#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k5v n MET 244 N 0.00 0.15 -3.70 0.00 0.00 -1.26 -3.79 117.12 108.52 3k5v n MET 244 Ca 0.00 0.15 -0.37 0.00 0.00 0.00 0.00 57.70 57.48 3k5v n MET 244 Cb 0.00 -1.68 -0.06 0.00 0.00 0.00 0.00 33.22 31.48 3k5v n MET 244 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 3k5v s ASP 245 N -3.86 6.59 0.54 7.83 1.01 -1.26 -4.99 116.67 122.53 3k5v s ASP 245 Ca 0.11 0.70 0.20 0.00 0.71 0.00 0.00 52.55 54.27 3k5v s ASP 245 Cb 0.14 -2.15 1.42 0.00 1.01 0.00 0.00 42.92 43.34 3k5v s ASP 245 CO 0.54 0.34 2.16 1.55 0.21 0.00 0.00 175.17 179.97 3k5v h PRO 246 N 4.66 0.00 0.00 8.23 0.13 -2.01 -1.29 132.00 141.73 3k5v h PRO 246 Ca -0.53 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.57 3k5v h PRO 246 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 3k5v h PRO 246 CO 0.61 0.00 -0.15 0.66 -0.23 0.00 0.00 178.00 178.89 3k5v h SER 247 N 0.00 0.00 -3.34 1.44 4.64 -1.96 -3.45 113.55 110.88 3k5v h SER 247 Ca 0.02 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.82 3k5v h SER 247 Cb 0.10 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.23 3k5v h SER 247 CO -0.00 0.15 0.72 -0.55 -0.87 0.00 0.00 176.83 176.28 3k5v s SER 248 N -6.23 6.75 0.62 4.97 0.15 -0.49 -4.91 113.70 114.56 3k5v s SER 248 Ca -0.02 2.55 0.40 0.00 0.70 0.00 0.00 55.95 59.58 3k5v s SER 248 Cb 0.13 -2.62 2.17 0.00 -1.71 0.00 0.00 66.02 63.99 3k5v s SER 248 CO 0.60 -0.64 2.22 -0.65 1.20 0.00 0.00 173.24 175.97 3k5v h PRO 249 N 5.30 0.00 -0.57 5.44 0.11 -1.88 -2.25 132.00 138.15 3k5v h PRO 249 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3k5v h PRO 249 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3k5v h PRO 249 CO 0.78 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.66 3k5v n ASN 250 N -2.93 3.08 -4.76 -2.05 3.02 -1.26 -4.99 115.26 105.37 3k5v n ASN 250 Ca -0.03 -2.00 -0.41 0.00 -0.03 0.00 0.00 54.58 52.11 3k5v n ASN 250 Cb 0.10 -0.38 -0.02 0.00 -0.61 0.00 0.00 39.78 38.87 3k5v n ASN 250 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3k5v s TYR 251 N -1.23 2.89 -0.08 3.10 5.04 -0.85 -4.87 117.35 121.34 3k5v s TYR 251 Ca 0.38 1.10 -0.02 0.00 -2.44 0.00 0.00 57.07 56.09 3k5v s TYR 251 Cb 0.20 -3.87 0.04 0.00 0.35 0.00 0.00 41.96 38.67 3k5v s TYR 251 CO 0.26 -2.71 0.05 0.34 -1.34 0.00 0.00 175.55 172.14 3k5v s ASP 252 N 0.08 1.61 0.65 4.32 -1.08 -1.26 -5.03 116.67 115.96 3k5v s ASP 252 Ca 0.56 -0.16 0.42 0.00 -0.52 0.00 0.00 52.55 52.86 3k5v s ASP 252 Cb -0.43 -0.28 2.30 0.00 -1.46 0.00 0.00 42.92 43.04 3k5v s ASP 252 CO 0.51 -0.26 2.34 0.07 0.52 0.00 0.00 175.17 178.35 3k5v h LYS 253 N 8.39 0.00 0.00 4.34 2.10 -1.96 -2.17 116.57 127.27 3k5v h LYS 253 Ca -0.15 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.50 3k5v h LYS 253 Cb 1.13 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.46 3k5v h LYS 253 CO 0.22 0.00 -0.66 -1.49 -2.00 0.00 0.00 179.45 175.52 3k5v h TRP 254 N 0.00 0.00 -2.94 0.07 4.06 -1.95 -3.46 115.95 111.73 3k5v h TRP 254 Ca -0.00 0.00 -0.55 0.00 2.06 0.00 0.00 58.89 60.40 3k5v h TRP 254 Cb 0.03 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.17 3k5v h TRP 254 CO 0.00 0.00 0.82 -1.21 -3.56 0.00 0.00 178.44 174.49 3k5v s GLU 255 N -3.29 4.29 0.35 0.49 0.41 -0.82 -0.56 118.70 119.56 3k5v s GLU 255 Ca 0.03 1.83 0.09 0.00 -0.41 0.00 0.00 54.97 56.50 3k5v s GLU 255 Cb 0.09 -3.64 -0.06 0.00 -1.78 0.00 0.00 34.13 28.74 3k5v s GLU 255 CO 0.74 -0.58 -0.00 0.00 -0.49 0.00 0.00 175.26 174.93 3k5v s MET 256 N 2.69 2.02 -0.17 1.61 0.23 -0.08 -4.89 119.30 120.70 3k5v s MET 256 Ca 0.60 -1.82 -0.29 0.00 -1.03 0.00 0.00 55.69 53.15 3k5v s MET 256 Cb -0.27 -1.86 -0.01 0.00 -1.53 0.00 0.00 34.83 31.16 3k5v s MET 256 CO 0.23 0.11 1.21 -2.00 -2.03 0.00 0.00 175.02 172.53 3k5v s GLU 257 N -3.70 4.25 0.34 3.16 2.56 -1.26 -4.72 118.70 119.33 3k5v s GLU 257 Ca 0.35 1.59 0.06 0.00 0.00 0.00 0.00 54.97 56.97 3k5v s GLU 257 Cb 0.01 -3.72 0.73 0.00 2.00 0.00 0.00 34.13 33.15 3k5v s GLU 257 CO 0.19 -0.67 1.91 -0.09 -0.56 0.00 0.00 175.26 176.04 3k5v h ARG 258 N 7.98 0.77 0.00 4.30 2.43 -1.94 -0.33 114.38 127.58 3k5v h ARG 258 Ca -0.25 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.87 3k5v h ARG 258 Cb 1.10 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.47 3k5v h ARG 258 CO 0.97 0.51 0.00 0.25 -1.51 0.00 0.00 179.97 180.18 3k5v n THR 259 N -4.52 0.90 0.39 0.20 -2.24 -1.26 -1.83 114.28 105.92 3k5v n THR 259 Ca 0.14 0.24 0.13 0.00 -2.27 0.00 0.00 64.05 62.30 3k5v n THR 259 Cb 0.33 -1.11 0.52 0.00 -2.10 0.00 0.00 70.33 67.97 3k5v n THR 259 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3k5v h ASP 260 N 0.00 0.00 -3.33 3.42 3.32 -1.44 -3.43 116.42 114.96 3k5v h ASP 260 Ca 0.00 0.00 -0.65 0.00 0.02 0.00 0.00 57.03 56.40 3k5v h ASP 260 Cb 0.32 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 39.61 3k5v h ASP 260 CO 0.00 0.00 -0.73 -0.63 -1.72 0.00 0.00 179.24 176.16 3k5v s ILE 261 N -3.37 3.33 -0.37 0.35 1.01 -0.76 -0.97 121.20 120.41 3k5v s ILE 261 Ca 0.04 -0.55 -0.17 0.00 0.00 0.00 0.00 60.65 59.97 3k5v s ILE 261 Cb 0.09 -2.44 0.00 0.00 0.01 0.00 0.00 42.46 40.13 3k5v s ILE 261 CO 0.45 0.50 0.46 -0.89 0.00 0.00 0.00 174.94 175.46 3k5v s THR 262 N 0.55 5.07 -0.02 2.92 2.01 0.13 -4.92 115.64 121.38 3k5v s THR 262 Ca -0.06 0.07 -0.30 0.00 0.31 0.00 0.00 61.69 61.71 3k5v s THR 262 Cb -0.15 -3.96 -0.03 0.00 0.01 0.00 0.00 72.50 68.38 3k5v s THR 262 CO 0.03 -0.26 0.98 -0.04 -0.69 0.00 0.00 174.62 174.65 3k5v s MET 263 N 2.25 4.53 0.00 4.92 1.00 -1.26 -1.13 119.30 129.61 3k5v s MET 263 Ca 0.15 1.41 0.00 0.00 0.00 0.00 0.00 55.69 57.25 3k5v s MET 263 Cb -0.16 -3.48 0.00 0.00 0.00 0.00 0.00 34.83 31.19 3k5v s MET 263 CO 0.13 -0.10 0.00 1.63 0.00 0.00 0.00 175.02 176.68 3k5v n LYS 264 N 4.12 3.71 -1.83 2.03 4.76 0.95 -4.99 118.16 126.91 3k5v n LYS 264 Ca 0.06 0.00 -0.29 0.00 -2.87 0.00 0.00 58.31 55.21 3k5v n LYS 264 Cb 0.51 0.00 0.08 0.00 -1.84 0.00 0.00 35.03 33.78 3k5v n LYS 264 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 3k5v s HIS 265 N 3.25 3.02 0.42 2.13 3.76 -1.26 -4.62 115.29 122.00 3k5v s HIS 265 Ca 0.00 0.90 -0.26 0.00 -0.15 0.00 0.00 55.06 55.55 3k5v s HIS 265 Cb 0.00 -3.31 -0.10 0.00 1.11 0.00 0.00 32.58 30.29 3k5v s HIS 265 CO 0.00 -1.64 1.43 1.17 -0.85 0.00 0.00 174.74 174.86 3k5v n LYS 266 N -3.27 2.36 -2.88 1.40 4.81 -1.26 -0.74 118.16 118.58 3k5v n LYS 266 Ca 0.07 0.84 -0.37 0.00 -0.87 0.00 0.00 58.31 57.98 3k5v n LYS 266 Cb 0.59 -2.61 -0.06 0.00 0.02 0.00 0.00 35.03 32.96 3k5v n LYS 266 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 3k5v s LEU 267 N -2.32 4.35 -1.51 3.14 1.43 0.59 -4.33 118.68 120.03 3k5v s LEU 267 Ca 0.58 1.71 -0.12 0.00 -1.03 0.00 0.00 54.13 55.27 3k5v s LEU 267 Cb -0.47 -3.87 0.07 0.00 0.03 0.00 0.00 46.19 41.96 3k5v s LEU 267 CO 0.60 -0.03 0.97 0.61 0.23 0.00 0.00 176.35 178.73 3k5v n GLY 268 N 0.64 -0.48 4.31 -3.19 0.00 -1.26 -2.15 105.19 103.06 3k5v n GLY 268 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3k5v n GLY 268 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k5v n GLY 269 N -1.70 2.05 0.00 -0.02 0.00 -1.26 -2.00 105.19 102.25 3k5v n GLY 269 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3k5v n GLY 269 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k5v n GLY 270 N -1.59 -0.20 0.14 -0.02 0.00 -0.91 -5.03 105.19 97.59 3k5v n GLY 270 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 3k5v n GLY 270 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k5v n GLN 271 N 0.00 0.16 -0.23 1.61 10.64 -0.85 -2.09 117.38 126.62 3k5v n GLN 271 Ca 0.00 0.54 0.06 0.00 -1.83 0.00 0.00 57.00 55.77 3k5v n GLN 271 Cb 0.00 -1.90 0.17 0.00 -0.86 0.00 0.00 30.24 27.65 3k5v n GLN 271 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3k5v n TYR 272 N -2.22 0.56 -2.85 2.61 4.02 -1.26 -4.71 117.16 113.32 3k5v n TYR 272 Ca 0.00 -0.56 0.00 0.00 -0.01 0.00 0.00 57.90 57.33 3k5v n TYR 272 Cb 0.11 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.36 3k5v n TYR 272 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3k5v n GLY 273 N 0.37 1.82 2.37 2.72 0.00 -0.89 -4.02 105.19 107.56 3k5v n GLY 273 Ca 0.13 -0.55 -0.39 0.00 0.00 0.00 0.00 46.02 45.21 3k5v n GLY 273 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3k5v n GLU 274 N 13.03 4.04 -5.13 1.61 -0.58 -1.26 -4.81 120.64 127.54 3k5v n GLU 274 Ca 0.00 -2.67 -0.32 0.00 -0.42 0.00 0.00 57.16 53.75 3k5v n GLU 274 Cb 0.00 -2.74 -0.16 0.00 -0.57 0.00 0.00 31.44 27.97 3k5v n GLU 274 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3k5v s VAL 275 N 0.94 2.25 0.08 2.62 1.01 -1.26 -0.73 120.40 125.32 3k5v s VAL 275 Ca 0.64 -0.95 0.09 0.00 0.00 0.00 0.00 61.98 61.76 3k5v s VAL 275 Cb 0.18 -1.88 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 3k5v s VAL 275 CO -0.07 0.55 -0.24 -0.31 0.00 0.00 0.00 175.10 175.03 3k5v s TYR 276 N 0.35 2.12 0.26 5.22 1.51 0.88 -0.30 117.35 127.38 3k5v s TYR 276 Ca -0.17 -0.40 -0.29 0.00 -1.01 0.00 0.00 57.07 55.20 3k5v s TYR 276 Cb -0.18 -1.21 -0.09 0.00 -0.11 0.00 0.00 41.96 40.37 3k5v s TYR 276 CO 0.08 0.20 1.21 -2.00 -1.11 0.00 0.00 175.55 173.93 3k5v s GLU 277 N -1.60 4.49 0.13 -0.62 2.12 0.08 -0.38 118.70 122.92 3k5v s GLU 277 Ca 0.11 1.97 0.00 0.00 0.36 0.00 0.00 54.97 57.40 3k5v s GLU 277 Cb -0.10 -3.17 -0.04 0.00 0.26 0.00 0.00 34.13 31.08 3k5v s GLU 277 CO 0.04 -0.03 0.02 0.20 -0.54 0.00 0.00 175.26 174.94 3k5v s GLY 278 N -0.34 0.98 -0.12 -1.50 0.00 0.11 -0.03 107.32 106.41 3k5v s GLY 278 Ca 0.50 -1.47 0.02 0.00 0.00 0.00 0.00 44.72 43.77 3k5v s GLY 278 CO 0.42 -1.42 -0.18 0.14 0.00 0.00 0.00 173.10 172.07 3k5v s VAL 279 N -3.88 1.72 -0.70 1.40 1.01 -0.28 -0.36 120.40 119.32 3k5v s VAL 279 Ca 0.21 -0.78 -0.25 0.00 0.00 0.00 0.00 61.98 61.17 3k5v s VAL 279 Cb 0.07 -1.55 0.05 0.00 0.00 0.00 0.00 36.38 34.95 3k5v s VAL 279 CO 0.00 