#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g42 n PRO 220 N 0.00 0.00 -0.84 -0.67 -0.02 -1.26 0.23 135.00 132.44 3g42 n PRO 220 Ca 0.00 0.06 0.03 0.00 -2.02 0.00 0.00 63.50 61.57 3g42 n PRO 220 Cb 0.00 -1.61 0.34 0.00 -0.02 0.00 0.00 33.50 32.21 3g42 n PRO 220 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3g42 n MET 221 N -0.83 4.22 -3.50 -0.52 2.81 -1.26 -4.41 117.12 113.62 3g42 n MET 221 Ca 0.00 -2.79 -0.27 0.00 -1.81 0.00 0.00 57.70 52.83 3g42 n MET 221 Cb 0.11 -2.17 -0.10 0.00 -0.71 0.00 0.00 33.22 30.35 3g42 n MET 221 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3g42 n LYS 222 N 0.39 0.86 0.00 0.03 5.02 0.61 -1.91 118.16 123.16 3g42 n LYS 222 Ca 0.28 -3.63 0.00 0.00 -2.02 0.00 0.00 58.31 52.94 3g42 n LYS 222 Cb 1.15 -1.81 0.00 0.00 -0.02 0.00 0.00 35.03 34.35 3g42 n LYS 222 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3g42 n ASN 223 N 2.27 0.55 -4.03 4.39 2.04 -0.68 -4.69 115.26 115.11 3g42 n ASN 223 Ca 0.26 -1.22 -0.29 0.00 -0.44 0.00 0.00 54.58 52.89 3g42 n ASN 223 Cb 0.45 0.00 -0.17 0.00 -2.53 0.00 0.00 39.78 37.53 3g42 n ASN 223 CO 0.00 0.00 0.00 -0.89 -0.44 0.00 0.00 177.26 175.93 3g42 s THR 224 N -0.22 1.50 -0.42 5.53 2.01 -0.33 -1.60 115.64 122.11 3g42 s THR 224 Ca 0.00 -0.61 -0.24 0.00 0.31 0.00 0.00 61.69 61.15 3g42 s THR 224 Cb 0.00 -1.40 0.02 0.00 0.01 0.00 0.00 72.50 71.14 3g42 s THR 224 CO 0.00 0.44 0.84 0.00 -0.69 0.00 0.00 174.62 175.21 3g42 s LYS 226 N 3.39 4.76 0.16 0.00 -0.14 -1.26 -1.95 119.74 124.69 3g42 s LYS 226 Ca 0.33 1.51 0.10 0.00 -1.36 0.00 0.00 55.97 56.55 3g42 s LYS 226 Cb -0.12 -3.31 -0.04 0.00 -1.68 0.00 0.00 37.83 32.68 3g42 s LYS 226 CO 0.22 0.34 -0.17 -0.51 -0.76 0.00 0.00 175.35 174.46 3g42 s LEU 227 N -0.64 2.70 -0.27 3.17 1.43 0.10 -2.26 118.68 122.90 3g42 s LEU 227 Ca 0.44 -0.65 -0.07 0.00 -1.03 0.00 0.00 54.13 52.82 3g42 s LEU 227 Cb -0.26 -1.47 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 3g42 s LEU 227 CO 0.32 0.14 0.07 -0.22 0.23 0.00 0.00 176.35 176.89 3g42 s LEU 228 N -2.49 3.65 -0.21 1.79 2.96 -0.22 0.37 118.68 124.54 3g42 s LEU 228 Ca 0.21 -0.47 -0.05 0.00 -0.22 0.00 0.00 54.13 53.59 3g42 s LEU 228 Cb -0.09 -1.90 -0.02 0.00 0.50 0.00 0.00 46.19 44.68 3g42 s LEU 228 CO 0.11 -0.12 0.00 -0.69 -1.32 0.00 0.00 176.35 174.33 3g42 s VAL 229 N 1.55 3.92 -0.08 1.68 1.01 0.12 -0.73 120.40 127.87 3g42 s VAL 229 Ca 0.05 -0.32 0.04 0.00 0.00 0.00 0.00 61.98 61.75 3g42 s VAL 229 Cb -0.16 -2.78 -0.00 0.00 0.00 0.00 0.00 36.38 33.44 3g42 s VAL 229 CO 0.03 0.42 -0.23 -0.69 0.00 0.00 0.00 175.10 174.63 3g42 s VAL 230 N 1.09 1.97 -0.24 2.92 1.01 -0.41 -0.15 120.40 126.59 3g42 s VAL 230 Ca 0.02 -0.98 -0.03 0.00 0.00 0.00 0.00 61.98 60.99 3g42 s VAL 230 Cb -0.14 -1.69 0.01 0.00 0.00 0.00 0.00 36.38 34.55 3g42 s VAL 230 CO 0.01 0.54 -0.03 0.00 0.00 0.00 0.00 175.10 175.62 3g42 s ALA 231 N 0.22 2.79 1.06 5.51 0.00 -0.39 -0.30 121.76 130.66 3g42 s ALA 231 Ca -0.14 -1.35 -0.17 0.00 0.00 0.00 0.00 51.96 50.30 3g42 s ALA 231 Cb -0.16 -1.76 0.23 0.00 0.00 0.00 0.00 23.12 21.43 3g42 s ALA 231 CO 0.07 -0.68 1.23 0.16 0.00 0.00 0.00 175.76 176.54 3g42 s ASP 232 N 1.41 2.23 0.47 0.00 3.84 -1.06 -0.86 116.67 122.70 3g42 s ASP 232 Ca 0.03 0.43 0.16 0.00 -0.00 0.00 0.00 52.55 53.17 3g42 s ASP 232 Cb -0.16 -0.57 1.12 0.00 -1.38 0.00 0.00 42.92 41.93 3g42 s ASP 232 CO -0.03 -3.29 2.03 1.12 -0.00 0.00 0.00 175.17 175.00 3g42 h HIS 233 N -2.02 0.00 -0.41 2.11 2.07 -1.74 -2.14 115.15 113.02 3g42 h HIS 233 Ca -0.45 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 56.98 3g42 h HIS 233 Cb 1.26 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.23 3g42 h HIS 233 CO -1.52 0.14 -0.12 0.00 -3.07 0.00 0.00 177.93 173.36 3g42 h ARG 234 N 0.00 0.80 -0.17 5.12 3.08 -1.91 -1.67 114.38 119.63 3g42 h ARG 234 Ca -0.00 -0.31 -0.12 0.00 0.07 0.00 0.00 59.98 59.61 3g42 h ARG 234 Cb 0.26 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 3g42 h ARG 234 CO 0.02 0.93 -0.43 0.35 -1.07 0.00 0.00 179.97 179.77 3g42 h PHE 235 N 0.61 0.48 0.36 3.04 3.04 -1.76 -1.75 116.94 120.96 3g42 h PHE 235 Ca 0.10 -0.14 -0.02 0.00 3.98 0.00 0.00 57.97 61.89 3g42 h PHE 235 Cb 0.65 -0.10 0.00 0.00 2.56 0.00 0.00 35.95 39.06 3g42 h PHE 235 CO 0.05 0.77 -0.17 -0.92 -2.02 0.00 0.00 178.31 176.02 3g42 h TYR 236 N 0.33 -0.45 0.13 0.41 3.20 -1.20 -0.44 116.97 118.96 3g42 h TYR 236 Ca 0.03 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 3g42 h TYR 236 Cb 0.90 0.15 0.00 0.00 1.54 0.00 0.00 36.73 39.31 3g42 h TYR 236 CO 0.03 -0.24 -0.06 -0.09 -1.64 0.00 0.00 178.16 176.16 3g42 h ARG 237 N -0.55 -0.17 0.01 1.82 2.43 -1.28 0.88 114.38 117.52 3g42 h ARG 237 Ca -0.05 0.01 -0.24 0.00 -0.81 0.00 0.00 59.98 58.89 3g42 h ARG 237 Cb 0.41 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.97 3g42 h ARG 237 CO 0.08 0.16 -1.23 1.88 -1.51 0.00 0.00 179.97 179.35 3g42 h TYR 238 N -0.52 0.04 0.00 2.20 -1.99 -1.41 -3.20 116.97 112.09 3g42 h TYR 238 Ca -0.02 -0.03 -0.37 0.00 2.00 0.00 0.00 58.73 60.32 3g42 h TYR 238 Cb 0.41 -0.00 -0.07 0.00 2.00 0.00 0.00 36.73 39.07 3g42 h TYR 238 CO 0.03 1.03 -2.38 -1.33 -0.00 0.00 0.00 178.16 175.51 3g42 n MET 239 N -3.28 0.61 -0.31 4.88 2.81 -0.27 -4.55 117.12 117.01 3g42 n MET 239 Ca -0.06 0.14 0.08 0.00 -1.81 0.00 0.00 57.70 56.06 3g42 n MET 239 Cb 0.98 -1.48 0.24 0.00 -0.71 0.00 0.00 33.22 32.25 3g42 n MET 239 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g42 n GLY 240 N 2.33 1.63 2.42 3.03 0.00 -0.61 -4.86 105.19 109.12 3g42 n GLY 240 Ca -0.43 -0.59 -0.19 0.00 0.00 0.00 0.00 46.02 44.81 3g42 n GLY 240 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g42 n ARG 241 N 1.04 -1.67 -2.20 1.61 5.12 -1.02 -1.14 116.66 118.40 3g42 n ARG 241 Ca 0.18 0.98 -0.18 0.00 -1.93 0.00 0.00 57.85 56.90 3g42 n ARG 241 Cb 0.50 -5.51 -0.02 0.00 -1.16 0.00 0.00 32.46 26.27 3g42 n ARG 241 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3g42 n GLY 242 N -0.72 -0.01 3.09 -0.13 0.00 0.26 -4.96 105.19 102.71 3g42 n GLY 242 Ca -0.21 -0.14 -0.27 0.00 0.00 0.00 0.00 46.02 45.40 3g42 n GLY 242 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g42 s GLU 243 N -4.66 2.16 0.15 1.61 2.02 -0.29 -5.01 118.70 114.68 3g42 s GLU 243 Ca 0.00 -0.58 -0.16 0.00 0.02 0.00 0.00 54.97 54.26 3g42 s GLU 243 Cb 0.00 -1.71 0.02 0.00 0.10 0.00 0.00 34.13 32.54 3g42 s GLU 243 CO 0.00 0.08 1.77 1.49 0.02 0.00 0.00 175.26 178.62 3g42 h GLU 244 N 6.86 0.59 0.26 1.61 4.81 -1.94 -1.83 114.58 124.95 3g42 h GLU 244 Ca -0.27 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 58.90 3g42 h GLU 244 Cb 1.21 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 3g42 h GLU 244 CO 0.47 0.46 -0.21 0.66 -0.73 0.00 0.00 179.01 179.67 3g42 h SER 245 N 0.57 -0.53 -0.62 1.04 4.64 -1.96 -0.01 113.55 116.68 3g42 h SER 245 Ca 0.15 0.04 0.07 0.00 -0.47 0.00 0.00 61.79 61.59 3g42 h SER 245 Cb 0.03 0.17 -0.06 0.00 -0.31 0.00 0.00 62.40 62.23 3g42 h SER 245 CO -0.03 -0.31 0.29 0.74 -0.87 0.00 0.00 176.83 176.65 3g42 h THR 246 N -0.47 0.88 -0.30 2.95 2.02 -1.77 -0.84 112.91 115.37 3g42 h THR 246 Ca -0.02 -0.18 -0.03 0.00 0.77 0.00 0.00 66.41 66.96 3g42 h THR 246 Cb 0.42 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 3g42 h THR 246 CO -0.01 0.10 0.09 0.74 0.37 0.00 0.00 175.52 176.80 3g42 h THR 247 N 0.54 1.21 -0.41 3.16 2.02 -1.11 -2.14 112.91 116.17 3g42 h THR 247 Ca 0.29 -0.68 -0.04 0.00 0.77 0.00 0.00 66.41 66.76 3g42 h THR 247 Cb 0.27 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 3g42 h THR 247 CO -0.23 0.23 0.12 0.74 0.37 0.00 0.00 175.52 176.75 3g42 h THR 248 N 0.33 1.22 -0.61 3.16 2.02 -0.67 -2.64 112.91 115.73 3g42 h THR 248 Ca 0.10 -0.74 -0.09 0.00 0.77 0.00 0.00 66.41 66.45 3g42 h THR 248 Cb 0.26 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 67.57 3g42 h THR 248 CO -0.00 0.26 0.04 0.78 0.37 0.00 0.00 175.52 176.97 3g42 h ASN 249 N 0.53 1.00 -0.24 4.18 2.35 -1.15 -0.28 115.58 121.97 3g42 h ASN 249 Ca 0.13 -0.26 0.02 0.00 -0.55 0.00 0.00 56.30 55.64 3g42 h ASN 249 Cb 0.28 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 3g42 h ASN 249 CO -0.00 1.03 0.12 0.22 -1.65 0.00 0.00 177.43 177.15 3g42 h TYR 250 N 0.95 0.21 -0.38 1.19 3.20 -1.27 -0.65 116.97 120.23 3g42 h TYR 250 Ca 0.18 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.94 3g42 h TYR 250 Cb 0.50 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 3g42 h TYR 250 CO 0.03 0.12 -0.23 -0.07 -1.64 0.00 0.00 178.16 176.37 3g42 h LEU 251 N 0.25 0.86 -0.41 2.82 3.38 -1.30 -1.41 115.31 119.49 3g42 h LEU 251 Ca 0.10 -0.42 0.01 0.00 0.09 0.00 0.00 57.88 57.66 3g42 h LEU 251 Cb 0.03 