.78 -0.32 0.00 -0.01 0.00 0.00 54.79 51.67 1buq n ASP 233 Cb 0.36 -0.18 0.11 0.00 -1.03 0.00 0.00 41.12 40.39 1buq n ASP 233 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1buq s ALA 234 N -2.29 1.98 0.04 2.12 0.00 -1.24 -3.46 121.76 118.92 1buq s ALA 234 Ca 0.29 0.50 0.02 0.00 0.00 0.00 0.00 51.96 52.77 1buq s ALA 234 Cb 0.42 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 20.13 1buq s ALA 234 CO -0.01 -2.08 0.02 0.95 0.00 0.00 0.00 175.76 174.64 1buq s THR 235 N -2.62 4.24 -0.17 0.00 -4.23 0.14 -2.82 115.64 110.18 1buq s THR 235 Ca 0.66 -0.72 -0.04 0.00 -1.18 0.00 0.00 61.69 60.40 1buq s THR 235 Cb -0.21 -2.96 0.07 0.00 1.34 0.00 0.00 72.50 70.73 1buq s THR 235 CO 0.54 0.26 0.12 -0.69 -0.54 0.00 0.00 174.62 174.31 1buq s VAL 236 N -1.21 -0.16 -0.54 2.29 1.01 -1.24 0.22 120.40 120.77 1buq s VAL 236 Ca 0.23 -0.09 -0.22 0.00 0.00 0.00 0.00 61.98 61.90 1buq s VAL 236 Cb -0.12 -0.56 0.05 0.00 0.00 0.00 0.00 36.38 35.76 1buq s VAL 236 CO 0.15 -0.22 0.81 -1.61 0.00 0.00 0.00 175.10 174.23 1buq s GLU 237 N 2.19 3.22 0.00 2.72 0.41 0.14 -2.97 118.70 124.42 1buq s GLU 237 Ca 0.03 -0.59 0.00 0.00 -0.41 0.00 0.00 54.97 54.01 1buq s GLU 237 Cb -0.16 -4.09 0.00 0.00 -1.78 0.00 0.00 34.13 28.11 1buq s GLU 237 CO -0.09 -1.40 0.00 -3.47 -0.49 0.00 0.00 175.26 169.81 1buq n ASP 238 N 6.92 0.00 -4.35 -0.19 2.03 -1.26 -1.08 116.55 118.61 1buq n ASP 238 Ca -0.02 0.00 -0.29 0.00 0.52 0.00 0.00 54.79 54.99 1buq n ASP 238 Cb 0.46 0.00 0.18 0.00 -0.72 0.00 0.00 41.12 41.05 1buq n ASP 238 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1buq s PRO 239 N -1.32 0.21 -0.28 -0.67 0.04 -1.26 -4.50 135.00 127.21 1buq s PRO 239 Ca 0.00 0.08 -0.29 0.00 0.04 0.00 0.00 61.00 60.83 1buq s PRO 239 Cb 0.00 -1.75 -0.02 0.00 0.04 0.00 0.00 34.50 32.77 1buq s PRO 239 CO 0.00 -2.79 1.65 0.14 0.04 0.00 0.00 177.00 176.04 1buq s VAL 240 N -3.27 3.65 0.00 -0.36 -7.23 -1.26 -1.98 120.40 109.96 1buq s VAL 240 Ca 0.68 0.71 0.00 0.00 -1.81 0.00 0.00 61.98 61.56 1buq s VAL 240 Cb -0.12 -3.75 0.00 0.00 0.56 0.00 0.00 36.38 33.07 1buq s VAL 240 CO 0.55 -0.39 0.00 0.61 -0.31 0.00 0.00 175.10 175.56 1buq n GLY 241 N 4.96 0.93 0.00 2.32 0.00 -1.26 -5.08 105.19 107.06 1buq n GLY 241 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1buq n GLY 241 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1buq n SER 242 N 0.00 0.00 -3.79 1.61 7.64 -0.84 -5.14 113.62 113.10 1buq n SER 242 Ca 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.75 1buq n SER 242 Cb 0.00 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.06 1buq n SER 242 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1buq s GLU 243 N 4.48 0.05 0.22 1.43 2.02 -1.26 -4.95 118.70 120.69 1buq s GLU 243 Ca 0.00 0.23 -0.04 0.00 0.02 0.00 0.00 54.97 55.18 1buq s GLU 243 Cb 0.00 -0.12 0.06 0.00 0.10 0.00 0.00 34.13 34.16 1buq s GLU 243 CO 0.00 -0.11 0.15 -0.35 0.02 0.00 0.00 175.26 174.96 1buq n PRO 244 N 3.79 -2.08 -3.33 0.39 -0.04 -1.25 -4.62 135.00 127.87 1buq n PRO 244 Ca -0.22 -0.24 -0.12 0.00 -0.04 0.00 0.00 63.50 62.88 1buq n PRO 244 Cb 0.54 -0.28 -0.07 0.00 -0.04 0.00 0.00 33.50 33.65 1buq n PRO 244 