#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kyh h ILE 246 N 0.00 0.07 -0.23 0.52 -0.00 -2.04 -2.48 117.51 113.34 3kyh h ILE 246 Ca 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 64.86 64.91 3kyh h ILE 246 Cb 0.00 0.07 -0.07 0.00 -0.00 0.00 0.00 36.82 36.81 3kyh h ILE 246 CO 0.00 0.00 -0.48 -0.50 -0.00 0.00 0.00 178.15 177.17 3kyh h TRP 247 N -0.06 -1.42 -0.88 0.16 6.55 -2.10 0.43 115.95 118.63 3kyh h TRP 247 Ca 0.31 0.06 0.23 0.00 0.95 0.00 0.00 58.89 60.44 3kyh h TRP 247 Cb 0.58 0.65 -0.14 0.00 -0.86 0.00 0.00 29.16 29.40 3kyh h TRP 247 CO -0.78 -0.50 0.25 0.00 -1.05 0.00 0.00 178.44 176.36 3kyh h ALA 248 N 0.03 1.29 -2.81 1.49 0.00 -2.02 -3.42 119.26 113.82 3kyh h ALA 248 Ca 0.08 0.22 -0.55 0.00 0.00 0.00 0.00 54.91 54.65 3kyh h ALA 248 Cb 0.64 0.30 0.11 0.00 0.00 0.00 0.00 17.79 18.84 3kyh h ALA 248 CO -0.48 -0.46 0.68 1.04 0.00 0.00 0.00 179.25 180.03 3kyh n GLN 249 N -5.21 2.45 -2.57 0.00 1.13 0.14 -4.96 117.38 108.35 3kyh n GLN 249 Ca 0.21 0.86 -0.41 0.00 -1.94 0.00 0.00 57.00 55.73 3kyh n GLN 249 Cb 0.68 -2.56 -0.04 0.00 0.11 0.00 0.00 30.24 28.43 3kyh n GLN 249 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 3kyh s LYS 250 N -2.08 4.66 -0.72 -1.09 1.02 -1.26 -4.91 119.74 115.36 3kyh s LYS 250 Ca 0.55 1.66 -0.26 0.00 0.02 0.00 0.00 55.97 57.94 3kyh s LYS 250 Cb -0.50 -3.27 -0.09 0.00 -0.52 0.00 0.00 37.83 33.44 3kyh s LYS 250 CO 0.63 0.19 2.27 -0.46 -0.92 0.00 0.00 175.35 177.06 3kyh s TRP 251 N -0.53 1.29 0.16 3.18 -0.11 -1.26 -4.79 118.94 116.89 3kyh s TRP 251 Ca 0.47 1.53 0.14 0.00 1.22 0.00 0.00 56.10 59.46 3kyh s TRP 251 Cb -0.29 -3.64 0.39 0.00 -1.50 0.00 0.00 33.47 28.43 3kyh s TRP 251 CO 0.35 -1.91 1.60 0.87 -4.62 0.00 0.00 176.95 173.24 3kyh h LYS 252 N 14.37 0.00 0.00 5.86 6.56 -2.02 -3.34 116.57 138.00 3kyh h LYS 252 Ca -0.07 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.52 3kyh h LYS 252 Cb 1.08 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.74 3kyh h LYS 252 CO 1.10 0.55 0.00 -2.30 -2.06 0.00 0.00 179.45 176.74 3kyh n PRO 253 N -3.57 0.00 -0.39 3.15 -0.01 -1.26 -4.22 135.00 128.71 3kyh n PRO 253 Ca -0.00 0.00 -0.22 0.00 -0.01 0.00 0.00 63.50 63.27 3kyh n PRO 253 Cb 0.62 -0.97 -0.05 0.00 -0.01 0.00 0.00 33.50 33.10 3kyh n PRO 253 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 175.50 177.90 3kyh n THR 254 N -0.20 0.56 0.00 3.45 -1.04 -1.26 -3.49 114.28 112.30 3kyh n THR 254 Ca 0.00 -0.39 0.00 0.00 -2.04 0.00 0.00 64.05 61.62 3kyh n THR 254 Cb 0.00 -1.84 0.00 0.00 -1.82 0.00 0.00 70.33 66.67 3kyh n THR 254 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 3kyh n ILE 255 N 5.60 0.00 0.14 12.58 -5.35 -1.26 -4.86 119.36 126.22 3kyh n ILE 255 Ca 0.26 0.00 0.07 0.00 -0.27 0.00 0.00 62.75 62.81 3kyh n ILE 255 Cb 0.19 0.00 0.05 0.00 -1.74 0.00 0.00 39.64 38.14 3kyh n ILE 255 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 3kyh h LYS 256 N 0.00 0.00 -0.60 6.28 2.10 -1.95 -3.29 116.57 119.10 3kyh h LYS 256 Ca 0.00 0.00 -0.44 0.00 -2.00 0.00 0.00 60.65 58.21 3kyh h LYS 256 Cb 0.00 0.00 -0.34 0.00 -0.90 0.00 0.00 32.23 30.99 3kyh h LYS 256 CO 0.00 0.20 -0.74 0.00 -2.00 0.00 0.00 179.45 176.92 3kyh n ALA 257 N -2.20 4.77 0.49 0.07 0.00 -1.26 -4.79 120.51 117.58 3kyh n ALA 257 Ca 0.00 -3.69 0.11 0.00 0.00 0.00 0.00 53.44 49.87 3kyh n ALA 257 Cb 0.65 -0.34 -0.01 0.00 0.00 0.00 0.00 19.45 19.75 3kyh n ALA 257 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3kyh n LEU 258 N -0.79 0.58 0.25 0.00 7.94 -1.24 -3.68 117.00 120.05 3kyh n LEU 258 Ca 0.39 -0.01 0.14 0.00 -1.11 0.00 0.00 56.01 55.42 3kyh n LEU 258 Cb 0.91 -0.08 0.51 0.00 0.53 0.00 0.00 43.42 45.30 3kyh n LEU 258 CO 0.32 0.03 0.88 0.06 -1.11 0.00 0.00 177.39 177.57 3kyh h GLN 259 N 0.00 0.00 -4.56 1.96 -0.00 -1.87 -3.40 115.11 107.24 3kyh h GLN 259 Ca 0.00 0.00 -0.71 0.00 -0.00 0.00 0.00 58.65 57.94 3kyh h GLN 259 Cb 0.77 0.00 -0.23 0.00 -0.00 0.00 0.00 27.48 28.02 3kyh h GLN 259 CO 0.00 0.09 -0.49 -1.54 -0.00 0.00 0.00 178.83 176.90 3kyh s SER 260 N -5.96 5.85 0.00 0.06 1.04 -1.24 -5.27 113.70 108.18 3kyh s SER 260 Ca 0.02 -0.96 0.00 0.00 0.48 0.00 0.00 55.95 55.49 3kyh s SER 260 Cb 0.09 -2.07 0.00 0.00 0.10 0.00 0.00 66.02 64.14 3kyh s SER 260 CO 0.60 -0.40 0.13 -0.38 0.98 0.00 0.00 173.24 174.16 3kyh n ILE 261 N 5.05 0.00 -2.52 -1.02 5.41 -1.26 -5.01 119.36 120.01 3kyh n ILE 261 Ca -0.12 0.32 -0.19 0.00 1.00 0.00 0.00 62.75 63.77 3kyh n ILE 261 Cb 0.46 -0.71 0.02 0.00 -0.71 0.00 0.00 39.64 38.70 3kyh n ILE 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3kyh n ILE 268 N -0.33 1.83 -0.46 1.39 3.06 -1.26 -5.15 119.36 118.45 3kyh n ILE 268 Ca 0.00 -4.09 -0.18 0.00 -2.50 0.00 0.00 62.75 55.97 3kyh n ILE 268 Cb 0.00 -0.42 -0.03 0.00 0.54 0.00 0.00 39.64 39.73 3kyh n ILE 268 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 3kyh n ASP 269 N -0.36 0.07 -0.34 9.51 9.92 -1.26 -4.79 116.55 129.31 3kyh n ASP 269 Ca 0.27 0.35 0.28 0.00 -0.53 0.00 0.00 54.79 55.16 3kyh n ASP 269 Cb 0.75 -0.27 0.46 0.00 -0.64 0.00 0.00 41.12 41.41 3kyh n ASP 269 CO 0.00 0.00 0.00 -2.65 0.13 0.00 0.00 177.20 174.68 3kyh n PRO 270 N 0.61 -0.02 -3.84 -0.24 -0.02 -1.26 -4.76 135.00 125.47 3kyh n PRO 270 Ca 0.07 0.77 -0.04 0.00 -2.02 0.00 0.00 63.50 62.28 3kyh n PRO 270 Cb 0.02 -1.58 0.01 0.00 -0.02 0.00 0.00 33.50 31.92 3kyh n PRO 270 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3kyh s SER 271 N -4.27 -0.04 -0.17 2.55 1.04 -1.26 -4.93 113.70 106.62 3kyh s SER 271 Ca -0.04 -0.68 -0.02 0.00 0.48 0.00 0.00 55.95 55.68 3kyh s SER 271 Cb 0.19 0.55 0.01 0.00 0.10 0.00 0.00 66.02 66.87 3kyh s SER 271 CO 0.53 -1.08 2.54 2.22 0.98 0.00 0.00 173.24 178.43 3kyh n PHE 272 N -0.62 0.72 -0.10 5.02 1.16 -1.26 -2.97 117.46 119.42 3kyh n PHE 272 Ca -0.05 -1.56 0.00 0.00 -1.87 0.00 0.00 57.45 53.97 3kyh n PHE 272 Cb 0.60 -1.05 0.00 0.00 -1.61 0.00 0.00 39.48 37.42 3kyh n PHE 272 CO 0.00 0.00 0.00 1.28 -1.87 0.00 0.00 176.76 176.17 3kyh n LEU 273 N 1.30 0.00 0.00 5.98 4.77 -1.26 -5.05 117.00 122.75 3kyh n LEU 273 Ca 0.28 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 3kyh n LEU 273 