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 3g42 h LEU 251 CO -0.07 1.09 0.25 0.40 0.09 0.00 0.00 178.44 180.21 3g42 h ILE 252 N 0.62 1.06 -0.51 1.22 2.04 -0.89 -1.06 117.51 119.99 3g42 h ILE 252 Ca 0.08 -0.18 -0.10 0.00 1.00 0.00 0.00 64.86 65.66 3g42 h ILE 252 Cb 0.80 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 3g42 h ILE 252 CO 0.07 0.09 -0.07 -0.33 0.00 0.00 0.00 178.15 177.90 3g42 h GLU 253 N 0.51 0.96 -0.08 2.37 5.08 -1.05 -1.64 114.58 120.73 3g42 h GLU 253 Ca 0.16 -0.34 -0.00 0.00 -1.00 0.00 0.00 59.36 58.17 3g42 h GLU 253 Cb -0.01 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 3g42 h GLU 253 CO -0.06 1.01 0.04 1.25 -1.00 0.00 0.00 179.01 180.24 3g42 h LEU 254 N 0.82 0.10 -1.11 1.33 6.46 -1.05 -0.00 115.31 121.86 3g42 h LEU 254 Ca 0.14 -0.12 0.00 0.00 -0.12 0.00 0.00 57.88 57.78 3g42 h LEU 254 Cb 0.63 -0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 40.49 3g42 h LEU 254 CO 0.04 0.19 0.57 0.40 -0.62 0.00 0.00 178.44 179.02 3g42 h ILE 255 N 0.00 1.23 -0.71 4.05 1.08 -1.17 0.59 117.51 122.58 3g42 h ILE 255 Ca 0.03 -0.44 -0.03 0.00 -0.39 0.00 0.00 64.86 64.02 3g42 h ILE 255 Cb 0.12 -0.05 -0.03 0.00 -3.07 0.00 0.00 36.82 33.79 3g42 h ILE 255 CO -0.00 0.23 0.32 -0.78 -0.69 0.00 0.00 178.15 177.23 3g42 h ASP 256 N 1.19 0.95 -0.34 1.72 3.58 -0.78 0.41 116.42 123.16 3g42 h ASP 256 Ca 0.32 -0.15 -0.14 0.00 0.42 0.00 0.00 57.03 57.48 3g42 h ASP 256 Cb -0.11 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 40.68 3g42 h ASP 256 CO -0.07 0.83 -0.31 0.03 -2.88 0.00 0.00 179.24 176.85 3g42 h ARG 257 N 1.00 0.86 -0.63 0.28 3.08 -0.37 -1.58 114.38 117.03 3g42 h ARG 257 Ca 0.24 -0.40 -0.09 0.00 0.07 0.00 0.00 59.98 59.80 3g42 h ARG 257 Cb 0.15 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 3g42 h ARG 257 CO -0.03 1.05 0.05 0.28 -1.07 0.00 0.00 179.97 180.25 3g42 h VAL 258 N 0.73 1.26 -0.36 2.04 2.07 -0.48 -2.20 116.25 119.30 3g42 h VAL 258 Ca 0.08 -1.09 -0.01 0.00 0.82 0.00 0.00 66.70 66.50 3g42 h VAL 258 Cb 0.86 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 3g42 h VAL 258 CO 0.08 0.40 0.18 -0.78 0.02 0.00 0.00 177.57 177.46 3g42 h ASP 259 N 0.99 0.44 -0.92 0.57 3.58 0.06 -1.93 116.42 119.21 3g42 h ASP 259 Ca 0.19 -0.03 0.01 0.00 0.42 0.00 0.00 57.03 57.61 3g42 h ASP 259 Cb 0.50 -0.11 -0.05 0.00 1.72 0.00 0.00 39.33 41.39 3g42 h ASP 259 CO 0.02 0.38 0.60 0.44 -2.88 0.00 0.00 179.24 177.81 3g42 h ASP 260 N 0.50 1.07 -0.14 2.28 3.32 -0.64 0.20 116.42 123.01 3g42 h ASP 260 Ca 0.13 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 3g42 h ASP 260 Cb 0.05 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.33 3g42 h ASP 260 CO -0.02 0.78 -0.00 0.40 -1.72 0.00 0.00 179.24 178.68 3g42 h ILE 261 N 1.25 1.26 0.20 0.35 2.04 -1.26 -2.80 117.51 118.55 3g42 h ILE 261 Ca 0.34 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.35 3g42 h ILE 261 Cb -0.13 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 3g42 h ILE 261 CO -0.07 0.25 -0.10 1.88 0.00 0.00 0.00 178.15 180.11 3g42 h TYR 262 N -0.02 -0.25 -0.69 1.37 -1.99 -1.10 -2.89 116.97 111.40 3g42 h TYR 262 Ca 0.04 -0.01 0.13 0.00 2.00 0.00 0.00 58.73 60.89 3g42 h TYR 262 Cb 0.38 0.08 -0.09 0.00 2.00 0.00 0.00 36.73 39.10 3g42 h TYR 262 CO 0.04 0.04 0.23 0.00 -0.00 0.00 0.00 178.16 178.47 3g42 h ARG 263 N -0.54 0.37 -0.04 4.88 3.08 -0.19 -1.05 114.38 120.89 3g42 h ARG 263 Ca -0.03 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.00 3g42 h ARG 263 Cb 0.40 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3g42 h ARG 263 CO 0.05 0.24 0.00 0.09 -1.07 0.00 0.00 179.97 179.28 3g42 n ASN 264 N -5.04 0.52 -4.72 7.04 3.02 -1.06 -1.08 115.26 113.94 3g42 n ASN 264 Ca 0.12 -1.40 -0.40 0.00 -0.03 0.00 0.00 54.58 52.87 3g42 n ASN 264 Cb 0.37 -0.02 -0.04 0.00 -0.61 0.00 0.00 39.78 39.47 3g42 n ASN 264 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3g42 s THR 265 N -1.95 5.01 -0.65 3.41 2.01 -0.40 -4.96 115.64 118.11 3g42 s THR 265 Ca 0.34 1.56 -0.16 0.00 0.31 0.00 0.00 61.69 63.75 3g42 s THR 265 Cb 0.17 -4.09 0.15 0.00 0.01 0.00 0.00 72.50 68.73 3g42 s THR 265 CO 0.27 0.23 0.65 0.00 -0.69 0.00 0.00 174.62 175.08 3g42 s ALA 266 N 0.84 3.72 0.60 7.40 0.00 -1.26 -4.33 121.76 128.72 3g42 s ALA 266 Ca 0.40 -2.72 0.32 0.00 0.00 0.00 0.00 51.96 49.97 3g42 s ALA 266 Cb -0.18 -3.43 1.93 0.00 0.00 0.00 0.00 23.12 21.43 3g42 s ALA 266 CO 0.20 -2.21 2.27 -1.49 0.00 0.00 0.00 175.76 174.53 3g42 h TRP 267 N 8.63 0.00 -0.25 0.00 4.06 -1.70 0.13 115.95 126.82 3g42 h TRP 267 Ca -0.16 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.79 3g42 h TRP 267 Cb 1.08 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.24 3g42 h TRP 267 CO 0.86 0.00 0.00 -0.40 -3.56 0.00 0.00 178.44 175.34 3g42 n ASP 268 N -3.71 2.63 -0.75 -3.49 5.68 -1.26 -4.59 116.55 111.06 3g42 n ASP 268 Ca -0.03 -1.92 -0.10 0.00 -0.50 0.00 0.00 54.79 52.25 3g42 n ASP 268 Cb 0.09 -0.17 -0.04 0.00 -1.14 0.00 0.00 41.12 39.86 3g42 n ASP 268 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3g42 n ASN 269 N 0.36 -5.16 0.00 -1.12 3.02 0.03 -4.83 115.26 107.56 3g42 n ASN 269 Ca 0.09 0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.88 3g42 n ASN 269 Cb 0.37 -3.52 0.00 0.00 -0.61 0.00 0.00 39.78 36.02 3g42 n ASN 269 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3g42 n ALA 270 N 1.18 0.00 0.96 5.41 0.00 -1.26 -5.03 120.51 121.77 3g42 n ALA 270 Ca -0.10 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.46 3g42 n ALA 270 Cb 0.49 0.00 0.08 0.00 0.00 0.00 0.00 19.45 20.02 3g42 n ALA 270 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g42 n GLY 271 N 2.24 0.76 3.37 0.00 0.00 -1.26 -4.74 105.19 105.55 3g42 n GLY 271 Ca 0.00 -0.65 -0.43 0.00 0.00 0.00 0.00 46.02 44.94 3g42 n GLY 271 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3g42 n PHE 272 N 1.09 4.41 -4.10 1.61 7.35 -1.26 -4.86 117.46 121.69 3g42 n PHE 272 Ca 0.13 -2.93 -0.11 0.00 -0.76 0.00 0.00 57.45 53.78 3g42 n PHE 272 Cb 0.55 -2.54 -0.04 0.00 0.35 0.00 0.00 39.48 37.80 3g42 n PHE 272 CO 0.00 0.00 0.00 0.36 -0.76 0.00 0.00 176.76 176.36 3g42 n LYS 273 N 7.43 0.28 -0.77 -4.13 2.85 -1.26 -1.77 118.16 120.79 3g42 n LYS 273 Ca 0.48 -1.90 0.00 0.00 -1.05 0.00 0.00 58.31 55.84 3g42 n LYS 273 Cb 0.44 1.61 0.00 0.00 -0.65 0.00 0.00 35.03 36.43 3g42 n LYS 273 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3g42 n GLY 274 N -0.37 0.60 3.70 2.58 0.00 -0.24 -5.03 105.19 106.44 3g42 n GLY 274 Ca 0.04 -0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 3g42 n GLY 274 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g42 s TYR 275 N -2.00 3.46 0.00 1.61 1.51 -1.26 -4.84 117.35 115.83 3g42 s TYR 275 Ca 0.00 0.81 0.00 0.00 -1.01 0.00 0.00 57.07 56.87 3g42 s TYR 275 Cb 0.00 -2.55 0.00 0.00 -0.11 0.00 0.00 41.96 39.30 3g42 s TYR 275 CO 0.00 0.10 0.00 0.41 -1.11 0.00 0.00 175.55 174.95 3g42 n GLY 276 N 3.47 4.51 3.20 0.71 0.00 -0.63 -2.31 105.19 114.15 3g42 n GLY 276 Ca -0.07 -1.05 -0.15 0.00 0.00 0.00 0.00 46.02 44.75 3g42 n GLY 276 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3g42 s ILE 277 N -0.86 1.04 -0.12 -0.61 -4.36 -1.26 -1.23 121.20 113.80 3g42 s ILE 277 Ca 0.00 -1.76 -0.19 0.00 -0.26 0.00 0.00 60.65 58.44 3g42 s ILE 277 Cb 0.00 -1.51 0.05 0.00 1.25 0.00 0.00 42.46 42.25 3g42 s ILE 277 CO 0.00 -0.59 0.48 -1.58 0.24 0.00 0.00 174.94 173.49 3g42 s GLN 278 N -3.02 0.70 -0.24 0.37 0.74 -0.82 -4.82 119.66 112.56 3g42 s GLN 278 Ca 0.09 0.38 -0.29 0.00 0.05 0.00 0.00 55.36 55.58 3g42 s GLN 278 Cb -0.02 0.33 0.01 0.00 1.10 0.00 0.00 33.01 34.43 3g42 s GLN 278 CO 0.00 -0.15 1.06 0.42 -0.55 0.00 0.00 175.29 176.08 3g42 s ILE 279 N -0.44 4.62 -0.13 -2.34 1.01 -1.26 0.02 121.20 122.68 3g42 s ILE 279 Ca -0.06 1.95 -0.21 0.00 0.00 0.00 0.00 60.65 62.33 3g42 s ILE 279 Cb -0.03 -4.31 -0.25 0.00 0.01 0.00 0.00 42.46 37.87 3g42 s ILE 279 CO 0.03 -0.23 0.56 -0.08 0.00 0.00 0.00 174.94 175.22 3g42 h GLU 280 N 7.62 0.13 -3.20 2.79 4.57 -0.40 -3.45 114.58 122.64 3g42 h GLU 280 Ca -0.20 -0.23 -0.18 0.00 -1.18 0.00 0.00 59.36 57.57 3g42 h GLU 280 Cb 1.06 0.08 -0.27 0.00 -0.16 0.00 0.00 28.75 29.47 3g42 h GLU 280 CO 0.99 1.11 -0.48 -1.14 -1.18 0.00 0.00 179.01 178.31 3g42 s GLN 281 N -2.38 0.23 -0.12 1.92 2.00 -0.72 -5.02 119.66 115.56 3g42 s GLN 281 Ca -0.21 0.33 0.01 0.00 -2.00 0.00 0.00 55.36 53.49 3g42 s GLN 281 Cb 0.03 0.07 -0.01 0.00 0.80 0.00 0.00 33.01 33.90 3g42 s GLN 281 CO 0.71 -0.05 -0.18 0.42 -0.50 0.00 0.00 175.29 175.69 3g42 s ILE 282 N 0.32 2.61 -0.17 -2.34 1.01 -1.26 0.16 121.20 121.52 3g42 s ILE 282 Ca -0.02 -0.82 0.01 0.00 0.00 0.00 0.00 60.65 59.82 3g42 s ILE 282 Cb -0.03 -2.06 0.02 0.00 0.01 