#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kcz s GLU 227 N 0.00 0.45 0.22 1.09 2.02 -1.26 -4.80 118.70 116.41 3kcz s GLU 227 Ca 0.00 1.09 0.23 0.00 0.02 0.00 0.00 54.97 56.31 3kcz s GLU 227 Cb 0.00 -1.69 0.93 0.00 0.10 0.00 0.00 34.13 33.46 3kcz s GLU 227 CO 0.00 -2.87 1.70 0.09 0.02 0.00 0.00 175.26 174.20 3kcz n ASN 228 N -4.35 0.61 0.13 -0.19 5.03 -1.26 -1.99 115.26 113.24 3kcz n ASN 228 Ca 0.07 0.63 0.01 0.00 0.87 0.00 0.00 54.58 56.16 3kcz n ASN 228 Cb 0.54 -0.77 0.32 0.00 -1.02 0.00 0.00 39.78 38.85 3kcz n ASN 228 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 3kcz h LEU 229 N 0.00 0.17 0.00 3.41 3.38 -2.02 -3.34 115.31 116.92 3kcz h LEU 229 Ca 0.00 -0.05 -0.22 0.00 0.09 0.00 0.00 57.88 57.70 3kcz h LEU 229 Cb 0.41 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 3kcz h LEU 229 CO 0.00 0.47 -1.44 -1.22 0.09 0.00 0.00 178.44 176.34 3kcz n TYR 230 N -4.14 0.57 -3.90 1.13 4.02 -1.06 -4.88 117.16 108.91 3kcz n TYR 230 Ca -0.01 0.25 -0.35 0.00 -0.01 0.00 0.00 57.90 57.78 3kcz n TYR 230 Cb 0.38 -0.92 -0.13 0.00 -0.02 0.00 0.00 39.34 38.64 3kcz n TYR 230 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 3kcz s PHE 231 N -2.46 3.35 -0.35 -0.72 0.08 -0.84 -5.07 117.98 111.97 3kcz s PHE 231 Ca -0.29 -2.04 -0.29 0.00 0.12 0.00 0.00 56.93 54.44 3kcz s PHE 231 Cb 0.07 -2.34 -0.01 0.00 -0.57 0.00 0.00 43.02 40.18 3kcz s PHE 231 CO 0.47 -0.84 1.64 -0.65 -0.10 0.00 0.00 175.22 175.74 3kcz s GLN 232 N 1.21 3.47 0.29 0.44 -0.21 -1.25 -4.14 119.66 119.46 3kcz s GLN 232 Ca -0.02 1.28 0.11 0.00 0.02 0.00 0.00 55.36 56.74 3kcz s GLN 232 Cb -0.20 -4.12 -0.05 0.00 1.00 0.00 0.00 33.01 29.63 3kcz s GLN 232 CO -0.02 -1.70 -0.16 -1.54 -2.12 0.00 0.00 175.29 169.75 3kcz s SER 233 N 5.14 3.47 0.16 5.90 1.04 -1.26 -5.10 113.70 123.05 3kcz s SER 233 Ca 0.72 -1.07 -0.33 0.00 0.48 0.00 0.00 55.95 55.75 3kcz s SER 233 Cb -0.20 -0.29 -0.13 0.00 0.10 0.00 0.00 66.02 65.51 3kcz s SER 233 CO 0.33 -0.06 1.67 0.80 0.98 0.00 0.00 173.24 176.96 3kcz n MET 234 N -0.63 2.44 -1.59 4.02 1.56 -1.26 -4.90 117.12 116.76 3kcz n MET 234 Ca -0.05 0.88 -0.47 0.00 -0.27 0.00 0.00 57.70 57.79 3kcz n MET 234 Cb 0.61 -2.69 -0.03 0.00 2.15 0.00 0.00 33.22 33.25 3kcz n MET 234 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 3kcz n ASP 235 N 3.98 1.50 -0.31 6.12 -0.08 -1.26 -4.75 116.55 121.74 3kcz n ASP 235 Ca 0.17 1.15 0.16 0.00 -1.51 0.00 0.00 54.79 54.76 3kcz n ASP 235 Cb 0.32 -1.26 0.35 0.00 2.34 0.00 0.00 41.12 42.87 3kcz n ASP 235 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 3kcz h LEU 236 N 3.12 0.32 -0.43 -2.67 -0.00 -1.99 -0.78 115.31 112.87 3kcz h LEU 236 Ca -0.42 0.17 -0.16 0.00 -0.00 0.00 0.00 57.88 57.47 3kcz h LEU 236 Cb 1.33 0.16 -0.01 0.00 -0.00 0.00 0.00 40.66 42.15 3kcz h LEU 236 CO 0.68 -0.07 -0.43 0.03 -0.00 0.00 0.00 178.44 178.66 3kcz h ARG 237 N 0.35 0.84 -0.64 1.13 3.08 -1.99 -0.75 114.38 116.40 3kcz h ARG 237 Ca 0.61 -0.46 -0.09 0.00 0.07 0.00 0.00 59.98 60.11 3kcz h ARG 237 Cb 1.24 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.29 3kcz h ARG 237 CO -0.58 1.10 0.04 0.28 -1.07 0.00 0.00 179.97 179.75 3kcz h VAL 238 N 0.68 1.27 -0.20 2.04 2.07 -1.74 -1.58 116.25 118.77 3kcz h VAL 238 Ca 0.05 -1.11 0.03 0.00 0.82 0.00 0.00 66.70 66.49 3kcz h VAL 238 Cb 1.01 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 3kcz h VAL 238 CO 0.10 0.41 0.01 1.56 0.02 0.00 0.00 177.57 179.67 3kcz h GLN 239 N 1.01 0.08 -0.14 1.57 4.20 -0.65 0.05 115.11 121.22 3kcz h GLN 239 Ca 0.19 -0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.82 3kcz h GLN 239 Cb 0.51 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 3kcz h GLN 239 CO 0.02 0.05 -0.22 0.93 -0.67 0.00 0.00 178.83 178.95 3kcz h GLU 240 N 0.08 0.25 -0.08 1.46 4.39 -1.04 -1.01 114.58 118.63 3kcz h GLU 240 Ca 0.09 -0.08 -0.01 0.00 0.34 0.00 0.00 59.36 59.71 3kcz h GLU 240 Cb 0.11 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.73 3kcz h GLU 240 CO -0.15 0.46 0.03 1.25 -1.16 0.00 0.00 179.01 179.44 3kcz h LEU 241 N 0.23 0.11 -0.35 1.33 5.85 -0.73 -2.12 115.31 119.63 3kcz h LEU 241 Ca 0.04 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 3kcz h LEU 241 Cb 0.52 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 3kcz h LEU 241 CO 0.04 0.26 0.20 0.40 -0.34 0.00 0.00 178.44 178.99 3kcz h ILE 242 N -0.04 1.13 -0.82 4.05 1.08 -0.69 -1.18 117.51 121.03 3kcz h ILE 242 Ca 0.03 -0.31 0.02 0.00 -0.39 0.00 0.00 64.86 64.21 3kcz h ILE 242 Cb 0.18 0.70 -0.04 0.00 -3.07 0.00 0.00 36.82 34.59 3kcz h ILE 242 CO -0.00 0.13 0.54 0.11 -0.69 0.00 0.00 178.15 178.24 3kcz h LYS 243 N 0.45 1.04 0.38 2.37 1.57 -1.20 -0.57 116.57 120.61 3kcz h LYS 243 Ca 0.12 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 3kcz h LYS 243 Cb 0.03 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.11 3kcz h LYS 243 CO -0.02 0.69 -0.18 1.25 -0.57 0.00 0.00 179.45 180.61 3kcz h LEU 244 N 1.07 -0.44 -0.86 2.94 5.85 -0.85 -2.85 115.31 120.18 3kcz h LEU 244 Ca 0.31 -0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.83 3kcz h LEU 244 Cb -0.05 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 3kcz h LEU 244 CO -0.08 -0.09 -0.39 0.16 -0.34 0.00 0.00 178.44 177.71 3kcz h ILE 245 N -0.82 0.88 -0.01 4.05 3.07 -1.02 -2.97 117.51 120.69 3kcz h ILE 245 Ca -0.05 -1.58 0.00 0.00 1.55 0.00 0.00 64.86 64.78 3kcz h ILE 245 Cb 0.54 1.97 0.00 0.00 -0.27 0.00 0.00 36.82 39.05 3kcz h ILE 245 CO 0.09 0.38 -0.03 0.00 -1.05 0.00 0.00 178.15 177.53 3kcz s ASN 247 N -2.10 5.33 0.20 0.00 3.84 -1.08 -4.85 114.94 116.28 3kcz s ASN 247 Ca 0.38 1.11 -0.00 0.00 0.21 0.00 0.00 52.86 54.56 3kcz s ASN 247 Cb 0.21 -2.52 0.14 0.00 -0.55 0.00 0.00 41.25 38.53 3kcz s ASN 247 CO 0.38 -2.19 1.50 0.58 -2.79 0.00 0.00 177.10 174.58 3kcz h VAL 248 N 7.09 1.36 -0.56 -5.21 2.07 -1.92 -2.75 116.25 116.33 3kcz h VAL 248 Ca -0.31 -1.97 0.05 0.00 0.82 0.00 0.00 66.70 65.29 3kcz h VAL 248 Cb 1.20 1.96 -0.05 0.00 -1.52 0.00 0.00 31.29 32.89 3kcz h VAL 248 CO 1.09 0.60 0.29 -0.61 0.02 0.00 0.00 177.57 178.97 3kcz h GLN 249 N 0.29 0.55 -0.87 1.57 5.75 -2.00 -0.56 115.11 119.84 3kcz h GLN 249 Ca -0.01 -0.03 0.01 0.00 -0.15 0.00 0.00 58.65 58.47 3kcz h GLN 249 Cb 1.17 -0.12 -0.04 0.00 1.07 0.00 0.00 27.48 29.55 3kcz h GLN 249 CO 0.11 0.36 0.57 0.00 -2.65 0.00 0.00 178.83 177.22 3kcz h ALA 250 N 1.30 1.40 -0.58 3.38 0.00 -1.94 -1.18 119.26 121.64 3kcz h ALA 250 Ca 0.25 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 3kcz h ALA 250 Cb 0.15 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3kcz h ALA 250 CO -0.17 0.55 0.07 0.52 0.00 0.00 0.00 179.25 180.22 3kcz h MET 251 N 1.15 0.98 -0.56 0.00 2.86 -0.89 -0.20 114.93 118.28 3kcz h MET 251 Ca 0.32 -0.28 0.05 0.00 -2.06 0.00 0.00 59.70 57.74 3kcz h MET 251 Cb -0.10 -0.11 -0.05 0.00 0.06 0.00 0.00 31.60 31.40 3kcz h MET 251 CO -0.08 0.95 0.28 0.93 1.06 0.00 0.00 176.91 180.05 3kcz h GLU 252 N 0.88 0.52 -0.43 1.72 5.08 -0.72 -1.32 114.58 120.32 3kcz h GLU 252 Ca 0.17 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.38 3kcz h GLU 252 Cb 0.46 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 3kcz h GLU 252 CO 0.02 0.34 -0.23 0.93 -1.00 0.00 0.00 179.01 179.07 3kcz h GLU 253 N 0.53 0.87 -0.75 2.33 5.08 -0.83 -1.65 114.58 120.15 3kcz h GLU 253 Ca 0.25 -0.36 -0.06 0.00 -1.00 0.00 0.00 59.36 58.19 3kcz h GLU 253 Cb 0.18 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 3kcz h GLU 253 CO -0.18 1.00 0.24 0.52 -1.00 0.00 0.00 179.01 179.59 3kcz h MET 254 N 0.75 1.17 -0.20 2.33 2.86 -0.77 -2.10 114.93 118.96 3kcz h MET 254 Ca 0.10 -0.25 -0.17 0.00 -2.06 0.00 0.00 59.70 57.32 3kcz h MET 254 Cb 0.77 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 32.25 3kcz h MET 254 CO 0.06 0.99 -0.55 0.52 1.06 0.00 0.00 176.91 178.99 3kcz h MET 255 N 1.12 0.62 -0.55 1.72 2.86 -0.98 -2.21 114.93 117.50 3kcz h MET 255 Ca 0.24 -0.39 -0.02 0.00 -2.06 0.00 0.00 59.70 57.47 3kcz h MET 255 Cb 0.31 0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.99 3kcz h MET 255 CO -0.01 1.01 0.25 0.52 1.06 0.00 0.00 176.91 179.74 3kcz h MET 256 N 0.47 0.78 -0.27 1.72 2.07 -1.20 -0.94 114.93 117.57 3kcz h MET 256 Ca 0.01 -0.10 -0.06 0.00 -2.07 0.00 0.00 59.70 57.47 3kcz h MET 256 Cb 1.11 -0.15 -0.02 0.00 -1.87 0.00 0.00 31.60 30.68 3kcz h MET 256 CO 0.11 0.62 -0.10 0.93 1.07 0.00 0.00 176.91 179.54 3kcz h GLU 257 N 0.78 0.44 -0.08 1.72 5.08 -1.06 -1.08 114.58 120.38 3kcz h GLU 257 Ca 0.19 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3kcz h GLU 257 Cb 0.11 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3kcz h GLU 257 CO -0.02 0.54 0.00 -1.33 -1.00 0.00 0.00 179.01 177.20 3kcz n MET 258 N -4.24 1.21 -1.00 2.33 2.81 -0.45 -4.88 117.12 112.90 3kcz n MET 258 Ca 0.00 -0.33 -0.00 0.00 -1.81 0.00 0.00 57.70 55.56 3kcz n MET 258 Cb 0.29 -1.14 -0.00 0.00 -0.71 0.00 0.00 33.22 31.66 3kcz n MET 258 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3kcz n LYS 259 N -0.29 -0.13 -2.50 0.03 4.76 -0.41 -5.02 118.16 114.61 3kcz n LYS 259 Ca 0.06 0.07 -0.41 0.00 -2.87 0.00 0.00 58.31 55.16 3kcz n LYS 259 Cb 0.09 -3.20 -0.04 0.00 -1.84 0.00 0.00 35.03 30.04 3kcz n LYS 259 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 3kcz s TYR 260 N -1.94 3.59 -1.01 2.13 5.04 -0.65 -0.23 117.35 124.29 3kcz s TYR 260 Ca 0.00 1.64 -0.17 0.00 -2.44 0.00 0.00 57.07 56.10 3kcz s TYR 260 Cb 0.00 -3.28 0.14 0.00 0.35 0.00 0.00 41.96 39.17 3kcz s TYR 260 CO 0.00 -0.58 1.22 1.21 -1.34 0.00 0.00 175.55 176.06 3kcz s ASN 261 N -0.46 6.75 0.52 4.32 3.84 -0.09 -4.07 114.94 125.76 3kcz s ASN 261 Ca 0.47 -2.30 0.28 0.00 0.21 0.00 0.00 52.86 51.53 3kcz s ASN 261 Cb -0.31 -2.40 1.44 0.00 -0.55 0.00 0.00 41.25 39.43 3kcz s ASN 261 CO 0.37 -0.98 2.06 0.71 -2.79 0.00 0.00 177.10 176.47 3kcz h THR 262 N 5.53 0.49 0.01 -5.21 1.35 -1.88 -1.14 112.91 112.06 3kcz h THR 262 Ca 0.20 -0.57 -0.00 0.00 -0.55 0.00 0.00 66.41 65.50 3kcz h THR 262 Cb 0.98 1.38 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 3kcz h THR 262 CO 1.15 0.11 -0.01 0.11 -0.25 0.00 0.00 175.52 176.64 3kcz h LYS 263 N 0.00 -0.02 -0.01 4.72 1.79 -1.99 -2.70 116.57 118.37 3kcz h LYS 263 Ca -0.00 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.35 3kcz h LYS 263 Cb 0.37 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.01 3kcz h LYS 263 CO 0.02 0.51 -0.56 0.87 -1.08 0.00 0.00 179.45 179.20 3kcz h LYS 264 N -0.55 0.02 -2.41 3.15 6.56 -1.95 -3.38 116.57 118.01 3kcz h LYS 264 Ca -0.00 -0.01 -0.59 0.00 -1.06 0.00 0.00 60.65 58.99 3kcz h LYS 264 Cb 0.53 0.00 -0.39 0.00 -0.57 0.00 0.00 32.23 31.80 3kcz h LYS 264 CO 0.00 0.58 -0.91 0.00 -2.06 0.00 0.00 179.45 177.05 3kcz n ALA 265 N -2.44 2.94 -1.72 3.86 0.00 -0.44 -5.08 120.51 117.63 3kcz n ALA 265 Ca -0.01 -3.48 -0.41 0.00 0.00 0.00 0.00 53.44 49.53 3kcz n ALA 265 Cb 0.57 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.21 3kcz n ALA 265 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3kcz n PRO 266 N 2.33 2.19 -0.31 0.00 -0.02 -1.02 -4.46 135.00 133.71 3kcz n PRO 266 Ca 0.27 0.77 0.03 0.00 -2.02 0.00 0.00 63.50 62.55 3kcz n PRO 266 Cb 0.46 -2.46 0.22 0.00 -0.02 0.00 0.00 33.50 31.70 3kcz n PRO 266 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3kcz h LEU 267 N 2.43 0.94 -2.35 2.45 3.38 -1.94 -1.02 115.31 119.20 3kcz h LEU 267 Ca -0.48 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.50 3kcz h LEU 267 Cb 1.28 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 3kcz h LEU 267 CO 0.62 0.61 0.22 1.23 0.09 0.00 0.00 178.44 181.21 3kcz h GLY 268 N 1.07 0.00 -1.19 0.83 0.00 -1.97 -2.11 103.07 99.71 3kcz h GLY 268 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.72 3kcz h GLY 268 CO -0.14 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.68 3kcz n LYS 269 N -3.03 1.52 -2.39 4.80 5.02 -0.39 -4.98 118.16 118.70 3kcz n LYS 269 Ca -0.02 -1.57 -0.41 0.00 -2.02 0.00 0.00 58.31 54.29 3kcz n LYS 269 Cb 0.28 -1.27 -0.04 0.00 -0.02 