Cb 0.63 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.72 3kyh n LEU 273 CO 0.20 0.00 0.00 -3.20 -1.33 0.00 0.00 177.39 173.06 3kyh n ASN 274 N 0.00 0.00 -4.84 -1.43 4.05 -1.16 -4.99 115.26 106.89 3kyh n ASN 274 Ca 0.00 0.00 -0.30 0.00 0.45 0.00 0.00 54.58 54.73 3kyh n ASN 274 Cb 0.00 -1.95 0.07 0.00 1.23 0.00 0.00 39.78 39.13 3kyh n ASN 274 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 177.26 174.48 3kyh s ILE 275 N -1.54 3.19 -0.32 -1.44 -4.36 -1.26 -4.80 121.20 110.67 3kyh s ILE 275 Ca 0.00 0.39 -0.04 0.00 -0.26 0.00 0.00 60.65 60.73 3kyh s ILE 275 Cb 0.00 -3.24 0.04 0.00 1.25 0.00 0.00 42.46 40.51 3kyh s ILE 275 CO 0.00 -0.50 0.06 -0.63 0.24 0.00 0.00 174.94 174.10 3kyh s ILE 276 N -3.26 3.44 -0.05 8.37 1.01 -1.26 -4.30 121.20 125.15 3kyh s ILE 276 Ca 0.60 -1.22 -0.30 0.00 0.00 0.00 0.00 60.65 59.73 3kyh s ILE 276 Cb -0.13 -2.95 -0.03 0.00 0.01 0.00 0.00 42.46 39.36 3kyh s ILE 276 CO 0.53 -0.13 1.23 -2.84 0.00 0.00 0.00 174.94 173.73 3kyh s PRO 277 N 1.34 4.34 -0.18 2.79 0.02 -1.26 -4.88 135.00 137.16 3kyh s PRO 277 Ca -0.03 1.71 -0.31 0.00 0.02 0.00 0.00 61.00 62.39 3kyh s PRO 277 Cb -0.19 -3.57 -0.08 0.00 0.02 0.00 0.00 34.50 30.67 3kyh s PRO 277 CO 0.01 -0.48 2.12 -0.25 -0.33 0.00 0.00 177.00 178.07 3kyh n ASP 278 N 5.30 3.21 0.00 2.53 9.92 -1.26 -4.96 116.55 131.28 3kyh n ASP 278 Ca 0.11 0.49 0.00 0.00 -0.53 0.00 0.00 54.79 54.86 3kyh n ASP 278 Cb 0.46 -1.46 0.00 0.00 -0.64 0.00 0.00 41.12 39.48 3kyh n ASP 278 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 3kyh n ASP 279 N 9.80 0.00 -0.10 -2.24 10.43 -1.26 -4.46 116.55 128.72 3kyh n ASP 279 Ca 0.29 0.00 -0.13 0.00 2.57 0.00 0.00 54.79 57.53 3kyh n ASP 279 Cb 0.37 0.00 -0.01 0.00 1.84 0.00 0.00 41.12 43.32 3kyh n ASP 279 CO 0.00 0.00 0.00 -0.78 -1.07 0.00 0.00 177.20 175.35 3kyh h ASP 280 N 0.00 0.95 0.00 -2.24 -0.00 -1.99 0.26 116.42 113.40 3kyh h ASP 280 Ca 0.00 -0.45 0.00 0.00 -0.00 0.00 0.00 57.03 56.58 3kyh h ASP 280 Cb 0.00 -0.27 0.00 0.00 -0.00 0.00 0.00 39.33 39.06 3kyh h ASP 280 CO 0.00 1.24 0.00 -0.11 -0.00 0.00 0.00 179.24 180.37 3kyh n LEU 281 N -4.04 0.13 -0.02 2.28 7.94 -1.26 -2.75 117.00 119.27 3kyh n LEU 281 Ca -0.02 0.47 -0.01 0.00 -1.11 0.00 0.00 56.01 55.34 3kyh n LEU 281 Cb 0.56 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.50 3kyh n LEU 281 CO 0.49 0.00 0.05 0.41 -1.11 0.00 0.00 177.39 177.23 3kyh n THR 282 N -0.50 -0.04 -0.29 1.96 -1.04 -1.25 0.12 114.28 113.25 3kyh n THR 282 Ca 0.00 0.21 0.11 0.00 -2.04 0.00 0.00 64.05 62.33 3kyh n THR 282 Cb 0.00 -0.27 0.26 0.00 -1.82 0.00 0.00 70.33 68.50 3kyh n THR 282 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 3kyh h LYS 283 N 0.00 0.25 0.00 -2.82 3.64 -0.46 -1.06 116.57 116.12 3kyh h LYS 283 Ca 0.01 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3kyh h LYS 283 Cb 0.02 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 3kyh h LYS 283 CO -0.05 0.16 -0.01 0.77 -2.27 0.00 0.00 179.45 178.05 3kyh h SER 284 N 0.25 0.01 -0.57 4.20 0.02 0.11 -2.12 113.55 115.45 3kyh h SER 284 Ca 0.51 -0.80 0.11 0.00 -0.84 0.00 0.00 61.79 60.77 3kyh h SER 284 Cb 0.98 -0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.41 3kyh h SER 284 CO -0.60 0.81 -0.22 0.58 -1.14 0.00 0.00 176.83 176.26 3kyh h VAL 285 N -0.79 0.32 -0.44 2.27 2.07 -0.64 0.11 116.25 119.14 3kyh h VAL 285 Ca -0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 3kyh h VAL 285 Cb 0.81 0.32 -0.08 0.00 -1.52 0.00 0.00 31.29 30.82 3kyh h VAL 285 CO 0.00 0.00 -0.48 1.56 0.02 0.00 0.00 177.57 178.67 3kyh h GLN 286 N -0.08 -0.26 -0.18 1.57 4.20 -1.04 0.41 115.11 119.72 3kyh h GLN 286 Ca 0.26 0.02 0.05 0.00 0.06 0.00 0.00 58.65 59.04 3kyh h GLN 286 Cb 0.49 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 3kyh h GLN 286 CO -0.62 -0.18 0.28 -0.44 -0.67 0.00 0.00 178.83 177.20 3kyh h ASP 287 N -0.27 0.00 0.00 1.46 5.19 -0.24 -0.30 116.42 122.26 3kyh h ASP 287 Ca 0.08 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.49 3kyh h ASP 287 Cb 0.47 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.98 3kyh h ASP 287 CO -0.56 0.00 0.00 1.87 -3.12 0.00 0.00 179.24 177.43 3kyh n TRP 288 N -3.51 0.00 0.00 4.55 -0.00 0.13 -2.59 117.44 116.01 3kyh n TRP 288 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.52 3kyh n TRP 288 Cb 0.39 -0.07 0.00 0.00 -0.00 0.00 0.00 31.31 31.63 3kyh n TRP 288 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 3kyh n VAL 289 N -0.90 0.00 0.00 5.87 0.31 -0.31 -1.81 118.33 121.49 3kyh n VAL 289 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 3kyh n VAL 289 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 3kyh n VAL 289 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3kyh n TYR 290 N -3.19 0.00 -0.19 3.52 9.36 -0.13 -2.99 117.16 123.55 3kyh n TYR 290 Ca 0.00 0.00 0.15 0.00 3.32 0.00 0.00 57.90 61.37 3kyh n TYR 290 Cb 0.00 0.00 0.23 0.00 -0.63 0.00 0.00 39.34 38.94 3kyh n TYR 290 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3kyh n ALA 291 N -2.20 0.53 -0.06 2.98 0.00 -1.07 -1.83 120.51 118.86 3kyh n ALA 291 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.62 3kyh n ALA 291 Cb 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 19.45 19.13 3kyh n ALA 291 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3kyh n THR 292 N -2.44 0.00 -0.32 0.00 -1.04 -0.75 -2.88 114.28 106.86 3kyh n THR 292 Ca 0.12 0.54 -0.08 0.00 -2.04 0.00 0.00 64.05 62.60 3kyh n THR 292 Cb 0.60 -1.49 -0.07 0.00 -1.82 0.00 0.00 70.33 67.56 3kyh n THR 292 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 3kyh n ILE 293 N -1.91 -0.51 -0.03 12.58 2.08 -0.76 0.25 119.36 131.05 3kyh n ILE 293 Ca 0.00 1.87 -0.01 0.00 0.56 0.00 0.00 62.75 65.17 3kyh n ILE 293 Cb 0.00 -2.32 -0.01 0.00 -0.75 0.00 0.00 39.64 36.56 3kyh n ILE 293 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3kyh n TYR 294 N -4.99 -0.03 0.29 1.39 9.36 -0.86 -0.31 117.16 122.01 3kyh n TYR 294 Ca 0.02 0.10 0.18 0.00 3.32 0.00 0.00 57.90 61.52 3kyh n TYR 294 Cb 0.21 -0.26 0.98 0.00 -0.63 0.00 0.00 39.34 39.65 3kyh n TYR 294 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 