0.00 0.00 42.46 40.40 3g42 s ILE 282 CO -0.01 0.54 -0.17 -0.13 0.00 0.00 0.00 174.94 175.17 3g42 s ARG 283 N 0.43 2.61 -0.28 2.79 0.52 0.79 -4.97 118.95 120.84 3g42 s ARG 283 Ca -0.13 -0.75 -0.08 0.00 -0.52 0.00 0.00 55.73 54.25 3g42 s ARG 283 Cb -0.17 -2.40 -0.01 0.00 0.52 0.00 0.00 34.95 32.89 3g42 s ARG 283 CO 0.06 -0.26 0.10 0.42 0.02 0.00 0.00 175.30 175.64 3g42 s ILE 284 N 1.36 4.32 -0.48 1.52 -1.09 -1.26 -1.26 121.20 124.31 3g42 s ILE 284 Ca 0.04 -0.37 -0.19 0.00 -2.23 0.00 0.00 60.65 57.90 3g42 s ILE 284 Cb -0.14 -3.13 0.05 0.00 -1.58 0.00 0.00 42.46 37.67 3g42 s ILE 284 CO -0.11 0.20 0.57 -0.76 -1.23 0.00 0.00 174.94 173.61 3g42 s LEU 285 N 1.59 4.96 0.17 2.97 1.43 -0.04 -4.93 118.68 124.83 3g42 s LEU 285 Ca 0.05 -0.85 0.27 0.00 -1.03 0.00 0.00 54.13 52.57 3g42 s LEU 285 Cb -0.16 -2.44 0.88 0.00 0.03 0.00 0.00 46.19 44.49 3g42 s LEU 285 CO 0.04 -0.80 1.79 0.29 0.23 0.00 0.00 176.35 177.90 3g42 n LYS 286 N 5.99 0.22 -3.88 1.70 5.02 -1.26 -2.38 118.16 123.57 3g42 n LYS 286 Ca -0.07 0.18 -0.09 0.00 -2.02 0.00 0.00 58.31 56.31 3g42 n LYS 286 Cb 0.46 -1.75 -0.08 0.00 -0.02 0.00 0.00 35.03 33.64 3g42 n LYS 286 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3g42 s SER 287 N -4.26 0.13 0.65 4.39 1.04 -1.26 -4.90 113.70 109.49 3g42 s SER 287 Ca 0.11 -0.58 -0.18 0.00 0.48 0.00 0.00 55.95 55.78 3g42 s SER 287 Cb 0.13 0.30 -0.01 0.00 0.10 0.00 0.00 66.02 66.55 3g42 s SER 287 CO 0.59 -0.64 1.29 -2.16 0.98 0.00 0.00 173.24 173.29 3g42 s PRO 288 N -3.32 2.55 -0.25 4.02 0.04 -1.26 -4.67 135.00 132.10 3g42 s PRO 288 Ca 0.01 2.04 -0.29 0.00 0.04 0.00 0.00 61.00 62.80 3g42 s PRO 288 Cb 0.03 -1.85 0.01 0.00 0.04 0.00 0.00 34.50 32.73 3g42 s PRO 288 CO -0.08 -1.60 1.05 -1.14 0.04 0.00 0.00 177.00 175.28 3g42 s GLN 289 N -3.40 4.21 0.35 4.56 2.00 0.75 -4.88 119.66 123.25 3g42 s GLN 289 Ca 0.82 1.30 -0.28 0.00 -2.00 0.00 0.00 55.36 55.20 3g42 s GLN 289 Cb -0.37 -3.67 -0.10 0.00 0.80 0.00 0.00 33.01 29.67 3g42 s GLN 289 CO 0.40 -0.70 1.35 -1.21 -0.50 0.00 0.00 175.29 174.63 3g42 s GLU 290 N 3.31 4.28 -0.02 1.67 2.02 -1.26 -4.27 118.70 124.43 3g42 s GLU 290 Ca 0.45 2.30 0.01 0.00 0.02 0.00 0.00 54.97 57.75 3g42 s GLU 290 Cb -0.15 -3.03 0.01 0.00 0.10 0.00 0.00 34.13 31.06 3g42 s GLU 290 CO 0.08 -0.28 -0.04 0.54 0.02 0.00 0.00 175.26 175.58 3g42 s VAL 291 N -1.14 0.42 0.84 2.63 0.11 -1.26 -5.05 120.40 116.95 3g42 s VAL 291 Ca 0.50 -0.13 -0.11 0.00 -2.93 0.00 0.00 61.98 59.31 3g42 s VAL 291 Cb -0.41 -0.42 0.09 0.00 -1.53 0.00 0.00 36.38 34.11 3g42 s VAL 291 CO 0.55 0.16 1.09 -0.54 -3.33 0.00 0.00 175.10 173.04 3g42 s LYS 292 N 0.47 1.75 0.13 1.54 1.02 -1.26 -4.90 119.74 118.49 3g42 s LYS 292 Ca -0.05 0.90 -0.35 0.00 0.02 0.00 0.00 55.97 56.48 3g42 s LYS 292 Cb -0.09 -1.86 -0.15 0.00 -0.52 0.00 0.00 37.83 35.21 3g42 s LYS 292 CO -0.00 -1.92 1.47 -0.35 -0.92 0.00 0.00 175.35 173.63 3g42 n PRO 293 N -3.67 1.71 0.00 -1.68 -0.04 -1.26 -1.57 135.00 128.49 3g42 n PRO 293 Ca 0.08 0.62 0.00 0.00 -0.04 0.00 0.00 63.50 64.15 3g42 n PRO 293 Cb 0.55 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 31.68 3g42 n PRO 293 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3g42 n GLY 294 N 2.99 2.97 3.92 0.55 0.00 -1.26 -5.02 105.19 109.34 3g42 n GLY 294 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 3g42 n GLY 294 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3g42 s GLU 295 N -0.16 3.55 0.26 1.61 -1.05 -0.61 -5.11 118.70 117.18 3g42 s GLU 295 Ca 0.00 -0.25 0.03 0.00 -0.15 0.00 0.00 54.97 54.61 3g42 s GLU 295 Cb 0.00 -2.75 -0.05 0.00 -0.44 0.00 0.00 34.13 30.88 3g42 s GLU 295 CO 0.00 0.30 0.03 -1.59 0.95 0.00 0.00 175.26 174.95 3g42 s LYS 296 N -3.58 1.42 -0.11 -4.83 -2.85 -1.26 -4.64 119.74 103.89 3g42 s LYS 296 Ca 0.40 -1.75 -0.25 0.00 -1.00 0.00 0.00 55.97 53.38 3g42 s LYS 296 Cb -0.11 -0.62 0.06 0.00 -2.06 0.00 0.00 37.83 35.10 3g42 s LYS 296 CO 0.30 -0.15 0.59 -1.58 0.10 0.00 0.00 175.35 174.62 3g42 s HIS 297 N -3.44 -0.59 0.51 1.78 2.46 -1.26 -5.04 115.29 109.71 3g42 s HIS 297 Ca 0.32 1.19 0.41 0.00 0.47 0.00 0.00 55.06 57.45 3g42 s HIS 297 Cb 0.07 0.29 2.10 0.00 -0.13 0.00 0.00 32.58 34.91 3g42 s HIS 297 CO 0.11 -0.46 2.26 0.10 -2.47 0.00 0.00 174.74 174.28 3g42 h TYR 298 N 3.99 0.00 -0.42 3.88 -0.00 -1.93 -1.93 116.97 120.56 3g42 h TYR 298 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.45 3g42 h TYR 298 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.89 3g42 h TYR 298 CO 0.41 0.01 0.00 -1.71 -0.00 0.00 0.00 178.16 176.86 3g42 n ASN 299 N -3.13 4.52 -4.80 0.10 5.15 -1.26 -5.01 115.26 110.83 3g42 n ASN 299 Ca -0.02 -2.83 -0.31 0.00 -0.60 0.00 0.00 54.58 50.82 3g42 n ASN 299 Cb 0.14 -0.57 0.06 0.00 -0.53 0.00 0.00 39.78 38.88 3g42 n ASN 299 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3g42 s MET 300 N -2.52 2.71 0.11 1.20 0.23 -0.73 -0.18 119.30 120.13 3g42 s MET 300 Ca 0.46 1.06 -0.27 0.00 -1.03 0.00 0.00 55.69 55.91 3g42 s MET 300 Cb 0.35 -1.96 -0.09 0.00 -1.53 0.00 0.00 34.83 31.60 3g42 s MET 300 CO 0.14 -1.28 1.65 0.00 -2.03 0.00 0.00 175.02 173.50 3g42 h ALA 301 N -0.77 -0.41 -2.36 3.16 0.00 -1.90 -3.44 119.26 113.53 3g42 h ALA 301 Ca -0.44 -0.04 -0.50 0.00 0.00 0.00 0.00 54.91 53.92 3g42 h ALA 301 Cb 1.22 0.37 -0.00 0.00 0.00 0.00 0.00 17.79 19.38 3g42 h ALA 301 CO 0.55 -0.77 -0.00 -1.59 0.00 0.00 0.00 179.25 177.43 3g42 s LYS 302 N -6.08 3.70 0.61 0.00 -2.85 -1.26 -5.07 119.74 108.79 3g42 s LYS 302 Ca -0.15 0.24 -0.15 0.00 -1.00 0.00 0.00 55.97 54.90 3g42 s LYS 302 Cb 0.08 -2.51 -0.03 0.00 -2.06 0.00 0.00 37.83 33.31 3g42 s LYS 302 CO 0.65 0.07 1.07 -1.12 0.10 0.00 0.00 175.35 176.12 3g42 s SER 303 N -3.21 5.62 -0.00 0.03 0.01 -1.26 -5.00 113.70 109.89 3g42 s SER 303 Ca 0.48 1.84 0.02 0.00 1.31 0.00 0.00 55.95 59.59 3g42 s SER 303 Cb -0.10 -2.53 -0.00 0.00 0.21 0.00 0.00 66.02 63.59 3g42 s SER 303 CO 0.31 -1.28 -0.06 -0.47 0.41 0.00 0.00 173.24 172.16 3g42 s TYR 304 N -2.48 0.51 -0.84 2.43 5.04 -1.26 -3.18 117.35 117.58 3g42 s TYR 304 Ca 0.64 -0.10 0.26 0.00 -2.44 0.00 0.00 57.07 55.43 3g42 s TYR 304 Cb -0.17 -0.33 0.76 0.00 0.35 0.00 0.00 41.96 42.58 3g42 s TYR 304 CO 0.39 -0.01 1.64 -0.35 -1.34 0.00 0.00 175.55 175.88 3g42 n PRO 305 N 2.91 0.14 -3.50 4.97 -0.04 -1.26 -1.29 135.00 136.93 3g42 n PRO 305 Ca -0.13 0.08 -0.42 0.00 -0.04 0.00 0.00 63.50 62.99 3g42 n PRO 305 Cb 0.58 -1.63 -0.06 0.00 -0.04 0.00 0.00 33.50 32.35 3g42 n PRO 305 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3g42 s ASN 306 N -3.72 5.97 0.52 3.54 0.02 -1.26 -4.92 114.94 115.08 3g42 s ASN 306 Ca 0.11 -2.39 0.25 0.00 -1.02 0.00 0.00 52.86 49.81 3g42 s ASN 306 Cb 0.15 -2.05 1.41 0.00 0.02 0.00 0.00 41.25 40.78 3g42 s ASN 306 CO 0.63 -0.59 2.08 1.05 0.02 0.00 0.00 177.10 180.28 3g42 h GLU 307 N 7.92 0.00 -0.43 -0.60 4.11 -1.90 -2.22 114.58 121.46 3g42 h GLU 307 Ca -0.07 0.00 0.04 0.00 0.07 0.00 0.00 59.36 59.40 3g42 h GLU 307 Cb 1.03 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.25 3g42 h GLU 307 CO 0.81 0.12 0.21 0.93 0.07 0.00 0.00 179.01 181.14 3g42 h GLU 308 N 0.00 0.41 -7.25 1.06 4.39 -1.91 -3.42 114.58 107.86 3g42 h GLU 308 Ca -0.00 -0.02 -0.52 0.00 0.34 0.00 0.00 59.36 59.15 3g42 h GLU 308 Cb 0.29 -0.09 0.16 0.00 -0.10 0.00 0.00 28.75 29.01 3g42 h GLU 308 CO 0.02 0.27 0.31 0.15 -1.16 0.00 0.00 179.01 178.59 3g42 s LYS 309 N -6.15 1.78 0.00 2.33 -0.14 -0.84 -4.89 119.74 111.84 3g42 s LYS 309 Ca -0.13 1.51 0.22 0.00 -1.36 0.00 0.00 55.97 56.22 3g42 s LYS 309 Cb 0.13 -1.82 1.27 0.00 -1.68 0.00 0.00 37.83 35.73 3g42 s LYS 309 CO 0.72 -2.06 1.82 -0.40 -0.76 0.00 0.00 175.35 174.68 3g42 n ASP 310 N -3.47 0.18 -3.60 2.83 5.68 -1.26 -4.72 116.55 112.19 3g42 n ASP 310 Ca 0.12 -1.35 -0.11 0.00 -0.50 0.00 0.00 54.79 52.95 3g42 n ASP 310 Cb 0.52 -0.01 -0.04 0.00 -1.14 0.00 0.00 41.12 40.45 3g42 n ASP 310 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3g42 s ALA 311 N -1.98 -1.03 0.97 2.12 0.00 -1.26 -4.39 121.76 116.19 3g42 s ALA 311 Ca 0.33 0.03 -0.12 0.00 0.00 0.00 0.00 51.96 52.20 3g42 s ALA 311 Cb 0.16 0.73 0.17 0.00 0.00 0.00 0.00 23.12 24.18 3g42 s ALA 311 CO 0.26 -0.67 1.09 -1.58 0.00 0.00 0.00 175.76 174.86 3g42 s TRP 312 N -3.80 2.14 -0.07 0.00 0.52 -1.26 -4.52 118.94 111.96 3g42 s TRP 312 Ca 0.03 1.07 -0.29 0.00 0.02 0.00 0.00 56.10 56.92 3g42 s TRP 312 Cb 0.01 -3.23 -0.02 0.00 -1.15 0.00 0.00 33.47 29.08 3g42 s TRP 312 CO -0.12 -2.78 0.98 0.34 0.02 0.00 0.00 176.95 175.39 3g42 s ASP 313 N -3.43 7.27 0.26 2.95 -1.08 -0.42 -4.79 116.67 117.45 3g42 s ASP 313 Ca 0.65 1.56 -0.02 0.00 -0.52 0.00 0.00 52.55 54.22 3g42 s ASP 313 Cb -0.19 -2.55 0.47 0.00 -1.46 0.00 0.00 