0.48 1.11 0.86 0.00 0.00 0.00 175.10 177.56 3k5v s TRP 280 N 0.93 2.49 0.00 5.22 -0.11 0.41 -0.70 118.94 127.19 3k5v s TRP 280 Ca -0.06 -0.32 0.00 0.00 1.22 0.00 0.00 56.10 56.94 3k5v s TRP 280 Cb -0.15 -4.45 0.00 0.00 -1.50 0.00 0.00 33.47 27.37 3k5v s TRP 280 CO -0.02 -1.84 1.00 1.63 -4.62 0.00 0.00 176.95 173.09 3k5v n LYS 281 N 8.47 0.00 0.12 5.86 5.02 -0.15 -1.64 118.16 135.83 3k5v n LYS 281 Ca -0.01 0.99 0.06 0.00 -2.02 0.00 0.00 58.31 57.34 3k5v n LYS 281 Cb 0.47 -1.50 0.32 0.00 -0.02 0.00 0.00 35.03 34.30 3k5v n LYS 281 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 3k5v n LYS 282 N -2.98 0.08 0.00 1.97 2.85 -1.26 -0.78 118.16 118.03 3k5v n LYS 282 Ca 0.00 0.53 0.03 0.00 -1.05 0.00 0.00 58.31 57.82 3k5v n LYS 282 Cb 0.00 -1.92 -0.01 0.00 -0.65 0.00 0.00 35.03 32.45 3k5v n LYS 282 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3k5v n TYR 283 N -1.91 0.00 -4.12 5.58 0.53 -0.65 -4.99 117.16 111.59 3k5v n TYR 283 Ca -0.01 0.00 -0.32 0.00 -1.02 0.00 0.00 57.90 56.55 3k5v n TYR 283 Cb 0.18 0.00 -0.03 0.00 -1.03 0.00 0.00 39.34 38.47 3k5v n TYR 283 CO 0.00 0.00 0.00 0.43 -1.02 0.00 0.00 176.86 176.27 3k5v n SER 284 N -0.50 -2.10 -4.32 7.72 7.64 0.04 -4.95 113.62 117.15 3k5v n SER 284 Ca 0.02 -1.01 -0.34 0.00 1.01 0.00 0.00 58.87 58.56 3k5v n SER 284 Cb 0.13 -2.87 -0.14 0.00 -1.01 0.00 0.00 64.21 60.32 3k5v n SER 284 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3k5v s LEU 285 N -7.17 2.71 0.21 -3.43 2.96 -1.16 -4.97 118.68 107.84 3k5v s LEU 285 Ca 0.44 -0.38 -0.30 0.00 -0.22 0.00 0.00 54.13 53.67 3k5v s LEU 285 Cb -0.24 -1.64 -0.08 0.00 0.50 0.00 0.00 46.19 44.73 3k5v s LEU 285 CO 0.91 0.09 1.18 -0.89 -1.32 0.00 0.00 176.35 176.32 3k5v s THR 286 N 0.83 3.52 0.20 3.68 2.01 -1.26 -0.44 115.64 124.17 3k5v s THR 286 Ca -0.04 1.33 0.03 0.00 0.31 0.00 0.00 61.69 63.32 3k5v s THR 286 Cb -0.15 -3.85 -0.05 0.00 0.01 0.00 0.00 72.50 68.46 3k5v s THR 286 CO 0.01 0.24 -0.01 0.68 -0.69 0.00 0.00 174.62 174.84 3k5v s VAL 287 N -0.33 0.90 -0.12 3.82 -7.23 0.52 -3.67 120.40 114.29 3k5v s VAL 287 Ca 0.51 -2.02 -0.03 0.00 -1.81 0.00 0.00 61.98 58.63 3k5v s VAL 287 Cb -0.33 -2.20 -0.03 0.00 0.56 0.00 0.00 36.38 34.38 3k5v s VAL 287 CO 0.38 -0.43 -0.01 0.00 -0.31 0.00 0.00 175.10 174.73 3k5v s ALA 288 N -3.51 3.15 -0.21 1.32 0.00 -0.30 -0.72 121.76 121.50 3k5v s ALA 288 Ca 0.25 -0.81 0.01 0.00 0.00 0.00 0.00 51.96 51.41 3k5v s ALA 288 Cb 0.05 -1.54 0.05 0.00 0.00 0.00 0.00 23.12 21.68 3k5v s ALA 288 CO 0.06 0.38 -0.09 0.08 0.00 0.00 0.00 175.76 176.20 3k5v s VAL 289 N -0.21 1.63 -0.03 0.00 1.01 0.49 -0.98 120.40 122.30 3k5v s VAL 289 Ca 0.05 -1.10 -0.17 0.00 0.00 0.00 0.00 61.98 60.76 3k5v s VAL 289 Cb -0.13 -1.77 -0.05 0.00 0.00 0.00 0.00 36.38 34.43 3k5v s VAL 289 CO 0.02 0.08 0.46 -0.75 0.00 0.00 0.00 175.10 174.91 3k5v s LYS 290 N 1.38 4.13 0.31 2.72 2.20 0.17 -0.09 119.74 130.57 3k5v s LYS 290 Ca -0.03 0.48 0.03 0.00 -0.36 0.00 0.00 55.97 56.09 3k5v s LYS 290 Cb -0.17 -3.30 -0.06 0.00 -1.51 0.00 0.00 37.83 32.79 3k5v s LYS 290 CO -0.07 0.48 0.08 0.95 -0.36 0.00 0.00 175.35 176.43 3k5v s THR 291 N -0.45 0.93 0.01 3.43 -4.23 0.09 -0.84 115.64 114.58 3k5v s THR 291 Ca 0.25 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.69 3k5v s THR 291 Cb -0.17 -2.70 -0.05 0.00 1.34 0.00 0.00 72.50 70.93 3k5v s THR 291 CO 0.13 0.00 0.29 -0.76 -0.54 0.00 0.00 174.62 173.75 3k5v s LEU 292 N -3.45 4.38 0.43 4.79 1.43 -1.23 -4.68 118.68 120.34 3k5v s LEU 292 Ca 0.36 0.63 -0.16 0.00 -1.03 0.00 0.00 54.13 53.92 3k5v s LEU 292 Cb 0.08 -2.68 -0.09 0.00 0.03 0.00 0.00 46.19 43.53 3k5v s LEU 292 CO 0.15 0.26 0.88 -1.59 0.23 0.00 0.00 176.35 176.28 3k5v s LYS 293 N -1.67 4.00 -0.00 1.70 -2.85 -1.26 -4.92 119.74 114.73 3k5v s LYS 293 Ca 0.27 0.84 -0.40 0.00 -1.00 0.00 0.00 55.97 55.69 3k5v s LYS 293 Cb -0.14 -2.26 -0.19 0.00 -2.06 0.00 0.00 37.83 33.18 3k5v s LYS 293 CO 0.15 -0.07 1.16 0.39 0.10 0.00 0.00 175.35 177.08 3k5v n GLU 294 N -1.02 0.27 -1.30 1.78 -0.58 -1.26 -5.13 120.64 113.40 3k5v n GLU 294 Ca 0.05 0.10 0.15 0.00 -0.42 0.00 0.00 57.16 57.04 3k5v n GLU 294 Cb 0.54 -1.63 -0.08 0.00 -0.57 0.00 0.00 31.44 29.70 3k5v n GLU 294 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3k5v n ASP 295 N 1.86 -6.67 0.00 1.62 8.00 -1.26 -5.20 116.55 114.90 3k5v n ASP 295 Ca 0.20 1.18 0.07 0.00 0.71 0.00 0.00 54.79 56.95 3k5v n ASP 295 Cb 0.10 -4.42 0.34 0.00 -0.02 0.00 0.00 41.12 37.12 3k5v n ASP 295 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3k5v n MET 297 N -4.12 0.16 0.00 -1.24 2.81 -1.26 -5.07 117.12 108.40 3k5v n MET 297 Ca -0.07 0.18 0.07 0.00 -1.81 0.00 0.00 57.70 56.06 3k5v n MET 297 Cb 0.59 -1.50 0.38 0.00 -0.71 0.00 0.00 33.22 31.98 3k5v n MET 297 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3k5v n GLU 298 N -1.33 0.39 -0.17 0.03 -0.58 -1.26 -3.28 120.64 114.44 3k5v n GLU 298 Ca 0.06 0.02 -0.03 0.00 -0.42 0.00 0.00 57.16 56.79 3k5v n GLU 298 Cb 0.12 -1.50 0.07 0.00 -0.57 0.00 0.00 31.44 29.56 3k5v n GLU 298 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3k5v h VAL 299 N 0.00 0.85 -0.09 2.62 2.07 -1.99 -1.69 116.25 118.02 3k5v h VAL 299 Ca 0.00 -0.13 -0.11 0.00 0.82 0.00 0.00 66.70 67.28 3k5v h VAL 299 Cb 0.01 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 3k5v h VAL 299 CO 0.00 0.07 -0.44 1.05 0.02 0.00 0.00 177.57 178.27 3k5v h GLU 300 N 0.39 0.20 -0.49 1.57 4.11 -1.98 -0.77 114.58 117.61 3k5v h GLU 300 Ca 0.24 -0.10 -0.04 0.00 0.07 0.00 0.00 59.36 59.54 3k5v h GLU 300 Cb 0.25 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 3k5v h GLU 300 CO -0.24 0.61 0.16 0.93 0.07 0.00 0.00 179.01 180.54 3k5v h GLU 301 N 0.17 0.75 -0.26 1.06 4.39 -1.71 0.91 114.58 119.89 3k5v h GLU 301 Ca 0.01 -0.16 -0.00 0.00 0.34 0.00 0.00 59.36 59.55 3k5v h GLU 301 Cb 0.85 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.37 3k5v h GLU 301 CO 0.07 0.70 0.14 0.35 -1.16 0.00 0.00 179.01 179.11 3k5v h PHE 302 N 0.65 0.35 -0.09 4.33 3.57 -1.01 -0.57 116.94 124.17 3k5v h PHE 302 Ca 0.16 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 3k5v h PHE 302 Cb 0.26 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 3k5v h PHE 302 CO 0.01 0.29 -0.31 -0.07 -2.23 0.00 0.00 178.31 176.00 3k5v h LEU 303 N 0.31 0.17 -0.45 0.59 3.38 -1.04 -1.64 115.31 116.63 3k5v h LEU 303 Ca 0.09 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 3k5v h LEU 303 Cb 0.06 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3k5v h LEU 303 CO -0.02 0.48 0.09 0.50 0.09 0.00 0.00 178.44 179.59 3k5v h LYS 304 N 0.15 0.73 -0.20 1.13 1.63 -0.46 -1.35 116.57 118.19 3k5v h LYS 304 Ca 0.02 -0.19 0.00 0.00 -0.85 0.00 0.00 60.65 59.63 3k5v h LYS 304 Cb 0.64 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 32.17 3k5v h LYS 304 CO 0.05 0.75 0.13 1.49 -3.45 0.00 0.00 179.45 178.41 3k5v h GLU 305 N 0.60 0.27 -0.67 1.90 4.81 -0.68 -1.39 114.58 119.42 3k5v h GLU 305 Ca 0.14 -0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.42 3k5v h GLU 305 Cb 0.36 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.62 3k5v h GLU 305 CO 0.01 0.20 0.36 0.00 -0.73 0.00 0.00 179.01 178.84 3k5v h ALA 306 N 1.06 0.91 -0.34 2.92 0.00 -1.18 -1.27 119.26 121.35 3k5v h ALA 306 Ca 0.07 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3k5v h ALA 306 Cb -0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3k5v h ALA 306 CO -0.02 0.01 0.21 0.00 0.00 0.00 0.00 179.25 179.45 3k5v h ALA 307 N 1.37 0.43 -0.30 0.00 0.00 -0.93 -2.33 119.26 117.50 3k5v h ALA 307 Ca 0.31 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.21 3k5v h ALA 307 Cb 0.24 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3k5v h ALA 307 CO -0.21 -0.08 0.11 0.28 0.00 0.00 0.00 179.25 179.35 3k5v h VAL 308 N 0.44 0.93 -0.01 0.00 2.07 -0.93 -2.58 116.25 116.17 3k5v h VAL 308 Ca 0.12 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.54 3k5v h VAL 308 Cb -0.00 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 3k5v h VAL 308 CO -0.02 0.04 -0.08 0.24 0.02 0.00 0.00 177.57 177.77 3k5v h MET 309 N 0.25 0.01 0.00 1.57 2.07 -1.02 0.12 114.93 117.93 3k5v h MET 309 Ca 0.13 -0.00 -0.00 0.00 -2.07 0.00 0.00 59.70 57.76 3k5v h MET 309 Cb 0.09 -0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 29.82 3k5v h MET 309 CO -0.13 0.10 -0.01 0.87 1.07 0.00 0.00 176.91 178.80 3k5v h LYS 310 N 0.01 0.00 -0.01 1.72 1.57 -1.01 -3.01 116.57 115.84 3k5v h LYS 310 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3k5v h LYS 310 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 3k5v h LYS 310 CO 0.01 0.01 -0.42 0.39 -0.57 0.00 0.00 179.45 178.88 3k5v n GLU 311 N -3.14 0.76 -4.87 3.15 -0.58 0.43 -4.93 120.64 111.45 3k5v n GLU 311 Ca -0.01 -0.52 -0.26 0.00 -0.42 0.00 0.00 57.16 55.95 3k5v n GLU 311 Cb 0.21 -1.49 -0.16 0.00 -0.57 0.00 0.00 31.44 29.44 3k5v n GLU 311 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 3k5v s ILE 312 N -2.61 1.45 -0.23 -3.67 -4.36 -1.14 -5.11 121.20 105.53 3k5v s ILE 312 Ca 0.19 -0.77 -0.05 0.00 -0.26 0.00 0.00 60.65 59.77 3k5v s ILE 312 Cb 0.18 -1.21 0.12 0.00 1.25 0.00 0.00 42.46 42.80 3k5v s ILE 312 CO 0.59 0.41 0.42 -0.75 0.24 0.00 0.00 174.94 175.85 3k5v s LYS 313 N -0.30 0.36 -0.12 0.37 2.47 -1.26 -4.85 119.74 116.42 3k5v s LYS 313 Ca 0.04 0.81 -0.25 0.00 -1.56 0.00 0.00 55.97 55.02 3k5v s LYS 313 Cb -0.08 -0.01 0.06 0.00 -1.46 0.00 0.00 37.83 36.34 3k5v s LYS 313 CO 0.00 -0.46 0.60 -1.58 0.16 0.00 0.00 175.35 174.07 3k5v s HIS 314 N 2.61 -0.60 0.63 4.03 2.46 -1.26 -5.04 115.29 118.13 3k5v s HIS 314 Ca 0.07 1.21 0.37 0.00 0.47 0.00 0.00 55.06 57.17 3k5v s HIS 314 Cb -0.14 0.29 2.09 0.00 -0.13 0.00 0.00 32.58 34.69 3k5v s HIS 314 CO -0.15 -0.47 2.28 -1.35 -2.47 0.00 0.00 174.74 172.58 3k5v h PRO 315 N 3.96 0.00 -0.24 2.88 0.11 -1.99 -2.28 132.00 134.45 3k5v h PRO 315 Ca -0.28 