3kyh h SER 295 N 0.00 0.00 -3.05 2.98 4.64 -0.06 -3.40 113.55 114.67 3kyh h SER 295 Ca 0.01 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.79 3kyh h SER 295 Cb 0.03 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 3kyh h SER 295 CO -0.07 0.00 0.71 -0.63 -0.87 0.00 0.00 176.83 175.97 3kyh s ILE 296 N -4.43 3.95 0.57 0.95 1.01 0.58 -5.03 121.20 118.79 3kyh s ILE 296 Ca -0.05 1.34 -0.19 0.00 0.00 0.00 0.00 60.65 61.76 3kyh s ILE 296 Cb 0.14 -3.86 -0.07 0.00 0.01 0.00 0.00 42.46 38.67 3kyh s ILE 296 CO 0.48 0.03 0.75 0.00 0.00 0.00 0.00 174.94 176.20 3kyh n ALA 297 N 4.85 -0.49 0.22 9.38 0.00 -1.26 -4.84 120.51 128.37 3kyh n ALA 297 Ca 0.11 0.02 0.13 0.00 0.00 0.00 0.00 53.44 53.70 3kyh n ALA 297 Cb 0.45 -1.96 0.74 0.00 0.00 0.00 0.00 19.45 18.67 3kyh n ALA 297 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3kyh h PRO 298 N 0.46 0.00 0.39 0.00 0.13 -1.91 -3.05 132.00 128.02 3kyh h PRO 298 Ca -0.46 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.65 3kyh h PRO 298 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 3kyh h PRO 298 CO 0.50 0.00 -0.19 1.05 -0.23 0.00 0.00 178.00 179.13 3kyh h GLU 299 N 0.00 -0.51 -0.87 0.86 9.09 -2.02 -3.32 114.58 117.81 3kyh h GLU 299 Ca 0.05 0.03 0.00 0.00 0.05 0.00 0.00 59.36 59.50 3kyh h GLU 299 Cb 0.24 0.12 -0.04 0.00 -1.65 0.00 0.00 28.75 27.41 3kyh h GLU 299 CO -0.00 -0.34 0.54 -0.07 0.05 0.00 0.00 179.01 179.20 3kyh h LEU 300 N -0.69 1.02 0.00 3.06 4.07 -1.95 -3.33 115.31 117.49 3kyh h LEU 300 Ca -0.05 -0.05 0.00 0.00 0.08 0.00 0.00 57.88 57.86 3kyh h LEU 300 Cb 0.40 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 41.89 3kyh h LEU 300 CO 0.09 0.77 0.06 -1.14 -1.08 0.00 0.00 178.44 177.14 3kyh n ARG 301 N -4.38 0.00 -0.01 1.13 0.63 -1.15 -0.32 116.66 112.56 3kyh n ARG 301 Ca 0.10 0.00 0.08 0.00 -0.92 0.00 0.00 57.85 57.10 3kyh n ARG 301 Cb 0.05 -0.28 -0.15 0.00 0.45 0.00 0.00 32.46 32.53 3kyh n ARG 301 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 3kyh n SER 302 N -0.14 0.13 -2.23 6.15 2.88 -1.25 -4.30 113.62 114.86 3kyh n SER 302 Ca 0.00 0.05 -0.21 0.00 -1.33 0.00 0.00 58.87 57.38 3kyh n SER 302 Cb 0.06 1.61 -0.05 0.00 -0.75 0.00 0.00 64.21 65.07 3kyh n SER 302 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 3kyh n PHE 303 N -2.40 1.23 -3.56 0.66 3.01 0.57 -4.96 117.46 112.01 3kyh n PHE 303 Ca -0.08 -1.83 -0.37 0.00 1.01 0.00 0.00 57.45 56.18 3kyh n PHE 303 Cb 0.66 -1.29 -0.06 0.00 -0.01 0.00 0.00 39.48 38.78 3kyh n PHE 303 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3kyh s ILE 304 N -1.59 5.19 -0.16 4.37 1.01 -1.26 -0.40 121.20 128.36 3kyh s ILE 304 Ca 0.52 0.67 -0.00 0.00 0.00 0.00 0.00 60.65 61.83 3kyh s ILE 304 Cb 0.33 -3.65 0.04 0.00 0.01 0.00 0.00 42.46 39.19 3kyh s ILE 304 CO -0.13 0.52 -0.06 -0.70 0.00 0.00 0.00 174.94 174.57 3kyh s GLU 305 N -0.55 1.48 -0.84 2.79 2.12 0.13 -4.82 118.70 119.01 3kyh s GLU 305 Ca 0.21 -0.49 -0.05 0.00 0.36 0.00 0.00 54.97 54.99 3kyh s GLU 305 Cb -0.15 -1.96 0.21 0.00 0.26 0.00 0.00 34.13 32.49 3kyh s GLU 305 CO 0.09 -0.41 0.74 -1.17 -0.54 0.00 0.00 175.26 173.97 3kyh s LEU 306 N 1.63 5.80 0.31 2.70 2.96 -1.26 -1.17 118.68 129.66 3kyh s LEU 306 Ca 0.01 -3.29 -0.03 0.00 -0.22 0.00 0.00 54.13 50.61 3kyh s LEU 306 Cb -0.15 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 3kyh s LEU 306 CO -0.08 -0.32 0.55 -0.70 -1.32 0.00 0.00 176.35 174.48 3kyh s GLU 307 N -0.73 3.56 -0.06 1.98 2.56 0.62 -3.05 118.70 123.58 3kyh s GLU 307 Ca 0.23 -0.14 -0.01 0.00 0.00 0.00 0.00 54.97 55.05 3kyh s GLU 307 Cb -0.12 -2.66 0.03 0.00 2.00 0.00 0.00 34.13 33.38 3kyh s GLU 307 CO -0.09 0.19 0.01 1.41 -0.56 0.00 0.00 175.26 176.22 3kyh s MET 308 N -3.87 0.44 0.02 4.30 -2.45 0.93 -2.42 119.30 116.26 3kyh s MET 308 Ca 0.42 0.15 0.08 0.00 -1.25 0.00 0.00 55.69 55.09 3kyh s MET 308 Cb -0.10 -0.81 -0.02 0.00 1.25 0.00 0.00 34.83 35.15 3kyh s MET 308 CO 0.33 -0.27 -0.24 0.15 1.05 0.00 0.00 175.02 176.04 3kyh s LYS 309 N 1.83 1.74 -0.27 4.11 1.02 -0.81 -0.52 119.74 126.84 3kyh s LYS 309 Ca 0.02 -0.97 -0.14 0.00 0.02 0.00 0.00 55.97 54.91 3kyh s LYS 309 Cb -0.12 -1.81 -0.04 0.00 -0.52 0.00 0.00 37.83 35.33 3kyh s LYS 309 CO -0.04 0.48 0.31 -0.06 -0.92 0.00 0.00 175.35 175.12 3kyh s PHE 310 N -0.71 3.24 0.00 3.18 0.40 -1.06 -2.34 117.98 120.69 3kyh s PHE 310 Ca 0.10 0.31 0.00 0.00 -0.60 0.00 0.00 56.93 56.74 3kyh s PHE 310 Cb -0.09 -2.50 0.00 0.00 0.51 0.00 0.00 43.02 40.94 3kyh s PHE 310 CO 0.01 -0.20 0.00 0.41 0.70 0.00 0.00 175.22 176.14 3kyh n GLY 311 N 4.80 3.48 2.51 4.36 0.00 -1.17 -2.98 105.19 116.19 3kyh n GLY 311 Ca -0.10 -0.61 -0.28 0.00 0.00 0.00 0.00 46.02 45.02 3kyh n GLY 311 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kyh s VAL 312 N -1.37 0.58 -0.66 1.61 -7.23 -1.26 -1.49 120.40 110.58 3kyh s VAL 312 Ca 0.00 -2.31 -0.39 0.00 -1.81 0.00 0.00 61.98 57.47 3kyh s VAL 312 Cb 0.00 -1.41 -0.20 0.00 0.56 0.00 0.00 36.38 35.33 3kyh s VAL 312 CO 0.00 -1.05 2.33 -0.38 -0.31 0.00 0.00 175.10 175.69 3kyh n ILE 313 N 3.45 0.00 -4.77 -0.62 5.41 -1.26 -4.49 119.36 117.08 3kyh n ILE 313 Ca 0.18 -0.01 -0.33 0.00 1.00 0.00 0.00 62.75 63.59 3kyh n ILE 313 Cb 0.40 -0.54 -0.14 0.00 -0.71 0.00 0.00 39.64 38.65 3kyh n ILE 313 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 3kyh s ILE 314 N 7.07 3.02 0.64 1.39 1.01 0.98 -1.98 121.20 133.34 3kyh s ILE 314 Ca 1.25 -0.67 -0.10 0.00 0.00 0.00 0.00 60.65 61.13 3kyh s ILE 314 Cb -1.40 -2.27 -0.00 0.00 0.01 0.00 0.00 42.46 38.80 3kyh s ILE 314 CO 0.60 0.52 1.02 -0.62 0.00 0.00 0.00 174.94 176.46 3kyh s ASP 315 N 0.37 5.74 0.14 3.58 -1.08 -1.26 0.01 116.67 124.16 3kyh s ASP 315 Ca -0.11 1.11 0.26 0.00 -0.52 0.00 0.00 52.55 53.29 3kyh s ASP 315 Cb -0.16 -2.05 0.70 0.00 -1.46 0.00 0.00 42.92 39.96 3kyh s ASP 315 CO 0.06 -1.11 1.63 0.00 0.52 0.00 0.00 175.17 176.27 3kyh n ALA 316 N -2.80 2.59 0.20 3.66 0.00 -1.15 -3.77 120.51 119.22 3kyh n ALA 316 Ca 0.06 -0.13 0.06 0.00 0.00 0.00 0.00 53.44 53.43 3kyh n ALA 316 Cb 0.56 -1.35 0.23 0.00 0.00 0.00 0.00 19.45 18.89 3kyh n ALA 316 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3kyh