42.92 39.19 3g42 s ASP 313 CO 0.58 -0.37 1.83 1.62 0.52 0.00 0.00 175.17 179.35 3g42 h VAL 314 N 4.99 0.94 -0.54 1.11 3.04 -1.93 -1.33 116.25 122.53 3g42 h VAL 314 Ca -0.35 -0.32 -0.05 0.00 -1.01 0.00 0.00 66.70 64.97 3g42 h VAL 314 Cb 1.17 -0.08 -0.02 0.00 -2.01 0.00 0.00 31.29 30.35 3g42 h VAL 314 CO 0.81 0.17 0.14 0.11 -1.01 0.00 0.00 177.57 177.80 3g42 h LYS 315 N 0.94 0.85 -0.33 4.17 1.57 -1.99 -1.81 116.57 119.97 3g42 h LYS 315 Ca 0.45 -0.20 -0.09 0.00 -1.87 0.00 0.00 60.65 58.94 3g42 h LYS 315 Cb 0.39 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 3g42 h LYS 315 CO -0.24 0.79 -0.16 0.52 -0.57 0.00 0.00 179.45 179.79 3g42 h MET 316 N 0.75 0.59 -0.06 3.15 2.86 -1.84 -1.99 114.93 118.38 3g42 h MET 316 Ca 0.17 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 3g42 h MET 316 Cb 0.32 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.93 3g42 h MET 316 CO -0.00 0.73 0.01 1.25 1.06 0.00 0.00 176.91 179.96 3g42 h LEU 317 N 0.53 0.10 -0.67 1.22 5.85 -0.97 0.11 115.31 121.49 3g42 h LEU 317 Ca 0.09 -0.27 0.05 0.00 0.84 0.00 0.00 57.88 58.58 3g42 h LEU 317 Cb 0.59 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.54 3g42 h LEU 317 CO 0.04 0.35 0.39 0.25 -0.34 0.00 0.00 178.44 179.13 3g42 h LEU 318 N -0.15 0.61 -0.40 2.25 5.85 -1.23 0.11 115.31 122.36 3g42 h LEU 318 Ca 0.02 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 3g42 h LEU 318 Cb 0.29 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 3g42 h LEU 318 CO 0.00 0.41 0.22 -0.08 -0.34 0.00 0.00 178.44 178.65 3g42 h GLU 319 N 0.74 0.55 -0.40 1.25 4.81 -1.19 -0.47 114.58 119.88 3g42 h GLU 319 Ca 0.29 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 3g42 h GLU 319 Cb 0.11 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 3g42 h GLU 319 CO -0.15 0.44 0.17 0.37 -0.73 0.00 0.00 179.01 179.11 3g42 h GLN 320 N 0.52 0.59 -0.38 1.92 5.75 -0.40 -1.40 115.11 121.70 3g42 h GLN 320 Ca 0.14 -0.10 0.05 0.00 -0.15 0.00 0.00 58.65 58.59 3g42 h GLN 320 Cb 0.05 -0.10 -0.05 0.00 1.07 0.00 0.00 27.48 28.45 3g42 h GLN 320 CO -0.02 0.55 0.11 0.35 -2.65 0.00 0.00 178.83 177.17 3g42 h PHE 321 N 0.50 0.20 -0.75 3.99 3.57 -0.56 0.68 116.94 124.56 3g42 h PHE 321 Ca 0.13 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.69 3g42 h PHE 321 Cb 0.17 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 38.83 3g42 h PHE 321 CO -0.00 0.06 0.47 0.77 -2.23 0.00 0.00 178.31 177.38 3g42 h SER 322 N 0.26 0.75 0.31 0.41 0.02 -0.78 0.04 113.55 114.57 3g42 h SER 322 Ca 0.18 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.12 3g42 h SER 322 Cb 0.18 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.57 3g42 h SER 322 CO -0.20 0.51 -0.15 0.15 -1.14 0.00 0.00 176.83 176.00 3g42 h PHE 323 N 0.89 -0.38 -0.26 3.45 3.04 -0.49 -1.93 116.94 121.25 3g42 h PHE 323 Ca 0.31 -0.01 -0.03 0.00 3.98 0.00 0.00 57.97 62.23 3g42 h PHE 323 Cb 0.06 0.13 -0.01 0.00 2.56 0.00 0.00 35.95 38.69 3g42 h PHE 323 CO -0.04 -0.10 0.05 -0.44 -2.02 0.00 0.00 178.31 175.76 3g42 h ASP 324 N -0.64 0.34 -0.22 0.41 3.45 -0.71 -2.86 116.42 116.19 3g42 h ASP 324 Ca -0.04 -0.04 0.00 0.00 0.43 0.00 0.00 57.03 57.38 3g42 h ASP 324 Cb 0.45 -0.09 0.00 0.00 -0.56 0.00 0.00 39.33 39.14 3g42 h ASP 324 CO 0.07 0.37 0.00 0.00 -1.57 0.00 0.00 179.24 178.11 3g42 n ILE 325 N -4.37 0.27 -0.36 0.35 0.13 -0.02 -4.68 119.36 110.68 3g42 n ILE 325 Ca 0.01 -0.57 -0.02 0.00 -1.10 0.00 0.00 62.75 61.07 3g42 n ILE 325 Cb 0.17 0.99 0.03 0.00 -0.84 0.00 0.00 39.64 39.99 3g42 n ILE 325 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3g42 n ALA 326 N 1.16 -0.15 -0.06 1.51 0.00 -0.73 -0.75 120.51 121.49 3g42 n ALA 326 Ca 0.17 0.91 -0.07 0.00 0.00 0.00 0.00 53.44 54.44 3g42 n ALA 326 Cb 0.54 -0.39 -0.01 0.00 0.00 0.00 0.00 19.45 19.59 3g42 n ALA 326 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3g42 h GLU 327 N 0.00 0.07 -0.48 0.00 4.39 -1.84 -2.29 114.58 114.42 3g42 h GLU 327 Ca 0.31 -0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.89 3g42 h GLU 327 Cb 0.54 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 3g42 h GLU 327 CO -0.91 0.04 -0.15 0.93 -1.16 0.00 0.00 179.01 177.77 3g42 h GLU 328 N 0.07 0.91 -0.62 2.33 4.39 -1.58 -3.21 114.58 116.86 3g42 h GLU 328 Ca 0.12 -0.34 -0.05 0.00 0.34 0.00 0.00 59.36 59.44 3g42 h GLU 328 Cb 0.16 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 3g42 h GLU 328 CO -0.21 0.99 0.20 0.00 -1.16 0.00 0.00 179.01 178.83 3g42 h ALA 329 N 1.02 1.18 0.00 3.43 0.00 -0.66 -2.30 119.26 121.94 3g42 h ALA 329 Ca 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3g42 h ALA 329 Cb 0.68 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3g42 h ALA 329 CO 0.05 0.57 0.01 -1.13 0.00 0.00 0.00 179.25 178.75 3g42 n SER 330 N -4.28 0.43 -0.94 0.00 3.41 -0.89 -1.84 113.62 109.51 3g42 n SER 330 Ca 0.05 0.70 0.12 0.00 -0.26 0.00 0.00 58.87 59.48 3g42 n SER 330 Cb 0.21 -0.75 0.10 0.00 -0.26 0.00 0.00 64.21 63.50 3g42 n SER 330 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3g42 n LYS 331 N -2.09 2.23 -4.26 4.33 4.76 -0.86 -4.84 118.16 117.43 3g42 n LYS 331 Ca -0.01 -1.90 -0.14 0.00 -2.87 0.00 0.00 58.31 53.39 3g42 n LYS 331 Cb 0.03 -1.45 -0.10 0.00 -1.84 0.00 0.00 35.03 31.68 3g42 n LYS 331 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3g42 s VAL 332 N -1.92 0.80 0.12 -0.18 -7.23 -0.77 -5.04 120.40 106.18 3g42 s VAL 332 Ca 0.27 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.29 3g42 s VAL 332 Cb 0.19 -2.16 -0.02 0.00 0.56 0.00 0.00 36.38 34.96 3g42 s VAL 332 CO 0.29 -0.45 1.61 0.00 -0.31 0.00 0.00 175.10 176.23 3g42 s LEU 334 N -9.56 0.76 -0.06 0.00 1.43 -1.11 -1.39 118.68 108.74 3g42 s LEU 334 Ca -0.13 -0.00 0.04 0.00 -1.03 0.00 0.00 54.13 53.01 3g42 s LEU 334 Cb 0.10 1.40 0.00 0.00 0.03 0.00 0.00 46.19 47.71 3g42 s LEU 334 CO 0.77 -0.54 -0.19 0.00 0.23 0.00 0.00 176.35 176.63 3g42 s ALA 335 N -1.89 1.71 -0.03 4.21 0.00 -0.12 -1.05 121.76 124.58 3g42 s ALA 335 Ca -0.09 -0.75 0.03 0.00 0.00 0.00 0.00 51.96 51.15 3g42 s ALA 335 Cb -0.03 -0.61 0.00 0.00 0.00 0.00 0.00 23.12 22.48 3g42 s ALA 335 CO 0.01 0.26 -0.11 -1.58 0.00 0.00 0.00 175.76 174.34 3g42 s HIS 336 N 0.22 1.16 -0.20 0.00 2.46 0.09 -2.39 115.29 116.63 3g42 s HIS 336 Ca -0.10 -0.30 -0.06 0.00 0.47 0.00 0.00 55.06 55.08 3g42 s HIS 336 Cb -0.14 -0.80 -0.03 0.00 -0.13 0.00 0.00 32.58 31.47 3g42 s HIS 336 CO 0.04 -0.11 0.02 -1.17 -2.47 0.00 0.00 174.74 171.05 3g42 s LEU 337 N 0.13 3.41 -0.19 8.88 2.96 -0.31 -1.28 118.68 132.27 3g42 s LEU 337 Ca -0.03 -0.13 -0.06 0.00 -0.22 0.00 0.00 54.13 53.69 3g42 s LEU 337 Cb -0.09 -1.86 -0.03 0.00 0.50 0.00 0.00 46.19 44.70 3g42 s LEU 337 CO 0.01 0.09 0.03 -0.36 -1.32 0.00 0.00 176.35 174.80 3g42 s PHE 338 N 0.85 3.12 0.37 5.38 0.40 0.60 -0.20 117.98 128.50 3g42 s PHE 338 Ca 0.02 -0.21 0.06 0.00 -0.60 0.00 0.00 56.93 56.20 3g42 s PHE 338 Cb -0.14 -2.08 -0.03 0.00 0.51 0.00 0.00 43.02 41.28 3g42 s PHE 338 CO 0.02 -0.06 0.24 -0.08 0.70 0.00 0.00 175.22 176.04 3g42 s THR 339 N 0.72 0.18 -0.41 0.64 -1.32 0.24 -2.56 115.64 113.12 3g42 s THR 339 Ca 0.01 -2.00 0.03 0.00 -1.21 0.00 0.00 61.69 58.52 3g42 s THR 339 Cb -0.14 -2.42 0.16 0.00 -1.51 0.00 0.00 72.50 68.59 3g42 s THR 339 CO 0.02 0.00 0.30 -0.47 -2.21 0.00 0.00 174.62 172.26 3g42 s TYR 340 N -3.33 1.20 -0.00 9.09 5.04 -1.26 -2.31 117.35 125.78 3g42 s TYR 340 Ca 0.34 -2.19 0.00 0.00 -2.44 0.00 0.00 57.07 52.78 3g42 s TYR 340 Cb 0.02 -1.10 0.00 0.00 0.35 0.00 0.00 41.96 41.23 3g42 s TYR 340 CO 0.24 -0.81 0.00 -0.65 -1.34 0.00 0.00 175.55 172.99 3g42 s GLN 341 N 0.28 -0.00 -0.90 4.97 -0.21 -1.26 -4.79 119.66 117.75 3g42 s GLN 341 Ca 0.27 0.02 -0.19 0.00 0.02 0.00 0.00 55.36 55.48 3g42 s GLN 341 Cb -0.07 -0.03 0.13 0.00 1.00 0.00 0.00 33.01 34.04 3g42 s GLN 341 CO -0.12 -0.02 1.09 0.34 -2.12 0.00 0.00 175.29 174.46 3g42 s ASP 342 N 0.14 6.59 0.65 5.90 -1.08 -1.26 -4.48 116.67 123.12 3g42 s ASP 342 Ca -0.01 -1.98 -0.16 0.00 -0.52 0.00 0.00 52.55 49.87 3g42 s ASP 342 Cb -0.02 -2.39 -0.00 0.00 -1.46 0.00 0.00 42.92 39.05 3g42 s ASP 342 CO -0.00 -1.07 1.16 -0.36 0.52 0.00 0.00 175.17 175.42 3g42 s PHE 343 N 2.67 2.40 0.80 -5.34 0.08 -1.26 -4.51 117.98 112.82 3g42 s PHE 343 Ca 0.31 1.56 -0.14 0.00 0.12 0.00 0.00 56.93 58.78 3g42 s PHE 343 Cb -0.06 -3.35 0.07 0.00 -0.57 0.00 0.00 43.02 39.10 3g42 s PHE 343 CO -0.08 -2.07 1.09 -0.25 -0.10 0.00 0.00 175.22 173.81 3g42 n ASP 344 N -2.17 0.65 -3.58 1.36 10.43 -1.26 -3.52 116.55 118.46 3g42 n ASP 344 Ca 0.12 0.58 -0.26 0.00 2.57 0.00 0.00 54.79 57.80 3g42 n ASP 344 Cb 0.51 -1.46 -0.01 0.00 1.84 0.00 0.00 41.12 42.00 3g42 n ASP 344 CO 0.00 0.00 0.00 0.23 -1.07 0.00 