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1buq s ARG 245 N -3.35 0.48 0.27 0.54 6.06 -1.16 -4.95 118.95 116.86 1buq s ARG 245 Ca 0.11 -0.20 -0.11 0.00 -2.50 0.00 0.00 55.73 53.03 1buq s ARG 245 Cb -0.02 -0.45 -0.08 0.00 0.06 0.00 0.00 34.95 34.47 1buq s ARG 245 CO 0.09 -1.09 0.63 -1.54 -2.50 0.00 0.00 175.30 170.89 1buq s SER 246 N 2.18 6.66 0.00 -2.12 1.04 -1.26 -3.02 113.70 117.19 1buq s SER 246 Ca 0.12 1.05 0.00 0.00 0.48 0.00 0.00 55.95 57.60 1buq s SER 246 Cb -0.13 -2.28 0.00 0.00 0.10 0.00 0.00 66.02 63.71 1buq s SER 246 CO -0.23 -0.14 0.00 0.61 0.98 0.00 0.00 173.24 174.46 1buq n GLY 247 N -0.32 2.34 0.25 7.32 0.00 -1.13 -4.33 105.19 109.33 1buq n GLY 247 Ca 0.02 -1.97 -0.09 0.00 0.00 0.00 0.00 46.02 43.98 1buq n GLY 247 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1buq h THR 248 N 0.00 0.00 -0.14 2.61 2.02 -0.01 1.09 112.91 118.48 1buq h THR 248 Ca 0.00 -0.43 0.04 0.00 0.77 0.00 0.00 66.41 66.79 1buq h THR 248 Cb 0.00 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.40 1buq h THR 248 CO 0.00 0.00 0.26 0.00 0.37 0.00 0.00 175.52 176.15 1buq h ALA 249 N -1.30 1.59 0.02 6.16 0.00 -1.90 -0.96 119.26 122.87 1buq h ALA 249 Ca -0.06 -0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.62 1buq h ALA 249 Cb 0.45 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1buq h ALA 249 CO 0.10 -0.33 -1.20 0.00 0.00 0.00 0.00 179.25 177.82 1buq h ALA 250 N 1.60 0.24 -0.75 0.00 0.00 -1.72 -2.02 119.26 116.61 1buq h ALA 250 Ca 0.07 -1.14 0.11 0.00 0.00 0.00 0.00 54.91 53.95 1buq h ALA 250 Cb 0.59 0.64 -0.08 0.00 0.00 0.00 0.00 17.79 18.94 1buq h ALA 250 CO -0.00 0.69 0.37 0.82 0.00 0.00 0.00 179.25 181.12 1buq h ILE 251 N -0.85 0.79 0.06 0.00 1.08 0.20 0.30 117.51 119.09 1buq h ILE 251 Ca -0.31 -0.20 -0.00 0.00 -0.39 0.00 0.00 64.86 63.95 1buq h ILE 251 Cb 1.37 0.15 0.00 0.00 -3.07 0.00 0.00 36.82 35.28 1buq h ILE 251 CO -0.14 0.11 -0.03 -0.09 -0.69 0.00 0.00 178.15 177.31 1buq h ARG 252 N 0.59 -0.08 -0.90 2.37 2.43 -1.36 0.19 114.38 117.63 1buq h ARG 252 Ca 0.39 0.01 0.26 0.00 -0.81 0.00 0.00 59.98 59.82 1buq h ARG 252 Cb 0.47 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.00 1buq h ARG 252 CO -0.31 0.52 0.78 0.93 -1.51 0.00 0.00 179.97 180.38 1buq h GLU 253 N -0.86 0.00 0.00 0.20 5.08 -0.97 2.16 114.58 120.20 1buq h GLU 253 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1buq h GLU 253 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1buq h GLU 253 CO 0.01 0.00 0.00 0.34 -1.00 0.00 0.00 179.01 178.36 1buq n PHE 254 N -3.86 0.00 0.26 4.33 7.35 0.10 -2.05 117.46 123.59 1buq n PHE 254 Ca 0.19 0.00 0.16 0.00 -0.76 0.00 0.00 57.45 57.04 1buq n PHE 254 Cb 1.08 -0.29 0.76 0.00 0.35 0.00 0.00 39.48 41.38 1buq n PHE 254 CO 0.00 0.00 0.00 0.35 -0.76 0.00 0.00 176.76 176.35 1buq h PHE 255 N 0.00 0.00 0.08 -5.13 3.04 -0.25 0.23 116.94 114.92 1buq h PHE 255 Ca 0.00 0.00 -0.11 0.00 3.98 0.00 0.00 57.97 61.84 1buq h PHE 255 Cb 0.00 0.00 0.01 0.00 2.56 0.00 0.00 35.95 38.52 1buq h PHE 255 CO 0.00 0.00 -0.51 0.00 -2.02 0.00 0.00 178.31 175.78 1buq h ALA 256 N 1.32 -0.04 -0.28 2.41 0.00 0.34 -2.72 119.26 120.30 1buq h ALA 256 Ca 0.06 -0.64 0.05 0.00 0.00 