n LYS 317 N -2.05 2.70 0.00 0.00 5.02 -1.26 -4.95 118.16 117.62 3kyh n LYS 317 Ca 0.05 -1.83 0.00 0.00 -2.02 0.00 0.00 58.31 54.51 3kyh n LYS 317 Cb 0.41 -1.64 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 3kyh n LYS 317 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kyh n GLY 318 N 0.88 2.85 0.36 0.72 0.00 -1.25 -5.02 105.19 103.73 3kyh n GLY 318 Ca 0.17 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.48 3kyh n GLY 318 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3kyh h PRO 319 N 0.00 1.14 -7.32 1.61 0.13 -1.93 -3.41 132.00 122.22 3kyh h PRO 319 Ca 0.00 -0.07 -0.51 0.00 -0.87 0.00 0.00 66.00 64.55 3kyh h PRO 319 Cb 0.00 -0.26 0.13 0.00 0.13 0.00 0.00 31.00 31.00 3kyh h PRO 319 CO 0.00 0.75 0.31 -0.51 -0.23 0.00 0.00 178.00 178.33 3kyh s ASP 320 N -5.93 4.45 0.37 1.44 -0.00 -1.26 -4.94 116.67 110.80 3kyh s ASP 320 Ca -0.13 1.79 -0.25 0.00 -0.00 0.00 0.00 52.55 53.96 3kyh s ASP 320 Cb 0.19 -2.50 -0.12 0.00 -0.00 0.00 0.00 42.92 40.49 3kyh s ASP 320 CO 0.81 -2.06 0.89 -1.14 -0.00 0.00 0.00 175.17 173.67 3kyh n ARG 321 N -3.54 1.14 -0.35 8.23 0.63 -1.26 -4.59 116.66 116.91 3kyh n ARG 321 Ca 0.09 0.40 -0.21 0.00 -0.92 0.00 0.00 57.85 57.21 3kyh n ARG 321 Cb 0.53 -1.82 0.20 0.00 0.45 0.00 0.00 32.46 31.82 3kyh n ARG 321 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67 3kyh n VAL 322 N -0.30 0.00 -2.65 5.15 3.14 -0.84 -4.97 118.33 117.86 3kyh n VAL 322 Ca 0.10 -0.12 -0.02 0.00 -2.96 0.00 0.00 64.34 61.34 3kyh n VAL 322 Cb 0.36 -0.85 0.11 0.00 -1.06 0.00 0.00 33.84 32.40 3kyh n VAL 322 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 3kyh n ASN 323 N -4.77 -1.05 -3.66 6.55 2.85 -1.26 -5.07 115.26 108.85 3kyh n ASN 323 Ca 0.10 -1.58 -0.30 0.00 -0.11 0.00 0.00 54.58 52.69 3kyh n ASN 323 Cb 0.42 1.03 0.28 0.00 1.24 0.00 0.00 39.78 42.75 3kyh n ASN 323 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 3kyh s PRO 324 N 0.01 -2.54 -1.35 1.20 0.04 -1.26 -4.84 135.00 126.26 3kyh s PRO 324 Ca 0.19 0.27 -0.10 0.00 0.04 0.00 0.00 61.00 61.40 3kyh s PRO 324 Cb 0.28 -1.41 0.12 0.00 0.04 0.00 0.00 34.50 33.53 3kyh s PRO 324 CO -0.21 -4.65 2.11 -2.30 0.04 0.00 0.00 177.00 171.99 3kyh n PRO 325 N -5.49 3.64 -4.00 0.56 -0.02 -1.26 -4.94 135.00 123.48 3kyh n PRO 325 Ca 0.11 -3.24 -0.08 0.00 -2.02 0.00 0.00 63.50 58.27 3kyh n PRO 325 Cb 0.59 -2.94 -0.09 0.00 -0.02 0.00 0.00 33.50 31.03 3kyh n PRO 325 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3kyh s VAL 326 N 0.81 0.18 -0.01 -1.45 -7.23 -1.26 -5.11 120.40 106.32 3kyh s VAL 326 Ca 0.46 -1.46 0.02 0.00 -1.81 0.00 0.00 61.98 59.19 3kyh s VAL 326 Cb 0.13 -1.23 0.03 0.00 0.56 0.00 0.00 36.38 35.86 3kyh s VAL 326 CO -0.03 -0.80 0.81 -0.24 -0.31 0.00 0.00 175.10 174.52 3kyh n SER 327 N 0.36 0.59 -4.22 4.85 2.88 -1.26 -4.84 113.62 111.98 3kyh n SER 327 Ca -0.16 -1.70 -0.24 0.00 -1.33 0.00 0.00 58.87 55.43 3kyh n SER 327 Cb 0.60 -0.11 -0.14 0.00 -0.75 0.00 0.00 64.21 63.81 3kyh n SER 327 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3kyh s SER 328 N -0.79 2.25 0.13 -3.46 1.04 -1.26 -4.27 113.70 107.33 3kyh s SER 328 Ca 0.04 -0.49 -0.28 0.00 0.48 0.00 0.00 55.95 55.69 3kyh s SER 328 Cb 0.03 -0.18 -0.16 0.00 0.10 0.00 0.00 66.02 65.81 3kyh s SER 328 CO 0.00 0.13 0.60 1.67 0.98 0.00 0.00 173.24 176.63 3kyh n GLN 329 N 1.91 0.00 -3.53 4.02 7.27 -1.26 -4.78 117.38 121.01 3kyh n GLN 329 Ca -0.17 0.00 -0.11 0.00 0.07 0.00 0.00 57.00 56.79 3kyh n GLN 329 Cb 0.54 -1.01 -0.04 0.00 2.41 0.00 0.00 30.24 32.13 3kyh n GLN 329 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3kyh s VAL 331 N -2.06 3.63 -0.80 0.00 1.01 -1.26 -1.84 120.40 119.08 3kyh s VAL 331 Ca -0.01 0.67 -0.23 0.00 0.00 0.00 0.00 61.98 62.42 3kyh s VAL 331 Cb -0.01 -3.76 0.07 0.00 0.00 0.00 0.00 36.38 32.69 3kyh s VAL 331 CO -0.02 -0.42 1.16 0.12 0.00 0.00 0.00 175.10 175.94 3kyh s PHE 332 N 5.97 2.64 -1.08 5.22 5.36 0.23 -4.97 117.98 131.35 3kyh s PHE 332 Ca 0.74 -0.65 -0.22 0.00 -0.96 0.00 0.00 56.93 55.84 3kyh s PHE 332 Cb -0.22 -4.45 0.02 0.00 -0.34 0.00 0.00 43.02 38.03 3kyh s PHE 332 CO 0.32 -1.78 1.69 0.95 -1.46 0.00 0.00 175.22 174.94 3kyh s THR 333 N 4.37 3.82 -0.20 0.12 -4.23 -1.26 -4.68 115.64 113.57 3kyh s THR 333 Ca 0.32 -0.98 -0.09 0.00 -1.18 0.00 0.00 61.69 59.76 3kyh s THR 333 Cb -0.09 -4.80 0.08 0.00 1.34 0.00 0.00 72.50 69.02 3kyh s THR 333 CO 0.04 -1.63 0.46 -0.70 -0.54 0.00 0.00 174.62 172.25 3kyh s GLU 334 N 5.43 0.40 -0.92 3.99 2.12 -1.26 -5.09 118.70 123.37 3kyh s GLU 334 Ca 0.56 1.00 -0.00 0.00 0.36 0.00 0.00 54.97 56.89 3kyh s GLU 334 Cb -0.01 0.24 0.30 0.00 0.26 0.00 0.00 34.13 34.93 3kyh s GLU 334 CO -0.01 -0.21 1.35 1.47 -0.54 0.00 0.00 175.26 177.33 3kyh n LEU 335 N 4.92 5.88 0.00 2.70 -0.00 -1.26 -2.63 117.00 126.62 3kyh n LEU 335 Ca -0.15 -5.36 0.00 0.00 -0.00 0.00 0.00 56.01 50.50 3kyh n LEU 335 Cb 0.52 -1.04 0.00 0.00 -0.00 0.00 0.00 43.42 42.90 3kyh n LEU 335 CO 0.02 1.93 0.00 0.47 -0.00 0.00 0.00 177.39 179.81 3kyh n ASP 336 N 0.72 0.00 -4.78 1.45 8.00 -1.26 -5.11 116.55 115.57 3kyh n ASP 336 Ca 0.32 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.46 3kyh n ASP 336 Cb 0.34 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.41 3kyh n ASP 336 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kyh s ALA 337 N 0.00 2.98 -0.23 2.24 0.00 -1.08 -2.96 121.76 122.71 3kyh s ALA 337 Ca 0.00 0.77 -0.26 0.00 0.00 0.00 0.00 51.96 52.47 3kyh s ALA 337 Cb 0.00 -3.31 0.08 0.00 0.00 0.00 0.00 23.12 19.89 3kyh s ALA 337 CO 0.00 -0.42 0.79 -3.38 0.00 0.00 0.00 175.76 172.75 3kyh s HIS 338 N -1.69 -0.69 -0.20 0.00 -3.43 0.10 -4.96 115.29 104.42 3kyh s HIS 338 Ca 0.63 1.60 0.01 0.00 -0.80 0.00 0.00 55.06 56.50 3kyh s HIS 338 Cb -0.23 0.32 0.03 0.00 -1.43 0.00 0.00 32.58 31.27 3kyh s HIS 338 CO 0.28 -0.39 -0.17 -1.17 -2.00 0.00 0.00 174.74 171.29 3kyh s LEU 339 N 0.04 2.46 -0.42 5.38 0.20 -1.26 -0.01 118.68 125.07 3kyh s LEU 339 Ca -0.01 -0.84 -0.10 0.00 0.69 0.00 0.00 54.13 53.87 3kyh s LEU 339 Cb -0.04 -1.49 0.07 0.00 -0.43 0.00 0.00 46.19 44.30 3kyh s LEU 339 CO 0.01 -0.05 0.26 -0.89 -0.29 0.00 0.00 176.35 