0.00 0.00 35.03 33.98 3kcz n LYS 269 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3kcz s LEU 270 N -1.05 4.48 0.31 -0.35 2.96 -0.79 -5.02 118.68 119.22 3kcz s LEU 270 Ca 0.19 2.27 0.10 0.00 -0.22 0.00 0.00 54.13 56.46 3kcz s LEU 270 Cb 0.12 -3.61 -0.05 0.00 0.50 0.00 0.00 46.19 43.14 3kcz s LEU 270 CO 0.17 -0.31 -0.03 0.42 -1.32 0.00 0.00 176.35 175.27 3kcz s THR 271 N -0.43 2.78 0.29 3.68 -4.23 -1.26 -4.96 115.64 111.51 3kcz s THR 271 Ca 0.50 -2.05 0.00 0.00 -1.18 0.00 0.00 61.69 58.97 3kcz s THR 271 Cb -0.33 -2.71 0.13 0.00 1.34 0.00 0.00 72.50 70.93 3kcz s THR 271 CO 0.39 -0.28 1.80 -0.37 -0.54 0.00 0.00 174.62 175.62 3kcz h VAL 272 N 1.92 1.23 -0.80 2.29 -1.51 -1.99 -2.65 116.25 114.74 3kcz h VAL 272 Ca -0.43 -0.94 -0.03 0.00 -1.23 0.00 0.00 66.70 64.08 3kcz h VAL 272 Cb 1.25 0.92 -0.04 0.00 -2.13 0.00 0.00 31.29 31.29 3kcz h VAL 272 CO 0.64 0.33 0.38 0.00 -1.23 0.00 0.00 177.57 177.69 3kcz h ALA 273 N 1.35 1.16 -0.57 5.19 0.00 -1.99 -0.86 119.26 123.54 3kcz h ALA 273 Ca 0.13 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 3kcz h ALA 273 Cb 0.42 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3kcz h ALA 273 CO 0.02 0.63 -0.01 1.96 0.00 0.00 0.00 179.25 181.85 3kcz h GLN 274 N 1.14 1.00 -0.34 0.00 4.20 -1.90 -0.62 115.11 118.60 3kcz h GLN 274 Ca 0.28 -0.31 -0.04 0.00 0.06 0.00 0.00 58.65 58.63 3kcz h GLN 274 Cb 0.12 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 3kcz h GLN 274 CO -0.03 0.99 0.05 0.82 -0.67 0.00 0.00 178.83 179.98 3kcz h ILE 275 N 0.92 1.24 -0.61 2.54 2.04 -1.14 -0.73 117.51 121.77 3kcz h ILE 275 Ca 0.16 -0.85 0.05 0.00 1.00 0.00 0.00 64.86 65.22 3kcz h ILE 275 Cb 0.55 1.14 -0.05 0.00 -0.74 0.00 0.00 36.82 37.72 3kcz h ILE 275 CO 0.03 0.28 0.34 0.50 0.00 0.00 0.00 178.15 179.30 3kcz h LYS 276 N 0.40 0.63 -1.00 2.37 3.64 -1.07 -0.27 116.57 121.26 3kcz h LYS 276 Ca 0.10 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.48 3kcz h LYS 276 Cb 0.37 -0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 31.99 3kcz h LYS 276 CO 0.01 0.42 0.65 0.00 -2.27 0.00 0.00 179.45 178.26 3kcz h ALA 277 N 1.30 1.32 -0.18 5.00 0.00 -0.86 -1.81 119.26 124.03 3kcz h ALA 277 Ca 0.26 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.17 3kcz h ALA 277 Cb 0.12 -0.36 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 3kcz h ALA 277 CO -0.15 0.56 -0.11 0.78 0.00 0.00 0.00 179.25 180.33 3kcz h GLY 278 N 1.27 0.04 0.53 0.00 0.00 0.14 -2.08 103.07 102.97 3kcz h GLY 278 Ca 0.39 0.14 0.09 0.00 0.00 0.00 0.00 47.33 47.95 3kcz h GLY 278 CO -0.12 -0.13 0.44 -0.97 0.00 0.00 0.00 176.54 175.77 3kcz h TYR 279 N -0.10 0.80 -0.48 5.60 0.05 -0.65 -1.40 116.97 120.79 3kcz h TYR 279 Ca 0.11 0.03 -0.05 0.00 0.05 0.00 0.00 58.73 58.87 3kcz h TYR 279 Cb 0.26 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 37.73 3kcz h TYR 279 CO -0.26 0.33 0.09 1.96 -1.05 0.00 0.00 178.16 179.23 3kcz h GLN 280 N 0.75 0.74 -0.45 4.88 4.20 -0.98 -0.17 115.11 124.09 3kcz h GLN 280 Ca 0.38 -0.15 -0.10 0.00 0.06 0.00 0.00 58.65 58.83 3kcz h GLN 280 Cb 0.35 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.00 3kcz h GLN 280 CO -0.24 0.69 -0.14 0.77 -0.67 0.00 0.00 178.83 179.24 3kcz h SER 281 N 0.71 0.83 -0.08 1.46 0.02 -0.84 -2.20 113.55 113.45 3kcz h SER 281 Ca 0.16 -0.27 -0.04 0.00 -0.84 0.00 0.00 61.79 60.80 3kcz h SER 281 Cb 0.30 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 3kcz h SER 281 CO 0.00 0.97 -0.04 -0.07 -1.14 0.00 0.00 176.83 176.55 3kcz h LEU 282 N 0.74 0.29 -0.60 5.07 3.38 -0.36 -1.30 115.31 122.53 3kcz h LEU 282 Ca 0.12 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 3kcz h LEU 282 Cb 0.64 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 3kcz h LEU 282 CO 0.04 0.38 -0.00 0.50 0.09 0.00 0.00 178.44 179.45 3kcz h LYS 283 N 0.31 1.07 -0.70 1.13 1.63 -0.67 0.26 116.57 119.59 3kcz h LYS 283 Ca 0.07 -0.34 0.03 0.00 -0.85 0.00 0.00 60.65 59.55 3kcz h LYS 283 Cb 0.28 -0.10 -0.04 0.00 -0.60 0.00 0.00 32.23 31.77 3kcz h LYS 283 CO 0.01 1.05 0.44 0.87 -3.45 0.00 0.00 179.45 178.37 3kcz h LYS 284 N 0.97 0.84 -0.46 1.90 1.57 -0.79 -0.58 116.57 120.02 3kcz h LYS 284 Ca 0.17 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 3kcz h LYS 284 Cb 0.57 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 3kcz h LYS 284 CO 0.03 0.56 0.25 0.82 -0.57 0.00 0.00 179.45 180.54 3kcz h ILE 285 N 0.87 1.17 -0.62 1.86 2.04 -0.80 -2.18 117.51 119.84 3kcz h ILE 285 Ca 0.28 -0.44 0.06 0.00 1.00 0.00 0.00 64.86 65.76 3kcz h ILE 285 Cb 0.00 0.62 -0.05 0.00 -0.74 0.00 0.00 36.82 36.65 3kcz h ILE 285 CO -0.10 0.18 0.34 -0.08 0.00 0.00 0.00 178.15 178.48 3kcz h GLU 286 N 0.60 0.61 -0.94 2.37 4.81 0.14 -0.52 114.58 121.65 3kcz h GLU 286 Ca 0.16 -0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.43 3kcz h GLU 286 Cb 0.06 -0.14 -0.07 0.00 0.63 0.00 0.00 28.75 29.24 3kcz h GLU 286 CO -0.02 0.40 0.59 -0.44 -0.73 0.00 0.00 179.01 178.81 3kcz h ASP 287 N 0.63 0.92 -0.18 1.04 3.32 -0.91 0.18 116.42 121.43 3kcz h ASP 287 Ca 0.28 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.30 3kcz h ASP 287 Cb 0.18 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 3kcz h ASP 287 CO -0.18 0.57 -0.07 0.00 -1.72 0.00 0.00 179.24 177.84 3kcz h ILE 289 N 0.06 1.12 -0.54 0.00 2.04 -0.73 -0.32 117.51 119.13 3kcz h ILE 289 Ca 0.04 -0.32 -0.05 0.00 1.00 0.00 0.00 64.86 65.54 3kcz h ILE 289 Cb 0.53 0.11 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 3kcz h ILE 289 CO 0.02 0.17 0.15 -0.09 0.00 0.00 0.00 178.15 178.40 3kcz h ARG 290 N 0.93 0.83 -0.00 2.37 2.43 -0.55 -2.60 114.38 117.78 3kcz h ARG 290 Ca 0.29 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 3kcz h ARG 290 Cb -0.00 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.42 3kcz h ARG 290 CO -0.10 0.73 -0.08 0.00 -1.51 0.00 0.00 179.97 179.01 3kcz n ALA 291 N -2.46 2.70 -1.51 2.80 0.00 -0.76 -4.91 120.51 116.36 3kcz n ALA 291 Ca 0.04 -0.24 -0.15 0.00 0.00 0.00 0.00 53.44 53.09 3kcz n ALA 291 Cb 0.22 -1.37 -0.06 0.00 0.00 0.00 0.00 19.45 18.23 3kcz n ALA 291 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kcz n GLY 292 N 1.26 1.36 3.75 0.00 0.00 -0.73 -4.99 105.19 105.85 3kcz n GLY 292 Ca 0.15 -0.31 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 3kcz n GLY 292 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3kcz s GLN 293 N -3.40 4.53 0.00 1.61 -2.07 -0.21 -4.94 119.66 115.19 3kcz s GLN 293 Ca 0.00 1.90 0.14 0.00 -1.82 0.00 0.00 55.36 55.58 3kcz s GLN 293 Cb 0.00 -3.19 0.23 0.00 -1.09 0.00 0.00 33.01 28.96 3kcz s GLN 293 CO 0.00 0.02 1.06 0.72 -1.32 0.00 0.00 175.29 175.78 3kcz n HIS 294 N 1.67 0.00 0.00 9.60 8.25 -1.26 -4.53 115.22 128.95 3kcz n HIS 294 Ca 0.01 -0.32 0.00 0.00 -0.26 0.00 0.00 57.72 57.15 3kcz n HIS 294 Cb 0.44 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.52 3kcz n HIS 294 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kcz n GLY 295 N 0.27 3.34 0.24 -1.41 0.00 -1.26 -4.92 105.19 101.45 3kcz n GLY 295 Ca 0.00 -0.97 0.01 0.00 0.00 0.00 0.00 46.02 45.07 3kcz n GLY 295 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3kcz h ARG 296 N 0.00 0.30 -0.36 1.61 2.43 -1.99 -2.10 114.38 114.28 3kcz h ARG 296 Ca 0.00 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.16 3kcz h ARG 296 Cb 0.00 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 3kcz h ARG 296 CO 0.00 0.20 0.22 0.00 -1.51 0.00 0.00 179.97 178.88 3kcz h ALA 297 N 1.48 0.45 -0.26 2.80 0.00 -1.98 0.69 119.26 122.44 3kcz h ALA 297 Ca 0.33 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.15 3kcz h ALA 297 Cb 0.48 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3kcz h ALA 297 CO -0.39 -0.13 -0.14 1.25 0.00 0.00 0.00 179.25 179.85 3kcz h LEU 298 N 0.44 0.57 -0.02 0.00 5.85 -1.79 -0.85 115.31 119.51 3kcz h LEU 298 Ca 0.14 -0.41 0.03 0.00 0.84 0.00 0.00 57.88 58.47 3kcz h LEU 298 Cb -0.01 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 3kcz h LEU 298 CO -0.06 0.86 -0.15 -0.03 -0.34 0.00 0.00 178.44 178.72 3kcz h MET 299 N 0.28 -0.23 -0.87 1.25 4.05 -1.23 0.36 114.93 118.54 3kcz h MET 299 Ca 0.06 0.02 0.07 0.00 -0.28 0.00 0.00 59.70 59.56 3kcz h MET 299 Cb 0.65 0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 31.44 3kcz h MET 299 CO 0.04 -0.16 0.57 0.93 0.23 0.00 0.00 176.91 178.52 3kcz h GLU 300 N -0.24 0.92 -0.02 0.39 5.08 -0.76 0.39 114.58 120.33 3kcz h GLU 300 Ca 0.06 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3kcz h GLU 300 Cb 0.32 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 3kcz h GLU 300 CO -0.17 0.61 -0.03 0.00 -1.00 0.00 0.00 179.01 178.42 3kcz h ALA 301 N 1.54 0.04 -0.65 3.43 0.00 -0.35 -1.43 119.26 121.83 3kcz h ALA 301 Ca 0.38 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3kcz h ALA 301 Cb 0.26 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3kcz h ALA 301 CO -0.14 -0.18 0.27 0.00 0.00 0.00 0.00 179.25 179.19 3kcz h ASN 303 N 0.93 0.77 -0.42 0.00 2.35 -0.92 -1.25 115.58 117.05 3kcz h ASN 303 Ca 0.22 -0.31 0.03 0.00 -0.55 0.00 0.00 56.30 55.69 3kcz h ASN 303 Cb 0.17 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.30 3kcz h ASN 303 CO -0.02 0.89 0.21 -0.08 -1.65 0.00 0.00 177.43 176.78 3kcz h GLU 304 N 0.63 0.40 -0.28 0.81 4.81 -1.04 -0.47 114.58 119.43 3kcz h GLU 304 Ca 0.12 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 3kcz h GLU 304 Cb 0.50 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 3kcz h GLU 304 CO 0.02 0.27 0.19 0.35 -0.73 0.00 0.00 179.01 179.11 3kcz h PHE 305 N 0.42 0.36 0.00 0.92 3.57 -0.90 -1.48 116.94 119.82 3kcz h PHE 305 Ca 0.18 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 3kcz h PHE 305 Cb 0.09 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 3kcz h PHE 305 CO -0.10 0.22 -0.18 1.88 -2.23 0.00 0.00 178.31 177.90 3kcz h TYR 306 N 0.38 0.00 -0.15 0.41 0.05 -1.09 0.23 116.97 116.80 3kcz h TYR 306 Ca 0.10 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.71 3kcz h TYR 306 Cb -0.04 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.70 3kcz h TYR 306 CO -0.06 0.18 -0.58 1.15 -1.05 0.00 0.00 178.16 177.80 3kcz h THR 307 N 0.00 1.32 0.01 -2.88 2.02 -0.81 -3.21 112.91 109.38 3kcz h THR 307 Ca -0.00 -1.83 -0.20 0.00 0.77 0.00 0.00 66.41 65.14 3kcz h THR 307 Cb 0.59 2.03 -0.02 0.00 -1.74 0.00 0.00 68.15 69.01 3kcz h THR 307 CO 0.02 0.57 -0.92 0.03 0.37 0.00 0.00 175.52 175.59 3kcz h ARG 308 N 0.33 0.12 -2.88 6.66 3.08 -0.77 -3.39 114.38 117.53 3kcz h ARG 308 Ca -0.03 -0.15 -0.61 0.00 0.07 0.00 0.00 59.98 59.26 3kcz h ARG 308 Cb 1.21 0.05 -0.40 0.00 0.08 0.00 0.00 29.97 30.90 3kcz h ARG 308 CO 0.12 0.95 -0.73 0.42 -1.07 0.00 0.00 179.97 179.66 3kcz s ILE 309 N -3.06 1.80 0.32 2.04 -1.09 0.75 -4.90 121.20 117.05 3kcz s ILE 309 Ca -0.02 -3.35 -0.29 0.00 -2.23 0.00 0.00 60.65 54.77 3kcz s ILE 309 Cb 0.10 -2.21 -0.12 0.00 -1.58 0.00 0.00 42.46 38.65 3kcz s ILE 309 CO 0.82 -1.03 1.51 -2.65 -1.23 0.00 0.00 174.94 172.36 3kcz n PRO 310 N 2.67 2.56 -4.42 2.79 -0.02 -1.21 -4.46 135.00 132.91 3kcz n PRO 310 Ca 0.19 0.91 -0.23 0.00 -2.02 0.00 0.00 63.50 62.34 3kcz n PRO 310 Cb 0.38 -2.64 -0.11 0.00 -0.02 0.00 0.00 33.50 31.12 3kcz n PRO 310 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 3kcz s HIS 311 N -0.47 2.11 -0.34 6.00 3.76 -1.26 -0.91 115.29 124.18 3kcz s HIS 311 Ca 0.60 -0.40 0.03 0.00 -0.15 0.00 0.00 55.06 55.14 3kcz s HIS 311 Cb -0.51 -0.97 0.10 0.00 1.11 0.00 0.00 32.58 32.31 3kcz s HIS 311 CO 0.55 0.55 0.07 0.34 -0.85 0.00 0.00 174.74 175.40 3kcz s ASP 312 N -3.19 4.62 -0.20 1.40 2.15 0.68 -4.65 116.67 117.49 3kcz s ASP 312 Ca 0.25 -2.12 0.15 0.00 0.43 0.00 0.00 52.55 51.26 3kcz s ASP 312 Cb -0.05 -1.50 0.75 0.00 -0.30 0.00 0.00 42.92 41.82 3kcz s ASP 312 CO 0.11 -0.38 1.67 0.49 -0.17 0.00 0.00 175.17 176.89 3kcz n PHE 313 N 4.29 1.77 0.00 -5.34 3.72 -1.26 -4.87 117.46 115.77 3kcz n PHE 313 Ca 0.03 -0.73 0.00 0.00 -0.05 0.00 0.00 57.45 56.70 3kcz n PHE 313 Cb 0.41 -0.43 0.00 0.00 -0.94 