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.79 3k5v h PRO 315 Cb 1.16 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 3k5v h PRO 315 CO 0.28 0.00 -0.02 0.09 -0.21 0.00 0.00 178.00 178.14 3k5v n ASN 316 N -3.44 3.31 -4.24 -2.05 4.13 -1.26 -4.87 115.26 106.84 3k5v n ASN 316 Ca -0.02 -3.22 -0.30 0.00 1.68 0.00 0.00 54.58 52.72 3k5v n ASN 316 Cb 0.12 -0.55 -0.16 0.00 -1.54 0.00 0.00 39.78 37.64 3k5v n ASN 316 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3k5v s LEU 317 N -2.94 2.03 0.26 3.41 1.43 -0.86 -0.36 118.68 121.65 3k5v s LEU 317 Ca 0.41 -0.46 -0.31 0.00 -1.03 0.00 0.00 54.13 52.75 3k5v s LEU 317 Cb 0.35 -1.25 -0.13 0.00 0.03 0.00 0.00 46.19 45.18 3k5v s LEU 317 CO 0.06 0.23 1.39 0.55 0.23 0.00 0.00 176.35 178.81 3k5v n VAL 318 N 2.91 1.11 -3.56 -1.59 3.14 -0.75 -4.63 118.33 114.96 3k5v n VAL 318 Ca -0.17 -0.28 -0.37 0.00 -2.96 0.00 0.00 64.34 60.56 3k5v n VAL 318 Cb 0.52 -1.50 -0.09 0.00 -1.06 0.00 0.00 33.84 31.71 3k5v n VAL 318 CO 0.00 0.00 0.00 -1.58 -6.46 0.00 0.00 176.83 168.79 3k5v s GLN 319 N -0.63 4.10 0.20 1.45 2.00 -1.26 -4.99 119.66 120.54 3k5v s GLN 319 Ca 0.66 -0.10 -0.31 0.00 -2.00 0.00 0.00 55.36 53.60 3k5v s GLN 319 Cb -0.63 -3.54 -0.11 0.00 0.80 0.00 0.00 33.01 29.53 3k5v s GLN 319 CO 0.51 0.02 1.60 -1.17 -0.50 0.00 0.00 175.29 175.75 3k5v s LEU 320 N 1.18 4.37 -0.13 3.68 2.96 -1.26 -2.57 118.68 126.90 3k5v s LEU 320 Ca 0.12 2.74 0.12 0.00 -0.22 0.00 0.00 54.13 56.88 3k5v s LEU 320 Cb -0.14 -3.60 -0.17 0.00 0.50 0.00 0.00 46.19 42.78 3k5v s LEU 320 CO 0.06 -0.87 0.04 0.18 -1.32 0.00 0.00 176.35 174.45 3k5v n LEU 321 N 3.61 0.03 0.00 -0.68 4.77 0.38 -4.94 117.00 120.17 3k5v n LEU 321 Ca 0.13 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 3k5v n LEU 321 Cb 0.38 0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.79 3k5v n LEU 321 CO 0.62 0.34 0.00 0.61 -1.33 0.00 0.00 177.39 177.63 3k5v n GLY 322 N 2.16 0.33 3.25 -0.72 0.00 -1.13 -4.99 105.19 104.09 3k5v n GLY 322 Ca -0.22 -0.97 -0.14 0.00 0.00 0.00 0.00 46.02 44.69 3k5v n GLY 322 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k5v s VAL 323 N -2.00 0.79 -0.39 1.61 -7.23 0.27 -1.15 120.40 112.30 3k5v s VAL 323 Ca 0.00 -1.99 0.01 0.00 -1.81 0.00 0.00 61.98 58.19 3k5v s VAL 323 Cb 0.00 -2.06 0.12 0.00 0.56 0.00 0.00 36.38 35.00 3k5v s VAL 323 CO 0.00 -0.54 0.18 0.00 -0.31 0.00 0.00 175.10 174.44 3k5v n THR 325 N 4.01 0.42 0.05 0.00 -2.24 -1.26 -0.54 114.28 114.73 3k5v n THR 325 Ca 0.05 -0.44 -0.13 0.00 -2.27 0.00 0.00 64.05 61.26 3k5v n THR 325 Cb 0.37 0.73 -0.09 0.00 -2.10 0.00 0.00 70.33 69.24 3k5v n THR 325 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 3k5v h ARG 326 N 0.00 -0.15 -4.69 -0.78 3.08 -1.95 -3.46 114.38 106.44 3k5v h ARG 326 Ca 0.00 0.01 -0.29 0.00 0.07 0.00 0.00 59.98 59.77 3k5v h ARG 326 Cb 0.88 0.03 -0.20 0.00 0.08 0.00 0.00 29.97 30.76 3k5v h ARG 326 CO 0.00 0.22 -0.74 -1.21 -1.07 0.00 0.00 179.97 177.17 3k5v s GLU 327 N -4.59 0.61 0.60 0.04 8.01 -1.26 -5.15 118.70 116.96 3k5v s GLU 327 Ca -0.15 -0.86 -0.19 0.00 0.01 0.00 0.00 54.97 53.78 3k5v s GLU 327 Cb 0.02 -0.36 -0.04 0.00 -4.31 0.00 0.00 34.13 29.45 3k5v s GLU 327 CO 0.62 0.06 1.12 -0.35 0.01 0.00 0.00 175.26 176.72 3k5v n PRO 328 N 1.24 1.11 -2.81 0.39 -0.04 -1.26 -4.24 135.00 129.38 3k5v n PRO 328 Ca -0.21 0.43 -0.40 0.00 -0.04 0.00 0.00 63.50 63.27 3k5v n PRO 328 Cb 0.55 -2.33 -0.05 0.00 -0.04 0.00 0.00 33.50 31.63 3k5v n PRO 328 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3k5v s PRO 329 N -2.91 4.66 0.16 0.54 0.04 -1.26 -5.13 135.00 131.09 3k5v s PRO 329 Ca 0.76 1.34 -0.30 0.00 0.04 0.00 0.00 61.00 62.84 3k5v s PRO 329 Cb -0.41 -3.35 -0.07 0.00 0.04 0.00 0.00 34.50 30.70 3k5v s PRO 329 CO 0.46 0.31 1.12 -0.06 0.04 0.00 0.00 177.00 178.87 3k5v s PHE 330 N -0.28 3.55 0.03 0.56 2.99 -1.26 -4.86 117.98 118.71 3k5v s PHE 330 Ca 0.43 1.54 0.09 0.00 0.00 0.00 0.00 56.93 58.99 3k5v s PHE 330 Cb -0.23 -3.31 -0.03 0.00 0.00 0.00 0.00 43.02 39.45 3k5v s PHE 330 CO 0.28 -0.76 -0.25 0.71 -0.00 0.00 0.00 175.22 175.20 3k5v s TYR 331 N 0.01 2.24 -0.15 0.36 4.12 0.30 -3.58 117.35 120.65 3k5v s TYR 331 Ca 0.51 -0.41 0.02 0.00 0.02 0.00 0.00 57.07 57.21 3k5v s TYR 331 Cb -0.30 -1.36 0.01 0.00 -1.52 0.00 0.00 41.96 38.80 3k5v s TYR 331 CO 0.34 0.09 -0.21 0.42 0.02 0.00 0.00 175.55 176.22 3k5v s ILE 332 N -0.77 2.01 -0.19 2.71 1.01 -0.02 -1.12 121.20 124.84 3k5v s ILE 332 Ca 0.11 -0.94 -0.03 0.00 0.00 0.00 0.00 60.65 59.79 3k5v s ILE 332 Cb -0.10 -1.79 -0.02 0.00 0.01 0.00 0.00 42.46 40.57 3k5v s ILE 332 CO 0.02 0.54 -0.05 -0.63 0.00 0.00 0.00 174.94 174.81 3k5v s ILE 333 N 0.95 3.53 0.39 2.92 1.01 -0.30 -0.66 121.20 129.04 3k5v s ILE 333 Ca -0.04 -0.46 0.07 0.00 0.00 0.00 0.00 60.65 60.22 3k5v s ILE 333 Cb -0.15 -2.57 -0.08 0.00 0.01 0.00 0.00 42.46 39.68 3k5v s ILE 333 CO -0.05 0.46 0.00 0.42 0.00 0.00 0.00 174.94 175.77 3k5v s THR 334 N 0.96 1.92 0.75 2.92 -4.23 -0.15 -0.47 115.64 117.34 3k5v s THR 334 Ca -0.00 -2.03 -0.15 0.00 -1.18 0.00 0.00 61.69 58.33 3k5v s THR 334 Cb -0.15 -2.92 0.04 0.00 1.34 0.00 0.00 72.50 70.82 3k5v s THR 334 CO 0.01 -0.03 1.13 -1.84 -0.54 0.00 0.00 174.62 173.35 3k5v n GLU 335 N -0.90 0.45 -3.82 3.99 0.28 -1.06 -1.15 120.64 118.42 3k5v n GLU 335 Ca -0.05 0.22 -0.36 0.00 -0.16 0.00 0.00 57.16 56.81 3k5v n GLU 335 Cb 0.66 -2.38 -0.07 0.00 1.43 0.00 0.00 31.44 31.09 3k5v n GLU 335 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 3k5v s PHE 336 N -1.89 3.52 -0.28 -1.84 5.36 -1.24 -4.10 117.98 117.51 3k5v s PHE 336 Ca 0.75 0.45 -0.06 0.00 -0.96 0.00 0.00 56.93 57.10 3k5v s PHE 336 Cb -0.32 -2.03 0.01 0.00 -0.34 0.00 0.00 43.02 40.33 3k5v s PHE 336 CO 0.49 0.55 0.06 -1.64 -1.46 0.00 0.00 175.22 173.22 3k5v s MET 337 N -0.46 3.14 0.26 10.12 -1.94 -1.26 -4.97 119.30 124.18 3k5v s MET 337 Ca 0.12 -0.82 -0.04 0.00 -1.71 0.00 0.00 55.69 53.25 3k5v s MET 337 Cb -0.12 -3.31 0.52 0.00 2.01 0.00 0.00 34.83 33.94 3k5v s MET 337 CO 0.02 -0.40 1.66 1.15 -0.01 0.00 0.00 175.02 177.43 3k5v h THR 338 N 5.85 0.40 -0.33 2.05 2.02 -1.90 -2.17 112.91 118.83 3k5v h THR 338 Ca -0.33 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 66.78 3k5v h THR 338 Cb 1.13 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 3k5v h THR 338 CO 0.60 0.04 0.00 -1.22 0.37 0.00 0.00 175.52 175.30 3k5v n TYR 339 N -5.24 0.42 -4.27 3.16 4.02 0.03 -5.03 117.16 110.26 3k5v n TYR 339 Ca 0.16 -0.21 0.00 0.00 -0.01 0.00 0.00 57.90 57.84 3k5v n TYR 339 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.84 3k5v n TYR 339 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3k5v n GLY 340 N 1.35 -0.69 3.78 2.72 0.00 -0.82 -4.69 105.19 106.83 3k5v n GLY 340 Ca 0.18 -1.14 -0.36 0.00 0.00 0.00 0.00 46.02 44.69 3k5v n GLY 340 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k5v s ASN 341 N -4.00 6.35 0.30 1.61 2.20 -1.26 -1.02 114.94 119.12 3k5v s ASN 341 Ca 0.00 2.15 0.02 0.00 -0.94 0.00 0.00 52.86 54.09 3k5v s ASN 341 Cb 0.00 -2.59 0.47 0.00 -2.00 0.00 0.00 41.25 37.13 3k5v s ASN 341 CO 0.00 -0.78 1.78 0.25 -2.94 0.00 0.00 177.10 175.41 3k5v h LEU 342 N 2.06 0.53 -0.03 3.54 5.85 -0.88 -1.73 115.31 124.64 3k5v h LEU 342 Ca -0.49 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.09 3k5v h LEU 342 Cb 1.23 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 42.12 3k5v h LEU 342 CO 0.60 0.68 0.02 0.25 -0.34 0.00 0.00 178.44 179.65 3k5v h LEU 343 N 0.50 0.04 -0.61 2.25 5.85 -1.77 0.76 115.31 122.33 3k5v h LEU 343 Ca 0.09 -0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.64 3k5v h LEU 343 Cb 0.52 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 3k5v h LEU 343 CO 0.03 0.15 0.20 0.44 -0.34 0.00 0.00 178.44 178.92 3k5v h ASP 344 N -0.07 0.89 -0.33 1.25 3.32 -1.88 -2.28 116.42 117.31 3k5v h ASP 344 Ca 0.01 -0.20 0.06 0.00 0.02 0.00 0.00 57.03 56.92 3k5v h ASP 344 Cb 0.12 -0.23 -0.06 0.00 0.22 0.00 0.00 39.33 39.38 3k5v h ASP 344 CO -0.00 0.85 -0.03 0.22 -1.72 0.00 0.00 179.24 178.56 3k5v h TYR 345 N 0.87 -0.08 -0.91 4.55 3.20 -1.13 -0.45 116.97 123.02 3k5v h TYR 345 Ca 0.20 0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.15 3k5v h TYR 345 Cb 0.28 0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.58 3k5v h TYR 345 CO 0.02 -0.10 0.59 -0.07 -1.64 0.00 0.00 178.16 176.97 3k5v h LEU 346 N 0.05 0.94 -0.43 2.82 3.38 -0.63 -0.52 115.31 120.93 3k5v h LEU 346 Ca 0.16 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.04 3k5v h LEU 346 Cb 0.23 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3k5v h LEU 346 CO -0.30 0.61 -0.45 0.03 0.09 0.00 0.00 178.44 178.42 3k5v h ARG 347 N 1.07 0.00 -0.00 1.13 3.08 -0.75 -3.30 114.38 115.60 3k5v h ARG 347 Ca 0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.43 3k5v h ARG 347 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.19 3k5v h ARG 347 CO -0.14 0.45 -0.62 0.39 -1.07 0.00 0.00 179.97 178.99 3k5v n GLU 348 N -3.35 2.30 -2.26 0.04 1.02 -0.26 -5.03 120.64 113.10 3k5v n GLU 348 Ca 0.01 -0.10 -0.35 0.00 -0.02 0.00 0.00 57.16 56.71 3k5v n GLU 348 Cb 0.64 -1.17 -0.00 0.00 -0.02 0.00 0.00 31.44 30.89 3k5v n GLU 348 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3k5v s ASN 350 N -1.87 6.74 0.46 0.00 3.84 -1.26 -4.93 114.94 117.91 3k5v s ASN 350 Ca 0.71 2.15 0.25 0.00 0.21 0.00 0.00 52.86 56.18 3k5v s ASN 350 Cb -0.22 -2.54 0.53 0.00 -0.55 0.00 0.00 41.25 38.46 3k5v s ASN 350 CO 0.27 -0.86 1.68 0.03 -2.79 0.00 0.00 177.10 175.43 3k5v h ARG 351 N 8.90 0.00 -0.55 0.43 3.08 -1.94 -1.40 114.38 122.90 3k5v h ARG 351 Ca -0.37 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.64 3k5v h ARG 351 Cb 1.17 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.19 3k5v h ARG 351 CO 0.94 0.00 0.21 0.37 -1.07 0.00 0.00 179.97 180.43 3k5v h GLN 352 N 0.00 0.83 0.35 0.04 4.15 -2.01 -3.25 115.11 115.22 3k5v h GLN 352 Ca -0.00 -0.15 -0.02 