175.39 3kyh s THR 340 N 1.25 4.39 0.28 3.68 2.01 -1.26 -4.90 115.64 121.08 3kyh s THR 340 Ca 0.01 -1.26 -0.29 0.00 0.31 0.00 0.00 61.69 60.46 3kyh s THR 340 Cb -0.15 -3.63 -0.10 0.00 0.01 0.00 0.00 72.50 68.63 3kyh s THR 340 CO -0.11 -0.46 1.31 -2.16 -0.69 0.00 0.00 174.62 172.51 3kyh s PRO 341 N 1.47 4.38 0.00 4.92 0.04 -1.26 -4.11 135.00 140.44 3kyh s PRO 341 Ca 0.03 2.15 0.00 0.00 0.04 0.00 0.00 61.00 63.22 3kyh s PRO 341 Cb -0.22 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.20 3kyh s PRO 341 CO 0.03 -0.20 0.00 -1.71 0.04 0.00 0.00 177.00 175.16 3kyh n ASN 342 N 1.56 0.00 -4.79 6.66 2.85 -1.16 -4.91 115.26 115.47 3kyh n ASN 342 Ca 0.03 0.00 -0.32 0.00 -0.11 0.00 0.00 54.58 54.18 3kyh n ASN 342 Cb 0.42 0.00 0.05 0.00 1.24 0.00 0.00 39.78 41.49 3kyh n ASN 342 CO 0.00 0.00 0.00 0.27 -2.11 0.00 0.00 177.26 175.42 3kyh s ILE 343 N 0.00 3.60 0.06 -1.44 -4.36 0.78 -4.84 121.20 115.00 3kyh s ILE 343 Ca 0.00 0.62 -0.31 0.00 -0.26 0.00 0.00 60.65 60.70 3kyh s ILE 343 Cb 0.00 -3.19 -0.08 0.00 1.25 0.00 0.00 42.46 40.44 3kyh s ILE 343 CO 0.00 -0.58 1.69 -0.62 0.24 0.00 0.00 174.94 175.67 3kyh s ASP 344 N -3.18 6.58 0.25 4.36 -1.08 -1.26 -4.36 116.67 117.99 3kyh s ASP 344 Ca 0.62 2.50 -0.11 0.00 -0.52 0.00 0.00 52.55 55.04 3kyh s ASP 344 Cb -0.17 -2.56 0.35 0.00 -1.46 0.00 0.00 42.92 39.08 3kyh s ASP 344 CO 0.48 -0.91 1.58 0.00 0.52 0.00 0.00 175.17 176.84 3kyh h ALA 345 N 8.57 0.50 0.68 3.66 0.00 -1.96 0.25 119.26 130.96 3kyh h ALA 345 Ca -0.43 0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 3kyh h ALA 345 Cb 1.20 0.69 0.00 0.00 0.00 0.00 0.00 17.79 19.68 3kyh h ALA 345 CO 0.93 -0.43 -0.37 0.77 0.00 0.00 0.00 179.25 180.15 3kyh h SER 346 N -0.01 -0.91 -0.52 0.00 0.02 -2.00 -0.32 113.55 109.80 3kyh h SER 346 Ca 0.40 0.04 0.05 0.00 -0.84 0.00 0.00 61.79 61.44 3kyh h SER 346 Cb 0.62 0.25 -0.07 0.00 0.14 0.00 0.00 62.40 63.35 3kyh h SER 346 CO -0.88 -0.60 -0.37 -0.07 -1.14 0.00 0.00 176.83 173.77 3kyh h LEU 347 N -0.97 -1.33 -0.97 5.07 3.38 -1.80 -2.30 115.31 116.40 3kyh h LEU 347 Ca -0.09 0.19 0.30 0.00 0.09 0.00 0.00 57.88 58.38 3kyh h LEU 347 Cb 0.77 0.58 -0.17 0.00 0.09 0.00 0.00 40.66 41.92 3kyh h LEU 347 CO 0.12 -0.18 0.23 0.15 0.09 0.00 0.00 178.44 178.85 3kyh h PHE 348 N -0.08 0.31 0.15 1.13 3.57 -0.13 0.89 116.94 122.78 3kyh h PHE 348 Ca 0.09 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.64 3kyh h PHE 348 Cb 0.30 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 3kyh h PHE 348 CO -0.90 -0.38 -0.13 0.87 -2.23 0.00 0.00 178.31 175.54 3kyh h LYS 349 N 0.07 -0.28 -0.30 1.11 1.57 -0.50 -2.84 116.57 115.39 3kyh h LYS 349 Ca 0.66 0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 59.42 3kyh h LYS 349 Cb 1.48 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.84 3kyh h LYS 349 CO -0.81 -0.19 0.02 0.93 -0.57 0.00 0.00 179.45 178.83 3kyh h GLU 350 N -0.30 0.45 -0.12 3.15 4.39 0.10 -2.97 114.58 119.28 3kyh h GLU 350 Ca -0.00 -0.08 -0.03 0.00 0.34 0.00 0.00 59.36 59.58 3kyh h GLU 350 Cb 0.27 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.84 3kyh h GLU 350 CO -0.02 0.46 -0.06 1.25 -1.16 0.00 0.00 179.01 179.49 3kyh h LEU 351 N 0.44 0.26 -1.35 1.33 5.85 -0.81 -2.79 115.31 118.25 3kyh h LEU 351 Ca 0.10 -0.41 -0.02 0.00 0.84 0.00 0.00 57.88 58.38 3kyh h LEU 351 Cb 0.26 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 3kyh h LEU 351 CO 0.01 0.62 0.16 -1.28 -0.34 0.00 0.00 178.44 177.60 3kyh h SER 352 N -0.09 0.54 -0.29 1.25 0.87 -1.33 -1.91 113.55 112.59 3kyh h SER 352 Ca 0.03 -0.06 -0.09 0.00 -1.23 0.00 0.00 61.79 60.44 3kyh h SER 352 Cb 0.52 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 3kyh h SER 352 CO 0.02 0.50 -0.17 0.11 -0.53 0.00 0.00 176.83 176.76 3kyh h LYS 353 N 0.60 0.63 -0.98 2.24 1.79 -1.62 0.70 116.57 119.93 3kyh h LYS 353 Ca 0.15 -0.29 0.15 0.00 -2.18 0.00 0.00 60.65 58.48 3kyh h LYS 353 Cb 0.14 -0.01 -0.09 0.00 -1.58 0.00 0.00 32.23 30.69 3kyh h LYS 353 CO -0.01 0.87 0.61 -0.92 -1.08 0.00 0.00 179.45 178.92 3kyh h TYR 354 N 0.37 1.02 0.02 -1.35 3.20 -1.09 0.36 116.97 119.50 3kyh h TYR 354 Ca 0.06 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.93 3kyh h TYR 354 Cb 0.70 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.66 3kyh h TYR 354 CO 0.06 0.34 -0.12 0.82 -1.64 0.00 0.00 178.16 177.62 3kyh h ILE 355 N 0.83 1.71 0.00 1.81 1.08 -1.04 -2.05 117.51 119.85 3kyh h ILE 355 Ca 0.51 -2.24 -0.00 0.00 -0.39 0.00 0.00 64.86 62.74 3kyh h ILE 355 Cb 0.70 3.22 -0.00 0.00 -3.07 0.00 0.00 36.82 37.67 3kyh h ILE 355 CO -0.28 0.59 -0.00 -0.09 -0.69 0.00 0.00 178.15 177.67 3kyh h ARG 356 N -0.84 0.00 0.03 2.37 1.12 0.53 0.86 114.38 118.45 3kyh h ARG 356 Ca -0.02 0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 58.85 3kyh h ARG 356 Cb 1.04 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.00 3kyh h ARG 356 CO 0.02 0.00 -0.01 0.78 -3.11 0.00 0.00 179.97 177.65 3kyh h GLY 357 N 0.02 -0.04 0.54 2.80 0.00 -0.39 -3.25 103.07 102.74 3kyh h GLY 357 Ca -0.00 0.01 0.19 0.00 0.00 0.00 0.00 47.33 47.53 3kyh h GLY 357 CO 0.00 -0.01 0.53 1.19 0.00 0.00 0.00 176.54 178.25 3kyh h ILE 358 N -0.64 0.70 -0.39 2.60 6.09 -1.24 0.25 117.51 124.88 3kyh h ILE 358 Ca -0.00 -0.08 -0.21 0.00 -1.37 0.00 0.00 64.86 63.20 3kyh h ILE 358 Cb 0.03 0.45 -0.12 0.00 0.47 0.00 0.00 36.82 37.65 3kyh h ILE 358 CO 0.01 0.04 0.26 -1.54 -3.07 0.00 0.00 178.15 173.85 3kyh n SER 359 N -4.42 3.43 0.00 2.19 3.41 0.30 -3.98 113.62 114.55 3kyh n SER 359 Ca 0.15 -2.64 0.00 0.00 -0.26 0.00 0.00 58.87 56.12 3kyh n SER 359 Cb 0.68 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 3kyh n SER 359 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 3kyh n GLU 360 N -0.11 0.00 -0.94 4.33 0.28 0.83 -4.83 120.64 120.20 3kyh n GLU 360 Ca 0.23 0.00 -0.35 0.00 -0.16 0.00 0.00 57.16 56.89 3kyh n GLU 360 Cb 0.94 -0.02 0.08 0.00 1.43 0.00 0.00 31.44 33.87 3kyh n GLU 360 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 177.13 178.52 3kyh n VAL 361 N 0.00 0.16 -0.16 3.84 3.14 -0.89 -4.87 118.33 119.55 3kyh n VAL 361 Ca 0.00 -0.35 0.14 0.00 -2.96 0.00 0.00 64.34 61.17 3kyh