0.00 0.00 39.48 38.53 3kcz n PHE 313 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3kcz n GLY 314 N 0.52 3.04 0.67 1.37 0.00 -1.26 -1.70 105.19 107.83 3kcz n GLY 314 Ca 0.26 0.22 0.13 0.00 0.00 0.00 0.00 46.02 46.63 3kcz n GLY 314 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3kcz n LEU 315 N 0.00 2.08 -4.84 0.99 4.77 -1.26 -4.93 117.00 113.81 3kcz n LEU 315 Ca 0.00 -0.74 -0.35 0.00 -0.03 0.00 0.00 56.01 54.89 3kcz n LEU 315 Cb 0.00 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 40.99 3kcz n LEU 315 CO 0.00 0.37 0.33 -0.60 -1.33 0.00 0.00 177.39 176.16 3kcz s ARG 316 N -1.93 4.06 0.11 3.23 3.52 -0.69 -5.01 118.95 122.25 3kcz s ARG 316 Ca 0.34 0.63 -0.34 0.00 -0.13 0.00 0.00 55.73 56.24 3kcz s ARG 316 Cb 0.20 -2.78 -0.13 0.00 -1.56 0.00 0.00 34.95 30.68 3kcz s ARG 316 CO 0.31 0.37 1.66 2.41 -0.81 0.00 0.00 175.30 179.24 3kcz n THR 317 N 0.43 0.14 -1.75 4.11 -1.04 -1.26 -4.83 114.28 110.07 3kcz n THR 317 Ca -0.02 -0.02 -0.42 0.00 -2.04 0.00 0.00 64.05 61.55 3kcz n THR 317 Cb 0.52 -1.67 -0.03 0.00 -1.82 0.00 0.00 70.33 67.33 3kcz n THR 317 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3kcz s PRO 318 N 1.66 4.14 0.41 -2.82 0.02 -1.26 -4.91 135.00 132.23 3kcz s PRO 318 Ca 0.81 2.58 -0.24 0.00 0.02 0.00 0.00 61.00 64.17 3kcz s PRO 318 Cb -0.66 -3.19 -0.09 0.00 0.02 0.00 0.00 34.50 30.58 3kcz s PRO 318 CO 0.40 -0.75 1.05 -1.25 -0.33 0.00 0.00 177.00 176.12 3kcz s PRO 319 N 1.50 4.12 0.59 5.54 0.04 -1.26 -5.02 135.00 140.51 3kcz s PRO 319 Ca 0.75 1.50 -0.16 0.00 0.04 0.00 0.00 61.00 63.13 3kcz s PRO 319 Cb -0.48 -2.49 -0.03 0.00 0.04 0.00 0.00 34.50 31.53 3kcz s PRO 319 CO 0.33 -0.17 1.08 -0.51 0.04 0.00 0.00 177.00 177.76 3kcz s LEU 320 N -2.74 3.53 -0.37 -3.56 1.43 -1.26 -5.01 118.68 110.71 3kcz s LEU 320 Ca 0.59 1.92 -0.09 0.00 -1.03 0.00 0.00 54.13 55.51 3kcz s LEU 320 Cb -0.21 -4.55 0.03 0.00 0.03 0.00 0.00 46.19 41.50 3kcz s LEU 320 CO 0.27 -1.25 0.18 -0.63 0.23 0.00 0.00 176.35 175.14 3kcz s ILE 321 N -2.30 4.30 0.00 -0.59 1.01 -1.26 -4.91 121.20 117.45 3kcz s ILE 321 Ca 0.66 -0.99 0.00 0.00 0.00 0.00 0.00 60.65 60.32 3kcz s ILE 321 Cb -0.18 -3.43 0.00 0.00 0.01 0.00 0.00 42.46 38.86 3kcz s ILE 321 CO 0.35 -0.24 0.05 -2.11 0.00 0.00 0.00 174.94 172.99 3kcz n ARG 322 N 4.93 1.32 -4.22 2.79 1.85 -1.26 -4.94 116.66 117.13 3kcz n ARG 322 Ca -0.12 -0.05 -0.24 0.00 -1.00 0.00 0.00 57.85 56.44 3kcz n ARG 322 Cb 0.45 -0.31 -0.08 0.00 -1.05 0.00 0.00 32.46 31.48 3kcz n ARG 322 CO 0.00 0.00 0.00 -0.08 -0.01 0.00 0.00 177.63 177.54 3kcz s THR 323 N -0.20 2.55 0.16 8.89 -1.32 -1.26 -4.95 115.64 119.51 3kcz s THR 323 Ca 0.00 -1.80 -0.11 0.00 -1.21 0.00 0.00 61.69 58.56 3kcz s THR 323 Cb 0.00 -2.93 0.03 0.00 -1.51 0.00 0.00 72.50 68.10 3kcz s THR 323 CO 0.00 -0.11 1.62 -0.61 -2.21 0.00 0.00 174.62 173.31 3kcz h GLN 324 N 1.60 0.92 -0.74 7.08 -0.00 -1.98 0.65 115.11 122.63 3kcz h GLN 324 Ca -0.43 -0.28 0.00 0.00 -0.00 0.00 0.00 58.65 57.94 3kcz h GLN 324 Cb 1.25 -0.09 -0.04 0.00 0.00 0.00 0.00 27.48 28.61 3kcz h GLN 324 CO 0.68 0.93 0.47 -0.22 0.00 0.00 0.00 178.83 180.69 3kcz h LYS 325 N 0.80 1.00 -0.28 1.69 3.64 -1.96 0.13 116.57 121.59 3kcz h LYS 325 Ca 0.15 -0.08 -0.15 0.00 -1.27 0.00 0.00 60.65 59.30 3kcz h LYS 325 Cb 0.50 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 3kcz h LYS 325 CO 0.02 0.69 -0.44 0.93 -2.27 0.00 0.00 179.45 178.38 3kcz h GLU 326 N 1.01 0.72 -0.37 1.90 5.08 -1.90 -1.22 114.58 119.80 3kcz h GLU 326 Ca 0.27 -0.40 -0.03 0.00 -1.00 0.00 0.00 59.36 58.20 3kcz h GLU 326 Cb -0.07 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 3kcz h GLU 326 CO -0.05 1.02 0.13 1.25 -1.00 0.00 0.00 179.01 180.35 3kcz h LEU 327 N 0.58 0.52 -0.76 1.33 5.85 -0.56 -2.74 115.31 119.53 3kcz h LEU 327 Ca 0.04 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 3kcz h LEU 327 Cb 1.00 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.86 3kcz h LEU 327 CO 0.09 0.57 0.41 -1.28 -0.34 0.00 0.00 178.44 177.90 3kcz h SER 328 N 0.44 0.96 -0.98 1.25 0.87 -0.55 -1.44 113.55 114.10 3kcz h SER 328 Ca 0.12 -0.10 0.07 0.00 -1.23 0.00 0.00 61.79 60.65 3kcz h SER 328 Cb 0.23 -0.24 -0.07 0.00 -0.44 0.00 0.00 62.40 61.88 3kcz h SER 328 CO -0.01 0.79 0.64 -0.33 -0.53 0.00 0.00 176.83 177.39 3kcz h GLU 329 N 1.06 1.10 -0.23 2.24 5.08 -1.11 0.48 114.58 123.19 3kcz h GLU 329 Ca 0.27 -0.07 -0.17 0.00 -1.00 0.00 0.00 59.36 58.39 3kcz h GLU 329 Cb 0.05 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.05 3kcz h GLU 329 CO -0.04 0.73 -0.54 0.87 -1.00 0.00 0.00 179.01 179.03 3kcz h LYS 330 N 1.13 0.68 -0.59 2.33 1.79 -1.11 -1.76 116.57 119.04 3kcz h LYS 330 Ca 0.43 -0.42 0.03 0.00 -2.18 0.00 0.00 60.65 58.50 3kcz h LYS 330 Cb 0.20 0.05 -0.04 0.00 -1.58 0.00 0.00 32.23 30.86 3kcz h LYS 330 CO -0.17 1.04 0.36 0.82 -1.08 0.00 0.00 179.45 180.42 3kcz h ILE 331 N 0.53 1.07 -0.65 1.86 2.04 -0.77 -1.85 117.51 119.73 3kcz h ILE 331 Ca 0.01 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.58 3kcz h ILE 331 Cb 1.10 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 3kcz h ILE 331 CO 0.11 0.13 0.23 1.56 0.00 0.00 0.00 178.15 180.18 3kcz h GLN 332 N 0.71 0.98 -0.56 2.37 4.20 -0.71 0.13 115.11 122.23 3kcz h GLN 332 Ca 0.24 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 58.76 3kcz h GLN 332 Cb 0.02 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.61 3kcz h GLN 332 CO -0.10 0.82 0.34 1.25 -0.67 0.00 0.00 178.83 180.47 3kcz h LEU 333 N 0.95 0.68 -0.45 1.46 5.85 -0.95 -0.41 115.31 122.45 3kcz h LEU 333 Ca 0.22 -0.06 -0.16 0.00 0.84 0.00 0.00 57.88 58.72 3kcz h LEU 333 Cb 0.23 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 3kcz h LEU 333 CO -0.01 0.54 -0.43 -0.07 -0.34 0.00 0.00 178.44 178.13 3kcz h LEU 334 N 0.76 0.89 -0.85 2.25 3.38 -0.64 0.07 115.31 121.17 3kcz h LEU 334 Ca 0.20 -0.42 0.05 0.00 0.09 0.00 0.00 57.88 57.80 3kcz h LEU 334 Cb -0.01 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.43 3kcz h LEU 334 CO -0.04 1.19 0.53 -0.33 0.09 0.00 0.00 178.44 179.89 3kcz h GLU 335 N 0.66 0.98 -0.39 1.13 5.08 -0.56 -0.03 114.58 121.46 3kcz h GLU 335 Ca 0.05 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 3kcz h GLU 335 Cb 1.00 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 3kcz h GLU 335 CO 0.10 0.65 -0.04 0.00 -1.00 0.00 0.00 179.01 178.72 3kcz h ALA 336 N 1.37 0.53 -0.70 3.43 0.00 -0.77 -2.05 119.26 121.07 3kcz h ALA 336 Ca 0.35 -0.28 0.09 0.00 0.00 0.00 0.00 54.91 55.07 3kcz h ALA 336 Cb 0.08 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 17.66 3kcz h ALA 336 CO -0.14 0.34 0.36 -0.07 0.00 0.00 0.00 179.25 179.74 3kcz h LEU 337 N 0.53 0.48 -0.54 0.00 3.38 -0.67 -0.62 115.31 117.87 3kcz h LEU 337 Ca 0.11 0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.19 3kcz h LEU 337 Cb 0.53 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.20 3kcz h LEU 337 CO 0.03 0.28 0.25 1.23 0.09 0.00 0.00 178.44 180.32 3kcz h GLY 338 N 0.62 0.75 1.78 0.83 0.00 -0.82 0.31 103.07 106.54 3kcz h GLY 338 Ca 0.34 -0.16 -0.11 0.00 0.00 0.00 0.00 47.33 47.40 3kcz h GLY 338 CO -0.25 0.08 -0.43 -0.55 0.00 0.00 0.00 176.54 175.39 3kcz h ASP 339 N 0.48 0.25 -0.50 0.19 3.32 -0.68 -2.73 116.42 116.75 3kcz h ASP 339 Ca 0.25 -0.11 -0.12 0.00 0.02 0.00 0.00 57.03 57.06 3kcz h ASP 339 Cb 0.20 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 3kcz h ASP 339 CO -0.20 0.66 -0.16 0.40 -1.72 0.00 0.00 179.24 178.22 3kcz h ILE 340 N 0.20 1.27 -0.68 0.35 2.04 -0.79 -1.05 117.51 118.84 3kcz h ILE 340 Ca 0.02 -1.32 0.02 0.00 1.00 0.00 0.00 64.86 64.57 3kcz h ILE 340 Cb 0.84 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.93 3kcz h ILE 340 CO 0.07 0.46 0.44 -0.08 0.00 0.00 0.00 178.15 179.04 3kcz h GLU 341 N 0.88 0.87 -0.01 2.37 4.22 -0.77 0.07 114.58 122.21 3kcz h GLU 341 Ca 0.13 -0.05 0.01 0.00 0.08 0.00 0.00 59.36 59.52 3kcz h GLU 341 Cb 0.73 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 3kcz h GLU 341 CO 0.06 0.57 -0.02 0.82 -2.18 0.00 0.00 179.01 178.27 3kcz h ILE 342 N 0.89 0.95 -0.49 2.32 2.04 -1.37 -2.98 117.51 118.88 3kcz h ILE 342 Ca 0.26 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 66.04 3kcz h ILE 342 Cb -0.06 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 3kcz h ILE 342 CO -0.07 0.00 0.01 0.00 0.00 0.00 0.00 178.15 178.08 3kcz h ALA 343 N 0.99 0.67 -0.81 1.87 0.00 -0.57 -0.96 119.26 120.45 3kcz h ALA 343 Ca 0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 3kcz h ALA 343 Cb 0.04 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 3kcz h ALA 343 CO -0.03 0.47 0.44 0.82 0.00 0.00 0.00 179.25 180.95 3kcz h ILE 344 N 0.73 1.24 -0.58 0.00 2.04 -1.03 -0.05 117.51 119.86 3kcz h ILE 344 Ca 0.14 -0.60 -0.10 0.00 1.00 0.00 0.00 64.86 65.30 3kcz h ILE 344 Cb 0.51 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 3kcz h ILE 344 CO 0.02 0.27 -0.01 0.11 0.00 0.00 0.00 178.15 178.54 3kcz h LYS 345 N 1.13 1.03 -0.44 2.37 1.57 -1.37 -3.12 116.57 117.73 3kcz h LYS 345 Ca 0.28 -0.33 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 3kcz h LYS 345 Cb 0.04 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 3kcz h LYS 345 CO -0.05 1.02 -0.04 1.25 -0.57 0.00 0.00 179.45 181.07 3kcz h LEU 346 N 0.92 0.71 -0.82 2.94 6.46 -0.28 -3.04 115.31 122.20 3kcz h LEU 346 Ca 0.16 -0.18 0.00 0.00 -0.12 0.00 0.00 57.88 57.74 3kcz h LEU 346 Cb 0.57 -0.19 0.00 0.00 -0.73 0.00 0.00 40.66 40.31 3kcz h LEU 346 CO 0.03 0.81 0.00 1.33 -0.62 0.00 0.00 178.44 179.99 3kcz n VAL 347 N -4.20 0.04 -1.71 1.05 0.24 -0.12 -4.82 118.33 108.81 3kcz n VAL 347 Ca 0.02 -0.22 -0.43 0.00 -2.04 0.00 0.00 64.34 61.66 3kcz n VAL 347 Cb 0.32 0.31 -0.03 0.00 -1.47 0.00 0.00 33.84 32.96 3kcz n VAL 347 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 3kcz n LYS 348 N 0.00 2.56 -3.78 7.34 5.02 -1.15 -4.99 118.16 123.15 3kcz n LYS 348 Ca 0.19 0.92 -0.20 0.00 -2.02 0.00 0.00 58.31 57.20 3kcz n LYS 348 Cb 0.31 -2.72 -0.02 0.00 -0.02 0.00 0.00 35.03 32.57 3kcz n LYS 348 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3kcz s THR 349 N 0.84 4.49 -0.29 -0.18 -4.23 -1.26 -5.04 115.64 109.96 3kcz s THR 349 Ca 0.74 -1.09 -0.11 0.00 -1.18 0.00 0.00 61.69 60.05 3kcz s THR 349 Cb -0.56 -3.54 -0.03 0.00 1.34 0.00 0.00 72.50 69.70 3kcz s THR 349 CO 0.37 -0.25 0.18 -1.61 -0.54 0.00 0.00 174.62 172.78 3kcz s GLU 350 N -4.04 3.71 0.10 3.99 2.02 -1.26 -5.00 118.70 118.22 3kcz s GLU 350 Ca 0.39 -0.48 -0.16 0.00 0.02 0.00 0.00 54.97 54.74 3kcz s GLU 350 Cb -0.09 -3.63 -0.00 0.00 0.10 0.00 0.00 34.13 30.51 3kcz s GLU 350 CO 0.29 -0.28 0.89 1.47 0.02 0.00 0.00 175.26 177.65 3kcz n LEU 351 N 5.04 -0.56 -4.03 1.80 -0.00 -1.26 -2.35 117.00 115.64 3kcz n LEU 351 Ca -0.14 1.02 -0.34 0.00 -0.00 0.00 0.00 56.01 56.55 3kcz n LEU 351 Cb 0.51 -0.15 -0.11 0.00 -0.00 0.00 0.00 43.42 43.67 3kcz n LEU 351 CO 0.34 -0.85 0.00 0.00 -0.00 0.00 0.00 177.39 176.88 3kcz s GLN 352 N -5.34 2.46 -0.02 1.47 1.03 -1.26 -5.04 119.66 112.97 3kcz s GLN 352 Ca -0.07 -2.72 0.06 0.00 0.04 0.00 0.00 55.36 52.66 3kcz s GLN 352 Cb 0.07 -3.61 -0.01 0.00 0.03 0.00 0.00 33.01 29.50 3kcz s GLN 352 CO 0.37 -1.18 -0.18 -1.54 -2.54 0.00 0.00 175.29 170.22 3kcz s SER 353 N 0.09 2.15 0.54 12.60 1.04 -0.99 -5.04 113.70 124.09 3kcz s SER 353 Ca 0.19 -0.33 0.32 0.00 0.48 0.00 0.00 55.95 56.61 3kcz s SER 353 Cb -0.19 -0.28 1.27 0.00 0.10 0.00 0.00 66.02 66.92 3kcz s SER 353 CO -0.04 0.22 1.95 1.55 0.98 0.00 0.00 173.24 177.89 3kcz h PRO 354 N 5.74 0.00 -6.60 4.02 0.13 -1.96 -3.44 132.00 129.89 3kcz h PRO 354 Ca -0.37 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.24 3kcz h PRO 354 Cb 1.15 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.30 3kcz h PRO 354 CO 0.48 0.02 0.59 -2.00 -0.23 0.00 0.00 178.00 176.85 3kcz s GLU 355 N -3.64 4.45 0.35 0.86 2.12 -1.26 -5.02 118.70 116.56 3kcz s GLU 355 Ca 0.01 1.89 -0.28 0.00 0.36 0.00 0.00 54.97 56.95 3kcz s GLU 355 Cb 0.09 -3.26 -0.10 0.00 0.26 0.00 0.00 34.13 31.11 