0.00 0.77 0.00 0.00 58.65 59.25 3k5v h GLN 352 Cb 0.91 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.47 3k5v h GLN 352 CO 0.00 0.72 -0.17 1.49 -1.93 0.00 0.00 178.83 178.95 3k5v h GLU 353 N 0.75 -0.45 -4.23 1.69 4.81 -1.90 -3.36 114.58 111.89 3k5v h GLU 353 Ca 0.18 0.03 -0.74 0.00 -0.13 0.00 0.00 59.36 58.70 3k5v h GLU 353 Cb 0.21 0.10 -0.15 0.00 0.63 0.00 0.00 28.75 29.54 3k5v h GLU 353 CO -0.01 -0.13 1.83 0.28 -0.73 0.00 0.00 179.01 180.25 3k5v n VAL 354 N -5.13 4.22 -2.10 0.32 0.31 -0.56 -4.80 118.33 110.60 3k5v n VAL 354 Ca -0.09 -4.43 -0.28 0.00 -0.01 0.00 0.00 64.34 59.53 3k5v n VAL 354 Cb 0.27 -2.42 0.18 0.00 -0.91 0.00 0.00 33.84 30.96 3k5v n VAL 354 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3k5v s SER 355 N 2.08 3.28 0.41 4.52 1.04 -1.23 -4.72 113.70 119.08 3k5v s SER 355 Ca 0.42 0.05 0.17 0.00 0.48 0.00 0.00 55.95 57.08 3k5v s SER 355 Cb 0.04 -0.12 1.07 0.00 0.10 0.00 0.00 66.02 67.11 3k5v s SER 355 CO 0.00 -2.61 1.83 0.00 0.98 0.00 0.00 173.24 173.45 3k5v h ALA 356 N -1.43 2.19 -0.34 5.32 0.00 -1.92 -0.33 119.26 122.75 3k5v h ALA 356 Ca -0.42 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.43 3k5v h ALA 356 Cb 1.23 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 3k5v h ALA 356 CO 0.36 -0.51 -0.12 0.28 0.00 0.00 0.00 179.25 179.26 3k5v h VAL 357 N 0.42 1.28 -0.44 0.00 2.07 -1.93 -0.83 116.25 116.82 3k5v h VAL 357 Ca 0.51 -1.21 -0.07 0.00 0.82 0.00 0.00 66.70 66.75 3k5v h VAL 357 Cb 1.24 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 32.36 3k5v h VAL 357 CO -0.21 0.39 0.02 0.58 0.02 0.00 0.00 177.57 178.37 3k5v h VAL 358 N 0.46 1.26 -0.66 2.57 2.07 -1.61 -1.72 116.25 118.61 3k5v h VAL 358 Ca 0.08 -1.01 0.03 0.00 0.82 0.00 0.00 66.70 66.63 3k5v h VAL 358 Cb 0.64 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 3k5v h VAL 358 CO 0.04 0.35 0.40 -0.07 0.02 0.00 0.00 177.57 178.31 3k5v h LEU 359 N 0.62 0.64 -0.53 2.57 3.38 -0.95 -0.58 115.31 120.46 3k5v h LEU 359 Ca 0.13 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.13 3k5v h LEU 359 Cb 0.47 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.05 3k5v h LEU 359 CO 0.02 0.44 0.32 0.25 0.09 0.00 0.00 178.44 179.56 3k5v h LEU 360 N 0.78 0.51 -1.04 1.67 5.85 -1.04 -1.08 115.31 120.96 3k5v h LEU 360 Ca 0.27 0.01 0.03 0.00 0.84 0.00 0.00 57.88 59.02 3k5v h LEU 360 Cb 0.05 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 40.92 3k5v h LEU 360 CO -0.12 0.36 0.64 0.22 -0.34 0.00 0.00 178.44 179.21 3k5v h TYR 361 N 0.63 1.21 -0.24 1.25 3.20 -0.71 -0.50 116.97 121.82 3k5v h TYR 361 Ca 0.22 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.08 3k5v h TYR 361 Cb 0.03 -0.41 -0.01 0.00 1.54 0.00 0.00 36.73 37.88 3k5v h TYR 361 CO -0.06 0.72 -0.01 0.52 -1.64 0.00 0.00 178.16 177.69 3k5v h MET 362 N 1.27 0.42 -0.60 1.82 2.86 -0.62 -1.58 114.93 118.50 3k5v h MET 362 Ca 0.38 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 3k5v h MET 362 Cb -0.05 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.54 3k5v h MET 362 CO -0.10 0.61 0.39 0.00 1.06 0.00 0.00 176.91 178.86 3k5v h ALA 363 N 0.80 0.77 -0.38 6.32 0.00 -0.93 -2.28 119.26 123.56 3k5v h ALA 363 Ca 0.07 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.96 3k5v h ALA 363 Cb 0.42 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3k5v h ALA 363 CO 0.01 0.22 0.18 1.15 0.00 0.00 0.00 179.25 180.80 3k5v h THR 364 N 0.82 0.96 -0.76 0.00 2.02 -0.96 -1.18 112.91 113.80 3k5v h THR 364 Ca 0.22 -0.12 0.01 0.00 0.77 0.00 0.00 66.41 67.29 3k5v h THR 364 Cb -0.07 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 66.86 3k5v h THR 364 CO -0.05 0.07 0.50 1.56 0.37 0.00 0.00 175.52 177.97 3k5v h GLN 365 N 0.36 0.98 -0.63 6.66 4.20 -1.05 -1.23 115.11 124.40 3k5v h GLN 365 Ca 0.16 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.75 3k5v h GLN 365 Cb 0.09 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 27.62 3k5v h GLN 365 CO -0.13 0.65 0.15 0.82 -0.67 0.00 0.00 178.83 179.65 3k5v h ILE 366 N 1.01 1.26 -0.25 2.54 2.04 -1.19 -2.13 117.51 120.78 3k5v h ILE 366 Ca 0.28 -0.94 -0.05 0.00 1.00 0.00 0.00 64.86 65.15 3k5v h ILE 366 Cb -0.09 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 3k5v h ILE 366 CO -0.07 0.35 -0.08 0.77 0.00 0.00 0.00 178.15 179.12 3k5v h SER 367 N 0.93 0.38 -0.09 1.72 4.64 -0.75 -1.59 113.55 118.79 3k5v h SER 367 Ca 0.20 -0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 61.44 3k5v h SER 367 Cb 0.37 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.35 3k5v h SER 367 CO 0.00 0.50 0.05 0.28 -0.87 0.00 0.00 176.83 176.80 3k5v h SER 368 N 0.38 0.11 -0.59 4.97 0.02 -0.74 0.66 113.55 118.37 3k5v h SER 368 Ca 0.08 -0.05 0.05 0.00 -0.84 0.00 0.00 61.79 61.03 3k5v h SER 368 Cb 0.38 -0.03 -0.05 0.00 0.14 0.00 0.00 62.40 62.84 3k5v h SER 368 CO 0.02 0.13 0.32 0.00 -1.14 0.00 0.00 176.83 176.16 3k5v h ALA 369 N 0.99 0.77 -0.08 3.77 0.00 -1.03 -1.57 119.26 122.11 3k5v h ALA 369 Ca 0.03 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 3k5v h ALA 369 Cb 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3k5v h ALA 369 CO -0.01 -0.00 -0.62 0.52 0.00 0.00 0.00 179.25 179.14 3k5v h MET 370 N 0.61 0.28 -0.73 0.00 2.86 -1.06 -1.06 114.93 115.83 3k5v h MET 370 Ca 0.26 -0.20 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 3k5v h MET 370 Cb 0.13 0.03 -0.04 0.00 0.06 0.00 0.00 31.60 31.79 3k5v h MET 370 CO -0.16 0.82 0.48 1.49 1.06 0.00 0.00 176.91 180.60 3k5v h GLU 371 N 0.21 0.97 0.08 1.72 4.81 -0.60 0.11 114.58 121.89 3k5v h GLU 371 Ca -0.01 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.15 3k5v h GLU 371 Cb 1.14 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.31 3k5v h GLU 371 CO 0.10 0.65 -0.04 -0.92 -0.73 0.00 0.00 179.01 178.07 3k5v h TYR 372 N 1.00 -0.10 -0.90 0.92 3.20 -0.93 -0.22 116.97 119.93 3k5v h TYR 372 Ca 0.27 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.20 3k5v h TYR 372 Cb -0.10 0.03 -0.07 0.00 1.54 0.00 0.00 36.73 38.14 3k5v h TYR 372 CO -0.02 -0.02 0.56 -0.07 -1.64 0.00 0.00 178.16 176.98 3k5v h LEU 373 N -0.15 0.88 -0.10 2.82 3.38 -0.95 -1.01 115.31 120.18 3k5v h LEU 373 Ca -0.01 0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.98 3k5v h LEU 373 Cb 0.13 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 3k5v h LEU 373 CO 0.02 0.55 0.04 -0.08 0.09 0.00 0.00 178.44 179.06 3k5v h GLU 374 N 1.01 0.10 -0.82 1.13 4.81 -0.59 -0.27 114.58 119.95 3k5v h GLU 374 Ca 0.40 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.65 3k5v h GLU 374 Cb 0.21 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.52 3k5v h GLU 374 CO -0.19 0.06 0.54 -0.22 -0.73 0.00 0.00 179.01 178.48 3k5v h LYS 375 N 0.10 1.03 -0.03 1.92 3.64 -0.51 -2.26 116.57 120.47 3k5v h LYS 375 Ca 0.04 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3k5v h LYS 375 Cb 0.01 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.60 3k5v h LYS 375 CO -0.03 0.68 0.00 1.63 -2.27 0.00 0.00 179.45 179.46 3k5v n LYS 376 N -4.43 1.26 -3.00 1.90 4.76 -0.43 -4.92 118.16 113.31 3k5v n LYS 376 Ca 0.10 -0.38 -0.18 0.00 -2.87 0.00 0.00 58.31 54.97 3k5v n LYS 376 Cb 0.07 -1.42 0.04 0.00 -1.84 0.00 0.00 35.03 31.87 3k5v n LYS 376 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3k5v n ASN 377 N -0.48 -5.31 -4.88 4.39 3.02 -0.85 -5.03 115.26 106.12 3k5v n ASN 377 Ca 0.19 -0.28 -0.23 0.00 -0.03 0.00 0.00 54.58 54.23 3k5v n ASN 377 Cb 0.19 -4.09 -0.04 0.00 -0.61 0.00 0.00 39.78 35.23 3k5v n ASN 377 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3k5v s PHE 378 N -3.10 3.27 0.11 3.10 0.40 -0.16 -5.04 117.98 116.56 3k5v s PHE 378 Ca 0.30 -0.04 0.09 0.00 -0.60 0.00 0.00 56.93 56.68 3k5v s PHE 378 Cb -0.13 -1.50 -0.04 0.00 0.51 0.00 0.00 43.02 41.86 3k5v s PHE 378 CO 0.37 0.49 -0.22 0.96 0.70 0.00 0.00 175.22 177.53 3k5v s ILE 379 N -1.98 1.83 -0.13 0.64 -4.36 -1.26 -4.23 121.20 111.71 3k5v s ILE 379 Ca 0.33 -1.63 -0.14 0.00 -0.26 0.00 0.00 60.65 58.95 3k5v s ILE 379 Cb -0.09 -1.67 -0.12 0.00 1.25 0.00 0.00 42.46 41.83 3k5v s ILE 379 CO 0.26 -0.06 0.31 -0.74 0.24 0.00 0.00 174.94 174.95 3k5v h HIS 380 N 3.94 0.00 0.00 1.37 -0.00 -1.96 -3.49 115.15 115.01 3k5v h HIS 380 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.90 3k5v h HIS 380 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.59 3k5v h HIS 380 CO 0.62 0.52 0.00 0.54 -0.00 0.00 0.00 177.93 179.61 3k5v n ARG 381 N -4.67 0.00 -2.77 5.26 1.74 -1.26 -4.82 116.66 110.13 3k5v n ARG 381 Ca -0.07 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.91 3k5v n ARG 381 Cb 0.27 -0.67 0.06 0.00 -1.02 0.00 0.00 32.46 31.10 3k5v n ARG 381 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3k5v n ASP 382 N 0.00 -0.40 -4.72 0.55 2.03 -1.26 -5.06 116.55 107.69 3k5v n ASP 382 Ca 0.00 -2.84 -0.42 0.00 0.52 0.00 0.00 54.79 52.06 3k5v n ASP 382 Cb 0.00 0.38 -0.03 0.00 -0.72 0.00 0.00 41.12 40.74 3k5v n ASP 382 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 3k5v s LEU 383 N -2.89 4.41 -0.20 -2.67 2.96 -1.26 -4.79 118.68 114.23 3k5v s LEU 383 Ca 0.27 2.11 -0.36 0.00 -0.22 0.00 0.00 54.13 55.93 3k5v s LEU 383 Cb 0.39 -3.59 0.14 0.00 0.50 0.00 0.00 46.19 43.64 3k5v s LEU 383 CO -0.04 -0.41 1.28 0.00 -1.32 0.00 0.00 176.35 175.86 3k5v s ALA 384 N 0.52 -2.14 0.47 5.97 0.00 -1.26 -4.73 121.76 120.59 3k5v s ALA 384 Ca 0.56 1.60 0.15 0.00 0.00 0.00 0.00 51.96 54.26 3k5v s ALA 384 Cb -0.31 -0.15 1.12 0.00 0.00 0.00 0.00 23.12 23.78 3k5v s ALA 384 CO 0.32 -0.63 2.06 0.00 0.00 0.00 0.00 175.76 177.51 3k5v h ALA 385 N 2.00 2.01 0.00 0.00 0.00 -1.94 -1.50 119.26 119.83 3k5v h ALA 385 Ca -0.09 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3k5v h ALA 385 Cb 1.16 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 3k5v h ALA 385 CO 0.22 -0.07 -0.02 0.07 0.00 0.00 0.00 179.25 179.45 3k5v h ARG 386 N 0.25 0.00 -0.54 0.00 0.11 -1.96 -1.92 114.38 110.32 3k5v h ARG 386 Ca 0.15 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.20 3k5v h ARG 386 Cb 0.28 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.34 3k5v h ARG 386 CO -0.03 0.02 0.04 0.09 0.10 0.00 0.00 179.97 180.19 3k5v n ASN 387 N -3.18 5.27 -4.40 0.08 3.02 -0.57 -4.80 115.26 110.68 3k5v n ASN 387 Ca -0.01 -3.00 -0.25 0.00 -0.03 0.00 0.00 54.58 51.29 3k5v n ASN 387 Cb 0.20 -0.67 -0.11 0.00 -0.61 0.00 0.00 39.78 38.59 3k5v n ASN 387 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k5v s LEU 389 N -2.80 2.47 -0.09 0.00 1.43 0.11 -0.68 118.68 119.12 3k5v s LEU 389 Ca 0.21 -0.90 0.03 0.00 -1.03 0.00 0.00 54.13 52.44 3k5v s LEU 389 Cb -0.07 -1.06 0.01 0.00 0.03 0.00 0.00 46.19 45.10 3k5v s LEU 389 CO 0.10 0.06 -0.18 -0.69 0.23 0.00 0.00 176.35 175.87 3k5v s VAL 390 N -1.94 1.59 0.00 -1.59 1.01 -0.19 -1.32 120.40 117.95 3k5v s VAL 390 Ca 0.21 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.45 3k5v s VAL 390 Cb -0.07 -1.40 0.00 0.00 0.00 0.00 0.00 36.38 34.91 3k5v s VAL 390 CO 0.10 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.26 3k5v n GLY 391 N 3.72 6.97 3.77 4.51 0.00 -0.07 -0.79 105.19 123.29 3k5v n GLY 391 Ca -0.21 -2.00 -0.40 0.00 0.00 0.00 0.00 46.02 43.42 3k5v n GLY 391 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k5v s GLU 392 N 1.32 3.74 -1.38 1.61 8.01 -1.26 -3.30 118.70 127.45 3k5v s GLU 392 Ca 0.00 2.38 -0.05 0.00 0.01 0.00 0.00 54.97 57.31 3k5v s GLU 392 Cb 0.00 -2.68 0.01 0.00 -4.31 0.00 0.00 34.13 27.15 3k5v s GLU 392 CO 0.00 -0.76 0.66 0.09 0.01 0.00 0.00 175.26 175.26 3k5v n ASN 393 N -0.12 -5.77 -2.02 -0.19 3.02 -1.26 -2.27 115.26 106.64 3k5v n ASN 393 Ca 0.05 -0.31 -0.20 0.00 -0.03 0.00 0.00 54.58 54.09 3k5v n ASN 393 Cb 0.42 -4.56 -0.04 0.00 -0.61 0.00 0.00 39.78 35.00 3k5v n ASN 393 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3k5v n HIS 394 N -4.48 -0.62 -1.92 3.10 8.25 -1.21 -4.96 115.22 113.39 3k5v n HIS 394 Ca -0.08 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 56.96 3k5v n HIS 394 Cb 0.60 -3.68 -0.02 0.00 1.12 0.00 0.00 29.99 28.01 3k5v n HIS 394 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3k5v s LEU 395 N -5.33 4.37 -0.03 2.41 2.96 -0.96 -4.74 118.68 117.35 3k5v s LEU 395 Ca 0.00 2.77 0.05 0.00 -0.22 0.00 0.00 54.13 56.73 3k5v s LEU 395 Cb 0.00 -3.63 -0.01 0.00 0.50 0.00 0.00 46.19 43.06 3k5v s LEU 395 CO 0.00 -0.79 -0.18 -0.69 -1.32 0.00 0.00 176.35 173.37 3k5v s VAL 396 N 0.07 1.46 -0.02 1.68 1.01 -1.26 -0.90 120.40 122.45 3k5v s VAL 396 Ca 0.61 -0.75 0.05 0.00 0.00 0.00 0.00 61.98 61.89 3k5v s VAL 396 Cb -0.44 -1.24 -0.01 0.00 0.00 0.00 0.00 36.38 34.68 3k5v s VAL 396 CO 0.44 0.42 -0.17 -0.54 0.00 0.00 0.00 175.10 175.25 3k5v s LYS 397 N -0.12 1.39 0.13 2.72 1.02 -0.43 -4.62 119.74 119.83 3k5v s LYS 397 Ca -0.00 -0.60 -0.28 0.00 0.02 0.00 0.00 55.97 55.11 3k5v s LYS 397 Cb -0.10 -1.33 -0.07 0.00 -0.52 0.00 0.00 37.83 35.81 3k5v s LYS 397 CO 0.01 0.35 0.88 0.08 -0.92 0.00 0.00 175.35 175.75 3k5v s VAL 398 N -0.35 4.44 0.39 3.17 1.01 0.52 -0.71 120.40 128.87 3k5v s VAL 398 Ca 0.06 1.91 0.03 0.00 0.00 0.00 0.00 61.98 63.98 3k5v s VAL 398 Cb -0.07 -4.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.05 3k5v s VAL 398 CO -0.00 0.40 0.12 0.00 0.00 0.00 0.00 175.10 175.61 3k5v n ALA 399 N 2.33 0.51 -3.38 5.51 0.00 0.36 -1.81 120.51 124.02 3k5v n ALA 399 Ca -0.01 -1.95 -0.14 0.00 0.00 0.00 0.00 53.44 51.34 3k5v n ALA 399 Cb 0.49 1.27 -0.09 0.00 0.00 0.00 0.00 19.45 21.12 3k5v n ALA 399 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3k5v s ASP 400 N -3.36 1.13 0.00 0.00 2.15 -1.26 -4.74 116.67 110.59 3k5v s ASP 400 Ca 0.16 -0.44 0.27 0.00 0.43 0.00 0.00 52.55 52.97 3k5v s ASP 400 Cb 0.01 0.72 0.78 0.00 -0.30 0.00 0.00 42.92 44.12 3k5v s ASP 400 CO 0.12 -0.36 1.58 0.49 -0.17 0.00 0.00 175.17 176.83 3k5v n PHE 401 N 5.33 0.00 -3.14 -5.34 0.99 -1.26 -4.96 117.46 109.09 3k5v n PHE 401 Ca -0.02 0.00 -0.14 0.00 -0.00 0.00 0.00 57.45 57.29 3k5v n PHE 401 Cb 0.48 -0.10 0.07 0.00 -1.00 0.00 0.00 39.48 38.93 3k5v n PHE 401 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3k5v n GLY 402 N 1.32 -0.42 0.20 1.37 0.00 -1.26 -4.93 105.19 101.47 3k5v n GLY 402 Ca 0.13 0.14 0.10 0.00 0.00 0.00 0.00 46.02 46.40 3k5v n GLY 402 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3k5v h LEU 403 N -1.40 0.00 -1.19 0.99 3.38 -1.96 -3.40 115.31 111.73 3k5v h LEU 403 Ca -0.50 0.00 0.18 0.00 0.09 0.00 0.00 57.88 57.64 3k5v h LEU 403 Cb 1.28 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.94 3k5v h LEU 403 CO 0.41 0.08 0.61 0.77 0.09 0.00 0.00 178.44 180.40 3k5v h SER 404 N 0.00 0.69 -0.38 -0.43 4.64 -1.91 0.11 113.55 116.26 3k5v h SER 404 Ca -0.00 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3k5v h SER 404 Cb 1.06 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 3k5v h SER 404 CO 0.01 0.29 0.00 0.54 -0.87 0.00 0.00 176.83 176.80 3k5v n ARG 405 N -4.64 3.13 -0.06 4.77 1.74 -1.26 -4.58 116.66 115.76 3k5v n ARG 405 Ca 0.21 -2.57 -0.11 0.00 -0.77 0.00 0.00 57.85 54.61 3k5v n ARG 405 Cb 0.56 -1.65 -0.04 0.00 -1.02 0.00 0.00 32.46 30.31 3k5v n ARG 405 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3k5v n LEU 406 N 0.25 1.55 -4.65 0.55 4.77 0.26 -5.02 117.00 114.71 3k5v n LEU 406 Ca 0.19 0.25 -0.48 0.00 -0.03 0.00 0.00 56.01 55.94 3k5v n LEU 406 Cb 0.72 -0.59 -0.05 0.00 -2.33 0.00 0.00 43.42 41.18 3k5v n LEU 406 CO 0.15 -0.14 1.12 0.80 -1.33 0.00 0.00 177.39 177.99 3k5v n MET 407 N -4.04 1.84 -2.60 3.23 1.56 -0.52 -5.00 117.12 111.59 3k5v n MET 407 Ca -0.19 0.66 -0.26 0.00 -0.27 0.00 0.00 57.70 57.64 3k5v n MET 407 Cb 0.50 -2.40 0.02 0.00 2.15 0.00 0.00 33.22 33.49 3k5v n MET 407 CO 0.00 0.00 0.00 0.99 -0.73 0.00 0.00 175.97 176.23 3k5v s THR 408 N 0.92 4.17 0.00 1.12 2.01 -1.26 -4.86 115.64 117.74 3k5v s THR 408 Ca 0.81 -0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.79 3k5v s THR 408 Cb -0.77 -3.61 0.00 0.00 0.01 0.00 0.00 72.50 68.14 3k5v s THR 408 CO 0.41 -0.58 0.00 0.61 -0.69 0.00 0.00 174.62 174.38 3k5v n GLY 409 N -2.37 -1.89 1.51 4.40 0.00 -1.26 -4.63 105.19 100.95 3k5v n GLY 409 Ca 0.02 -1.91 0.08 0.00 0.00 0.00 0.00 46.02 44.21 3k5v n GLY 409 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3k5v n ASP 410 N 0.21 4.98 0.02 1.61 5.68 -1.26 -4.41 116.55 123.39 3k5v n ASP 410 Ca 0.00 -2.89 -0.10 0.00 -0.50 0.00 0.00 54.79 51.30 3k5v n ASP 410 Cb 0.00 -0.62 -0.04 0.00 -1.14 0.00 0.00 41.12 39.33 3k5v n ASP 410 CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 3k5v h THR 411 N 3.25 0.56 -3.28 2.12 2.02 -1.94 -3.40 112.91 112.24 3k5v h THR 411 Ca 0.00 0.00 -0.64 0.00 0.77 0.00 0.00 66.41 66.54 3k5v h THR 411 Cb 1.73 0.56 -0.17 0.00 -1.74 0.00 0.00 68.15 68.52 3k5v h THR 411 CO 0.37 0.00 -0.61 -0.31 0.37 0.00 0.00 175.52 175.34 3k5v s TYR 412 N -6.12 3.16 0.15 3.16 1.51 -1.26 -3.97 117.35 113.96 3k5v s TYR 412 Ca -0.15 -0.01 0.03 0.00 -1.01 0.00 0.00 57.07 55.93 3k5v s TYR 412 Cb 0.10 -1.96 -0.04 0.00 -0.11 0.00 0.00 41.96 39.95 3k5v s TYR 412 CO 0.67 0.19 -0.06 0.95 -1.11 0.00 0.00 175.55 176.19 3k5v s THR 413 N -0.00 0.93 0.19 -0.71 -4.23 -0.37 -4.84 115.64 106.61 3k5v s THR 413 Ca 0.03 -2.01 -0.32 0.00 -1.18 0.00 0.00 61.69 58.22 3k5v s THR 413 Cb -0.13 -1.91 -0.11 0.00 1.34 0.00 0.00 72.50 71.69 3k5v s THR 413 CO 0.02 -0.68 1.70 0.00 -0.54 0.00 0.00 174.62 175.12 3k5v s ALA 414 N -3.48 3.90 -0.29 3.99 0.00 -1.26 -1.03 121.76 123.58 3k5v s ALA 414 Ca 0.18 1.54 -0.14 0.00 0.00 0.00 0.00 51.96 53.54 3k5v s ALA 414 Cb 0.04 -3.69 0.10 0.00 0.00 0.00 0.00 23.12 19.58 3k5v s ALA 414 CO 0.01 -0.92 0.69 -1.58 0.00 0.00 0.00 175.76 173.96 3k5v s HIS 415 N 1.30 -1.15 -1.58 0.00 5.04 -0.19 -4.88 115.29 113.83 3k5v s HIS 415 Ca 0.74 2.15 -0.15 0.00 -1.54 0.00 0.00 55.06 56.26 3k5v s HIS 415 Cb -0.48 0.69 0.11 0.00 0.04 0.00 0.00 32.58 32.93 3k5v s HIS 415 CO 0.32 -0.57 0.90 0.00 -2.34 0.00 0.00 174.74 173.05 3k5v n ALA 416 N 4.76 -1.31 -0.75 1.58 0.00 -1.26 -1.79 120.51 121.74 3k5v n ALA 416 Ca -0.16 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3k5v n ALA 416 Cb 0.55 -4.04 0.00 0.00 0.00 0.00 0.00 19.45 15.96 3k5v n ALA 416 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k5v n GLY 417 N -1.60 0.98 1.85 0.00 0.00 -1.26 -5.00 105.19 100.16 3k5v n GLY 417 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 3k5v n GLY 417 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k5v n ALA 418 N 0.34 0.36 -3.19 4.61 0.00 -0.74 -5.14 120.51 116.76 3k5v n ALA 418 Ca 0.00 -1.13 -0.35 0.00 0.00 0.00 0.00 53.44 51.95 3k5v n ALA 418 Cb 0.00 0.83 -0.13 0.00 0.00 0.00 0.00 19.45 20.15 3k5v n ALA 418 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3k5v s LYS 419 N -2.82 3.57 0.01 0.00 -0.14 -1.26 -1.02 119.74 118.07 3k5v s LYS 419 Ca 0.17 -0.53 0.05 0.00 -1.36 0.00 0.00 55.97 54.29 3k5v s LYS 419 Cb 0.01 -3.15 -0.03 0.00 -1.68 0.00 0.00 37.83 32.98 3k5v s LYS 419 CO 0.12 -0.11 -0.12 -0.06 -0.76 0.00 0.00 175.35 174.42 3k5v s PHE 420 N 1.34 2.75 -1.03 3.18 2.99 -0.20 -4.81 117.98 122.19 3k5v s PHE 420 Ca 0.04 -0.13 -0.21 0.00 0.00 0.00 0.00 56.93 56.64 3k5v s PHE 420 Cb -0.15 -1.56 0.08 0.00 0.00 0.00 0.00 43.02 41.39 3k5v s PHE 420 CO 0.01 0.30 1.37 -1.25 -0.00 0.00 0.00 175.22 175.66 3k5v s PRO 421 N -1.31 3.66 0.27 0.24 0.04 -1.26 -1.23 135.00 135.41 3k5v s PRO 421 Ca 0.15 -1.50 -0.00 0.00 0.04 0.00 0.00 61.00 59.70 3k5v s PRO 421 Cb -0.11 -5.22 0.59 0.00 0.04 0.00 0.00 34.50 29.80 3k5v s PRO 421 CO 0.06 -2.05 1.73 0.82 0.04 0.00 0.00 177.00 177.60 3k5v h ILE 422 N 6.25 0.62 0.00 0.56 1.08 -1.91 -1.00 117.51 123.11 3k5v h ILE 422 Ca 0.22 -0.17 0.00 0.00 -0.39 0.00 0.00 64.86 64.51 3k5v h ILE 422 Cb 0.99 0.07 0.00 0.00 -3.07 0.00 0.00 36.82 34.82 3k5v h ILE 422 CO 1.32 0.09 0.00 0.29 -0.69 0.00 0.00 178.15 179.16 3k5v n