n VAL 361 Cb 0.04 -0.34 0.49 0.00 -1.06 0.00 0.00 33.84 32.97 3kyh n VAL 361 CO 0.00 0.00 0.00 0.71 -6.46 0.00 0.00 176.83 171.08 3kyh h THR 362 N -1.15 0.82 0.58 1.55 1.35 -1.96 -2.97 112.91 111.13 3kyh h THR 362 Ca -0.44 -0.16 -0.03 0.00 -0.55 0.00 0.00 66.41 65.24 3kyh h THR 362 Cb 1.30 0.33 0.01 0.00 -1.73 0.00 0.00 68.15 68.06 3kyh h THR 362 CO 0.31 0.08 -0.28 -0.08 -0.25 0.00 0.00 175.52 175.30 3kyh h GLU 363 N 0.45 -0.74 -6.03 4.72 4.57 -1.98 -3.40 114.58 112.16 3kyh h GLU 363 Ca 0.36 0.05 -0.59 0.00 -1.18 0.00 0.00 59.36 58.00 3kyh h GLU 363 Cb 0.78 0.17 -0.10 0.00 -0.16 0.00 0.00 28.75 29.43 3kyh h GLU 363 CO -0.12 -0.50 1.27 -0.80 -1.18 0.00 0.00 179.01 177.68 3kyh s ASN 364 N -4.44 6.41 0.00 1.04 -0.87 -1.12 -4.88 114.94 111.08 3kyh s ASN 364 Ca -0.11 -1.22 0.00 0.00 -1.57 0.00 0.00 52.86 49.95 3kyh s ASN 364 Cb 0.01 -2.54 0.00 0.00 -0.02 0.00 0.00 41.25 38.70 3kyh s ASN 364 CO 0.34 -1.55 0.00 0.35 -2.57 0.00 0.00 177.10 173.67 3kyh n THR 365 N 6.57 0.00 -0.29 1.60 -2.24 -1.26 -4.27 114.28 114.39 3kyh n THR 365 Ca 0.22 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.99 3kyh n THR 365 Cb 0.50 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.72 3kyh n THR 365 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kyh n GLY 366 N 5.00 1.59 0.06 3.38 0.00 -1.26 -3.07 105.19 110.89 3kyh n GLY 366 Ca 0.00 -0.08 -0.06 0.00 0.00 0.00 0.00 46.02 45.88 3kyh n GLY 366 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kyh n LYS 367 N 1.88 2.00 -4.14 1.61 4.76 -1.26 -4.96 118.16 118.05 3kyh n LYS 367 Ca 0.03 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 55.13 3kyh n LYS 367 Cb 0.29 -1.29 -0.14 0.00 -1.84 0.00 0.00 35.03 32.05 3kyh n LYS 367 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 3kyh s PHE 368 N -2.27 2.95 -0.15 2.13 0.40 -1.17 -4.21 117.98 115.65 3kyh s PHE 368 Ca -0.07 -0.77 0.01 0.00 -0.60 0.00 0.00 56.93 55.51 3kyh s PHE 368 Cb 0.03 -2.04 0.02 0.00 0.51 0.00 0.00 43.02 41.54 3kyh s PHE 368 CO 0.44 -0.40 -0.18 -1.54 0.70 0.00 0.00 175.22 174.24 3kyh s SER 369 N 1.10 2.90 -0.03 1.36 1.04 -1.16 -4.99 113.70 113.93 3kyh s SER 369 Ca 0.01 -0.56 -0.01 0.00 0.48 0.00 0.00 55.95 55.87 3kyh s SER 369 Cb -0.15 -1.33 -0.04 0.00 0.10 0.00 0.00 66.02 64.60 3kyh s SER 369 CO -0.01 0.01 0.07 -0.63 0.98 0.00 0.00 173.24 173.67 3kyh s ILE 370 N 1.13 4.69 -0.12 -1.02 1.09 -1.26 -2.19 121.20 123.53 3kyh s ILE 370 Ca -0.01 -0.32 -0.04 0.00 -1.10 0.00 0.00 60.65 59.18 3kyh s ILE 370 Cb -0.14 -3.09 0.06 0.00 -1.06 0.00 0.00 42.46 38.22 3kyh s ILE 370 CO -0.07 0.43 0.19 -0.63 -0.10 0.00 0.00 174.94 174.76 3kyh s ILE 371 N -1.10 -0.30 -0.06 2.92 1.01 0.38 -4.96 121.20 119.08 3kyh s ILE 371 Ca 0.20 0.24 -0.26 0.00 0.00 0.00 0.00 60.65 60.84 3kyh s ILE 371 Cb -0.12 -0.40 -0.03 0.00 0.01 0.00 0.00 42.46 41.92 3kyh s ILE 371 CO 0.10 0.07 0.80 -0.70 0.00 0.00 0.00 174.94 175.21 3kyh s GLU 372 N 2.32 4.45 -0.07 2.79 2.12 -1.26 -1.94 118.70 127.11 3kyh s GLU 372 Ca 0.03 1.05 0.00 0.00 0.36 0.00 0.00 54.97 56.42 3kyh s GLU 372 Cb -0.13 -3.47 0.02 0.00 0.26 0.00 0.00 34.13 30.81 3kyh s GLU 372 CO -0.07 -0.03 -0.05 -1.54 -0.54 0.00 0.00 175.26 173.02 3kyh s SER 373 N 0.92 1.43 -0.58 -1.70 1.04 -0.94 -5.05 113.70 108.81 3kyh s SER 373 Ca 0.42 -0.18 -0.07 0.00 0.48 0.00 0.00 55.95 56.60 3kyh s SER 373 Cb -0.18 -0.57 0.15 0.00 0.10 0.00 0.00 66.02 65.51 3kyh s SER 373 CO 0.20 -0.08 0.44 -1.10 0.98 0.00 0.00 173.24 173.68 3kyh s GLN 374 N 1.24 2.67 0.10 4.02 -0.21 -1.25 -2.74 119.66 123.49 3kyh s GLN 374 Ca -0.05 -2.16 0.01 0.00 0.02 0.00 0.00 55.36 53.18 3kyh s GLN 374 Cb -0.14 -3.92 0.01 0.00 1.00 0.00 0.00 33.01 29.97 3kyh s GLN 374 CO -0.02 -1.19 0.11 0.25 -2.12 0.00 0.00 175.29 172.32 3kyh n THR 375 N 4.22 0.00 -2.91 -0.19 -2.24 -0.83 -3.05 114.28 109.28 3kyh n THR 375 Ca 0.02 -0.35 -0.06 0.00 -2.27 0.00 0.00 64.05 61.39 3kyh n THR 375 Cb 0.41 -0.72 -0.01 0.00 -2.10 0.00 0.00 70.33 67.91 3kyh n THR 375 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3kyh s ARG 376 N -2.43 1.01 -0.10 -0.78 3.52 0.83 -2.43 118.95 118.57 3kyh s ARG 376 Ca 0.08 -1.08 -0.30 0.00 -0.13 0.00 0.00 55.73 54.31 3kyh s ARG 376 Cb -0.01 -0.21 -0.02 0.00 -1.56 0.00 0.00 34.95 33.15 3kyh s ARG 376 CO 0.05 -1.31 1.11 -0.51 -0.81 0.00 0.00 175.30 173.83 3kyh s ASP 377 N 0.93 7.13 -0.11 -2.12 -0.00 -1.18 -2.82 116.67 118.50 3kyh s ASP 377 Ca 0.28 1.64 -0.00 0.00 -0.00 0.00 0.00 52.55 54.47 3kyh s ASP 377 Cb -0.01 -2.55 -0.02 0.00 -0.00 0.00 0.00 42.92 40.34 3kyh s ASP 377 CO -0.07 -0.54 -0.10 -0.44 -0.00 0.00 0.00 175.17 174.02 3kyh s SER 378 N 1.32 4.34 0.30 0.27 0.01 -0.75 -2.67 113.70 116.51 3kyh s SER 378 Ca 0.51 -0.19 0.04 0.00 1.31 0.00 0.00 55.95 57.62 3kyh s SER 378 Cb -0.21 -1.43 -0.02 0.00 0.21 0.00 0.00 66.02 64.57 3kyh s SER 378 CO 0.18 0.24 0.45 -0.69 0.41 0.00 0.00 173.24 173.83 3kyh s VAL 379 N -0.08 4.86 -0.14 3.43 1.01 -1.21 -0.14 120.40 128.14 3kyh s VAL 379 Ca -0.01 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 60.99 3kyh s VAL 379 Cb -0.14 -3.73 0.04 0.00 0.00 0.00 0.00 36.38 32.55 3kyh s VAL 379 CO 0.03 -0.34 0.38 -0.31 0.00 0.00 0.00 175.10 174.87 3kyh s TYR 380 N -2.13 -0.41 0.52 5.22 1.51 -0.85 -2.19 117.35 119.01 3kyh s TYR 380 Ca 0.39 0.99 0.08 0.00 -1.01 0.00 0.00 57.07 57.52 3kyh s TYR 380 Cb -0.09 0.14 0.06 0.00 -0.11 0.00 0.00 41.96 41.96 3kyh s TYR 380 CO 0.32 -0.22 0.72 1.03 -1.11 0.00 0.00 175.55 176.28 3kyh s ARG 381 N 0.11 2.49 0.00 -0.62 1.81 -1.26 -2.80 118.95 118.68 3kyh s ARG 381 Ca -0.01 -1.42 0.00 0.00 -1.72 0.00 0.00 55.73 52.59 3kyh s ARG 381 Cb -0.03 -2.67 0.00 0.00 -0.45 0.00 0.00 34.95 31.80 3kyh s ARG 381 CO 0.01 -0.65 0.00 0.28 -0.68 0.00 0.00 175.30 174.25 3kyh n VAL 382 N -2.13 0.00 -2.01 3.52 0.31 -1.26 -4.98 118.33 111.78 3kyh n VAL 382 Ca 0.12 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.45 3kyh n VAL 382 Cb 0.60 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.53 3kyh n VAL 382 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3kyh n GLY 383 N 3.07 0.84 2.87 2.92 0.00 -1.26 -5.10 105.19 108.54 3kyh n GLY 383 Ca 0.00 