3kcz s GLU 355 CO 0.56 -0.19 1.36 -1.58 -0.54 0.00 0.00 175.26 174.87 3kcz s HIS 356 N 0.38 2.88 0.32 5.30 5.65 -1.26 -4.86 115.29 123.71 3kcz s HIS 356 Ca 0.56 1.34 0.10 0.00 0.25 0.00 0.00 55.06 57.31 3kcz s HIS 356 Cb -0.33 -3.78 0.88 0.00 -1.18 0.00 0.00 32.58 28.17 3kcz s HIS 356 CO 0.34 -2.23 1.75 -1.35 -0.65 0.00 0.00 174.74 172.60 3kcz h PRO 357 N 3.18 0.59 -0.54 2.88 0.11 -1.96 -1.59 132.00 134.67 3kcz h PRO 357 Ca -0.50 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.47 3kcz h PRO 357 Cb 1.23 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 3kcz h PRO 357 CO 0.65 0.39 -0.11 -0.07 -0.21 0.00 0.00 178.00 178.65 3kcz h LEU 358 N 0.61 1.01 -0.86 2.35 3.38 -1.99 0.19 115.31 120.00 3kcz h LEU 358 Ca 0.62 -0.33 -0.10 0.00 0.09 0.00 0.00 57.88 58.16 3kcz h LEU 358 Cb 1.17 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 3kcz h LEU 358 CO -0.43 1.12 -0.20 0.44 0.09 0.00 0.00 178.44 179.46 3kcz h ASP 359 N 0.90 0.62 -0.09 -0.43 3.32 -1.74 -1.39 116.42 117.61 3kcz h ASP 359 Ca 0.14 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 3kcz h ASP 359 Cb 0.67 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 40.04 3kcz h ASP 359 CO 0.05 0.83 0.03 -0.61 -1.72 0.00 0.00 179.24 177.81 3kcz h GLN 360 N 0.55 0.14 -0.16 3.56 4.15 -0.84 -0.10 115.11 122.42 3kcz h GLN 360 Ca 0.08 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.48 3kcz h GLN 360 Cb 0.65 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.31 3kcz h GLN 360 CO 0.05 0.31 0.08 0.45 -1.93 0.00 0.00 178.83 177.78 3kcz h HIS 361 N -0.04 0.15 -0.52 3.99 3.86 -0.53 -0.65 115.15 121.41 3kcz h HIS 361 Ca 0.03 0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.26 3kcz h HIS 361 Cb 0.22 -0.04 -0.03 0.00 1.06 0.00 0.00 27.41 28.62 3kcz h HIS 361 CO -0.00 0.08 0.32 -0.92 0.86 0.00 0.00 177.93 178.28 3kcz h TYR 362 N 0.17 0.61 -0.47 2.45 3.20 -1.20 -2.18 116.97 119.55 3kcz h TYR 362 Ca 0.06 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.97 3kcz h TYR 362 Cb 0.01 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.05 3kcz h TYR 362 CO -0.09 0.36 0.28 -0.09 -1.64 0.00 0.00 178.16 176.98 3kcz h ARG 363 N 0.65 0.54 0.00 1.82 2.43 -0.75 -2.37 114.38 116.69 3kcz h ARG 363 Ca 0.20 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 3kcz h ARG 363 Cb -0.02 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 3kcz h ARG 363 CO -0.07 0.36 0.00 0.09 -1.51 0.00 0.00 179.97 178.83 3kcz n ASN 364 N -4.82 0.24 0.17 -3.80 3.02 -0.27 -1.96 115.26 107.84 3kcz n ASN 364 Ca 0.03 0.58 0.05 0.00 -0.03 0.00 0.00 54.58 55.20 3kcz n ASN 364 Cb 0.07 -0.62 0.21 0.00 -0.61 0.00 0.00 39.78 38.82 3kcz n ASN 364 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3kcz h LEU 365 N 0.00 0.00 -1.75 3.41 3.38 -1.04 -3.48 115.31 115.83 3kcz h LEU 365 Ca 0.00 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 3kcz h LEU 365 Cb 0.20 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3kcz h LEU 365 CO 0.00 0.42 -0.86 1.41 0.09 0.00 0.00 178.44 179.50 3kcz n HIS 366 N -3.36 -1.79 -3.24 1.13 8.25 -0.83 -4.07 115.22 111.31 3kcz n HIS 366 Ca 0.01 0.79 -0.02 0.00 -0.26 0.00 0.00 57.72 58.24 3kcz n HIS 366 Cb 0.61 -3.95 -0.04 0.00 1.12 0.00 0.00 29.99 27.72 3kcz n HIS 366 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3kcz s ALA 368 N 2.71 3.55 -0.17 0.00 0.00 -0.40 -4.88 121.76 122.57 3kcz s ALA 368 Ca 0.16 1.20 -0.00 0.00 0.00 0.00 0.00 51.96 53.32 3kcz s ALA 368 Cb -0.14 -3.50 0.04 0.00 0.00 0.00 0.00 23.12 19.52 3kcz s ALA 368 CO -0.20 -0.61 -0.06 -0.51 0.00 0.00 0.00 175.76 174.37 3kcz s LEU 369 N -0.58 1.69 -0.20 0.00 1.43 -1.26 -1.43 118.68 118.33 3kcz s LEU 369 Ca 0.56 -0.68 0.01 0.00 -1.03 0.00 0.00 54.13 52.99 3kcz s LEU 369 Cb -0.39 -0.96 0.04 0.00 0.03 0.00 0.00 46.19 44.91 3kcz s LEU 369 CO 0.43 -0.17 -0.14 -0.13 0.23 0.00 0.00 176.35 176.57 3kcz s ARG 370 N 1.60 2.37 0.35 1.70 0.52 -0.15 -4.89 118.95 120.45 3kcz s ARG 370 Ca 0.01 -0.92 -0.28 0.00 -0.52 0.00 0.00 55.73 54.01 3kcz s ARG 370 Cb -0.15 -2.53 -0.12 0.00 0.52 0.00 0.00 34.95 32.67 3kcz s ARG 370 CO -0.08 -0.38 1.43 -0.35 0.02 0.00 0.00 175.30 175.94 3kcz n PRO 371 N 4.62 2.46 -4.19 3.54 -0.05 -1.26 -0.04 135.00 140.07 3kcz n PRO 371 Ca -0.17 0.86 -0.28 0.00 -0.05 0.00 0.00 63.50 63.87 3kcz n PRO 371 Cb 0.47 -2.54 -0.08 0.00 -0.05 0.00 0.00 33.50 31.29 3kcz n PRO 371 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 175.50 174.94 3kcz s LEU 372 N -1.40 3.28 0.20 1.53 1.43 -0.52 -4.85 118.68 118.35 3kcz s LEU 372 Ca 0.56 -0.34 -0.30 0.00 -1.03 0.00 0.00 54.13 53.02 3kcz s LEU 372 Cb -0.52 -1.99 -0.09 0.00 0.03 0.00 0.00 46.19 43.62 3kcz s LEU 372 CO 0.61 0.13 1.36 -0.62 0.23 0.00 0.00 176.35 178.06 3kcz s ASP 373 N -2.60 6.82 0.47 2.29 -1.08 -1.26 -4.73 116.67 116.59 3kcz s ASP 373 Ca 0.25 2.46 0.32 0.00 -0.52 0.00 0.00 52.55 55.06 3kcz s ASP 373 Cb -0.10 -2.61 1.46 0.00 -1.46 0.00 0.00 42.92 40.21 3kcz s ASP 373 CO 0.17 -0.59 1.95 0.45 0.52 0.00 0.00 175.17 177.68 3kcz h HIS 374 N 5.48 0.00 -0.61 -5.34 3.86 -1.98 -1.28 115.15 115.28 3kcz h HIS 374 Ca -0.45 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.76 3kcz h HIS 374 Cb 1.21 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.68 3kcz h HIS 374 CO 0.62 0.00 0.00 0.39 0.86 0.00 0.00 177.93 179.80 3kcz n GLU 375 N -2.76 2.71 -2.35 2.45 1.02 -1.26 -4.70 120.64 115.75 3kcz n GLU 375 Ca -0.00 -2.32 -0.31 0.00 -0.02 0.00 0.00 57.16 54.52 3kcz n GLU 375 Cb 0.20 -1.58 -0.01 0.00 -0.02 0.00 0.00 31.44 30.03 3kcz n GLU 375 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3kcz s SER 376 N -0.95 6.40 0.22 1.62 1.04 -0.48 -4.97 113.70 116.58 3kcz s SER 376 Ca 0.43 1.32 -0.08 0.00 0.48 0.00 0.00 55.95 58.09 3kcz s SER 376 Cb 0.24 -2.41 0.28 0.00 0.10 0.00 0.00 66.02 64.23 3kcz s SER 376 CO 0.27 -0.64 1.81 0.22 0.98 0.00 0.00 173.24 175.87 3kcz h TYR 377 N 0.44 0.74 -0.32 5.02 3.20 -1.94 -1.93 116.97 122.20 3kcz h TYR 377 Ca -0.46 0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.47 3kcz h TYR 377 Cb 1.19 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 39.20 3kcz h TYR 377 CO 0.63 0.34 0.12 0.93 -1.64 0.00 0.00 178.16 178.55 3kcz h GLU 378 N 0.73 0.26 -0.95 1.82 3.07 -1.93 -1.14 114.58 116.44 3kcz h GLU 378 Ca 0.33 -0.02 -0.00 0.00 -0.50 0.00 0.00 59.36 59.17 3kcz h GLU 378 Cb 0.23 -0.06 -0.05 0.00 -0.84 0.00 0.00 28.75 28.03 3kcz h GLU 378 CO -0.20 0.17 0.59 0.35 -1.40 0.00 0.00 179.01 178.52 3kcz h PHE 379 N 0.27 1.24 0.07 4.33 3.57 -1.70 -1.30 116.94 123.43 3kcz h PHE 379 Ca 0.14 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.64 3kcz h PHE 379 Cb 0.09 -0.41 0.00 0.00 2.79 0.00 0.00 35.95 38.42 3kcz h PHE 379 CO -0.12 0.82 -0.03 -0.22 -2.23 0.00 0.00 178.31 176.52 3kcz h LYS 380 N 1.31 -0.09 -0.76 1.11 3.64 -0.76 -0.61 116.57 120.40 3kcz h LYS 380 Ca 0.34 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.68 3kcz h LYS 380 Cb -0.08 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 3kcz h LYS 380 CO -0.07 0.09 0.29 0.28 -2.27 0.00 0.00 179.45 177.77 3kcz h VAL 381 N -0.26 1.26 -0.25 2.00 2.07 -0.92 -1.64 116.25 118.51 3kcz h VAL 381 Ca -0.01 -0.83 -0.11 0.00 0.82 0.00 0.00 66.70 66.58 3kcz h VAL 381 Cb 0.23 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 3kcz h VAL 381 CO 0.02 0.33 -0.27 0.40 0.02 0.00 0.00 177.57 178.07 3kcz h ILE 382 N 1.11 1.31 -0.45 4.57 2.04 -1.20 0.14 117.51 125.03 3kcz h ILE 382 Ca 0.25 -1.44 0.07 0.00 1.00 0.00 0.00 64.86 64.74 3kcz h ILE 382 Cb 0.23 1.67 -0.06 0.00 -0.74 0.00 0.00 36.82 37.92 3kcz h ILE 382 CO -0.02 0.45 0.11 0.28 0.00 0.00 0.00 178.15 178.97 3kcz h SER 383 N 0.34 0.04 -0.57 1.72 0.02 -1.00 0.24 113.55 114.34 3kcz h SER 383 Ca 0.04 0.07 0.03 0.00 -0.84 0.00 0.00 61.79 61.09 3kcz h SER 383 Cb 0.83 0.09 -0.04 0.00 0.14 0.00 0.00 62.40 63.42 3kcz h SER 383 CO 0.07 0.06 0.34 1.56 -1.14 0.00 0.00 176.83 177.71 3kcz h GLN 384 N 0.25 0.65 -0.33 3.45 4.20 -1.06 -1.14 115.11 121.13 3kcz h GLN 384 Ca 0.22 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.88 3kcz h GLN 384 Cb 0.27 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 3kcz h GLN 384 CO -0.27 0.43 0.14 -0.92 -0.67 0.00 0.00 178.83 177.54 3kcz h TYR 385 N 0.67 0.49 -0.10 2.96 3.20 0.03 0.12 116.97 124.35 3kcz h TYR 385 Ca 0.24 -0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.11 3kcz h TYR 385 Cb 0.05 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.13 3kcz h TYR 385 CO -0.06 0.45 -0.13 1.25 -1.64 0.00 0.00 178.16 178.03 3kcz h LEU 386 N 0.39 -0.39 -0.01 2.82 5.85 -0.16 -2.59 115.31 121.22 3kcz h LEU 386 Ca 0.11 0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.79 3kcz h LEU 386 Cb 0.16 0.19 0.01 0.00 0.37 0.00 0.00 40.66 41.38 3kcz h LEU 386 CO -0.01 -0.17 -0.45 1.56 -0.34 0.00 0.00 178.44 179.03 3kcz h GLN 387 N -0.17 0.32 0.00 1.25 1.08 -1.12 -3.25 115.11 113.22 3kcz h GLN 387 Ca 0.08 -0.33 0.00 0.00 -1.45 0.00 0.00 58.65 56.95 3kcz h GLN 387 Cb 0.28 0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.80 3kcz h GLN 387 CO -0.20 1.02 0.00 0.66 -0.95 0.00 0.00 178.83 179.36 3kcz h SER 388 N -0.25 0.00 -0.29 1.46 4.64 -0.78 -2.69 113.55 115.64 3kcz h SER 388 Ca -0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 3kcz h SER 388 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3kcz h SER 388 CO 0.09 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.40 3kcz n THR 389 N -2.82 2.24 -2.45 2.95 -2.24 -0.98 -3.91 114.28 107.07 3kcz n THR 389 Ca 0.02 -1.79 -0.43 0.00 -2.27 0.00 0.00 64.05 59.58 3kcz n THR 389 Cb 0.31 -0.21 -0.02 0.00 -2.10 0.00 0.00 70.33 68.31 3kcz n THR 389 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3kcz s HIS 390 N -2.70 2.82 0.48 4.78 5.04 -1.02 -1.63 115.29 123.06 3kcz s HIS 390 Ca 0.42 0.98 -0.20 0.00 -1.54 0.00 0.00 55.06 54.73 3kcz s HIS 390 Cb 0.33 -3.70 -0.09 0.00 0.04 0.00 0.00 32.58 29.16 3kcz s HIS 390 CO 0.10 -1.56 1.00 0.00 -2.34 0.00 0.00 174.74 171.94 3kcz s ALA 391 N 3.93 2.94 0.41 1.58 0.00 -1.26 -4.95 121.76 124.41 3kcz s ALA 391 Ca 0.54 0.46 0.09 0.00 0.00 0.00 0.00 51.96 53.05 3kcz s ALA 391 Cb -0.18 -3.20 0.86 0.00 0.00 0.00 0.00 23.12 20.61 3kcz s ALA 391 CO 0.18 -0.19 2.00 -1.00 0.00 0.00 0.00 175.76 176.75 3kcz h PRO 392 N 1.49 0.36 -0.21 0.00 0.13 -1.99 -2.61 132.00 129.17 3kcz h PRO 392 Ca -0.49 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 3kcz h PRO 392 Cb 1.20 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3kcz h PRO 392 CO 0.60 0.34 0.00 0.25 -0.23 0.00 0.00 178.00 178.95 3kcz n THR 393 N -4.39 0.28 -2.29 1.56 -2.24 -1.26 -3.88 114.28 102.05 3kcz n THR 393 Ca 0.01 -0.34 -0.32 0.00 -2.27 0.00 0.00 64.05 61.13 3kcz n THR 393 Cb 0.16 0.23 0.01 0.00 -2.10 0.00 0.00 70.33 68.63 3kcz n THR 393 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3kcz n HIS 394 N 0.24 3.27 1.41 4.78 8.25 -0.98 -4.85 115.22 127.34 3kcz n HIS 394 Ca 0.13 -2.85 0.11 0.00 -0.26 0.00 0.00 57.72 54.85 3kcz n HIS 394 Cb 0.27 -0.47 0.45 0.00 1.12 0.00 0.00 29.99 31.35 3kcz n HIS 394 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 3kcz n SER 395 N -0.50 1.35 0.00 0.41 3.41 -1.25 -3.88 113.62 113.17 3kcz n SER 395 Ca 0.44 -1.60 0.12 0.00 -0.26 0.00 0.00 58.87 57.57 3kcz n SER 395 Cb 0.51 -0.07 0.64 0.00 -0.26 0.00 0.00 64.21 65.04 3kcz n SER 395 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3kcz n ASP 396 N 0.10 0.00 -3.67 4.04 5.75 -1.26 -4.82 116.55 116.69 3kcz n ASP 396 Ca 0.17 -0.20 -0.10 0.00 -0.01 0.00 0.00 54.79 54.64 3kcz n ASP 396 Cb 0.29 -0.23 -0.04 0.00 -1.03 0.00 0.00 41.12 40.11 3kcz n ASP 396 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 3kcz s TYR 397 N -2.46 -0.17 0.40 2.11 -0.85 -1.25 -4.55 117.35 110.57 3kcz s TYR 397 Ca 0.26 -0.15 0.07 0.00 -0.52 0.00 0.00 57.07 56.74 3kcz s TYR 397 Cb 0.17 0.33 -0.07 0.00 0.38 0.00 0.00 41.96 42.76 3kcz s TYR 397 CO 0.36 -0.80 0.04 0.95 -1.52 0.00 0.00 175.55 174.58 3kcz s THR 398 N -3.83 2.15 -0.00 -3.49 -4.23 -0.77 -4.93 115.64 100.53 3kcz s THR 398 Ca 0.06 -1.95 0.07 0.00 -1.18 0.00 0.00 61.69 58.69 3kcz s THR 398 Cb 0.01 -2.95 -0.02 0.00 1.34 0.00 0.00 72.50 70.88 3kcz s THR 398 CO -0.08 -0.04 -0.23 -0.04 -0.54 0.00 0.00 174.62 173.70 3kcz s MET 399 N -3.75 1.76 -0.13 3.99 -1.94 -1.26 0.75 119.30 118.73 3kcz s MET 399 Ca 0.36 -0.84 0.02 0.00 -1.71 0.00 0.00 55.69 53.52 3kcz s MET 399 Cb 0.07 -1.74 0.01 0.00 2.01 0.00 0.00 34.83 35.18 3kcz s MET 399 CO 0.19 0.47 -0.19 0.99 -0.01 0.00 0.00 175.02 176.47 3kcz s THR 400 N -0.58 1.84 -0.38 2.05 2.01 0.52 -4.96 115.64 116.14 3kcz s THR 400 Ca 0.09 -0.84 -0.29 0.00 0.31 0.00 0.00 61.69 60.96 3kcz s THR 400 Cb -0.09 -1.64 0.02 0.00 0.01 0.00 0.00 72.50 70.80 3kcz s THR 400 CO -0.00 0.51 1.18 -0.22 -0.69 0.00 0.00 174.62 175.40 3kcz s LEU 401 N 0.92 3.78 -0.11 4.42 2.96 -1.26 0.40 118.68 129.79 3kcz s LEU 401 Ca -0.06 0.85 -0.13 0.00 -0.22 0.00 0.00 54.13 54.58 3kcz s LEU 401 Cb -0.15 -3.54 -0.27 0.00 0.50 0.00 0.00 46.19 42.73 3kcz s LEU 401 CO -0.03 -1.12 0.49 -0.07 -1.32 0.00 0.00 176.35 174.31 3kcz h LEU 402 N 10.89 0.40 -7.98 -0.68 3.38 -1.25 -3.48 115.31 116.59 3kcz h LEU 402 Ca -0.23 -0.87 -0.01 0.00 0.09 0.00 0.00 57.88 56.85 3kcz h LEU 402 Cb 1.07 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 41.61 3kcz h LEU 402 CO 1.07 1.72 0.01 -0.62 0.09 0.00 0.00 178.44 180.71 3kcz s ASP 403 N -7.07 -0.19 -0.06 -0.43 -1.08 -1.12 -5.00 116.67 101.72 3kcz s ASP 403 Ca -0.21 -0.70 -0.03 0.00 -0.52 0.00 0.00 52.55 51.10 3kcz s ASP 403 Cb 0.05 0.62 0.03 0.00 -1.46 0.00 0.00 42.92 42.16 3kcz s ASP 403 CO 0.77 -1.16 0.13 -0.22 0.52 0.00 0.00 175.17 175.21 3kcz s LEU 404 N -2.94 0.87 -0.03 -1.34 2.96 -1.26 -1.40 118.68 115.54 3kcz s LEU 404 Ca 0.15 0.26 0.05 0.00 -0.22 0.00 0.00 54.13 54.37 3kcz s LEU 404 Cb -0.02 0.31 -0.01 0.00 0.50 0.00 0.00 46.19 46.97 3kcz s LEU 404 CO 0.04 -0.13 -0.17 -0.36 -1.32 0.00 0.00 176.35 174.41 3kcz s PHE 405 N 1.02 1.63 0.11 5.38 0.08 0.03 -1.44 117.98 124.79 3kcz s PHE 405 Ca -0.08 -0.38 -0.28 0.00 0.12 0.00 0.00 56.93 56.31 3kcz s PHE 405 Cb -0.10 -1.08 -0.06 0.00 -0.57 0.00 0.00 43.02 41.21 3kcz s PHE 405 CO -0.05 -0.09 0.86 -2.00 -0.10 0.00 0.00 175.22 173.85 3kcz s GLU 406 N -0.21 4.62 -0.14 0.44 2.12 0.94 -0.56 118.70 125.91 3kcz s GLU 406 Ca 0.02 1.27 -0.02 0.00 0.36 0.00 0.00 54.97 56.60 3kcz s GLU 406 Cb -0.09 -3.35 -0.02 0.00 0.26 0.00 0.00 34.13 30.93 3kcz s GLU 406 CO 0.01 0.32 -0.06 0.08 -0.54 0.00 0.00 175.26 175.06 3kcz s VAL 407 N -0.31 3.67 -0.37 3.70 1.01 0.81 -0.97 120.40 127.94 3kcz s VAL 407 Ca 0.42 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.96 3kcz s VAL 407 Cb -0.23 -2.58 0.14 0.00 0.00 0.00 0.00 36.38 33.71 3kcz s VAL 407 CO 0.27 0.52 0.21 -0.70 0.00 0.00 0.00 175.10 175.40 3kcz s GLU 408 N 0.18 0.75 0.02 2.72 2.12 -0.52 -4.22 118.70 119.75 3kcz s GLU 408 Ca -0.03 -1.47 -0.30 0.00 0.36 0.00 0.00 54.97 53.52 3kcz s GLU 408 Cb -0.14 -1.61 -0.04 0.00 0.26 0.00 0.00 34.13 32.59 3kcz s GLU 408 CO 0.03 -1.18 1.12 0.21 -0.54 0.00 0.00 175.26 174.91 3kcz s LYS 409 N 0.93 4.46 -0.03 4.30 2.47 -1.26 -1.28 119.74 129.33 3kcz s LYS 409 Ca 0.17 1.63 -0.37 0.00 -1.56 0.00 0.00 55.97 55.84 3kcz s LYS 409 Cb -0.23 -3.43 -0.15 0.00 -1.46 0.00 0.00 37.83 32.56 3kcz s LYS 409 CO -0.02 -0.22 1.58 -0.25 0.16 0.00 0.00 175.35 176.59 3kcz n ASP 410 N 4.17 2.37 0.00 1.43 8.00 -1.09 -2.41 116.55 129.02 3kcz n ASP 410 Ca 0.08 1.08 0.00 0.00 0.71 0.00 0.00 54.79 56.66 3kcz n ASP 410 Cb 0.48 -1.24 0.00 0.00 -0.02 0.00 0.00 41.12 40.34 3kcz n ASP 410 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3kcz n GLY 411 N 3.43 3.15 0.26 0.44 0.00 -1.26 -4.91 105.19 106.30 3kcz n GLY 411 Ca 0.21 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.17 3kcz n GLY 411 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3kcz h GLU 412 N 1.12 0.70 -0.16 1.61 5.08 -1.85 -1.40 114.58 119.67 3kcz h GLU 412 Ca 0.00 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.07 3kcz h GLU 412 Cb 0.00 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3kcz h GLU 412 CO 0.00 0.86 0.04 -0.22 -1.00 0.00 0.00 179.01 178.69 3kcz h LYS 413 N 0.61 0.25 -0.68 2.33 3.64 -1.91 -1.71 116.57 119.09 3kcz h LYS 413 Ca 0.09 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.35 3kcz h LYS 413 Cb 0.70 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.46 3kcz h LYS 413 CO 0.05 0.39 0.18 0.93 -2.27 0.00 0.00 179.45 178.73 3kcz h GLU 414 N 0.07 1.08 0.00 1.90 3.07 -1.93 -3.08 114.58 115.69 3kcz h GLU 414 Ca 0.05 -0.25 -0.00 0.00 -0.50 0.00 0.00 59.36 58.66 3kcz h GLU 414 Cb 0.25 -0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 28.01 3kcz h GLU 414 CO -0.00 0.95 -0.01 0.00 -1.40 0.00 0.00 179.01 178.56 3kcz h ALA 415 N 1.08 1.00 -2.90 3.43 0.00 -1.13 -3.48 119.26 117.26 3kcz h ALA 415 Ca 0.22 -0.01 -0.54 0.00 0.00 0.00 0.00 54.91 54.58 3kcz h ALA 415 Cb 0.35 -0.00 0.11 0.00 0.00 0.00 0.00 17.79 18.25 3kcz h ALA 415 CO -0.00 0.01 0.73 0.34 0.00 0.00 0.00 179.25 180.33 3kcz n PHE 416 N -3.10 2.87 -1.77 0.00 7.35 -0.66 -4.82 117.46 117.33 3kcz n PHE 416 Ca 0.04 0.45 -0.42 0.00 -0.76 0.00 0.00 57.45 56.77 3kcz n PHE 416 Cb 0.53 -2.51 -0.01 0.00 0.35 0.00 0.00 39.48 37.83 3kcz n PHE 416 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 3kcz n ARG 417 N 0.33 2.59 -0.13 -4.13 5.12 0.78 -4.72 116.66 116.50 3kcz n ARG 417 Ca 0.02 -2.56 0.12 0.00 -1.93 0.00 0.00 57.85 53.50 3kcz n ARG 417 Cb 0.39 -3.27 0.47 0.00 -1.16 0.00 0.00 32.46 28.88 3kcz n ARG 417 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 3kcz h GLU 418 N 6.80 0.48 -0.09 5.56 5.08 -1.89 -2.82 114.58 127.69 3kcz h GLU 418 Ca 0.51 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.82 3kcz h GLU 418 Cb 0.70 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 3kcz h GLU 418 CO 1.80 0.32 -0.03 0.38 -1.00 0.00 0.00 179.01 180.48 3kcz h ASP 419 N 0.49 0.12 -3.87 1.42 2.03 -2.01 -3.45 116.42 111.15 3kcz h ASP 419 Ca 0.31 -0.01 -0.51 0.00 -0.73 0.00 0.00 57.03 56.10 3kcz h ASP 419 Cb 0.57 -0.03 0.04 0.00 -0.83 0.00 0.00 39.33 39.08 3kcz h ASP 419 CO -0.10 0.17 0.51 -0.76 -1.03 0.00 0.00 179.24 178.03 3kcz s LEU 420 N -8.98 4.39 0.97 0.15 1.43 -1.06 -5.02 118.68 110.55 3kcz s LEU 420 Ca -0.05 2.36 -0.12 0.00 -1.03 0.00 0.00 54.13 55.28 3kcz s LEU 420 Cb 0.16 -3.79 0.17 0.00 0.03 0.00 0.00 46.19 42.76 3kcz s LEU 420 CO 0.70 -0.41 1.11 -1.38 0.23 0.00 0.00 176.35 176.60 3kcz s HIS 421 N -1.27 2.27 -0.98 0.29 -3.43 -1.26 -4.41 115.29 106.50 3kcz s HIS 421 Ca 0.50 0.92 -0.01 0.00 -0.80 0.00 0.00 55.06 55.66 3kcz s HIS 421 Cb -0.32 -3.32 0.00 0.00 -1.43 0.00 0.00 32.58 27.51 3kcz s HIS 421 CO 0.42 -2.69 0.83 -1.71 -2.00 0.00 0.00 174.74 169.58 3kcz n ASN 422 N -4.01 -2.76 -4.66 7.38 5.15 -1.26 -0.64 115.26 114.46 3kcz n ASN 422 Ca 0.06 -0.48 -0.43 0.00 -0.60 0.00 0.00 54.58 53.13 3kcz n ASN 422 Cb 0.58 -4.16 -0.03 0.00 -0.53 0.00 0.00 39.78 35.64 3kcz n ASN 422 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 3kcz s ARG 423 N -5.28 4.26 0.10 1.20 3.52 -1.26 -2.17 118.95 119.32 3kcz s ARG 423 Ca 0.10 1.27 0.07 0.00 -0.13 0.00 0.00 55.73 57.04 3kcz s ARG 423 Cb -0.04 -3.63 -0.03 0.00 -1.56 0.00 0.00 34.95 29.68 3kcz s ARG 423 CO 0.58 -0.57 -0.19 -1.64 -0.81 0.00 0.00 175.30 172.67 3kcz s MET 424 N 2.99 1.04 -0.36 5.12 -1.94 -0.66 -1.11 119.30 124.39 3kcz s MET 424 Ca 0.42 -1.12 -0.16 0.00 -1.71 0.00 0.00 55.69 53.13 3kcz s MET 424 Cb -0.15 -1.22 -0.00 0.00 2.01 0.00 0.00 34.83 35.46 3kcz s MET 424 CO 0.07 0.28 0.39 -1.17 -0.01 0.00 0.00 175.02 174.58 3kcz s LEU 425 N -1.91 4.54 0.15 -0.03 2.96 -0.05 -0.42 118.68 123.92 3kcz s LEU 425 Ca 0.05 -0.33 0.06 0.00 -0.22 0.00 0.00 54.13 53.69 3kcz s LEU 425 Cb -0.10 -2.37 -0.04 0.00 0.50 0.00 0.00 46.19 44.18 3kcz s LEU 425 CO 0.04 -0.41 -0.12 -0.76 -1.32 0.00 0.00 176.35 173.78 3kcz s LEU 426 N 2.07 2.50 0.27 -0.68 1.43 -0.18 -4.63 118.68 119.46 3kcz s LEU 426 Ca 0.12 -0.95 -0.17 0.00 -1.03 0.00 0.00 54.13 52.10 3kcz s LEU 426 Cb -0.17 -0.48 -0.09 0.00 0.03 0.00 0.00 46.19 45.49 3kcz s LEU 426 CO 0.12 -0.24 0.72 0.26 0.23 0.00 0.00 176.35 177.44 3kcz s TRP 427 N -2.88 3.50 -0.07 0.29 0.52 -0.17 -1.75 118.94 118.36 3kcz s TRP 427 Ca 0.16 1.27 -0.03 0.00 0.02 0.00 0.00 56.10 57.51 3kcz s TRP 427 Cb -0.00 -2.55 0.04 0.00 -1.15 0.00 0.00 33.47 29.81 3kcz s TRP 427 CO 0.03 0.21 0.16 -1.58 0.02 0.00 0.00 176.95 175.79 3kcz s HIS 428 N -1.76 -0.18 0.17 -1.98 2.46 -0.39 -1.56 115.29 112.05 3kcz s HIS 428 Ca 0.49 0.54 0.07 0.00 0.47 0.00 0.00 55.06 56.63 3kcz s HIS 428 Cb -0.13 -0.15 -0.04 0.00 -0.13 0.00 0.00 32.58 32.13 3kcz s HIS 428 CO 0.19 -0.21 0.03 0.20 -2.47 0.00 0.00 174.74 172.48 3kcz s GLY 429 N 1.61 1.73 0.18 1.59 0.00 -1.24 -1.21 107.32 109.98 3kcz s GLY 429 Ca -0.05 -1.33 -0.20 0.00 0.00 0.00 0.00 44.72 43.14 3kcz s GLY 429 CO -0.06 -1.34 0.56 -0.45 0.00 0.00 0.00 173.10 171.81 3kcz s SER 430 N -2.97 -0.40 0.64 1.64 0.15 -1.22 -4.68 113.70 106.86 3kcz s SER 430 Ca 0.28 -0.24 -0.18 0.00 0.70 0.00 0.00 55.95 56.52 3kcz s SER 430 Cb -0.09 0.59 -0.01 0.00 -1.71 0.00 0.00 66.02 64.79 3kcz s SER 430 CO 0.20 -1.01 1.24 -0.13 1.20 0.00 0.00 173.24 174.73 3kcz s ARG 431 N -3.81 2.64 0.56 5.44 0.52 -1.10 -4.08 118.95 119.13 3kcz s ARG 431 Ca 0.04 1.89 0.24 0.00 -0.52 0.00 0.00 55.73 57.39 3kcz s ARG 431 Cb -0.01 -1.88 1.59 0.00 0.52 0.00 0.00 34.95 35.17 3kcz s ARG 431 CO -0.08 -1.48 2.20 0.52 0.02 0.00 0.00 175.30 176.47 3kcz h MET 432 N 0.50 0.00 0.00 3.54 2.86 -1.92 -1.19 114.93 118.72 3kcz h MET 432 Ca -0.50 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.14 3kcz h MET 432 Cb 1.31 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.97 3kcz h MET 432 CO 0.53 0.00 -0.02 0.66 1.06 0.00 0.00 176.91 179.14 3kcz h SER 433 N 0.00 0.00 0.12 1.22 4.64 -1.91 -3.30 113.55 114.32 3kcz h SER 433 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 3kcz h SER 433 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 3kcz h SER 433 CO -0.00 0.02 -0.80 0.59 -0.87 0.00 0.00 176.83 175.77 3kcz n ASN 434 N -3.25 1.00 0.09 4.97 3.02 -0.45 -4.36 115.26 116.29 3kcz n ASN 434 Ca -0.02 -0.89 -0.04 0.00 -0.03 0.00 0.00 54.58 53.60 3kcz n ASN 434 Cb 0.14 0.74 0.15 0.00 -0.61 0.00 0.00 39.78 40.20 3kcz n ASN 434 CO 0.00 0.00 0.00 -0.50 -2.62 0.00 0.00 177.26 174.14 3kcz h TRP 435 N 0.32 0.29 -0.54 3.10 4.06 -1.71 -1.37 115.95 120.09 3kcz h TRP 435 Ca 0.00 -0.10 0.02 0.00 2.06 0.00 0.00 58.89 60.87 3kcz h TRP 435 Cb 0.53 -0.05 -0.04 0.00 -1.00 0.00 0.00 29.16 28.60 3kcz h TRP 435 CO 0.00 0.73 0.33 0.28 -3.56 0.00 0.00 178.44 176.22 3kcz h VAL 436 N 0.17 1.06 -0.17 1.49 2.07 -1.81 -0.38 116.25 118.68 3kcz h VAL 436 Ca -0.00 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 3kcz h VAL 436 Cb 1.03 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 3kcz h VAL 436 CO 0.09 0.12 0.05 1.23 0.02 0.00 0.00 177.57 179.07 3kcz h GLY 437 N 0.65 0.29 1.02 2.17 0.00 -1.63 -0.68 103.07 104.90 3kcz h GLY 437 Ca 0.22 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.34 3kcz h GLY 437 CO -0.09 0.16 0.33 -2.22 0.00 0.00 0.00 176.54 174.72 3kcz h ILE 438 N 0.09 1.24 -0.02 2.60 2.04 -1.09 0.32 117.51 122.70 3kcz h ILE 438 Ca 0.05 -0.71 -0.15 0.00 1.00 0.00 0.00 64.86 65.05 3kcz h ILE 438 Cb 0.24 0.37 0.01 0.00 -0.74 0.00 0.00 36.82 36.69 3kcz h ILE 438 CO -0.00 0.29 -0.59 -0.07 0.00 0.00 0.00 178.15 177.78 3kcz h LEU 439 N 1.02 0.55 -0.57 1.44 3.38 -1.05 0.26 115.31 120.35 3kcz h LEU 439 Ca 0.25 -0.74 -0.16 0.00 0.09 0.00 0.00 57.88 57.32 3kcz h LEU 439 Cb 0.16 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3kcz h LEU 439 CO -0.03 1.21 -0.61 0.77 0.09 0.00 0.00 178.44 179.87 3kcz h SER 440 N -0.06 0.41 -0.00 -0.43 4.64 -1.01 -3.34 113.55 113.74 3kcz h SER 440 Ca -0.07 -0.24 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 3kcz h SER 440 Cb 1.29 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3kcz h SER 440 CO 0.12 