LYS 423 N -4.96 0.19 0.00 2.37 5.02 -1.26 -1.86 118.16 117.65 3k5v n LYS 423 Ca 0.18 0.10 0.07 0.00 -2.02 0.00 0.00 58.31 56.64 3k5v n LYS 423 Cb 0.51 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 34.05 3k5v n LYS 423 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 3k5v n TRP 424 N -1.38 0.00 -3.48 2.13 8.01 -0.40 -4.98 117.44 117.36 3k5v n TRP 424 Ca 0.08 0.00 -0.37 0.00 -1.31 0.00 0.00 57.50 55.90 3k5v n TRP 424 Cb 0.21 0.00 -0.07 0.00 -2.01 0.00 0.00 31.31 29.44 3k5v n TRP 424 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.69 177.67 3k5v s THR 425 N -1.38 5.26 0.57 -0.99 2.01 -0.78 -4.00 115.64 116.32 3k5v s THR 425 Ca 0.15 0.68 -0.20 0.00 0.31 0.00 0.00 61.69 62.62 3k5v s THR 425 Cb 0.12 -3.69 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 3k5v s THR 425 CO 0.24 0.39 1.30 0.00 -0.69 0.00 0.00 174.62 175.86 3k5v s ALA 426 N 0.38 2.67 0.28 7.40 0.00 -1.26 -4.81 121.76 126.42 3k5v s ALA 426 Ca 0.20 1.22 -0.03 0.00 0.00 0.00 0.00 51.96 53.34 3k5v s ALA 426 Cb -0.14 -3.53 0.37 0.00 0.00 0.00 0.00 23.12 19.83 3k5v s ALA 426 CO 0.06 -1.34 1.94 -1.35 0.00 0.00 0.00 175.76 175.07 3k5v h PRO 427 N 1.18 1.19 0.00 0.00 0.11 -1.96 -0.82 132.00 131.69 3k5v h PRO 427 Ca -0.51 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 65.49 3k5v h PRO 427 Cb 1.31 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 3k5v h PRO 427 CO 0.56 0.78 -0.19 1.05 -0.21 0.00 0.00 178.00 179.99 3k5v h GLU 428 N 1.22 0.00 -0.21 1.05 9.09 -1.89 0.10 114.58 123.94 3k5v h GLU 428 Ca 0.36 0.00 -0.19 0.00 0.05 0.00 0.00 59.36 59.58 3k5v h GLU 428 Cb -0.07 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.03 3k5v h GLU 428 CO -0.09 0.19 -0.60 0.77 0.05 0.00 0.00 179.01 179.33 3k5v h SER 429 N 0.00 0.89 -0.43 3.06 0.02 -1.11 -0.74 113.55 115.24 3k5v h SER 429 Ca -0.00 -0.58 -0.09 0.00 -0.84 0.00 0.00 61.79 60.28 3k5v h SER 429 Cb 0.64 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 3k5v h SER 429 CO 0.02 1.32 -0.07 -0.07 -1.14 0.00 0.00 176.83 176.89 3k5v h LEU 430 N 0.52 0.80 0.01 5.07 3.38 -0.54 -2.50 115.31 122.04 3k5v h LEU 430 Ca -0.02 -0.35 -0.33 0.00 0.09 0.00 0.00 57.88 57.27 3k5v h LEU 430 Cb 1.22 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.70 3k5v h LEU 430 CO 0.13 0.96 -2.05 0.00 0.09 0.00 0.00 178.44 177.57 3k5v n ALA 431 N -2.45 1.45 -0.23 1.53 0.00 0.27 -4.50 120.51 116.58 3k5v n ALA 431 Ca -0.01 -1.00 0.00 0.00 0.00 0.00 0.00 53.44 52.43 3k5v n ALA 431 Cb 0.35 -0.52 0.00 0.00 0.00 0.00 0.00 19.45 19.27 3k5v n ALA 431 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3k5v n TYR 432 N -2.97 0.00 -2.53 0.00 4.02 -0.34 -5.00 117.16 110.33 3k5v n TYR 432 Ca -0.26 -0.25 -0.18 0.00 -0.01 0.00 0.00 57.90 57.19 3k5v n TYR 432 Cb 1.09 -0.03 -0.00 0.00 -0.02 0.00 0.00 39.34 40.38 3k5v n TYR 432 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3k5v n ASN 433 N -0.25 -5.20 -4.54 7.72 5.15 -0.94 -4.94 115.26 112.25 3k5v n ASN 433 Ca 0.00 0.00 -0.41 0.00 -0.60 0.00 0.00 54.58 53.58 3k5v n ASN 433 Cb 0.22 -4.34 -0.10 0.00 -0.53 0.00 0.00 39.78 35.04 3k5v n ASN 433 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 3k5v s LYS 434 N -5.16 3.52 -0.05 1.20 2.47 -0.85 -4.93 119.74 115.94 3k5v s LYS 434 Ca 0.05 -0.53 0.05 0.00 -1.56 0.00 0.00 55.97 53.98 3k5v s LYS 434 Cb -0.02 -3.81 -0.02 0.00 -1.46 0.00 0.00 37.83 32.52 3k5v s LYS 434 CO 0.07 -0.49 -0.20 -0.06 0.16 0.00 0.00 175.35 174.83 3k5v s PHE 435 N 1.88 2.56 0.37 4.03 0.40 -1.26 -3.09 117.98 122.87 3k5v s PHE 435 Ca 0.09 -0.39 -0.16 0.00 -0.60 0.00 0.00 56.93 55.87 3k5v s PHE 435 Cb -0.17 -1.61 0.05 0.00 0.51 0.00 0.00 43.02 41.80 3k5v s PHE 435 CO 0.11 0.01 0.77 -1.54 0.70 0.00 0.00 175.22 175.27 3k5v s SER 436 N -0.49 0.01 0.53 1.36 1.04 -1.26 -4.97 113.70 109.93 3k5v s SER 436 Ca 0.06 -1.11 0.19 0.00 0.48 0.00 0.00 55.95 55.58 3k5v s SER 436 Cb -0.12 0.83 1.38 0.00 0.10 0.00 0.00 66.02 68.22 3k5v s SER 436 CO 0.01 -1.65 2.15 -0.29 0.98 0.00 0.00 173.24 174.45 3k5v h ILE 437 N 2.00 0.89 0.00 -1.02 6.09 -1.99 -0.68 117.51 122.80 3k5v h ILE 437 Ca -0.31 0.00 -0.08 0.00 -1.37 0.00 0.00 64.86 63.10 3k5v h ILE 437 Cb 1.25 0.97 -0.01 0.00 0.47 0.00 0.00 36.82 39.50 3k5v h ILE 437 CO 0.39 0.00 -0.37 0.11 -3.07 0.00 0.00 178.15 175.21 3k5v h LYS 438 N 0.00 0.00 -0.00 2.19 1.79 -1.95 -0.73 116.57 117.87 3k5v h LYS 438 Ca 0.03 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.34 3k5v h LYS 438 Cb 0.11 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.74 3k5v h LYS 438 CO -0.00 0.37 -0.74 0.66 -1.08 0.00 0.00 179.45 178.66 3k5v h SER 439 N 0.00 0.04 -0.41 0.86 4.64 -1.49 -2.45 113.55 114.74 3k5v h SER 439 Ca -0.00 -0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.24 3k5v h SER 439 Cb 0.80 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.86 3k5v h SER 439 CO 0.05 0.77 0.09 0.44 -0.87 0.00 0.00 176.83 177.30 3k5v h ASP 440 N 0.02 0.69 -0.60 4.97 3.32 -0.96 -2.32 116.42 121.55 3k5v h ASP 440 Ca -0.01 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 56.91 3k5v h ASP 440 Cb 1.31 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 40.65 3k5v h ASP 440 CO 0.10 0.71 0.38 0.58 -1.72 0.00 0.00 179.24 179.29 3k5v h VAL 441 N 0.71 1.16 -0.09 -1.35 2.07 -0.83 0.19 116.25 118.13 3k5v h VAL 441 Ca 0.16 -0.32 0.03 0.00 0.82 0.00 0.00 66.70 67.38 3k5v h VAL 441 Cb 0.31 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 3k5v h VAL 441 CO 0.00 0.16 -0.10 -0.25 0.02 0.00 0.00 177.57 177.40 3k5v h TRP 442 N 0.81 -0.25 -0.90 1.57 2.91 -1.15 -1.90 115.95 117.03 3k5v h TRP 442 Ca 0.22 0.01 0.05 0.00 1.13 0.00 0.00 58.89 60.30 3k5v h TRP 442 Cb -0.07 0.12 -0.06 0.00 -0.51 0.00 0.00 29.16 28.65 3k5v h TRP 442 CO -0.03 -0.15 0.57 0.00 -1.03 0.00 0.00 178.44 177.80 3k5v h ALA 443 N 0.92 1.21 -0.84 2.65 0.00 -1.15 -1.43 119.26 120.63 3k5v h ALA 443 Ca 0.07 -0.03 0.10 0.00 0.00 0.00 0.00 54.91 55.04 3k5v h ALA 443 Cb 0.23 -0.29 -0.07 0.00 0.00 0.00 0.00 17.79 17.65 3k5v h ALA 443 CO -0.16 0.39 0.48 0.35 0.00 0.00 0.00 179.25 180.31 3k5v h PHE 444 N 1.09 0.88 -0.70 0.00 3.57 -0.16 0.11 116.94 121.72 3k5v h PHE 444 Ca 0.37 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.94 3k5v h PHE 444 Cb 0.07 -0.27 -0.05 0.00 2.79 0.00 0.00 35.95 38.49 3k5v h PHE 444 CO -0.02 0.36 0.43 0.78 -2.23 0.00 0.00 178.31 177.63 3k5v h GLY 445 N 0.81 1.02 0.95 2.40 0.00 -0.49 0.33 103.07 108.10 3k5v h GLY 445 Ca 0.40 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 47.38 3k5v h GLY 445 CO -0.25 0.25 0.15 -2.08 0.00 0.00 0.00 176.54 174.61 3k5v h VAL 446 N 0.83 1.21 -0.75 4.60 2.07 -0.92 -1.93 116.25 121.36 3k5v h VAL 446 Ca 0.29 -0.69 0.04 0.00 0.82 0.00 0.00 66.70 67.16 3k5v h VAL 446 Cb 0.07 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 3k5v h VAL 446 CO -0.13 0.25 0.47 0.25 0.02 0.00 0.00 177.57 178.43 3k5v h LEU 447 N 0.55 0.77 -0.87 2.57 5.85 -0.25 -0.35 115.31 123.58 3k5v h LEU 447 Ca 0.14 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.94 3k5v h LEU 447 Cb 0.24 -0.16 -0.07 0.00 0.37 0.00 0.00 40.66 41.04 3k5v h LEU 447 CO -0.01 0.52 0.53 0.25 -0.34 0.00 0.00 178.44 179.40 3k5v h LEU 448 N 0.91 0.81 -0.69 2.25 5.85 -0.14 0.28 115.31 124.58 3k5v h LEU 448 Ca 0.30 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 59.02 3k5v h LEU 448 Cb 0.04 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 3k5v h LEU 448 CO -0.12 0.49 0.31 -0.25 -0.34 0.00 0.00 178.44 178.53 3k5v h TRP 449 N 0.93 1.02 -0.70 1.25 7.01 -0.51 -0.10 115.95 124.85 3k5v h TRP 449 Ca 0.39 -0.06 0.05 0.00 2.11 0.00 0.00 58.89 61.38 3k5v h TRP 449 Cb 0.25 -0.31 -0.05 0.00 -2.10 0.00 0.00 29.16 26.95 3k5v h TRP 449 CO -0.04 0.77 0.41 0.93 -2.79 0.00 0.00 178.44 177.72 3k5v h GLU 450 N 0.97 0.75 -0.08 2.65 5.08 -0.22 -1.77 114.58 121.96 3k5v h GLU 450 Ca 0.23 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 3k5v h GLU 450 Cb 0.16 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 3k5v h GLU 450 CO -0.03 0.50 0.01 0.82 -1.00 0.00 0.00 179.01 179.31 3k5v h ILE 451 N 0.77 1.22 0.00 3.13 2.04 -0.57 0.28 117.51 124.37 3k5v h ILE 451 Ca 0.30 -0.67 -0.00 0.00 1.00 0.00 0.00 64.86 65.49 3k5v h ILE 451 Cb 0.13 1.52 -0.00 0.00 -0.74 0.00 0.00 36.82 37.73 3k5v h ILE 451 CO -0.16 0.19 -0.01 0.00 0.00 0.00 0.00 178.15 178.17 3k5v h ALA 452 N 0.77 1.22 -0.46 1.87 0.00 -0.72 -1.80 119.26 120.14 3k5v h ALA 452 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3k5v h ALA 452 Cb 0.29 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3k5v h ALA 452 CO 0.00 0.02 0.00 0.25 0.00 0.00 0.00 179.25 179.52 3k5v n THR 453 N -3.41 1.12 -3.91 0.00 -2.24 -0.69 -4.90 114.28 100.25 3k5v n THR 453 Ca -0.03 -1.06 -0.30 0.00 -2.27 0.00 0.00 64.05 60.40 3k5v n THR 453 Cb 0.10 0.44 0.02 0.00 -2.10 0.00 0.00 70.33 68.79 3k5v n THR 453 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3k5v n TYR 454 N 0.80 -2.24 -0.81 4.78 4.01 -0.68 -3.42 117.16 119.61 3k5v n TYR 454 Ca 0.16 0.89 0.00 0.00 -0.16 0.00 0.00 57.90 58.80 3k5v n TYR 454 Cb 0.53 -3.97 0.00 0.00 -0.31 0.00 0.00 39.34 35.59 3k5v n TYR 454 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3k5v n GLY 455 N -1.68 0.93 3.76 2.72 0.00 0.94 -3.53 105.19 108.34 3k5v n GLY 455 Ca 0.01 -0.52 -0.35 0.00 0.00 0.00 0.00 46.02 45.16 3k5v n GLY 455 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3k5v s MET 456 N -1.87 2.94 0.13 1.61 -1.94 -1.22 -4.90 119.30 114.05 3k5v s MET 456 Ca 0.00 1.65 -0.30 0.00 -1.71 0.00 0.00 55.69 55.33 3k5v s MET 456 Cb 0.00 -1.94 -0.07 0.00 2.01 0.00 0.00 34.83 34.83 3k5v s MET 456 CO 0.00 -1.19 1.15 -1.12 -0.01 0.00 0.00 175.02 173.85 3k5v s SER 457 N -1.94 7.17 0.81 3.03 0.01 -1.26 -4.74 113.70 116.79 3k5v s SER 457 Ca 0.73 2.08 -0.11 0.00 1.31 0.00 0.00 55.95 59.96 3k5v s SER 457 Cb -0.26 -2.59 0.08 0.00 0.21 0.00 0.00 66.02 63.46 3k5v s SER 