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 3kyh n GLY 383 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3kyh s PRO 389 N 0.00 1.30 -0.07 1.61 0.04 -1.26 -5.26 135.00 131.36 3kyh s PRO 389 Ca 0.01 -0.68 0.02 0.00 0.04 0.00 0.00 61.00 60.39 3kyh s PRO 389 Cb 0.01 -2.26 -0.03 0.00 0.04 0.00 0.00 34.50 32.26 3kyh s PRO 389 CO -0.00 -0.55 -0.10 1.03 0.04 0.00 0.00 177.00 177.41 3kyh s ARG 390 N 1.60 2.75 -0.04 4.56 0.52 -1.26 -5.13 118.95 121.96 3kyh s ARG 390 Ca -0.02 -0.61 0.03 0.00 -0.52 0.00 0.00 55.73 54.60 3kyh s ARG 390 Cb -0.17 -2.53 0.00 0.00 0.52 0.00 0.00 34.95 32.77 3kyh s ARG 390 CO -0.07 0.59 -0.12 -0.06 0.02 0.00 0.00 175.30 175.66 3kyh s PHE 391 N -0.63 1.24 -0.16 -0.53 0.40 -1.26 -4.16 117.98 112.88 3kyh s PHE 391 Ca 0.09 -0.34 -0.00 0.00 -0.60 0.00 0.00 56.93 56.07 3kyh s PHE 391 Cb -0.11 -0.87 0.04 0.00 0.51 0.00 0.00 43.02 42.59 3kyh s PHE 391 CO 0.01 -0.14 -0.06 -0.51 0.70 0.00 0.00 175.22 175.23 3kyh s LEU 392 N 0.20 1.61 0.16 -0.37 1.43 -1.12 -4.54 118.68 116.04 3kyh s LEU 392 Ca -0.05 -0.65 -0.30 0.00 -1.03 0.00 0.00 54.13 52.10 3kyh s LEU 392 Cb -0.10 -0.92 -0.08 0.00 0.03 0.00 0.00 46.19 45.12 3kyh s LEU 392 CO 0.01 -0.18 1.27 -0.13 0.23 0.00 0.00 176.35 177.55 3kyh s ARG 393 N 1.63 4.42 -0.16 1.70 0.52 -0.06 -2.02 118.95 124.98 3kyh s ARG 393 Ca 0.01 1.95 -0.04 0.00 -0.52 0.00 0.00 55.73 57.13 3kyh s ARG 393 Cb -0.15 -3.24 0.06 0.00 0.52 0.00 0.00 34.95 32.13 3kyh s ARG 393 CO -0.08 -0.23 0.07 1.41 0.02 0.00 0.00 175.30 176.49 3kyh s MET 394 N 0.25 0.19 -0.80 3.54 1.75 0.80 -0.91 119.30 124.12 3kyh s MET 394 Ca 0.57 -0.10 -0.22 0.00 -1.25 0.00 0.00 55.69 54.69 3kyh s MET 394 Cb -0.34 -1.74 0.08 0.00 2.84 0.00 0.00 34.83 35.67 3kyh s MET 394 CO 0.35 -0.62 1.14 -1.12 -0.65 0.00 0.00 175.02 174.11 3kyh s SER 395 N 2.08 6.34 0.05 1.11 0.01 -0.77 -1.81 113.70 120.71 3kyh s SER 395 Ca 0.02 -1.25 -0.25 0.00 1.31 0.00 0.00 55.95 55.77 3kyh s SER 395 Cb -0.16 -2.46 -0.06 0.00 0.21 0.00 0.00 66.02 63.56 3kyh s SER 395 CO -0.08 -1.42 0.77 -0.89 0.41 0.00 0.00 173.24 172.03 3kyh s THR 396 N 4.12 4.70 1.12 1.44 2.01 -1.13 -0.33 115.64 127.58 3kyh s THR 396 Ca 0.31 1.64 -0.16 0.00 0.31 0.00 0.00 61.69 63.79 3kyh s THR 396 Cb -0.10 -4.12 0.25 0.00 0.01 0.00 0.00 72.50 68.54 3kyh s THR 396 CO 0.03 0.37 1.09 -0.62 -0.69 0.00 0.00 174.62 174.80 3kyh s ASP 397 N -0.13 1.59 0.00 3.53 -1.08 -1.20 -0.12 116.67 119.26 3kyh s ASP 397 Ca 0.38 0.90 0.00 0.00 -0.52 0.00 0.00 52.55 53.32 3kyh s ASP 397 Cb -0.21 -1.36 0.00 0.00 -1.46 0.00 0.00 42.92 39.89 3kyh s ASP 397 CO 0.23 -3.74 0.00 2.30 0.52 0.00 0.00 175.17 174.48 3kyh n ILE 398 N -4.54 0.00 -0.07 4.11 -6.64 -1.17 -4.08 119.36 106.97 3kyh n ILE 398 Ca 0.09 0.00 -0.22 0.00 -1.77 0.00 0.00 62.75 60.85 3kyh n ILE 398 Cb 0.58 0.25 -0.12 0.00 -1.44 0.00 0.00 39.64 38.91 3kyh n ILE 398 CO 0.00 0.00 0.00 2.29 -1.77 0.00 0.00 176.55 177.07 3kyh n LYS 399 N -1.36 0.65 -0.01 6.28 2.85 -1.26 -4.64 118.16 120.67 3kyh n LYS 399 Ca 0.00 0.37 -0.10 0.00 -1.05 0.00 0.00 58.31 57.53 3kyh n LYS 399 Cb 0.06 -1.68 -0.14 0.00 -0.65 0.00 0.00 35.03 32.62 3kyh n LYS 399 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 3kyh h THR 400 N -0.47 0.86 -5.66 0.58 2.02 -1.97 -3.49 112.91 104.77 3kyh h THR 400 Ca -0.45 -2.70 -0.23 0.00 0.77 0.00 0.00 66.41 63.80 3kyh h THR 400 Cb 1.69 2.45 0.11 0.00 -1.74 0.00 0.00 68.15 70.66 3kyh h THR 400 CO -0.11 0.54 -0.65 0.61 0.37 0.00 0.00 175.52 176.28 3kyh n GLY 401 N 1.58 -1.16 3.17 2.16 0.00 -1.26 -5.00 105.19 104.69 3kyh n GLY 401 Ca -0.17 0.53 -0.13 0.00 0.00 0.00 0.00 46.02 46.25 3kyh n GLY 401 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3kyh s ARG 402 N -4.38 0.33 -0.26 1.61 1.70 -1.26 -4.81 118.95 111.88 3kyh s ARG 402 Ca 0.31 0.42 -0.32 0.00 -0.47 0.00 0.00 55.73 55.68 3kyh s ARG 402 Cb -0.06 0.15 -0.08 0.00 -0.57 0.00 0.00 34.95 34.38 3kyh s ARG 402 CO 0.78 -0.05 2.18 0.28 -1.08 0.00 0.00 175.30 177.41 3kyh n VAL 403 N 3.02 0.30 0.79 4.99 0.31 -1.26 -3.21 118.33 123.27 3kyh n VAL 403 Ca -0.14 -0.35 0.09 0.00 -0.01 0.00 0.00 64.34 63.94 3kyh n VAL 403 Cb 0.58 -2.13 0.05 0.00 -0.91 0.00 0.00 33.84 31.43 3kyh n VAL 403 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3kyh n GLY 404 N 5.98 0.33 3.17 2.92 0.00 0.55 -4.97 105.19 113.18 3kyh n GLY 404 Ca 0.34 -0.54 0.05 0.00 0.00 0.00 0.00 46.02 45.87 3kyh n GLY 404 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3kyh s GLN 405 N -1.72 0.10 -0.34 1.61 -0.21 -1.26 -4.97 119.66 112.86 3kyh s GLN 405 Ca 0.20 0.19 -0.03 0.00 0.02 0.00 0.00 55.36 55.74 3kyh s GLN 405 Cb 0.15 0.11 0.07 0.00 1.00 0.00 0.00 33.01 34.34 3kyh s GLN 405 CO 0.30 -0.08 0.09 0.12 -2.12 0.00 0.00 175.29 173.59 3kyh s PHE 406 N 2.75 3.37 -0.03 0.91 2.19 -1.26 -1.86 117.98 124.06 3kyh s PHE 406 Ca -0.05 -1.97 -0.12 0.00 0.33 0.00 0.00 56.93 55.12 3kyh s PHE 406 Cb -0.07 -2.51 0.02 0.00 -1.31 0.00 0.00 43.02 39.15 3kyh s PHE 406 CO -0.11 -0.85 0.27 0.96 1.83 0.00 0.00 175.22 177.33 3kyh s ILE 407 N 1.24 0.05 -0.81 3.12 -4.36 -0.08 -3.87 121.20 116.49 3kyh s ILE 407 Ca -0.00 -0.41 -0.06 0.00 -0.26 0.00 0.00 60.65 59.91 3kyh s ILE 407 Cb -0.21 -0.54 0.21 0.00 1.25 0.00 0.00 42.46 43.17 3kyh s ILE 407 CO -0.01 -0.23 0.69 -0.70 0.24 0.00 0.00 174.94 174.93 3kyh s GLU 408 N -1.02 3.22 -0.28 0.37 2.12 0.21 -0.88 118.70 122.45 3kyh s GLU 408 Ca -0.11 -2.79 -0.28 0.00 0.36 0.00 0.00 54.97 52.15 3kyh s GLU 408 Cb -0.05 -4.07 -0.04 0.00 0.26 0.00 0.00 34.13 30.22 3kyh s GLU 408 CO 0.03 -1.24 2.12 0.21 -0.54 0.00 0.00 175.26 175.84 3kyh s LYS 409 N -0.48 3.09 0.07 4.30 2.20 -1.26 -2.43 119.74 125.23 3kyh s LYS 409 Ca 0.22 1.79 0.09 0.00 -0.36 0.00 0.00 55.97 57.71 3kyh s LYS 409 Cb -0.13 -4.35 -0.03 0.00 -1.51 0.00 0.00 37.83 31.81 3kyh s LYS 409 CO -0.08 -2.15 -0.24 1.03 -0.36 0.00 0.00 175.35 173.55 3kyh s ARG 410 N 6.34 1.75 -0.12 4.03 1.81 -0.37 -4.99 118.95 127.41 3kyh s ARG 410 Ca 0.94 -1.15 -0.05 0.00 -1.72 0.00 0.00 55.73 53.75 3kyh s ARG 410 Cb -0.29 -2.01 -0.04 0.00 -0.45 0.00 0.00 34.95 32.16 3kyh s ARG 410 CO 0.34 0.50 0.06 -1.58 -0.68 0.00 0.00 175.30 