0.00 0.00 54.91 54.39 1buq h ALA 256 Cb 0.86 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1buq h ALA 256 CO -0.00 0.24 0.19 -0.97 0.00 0.00 0.00 179.25 178.72 1buq h ASN 257 N -0.63 0.13 0.39 0.00 -0.73 -0.03 0.34 115.58 115.05 1buq h ASN 257 Ca -0.09 -0.00 -0.12 0.00 1.87 0.00 0.00 56.30 57.95 1buq h ASN 257 Cb 1.38 -0.03 -0.01 0.00 0.27 0.00 0.00 38.32 39.93 1buq h ASN 257 CO 0.08 0.08 -0.52 -1.28 -0.37 0.00 0.00 177.43 175.42 1buq h SER 258 N 0.15 0.16 0.68 1.15 0.87 -1.08 -2.50 113.55 112.98 1buq h SER 258 Ca 0.12 -0.08 -0.09 0.00 -1.23 0.00 0.00 61.79 60.51 1buq h SER 258 Cb 0.31 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 1buq h SER 258 CO -0.02 0.66 -0.43 0.25 -0.53 0.00 0.00 176.83 176.76 1buq h LEU 259 N 0.12 0.00 -1.72 2.23 5.85 -0.02 -2.83 115.31 118.94 1buq h LEU 259 Ca 0.00 0.00 0.35 0.00 0.84 0.00 0.00 57.88 59.07 1buq h LEU 259 Cb 0.97 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.95 1buq h LEU 259 CO 0.08 0.43 1.03 0.11 -0.34 0.00 0.00 178.44 179.74 1buq h LYS 260 N 0.00 0.00 -5.49 1.25 1.57 -0.82 -3.30 116.57 109.77 1buq h LYS 260 Ca -0.00 0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 58.14 1buq h LYS 260 Cb 0.89 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.06 1buq h LYS 260 CO 0.06 0.00 0.15 -1.17 -0.57 0.00 0.00 179.45 177.92 1buq s LEU 261 N -7.52 4.27 -0.43 2.94 0.20 -1.07 -5.00 118.68 112.07 1buq s LEU 261 Ca -0.04 0.12 -0.28 0.00 0.69 0.00 0.00 54.13 54.62 1buq s LEU 261 Cb 0.20 -2.79 -0.00 0.00 -0.43 0.00 0.00 46.19 43.16 1buq s LEU 261 CO 0.68 -0.62 1.61 -2.16 -0.29 0.00 0.00 176.35 175.57 1buq s PRO 262 N 2.74 3.33 0.12 0.98 0.04 -1.25 -4.97 135.00 135.99 1buq s PRO 262 Ca 0.25 1.00 0.01 0.00 0.04 0.00 0.00 61.00 62.29 1buq s PRO 262 Cb -0.14 -4.15 -0.04 0.00 0.04 0.00 0.00 34.50 30.21 1buq s PRO 262 CO 0.15 -1.88 -0.01 -0.48 0.04 0.00 0.00 177.00 174.83 1buq s LEU 263 N 6.52 2.22 -0.23 -3.56 2.34 -1.26 -4.25 118.68 120.45 1buq s LEU 263 Ca 0.67 -1.10 -0.14 0.00 0.06 0.00 0.00 54.13 53.62 1buq s LEU 263 Cb -0.16 0.07 -0.04 0.00 -0.56 0.00 0.00 46.19 45.50 1buq s LEU 263 CO 0.30 -0.58 0.32 0.00 -1.06 0.00 0.00 176.35 175.33 1buq s ALA 264 N -3.79 3.57 -0.29 1.48 0.00 0.11 -4.82 121.76 118.02 1buq s ALA 264 Ca 0.17 -0.72 -0.09 0.00 0.00 0.00 0.00 51.96 51.33 1buq s ALA 264 Cb 0.07 -2.56 -0.02 0.00 0.00 0.00 0.00 23.12 20.61 1buq s ALA 264 CO -0.02 -0.37 0.12 0.08 0.00 0.00 0.00 175.76 175.57 1buq s VAL 265 N 1.45 4.49 -0.26 0.00 1.01 -1.26 -2.48 120.40 123.35 1buq s VAL 265 Ca 0.14 -0.32 -0.02 0.00 0.00 0.00 0.00 61.98 61.78 1buq s VAL 265 Cb -0.15 -3.22 0.12 0.00 0.00 0.00 0.00 36.38 33.14 1buq s VAL 265 CO 0.08 0.17 0.30 -0.70 0.00 0.00 0.00 175.10 174.95 1buq s GLU 266 N 1.61 0.30 0.98 2.72 2.12 -1.23 -4.60 118.70 120.60 1buq s GLU 266 Ca 0.05 0.12 -0.17 0.00 0.36 0.00 0.00 54.97 55.33 1buq s GLU 266 Cb -0.16 -0.75 0.05 0.00 0.26 0.00 0.00 34.13 33.52 1buq s GLU 266 CO 0.05 -0.84 -0.22 1.28 -0.54 0.00 0.00 175.26 174.99 1buq n LEU 267 N 5.33 -2.07 0.00 2.70 4.77 -1.26 -3.87 117.00 122.60 1buq n LEU 267 Ca -0.03 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 1buq n LEU 267 Cb 