0.92 -0.23 1.41 -0.87 0.00 0.00 176.83 178.17 3kcz n HIS 441 N -3.89 0.00 -0.31 4.77 8.25 0.11 -4.88 115.22 119.28 3kcz n HIS 441 Ca -0.03 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.47 3kcz n HIS 441 Cb 0.63 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.73 3kcz n HIS 441 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kcz n GLY 442 N 0.93 -2.08 3.76 -1.41 0.00 0.93 -4.82 105.19 102.51 3kcz n GLY 442 Ca 0.03 -1.42 -0.41 0.00 0.00 0.00 0.00 46.02 44.22 3kcz n GLY 442 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kcz s LEU 443 N -5.42 4.43 0.10 0.99 1.43 -1.25 -4.53 118.68 114.43 3kcz s LEU 443 Ca 0.00 2.58 0.08 0.00 -1.03 0.00 0.00 54.13 55.76 3kcz s LEU 443 Cb 0.00 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.55 3kcz s LEU 443 CO 0.00 -0.52 -0.21 -0.13 0.23 0.00 0.00 176.35 175.72 3kcz s ARG 444 N -1.15 1.13 0.64 1.70 0.52 -1.26 -4.85 118.95 115.68 3kcz s ARG 444 Ca 0.52 -1.14 -0.14 0.00 -0.52 0.00 0.00 55.73 54.45 3kcz s ARG 444 Cb -0.39 -1.38 -0.01 0.00 0.52 0.00 0.00 34.95 33.70 3kcz s ARG 444 CO 0.47 0.32 1.07 0.96 0.02 0.00 0.00 175.30 178.14 3kcz s ILE 445 N -1.15 3.78 0.73 1.52 -4.36 -1.26 -4.76 121.20 115.69 3kcz s ILE 445 Ca 0.06 0.74 -0.16 0.00 -0.26 0.00 0.00 60.65 61.04 3kcz s ILE 445 Cb -0.10 -3.32 0.02 0.00 1.25 0.00 0.00 42.46 40.31 3kcz s ILE 445 CO 0.04 -0.59 1.10 0.00 0.24 0.00 0.00 174.94 175.73 3kcz n ALA 446 N -2.49 0.14 -1.62 2.27 0.00 -1.26 -4.92 120.51 112.63 3kcz n ALA 446 Ca 0.09 -0.18 -0.46 0.00 0.00 0.00 0.00 53.44 52.89 3kcz n ALA 446 Cb 0.53 -2.20 -0.03 0.00 0.00 0.00 0.00 19.45 17.76 3kcz n ALA 446 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3kcz n HIS 447 N -2.56 1.65 0.17 0.00 -0.00 -1.26 -4.88 115.22 108.34 3kcz n HIS 447 Ca 0.14 0.60 0.15 0.00 0.46 0.00 0.00 57.72 59.07 3kcz n HIS 447 Cb 0.49 -2.34 0.73 0.00 -0.12 0.00 0.00 29.99 28.76 3kcz n HIS 447 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 3kcz h PRO 448 N 3.11 0.00 -0.00 1.57 0.13 -2.03 -1.77 132.00 133.01 3kcz h PRO 448 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3kcz h PRO 448 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 3kcz h PRO 448 CO 0.68 0.00 -0.14 0.39 -0.23 0.00 0.00 178.00 178.70 3kcz n GLU 449 N -4.22 0.58 -2.20 0.86 -0.58 -1.26 -4.89 120.64 108.92 3kcz n GLU 449 Ca 0.02 -0.21 -0.40 0.00 -0.42 0.00 0.00 57.16 56.15 3kcz n GLU 449 Cb 0.30 -1.50 -0.02 0.00 -0.57 0.00 0.00 31.44 29.66 3kcz n GLU 449 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3kcz s ALA 450 N -2.57 3.32 0.27 0.62 0.00 -0.67 -4.32 121.76 118.41 3kcz s ALA 450 Ca 0.26 1.12 -0.30 0.00 0.00 0.00 0.00 51.96 53.04 3kcz s ALA 450 Cb 0.20 -3.43 -0.11 0.00 0.00 0.00 0.00 23.12 19.77 3kcz s ALA 450 CO 0.50 -0.60 1.54 -1.25 0.00 0.00 0.00 175.76 175.96 3kcz s PRO 451 N -2.02 4.18 0.45 0.00 0.04 -1.26 -4.88 135.00 131.50 3kcz s PRO 451 Ca 0.53 2.47 0.19 0.00 0.04 0.00 0.00 61.00 64.23 3kcz s PRO 451 Cb -0.36 -3.06 1.07 0.00 0.04 0.00 0.00 34.50 32.19 3kcz s PRO 451 CO 0.46 -0.56 1.96 0.97 0.04 0.00 0.00 177.00 179.87 3kcz h ILE 452 N 3.49 0.95 0.00 0.56 2.10 -1.95 -2.28 117.51 120.38 3kcz h ILE 452 Ca -0.46 -0.80 0.00 0.00 1.08 0.00 0.00 64.86 64.67 3kcz h ILE 452 Cb 1.22 1.46 0.00 0.00 -1.09 0.00 0.00 36.82 38.41 3kcz h ILE 452 CO 0.80 0.21 0.00 0.35 -1.08 0.00 0.00 178.15 178.43 3kcz n THR 453 N -3.98 0.54 0.38 2.19 -2.24 -1.26 -1.65 114.28 108.27 3kcz n THR 453 Ca -0.02 0.14 0.05 0.00 -2.27 0.00 0.00 64.05 61.95 3kcz n THR 453 Cb 0.30 -0.85 0.24 0.00 -2.10 0.00 0.00 70.33 67.92 3kcz n THR 453 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kcz n GLY 454 N 0.21 -0.88 2.89 3.38 0.00 -0.86 -4.69 105.19 105.24 3kcz n GLY 454 Ca 0.08 -0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 3kcz n GLY 454 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kcz s TYR 455 N -3.00 2.09 0.33 1.61 2.02 -0.66 -4.85 117.35 114.90 3kcz s TYR 455 Ca 0.05 -1.58 0.08 0.00 -0.37 0.00 0.00 57.07 55.26 3kcz s TYR 455 Cb 0.07 -1.48 0.80 0.00 -0.40 0.00 0.00 41.96 40.95 3kcz s TYR 455 CO 0.20 -0.74 1.82 1.98 -1.57 0.00 0.00 175.55 177.23 3kcz h MET 456 N 8.02 0.69 -0.30 -0.62 1.85 -1.84 -2.29 114.93 120.44 3kcz h MET 456 Ca -0.17 -0.04 -0.24 0.00 -0.61 0.00 0.00 59.70 58.64 3kcz h MET 456 Cb 1.08 -0.16 -0.24 0.00 0.43 0.00 0.00 31.60 32.71 3kcz h MET 456 CO 0.40 0.46 -0.75 1.19 -0.40 0.00 0.00 176.91 177.81 3kcz n PHE 457 N -4.65 1.08 -1.64 1.39 3.72 -1.26 -0.97 117.46 115.13 3kcz n PHE 457 Ca 0.21 -1.68 0.00 0.00 -0.05 0.00 0.00 57.45 55.93 3kcz n PHE 457 Cb 0.55 -0.27 0.00 0.00 -0.94 0.00 0.00 39.48 38.83 3kcz n PHE 457 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3kcz n GLY 458 N -0.71 -2.37 3.11 1.37 0.00 -0.86 -4.26 105.19 101.47 3kcz n GLY 458 Ca 0.25 -1.63 -0.43 0.00 0.00 0.00 0.00 46.02 44.20 3kcz n GLY 458 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kcz n LYS 459 N -0.34 3.57 -1.59 1.61 5.02 -1.26 -4.80 118.16 120.37 3kcz n LYS 459 Ca 0.00 -3.73 0.00 0.00 -2.02 0.00 0.00 58.31 52.56 3kcz n LYS 459 Cb 0.00 -2.94 0.00 0.00 -0.02 0.00 0.00 35.03 32.07 3kcz n LYS 459 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kcz n GLY 460 N 3.20 4.95 3.56 0.72 0.00 -1.26 -4.52 105.19 111.84 3kcz n GLY 460 Ca 0.38 -2.17 -0.35 0.00 0.00 0.00 0.00 46.02 43.88 3kcz n GLY 460 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kcz s ILE 461 N -0.60 4.59 -0.14 -0.61 1.01 0.13 -4.52 121.20 121.06 3kcz s ILE 461 Ca 0.00 -0.10 -0.10 0.00 0.00 0.00 0.00 60.65 60.45 3kcz s ILE 461 Cb 0.00 -3.09 -0.05 0.00 0.01 0.00 0.00 42.46 39.33 3kcz s ILE 461 CO 0.00 0.42 0.20 -0.31 0.00 0.00 0.00 174.94 175.25 3kcz s TYR 462 N 0.79 3.53 0.06 3.97 1.51 -1.26 -2.19 117.35 123.76 3kcz s TYR 462 Ca 0.03 0.54 0.02 0.00 -1.01 0.00 0.00 57.07 56.65 3kcz s TYR 462 Cb -0.14 -2.12 -0.03 0.00 -0.11 0.00 0.00 41.96 39.56 3kcz s TYR 462 CO 0.02 0.50 -0.08 -0.06 -1.11 0.00 0.00 175.55 174.83 3kcz s PHE 463 N -0.34 0.73 0.19 2.71 0.08 0.08 -4.76 117.98 116.68 3kcz s PHE 463 Ca 0.14 -0.59 0.09 0.00 0.12 0.00 0.00 56.93 56.69 3kcz s PHE 463 Cb -0.12 -0.44 -0.04 0.00 -0.57 0.00 0.00 43.02 41.85 3kcz s PHE 463 CO 0.03 -0.10 -0.19 0.00 -0.10 0.00 0.00 175.22 174.86 3kcz s ALA 464 N -1.89 2.21 -2.87 5.36 0.00 -0.60 -1.08 121.76 122.89 3kcz s ALA 464 Ca -0.05 -1.59 0.24 0.00 0.00 0.00 0.00 51.96 50.56 3kcz s ALA 464 Cb -0.07 -0.22 0.23 0.00 0.00 0.00 0.00 23.12 23.07 3kcz s ALA 464 CO -0.01 0.27 1.28 -0.40 0.00 0.00 0.00 175.76 176.90 3kcz n ASP 465 N 0.11 3.06 -4.29 0.00 5.68 -1.26 -1.00 116.55 118.85 3kcz n ASP 465 Ca -0.12 -1.99 -0.35 0.00 -0.50 0.00 0.00 54.79 51.84 3kcz n ASP 465 Cb 0.57 -0.04 -0.14 0.00 -1.14 0.00 0.00 41.12 40.37 3kcz n ASP 465 CO 0.00 0.00 0.00 -0.04 -1.33 0.00 0.00 177.20 175.83 3kcz s MET 466 N -1.89 3.32 0.26 0.11 -1.94 -1.26 -4.88 119.30 113.03 3kcz s MET 466 Ca 0.30 -0.66 -0.01 0.00 -1.71 0.00 0.00 55.69 53.61 3kcz s MET 466 Cb 0.20 -2.92 0.52 0.00 2.01 0.00 0.00 34.83 34.64 3kcz s MET 466 CO 0.30 -0.17 1.77 0.66 -0.01 0.00 0.00 175.02 177.56 3kcz h SER 467 N 8.00 0.54 1.20 3.03 4.64 -1.58 -1.82 113.55 127.57 3kcz h SER 467 Ca -0.41 0.09 -0.13 0.00 -0.47 0.00 0.00 61.79 60.86 3kcz h SER 467 Cb 1.16 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.23 3kcz h SER 467 CO 0.61 0.24 -0.63 0.77 -0.87 0.00 0.00 176.83 176.94 3kcz h SER 468 N 0.64 0.00 -0.23 4.97 4.64 -1.88 0.02 113.55 121.72 3kcz h SER 468 Ca 0.46 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.82 3kcz h SER 468 Cb 0.62 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.67 3kcz h SER 468 CO -0.35 0.63 -0.05 0.50 -0.87 0.00 0.00 176.83 176.69 3kcz h LYS 469 N 0.00 0.01 -0.43 4.77 3.64 -1.63 -1.61 116.57 121.32 3kcz h LYS 469 Ca -0.01 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.30 3kcz h LYS 469 Cb 1.41 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.21 3kcz h LYS 469 CO 0.08 0.01 -0.03 0.77 -2.27 0.00 0.00 179.45 178.01 3kcz h SER 470 N 0.01 0.77 0.17 4.20 0.02 -1.47 -3.28 113.55 113.98 3kcz h SER 470 Ca 0.11 -0.33 -0.02 0.00 -0.84 0.00 0.00 61.79 60.72 3kcz h SER 470 Cb 0.16 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.49 3kcz h SER 470 CO -0.23 0.91 -0.09 0.00 -1.14 0.00 0.00 176.83 176.29 3kcz h ALA 471 N 0.89 1.52 -0.05 3.77 0.00 -0.80 -0.06 119.26 124.54 3kcz h ALA 471 Ca 0.12 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3kcz h ALA 471 Cb 0.54 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3kcz h ALA 471 CO 0.03 0.11 -0.07 -0.91 0.00 0.00 0.00 179.25 178.41 3kcz h ASN 472 N 0.00 0.06 0.00 0.00 2.35 -1.35 -1.37 115.58 115.26 3kcz h ASN 472 Ca -0.00 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3kcz h ASN 472 Cb 0.19 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.55 3kcz h ASN 472 CO 0.01 0.14 0.00 -1.22 -1.65 0.00 0.00 177.43 174.72 3kcz n TYR 473 N -4.42 0.00 0.19 1.19 4.01 -0.04 -2.35 117.16 115.75 3kcz n TYR 473 Ca -0.02 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.78 3kcz n TYR 473 Cb 0.17 0.00 0.30 0.00 -0.31 0.00 0.00 39.34 39.50 3kcz n TYR 473 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3kcz n PHE 475 N -3.41 -2.11 -1.38 0.00 3.72 -0.99 -4.28 117.46 109.01 3kcz n PHE 475 Ca 0.00 0.87 -0.30 0.00 -0.05 0.00 0.00 57.45 57.97 3kcz n PHE 475 Cb 0.54 -3.90 0.10 0.00 -0.94 0.00 0.00 39.48 35.28 3kcz n PHE 475 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3kcz s ALA 476 N -3.42 2.09 0.23 4.37 0.00 -1.26 -5.00 121.76 118.77 3kcz s ALA 476 Ca 0.50 -0.02 -0.12 0.00 0.00 0.00 0.00 51.96 52.33 3kcz s ALA 476 Cb -0.26 -3.18 -0.00 0.00 0.00 0.00 0.00 23.12 19.68 3kcz s ALA 476 CO 0.84 -1.86 0.44 -1.54 0.00 0.00 0.00 175.76 173.64 3kcz s SER 477 N -3.63 -0.08 0.49 0.00 1.04 -0.26 -4.98 113.70 106.28 3kcz s SER 477 Ca 0.61 -0.90 0.21 0.00 0.48 0.00 0.00 55.95 56.36 3kcz s SER 477 Cb -0.16 0.56 1.27 0.00 0.10 0.00 0.00 66.02 67.79 3kcz s SER 477 CO 0.56 -1.08 2.05 0.08 0.98 0.00 0.00 173.24 175.82 3kcz h ARG 478 N 2.31 0.00 0.06 4.02 0.11 -1.97 -2.06 114.38 116.85 3kcz h ARG 478 Ca -0.27 0.00 -0.23 0.00 0.10 0.00 0.00 59.98 59.58 3kcz h ARG 478 Cb 1.25 0.00 0.02 0.00 1.11 0.00 0.00 29.97 32.35 3kcz h ARG 478 CO 0.38 0.14 -0.92 1.25 0.10 0.00 0.00 179.97 180.92 3kcz h LEU 479 N 0.00 0.70 -7.27 0.08 5.85 -2.00 -3.39 115.31 109.27 3kcz h LEU 479 Ca -0.00 -0.81 -0.63 0.00 0.84 0.00 0.00 57.88 57.28 3kcz h LEU 479 Cb 0.30 -0.22 -0.41 0.00 0.37 0.00 0.00 40.66 40.70 3kcz h LEU 479 CO 0.02 1.43 -0.61 -0.54 -0.34 0.00 0.00 178.44 178.40 3kcz s LYS 480 N -3.03 2.14 0.00 1.25 1.02 -0.83 -4.95 119.74 115.32 3kcz s LYS 480 Ca -0.11 -2.87 0.22 0.00 0.02 0.00 0.00 55.97 53.23 3kcz s LYS 480 Cb 0.04 -3.34 0.49 0.00 -0.52 0.00 0.00 37.83 34.50 3kcz s LYS 480 CO 0.88 -1.17 1.44 0.27 -0.92 0.00 0.00 175.35 175.84 3kcz n ASN 481 N 2.72 3.18 -4.50 2.83 6.94 -0.84 -1.11 115.26 124.48 3kcz n ASN 481 Ca 0.10 -1.95 -0.38 0.00 -0.02 0.00 0.00 54.58 52.33 3kcz n ASN 481 Cb 0.33 -0.25 -0.12 0.00 -2.36 0.00 0.00 39.78 37.38 3kcz n ASN 481 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 3kcz s THR 482 N -1.50 4.80 0.42 5.53 2.01 -1.26 0.24 115.64 125.88 3kcz s THR 482 Ca 0.38 -0.14 0.03 0.00 0.31 0.00 0.00 61.69 62.28 3kcz s THR 482 Cb 0.22 -3.34 -0.03 0.00 0.01 0.00 0.00 72.50 69.36 3kcz s THR 482 CO 0.31 0.20 0.07 -0.83 -0.69 0.00 0.00 174.62 173.68 3kcz s GLY 483 N 1.67 2.62 0.13 4.40 0.00 -0.63 -4.98 107.32 110.53 3kcz s GLY 483 Ca 0.06 -1.24 0.11 0.00 0.00 0.00 0.00 44.72 43.65 3kcz s GLY 483 CO 0.07 -1.96 -0.27 1.08 0.00 0.00 0.00 173.10 172.03 3kcz s LEU 484 N -3.67 2.32 -0.01 0.66 1.43 -1.26 -0.60 118.68 117.55 3kcz s LEU 484 Ca 0.22 -0.75 0.04 0.00 -1.03 0.00 0.00 54.13 52.61 3kcz s LEU 484 Cb 0.04 -1.21 -0.01 0.00 0.03 0.00 0.00 46.19 45.04 3kcz s LEU 484 CO 0.12 0.18 -0.12 -0.76 0.23 0.00 0.00 176.35 176.00 3kcz s LEU 485 N -2.04 2.03 -0.13 1.79 1.43 -0.49 -4.41 118.68 116.86 3kcz s LEU 485 Ca 0.14 -0.22 -0.03 0.00 -1.03 0.00 0.00 54.13 52.98 3kcz s LEU 485 Cb -0.10 -0.60 -0.03 0.00 0.03 0.00 0.00 46.19 45.49 3kcz s LEU 485 CO 0.06 0.14 -0.04 -0.22 0.23 0.00 0.00 176.35 176.52 3kcz s LEU 486 N -0.32 3.29 -0.13 1.79 2.96 -0.35 -0.19 118.68 125.74 3kcz s LEU 486 Ca 0.04 -0.08 -0.04 0.00 -0.22 0.00 0.00 54.13 53.84 3kcz s LEU 486 Cb -0.05 -1.78 -0.03 0.00 0.50 0.00 0.00 46.19 44.83 3kcz s LEU 486 CO -0.00 0.22 0.02 -0.76 -1.32 0.00 0.00 176.35 174.51 3kcz s LEU 487 N 0.03 3.61 0.01 -0.68 1.43 0.70 -1.26 118.68 122.53 3kcz s LEU 487 Ca 0.00 0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.20 3kcz s LEU 487 Cb -0.13 -1.86 -0.01 0.00 0.03 0.00 0.00 46.19 44.21 3kcz s LEU 487 CO 0.03 0.29 -0.03 -0.44 0.23 0.00 0.00 176.35 176.42 3kcz s SER 488 N -0.33 0.29 -0.11 2.29 0.01 -0.72 -1.05 113.70 114.08 3kcz s SER 488 Ca 0.07 -0.32 -0.30 0.00 1.31 0.00 0.00 55.95 56.72 3kcz s SER 488 Cb -0.12 0.04 -0.02 0.00 0.21 0.00 0.00 66.02 66.13 3kcz s SER 488 CO 0.02 -0.16 1.15 -1.61 0.41 0.00 0.00 173.24 173.05 3kcz s GLU 489 N -0.91 4.33 -0.20 12.44 2.02 0.81 -1.01 118.70 136.19 3kcz s GLU 489 Ca -0.09 1.56 0.01 0.00 0.02 0.00 0.00 54.97 56.48 3kcz s GLU 489 Cb -0.06 -3.61 0.03 0.00 0.10 0.00 0.00 34.13 30.59 3kcz s GLU 489 CO -0.00 -0.49 -0.18 0.08 0.02 0.00 0.00 175.26 174.69 3kcz s VAL 490 N 2.55 2.14 -1.04 2.63 1.01 0.44 -1.46 120.40 126.67 3kcz s VAL 490 Ca 0.52 -1.05 -0.21 0.00 0.00 0.00 0.00 61.98 61.24 3kcz s VAL 490 Cb -0.21 -1.97 0.08 0.00 0.00 0.00 0.00 36.38 34.27 3kcz s VAL 490 CO 0.17 0.43 1.40 0.00 0.00 0.00 0.00 175.10 177.11 3kcz s ALA 491 N 1.26 3.00 0.19 5.51 0.00 -0.46 -1.65 121.76 129.61 3kcz s ALA 491 Ca 0.02 -2.51 0.07 0.00 0.00 0.00 0.00 51.96 49.54 3kcz s ALA 491 Cb -0.14 -4.41 0.06 0.00 0.00 0.00 0.00 23.12 18.63 3kcz s ALA 491 CO -0.11 -3.39 1.43 -0.07 0.00 0.00 0.00 175.76 173.62 3kcz h LEU 492 N 12.05 0.09 0.00 0.00 3.38 -1.55 -3.47 115.31 125.81 3kcz h LEU 492 Ca 0.22 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3kcz h LEU 492 Cb 0.99 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.71 3kcz h LEU 492 CO 1.35 0.87 0.00 0.61 0.09 0.00 0.00 178.44 181.35 3kcz n GLY 493 N 0.78 2.53 3.71 0.83 0.00 0.19 -3.57 105.19 109.65 3kcz n GLY 493 Ca -0.02 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 3kcz n GLY 493 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3kcz s GLN 494 N 0.00 4.51 -0.04 1.61 -1.52 -1.26 -4.65 119.66 118.31 3kcz s GLN 494 Ca 0.00 1.48 -0.16 0.00 -1.95 0.00 0.00 55.36 54.73 3kcz s GLN 494 Cb 0.00 -3.46 -0.05 0.00 -0.22 0.00 0.00 33.01 29.27 3kcz s GLN 494 CO 0.00 -0.14 0.43 0.00 -0.25 0.00 0.00 175.29 175.32 3kcz s ASN 496 N -0.56 6.54 -0.13 0.00 2.47 0.18 -4.88 114.94 118.57 3kcz s ASN 496 Ca 0.24 0.24 -0.23 0.00 0.42 0.00 0.00 52.86 53.54 3kcz s ASN 496 Cb -0.16 -2.45 -0.03 0.00 -1.45 0.00 0.00 41.25 37.16 3kcz s ASN 496 CO 0.12 -0.99 0.69 -1.61 -3.72 0.00 0.00 177.10 171.60 3kcz s GLU 497 N 3.65 4.33 0.05 0.43 2.02 -1.26 -1.42 118.70 126.50 3kcz s GLU 497 Ca 0.37 0.80 0.07 0.00 0.02 0.00 0.00 54.97 56.23 3kcz s GLU 497 Cb -0.11 -3.51 -0.03 0.00 0.10 0.00 0.00 34.13 30.58 3kcz s GLU 497 CO 0.24 -0.11 -0.18 -0.51 0.02 0.00 0.00 175.26 174.72 3kcz s LEU 498 N 1.42 2.19 0.10 1.80 1.43 -0.22 -4.96 118.68 120.44 3kcz s LEU 498 Ca 0.34 -0.53 0.22 0.00 -1.03 0.00 0.00 54.13 53.13 3kcz s LEU 498 Cb -0.17 -0.82 -0.09 0.00 0.03 0.00 0.00 46.19 45.14 3kcz s LEU 498 CO 0.14 0.09 0.87 0.18 0.23 0.00 0.00 176.35 177.86 3kcz n LEU 499 N 1.72 0.54 -3.80 1.79 4.77 -1.26 -1.40 117.00 119.35 3kcz n LEU 499 Ca -0.18 0.15 -0.09 0.00 -0.03 0.00 0.00 56.01 55.85 3kcz n LEU 499 Cb 0.54 -0.05 -0.04 0.00 -2.33 0.00 0.00 43.42 41.53 3kcz n LEU 499 CO 0.23 -0.08 0.22 -1.83 -1.33 0.00 0.00 177.39 174.60 3kcz s GLU 500 N -3.37 1.37 0.29 3.23 -1.05 -1.26 -4.37 118.70 113.53 3kcz s GLU 500 Ca -0.02 -0.95 -0.30 0.00 -0.15 0.00 0.00 54.97 53.55 3kcz s GLU 500 Cb 0.12 0.49 -0.12 0.00 -0.44 0.00 0.00 34.13 34.18 3kcz s GLU 500 CO 0.83 -0.57 1.44 0.00 0.95 0.00 0.00 175.26 177.91 3kcz n ALA 501 N -0.32 1.62 -3.31 -0.84 0.00 -1.26 -5.00 120.51 111.40 3kcz n ALA 501 Ca -0.09 0.38 -0.10 0.00 0.00 0.00 0.00 53.44 53.64 3kcz n ALA 501 Cb 0.62 -2.33 -0.06 0.00 0.00 0.00 0.00 19.45 17.68 3kcz n ALA 501 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3kcz s ASN 502 N 0.18 0.48 0.63 0.00 3.84 -0.14 -5.03 114.94 114.90 3kcz s ASN 502 Ca 0.63 -0.57 0.39 0.00 0.21 0.00 0.00 52.86 53.52 3kcz s ASN 502 Cb -0.58 1.04 2.12 0.00 -0.55 0.00 0.00 41.25 43.28 3kcz s ASN 502 CO 0.53 -0.34 2.19 -0.65 -2.79 0.00 0.00 177.10 176.05 3kcz h PRO 503 N 7.99 0.00 -0.65 0.43 0.11 -1.64 0.19 132.00 138.43 3kcz h PRO 503 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 3kcz h PRO 503 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3kcz h PRO 503 CO 0.25 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.67 3kcz n LYS 504 N -2.94 2.81 -0.27 1.05 5.02 -1.26 -2.84 118.16 119.73 3kcz n LYS 504 Ca -0.03 -1.71 0.28 0.00 -2.02 0.00 0.00 58.31 54.83 3kcz n LYS 504 Cb 0.14 -1.74 0.64 0.00 -0.02 0.00 0.00 35.03 34.05 3kcz n LYS 504 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3kcz h ALA 505 N 3.36 2.66 -1.00 7.82 0.00 -0.83 -2.21 119.26 129.05 3kcz h ALA 505 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 3kcz h ALA 505 Cb 1.09 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.87 3kcz h ALA 505 CO 0.19 -0.99 0.66 1.49 0.00 0.00 0.00 179.25 180.60 3kcz h GLU 506 N 0.17 1.25 0.00 0.00 4.81 -1.81 -0.90 114.58 118.10 3kcz h GLU 506 Ca 0.52 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.68 3kcz h GLU 506 Cb 1.74 -0.28 0.00 0.00 0.63 0.00 0.00 28.75 30.84 3kcz h GLU 506 CO -0.12 0.82 0.00 0.41 -0.73 0.00 0.00 179.01 179.40 3kcz n GLY 507 N -1.37 -1.11 0.27 1.92 0.00 -0.83 -2.62 105.19 101.45 3kcz n GLY 507 Ca 0.13 -0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.19 3kcz n GLY 507 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3kcz n LEU 508 N -1.37 1.12 0.34 0.99 4.32 -0.34 -4.49 117.00 117.57 3kcz n LEU 508 Ca 0.08 -0.31 -0.19 0.00 -0.02 0.00 0.00 56.01 55.58 3kcz n LEU 508 Cb 0.21 -0.11 -0.10 0.00 -1.62 0.00 0.00 43.42 41.80 3kcz n LEU 508 CO 0.18 0.21 0.55 -0.07 -1.22 0.00 0.00 177.39 177.04 3kcz h LEU 509 N 1.33 -1.27 -2.55 2.23 3.38 -1.53 -3.47 115.31 113.42 3kcz h LEU 509 Ca 0.00 0.09 -0.37 0.00 0.09 0.00 0.00 57.88 57.69 3kcz h LEU 509 Cb 0.53 0.40 0.11 0.00 0.09 0.00 0.00 40.66 41.79 3kcz h LEU 509 CO 0.00 -0.68 -0.88 0.00 0.09 0.00 0.00 178.44 176.96 3kcz n GLN 510 N -5.58 -2.66 0.00 1.13 6.02 -1.26 -2.13 117.38 112.90 3kcz n GLN 510 Ca -0.13 0.63 0.00 0.00 -0.01 0.00 0.00 57.00 57.49 3kcz n GLN 510 Cb 0.47 -4.96 0.00 0.00 1.02 0.00 0.00 30.24 26.77 3kcz n GLN 510 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3kcz n GLY 511 N -1.51 2.72 3.68 1.08 0.00 -1.26 -5.06 105.19 104.84 3kcz n GLY 511 Ca -0.15 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.33 3kcz n GLY 511 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kcz s LYS 512 N 0.00 1.03 -0.00 1.61 1.02 -0.90 -4.98 119.74 117.52 3kcz s LYS 512 Ca 0.00 1.07 0.10 0.00 0.02 0.00 0.00 55.97 57.16 3kcz s LYS 512 Cb 0.00 -1.76 -0.12 0.00 -0.52 0.00 0.00 37.83 35.42 3kcz s LYS 512 CO 0.00 -2.47 0.36 0.72 -0.92 0.00 0.00 175.35 173.04 3kcz n HIS 513 N -4.07 0.00 -3.76 3.18 8.25 -0.33 -4.87 115.22 113.61 3kcz n HIS 513 Ca 0.08 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.45 3kcz n HIS 513 Cb 0.54 -0.07 -0.03 0.00 1.12 0.00 0.00 29.99 31.55 3kcz n HIS 513 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3kcz s SER 514 N -2.30 -0.31 -0.08 0.41 1.04 -1.11 -4.55 113.70 106.81 3kcz s SER 514 Ca 0.01 -0.49 0.01 0.00 0.48 0.00 0.00 55.95 55.97 3kcz s SER 514 Cb 0.07 0.67 -0.03 0.00 0.10 0.00 0.00 66.02 66.83 3kcz s SER 514 CO 0.41 -1.20 -0.11 -0.89 0.98 0.00 0.00 173.24 172.43 3kcz s THR 515 N -3.89 3.34 -0.19 2.02 2.01 -0.46 0.51 115.64 118.99 3kcz s THR 515 Ca 0.10 -0.60 0.01 0.00 0.31 0.00 0.00 61.69 61.51 3kcz s THR 515 Cb -0.04 -2.36 0.03 0.00 0.01 0.00 0.00 72.50 70.14 3kcz s THR 515 CO 0.01 0.57 -0.16 -0.75 -0.69 0.00 0.00 174.62 173.61 3kcz s LYS 516 N -0.48 2.62 -0.09 4.92 2.20 -0.51 -0.45 119.74 127.97 3kcz s LYS 516 Ca 0.06 -0.84 -0.30 0.00 -0.36 0.00 0.00 55.97 54.54 3kcz s LYS 516 Cb -0.12 -2.49 -0.02 0.00 -1.51 0.00 0.00 37.83 33.69 3kcz s LYS 516 CO 0.02 -0.29 1.06 0.20 -0.36 0.00 0.00 175.35 175.98 3kcz s GLY 517 N 1.32 2.30 -0.14 5.54 0.00 0.15 -1.06 107.32 115.44 3kcz s GLY 517 Ca 0.02 0.45 -0.22 0.00 0.00 0.00 0.00 44.72 44.97 3kcz s GLY 517 CO -0.11 1.99 0.68 1.08 0.00 0.00 0.00 173.10 176.74 3kcz s LEU 518 N 2.03 4.23 0.23 0.66 1.43 -0.49 -1.71 118.68 125.05 3kcz s LEU 518 Ca 0.51 1.02 0.05 0.00 -1.03 0.00 0.00 54.13 54.68 3kcz s LEU 518 Cb -0.20 -3.01 -0.03 0.00 0.03 0.00 0.00 46.19 42.98 3kcz s LEU 518 CO 0.19 -0.21 0.32 -0.83 0.23 0.00 0.00 176.35 176.05 3kcz s GLY 519 N 0.99 1.31 0.38 -3.19 0.00 -1.26 -4.12 107.32 101.44 3kcz s GLY 519 Ca 0.33 -1.24 0.06 0.00 0.00 0.00 0.00 44.72 43.87 3kcz s GLY 519 CO 0.14 -1.26 2.00 0.50 0.00 0.00 0.00 173.10 174.48 3kcz h LYS 520 N 1.37 0.57 -4.79 2.90 1.57 -0.02 -3.43 116.57 114.73 3kcz h LYS 520 Ca -0.51 -0.06 -0.51 0.00 -1.87 0.00 0.00 60.65 57.70 3kcz h LYS 520 Cb 1.23 -0.12 -0.32 0.00 0.08 0.00 0.00 32.23 33.10 3kcz h LYS 520 CO 0.62 0.44 -0.82 -1.64 -0.57 0.00 0.00 179.45 177.48 3kcz s MET 521 N -5.37 1.59 0.15 3.15 -1.94 -0.51 -0.52 119.30 115.86 3kcz s MET 521 Ca -0.08 -0.46 -0.18 0.00 -1.71 0.00 0.00 55.69 53.26 3kcz s MET 521 Cb 0.17 -1.36 0.04 0.00 2.01 0.00 0.00 34.83 35.69 3kcz s MET 521 CO 0.75 0.11 0.47 0.00 -0.01 0.00 0.00 175.02 176.34 3kcz s ALA 522 N 0.38 -1.06 0.40 3.03 0.00 -0.45 -4.23 121.76 119.83 3kcz s ALA 522 Ca -0.09 0.00 -0.27 0.00 0.00 0.00 0.00 51.96 51.60 3kcz s ALA 522 Cb -0.13 0.78 -0.10 0.00 0.00 0.00 0.00 23.12 23.66 3kcz s ALA 522 CO 0.03 -0.71 1.38 -2.30 0.00 0.00 0.00 175.76 174.16 3kcz n PRO 523 N -0.29 2.30 -4.22 0.00 -0.02 -1.26 -0.48 135.00 131.03 3kcz n PRO 523 Ca -0.14 0.81 -0.32 0.00 -2.02 0.00 0.00 63.50 61.82 3kcz n PRO 523 Cb 0.64 -2.52 -0.08 0.00 -0.02 0.00 0.00 33.50 31.51 3kcz n PRO 523 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3kcz s SER 524 N -0.34 5.25 0.46 2.55 1.04 -1.26 -4.90 113.70 116.51 3kcz s SER 524 Ca 0.57 0.01 0.25 0.00 0.48 0.00 0.00 55.95 57.26 3kcz s SER 524 Cb -0.50 -1.39 1.27 0.00 0.10 0.00 0.00 66.02 65.50 3kcz s SER 524 CO 0.61 0.26 1.82 -1.28 0.98 0.00 0.00 173.24 175.64 3kcz h SER 525 N 4.17 0.26 -0.01 7.02 0.87 -1.95 -1.16 113.55 122.73 3kcz h SER 525 Ca -0.49 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.12 3kcz h SER 525 Cb 1.18 -0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.13 3kcz h SER 525 CO 0.59 0.07 0.03 0.00 -0.53 0.00 0.00 176.83 176.99 3kcz h ALA 526 N 1.56 1.26 -0.02 6.23 0.00 -1.96 -1.82 119.26 124.50 3kcz h ALA 526 Ca 0.52 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.43 3kcz h ALA 526 Cb 1.