0.00 177.20 176.36 3g42 n MET 345 N -2.89 -3.57 -1.44 -1.24 2.81 -1.26 -2.26 117.12 107.27 3g42 n MET 345 Ca 0.13 0.47 -0.15 0.00 -1.81 0.00 0.00 57.70 56.33 3g42 n MET 345 Cb 0.50 -5.20 -0.07 0.00 -0.71 0.00 0.00 33.22 27.75 3g42 n MET 345 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g42 n GLY 346 N -1.26 1.52 3.73 3.03 0.00 -1.23 -4.96 105.19 106.02 3g42 n GLY 346 Ca 0.01 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 3g42 n GLY 346 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g42 s THR 347 N -2.48 3.03 -0.09 2.61 2.01 -0.96 -4.92 115.64 114.85 3g42 s THR 347 Ca 0.00 0.82 0.12 0.00 0.31 0.00 0.00 61.69 62.94 3g42 s THR 347 Cb 0.00 -3.52 -0.18 0.00 0.01 0.00 0.00 72.50 68.81 3g42 s THR 347 CO 0.00 0.11 0.13 0.18 -0.69 0.00 0.00 174.62 174.35 3g42 n LEU 348 N 2.92 0.00 0.00 4.42 4.77 -1.26 -4.20 117.00 123.65 3g42 n LEU 348 Ca 0.08 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.01 3g42 n LEU 348 Cb 0.42 0.20 0.02 0.00 -2.33 0.00 0.00 43.42 41.73 3g42 n LEU 348 CO 0.59 0.20 0.51 0.61 -1.33 0.00 0.00 177.39 177.97 3g42 n GLY 349 N 2.05 1.02 3.56 -0.72 0.00 -1.26 -0.78 105.19 109.06 3g42 n GLY 349 Ca -0.14 -1.17 -0.14 0.00 0.00 0.00 0.00 46.02 44.58 3g42 n GLY 349 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3g42 s LEU 350 N 0.00 -0.52 -0.14 0.99 2.96 -0.91 -4.99 118.68 116.07 3g42 s LEU 350 Ca 0.15 0.64 -0.29 0.00 -0.22 0.00 0.00 54.13 54.40 3g42 s LEU 350 Cb -0.03 2.18 0.10 0.00 0.50 0.00 0.00 46.19 48.93 3g42 s LEU 350 CO 0.07 -0.43 0.83 0.00 -1.32 0.00 0.00 176.35 175.51 3g42 s ALA 351 N -0.92 -1.85 0.27 5.97 0.00 -1.26 -0.42 121.76 123.55 3g42 s ALA 351 Ca -0.05 1.55 -0.29 0.00 0.00 0.00 0.00 51.96 53.16 3g42 s ALA 351 Cb -0.01 -0.52 -0.09 0.00 0.00 0.00 0.00 23.12 22.49 3g42 s ALA 351 CO 0.04 -0.33 1.12 0.71 0.00 0.00 0.00 175.76 177.30 3g42 s TYR 352 N -0.85 3.54 -0.02 0.00 2.02 -1.12 -4.82 117.35 116.10 3g42 s TYR 352 Ca -0.05 1.66 -0.30 0.00 -0.37 0.00 0.00 57.07 58.01 3g42 s TYR 352 Cb -0.01 -3.32 -0.03 0.00 -0.40 0.00 0.00 41.96 38.20 3g42 s TYR 352 CO 0.04 -0.68 0.98 0.08 -1.57 0.00 0.00 175.55 174.40 3g42 s VAL 353 N -1.03 4.86 1.09 0.71 1.01 -1.26 -3.22 120.40 122.56 3g42 s VAL 353 Ca 0.46 2.04 -0.18 0.00 0.00 0.00 0.00 61.98 64.29 3g42 s VAL 353 Cb -0.32 -4.31 0.25 0.00 0.00 0.00 0.00 36.38 31.99 3g42 s VAL 353 CO 0.41 0.13 1.21 -0.83 0.00 0.00 0.00 175.10 176.02 3g42 s GLY 354 N 1.02 1.67 -0.04 4.51 0.00 0.12 -3.77 107.32 110.84 3g42 s GLY 354 Ca 0.51 -1.07 -0.29 0.00 0.00 0.00 0.00 44.72 43.87 3g42 s GLY 354 CO 0.26 -0.23 0.88 -0.45 0.00 0.00 0.00 173.10 173.56 3g42 s SER 355 N -4.36 -0.40 0.42 1.64 0.15 -1.26 -4.31 113.70 105.58 3g42 s SER 355 Ca 0.72 0.17 0.23 0.00 0.70 0.00 0.00 55.95 57.77 3g42 s SER 355 Cb -0.07 0.39 0.51 0.00 -1.71 0.00 0.00 66.02 65.14 3g42 s SER 355 CO 0.55 -0.56 1.66 1.55 1.20 0.00 0.00 173.24 177.63 3g42 h PRO 356 N 2.24 0.00 -6.57 5.44 0.13 -1.84 -3.45 132.00 127.94 3g42 h PRO 356 Ca -0.22 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.38 3g42 h PRO 356 Cb 1.21 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.39 3g42 h PRO 356 CO 0.32 0.16 0.99 1.03 -0.23 0.00 0.00 178.00 180.26 3g42 s ARG 357 N -3.28 4.17 0.37 0.86 0.52 -1.26 -4.67 118.95 115.66 3g42 s ARG 357 Ca 0.04 2.47 0.06 0.00 -0.52 0.00 0.00 55.73 57.78 3g42 s ARG 357 Cb 0.07 -3.30 0.72 0.00 0.52 0.00 0.00 34.95 32.96 3g42 s ARG 357 CO 0.66 -0.72 1.96 0.00 0.02 0.00 0.00 175.30 177.23 3g42 h ALA 358 N 7.45 1.53 -0.95 2.13 0.00 -2.00 -2.70 119.26 124.72 3g42 h ALA 358 Ca -0.43 -0.12 -0.70 0.00 0.00 0.00 0.00 54.91 53.66 3g42 h ALA 358 Cb 1.21 -0.16 -0.27 0.00 0.00 0.00 0.00 17.79 18.57 3g42 h ALA 358 CO 0.94 0.36 0.93 0.09 0.00 0.00 0.00 179.25 181.57 3g42 n ASN 359 N -4.37 7.50 -3.70 0.00 3.02 -1.26 -4.74 115.26 111.70 3g42 n ASN 359 Ca 0.02 -3.75 -0.30 0.00 -0.03 0.00 0.00 54.58 50.53 3g42 n ASN 359 Cb 0.15 -1.05 -0.14 0.00 -0.61 0.00 0.00 39.78 38.14 3g42 n ASN 359 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3g42 s SER 360 N -1.22 3.78 0.11 6.41 0.15 -1.02 -5.07 113.70 116.84 3g42 s SER 360 Ca 0.56 -2.12 -0.22 0.00 0.70 0.00 0.00 55.95 54.88 3g42 s SER 360 Cb 0.45 -0.90 -0.05 0.00 -1.71 0.00 0.00 66.02 63.81 3g42 s SER 360 CO -0.24 -0.34 1.38 0.45 1.20 0.00 0.00 173.24 175.68 3g42 h HIS 361 N 7.40 -1.32 -2.81 3.44 3.86 -1.87 -3.44 115.15 120.42 3g42 h HIS 361 Ca -0.06 0.09 -0.51 0.00 -1.16 0.00 0.00 60.37 58.73 3g42 h HIS 361 Cb 0.97 0.66 0.23 0.00 1.06 0.00 0.00 27.41 30.33 3g42 h HIS 361 CO 0.42 -0.26 -0.99 0.41 0.86 0.00 0.00 177.93 178.37 3g42 n GLY 362 N -1.18 -2.54 7.00 2.45 0.00 -1.26 -4.57 105.19 105.09 3g42 n GLY 362 Ca 0.01 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.30 3g42 n GLY 362 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g42 n GLY 363 N 2.00 -1.16 3.55 -0.02 0.00 -0.90 -4.29 105.19 104.38 3g42 n GLY 363 Ca 0.03 -1.21 -0.45 0.00 0.00 0.00 0.00 46.02 44.39 3g42 n GLY 363 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3g42 n VAL 364 N -0.29 1.97 -0.28 1.61 0.24 -0.76 -3.90 118.33 116.93 3g42 n VAL 364 Ca 0.00 -0.49 0.00 0.00 -2.04 0.00 0.00 64.34 61.81 3g42 n VAL 364 Cb 0.00 -0.79 0.00 0.00 -1.47 0.00 0.00 33.84 31.58 3g42 n VAL 364 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3g42 s PRO 366 N -3.44 4.39 -0.20 0.00 0.04 -1.26 -4.72 135.00 129.82 3g42 s PRO 366 Ca 0.00 1.95 -0.04 0.00 0.04 0.00 0.00 61.00 62.95 3g42 s PRO 366 Cb 0.00 -3.26 0.09 0.00 0.04 0.00 0.00 34.50 31.37 3g42 s PRO 366 CO 0.00 -0.30 0.21 0.21 0.04 0.00 0.00 177.00 177.16 3g42 s LYS 367 N 0.66 0.18 0.06 4.56 2.47 -1.26 -5.08 119.74 121.33 3g42 s LYS 367 Ca 0.60 0.19 -0.37 0.00 -1.56 0.00 0.00 55.97 54.82 3g42 s LYS 367 Cb -0.34 -1.24 -0.18 0.00 -1.46 0.00 0.00 37.83 34.61 3g42 s LYS 367 CO 0.32 -0.65 1.23 0.00 0.16 0.00 0.00 175.35 176.41 3g42 n ALA 368 N 5.32 -1.88 -3.96 3.13 0.00 -1.26 -4.54 120.51 117.33 3g42 n ALA 368 Ca -0.06 0.54 -0.30 0.00 0.00 0.00 0.00 53.44 53.63 3g42 n ALA 368 Cb 0.49 -1.96 -0.16 0.00 0.00 0.00 0.00 19.45 17.82 3g42 n ALA 368 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3g42 s TYR 369 N 0.27 2.18 0.04 0.00 5.04 0.33 -4.95 117.35 120.26 3g42 s TYR 369 Ca 0.86 -1.44 -0.30 0.00 -2.44 0.00 0.00 57.07 53.74 3g42 s TYR 369 Cb -1.05 -1.53 -0.06 0.00 0.35 0.00 0.00 41.96 39.67 3g42 s TYR 369 CO 0.51 -0.71 1.32 -0.47 -1.34 0.00 0.00 175.55 174.86 3g42 s TYR 370 N 1.47 3.14 -0.39 4.97 5.04 -1.26 -0.71 117.35 129.61 3g42 s TYR 370 Ca -0.01 1.03 -0.11 0.00 -2.44 0.00 0.00 57.07 55.53 3g42 s TYR 370 Cb -0.16 -3.58 0.04 0.00 0.35 0.00 0.00 41.96 38.61 3g42 s TYR 370 CO -0.08 -1.99 0.23 0.45 -1.34 0.00 0.00 175.55 172.82 3g42 s SER 371 N 1.42 5.77 0.16 4.32 0.15 -0.41 -4.93 113.70 120.18 3g42 s SER 371 Ca 0.62 -1.09 -0.16 0.00 0.70 0.00 0.00 55.95 56.02 3g42 s SER 371 Cb -0.31 -2.04 0.10 0.00 -1.71 0.00 0.00 66.02 62.06 3g42 s SER 371 CO 0.28 -0.43 1.72 -0.65 1.20 0.00 0.00 173.24 175.35 3g42 h PRO 372 N 8.47 0.18 -0.04 5.44 0.11 -1.94 0.18 132.00 144.39 3g42 h PRO 372 Ca -0.25 -0.01 -0.17 0.00 0.11 0.00 0.00 66.00 65.68 3g42 h PRO 372 Cb 1.10 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 3g42 h PRO 372 CO 0.70 0.12 -0.72 -0.24 -0.21 0.00 0.00 178.00 177.64 3g42 h VAL 373 N 0.18 1.42 0.00 3.15 3.04 -1.96 -3.11 116.25 118.98 3g42 h VAL 373 Ca 0.19 -2.24 0.00 0.00 -1.01 0.00 0.00 66.70 63.64 3g42 h VAL 373 Cb 0.24 2.19 0.00 0.00 -2.01 0.00 0.00 31.29 31.70 3g42 h VAL 373 CO -0.26 0.66 0.00 1.23 -1.01 0.00 0.00 177.57 178.19 3g42 h GLY 374 N 1.58 0.00 -5.81 3.17 0.00 -1.88 -3.47 103.07 96.66 3g42 h GLY 374 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 47.33 46.89 3g42 h GLY 374 CO 0.11 0.00 -0.69 0.28 0.00 0.00 0.00 176.54 176.24 3g42 n LYS 375 N -2.82 -7.00 -3.69 4.80 4.76 0.60 -4.95 118.16 109.85 3g42 n LYS 375 Ca 0.04 0.77 -0.02 0.00 -2.87 0.00 0.00 58.31 56.24 3g42 n LYS 375 Cb 0.45 -5.77 -0.01 0.00 -1.84 0.00 0.00 35.03 27.87 3g42 n LYS 375 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 3g42 s LYS 376 N -6.33 0.87 0.02 1.97 -2.85 -1.20 -5.03 119.74 107.19 3g42 s LYS 376 Ca 0.58 -0.47 -0.23 0.00 -1.00 0.00 0.00 55.97 54.84 3g42 s LYS 376 Cb -0.26 0.30 -0.05 0.00 -2.06 0.00 0.00 37.83 35.75 3g42 s LYS 376 CO 0.71 -0.40 0.68 -0.80 0.10 0.00 0.00 175.35 175.65 3g42 s ASN 377 N -2.93 7.10 0.40 0.03 0.01 -1.26 -1.29 114.94 117.00 3g42 s ASN 377 Ca 0.13 1.31 0.05 0.00 -0.71 0.00 0.00 52.86 53.64 3g42 s ASN 377 Cb 0.01 -2.42 -0.06 0.00 0.41 0.00 0.00 41.25 39.19 3g42 s ASN 377 CO -0.01 0.06 0.03 0.27 -1.51 0.00 0.00 177.10 175.95 3g42 s ILE 378 N -0.14 1.55 -0.01 0.60 -4.36 0.11 -4.89 121.20 114.06 3g42 s ILE 378 Ca 0.35 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 58.80 3g42 s ILE 378 Cb -0.19 -2.76 -0.01 0.00 1.25 0.00 0.00 42.46 40.74 3g42 s ILE 378 CO 0.20 0.00 -0.19 -0.31 0.24 0.00 0.00 174.94 174.88 3g42 s TYR 379 N -2.93 1.73 -0.33 1.37 1.51 -1.26 -0.52 117.35 116.93 3g42 s TYR 379 Ca 0.30 -0.33 0.10 0.00 -1.01 0.00 0.00 57.07 56.13 3g42 s TYR 379 Cb 0.08 -1.12 0.71 0.00 -0.11 0.00 0.00 41.96 41.52 3g42 s TYR 379 CO 0.15 -0.03 1.77 1.28 -1.11 0.00 0.00 175.55 177.61 3g42 n LEU 380 N 2.60 5.88 -3.21 -1.29 4.77 -1.26 -4.61 117.00 119.88 3g42 n LEU 380 Ca -0.15 -3.30 -0.37 0.00 -0.03 0.00 0.00 56.01 52.17 3g42 n LEU 380 Cb 0.53 -0.73 -0.01 0.00 -2.33 0.00 0.00 43.42 40.88 3g42 n LEU 380 CO 0.24 0.86 1.96 -0.46 -1.33 0.00 0.00 177.39 178.66 3g42 n ASN 381 N -0.36 7.50 -4.18 -1.43 6.94 -1.25 -2.11 115.26 120.36 3g42 n ASN 381 Ca 0.41 -3.31 -0.13 0.00 -0.02 0.00 0.00 54.58 51.53 3g42 n ASN 381 Cb 1.36 -1.27 -0.10 0.00 -2.36 0.00 0.00 39.78 37.41 3g42 n ASN 381 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3g42 s SER 382 N -0.03 0.47 0.08 0.53 1.04 -1.26 -0.95 113.70 113.59 3g42 s SER 382 Ca 0.53 -1.41 -0.27 0.00 0.48 0.00 0.00 55.95 55.28 3g42 s SER 382 Cb 0.26 0.34 0.09 0.00 0.10 0.00 0.00 66.02 66.81 3g42 s SER 382 CO -0.16 -0.83 1.13 -0.83 0.98 0.00 0.00 173.24 173.54 3g42 s GLY 383 N -3.21 -0.21 0.05 7.32 0.00 -1.00 -2.80 107.32 107.47 3g42 s GLY 383 Ca 0.39 0.22 -0.13 0.00 0.00 0.00 0.00 44.72 45.20 3g42 s GLY 383 CO 0.13 1.22 0.28 0.48 0.00 0.00 0.00 173.10 175.22 3g42 s LEU 384 N -3.16 0.97 -0.02 0.66 0.05 0.43 -1.16 118.68 116.46 3g42 s LEU 384 Ca 0.17 -0.25 0.03 0.00 0.05 0.00 0.00 54.13 54.13 3g42 s LEU 384 Cb 0.01 1.29 -0.00 0.00 -2.05 0.00 0.00 46.19 45.44 3g42 s LEU 384 CO 0.00 -0.62 -0.09 -0.89 -0.55 0.00 0.00 176.35 174.20 3g42 s THR 385 N -2.68 0.75 -0.05 5.48 2.01 0.72 -2.14 115.64 119.72 3g42 s THR 385 Ca -0.04 -0.37 0.06 0.00 0.31 0.00 0.00 61.69 61.65 3g42 s THR 385 Cb -0.00 -0.65 -0.01 0.00 0.01 0.00 0.00 72.50 71.84 3g42 s THR 385 CO -0.04 0.23 -0.24 -0.55 -0.69 0.00 0.00 174.62 173.33 3g42 s SER 386 N 0.03 3.21 -0.19 3.53 0.15 0.04 -0.59 113.70 119.88 3g42 s SER 386 Ca -0.00 -0.46 0.16 0.00 0.70 0.00 0.00 55.95 56.34 3g42 s SER 386 Cb -0.06 -0.78 0.74 0.00 -1.71 0.00 0.00 66.02 64.20 3g42 s SER 386 CO 0.00 0.27 1.65 0.35 1.20 0.00 0.00 173.24 176.71 3g42 n THR 387 N 2.81 2.38 -5.20 6.45 -2.24 -0.98 -4.83 114.28 112.68 3g42 n THR 387 Ca -0.17 -1.41 -0.32 0.00 -2.27 0.00 0.00 64.05 59.88 3g42 n THR 387 Cb 0.52 -0.13 -0.16 0.00 -2.10 0.00 0.00 70.33 68.45 3g42 n THR 387 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3g42 s LYS 388 N -2.46 2.84 -0.21 -0.78 2.20 -1.26 -0.85 119.74 119.22 3g42 s LYS 388 Ca 0.51 -0.87 -0.17 0.00 -0.36 0.00 0.00 55.97 55.07 3g42 s LYS 388 Cb 0.37 -2.27 0.06 0.00 -1.51 0.00 0.00 37.83 34.48 3g42 s LYS 388 CO 0.17 0.28 0.54 1.21 -0.36 0.00 0.00 175.35 177.20 3g42 s ASN 389 N 0.09 -0.59 -1.34 1.43 2.47 0.01 -4.24 114.94 112.77 3g42 s ASN 389 Ca -0.11 1.10 -0.10 0.00 0.42 0.00 0.00 52.86 54.18 3g42 s ASN 389 Cb -0.16 1.09 0.00 0.00 -1.45 0.00 0.00 41.25 40.74 3g42 s ASN 389 CO 0.06 -0.19 0.47 -1.22 -3.72 0.00 0.00 177.10 172.50 3g42 n TYR 390 N 3.09 -1.60 0.00 0.43 0.53 -1.26 -2.10 117.16 116.25 3g42 n TYR 390 Ca -0.15 0.56 0.00 0.00 -1.02 0.00 0.00 57.90 57.29 3g42 n TYR 390 Cb 0.56 -3.38 0.00 0.00 -1.03 0.00 0.00 39.34 35.49 3g42 n TYR 390 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 3g42 n GLY 391 N -2.03 2.98 3.28 2.72 0.00 -1.26 -5.00 105.19 105.87 3g42 n GLY 391 Ca -0.24 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.60 3g42 n GLY 391 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g42 s LYS 392 N -0.18 1.64 0.05 1.61 0.00 -0.89 -5.13 119.74 116.84 3g42 s LYS 392 Ca 0.00 -1.94 -0.30 0.00 0.00 0.00 0.00 55.97 53.73 3g42 s LYS 392 Cb 0.00 0.25 -0.05 0.00 0.00 0.00 0.00 37.83 38.03 3g42 s LYS 392 CO 0.00 -0.58 1.20 0.99 0.00 0.00 0.00 175.35 176.96 3g42 s THR 393 N -3.59 4.07 0.85 3.79 2.01 -1.26 -0.81 115.64 120.70 3g42 s THR 393 Ca 0.39 1.48 -0.12 0.00 0.31 0.00 0.00 61.69 63.76 3g42 s THR 393 Cb 0.03 -3.95 0.10 0.00 0.01 0.00 0.00 72.50 68.70 3g42 s THR 393 CO 0.23 0.10 1.10 0.27 -0.69 0.00 0.00 174.62 175.64 3g42 s ILE 394 N 1.19 2.70 0.69 1.82 -4.36 -0.03 -4.92 121.20 118.29 3g42 s ILE 394 Ca 0.58 0.23 -0.14 0.00 -0.26 0.00 0.00 60.65 61.07 3g42 s ILE 394 Cb -0.29 -2.92 0.01 0.00 1.25 0.00 0.00 42.46 40.52 3g42 s ILE 394 CO 0.28 -0.30 1.10 -0.76 0.24 0.00 0.00 174.94 175.51 3g42 s LEU 395 N -5.94 3.29 0.20 0.37 1.43 -1.26 -4.83 118.68 111.93 3g42 s LEU 395 Ca 0.62 1.93 -0.10 0.00 -1.03 0.00 0.00 54.13 55.55 3g42 s LEU 395 Cb -0.15 -4.54 0.15 0.00 0.03 0.00 0.00 46.19 41.67 3g42 s LEU 395 CO 0.55 -1.72 1.86 0.74 0.23 0.00 0.00 176.35 178.01 3g42 h THR 396 N -0.29 1.20 0.00 5.49 2.02 -1.99 -0.07 112.91 119.27 3g42 h THR 396 Ca -0.46 -0.41 -0.02 0.00 0.77 0.00 0.00 66.41 66.29 3g42 h THR 396 Cb 1.24 0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 67.80 3g42 h THR 396 CO 0.54 0.20 -0.09 0.07 0.37 0.00 0.00 175.52 176.61 3g42 h LYS 397 N 1.00 0.00 0.22 6.66 2.10 -1.96 -1.54 116.57 123.04 3g42 h LYS 397 Ca 0.27 0.00 -0.34 0.00 -2.00 0.00 0.00 60.65 58.58 3g42 h LYS 397 Cb -0.07 0.00 0.03 0.00 -0.90 0.00 0.00 32.23 31.29 3g42 h LYS 397 CO -0.05 0.09 -1.55 0.93 -2.00 0.00 0.00 179.45 176.86 3g42 h GLU 398 N 0.00 0.47 -0.71 0.07 5.08 -1.54 -3.15 114.58 114.79 3g42 h GLU 398 Ca -0.00 -0.80 0.03 0.00 -1.00 0.00 0.00 59.36 57.59 3g42 h GLU 398 Cb 0.37 0.30 -0.04 0.00 0.50 0.00 0.00 28.75 29.87 3g42 h GLU 398 CO 0.01 1.37 0.45 0.00 -1.00 0.00 0.00 179.01 179.85 3g42 h ALA 399 N 0.19 0.92 -0.68 3.43 0.00 -0.41 -1.53 119.26 121.20 3g42 h ALA 399 Ca -0.27 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.69 3g42 h ALA 399 Cb 2.13 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 19.62 3g42 h ALA 399 CO 0.24 0.24 0.34 -0.44 0.00 0.00 0.00 179.25 179.63 3g42 h ASP 400 N 0.89 0.46 0.45 0.00 5.19 -1.36 -2.52 116.42 119.53 3g42 h ASP 400 Ca 0.28 0.05 -0.14 0.00 -0.62 0.00 0.00 57.03 56.60 3g42 h ASP 400 Cb -0.01 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 39.46 3g42 h ASP 400 CO -0.10 0.28 -0.61 -0.07 -3.12 0.00 0.00 179.24 175.62 3g42 h LEU 401 N 0.60 0.18 -0.17 1.55 3.38 -1.36 -1.29 115.31 118.21 3g42 h LEU 401 Ca 0.32 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 3g42 h LEU 401 Cb 0.30 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 3g42 h LEU 401 CO -0.24 0.75 0.05 0.58 0.09 0.00 0.00 178.44 179.66 3g42 h VAL 402 N 0.12 1.19 -0.49 1.22 2.07 -0.89 0.90 116.25 120.37 3g42 h VAL 402 Ca -0.01 -0.61 -0.10 0.00 0.82 0.00 0.00 66.70 66.80 3g42 h VAL 402 Cb 1.10 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 3g42 h VAL 402 CO 0.09 0.19 -0.09 0.74 0.02 0.00 0.00 177.57 178.52 3g42 h THR 403 N 0.09 1.27 -0.45 2.57 2.02 -1.46 0.53 112.91 117.48 3g42 h THR 403 Ca 0.05 -1.21 0.05 0.00 0.77 0.00 0.00 66.41 66.07 3g42 h THR 403 Cb 0.25 1.06 -0.05 0.00 -1.74 0.00 0.00 68.15 67.67 3g42 h THR 403 CO -0.00 0.42 0.17 0.74 0.37 0.00 0.00 175.52 177.22 3g42 h THR 404 N 0.77 0.88 0.13 3.16 2.02 -1.09 -0.01 112.91 118.77 3g42 h THR 404 Ca 0.13 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.18 3g42 h THR 404 Cb 0.64 0.49 0.00 0.00 -1.74 0.00 0.00 68.15 67.54 3g42 h THR 404 CO 0.04 0.06 -0.06 -0.74 0.37 0.00 0.00 175.52 175.20 3g42 h HIS 405 N 0.35 -0.16 -0.48 3.16 6.17 -0.41 0.32 115.15 124.11 3g42 h HIS 405 Ca 0.21 -0.00 -0.02 0.00 0.71 0.00 0.00 60.37 61.26 3g42 h HIS 405 Cb 0.19 0.05 -0.02 0.00 2.52 0.00 0.00 27.41 30.15 3g42 h HIS 405 CO -0.14 -0.01 0.20 0.93 0.71 0.00 0.00 177.93 179.62 3g42 h GLU 406 N -0.27 0.70 -0.15 5.26 4.39 -0.68 0.09 114.58 123.93 3g42 h GLU 406 Ca -0.02 -0.12 -0.02 0.00 0.34 0.00 0.00 59.36 59.54 3g42 h GLU 406 Cb 0.22 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 3g42 h GLU 406 CO 0.03 0.62 0.01 -0.07 -1.16 0.00 0.00 179.01 178.43 3g42 h LEU 407 N 0.62 0.18 -0.53 1.33 4.07 -0.96 -1.22 115.31 118.81 3g42 h LEU 407 Ca 0.16 -0.02 0.01 0.00 0.08 0.00 0.00 57.88 58.11 3g42 h LEU 407 Cb 0.17 -0.05 -0.03 0.00 1.08 0.00 0.00 40.66 41.84 3g42 h LEU 407 CO -0.02 0.22 0.35 1.23 -1.08 0.00 0.00 178.44 179.14 3g42 h GLY 408 N 0.42 0.74 0.98 0.83 0.00 0.98 0.34 103.07 107.36 3g42 h GLY 408 Ca 0.05 -0.27 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 3g42 h GLY 408 CO 0.00 0.27 0.29 0.45 0.00 0.00 0.00 176.54 177.55 3g42 h HIS 409 N 0.71 0.73 -0.79 5.60 3.86 -0.23 -0.27 115.15 124.77 3g42 h HIS 409 Ca 0.19 -0.02 0.07 0.00 -1.16 0.00 0.00 60.37 59.45 3g42 h HIS 409 Cb -0.08 -0.23 -0.06 0.00 1.06 0.00 0.00 27.41 28.10 3g42 h HIS 409 CO -0.04 0.54 0.47 -0.91 0.86 0.00 0.00 177.93 178.85 3g42 h ASN 410 N 0.71 0.72 0.23 2.45 -0.26 -0.11 0.41 115.58 119.73 3g42 h ASN 410 Ca 0.19 0.03 0.00 0.00 -0.56 0.00 0.00 56.30 55.96 3g42 h ASN 410 Cb 0.05 -0.12 0.00 0.00 -1.06 0.00 0.00 38.32 37.19 3g42 h ASN 410 CO -0.03 0.45 0.00 0.49 -1.06 0.00 0.00 177.43 177.28 3g42 n PHE 411 N -4.70 0.00 0.00 1.19 3.01 0.11 -1.82 117.46 115.25 3g42 n PHE 411 Ca 0.11 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.57 3g42 n PHE 411 Cb 0.20 -0.20 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 3g42 n PHE 411 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3g42 n GLY 412 N 0.19 0.83 3.77 1.37 0.00 -0.00 -4.38 105.19 106.96 3g42 n GLY 412 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 3g42 n GLY 412 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g42 s ALA 413 N -2.00 3.42 0.53 4.61 0.00 -0.17 -4.41 121.76 123.74 3g42 s ALA 413 Ca 0.00 0.35 0.08 0.00 0.00 0.00 0.00 51.96 52.39 3g42 s ALA 413 Cb 0.00 -2.98 0.05 0.00 0.00 0.00 0.00 23.12 20.19 3g42 s ALA 413 CO 0.00 0.21 0.62 -1.21 0.00 0.00 0.00 175.76 175.39 3g42 s GLU 414 N -0.78 2.38 0.36 0.00 0.41 -1.26 -3.97 118.70 115.84 3g42 s GLU 414 Ca 0.37 -1.68 -0.27 0.00 -0.41 0.00 0.00 54.97 52.98 3g42 s GLU 414 Cb -0.22 -2.49 -0.09 0.00 -1.78 0.00 0.00 34.13 29.55 3g42 s GLU 414 CO 0.25 -0.66 1.22 -1.01 -0.49 0.00 0.00 175.26 174.57 3g42 s HIS 415 N -2.64 3.10 0.35 1.61 3.76 -1.26 -4.88 115.29 115.32 3g42 s HIS 415 Ca 0.52 1.52 -0.29 0.00 -0.15 0.00 0.00 55.06 56.66 3g42 s HIS 415 Cb -0.05 -3.50 -0.11 0.00 1.11 0.00 0.00 32.58 30.04 3g42 s HIS 415 CO 0.32 -1.47 1.39 -0.51 -0.85 0.00 0.00 174.74 173.63 3g42 s ASP 416 N -0.86 6.58 0.07 1.40 1.01 -0.67 -4.91 116.67 119.30 3g42 s ASP 416 Ca 0.53 2.85 -0.31 0.00 0.71 0.00 0.00 52.55 56.33 3g42 s ASP 416 Cb -0.35 -2.66 -0.09 0.00 1.01 0.00 0.00 42.92 40.84 3g42 s ASP 416 CO 0.44 -0.69 1.71 -2.84 0.21 0.00 0.00 175.17 174.00 3g42 s PRO 417 N -1.83 4.18 0.35 8.23 0.02 -1.26 -4.59 135.00 140.10 3g42 s PRO 417 Ca 0.51 2.40 0.27 0.00 0.02 0.00 0.00 61.00 64.20 3g42 s PRO 417 Cb -0.43 -3.65 1.01 0.00 0.02 0.00 0.00 34.50 31.46 3g42 s PRO 417 CO 0.57 -0.78 1.79 0.38 -0.33 0.00 0.00 177.00 178.63 3g42 h ASP 418 N 8.57 0.00 0.16 2.53 3.04 -1.93 -3.08 116.42 125.70 3g42 h ASP 418 Ca -0.44 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.35 3g42 h ASP 418 Cb 1.21 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.50 3g42 h ASP 418 CO 0.94 0.00 -0.72 0.61 -2.04 0.00 0.00 179.24 178.03 3g42 n GLY 419 N 0.31 -0.89 3.47 7.15 0.00 -1.26 -4.84 105.19 109.14 3g42 n GLY 419 Ca 0.02 -0.52 -0.43 0.00 0.00 0.00 0.00 46.02 45.09 3g42 n GLY 419 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3g42 s LEU 420 N -2.88 4.88 0.19 0.99 2.96 -1.17 -4.95 118.68 118.71 3g42 s LEU 420 Ca 0.12 -0.72 -0.17 0.00 -0.22 0.00 0.00 54.13 53.14 3g42 s LEU 420 Cb 0.17 -2.44 0.17 0.00 0.50 0.00 0.00 46.19 44.59 3g42 s LEU 420 CO 0.75 -0.68 1.62 0.00 -1.32 0.00 0.00 176.35 176.71 3g42 h ALA 421 N 8.81 0.22 -0.96 5.97 0.00 -1.88 -0.94 119.26 130.48 3g42 h ALA 421 Ca -0.27 0.20 0.19 0.00 0.00 0.00 0.00 54.91 55.03 3g42 h ALA 421 Cb 1.10 0.55 -0.18 0.00 0.00 0.00 0.00 17.79 19.26 3g42 h ALA 421 CO 0.85 -0.52 -0.25 1.49 0.00 0.00 0.00 179.25 180.82 3g42 h GLU 422 N -0.08 -0.00 -0.50 0.00 4.22 -1.95 -0.93 114.58 115.34 3g42 h GLU 422 Ca 0.26 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.70 3g42 h GLU 422 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3g42 h GLU 422 CO -0.61 -0.00 0.00 0.00 -2.18 0.00 0.00 179.01 176.22 3g42 n ALA 424 N 1.42 0.15 -1.07 0.00 0.00 -0.38 -4.51 120.51 116.13 3g42 n ALA 424 Ca 0.20 -2.21 -0.31 0.00 0.00 0.00 0.00 53.44 51.12 3g42 n ALA 424 Cb 0.58 -1.12 0.12 0.00 0.00 0.00 0.00 19.45 19.04 3g42 n ALA 424 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3g42 s PRO 425 N -0.12 1.69 0.65 0.00 0.02 -1.03 -4.57 135.00 131.64 3g42 s PRO 425 Ca 0.33 1.24 -0.11 0.00 0.02 0.00 0.00 61.00 62.48 3g42 s PRO 425 Cb 0.22 -1.83 -0.01 0.00 0.02 0.00 0.00 34.50 32.89 3g42 s PRO 425 CO -0.18 -2.06 1.04 -0.80 -0.33 0.00 0.00 177.00 174.66 3g42 s ASN 426 N -3.16 5.88 0.49 2.53 0.01 -1.26 -3.59 114.94 115.83 3g42 s ASN 426 Ca 0.63 1.23 0.22 0.00 -0.71 0.00 0.00 52.86 54.23 3g42 s ASN 426 Cb -0.19 -2.19 1.26 0.00 0.41 0.00 0.00 41.25 40.54 3g42 s ASN 426 CO 0.57 -1.06 1.96 1.05 -1.51 0.00 0.00 177.10 178.11 3g42 h GLU 427 N -0.42 0.16 -0.97 -0.60 4.11 -1.91 0.14 114.58 115.10 3g42 h GLU 427 Ca -0.45 -0.01 0.15 0.00 0.07 0.00 0.00 59.36 59.12 3g42 h GLU 427 Cb 1.22 -0.04 -0.09 0.00 0.50 0.00 0.00 28.75 30.35 3g42 h GLU 427 CO 0.63 0.11 0.61 -0.44 0.07 0.00 0.00 179.01 179.98 3g42 h ASP 428 N 0.17 0.79 -0.18 3.06 3.32 -1.97 -0.37 116.42 121.24 3g42 h ASP 428 Ca 0.31 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.42 3g42 h ASP 428 Cb 0.98 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.44 3g42 h ASP 428 CO -0.05 0.37 0.00 0.00 -1.72 0.00 0.00 179.24 177.85 3g42 n GLN 429 N -4.64 2.00 0.00 3.56 3.00 0.39 -4.88 117.38 116.80 3g42 n GLN 429 Ca 0.20 -1.48 0.00 0.00 -0.01 0.00 0.00 57.00 55.70 3g42 n GLN 429 Cb 0.46 -1.45 0.00 0.00 0.00 0.00 0.00 30.24 29.26 3g42 n GLN 429 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3g42 n GLY 430 N 1.26 0.93 5.37 1.08 0.00 -0.15 -4.91 105.19 108.77 3g42 n GLY 430 Ca 0.17 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.20 3g42 n GLY 430 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g42 n GLY 431 N 0.00 -1.98 3.81 -0.02 0.00 -0.58 -0.74 105.19 105.69 3g42 n GLY 431 Ca 0.00 -1.38 -0.31 0.00 0.00 0.00 0.00 46.02 44.33 3g42 n GLY 431 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g42 s LYS 432 N -0.29 2.77 0.44 1.61 -0.14 -1.24 -4.00 119.74 118.89 3g42 s LYS 432 Ca 0.00 1.01 -0.01 0.00 -1.36 0.00 0.00 55.97 55.61 3g42 s LYS 432 Cb 0.00 -1.97 -0.01 0.00 -1.68 0.00 0.00 37.83 34.17 3g42 s LYS 432 CO 0.00 -1.24 0.68 0.71 -0.76 0.00 0.00 175.35 174.74 3g42 s TYR 433 N -3.01 3.33 0.49 3.18 1.51 -1.26 -1.56 117.35 120.04 3g42 s TYR 433 Ca 0.59 0.37 0.28 0.00 -1.01 0.00 0.00 57.07 57.29 3g42 s TYR 433 Cb -0.15 -2.25 1.36 0.00 -0.11 0.00 0.00 41.96 40.81 3g42 s TYR 433 CO 0.55 -0.28 1.84 -0.24 -1.11 0.00 0.00 175.55 176.32 3g42 h VAL 434 N 0.41 0.53 -0.25 0.71 3.04 -1.04 -1.07 116.25 118.59 3g42 h VAL 434 Ca -0.47 -0.05 0.00 0.00 -1.01 0.00 0.00 66.70 65.17 3g42 h VAL 434 Cb 1.24 0.38 0.00 0.00 -2.01 0.00 0.00 31.29 30.90 3g42 h VAL 434 CO 0.59 0.03 0.00 0.23 -1.01 0.00 0.00 177.57 177.41 3g42 n MET 435 N -4.36 2.45 -2.03 4.17 2.81 -1.26 -4.77 117.12 114.14 3g42 n MET 435 Ca 0.22 -1.25 -0.40 0.00 -1.81 0.00 0.00 57.70 54.45 3g42 n MET 435 Cb 0.97 -1.72 -0.01 0.00 -0.71 0.00 0.00 33.22 31.75 3g42 n MET 435 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 3g42 s TYR 436 N -1.70 2.86 0.49 2.03 5.04 -0.41 -1.67 117.35 124.00 3g42 s TYR 436 Ca 0.22 1.37 0.16 0.00 -2.44 0.00 0.00 57.07 56.37 3g42 s TYR 436 Cb 0.16 -3.74 1.17 0.00 0.35 0.00 0.00 41.96 39.90 3g42 s TYR 436 CO 0.08 -2.17 2.09 -1.00 -1.34 0.00 0.00 175.55 173.20 3g42 h PRO 437 N 3.02 0.00 -5.15 4.97 0.13 -1.91 -3.39 132.00 129.67 3g42 h PRO 437 Ca -0.50 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.01 3g42 h PRO 437 Cb 1.24 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.22 3g42 h PRO 437 CO 0.64 0.08 -0.30 0.42 -0.23 0.00 0.00 178.00 178.60 3g42 s ILE 438 N -4.88 5.22 -0.36 -3.56 1.01 -1.26 -5.00 121.20 112.37 3g42 s ILE 438 Ca -0.05 0.49 -0.42 0.00 0.00 0.00 0.00 60.65 60.67 3g42 s ILE 438 Cb 0.16 -3.66 -0.17 0.00 0.01 0.00 0.00 42.46 38.81 3g42 s ILE 438 CO 0.68 0.20 1.76 0.00 0.00 0.00 0.00 174.94 177.58 3g42 n ALA 439 N 5.06 -0.39 -1.62 9.38 0.00 -1.26 -4.92 120.51 126.76 3g42 n ALA 439 Ca -0.10 0.38 -0.33 0.00 0.00 0.00 0.00 53.44 53.39 3g42 n ALA 439 Cb 0.51 -2.16 0.02 0.00 0.00 0.00 0.00 19.45 17.82 3g42 n ALA 439 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3g42 s VAL 440 N 3.80 3.54 0.16 0.00 -7.23 -1.26 -4.97 120.40 114.43 3g42 s VAL 440 Ca 1.02 0.75 -0.07 0.00 -1.81 0.00 0.00 61.98 61.87 3g42 s VAL 440 Cb -1.20 -3.27 -0.08 0.00 0.56 0.00 0.00 36.38 32.39 3g42 s VAL 440 CO 0.69 -0.41 1.44 0.77 -0.31 0.00 0.00 175.10 177.29 3g42 h SER 441 N 0.40 0.78 0.00 4.85 4.64 -1.98 -3.47 113.55 118.78 3g42 h SER 441 Ca -0.47 -0.44 0.00 0.00 -0.47 0.00 0.00 61.79 60.41 3g42 h SER 441 Cb 1.23 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 3g42 h SER 441 CO 0.56 1.19 0.00 