0.48 -0.73 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 1buq n LEU 267 CO 0.04 -2.88 0.00 1.07 -1.33 0.00 0.00 177.39 174.28 1buq n THR 268 N -4.05 0.00 -1.36 -5.08 5.66 -1.26 -4.84 114.28 103.35 1buq n THR 268 Ca 0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.02 1buq n THR 268 Cb 0.48 -0.01 0.00 0.00 -1.55 0.00 0.00 70.33 69.25 1buq n THR 268 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1buq n GLN 269 N -1.53 3.80 -4.22 1.09 10.64 -1.26 -5.09 117.38 120.81 1buq n GLN 269 Ca 0.00 0.00 -0.34 0.00 -1.83 0.00 0.00 57.00 54.83 1buq n GLN 269 Cb 0.00 0.00 -0.11 0.00 -0.86 0.00 0.00 30.24 29.27 1buq n GLN 269 CO 0.00 0.00 0.00 -2.00 -1.83 0.00 0.00 177.06 173.23 1buq s GLU 270 N 3.51 3.78 0.52 2.61 2.12 -1.26 -5.07 118.70 124.91 1buq s GLU 270 Ca 0.00 -0.43 -0.21 0.00 0.36 0.00 0.00 54.97 54.69 1buq s GLU 270 Cb 0.00 -3.05 -0.06 0.00 0.26 0.00 0.00 34.13 31.29 1buq s GLU 270 CO 0.00 0.29 1.21 0.08 -0.54 0.00 0.00 175.26 176.30 1buq s VAL 271 N 0.28 2.79 -0.14 3.70 1.01 -1.26 -4.85 120.40 121.93 1buq s VAL 271 Ca 0.00 0.56 -0.06 0.00 0.00 0.00 0.00 61.98 62.48 1buq s VAL 271 Cb -0.13 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 1buq s VAL 271 CO 0.02 -0.04 0.08 -0.60 0.00 0.00 0.00 175.10 174.55 1buq s ARG 272 N -2.95 3.56 -0.06 2.72 6.06 0.40 -4.96 118.95 123.73 1buq s ARG 272 Ca 0.69 -0.27 -0.14 0.00 -2.50 0.00 0.00 55.73 53.51 1buq s ARG 272 Cb -0.31 -3.12 0.03 0.00 0.06 0.00 0.00 34.95 31.61 1buq s ARG 272 CO 0.36 0.56 0.33 0.00 -2.50 0.00 0.00 175.30 174.05 1buq s ALA 273 N -0.43 -0.83 -0.16 6.12 0.00 -1.26 0.61 121.76 125.81 1buq s ALA 273 Ca 0.10 0.58 -0.28 0.00 0.00 0.00 0.00 51.96 52.36 1buq s ALA 273 Cb -0.12 -0.16 0.08 0.00 0.00 0.00 0.00 23.12 22.92 1buq s ALA 273 CO 0.02 -0.23 0.78 0.14 0.00 0.00 0.00 175.76 176.47 1buq s VAL 274 N -0.78 0.00 0.00 0.00 -7.23 -1.11 -4.92 120.40 106.37 1buq s VAL 274 Ca -0.09 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.08 1buq s VAL 274 Cb -0.04 -1.00 0.00 0.00 0.56 0.00 0.00 36.38 35.90 1buq s VAL 274 CO 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.82 1buq n ALA 275 N 1.54 0.00 -2.24 1.32 0.00 -1.26 0.25 120.51 120.12 1buq n ALA 275 Ca -0.15 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.27 1buq n ALA 275 Cb 0.56 0.00 0.08 0.00 0.00 0.00 0.00 19.45 20.09 1buq n ALA 275 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1buq n ASN 276 N 2.54 2.05 0.00 0.00 3.02 -1.26 -4.86 115.26 116.75 1buq n ASN 276 Ca 0.00 -2.86 0.00 0.00 -0.03 0.00 0.00 54.58 51.69 1buq n ASN 276 Cb 0.00 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 38.76 1buq n ASN 276 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1buq n GLU 277 N -0.41 0.10 0.00 3.52 2.13 0.14 0.27 120.64 126.39 1buq n GLU 277 Ca 0.17 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.99 1buq n GLU 277 Cb 0.91 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.62 1buq n GLU 277 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1buq n ALA 278 N -3.00 0.00 -3.59 4.31 0.00 -0.81 -2.75 120.51 114.67 1buq n ALA 278 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 1buq n ALA 278 