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.41 3kcz h ALA 526 CO -0.15 -0.04 -0.18 0.72 0.00 0.00 0.00 179.25 179.60 3kcz n HIS 527 N -3.39 0.00 -2.44 0.00 -0.00 -0.44 -5.03 115.22 103.92 3kcz n HIS 527 Ca -0.03 0.00 -0.36 0.00 -0.00 0.00 0.00 57.72 57.34 3kcz n HIS 527 Cb 0.11 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.07 3kcz n HIS 527 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 3kcz s PHE 528 N -2.12 3.02 0.49 4.41 2.99 -0.69 -4.37 117.98 121.71 3kcz s PHE 528 Ca 0.23 1.59 0.00 0.00 0.00 0.00 0.00 56.93 58.75 3kcz s PHE 528 Cb 0.19 -3.19 -0.00 0.00 0.00 0.00 0.00 43.02 40.02 3kcz s PHE 528 CO 0.39 -1.01 0.01 1.33 -0.00 0.00 0.00 175.22 175.94 3kcz n VAL 529 N -0.60 0.00 -4.23 -0.44 0.24 -0.99 -4.98 118.33 107.34 3kcz n VAL 529 Ca 0.08 -2.37 -0.18 0.00 -2.04 0.00 0.00 64.34 59.82 3kcz n VAL 529 Cb 0.50 0.50 -0.11 0.00 -1.47 0.00 0.00 33.84 33.26 3kcz n VAL 529 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3kcz s THR 530 N -2.83 1.31 -0.24 3.34 -4.23 -1.26 0.21 115.64 111.93 3kcz s THR 530 Ca 0.02 -1.66 -0.03 0.00 -1.18 0.00 0.00 61.69 58.84 3kcz s THR 530 Cb 0.00 -1.47 0.08 0.00 1.34 0.00 0.00 72.50 72.45 3kcz s THR 530 CO 0.01 -0.38 0.09 -0.22 -0.54 0.00 0.00 174.62 173.58 3kcz s LEU 531 N -2.34 1.08 -1.48 4.79 2.96 -0.12 -4.88 118.68 118.70 3kcz s LEU 531 Ca 0.07 -1.10 -0.10 0.00 -0.22 0.00 0.00 54.13 52.78 3kcz s LEU 531 Cb -0.06 -0.52 0.06 0.00 0.50 0.00 0.00 46.19 46.17 3kcz s LEU 531 CO 0.03 -0.38 0.93 0.59 -1.32 0.00 0.00 176.35 176.20 3kcz n ASN 532 N 5.10 -4.03 0.00 3.68 3.02 -1.26 -2.36 115.26 119.41 3kcz n ASN 532 Ca -0.06 -0.78 0.00 0.00 -0.03 0.00 0.00 54.58 53.71 3kcz n ASN 532 Cb 0.45 -3.96 0.00 0.00 -0.61 0.00 0.00 39.78 35.65 3kcz n ASN 532 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kcz n GLY 533 N -1.69 1.76 3.58 7.41 0.00 -1.26 -5.06 105.19 109.92 3kcz n GLY 533 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 3kcz n GLY 533 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3kcz s SER 534 N -1.59 4.90 0.07 1.61 0.01 -0.99 -4.82 113.70 112.88 3kcz s SER 534 Ca 0.00 -0.02 -0.31 0.00 1.31 0.00 0.00 55.95 56.94 3kcz s SER 534 Cb 0.00 -1.52 -0.08 0.00 0.21 0.00 0.00 66.02 64.63 3kcz s SER 534 CO 0.00 0.28 1.59 -0.89 0.41 0.00 0.00 173.24 174.63 3kcz s THR 535 N -0.33 3.13 -0.34 1.44 2.01 -0.26 -0.94 115.64 120.35 3kcz s THR 535 Ca 0.06 0.61 -0.09 0.00 0.31 0.00 0.00 61.69 62.58 3kcz s THR 535 Cb -0.12 -3.39 0.02 0.00 0.01 0.00 0.00 72.50 69.01 3kcz s THR 535 CO 0.02 0.00 0.15 -0.69 -0.69 0.00 0.00 174.62 173.42 3kcz s VAL 536 N 2.41 4.32 -1.31 3.82 1.01 0.13 -0.87 120.40 129.90 3kcz s VAL 536 Ca 0.71 -0.77 -0.13 0.00 0.00 0.00 0.00 61.98 61.79 3kcz s VAL 536 Cb -0.38 -3.33 0.12 0.00 0.00 0.00 0.00 36.38 32.78 3kcz s VAL 536 CO 0.31 -0.09 1.85 -0.81 0.00 0.00 0.00 175.10 176.36 3kcz n PRO 537 N 4.93 3.31 -1.78 2.72 -0.04 -1.26 -2.34 135.00 140.54 3kcz n PRO 537 Ca -0.13 -3.32 -0.40 0.00 -0.04 0.00 0.00 63.50 59.61 3kcz n PRO 537 Cb 0.47 -3.13 0.02 0.00 -0.04 0.00 0.00 33.50 30.81 3kcz n PRO 537 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3kcz s LEU 538 N 1.51 4.10 0.00 1.53 1.43 -1.26 -4.76 118.68 121.23 3kcz s LEU 538 Ca 0.44 2.94 -0.01 0.00 -1.03 0.00 0.00 54.13 56.47 3kcz s LEU 538 Cb 0.07 -3.95 0.01 0.00 0.03 0.00 0.00 46.19 42.36 3kcz s LEU 538 CO -0.01 -1.21 0.07 0.61 0.23 0.00 0.00 176.35 176.04 3kcz n GLY 539 N 0.58 -0.92 3.86 -3.19 0.00 -1.25 -4.40 105.19 99.86 3kcz n GLY 539 Ca 0.05 -1.71 -0.30 0.00 0.00 0.00 0.00 46.02 44.06 3kcz n GLY 539 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3kcz s PRO 540 N -3.08 2.77 0.46 1.61 0.04 -1.26 -4.94 135.00 130.60 3kcz s PRO 540 Ca 0.04 0.57 -0.21 0.00 0.04 0.00 0.00 61.00 61.44 3kcz s PRO 540 Cb -0.00 -2.00 -0.09 0.00 0.04 0.00 0.00 34.50 32.45 3kcz s PRO 540 CO 0.03 -1.12 1.03 0.00 0.04 0.00 0.00 177.00 176.98 3kcz s ALA 541 N -3.27 2.94 0.21 8.56 0.00 -1.26 -4.25 121.76 124.69 3kcz s ALA 541 Ca 0.58 0.61 -0.05 0.00 0.00 0.00 0.00 51.96 53.10 3kcz s ALA 541 Cb -0.12 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 19.72 3kcz s ALA 541 CO 0.53 -0.24 0.24 -1.54 0.00 0.00 0.00 175.76 174.75 3kcz s SER 542 N -1.90 0.08 0.34 0.00 1.04 0.37 -4.81 113.70 108.81 3kcz s SER 542 Ca 0.64 -1.24 -0.29 0.00 0.48 0.00 0.00 55.95 55.55 3kcz s SER 542 Cb -0.17 0.44 -0.12 0.00 0.10 0.00 0.00 66.02 66.28 3kcz s SER 542 CO 0.21 -0.93 1.48 -0.67 0.98 0.00 0.00 173.24 174.30 3kcz n ASP 543 N -0.30 3.56 -0.02 7.02 2.03 -1.26 -1.34 116.55 126.24 3kcz n ASP 543 Ca 0.01 1.20 0.06 0.00 0.52 0.00 0.00 54.79 56.57 3kcz n ASP 543 Cb 0.65 -1.58 -0.13 0.00 -0.72 0.00 0.00 41.12 39.34 3kcz n ASP 543 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 3kcz n THR 544 N 0.96 0.19 -1.91 5.18 -2.24 0.32 -4.85 114.28 111.93 3kcz n THR 544 Ca 0.04 -0.43 -0.02 0.00 -2.27 0.00 0.00 64.05 61.37 3kcz n THR 544 Cb 0.37 -0.01 -0.02 0.00 -2.10 0.00 0.00 70.33 68.58 3kcz n THR 544 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kcz n GLY 545 N 1.63 -3.90 2.37 3.38 0.00 -1.26 -5.10 105.19 102.30 3kcz n GLY 545 Ca -0.07 0.45 -0.39 0.00 0.00 0.00 0.00 46.02 46.01 3kcz n GLY 545 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3kcz n TYR 552 N 0.68 0.34 -4.33 1.61 4.01 -1.26 -4.87 117.16 113.34 3kcz n TYR 552 Ca -0.16 0.71 -0.19 0.00 -0.16 0.00 0.00 57.90 58.11 3kcz n TYR 552 Cb 0.25 -1.41 -0.14 0.00 -0.31 0.00 0.00 39.34 37.73 3kcz n TYR 552 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3kcz s THR 553 N -0.09 0.86 0.43 -0.72 -4.23 -1.26 -4.81 115.64 105.82 3kcz s THR 553 Ca 0.59 -0.74 -0.26 0.00 -1.18 0.00 0.00 61.69 60.11 3kcz s THR 553 Cb -0.83 -0.78 -0.09 0.00 1.34 0.00 0.00 72.50 72.14 3kcz s THR 553 CO 0.39 0.04 1.41 -0.76 -0.54 0.00 0.00 174.62 175.16 3kcz s LEU 554 N -0.78 4.18 0.14 4.79 1.43 -1.26 -4.85 118.68 122.32 3kcz s LEU 554 Ca 0.01 2.88 -0.14 0.00 -1.03 0.00 0.00 54.13 55.85 3kcz s LEU 554 Cb -0.06 -3.88 0.00 0.00 0.03 0.00 0.00 46.19 42.28 3kcz s LEU 554 CO 0.00 -1.04 1.61 0.78 0.23 0.00 0.00 176.35 177.93 3kcz h ASN 555 N 2.54 0.75 -4.82 2.29 2.35 -1.93 0.87 115.58 117.63 3kcz h ASN 555 Ca -0.51 -0.28 -0.21 0.00 -0.55 0.00 0.00 56.30 54.75 3kcz h ASN 555 Cb 1.26 -0.20 -0.17 0.00 0.05 0.00 0.00 38.32 39.25 3kcz h ASN 555 CO 0.62 0.85 -0.70 -0.31 -1.65 0.00 0.00 177.43 176.24 3kcz s TYR 556 N -5.10 0.68 0.87 1.19 2.02 -1.26 -1.43 117.35 114.33 3kcz s TYR 556 Ca -0.13 -0.79 -0.12 0.00 -0.37 0.00 0.00 57.07 55.67 3kcz s TYR 556 Cb 0.11 -0.42 0.11 0.00 -0.40 0.00 0.00 41.96 41.35 3kcz s TYR 556 CO 0.80 -0.18 1.09 0.09 -1.57 0.00 0.00 175.55 175.78 3kcz n ASN 557 N 0.59 0.38 -3.82 2.29 3.02 -1.26 -4.14 115.26 112.32 3kcz n ASN 557 Ca -0.17 0.49 -0.12 0.00 -0.03 0.00 0.00 54.58 54.75 3kcz n ASN 557 Cb 0.58 -1.46 -0.09 0.00 -0.61 0.00 0.00 39.78 38.20 3kcz n ASN 557 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 3kcz s GLU 558 N -4.29 0.59 -0.05 3.52 -1.05 -0.69 -4.55 118.70 112.17 3kcz s GLU 558 Ca 0.69 -0.32 0.04 0.00 -0.15 0.00 0.00 54.97 55.23 3kcz s GLU 558 Cb -0.26 0.25 0.00 0.00 -0.44 0.00 0.00 34.13 33.69 3kcz s GLU 558 CO 0.56 -0.15 -0.16 0.71 0.95 0.00 0.00 175.26 177.16 3kcz s TYR 559 N -1.44 1.70 -0.08 4.83 2.02 -0.24 -0.67 117.35 123.46 3kcz s TYR 559 Ca -0.14 -0.53 0.01 0.00 -0.37 0.00 0.00 57.07 56.05 3kcz s TYR 559 Cb -0.06 -1.16 0.02 0.00 -0.40 0.00 0.00 41.96 40.35 3kcz s TYR 559 CO 0.03 -0.20 -0.11 0.42 -1.57 0.00 0.00 175.55 174.11 3kcz s ILE 560 N 0.19 1.14 0.08 2.71 1.09 0.41 -0.74 121.20 126.08 3kcz s ILE 560 Ca -0.07 -0.44 0.06 0.00 -1.10 0.00 0.00 60.65 59.10 3kcz s ILE 560 Cb -0.13 -1.08 -0.04 0.00 -1.06 0.00 0.00 42.46 40.16 3kcz s ILE 560 CO 0.03 0.37 -0.09 0.68 -0.10 0.00 0.00 174.94 175.83 3kcz s VAL 561 N 1.00 3.43 -1.01 2.92 -7.23 -0.93 -1.36 120.40 117.22 3kcz s VAL 561 Ca -0.08 -1.14 0.12 0.00 -1.81 0.00 0.00 61.98 59.07 3kcz s VAL 561 Cb -0.15 -2.57 0.35 0.00 0.56 0.00 0.00 36.38 34.56 3kcz s VAL 561 CO -0.00 0.19 1.29 -1.22 -0.31 0.00 0.00 175.10 175.04 3kcz n TYR 562 N 0.94 0.53 -3.97 2.82 4.01 -1.26 0.18 117.16 120.41 3kcz n TYR 562 Ca -0.14 -0.51 -0.19 0.00 -0.16 0.00 0.00 57.90 56.90 3kcz n TYR 562 Cb 0.52 -0.03 -0.17 0.00 -0.31 0.00 0.00 39.34 39.36 3kcz n TYR 562 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 3kcz s ASN 563 N -1.02 0.87 0.48 7.72 3.84 -1.26 -4.94 114.94 120.63 3kcz s ASN 563 Ca 0.26 -0.07 0.32 0.00 0.21 0.00 0.00 52.86 53.59 3kcz s ASN 563 Cb 0.14 -0.34 1.76 0.00 -0.55 0.00 0.00 41.25 42.26 3kcz s ASN 563 CO 0.17 -0.11 1.99 1.55 -2.79 0.00 0.00 177.10 177.91 3kcz h PRO 564 N 7.50 0.00 0.00 0.43 0.13 -1.90 -1.35 132.00 136.81 3kcz h PRO 564 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 3kcz h PRO 564 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3kcz h PRO 564 CO 0.42 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.46 3kcz n ASN 565 N -2.63 0.00 -1.13 1.44 6.94 -1.26 -1.68 115.26 116.94 3kcz n ASN 565 Ca -0.02 -0.33 0.09 0.00 -0.02 0.00 0.00 54.58 54.30 3kcz n ASN 565 Cb 0.05 -0.14 0.26 0.00 -2.36 0.00 0.00 39.78 37.60 3kcz n ASN 565 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3kcz n GLN 566 N -1.14 2.51 -4.71 -3.83 6.02 -0.51 -0.15 117.38 115.57 3kcz n GLN 566 Ca 0.12 -2.15 -0.26 0.00 -0.01 0.00 0.00 57.00 54.70 3kcz n GLN 566 Cb 0.11 -1.51 -0.17 0.00 1.02 0.00 0.00 30.24 29.69 3kcz n GLN 566 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3kcz s VAL 567 N -1.32 1.36 -0.18 5.09 1.01 -0.67 -1.36 120.40 124.33 3kcz s VAL 567 Ca 0.40 -0.61 -0.00 0.00 0.00 0.00 0.00 61.98 61.77 3kcz s VAL 567 Cb 0.22 -1.22 0.05 0.00 0.00 0.00 0.00 36.38 35.42 3kcz s VAL 567 CO 0.26 0.41 -0.05 -0.60 0.00 0.00 0.00 175.10 175.11 3kcz s ARG 568 N 0.63 1.42 0.31 2.72 3.52 -0.54 -4.86 118.95 122.15 3kcz s ARG 568 Ca -0.15 -0.61 -0.29 0.00 -0.13 0.00 0.00 55.73 54.55 3kcz s ARG 568 Cb -0.16 -2.15 -0.10 0.00 -1.56 0.00 0.00 34.95 30.98 3kcz s ARG 568 CO 0.04 -0.48 1.28 -1.64 -0.81 0.00 0.00 175.30 173.69 3kcz s MET 569 N 1.60 4.41 0.00 5.12 -1.94 -1.26 -0.13 119.30 127.09 3kcz s MET 569 Ca -0.01 2.13 0.00 0.00 -1.71 0.00 0.00 55.69 56.10 3kcz s MET 569 Cb -0.16 -3.11 0.00 0.00 2.01 0.00 0.00 34.83 33.57 3kcz s MET 569 CO -0.07 -0.13 0.00 0.54 -0.01 0.00 0.00 175.02 175.34 3kcz n ARG 570 N 1.11 0.35 -4.04 2.03 5.12 -0.22 -4.59 116.66 116.42 3kcz n ARG 570 Ca 0.01 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.79 3kcz n ARG 570 Cb 0.42 -0.73 -0.13 0.00 -1.16 0.00 0.00 32.46 30.86 3kcz n ARG 570 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 3kcz s TYR 571 N -1.45 0.34 -0.12 -1.55 2.02 -0.70 -0.14 117.35 115.75 3kcz s TYR 571 Ca 0.00 -0.19 0.02 0.00 -0.37 0.00 0.00 57.07 56.53 3kcz s TYR 571 Cb 0.00 -0.22 0.01 0.00 -0.40 0.00 0.00 41.96 41.36 3kcz s TYR 571 CO 0.00 -0.04 -0.17 -1.17 -1.57 0.00 0.00 175.55 172.60 3kcz s LEU 572 N -0.50 1.82 -0.21 -1.29 2.96 0.27 -0.21 118.68 121.51 3kcz s LEU 572 Ca -0.03 -0.48 -0.09 0.00 -0.22 0.00 0.00 54.13 53.31 3kcz s LEU 572 Cb -0.04 -1.20 -0.04 0.00 0.50 0.00 0.00 46.19 45.41 3kcz s LEU 572 CO -0.00 0.02 0.10 -0.76 -1.32 0.00 0.00 176.35 174.39 3kcz s LEU 573 N 1.03 3.90 -0.30 -0.68 1.02 0.73 -0.79 118.68 123.59 3kcz s LEU 573 Ca -0.05 0.07 -0.18 0.00 0.02 0.00 0.00 54.13 53.99 3kcz s LEU 573 Cb -0.15 -2.02 -0.02 0.00 0.02 0.00 0.00 46.19 44.03 3kcz s LEU 573 CO -0.03 0.11 0.53 -0.75 0.02 0.00 0.00 176.35 176.23 3kcz s LYS 574 N 0.77 3.89 -0.03 1.70 2.20 -0.50 -1.39 119.74 126.38 3kcz s LYS 574 Ca 0.05 0.15 0.06 0.00 -0.36 0.00 0.00 55.97 55.87 3kcz s LYS 574 Cb -0.13 -3.72 -0.02 0.00 -1.51 0.00 0.00 37.83 32.45 3kcz s LYS 574 CO 0.02 -0.49 -0.20 0.08 -0.36 0.00 0.00 175.35 174.40 3kcz s VAL 575 N 2.40 2.61 -0.25 4.02 1.01 0.23 -0.67 120.40 129.75 3kcz s VAL 575 Ca 0.21 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 61.16 3kcz s VAL 575 Cb -0.15 -1.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.20 3kcz s VAL 575 CO 0.11 0.57 0.20 -1.58 0.00 0.00 0.00 175.10 174.40 3kcz s GLN 576 N -0.72 4.05 -0.14 2.72 0.74 0.16 -1.60 119.66 124.87 3kcz s GLN 576 Ca 0.11 -0.22 -0.18 0.00 0.05 0.00 0.00 55.36 55.12 3kcz s GLN 576 Cb -0.10 -3.57 -0.04 0.00 1.10 0.00 0.00 33.01 30.40 3kcz s GLN 576 CO 0.00 -0.01 0.47 -0.06 -0.55 0.00 0.00 175.29 175.14 3kcz s PHE 577 N 1.27 3.47 -0.49 1.67 0.08 0.14 -0.35 117.98 123.77 3kcz s PHE 577 Ca 0.09 0.84 -0.10 0.00 0.12 0.00 0.00 56.93 57.88 3kcz s PHE 577 Cb -0.14 -2.56 0.12 0.00 -0.57 0.00 0.00 43.02 39.87 3kcz s PHE 577 CO 0.06 0.11 0.37 -0.80 -0.10 0.00 0.00 175.22 174.87 3kcz s ASN 578 N 0.74 5.77 0.00 1.36 0.01 0.23 -4.85 114.94 118.21 3kcz s ASN 578 Ca 0.25 -1.93 0.27 0.00 -0.71 0.00 0.00 52.86 50.74 3kcz s ASN 578 Cb -0.15 -2.04 0.89 0.00 0.41 0.00 0.00 41.25 40.36 3kcz s ASN 578 CO 0.10 -0.71 1.65 0.49 -1.51 0.00 0.00 177.10 177.12