0.61 -0.87 0.00 0.00 176.83 178.33 3g42 n GLY 442 N 0.36 0.35 0.19 -0.77 0.00 -1.26 -4.74 105.19 99.33 3g42 n GLY 442 Ca -0.04 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.04 3g42 n GLY 442 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3g42 h ASP 443 N 0.00 0.00 -2.86 1.61 3.32 -1.98 -3.46 116.42 113.04 3g42 h ASP 443 Ca 0.00 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.45 3g42 h ASP 443 Cb 0.00 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.50 3g42 h ASP 443 CO 0.00 0.36 -0.51 -1.00 -1.72 0.00 0.00 179.24 176.37 3g42 s HIS 444 N -3.52 3.45 0.23 4.55 3.76 -1.26 -5.04 115.29 117.46 3g42 s HIS 444 Ca 0.01 0.18 -0.10 0.00 -0.15 0.00 0.00 55.06 55.00 3g42 s HIS 444 Cb 0.10 -1.71 0.35 0.00 1.11 0.00 0.00 32.58 32.44 3g42 s HIS 444 CO 0.69 0.56 1.63 1.49 -0.85 0.00 0.00 174.74 178.26 3g42 h GLU 445 N 2.87 0.06 0.00 1.40 4.57 -1.88 -1.84 114.58 119.77 3g42 h GLU 445 Ca -0.46 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 3g42 h GLU 445 Cb 1.17 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 3g42 h GLU 445 CO 0.72 0.04 0.00 -0.91 -1.18 0.00 0.00 179.01 177.68 3g42 h ASN 446 N 0.06 0.00 -0.93 1.04 2.35 -1.14 -3.35 115.58 113.61 3g42 h ASN 446 Ca 0.37 0.00 0.19 0.00 -0.55 0.00 0.00 56.30 56.31 3g42 h ASN 446 Cb 0.62 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 38.91 3g42 h ASN 446 CO -0.66 0.00 0.60 0.78 -1.65 0.00 0.00 177.43 176.50 3g42 h ASN 447 N 0.00 0.54 -0.70 5.81 -0.26 -0.39 -1.36 115.58 119.22 3g42 h ASN 447 Ca 0.00 0.06 -0.20 0.00 -0.56 0.00 0.00 56.30 55.60 3g42 h ASN 447 Cb 0.67 -0.04 -0.12 0.00 -1.06 0.00 0.00 38.32 37.77 3g42 h ASN 447 CO 0.00 0.22 0.24 2.29 -1.06 0.00 0.00 177.43 179.11 3g42 n LYS 448 N -4.58 3.67 -4.26 0.81 2.85 -1.26 -2.59 118.16 112.80 3g42 n LYS 448 Ca 0.20 -3.09 -0.17 0.00 -1.05 0.00 0.00 58.31 54.20 3g42 n LYS 448 Cb 0.64 -2.19 -0.11 0.00 -0.65 0.00 0.00 35.03 32.72 3g42 n LYS 448 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 177.40 175.71 3g42 s MET 449 N -3.00 1.08 0.03 -1.58 -1.94 -0.51 -4.94 119.30 108.45 3g42 s MET 449 Ca 0.54 -1.37 -0.17 0.00 -1.71 0.00 0.00 55.69 52.98 3g42 s MET 449 Cb 0.44 -0.84 -0.06 0.00 2.01 0.00 0.00 34.83 36.38 3g42 s MET 449 CO 0.13 0.14 0.50 -0.06 -0.01 0.00 0.00 175.02 175.71 3g42 s PHE 450 N -2.68 3.76 0.97 -0.03 0.08 -1.26 -1.62 117.98 117.20 3g42 s PHE 450 Ca 0.14 1.14 -0.15 0.00 0.12 0.00 0.00 56.93 58.18 3g42 s PHE 450 Cb -0.02 -2.41 0.18 0.00 -0.57 0.00 0.00 43.02 40.20 3g42 s PHE 450 CO 0.03 0.59 1.18 -1.54 -0.10 0.00 0.00 175.22 175.38 3g42 s SER 451 N -1.02 2.98 0.36 1.36 1.04 -1.26 -4.80 113.70 112.36 3g42 s SER 451 Ca 0.27 0.71 0.09 0.00 0.48 0.00 0.00 55.95 57.49 3g42 s SER 451 Cb -0.18 -1.08 0.71 0.00 0.10 0.00 0.00 66.02 65.57 3g42 s SER 451 CO 0.16 -2.86 1.87 1.56 0.98 0.00 0.00 173.24 174.95 3g42 h GLN 452 N -1.71 0.26 -0.50 4.02 1.08 -1.93 -0.57 115.11 115.75 3g42 h GLN 452 Ca -0.48 -0.07 -0.08 0.00 -1.45 0.00 0.00 58.65 56.57 3g42 h GLN 452 Cb 1.30 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.68 3g42 h GLN 452 CO 0.51 0.44 -0.02 0.00 -0.95 0.00 0.00 178.83 178.81 3g42 h SER 454 N 0.78 0.79 -0.94 0.00 0.02 -1.74 -2.97 113.55 109.49 3g42 h SER 454 Ca 0.15 -0.59 0.06 0.00 -0.84 0.00 0.00 61.79 60.56 3g42 h SER 454 Cb 0.49 -0.23 -0.06 0.00 0.14 0.00 0.00 62.40 62.74 3g42 h SER 454 CO 0.02 1.25 0.61 0.11 -1.14 0.00 0.00 176.83 177.68 3g42 h LYS 455 N 0.38 1.07 0.40 3.45 1.57 -0.82 0.15 116.57 122.77 3g42 h LYS 455 Ca -0.02 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 3g42 h LYS 455 Cb 1.18 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 33.25 3g42 h LYS 455 CO 0.12 0.71 -0.19 1.96 -0.57 0.00 0.00 179.45 181.47 3g42 h GLN 456 N 1.10 -0.52 0.25 3.15 4.20 -1.21 0.11 115.11 122.20 3g42 h GLN 456 Ca 0.40 0.04 -0.00 0.00 0.06 0.00 0.00 58.65 59.14 3g42 h GLN 456 Cb 0.16 0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 3g42 h GLN 456 CO -0.15 -0.25 -0.20 0.77 -0.67 0.00 0.00 178.83 178.33 3g42 h SER 457 N -0.71 -0.52 -0.85 1.46 0.02 -1.33 -2.22 113.55 109.39 3g42 h SER 457 Ca -0.05 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.91 3g42 h SER 457 Cb 0.50 0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.17 3g42 h SER 457 CO 0.09 -0.31 0.41 0.40 -1.14 0.00 0.00 176.83 176.28 3g42 h ILE 458 N -0.46 1.26 -0.26 3.27 2.04 -1.02 -2.30 117.51 120.04 3g42 h ILE 458 Ca -0.01 -0.73 0.03 0.00 1.00 0.00 0.00 64.86 65.15 3g42 h ILE 458 Cb 0.41 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 3g42 h ILE 458 CO -0.01 0.31 0.07 0.22 0.00 0.00 0.00 178.15 178.75 3g42 h TYR 459 N 1.22 0.13 -0.94 1.37 3.20 -0.60 0.19 116.97 121.55 3g42 h TYR 459 Ca 0.29 0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.22 3g42 h TYR 459 Cb 0.12 -0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.31 3g42 h TYR 459 CO 0.02 0.06 0.61 0.87 -1.64 0.00 0.00 178.16 178.07 3g42 h LYS 460 N 0.18 1.10 -0.02 1.82 6.56 -1.07 0.11 116.57 125.25 3g42 h LYS 460 Ca 0.11 -0.07 -0.01 0.00 -1.06 0.00 0.00 60.65 59.63 3g42 h LYS 460 Cb 0.09 -0.25 0.00 0.00 -0.57 0.00 0.00 32.23 31.50 3g42 h LYS 460 CO -0.13 0.73 -0.03 1.15 -2.06 0.00 0.00 179.45 179.11 3g42 h THR 461 N 1.14 1.44 -0.07 -0.16 2.02 -0.83 -3.05 112.91 113.39 3g42 h THR 461 Ca 0.38 -1.34 0.03 0.00 0.77 0.00 0.00 66.41 66.26 3g42 h THR 461 Cb 0.08 2.30 -0.04 0.00 -1.74 0.00 0.00 68.15 68.75 3g42 h THR 461 CO -0.13 0.35 -0.14 0.40 0.37 0.00 0.00 175.52 176.37 3g42 h ILE 462 N -0.48 0.63 -0.78 3.11 2.04 -0.37 0.37 117.51 122.02 3g42 h ILE 462 Ca 0.00 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.02 3g42 h ILE 462 Cb 0.59 0.63 -0.15 0.00 -0.74 0.00 0.00 36.82 37.16 3g42 h ILE 462 CO 0.01 0.00 -0.20 -0.08 0.00 0.00 0.00 178.15 177.88 3g42 h GLU 463 N -0.20 -0.00 0.04 2.37 4.81 -0.85 0.42 114.58 121.16 3g42 h GLU 463 Ca 0.07 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3g42 h GLU 463 Cb 0.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.68 3g42 h GLU 463 CO -0.19 -0.00 -0.02 1.03 -0.73 0.00 0.00 179.01 179.10 3g42 h SER 464 N -0.00 -0.04 0.94 1.04 0.87 -1.34 -3.40 113.55 111.62 3g42 h SER 464 Ca 0.38 -0.41 -0.12 0.00 -1.23 0.00 0.00 61.79 60.40 3g42 h SER 464 Cb 0.57 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.53 3g42 h SER 464 CO -0.81 0.65 -0.56 0.11 -0.53 0.00 0.00 176.83 175.69 3g42 h LYS 465 N -0.98 0.00 -0.87 2.24 1.79 -0.12 -3.27 116.57 115.35 3g42 h LYS 465 Ca -0.01 0.00 0.17 0.00 -2.18 0.00 0.00 60.65 58.64 3g42 h LYS 465 Cb 0.45 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 31.00 3g42 h LYS 465 CO 0.01 0.56 0.43 0.00 -1.08 0.00 0.00 179.45 179.37 3g42 h ALA 466 N 1.44 1.35 -0.64 3.86 0.00 -0.32 0.49 119.26 125.45 3g42 h ALA 466 Ca -0.01 0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3g42 h ALA 466 Cb 1.18 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 3g42 h ALA 466 CO 0.07 -0.17 0.17 1.96 0.00 0.00 0.00 179.25 181.28 3g42 h GLN 467 N 0.56 0.99 0.53 0.00 4.20 -1.75 -1.68 115.11 117.95 3g42 h GLN 467 Ca 0.50 -0.21 -0.03 0.00 0.06 0.00 0.00 58.65 58.97 3g42 h GLN 467 Cb 0.80 -0.14 0.01 0.00 0.30 0.00 0.00 27.48 28.44 3g42 h GLN 467 CO -0.42 0.86 -0.26 0.93 -0.67 0.00 0.00 178.83 179.28 3g42 h GLU 468 N 0.95 -0.69 0.00 1.46 5.08 -0.18 -3.42 114.58 117.78 3g42 h GLU 468 Ca 0.21 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 3g42 h GLU 468 Cb 0.31 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.72 3g42 h GLU 468 CO -0.00 -0.41 0.00 0.00 -1.00 0.00 0.00 179.01 177.59 3g42 s PHE 470 N -0.08 2.90 0.03 0.00 0.40 -0.63 -4.71 117.98 115.88 3g42 s PHE 470 Ca 0.00 1.54 0.00 0.00 -0.60 0.00 0.00 56.93 57.87 3g42 s PHE 470 Cb 0.00 -3.08 -0.00 0.00 0.51 0.00 0.00 43.02 40.45 3g42 s PHE 470 CO 0.00 -1.19 0.01 1.04 0.70 0.00 0.00 175.22 175.79 3g42 n GLN 471 N -1.75 0.75 -2.51 0.44 6.02 0.47 -4.65 117.38 116.14 3g42 n GLN 471 Ca 0.09 -0.24 -0.41 0.00 -0.01 0.00 0.00 57.00 56.43 3g42 n GLN 471 Cb 0.52 0.14 -0.04 0.00 1.02 0.00 0.00 30.24 31.89 3g42 n GLN 471 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3g42 s GLU 472 N -2.11 4.62 0.03 -1.09 2.02 -0.80 -1.18 118.70 120.19 3g42 s GLU 472 Ca 0.02 1.73 -0.30 0.00 0.02 0.00 0.00 54.97 56.44 3g42 s GLU 472 Cb 0.00 -3.25 -0.06 0.00 0.10 0.00 0.00 34.13 30.92 3g42 s GLU 472 CO 0.01 0.14 1.35 0.50 0.02 0.00 0.00 175.26 177.28 3g42 s ARG 473 N -0.73 4.32 0.00 1.61 3.52 -1.26 -4.86 118.95 121.55 3g42 s ARG 473 Ca 0.47 1.93 0.29 0.00 -0.13 0.00 0.00 55.73 58.29 3g42 s ARG 473 Cb -0.30 -3.46 1.17 0.00 -1.56 0.00 0.00 34.95 30.80 3g42 s ARG 473 CO 0.37 -0.48 1.82 0.43 -0.81 0.00 0.00 175.30 176.62