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.29 1buq n ALA 278 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1buq s ALA 279 N -1.96 0.49 0.31 0.00 0.00 0.20 0.23 121.76 121.04 1buq s ALA 279 Ca 0.00 0.03 -0.07 0.00 0.00 0.00 0.00 51.96 51.92 1buq s ALA 279 Cb 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 23.12 22.78 1buq s ALA 279 CO 0.00 -0.02 0.49 -0.59 0.00 0.00 0.00 175.76 175.64 1buq s PHE 280 N 0.85 0.75 0.33 0.00 -0.12 0.10 0.15 117.98 120.05 1buq s PHE 280 Ca -0.10 -1.07 -0.03 0.00 -0.05 0.00 0.00 56.93 55.68 1buq s PHE 280 Cb -0.13 0.07 0.01 0.00 -0.63 0.00 0.00 43.02 42.35 1buq s PHE 280 CO -0.01 -1.11 0.49 0.00 -0.05 0.00 0.00 175.22 174.54 1buq n ALA 281 N -0.49 -0.49 -3.00 1.99 0.00 -1.26 0.24 120.51 117.50 1buq n ALA 281 Ca -0.01 -1.47 0.00 0.00 0.00 0.00 0.00 53.44 51.96 1buq n ALA 281 Cb 0.62 1.19 0.00 0.00 0.00 0.00 0.00 19.45 21.25 1buq n ALA 281 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1buq n PHE 282 N -0.54 -0.08 -4.17 0.00 -1.74 -1.05 -4.60 117.46 105.30 1buq n PHE 282 Ca -0.01 0.00 -0.16 0.00 -0.56 0.00 0.00 57.45 56.72 1buq n PHE 282 Cb 0.55 0.00 -0.12 0.00 1.52 0.00 0.00 39.48 41.43 1buq n PHE 282 CO 0.00 0.00 0.00 0.95 -0.56 0.00 0.00 176.76 177.15 1buq s THR 283 N -2.35 0.76 -0.19 1.97 -4.23 -1.25 -3.53 115.64 106.82 1buq s THR 283 Ca 0.00 -0.97 0.01 0.00 -1.18 0.00 0.00 61.69 59.55 1buq s THR 283 Cb 0.00 -0.75 0.03 0.00 1.34 0.00 0.00 72.50 73.13 1buq s THR 283 CO 0.00 -0.18 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.08 1buq s VAL 284 N -1.04 1.73 -0.27 2.29 1.01 0.21 -3.56 120.40 120.77 1buq s VAL 284 Ca -0.04 -0.95 -0.04 0.00 0.00 0.00 0.00 61.98 60.95 1buq s VAL 284 Cb -0.08 -1.72 0.02 0.00 0.00 0.00 0.00 36.38 34.60 1buq s VAL 284 CO 0.01 0.29 0.01 -0.94 0.00 0.00 0.00 175.10 174.47 1buq s SER 285 N 1.38 4.73 0.17 3.32 1.04 -1.04 0.50 113.70 123.81 1buq s SER 285 Ca 0.01 -0.82 -0.04 0.00 0.48 0.00 0.00 55.95 55.57 1buq s SER 285 Cb -0.15 -1.77 -0.03 0.00 0.10 0.00 0.00 66.02 64.17 1buq s SER 285 CO -0.09 -0.17 0.18 0.72 0.98 0.00 0.00 173.24 174.87 1buq s PHE 286 N 1.40 0.79 0.03 5.02 -0.71 -1.05 0.04 117.98 123.50 1buq s PHE 286 Ca 0.01 -1.11 -0.06 0.00 -1.04 0.00 0.00 56.93 54.73 1buq s PHE 286 Cb -0.17 -0.33 -0.01 0.00 -1.21 0.00 0.00 43.02 41.31 1buq s PHE 286 CO -0.01 -0.66 0.11 -2.00 -1.34 0.00 0.00 175.22 171.32 1buq s GLU 287 N -4.06 0.56 0.00 1.99 2.12 -1.26 -2.69 118.70 115.35 1buq s GLU 287 Ca 0.27 -0.64 0.00 0.00 0.36 0.00 0.00 54.97 54.96 1buq s GLU 287 Cb 0.05 0.22 0.00 0.00 0.26 0.00 0.00 34.13 34.67 1buq s GLU 287 CO 0.06 -0.14 0.32 1.97 -0.54 0.00 0.00 175.26 176.93 1buq n PHE 288 N 0.99 0.00 -1.33 5.30 -1.74 -1.26 -4.96 117.46 114.46 1buq n PHE 288 Ca -0.20 -0.04 0.00 0.00 -0.56 0.00 0.00 57.45 56.64 1buq n PHE 288 Cb 0.57 -0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.57 1buq n PHE 288 CO 0.00 0.00 0.00 0.94 -0.56 0.00 0.00 176.76 177.14 1buq n GLN 289 N -0.04 0.00 0.05 3.97 7.27 -1.26 -4.97 117.38 122.39 1buq n GLN 289 Ca 0.00 0.00 0.11 0.00 0.07 0.00 0.00 57.00 57.18 1buq n GLN 289 Cb 0.31 0.00 0.46 0.00 2.41 0.00 0.00 30.24 33.41 1buq n GLN 289 