457 CO 0.35 -0.34 1.09 -2.16 0.41 0.00 0.00 173.24 172.59 3k5v s PRO 458 N 0.20 1.94 -1.44 12.44 0.04 -1.26 -3.78 135.00 143.14 3k5v s PRO 458 Ca 0.53 1.11 -0.03 0.00 0.04 0.00 0.00 61.00 62.65 3k5v s PRO 458 Cb -0.30 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.38 3k5v s PRO 458 CO 0.33 -1.84 0.29 0.66 0.04 0.00 0.00 177.00 176.47 3k5v n TYR 459 N -3.65 -1.49 -1.88 0.56 4.02 -1.26 -4.81 117.16 108.65 3k5v n TYR 459 Ca 0.09 0.64 -0.42 0.00 -0.01 0.00 0.00 57.90 58.20 3k5v n TYR 459 Cb 0.53 -3.30 -0.02 0.00 -0.02 0.00 0.00 39.34 36.53 3k5v n TYR 459 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 3k5v s PRO 460 N -6.91 4.19 0.00 -0.72 0.04 -1.25 -1.81 135.00 128.55 3k5v s PRO 460 Ca 0.05 2.45 0.00 0.00 0.04 0.00 0.00 61.00 63.54 3k5v s PRO 460 Cb -0.02 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.42 3k5v s PRO 460 CO 0.94 -0.59 0.00 0.41 0.04 0.00 0.00 177.00 177.80 3k5v n GLY 461 N 2.91 1.31 3.67 0.56 0.00 -1.26 -5.02 105.19 107.36 3k5v n GLY 461 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 3k5v n GLY 461 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k5v s ILE 462 N -3.10 5.34 0.38 -0.61 1.01 -0.75 -5.07 121.20 118.41 3k5v s ILE 462 Ca 0.00 0.17 -0.28 0.00 0.00 0.00 0.00 60.65 60.55 3k5v s ILE 462 Cb 0.00 -3.48 -0.11 0.00 0.01 0.00 0.00 42.46 38.88 3k5v s ILE 462 CO 0.00 0.36 1.46 -0.62 0.00 0.00 0.00 174.94 176.14 3k5v s ASP 463 N 0.95 6.31 0.37 3.58 2.15 -1.26 -4.90 116.67 123.87 3k5v s ASP 463 Ca 0.07 3.00 0.10 0.00 0.43 0.00 0.00 52.55 56.16 3k5v s ASP 463 Cb -0.13 -2.66 0.86 0.00 -0.30 0.00 0.00 42.92 40.68 3k5v s ASP 463 CO 0.03 -0.89 1.87 -0.07 -0.17 0.00 0.00 175.17 175.95 3k5v h LEU 464 N 2.93 0.61 -2.79 -1.34 3.38 -1.97 -1.21 115.31 114.93 3k5v h LEU 464 Ca -0.51 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3k5v h LEU 464 Cb 1.24 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 3k5v h LEU 464 CO 0.64 0.30 0.04 0.77 0.09 0.00 0.00 178.44 180.28 3k5v h SER 465 N 0.64 0.00 0.00 -0.43 4.64 -2.05 -2.47 113.55 113.89 3k5v h SER 465 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 3k5v h SER 465 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 3k5v h SER 465 CO -0.20 0.00 -0.89 0.00 -0.87 0.00 0.00 176.83 174.87 3k5v n GLN 466 N -3.25 0.78 0.15 4.77 1.13 -0.46 -4.66 117.38 115.84 3k5v n GLN 466 Ca -0.03 -0.00 -0.14 0.00 -1.94 0.00 0.00 57.00 54.89 3k5v n GLN 466 Cb 0.11 -1.39 -0.08 0.00 0.11 0.00 0.00 30.24 28.99 3k5v n GLN 466 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3k5v h VAL 467 N 0.00 0.78 0.02 5.09 2.07 -1.43 -1.31 116.25 121.47 3k5v h VAL 467 Ca 0.00 -0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 3k5v h VAL 467 Cb 0.44 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 3k5v h VAL 467 CO 0.00 0.00 -0.05 0.22 0.02 0.00 0.00 177.57 177.76 3k5v h TYR 468 N -0.31 -0.11 -0.58 1.57 3.20 -1.83 -0.96 116.97 117.95 3k5v h TYR 468 Ca -0.03 0.00 0.07 0.00 3.14 0.00 0.00 58.73 61.91 3k5v h TYR 468 Cb 0.23 0.05 -0.06 0.00 1.54 0.00 0.00 36.73 38.50 3k5v h TYR 468 CO -0.06 -0.07 0.27 1.49 -1.64 0.00 0.00 178.16 178.15 3k5v h GLU 469 N -0.09 0.49 -0.49 1.82 4.57 -1.82 0.83 114.58 119.89 3k5v h GLU 469 Ca 0.01 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.16 3k5v h GLU 469 Cb 0.10 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 3k5v h GLU 469 CO -0.04 0.33 0.27 -0.07 -1.18 0.00 0.00 179.01 178.32 3k5v h LEU 470 N 0.51 0.61 -0.60 1.64 3.38 -0.95 -1.89 115.31 118.00 3k5v h LEU 470 Ca 0.27 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 58.07 3k5v h LEU 470 Cb 0.24 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 3k5v h LEU 470 CO -0.22 0.52 0.05 -0.07 0.09 0.00 0.00 178.44 178.81 3k5v h LEU 471 N 0.64 1.01 -2.11 1.67 3.38 -0.59 -0.48 115.31 118.83 3k5v h LEU 471 Ca 0.17 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3k5v h LEU 471 Cb 0.05 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 3k5v h LEU 471 CO -0.03 1.04 -0.06 -0.08 0.09 0.00 0.00 178.44 179.41 3k5v h GLU 472 N 0.94 0.00 -0.68 1.13 4.22 -0.63 -0.71 114.58 118.85 3k5v h GLU 472 Ca 0.18 0.00 -0.07 0.00 0.08 0.00 0.00 59.36 59.55 3k5v h GLU 472 Cb 0.50 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.71 3k5v h GLU 472 CO 0.02 0.06 0.09 1.63 -2.18 0.00 0.00 179.01 178.63 3k5v n LYS 473 N -4.03 4.21 -1.04 1.92 4.76 -0.71 -4.93 118.16 118.34 3k5v n LYS 473 Ca -0.03 -2.85 -0.01 0.00 -2.87 0.00 0.00 58.31 52.55 3k5v n LYS 473 Cb 0.15 -2.18 -0.01 0.00 -1.84 0.00 0.00 35.03 31.15 3k5v n LYS 473 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 3k5v n ASP 474 N 0.34 -3.66 -4.77 4.39 8.00 -0.27 -5.02 116.55 115.56 3k5v n ASP 474 Ca 0.29 0.04 -0.39 0.00 0.71 0.00 0.00 54.79 55.45 3k5v n ASP 474 Cb 1.18 -1.29 -0.01 0.00 -0.02 0.00 0.00 41.12 40.99 3k5v n ASP 474 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3k5v s TYR 475 N -1.89 2.85 0.02 1.24 5.04 -0.27 -4.99 117.35 119.35 3k5v s TYR 475 Ca 0.00 1.47 -0.07 0.00 -2.44 0.00 0.00 57.07 56.03 3k5v s TYR 475 Cb 0.00 -3.56 -0.00 0.00 0.35 0.00 0.00 41.96 38.75 3k5v s TYR 475 CO 0.00 -1.85 0.13 1.03 -1.34 0.00 0.00 175.55 173.52 3k5v s ARG 476 N -2.39 0.55 0.40 4.97 1.81 -1.26 -4.32 118.95 118.71 3k5v s ARG 476 Ca 0.59 -0.56 -0.25 0.00 -1.72 0.00 0.00 55.73 53.79 3k5v s ARG 476 Cb -0.35 0.22 -0.11 0.00 -0.45 0.00 0.00 34.95 34.27 3k5v s ARG 476 CO 0.44 -0.14 1.03 -1.33 -0.68 0.00 0.00 175.30 174.62 3k5v n MET 477 N 1.10 1.41 -1.55 3.54 2.81 -1.26 -4.95 117.12 118.22 3k5v n MET 477 Ca -0.21 0.50 -0.31 0.00 -1.81 0.00 0.00 57.70 55.87 3k5v n MET 477 Cb 0.57 -2.04 0.05 0.00 -0.71 0.00 0.00 33.22 31.10 3k5v n MET 477 CO 0.00 0.00 0.00 -1.83 1.51 0.00 0.00 175.97 175.65 3k5v s GLU 478 N -1.94 2.86 0.11 0.03 -1.05 -1.26 -4.96 118.70 112.49 3k5v s GLU 478 Ca 0.62 1.00 -0.32 0.00 -0.15 0.00 0.00 54.97 56.12 3k5v s GLU 478 Cb -0.58 -1.98 -0.11 0.00 -0.44 0.00 0.00 34.13 31.02 3k5v s GLU 478 CO 0.58 -1.17 1.81 -2.13 0.95 0.00 0.00 175.26 175.30 3k5v n ARG 479 N -3.13 2.68 -1.68 -4.83 0.63 -1.26 -4.94 116.66 104.12 3k5v n ARG 479 Ca 0.08 0.98 -0.34 0.00 -0.92 0.00 0.00 57.85 57.64 3k5v n ARG 479 Cb 0.53 -2.85 0.06 0.00 0.45 0.00 0.00 32.46 30.65 3k5v n ARG 479 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 3k5v s PRO 480 N 2.59 2.58 0.03 -0.14 0.02 -1.26 -4.90 135.00 133.92 3k5v s PRO 480 Ca 0.82 1.60 -0.34 0.00 0.02 0.00 0.00 61.00 63.10 3k5v s PRO 480 Cb -0.52 -1.90 -0.12 0.00 0.02 0.00 0.00 34.50 31.97 3k5v s PRO 480 CO 0.38 -1.46 1.76 -1.91 -0.33 0.00 0.00 177.00 175.45 3k5v n GLU 481 N -2.38 2.23 -0.19 5.54 2.13 -1.26 -1.42 120.64 125.29 3k5v n GLU 481 Ca 0.12 0.81 0.00 0.00 0.66 0.00 0.00 57.16 58.75 3k5v n GLU 481 Cb 0.51 -2.64 0.00 0.00 0.27 0.00 0.00 31.44 29.58 3k5v n GLU 481 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3k5v n GLY 482 N 4.01 1.39 3.69 8.31 0.00 -1.26 -4.98 105.19 116.33 3k5v n GLY 482 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3k5v n GLY 482 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k5v s PRO 484 N 2.38 4.02 0.28 0.00 0.02 -1.26 -4.84 135.00 135.61 3k5v s PRO 484 Ca 0.58 2.58 0.02 0.00 0.02 0.00 0.00 61.00 64.20 3k5v s PRO 484 Cb -0.26 -2.91 0.60 0.00 0.02 0.00 0.00 34.50 31.94 3k5v s PRO 484 CO 0.23 -0.60 1.81 0.93 -0.33 0.00 0.00 177.00 179.03 3k5v h GLU 485 N 2.87 0.87 -0.25 5.54 4.39 -1.93 -1.78 114.58 124.30 3k5v h GLU 485 Ca -0.51 -0.05 -0.06 0.00 0.34 0.00 0.00 59.36 59.07 3k5v h GLU 485 Cb 1.24 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.68 3k5v h GLU 485 CO 0.64 0.58 -0.12 0.87 -1.16 0.00 0.00 179.01 179.81 3k5v h LYS 486 N 0.90 0.41 -0.27 2.33 1.57 -1.99 0.34 116.57 119.85 3k5v h LYS 486 Ca 0.51 -0.11 -0.10 0.00 -1.87 0.00 0.00 60.65 59.09 3k5v h LYS 486 Cb 0.61 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 3k5v h LYS 486 CO -0.30 0.54 -0.21 0.28 -0.57 0.00 0.00 179.45 179.18 3k5v h VAL 487 N 0.38 1.30 -0.52 0.50 2.07 -1.72 -2.52 116.25 115.75 3k5v h VAL 487 Ca 0.07 -1.36 -0.06 0.00 0.82 0.00 0.00 66.70 66.18 3k5v h VAL 487 Cb 0.45 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.78 3k5v h VAL 487 CO 0.03 0.43 0.09 0.22 0.02 0.00 0.00 177.57 178.35 3k5v h TYR 488 N 0.36 0.84 -0.95 1.57 3.20 -0.90 -0.73 116.97 120.36 3k5v h TYR 488 Ca 0.05 -0.09 0.03 0.00 3.14 0.00 0.00 58.73 61.86 3k5v h TYR 488 Cb 0.76 -0.24 -0.05 0.00 1.54 0.00 0.00 36.73 38.74 3k5v h TYR 488 CO 0.07 0.73 0.62 0.93 -1.64 0.00 0.00 178.16 178.87 3k5v h GLU 489 N 0.77 1.18 -0.52 1.82 5.08 -0.89 0.37 114.58 122.39 3k5v h GLU 489 Ca 0.16 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.34 3k5v h GLU 489 Cb 0.34 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3k5v h GLU 489 CO 0.00 0.78 -0.14 1.25 -1.00 0.00 0.00 179.01 179.91 3k5v h LEU 490 N 1.21 1.00 -0.04 1.33 5.85 -0.90 -0.93 115.31 122.84 3k5v h LEU 490 Ca 0.37 -0.34 0.02 0.00 0.84 0.00 0.00 57.88 58.77 3k5v h LEU 490 Cb -0.02 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 3k5v h LEU 490 CO -0.11 1.13 -0.07 0.24 -0.34 0.00 0.00 178.44 179.29 3k5v h MET 491 N 0.88 -0.10 -0.29 1.25 2.86 -0.54 -1.66 114.93 117.33 3k5v h MET 491 Ca 0.13 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 3k5v h MET 491 Cb 0.70 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.37 3k5v h MET 491 CO 0.05 -0.07 0.19 0.00 1.06 0.00 0.00 176.91 178.15 3k5v h ARG 492 N -0.11 0.38 -0.42 1.72 2.47 -0.73 -1.91 114.38 115.79 3k5v h ARG 492 Ca 0.04 -0.02 -0.14 0.00 -1.26 0.00 0.00 59.98 58.60 3k5v h ARG 492 Cb 0.17 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.39 3k5v h ARG 492 CO -0.11 0.26 -0.28 0.00 0.56 0.00 0.00 179.97 180.40 3k5v h ALA 493 N 1.81 0.60 0.00 0.04 0.00 -0.76 -2.42 119.26 118.54 3k5v h ALA 493 Ca 0.11 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 3k5v h ALA 493 Cb -0.04 