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1buq n GLY 290 N 0.00 -1.34 3.49 1.69 0.00 -1.26 -4.69 105.19 103.08 1buq n GLY 290 Ca 0.00 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 1buq n GLY 290 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1buq s ARG 291 N -3.09 2.50 0.38 1.61 0.52 -1.26 -5.00 118.95 114.61 1buq s ARG 291 Ca 0.09 -0.70 0.04 0.00 -0.52 0.00 0.00 55.73 54.64 1buq s ARG 291 Cb 0.13 -2.39 -0.05 0.00 0.52 0.00 0.00 34.95 33.15 1buq s ARG 291 CO 0.43 0.62 0.05 -1.59 0.02 0.00 0.00 175.30 174.84 1buq s LYS 292 N -0.80 1.83 0.29 3.54 -2.85 -1.19 -4.00 119.74 116.55 1buq s LYS 292 Ca 0.12 -2.06 -0.17 0.00 -1.00 0.00 0.00 55.97 52.86 1buq s LYS 292 Cb -0.11 -1.06 0.02 0.00 -2.06 0.00 0.00 37.83 34.62 1buq s LYS 292 CO 0.01 -0.23 0.64 0.99 0.10 0.00 0.00 175.35 176.85 1buq s THR 293 N -3.11 0.00 0.20 3.79 2.01 -1.10 -0.28 115.64 117.16 1buq s THR 293 Ca 0.30 -1.17 0.02 0.00 0.31 0.00 0.00 61.69 61.15 1buq s THR 293 Cb 0.07 -2.21 -0.05 0.00 0.01 0.00 0.00 72.50 70.32 1buq s THR 293 CO 0.14 0.00 0.02 0.54 -0.69 0.00 0.00 174.62 174.64 1buq s VAL 294 N -3.71 0.70 0.02 3.82 0.11 -1.26 -2.54 120.40 117.55 1buq s VAL 294 Ca 0.16 -1.99 0.02 0.00 -2.93 0.00 0.00 61.98 57.24 1buq s VAL 294 Cb -0.04 -2.28 -0.01 0.00 -1.53 0.00 0.00 36.38 32.52 1buq s VAL 294 CO 0.09 -0.33 -0.06 -0.69 -3.33 0.00 0.00 175.10 170.78 1buq s VAL 295 N -3.64 0.40 -0.49 2.04 1.01 0.18 -0.51 120.40 119.38 1buq s VAL 295 Ca 0.28 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 61.64 1buq s VAL 295 Cb 0.06 -0.43 0.23 0.00 0.00 0.00 0.00 36.38 36.24 1buq s VAL 295 CO 0.07 -0.20 0.55 0.00 0.00 0.00 0.00 175.10 175.52 1buq n ALA 296 N 2.11 3.05 -2.55 5.51 0.00 0.73 0.68 120.51 130.05 1buq n ALA 296 Ca -0.19 -3.84 -0.17 0.00 0.00 0.00 0.00 53.44 49.25 1buq n ALA 296 Cb 0.56 -0.85 0.08 0.00 0.00 0.00 0.00 19.45 19.25 1buq n ALA 296 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1buq n PRO 297 N 1.58 0.13 -4.19 0.00 -0.04 -1.23 -4.59 135.00 126.66 1buq n PRO 297 Ca 0.25 -1.99 -0.16 0.00 -0.04 0.00 0.00 63.50 61.56 1buq n PRO 297 Cb 0.47 -0.46 -0.13 0.00 -0.04 0.00 0.00 33.50 33.34 1buq n PRO 297 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1buq s ILE 298 N -2.13 0.64 0.37 0.52 1.09 -0.21 -2.52 121.20 118.96 1buq s ILE 298 Ca 0.48 -0.70 0.08 0.00 -1.10 0.00 0.00 60.65 59.41 1buq s ILE 298 Cb -0.03 -0.61 -0.06 0.00 -1.06 0.00 0.00 42.46 40.70 1buq s ILE 298 CO 0.32 -0.07 0.03 -0.62 -0.10 0.00 0.00 174.94 174.50 1buq s ASP 299 N -0.84 4.09 0.46 3.58 -1.08 0.65 -0.11 116.67 123.41 1buq s ASP 299 Ca -0.02 -1.12 0.05 0.00 -0.52 0.00 0.00 52.55 50.94 1buq s ASP 299 Cb -0.06 -0.46 -0.04 0.00 -1.46 0.00 0.00 42.92 40.89 1buq s ASP 299 CO 0.00 -0.34 0.09 -2.28 0.52 0.00 0.00 175.17 173.16 1buq s HIS 300 N -2.59 2.24 -0.03 -5.34 2.46 0.69 -0.72 115.29 111.99 1buq s HIS 300 Ca 0.36 -0.76 -0.08 0.00 0.47 0.00 0.00 55.06 55.05 1buq s HIS 300 Cb 0.03 -1.78 0.01 0.00 -0.13 0.00 0.00 32.58 30.71 1buq s HIS 300 CO 0.19 0.23 0.18 -0.06 -2.47 0.00 0.00 174.74 172.81 1buq s PHE 301 N -2.75 -0.09 -0.31 3.88 0.08 0.62 -3.84 117.98 115.58 1buq s PHE 301 Ca 0.27 0.19 -0.03 0.00 0.12 0.00 0.00 56.93 57.49 1buq s PHE 301 Cb 0.05 0.02 0.10 0.00 -0.57 0.00 0.00 43.02 42.62 1buq s PHE 301 CO 0.14 -0.22 0.13 0.50 -0.10 0.00 0.00 175.22 175.67 1buq s ARG 302 N -0.76 0.39 0.74 0.44 3.52 0.21 -1.92 118.95 121.57 1buq s ARG 302 Ca -0.08 -0.79 -0.03 0.00 -0.13 0.00 0.00 55.73 54.69 1buq s ARG 302 Cb -0.05 -1.42 0.12 0.00 -1.56 0.00 0.00 34.95 32.05 1buq s ARG 302 CO 0.01 -1.03 1.03 -0.06 -0.81 0.00 0.00 175.30 174.43 1buq s PHE 303 N 1.83 1.80 -0.01 5.12 0.40 0.75 -2.12 117.98 125.75 1buq s PHE 303 Ca 0.10 -0.11 0.01 0.00 -0.60 0.00 0.00 56.93 56.34 1buq s PHE 303 Cb -0.17 -3.15 -0.02 0.00 0.51 0.00 0.00 43.02 40.19 1buq s PHE 303 CO -0.29 -1.76 0.01 0.27 0.70 0.00 0.00 175.22 174.16 1buq n ASN 304 N -2.94 4.66 0.15 1.36 0.23 -1.26 -4.62 115.26 112.84 1buq n ASN 304 Ca 0.14 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.19 1buq n ASN 304 Cb 0.60 0.69 0.00 0.00 -2.08 0.00 0.00 39.78 39.00 1buq n ASN 304 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1buq n GLY 305 N 2.77 -1.77 0.00 4.83 0.00 -1.26 -4.97 105.19 104.78 1buq n GLY 305 Ca -0.02 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.39 1buq n GLY 305 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1buq n ALA 306 N -3.10 0.00 0.00 4.61 0.00 -1.26 -4.80 120.51 115.96 1buq n ALA 306 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1buq n ALA 306 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1buq n ALA 306 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1buq n GLY 307 N 0.00 -1.08 1.07 0.00 0.00 -1.26 -5.00 105.19 98.91 1buq n GLY 307 Ca 0.00 0.38 -0.08 0.00 0.00 0.00 0.00 46.02 46.32 1buq n GLY 307 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1buq n LYS 308 N 0.00 1.32 -4.52 1.61 2.85 -1.26 -4.93 118.16 113.22 1buq n LYS 308 Ca 0.00 -0.98 -0.26 0.00 -1.05 0.00 0.00 58.31 56.02 1buq n LYS 308 Cb 0.00 0.13 -0.10 0.00 -0.65 0.00 0.00 35.03 34.41 1buq n LYS 308 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1buq s VAL 309 N -0.87 2.30 0.00 0.58 1.01 -0.67 -4.51 120.40 118.24 1buq s VAL 309 Ca 0.08 -2.21 0.00 0.00 0.00 0.00 0.00 61.98 59.84 1buq s VAL 309 Cb -0.01 -2.62 0.00 0.00 0.00 0.00 0.00 36.38 33.76 1buq s VAL 309 CO 0.05 -0.23 0.00 0.52 0.00 0.00 0.00 175.10 175.44 1buq n VAL 310 N -0.78 0.00 -4.21 2.92 0.31 -0.90 -1.19 118.33 114.47 1buq n VAL 310 Ca -0.05 0.00 -0.23 0.00 -0.01 0.00 0.00 64.34 64.05 1buq n VAL 310 Cb 0.63 -0.22 -0.07 0.00 -0.91 0.00 0.00 33.84 33.27 1buq n VAL 310 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1buq s SER 311 N -2.77 4.60 -0.27 4.52 0.01 -0.90 -0.68 113.70 118.22 1buq s SER 311 Ca 0.00 -0.71 -0.23 0.00 1.31 0.00 0.00 55.95 56.32 1buq s SER 311 Cb 0.00 -0.79 0.07 0.00 0.21 0.00 0.00 66.02 65.51 1buq s SER 311 CO 0.00 -0.14 0.71 -0.32 0.41 0.00 0.00 173.24 173.90 1buq s MET 312 N -3.75 0.81 0.21 12.44 1.75 0.13 -0.62 119.30 130.27 1buq s MET 312 Ca 0.34 1.04 0.08 0.00 -1.25 0.00 0.00 55.69 55.91 1buq s MET 312 Cb -0.04 0.35 -0.05 0.00 2.84 0.00 0.00 34.83 37.94 1buq s MET 312 CO 0.21 -0.11 -0.16 1.03 -0.65 0.00 0.00 175.02 175.35 1buq s ARG 313 N 0.63 1.35 0.11 4.11 0.52 -1.25 -0.68 118.95 123.74 