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 3k5v h ALA 493 CO -0.02 0.63 -0.06 0.00 0.00 0.00 0.00 179.25 179.80 3k5v n TRP 495 N -3.64 2.15 -1.77 0.00 8.01 -0.91 -3.66 117.44 117.63 3k5v n TRP 495 Ca -0.02 -1.27 -0.41 0.00 -1.31 0.00 0.00 57.50 54.49 3k5v n TRP 495 Cb 0.16 -0.64 -0.01 0.00 -2.01 0.00 0.00 31.31 28.82 3k5v n TRP 495 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.69 176.03 3k5v s GLN 496 N -3.04 4.10 0.11 -0.99 -1.52 -1.10 -4.93 119.66 112.29 3k5v s GLN 496 Ca 0.52 2.60 -0.20 0.00 -1.95 0.00 0.00 55.36 56.34 3k5v s GLN 496 Cb 0.43 -2.99 -0.08 0.00 -0.22 0.00 0.00 33.01 30.15 3k5v s GLN 496 CO 0.11 -0.61 1.72 2.35 -0.25 0.00 0.00 175.29 178.61 3k5v h TRP 497 N 3.93 0.26 -3.04 0.91 2.91 -1.93 -3.39 115.95 115.59 3k5v h TRP 497 Ca -0.49 -0.00 -0.57 0.00 1.13 0.00 0.00 58.89 58.96 3k5v h TRP 497 Cb 1.23 -0.08 -0.05 0.00 -0.51 0.00 0.00 29.16 29.75 3k5v h TRP 497 CO 0.56 0.22 0.89 1.21 -1.03 0.00 0.00 178.44 180.29 3k5v s ASN 498 N -5.45 6.91 0.40 2.65 3.84 -1.26 -4.87 114.94 117.16 3k5v s ASN 498 Ca -0.13 1.44 0.11 0.00 0.21 0.00 0.00 52.86 54.49 3k5v s ASN 498 Cb 0.08 -2.54 0.92 0.00 -0.55 0.00 0.00 41.25 39.16 3k5v s ASN 498 CO 0.70 -0.83 1.96 -0.65 -2.79 0.00 0.00 177.10 175.48 3k5v h PRO 499 N 8.31 0.53 0.00 0.43 0.10 -1.95 -0.51 132.00 138.91 3k5v h PRO 499 Ca -0.24 -0.03 -0.01 0.00 0.10 0.00 0.00 66.00 65.82 3k5v h PRO 499 Cb 1.09 -0.12 -0.00 0.00 0.10 0.00 0.00 31.00 32.07 3k5v h PRO 499 CO 0.99 0.35 -0.04 0.77 0.10 0.00 0.00 178.00 180.17 3k5v h SER 500 N 0.54 0.00 1.38 -2.05 0.02 -1.93 -2.39 113.55 109.13 3k5v h SER 500 Ca 0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 3k5v h SER 500 Cb 0.47 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.01 3k5v h SER 500 CO -0.10 0.04 -0.07 0.47 -1.14 0.00 0.00 176.83 176.03 3k5v n ASP 501 N -3.69 0.77 -4.79 3.07 8.00 -0.20 -4.88 116.55 114.83 3k5v n ASP 501 Ca -0.03 0.52 -0.35 0.00 0.71 0.00 0.00 54.79 55.64 3k5v n ASP 501 Cb 0.14 -0.67 -0.04 0.00 -0.02 0.00 0.00 41.12 40.53 3k5v n ASP 501 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3k5v s ARG 502 N -3.10 3.98 0.72 -1.24 0.52 -0.90 -4.93 118.95 113.99 3k5v s ARG 502 Ca 0.10 1.46 -0.14 0.00 -0.52 0.00 0.00 55.73 56.63 3k5v s ARG 502 Cb 0.13 -2.34 0.03 0.00 0.52 0.00 0.00 34.95 33.29 3k5v s ARG 502 CO 0.61 -0.30 1.16 -1.25 0.02 0.00 0.00 175.30 175.54 3k5v s PRO 503 N -2.83 2.31 0.74 3.54 0.04 -1.26 -5.03 135.00 132.51 3k5v s PRO 503 Ca 0.62 1.56 -0.11 0.00 0.04 0.00 0.00 61.00 63.11 3k5v s PRO 503 Cb -0.20 -1.87 0.03 0.00 0.04 0.00 0.00 34.50 32.50 3k5v s PRO 503 CO 0.25 -1.66 1.08 -1.54 0.04 0.00 0.00 177.00 175.16 3k5v s SER 504 N -2.39 5.04 0.39 6.66 1.04 -1.26 -4.88 113.70 118.30 3k5v s SER 504 Ca 0.70 1.42 0.10 0.00 0.48 0.00 0.00 55.95 58.65 3k5v s SER 504 Cb -0.24 -2.24 0.80 0.00 0.10 0.00 0.00 66.02 64.43 3k5v s SER 504 CO 0.45 -1.64 1.91 -0.26 0.98 0.00 0.00 173.24 174.69 3k5v h PHE 505 N -0.86 0.21 -0.59 5.02 -1.00 -1.93 -0.58 116.94 117.21 3k5v h PHE 505 Ca -0.45 -0.02 0.02 0.00 2.81 0.00 0.00 57.97 60.32 3k5v h PHE 505 Cb 1.24 -0.06 -0.04 0.00 3.61 0.00 0.00 35.95 40.70 3k5v h PHE 505 CO 0.54 0.35 0.37 0.00 -1.61 0.00 0.00 178.31 177.97 3k5v h ALA 506 N 1.66 0.77 -0.67 2.45 0.00 -1.89 0.14 119.26 121.73 3k5v h ALA 506 Ca 0.04 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3k5v h ALA 506 Cb 0.39 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3k5v h ALA 506 CO 0.02 0.12 0.24 0.93 0.00 0.00 0.00 179.25 180.57 3k5v h GLU 507 N 0.74 1.01 -0.26 0.00 5.08 -1.76 -1.45 114.58 117.95 3k5v h GLU 507 Ca 0.23 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 3k5v h GLU 507 Cb -0.01 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 3k5v h GLU 507 CO -0.09 0.86 0.12 0.82 -1.00 0.00 0.00 179.01 179.73 3k5v h ILE 508 N 0.95 1.14 -0.36 3.13 2.04 -0.84 0.13 117.51 123.71 3k5v h ILE 508 Ca 0.22 -0.41 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 3k5v h ILE 508 Cb 0.25 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 3k5v h ILE 508 CO -0.01 0.14 0.15 -0.74 0.00 0.00 0.00 178.15 177.69 3k5v h HIS 509 N 0.28 0.55 -0.82 1.37 2.76 -0.60 -1.61 115.15 117.09 3k5v h HIS 509 Ca 0.09 -0.04 0.07 0.00 -2.20 0.00 0.00 60.37 58.29 3k5v h HIS 509 Cb 0.12 -0.16 -0.06 0.00 1.55 0.00 0.00 27.41 28.85 3k5v h HIS 509 CO -0.02 0.50 0.49 0.37 -1.30 0.00 0.00 177.93 177.97 3k5v h GLN 510 N 0.44 0.85 -0.69 5.26 5.75 -1.15 -1.98 115.11 123.59 3k5v h GLN 510 Ca 0.12 -0.05 0.02 0.00 -0.15 0.00 0.00 58.65 58.59 3k5v h GLN 510 Cb 0.18 -0.19 -0.04 0.00 1.07 0.00 0.00 27.48 28.50 3k5v h GLN 510 CO -0.01 0.56 0.44 0.00 -2.65 0.00 0.00 178.83 177.18 3k5v h ALA 511 N 1.41 0.89 -0.37 3.38 0.00 -0.27 -1.19 119.26 123.10 3k5v h ALA 511 Ca 0.37 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.20 3k5v h ALA 511 Cb 0.22 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3k5v h ALA 511 CO -0.19 0.24 0.06 0.74 0.00 0.00 0.00 179.25 180.10 3k5v h PHE 512 N 0.88 0.57 -0.06 0.00 0.04 -0.65 0.26 116.94 117.99 3k5v h PHE 512 Ca 0.27 -0.04 -0.18 0.00 2.80 0.00 0.00 57.97 60.82 3k5v h PHE 512 Cb -0.03 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 37.94 3k5v h PHE 512 CO -0.04 0.52 -0.73 0.93 -0.60 0.00 0.00 178.31 178.40 3k5v h GLU 513 N 0.54 0.32 0.13 1.51 5.08 -0.66 -3.34 114.58 118.17 3k5v h GLU 513 Ca 0.12 -0.27 -0.36 0.00 -1.00 0.00 0.00 59.36 57.86 3k5v h GLU 513 Cb 0.26 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3k5v h GLU 513 CO 0.00 0.92 -1.91 1.15 -1.00 0.00 0.00 179.01 178.16 3k5v h THR 514 N 0.22 0.70 -0.99 1.13 2.02 -0.99 -3.36 112.91 111.64 3k5v h THR 514 Ca -0.03 -2.37 0.37 0.00 0.77 0.00 0.00 66.41 65.15 3k5v h THR 514 Cb 1.29 2.56 -0.17 0.00 -1.74 0.00 0.00 68.15 70.08 3k5v h THR 514 CO 0.12 0.87 0.43 -0.03 0.37 0.00 0.00 175.52 177.28 3k5v h MET 515 N 0.04 0.06 -0.00 6.66 -1.53 -0.61 -0.97 114.93 118.58 3k5v h MET 515 Ca -0.40 -0.00 -0.07 0.00 -3.44 0.00 0.00 59.70 55.78 3k5v h MET 515 Cb 2.02 -0.01 -0.15 0.00 -0.55 0.00 0.00 31.60 32.91 3k5v h MET 515 CO 0.10 0.04 -0.71 1.19 0.14 0.00 0.00 176.91 177.67 3k5v n PHE 516 N -5.27 0.01 -0.06 1.39 3.01 -1.26 -4.78 117.46 110.49 3k5v n PHE 516 Ca 0.33 -1.13 -0.02 0.00 1.01 0.00 0.00 57.45 57.64 3k5v n PHE 516 Cb 1.11 -0.21 0.23 0.00 -0.01 0.00 0.00 39.48 40.60 3k5v n PHE 516 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 3k5v h GLN 517 N 1.01 0.67 -0.01 -1.08 4.15 -1.31 -3.24 115.11 115.30 3k5v h GLN 517 Ca -0.09 -0.15 0.00 0.00 0.77 0.00 0.00 58.65 59.18 3k5v h GLN 517 Cb 1.34 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.94 3k5v h GLN 517 CO 0.04 0.67 -0.10 0.39 -1.93 0.00 0.00 178.83 177.90 3k5v n GLU 518 N -4.26 1.31 -3.89 1.69 1.02 -1.26 -5.03 120.64 110.22 3k5v n GLU 518 Ca 0.02 -0.80 -0.11 0.00 -0.02 0.00 0.00 57.16 56.26 3k5v n GLU 518 Cb 0.25 -1.11 -0.10 0.00 -0.02 0.00 0.00 31.44 30.47 3k5v n GLU 518 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3k5v s SER 519 N -1.05 0.08 -0.11 1.62 1.04 -1.22 -5.15 113.70 108.91 3k5v s SER 519 Ca 0.09 -0.32 -0.20 0.00 0.48 0.00 0.00 55.95 56.00 3k5v s SER 519 Cb 0.08 0.21 -0.04 0.00 0.10 0.00 0.00 66.02 66.37 3k5v s SER 519 CO 0.18 -0.42 0.58 -0.55 0.98 0.00 0.00 173.24 174.01 3k5v s SER 520 N -1.63 6.79 0.32 7.02 0.15 -1.26 -4.52 113.70 120.58 3k5v s SER 520 Ca -0.12 0.95 0.02 0.00 0.70 0.00 0.00 55.95 57.51 3k5v s SER 520 Cb -0.06 -2.34 0.54 0.00 -1.71 0.00 0.00 66.02 62.46 3k5v s SER 520 CO -0.00 -0.08 1.88 -0.29 1.20 0.00 0.00 173.24 175.94 3k5v h ILE 521 N 4.81 1.20 -0.74 6.45 2.10 -1.96 -2.18 117.51 127.19 3k5v h ILE 521 Ca -0.40 -0.70 0.11 0.00 1.08 0.00 0.00 64.86 64.96 3k5v h ILE 521 Cb 1.18 0.72 -0.08 0.00 -1.09 0.00 0.00 36.82 37.55 3k5v h ILE 521 CO 0.76 0.26 0.36 0.28 -1.08 0.00 0.00 178.15 178.72 3k5v h SER 522 N 0.67 0.44 -0.49 2.19 0.02 -1.93 -1.52 113.55 112.92 3k5v h SER 522 Ca 0.15 0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 61.11 3k5v h SER 522 Cb 0.24 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 3k5v h SER 522 CO -0.00 0.23 0.07 0.44 -1.14 0.00 0.00 176.83 176.42 3k5v h ASP 523 N 0.58 0.84 -0.28 3.07 3.32 -1.81 -1.85 116.42 120.28 3k5v h ASP 523 Ca 0.38 -0.18 -0.05 0.00 0.02 0.00 0.00 57.03 57.19 3k5v h ASP 523 Cb 0.45 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 3k5v h ASP 523 CO -0.31 0.86 -0.02 -0.33 -1.72 0.00 0.00 179.24 177.73 3k5v h GLU 524 N 0.83 0.51 -0.11 3.56 4.39 -1.14 -0.83 114.58 121.80 3k5v h GLU 524 Ca 0.17 -0.17 0.01 0.00 0.34 0.00 0.00 59.36 59.71 3k5v h GLU 524 Cb 0.40 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 3k5v h GLU 524 CO 0.01 0.68 0.02 0.28 -1.16 0.00 0.00 179.01 178.84 3k5v h VAL 525 N 0.29 0.96 -0.65 3.13 2.07 -1.21 0.15 116.25 120.98 3k5v h VAL 525 Ca 0.08 -0.02 0.09 0.00 0.82 0.00 0.00 66.70 67.66 3k5v h VAL 525 Cb 0.46 0.88 -0.07 0.00 -1.52 0.00 0.00 31.29 31.04 3k5v h VAL 525 CO 0.02 0.01 0.29 -0.08 0.02 0.00 0.00 177.57 177.83 3k5v h GLU 526 N 0.07 0.49 -0.63 1.57 4.81 -1.27 -0.11 114.58 119.51 3k5v h GLU 526 Ca 0.05 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.26 3k5v h GLU 526 Cb 0.04 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.27 3k5v h GLU 526 CO -0.06 0.33 0.42 -0.22 -0.73 0.00 0.00 179.01 178.74 3k5v h LYS 527 N 0.51 0.83 -0.50 1.92 3.64 -0.63 -2.86 116.57 119.47 3k5v h LYS 527 Ca 0.32 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.54 3k5v h LYS 527 Cb 0.35 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 3k5v h LYS 527 CO -0.27 0.55 -0.12 0.93 -2.27 0.00 0.00 179.45 178.27 3k5v h GLU 528 N 0.85 0.94 0.00 1.90 4.39 -0.25 -3.51 114.58 118.90 3k5v h GLU 528 Ca 0.23 -0.34 0.00 0.00 0.34 0.00 0.00 59.36 59.60 3k5v h GLU 528 Cb -0.09 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.50 3k5v h GLU 528 CO -0.05 1.00 0.00 1.28 -1.16 0.00 0.00 179.01 180.07