1buq s ARG 313 Ca -0.02 -1.58 0.08 0.00 -0.52 0.00 0.00 55.73 53.69 1buq s ARG 313 Cb -0.05 -1.22 -0.04 0.00 0.52 0.00 0.00 34.95 34.17 1buq s ARG 313 CO -0.03 0.21 -0.21 0.00 0.02 0.00 0.00 175.30 175.29 1buq s ALA 314 N -2.78 1.81 -0.01 2.13 0.00 -0.24 0.25 121.76 122.91 1buq s ALA 314 Ca 0.22 -1.26 -0.01 0.00 0.00 0.00 0.00 51.96 50.91 1buq s ALA 314 Cb -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 22.86 1buq s ALA 314 CO 0.08 0.35 0.03 -1.17 0.00 0.00 0.00 175.76 175.05 1buq s LEU 315 N -1.96 1.88 0.00 0.00 0.20 0.84 -4.63 118.68 115.01 1buq s LEU 315 Ca 0.07 0.03 0.00 0.00 0.69 0.00 0.00 54.13 54.92 1buq s LEU 315 Cb -0.10 0.13 0.00 0.00 -0.43 0.00 0.00 46.19 45.80 1buq s LEU 315 CO 0.04 -0.04 0.00 2.22 -0.29 0.00 0.00 176.35 178.29 1buq n PHE 316 N 2.94 0.00 -2.53 5.38 -1.74 -1.26 -1.05 117.46 119.20 1buq n PHE 316 Ca -0.13 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.76 1buq n PHE 316 Cb 0.59 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.59 1buq n PHE 316 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1buq n GLY 317 N 0.00 -1.39 0.00 4.97 0.00 -1.26 -4.94 105.19 102.57 1buq n GLY 317 Ca 0.00 -0.98 0.06 0.00 0.00 0.00 0.00 46.02 45.10 1buq n GLY 317 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1buq n GLU 318 N -0.08 0.14 0.01 1.61 2.13 -1.26 -1.87 120.64 121.33 1buq n GLU 318 Ca 0.00 0.19 -0.11 0.00 0.66 0.00 0.00 57.16 57.91 1buq n GLU 318 Cb 0.00 -1.50 -0.14 0.00 0.27 0.00 0.00 31.44 30.07 1buq n GLU 318 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1buq h LYS 319 N 0.00 0.07 -0.55 5.31 3.64 -1.99 -3.28 116.57 119.77 1buq h LYS 319 Ca 0.00 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1buq h LYS 319 Cb 0.14 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1buq h LYS 319 CO 0.00 0.76 0.00 0.09 -2.27 0.00 0.00 179.45 178.03 1buq n ASN 320 N -3.21 2.51 -1.38 4.20 5.03 -0.78 -4.87 115.26 116.75 1buq n ASN 320 Ca -0.15 -2.19 0.00 0.00 0.87 0.00 0.00 54.58 53.11 1buq n ASN 320 Cb 1.03 -0.39 0.00 0.00 -1.02 0.00 0.00 39.78 39.40 1buq n ASN 320 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 1buq n ILE 321 N 0.45 0.00 -3.58 2.41 2.08 -1.20 0.26 119.36 119.77 1buq n ILE 321 Ca 0.13 0.00 -0.03 0.00 0.56 0.00 0.00 62.75 63.40 1buq n ILE 321 Cb 0.48 -0.96 -0.00 0.00 -0.75 0.00 0.00 39.64 38.41 1buq n ILE 321 CO 0.00 0.00 0.00 1.57 0.56 0.00 0.00 176.55 178.68 1buq n HIS 322 N -0.66 -0.84 -3.67 1.39 -0.00 0.33 -4.54 115.22 107.24 1buq n HIS 322 Ca 0.00 -0.56 -0.08 0.00 0.46 0.00 0.00 57.72 57.54 1buq n HIS 322 Cb 0.00 0.16 -0.09 0.00 -0.12 0.00 0.00 29.99 29.94 1buq n HIS 322 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1buq s ALA 323 N -1.73 -1.45 -0.05 1.57 0.00 -1.26 -4.47 121.76 114.37 1buq s ALA 323 Ca 0.06 1.94 0.05 0.00 0.00 0.00 0.00 51.96 54.01 1buq s ALA 323 Cb -0.00 -1.21 -0.01 0.00 0.00 0.00 0.00 23.12 21.90 1buq s ALA 323 CO 0.05 -0.39 -0.22 0.20 0.00 0.00 0.00 175.76 175.40 1buq s GLY 324 N 1.68 1.15 0.00 0.00 0.00 0.61 -4.84 107.32 105.93 1buq s GLY 324 Ca -0.09 -0.91 0.00 0.00 0.00 0.00 0.00 44.72 43.72 1buq s GLY 324 CO -0.16 -0.52 0.34 0.00 0.00 0.00 0.00 173.10 172.76