173.93 3kyh s HIS 411 N -0.93 3.32 0.00 -0.53 2.46 -1.26 0.43 115.29 118.78 3kyh s HIS 411 Ca 0.13 0.26 0.00 0.00 0.47 0.00 0.00 55.06 55.92 3kyh s HIS 411 Cb -0.10 -1.91 0.00 0.00 -0.13 0.00 0.00 32.58 30.43 3kyh s HIS 411 CO 0.04 0.46 0.00 0.28 -2.47 0.00 0.00 174.74 173.05 3kyh n VAL 412 N 2.49 0.00 -4.36 0.89 0.31 -1.25 -4.95 118.33 111.47 3kyh n VAL 412 Ca -0.18 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 63.93 3kyh n VAL 412 Cb 0.54 -0.24 -0.11 0.00 -0.91 0.00 0.00 33.84 33.12 3kyh n VAL 412 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3kyh s ALA 413 N -4.00 2.11 0.21 3.52 0.00 -1.25 -5.06 121.76 117.29 3kyh s ALA 413 Ca 0.00 -1.59 0.08 0.00 0.00 0.00 0.00 51.96 50.45 3kyh s ALA 413 Cb 0.00 -0.17 -0.04 0.00 0.00 0.00 0.00 23.12 22.91 3kyh s ALA 413 CO 0.00 0.19 -0.01 1.14 0.00 0.00 0.00 175.76 177.08 3kyh s GLN 414 N -3.14 2.33 -0.01 0.00 -2.07 -1.26 -3.28 119.66 112.23 3kyh s GLN 414 Ca 0.20 -1.23 0.02 0.00 -1.82 0.00 0.00 55.36 52.52 3kyh s GLN 414 Cb -0.04 -2.27 -0.03 0.00 -1.09 0.00 0.00 33.01 29.58 3kyh s GLN 414 CO 0.08 0.42 -0.04 -0.51 -1.32 0.00 0.00 175.29 173.91 3kyh s LEU 415 N -3.20 3.29 -0.20 2.60 1.43 0.13 -4.96 118.68 117.77 3kyh s LEU 415 Ca 0.28 -0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.30 3kyh s LEU 415 Cb -0.08 -1.86 0.02 0.00 0.03 0.00 0.00 46.19 44.30 3kyh s LEU 415 CO 0.19 0.29 -0.15 -0.76 0.23 0.00 0.00 176.35 176.15 3kyh s LEU 416 N -1.38 2.52 -0.36 1.79 1.43 -1.26 -0.51 118.68 120.91 3kyh s LEU 416 Ca 0.17 -0.71 -0.00 0.00 -1.03 0.00 0.00 54.13 52.56 3kyh s LEU 416 Cb -0.11 -1.55 0.09 0.00 0.03 0.00 0.00 46.19 44.65 3kyh s LEU 416 CO 0.08 -0.04 0.10 -0.76 0.23 0.00 0.00 176.35 175.95 3kyh s LEU 417 N 1.31 4.73 -0.43 1.79 1.02 0.11 0.78 118.68 127.99 3kyh s LEU 417 Ca 0.03 -1.89 -0.27 0.00 0.02 0.00 0.00 54.13 52.02 3kyh s LEU 417 Cb -0.14 -1.72 0.02 0.00 0.02 0.00 0.00 46.19 44.37 3kyh s LEU 417 CO -0.10 -0.41 1.02 -0.47 0.02 0.00 0.00 176.35 176.41 3kyh s TYR 418 N 1.08 2.95 -0.95 0.29 5.04 -0.77 -0.10 117.35 124.89 3kyh s TYR 418 Ca 0.06 0.69 -0.03 0.00 -2.44 0.00 0.00 57.07 55.34 3kyh s TYR 418 Cb -0.21 -4.02 0.24 0.00 0.35 0.00 0.00 41.96 38.32 3kyh s TYR 418 CO -0.05 -1.05 0.91 0.43 -1.34 0.00 0.00 175.55 174.45 3kyh n SER 419 N 7.27 4.65 0.22 4.32 7.64 -1.26 -2.10 113.62 134.35 3kyh n SER 419 Ca 0.09 -3.15 -0.15 0.00 1.01 0.00 0.00 58.87 56.67 3kyh n SER 419 Cb 0.48 -1.12 -0.07 0.00 -1.01 0.00 0.00 64.21 62.48 3kyh n SER 419 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3kyh h PRO 420 N 6.00 -0.55 0.00 1.43 0.13 -1.88 -2.48 132.00 134.65 3kyh h PRO 420 Ca 0.17 0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 3kyh h PRO 420 Cb 0.80 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.06 3kyh h PRO 420 CO 0.93 -0.37 0.00 1.63 -0.23 0.00 0.00 178.00 179.96 3kyh n LYS 421 N -5.36 0.00 -4.14 0.86 5.02 -1.26 -4.64 118.16 108.64 3kyh n LYS 421 Ca -0.10 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.05 3kyh n LYS 421 Cb 0.27 -1.31 -0.11 0.00 -0.02 0.00 0.00 35.03 33.86 3kyh n LYS 421 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3kyh s ASP 422 N -1.90 1.27 0.00 4.39 1.01 -0.94 -5.05 116.67 115.46 3kyh s ASP 422 Ca 0.00 -0.70 0.06 0.00 0.71 0.00 0.00 52.55 52.63 3kyh s ASP 422 Cb 0.00 0.01 0.34 0.00 1.01 0.00 0.00 42.92 44.28 3kyh s ASP 422 CO 0.00 -0.22 1.22 -1.54 0.21 0.00 0.00 175.17 174.85 3kyh n SER 423 N 0.98 0.17 -3.74 0.27 3.41 -1.26 -4.81 113.62 108.63 3kyh n SER 423 Ca -0.19 -1.84 -0.12 0.00 -0.26 0.00 0.00 58.87 56.46 3kyh n SER 423 Cb 0.56 -0.02 -0.13 0.00 -0.26 0.00 0.00 64.21 64.37 3kyh n SER 423 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3kyh s TYR 424 N -1.96 -0.33 0.71 7.33 1.51 -1.26 -5.00 117.35 118.34 3kyh s TYR 424 Ca 0.10 0.78 -0.05 0.00 -1.01 0.00 0.00 57.07 56.89 3kyh s TYR 424 Cb 0.05 0.07 0.09 0.00 -0.11 0.00 0.00 41.96 42.05 3kyh s TYR 424 CO 0.08 -0.21 1.00 -0.51 -1.11 0.00 0.00 175.55 174.79 3kyh s ASP 425 N 0.96 4.61 -0.04 2.29 1.01 -0.55 -4.61 116.67 120.34 3kyh s ASP 425 Ca -0.07 0.17 -0.01 0.00 0.71 0.00 0.00 52.55 53.34 3kyh s ASP 425 Cb -0.08 -0.73 0.03 0.00 1.01 0.00 0.00 42.92 43.15 3kyh s ASP 425 CO -0.06 -1.70 0.08 0.68 0.21 0.00 0.00 175.17 174.38 3kyh s VAL 426 N -3.20 -0.08 0.30 -1.27 -7.23 0.85 -3.02 120.40 106.75 3kyh s VAL 426 Ca 0.62 0.25 -0.16 0.00 -1.81 0.00 0.00 61.98 60.88 3kyh s VAL 426 Cb -0.09 -0.15 -0.09 0.00 0.56 0.00 0.00 36.38 36.61 3kyh s VAL 426 CO 0.44 0.10 0.73 -0.75 -0.31 0.00 0.00 175.10 175.32 3kyh s LYS 427 N 1.34 4.07 -0.10 4.82 2.20 -0.99 0.09 119.74 131.17 3kyh s LYS 427 Ca -0.06 0.72 -0.02 0.00 -0.36 0.00 0.00 55.97 56.25 3kyh s LYS 427 Cb -0.12 -2.55 0.03 0.00 -1.51 0.00 0.00 37.83 33.68 3kyh s LYS 427 CO -0.04 0.22 -0.00 0.42 -0.36 0.00 0.00 175.35 175.59 3kyh s ILE 428 N -1.86 0.49 -0.21 5.43 1.01 0.34 -1.92 121.20 124.48 3kyh s ILE 428 Ca 0.51 -0.08 -0.00 0.00 0.00 0.00 0.00 60.65 61.08 3kyh s ILE 428 Cb -0.12 -0.71 0.02 0.00 0.01 0.00 0.00 42.46 41.66 3kyh s ILE 428 CO 0.18 0.17 -0.14 -0.44 0.00 0.00 0.00 174.94 174.71 3kyh s SER 429 N 1.91 3.69 -0.78 3.58 0.01 -1.01 0.21 113.70 121.31 3kyh s SER 429 Ca 0.04 -0.74 -0.07 0.00 1.31 0.00 0.00 55.95 56.49 3kyh s SER 429 Cb -0.13 -1.56 0.20 0.00 0.21 0.00 0.00 66.02 64.73 3kyh s SER 429 CO -0.06 -0.05 0.66 -0.22 0.41 0.00 0.00 173.24 173.98 3kyh s LEU 430 N 1.30 5.87 0.00 2.44 0.20 -1.21 -0.27 118.68 127.01 3kyh s LEU 430 Ca 0.03 -3.02 0.02 0.00 0.69 0.00 0.00 54.13 51.84 3kyh s LEU 430 Cb -0.15 -2.00 0.02 0.00 -0.43 0.00 0.00 46.19 43.63 3kyh s LEU 430 CO -0.09 -0.39 0.17 -0.46 -0.29 0.00 0.00 176.35 175.28 3kyh n ASN 431 N 3.36 1.29 -4.30 3.68 2.04 -0.32 -3.75 115.26 117.28 3kyh n ASN 431 Ca 0.13 -1.57 -0.28 0.00 -0.44 0.00 0.00 54.58 52.43 3kyh n ASN 431 Cb 0.41 -0.05 -0.14 0.00 -2.53 0.00 0.00 39.78 37.47 3kyh n ASN 431 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 3kyh s LEU 432 N 0.00 2.18 -0.65 -4.53 1.43 0.17 -0.69 118.68 116.59 3kyh s LEU 432 Ca 0.13 -0.57 0.06 0.00 -1.03 0.00 0.00 54.13 52.71 3kyh s LEU 432 Cb -0.01 -1.12 0.22 0.00 0.03 0.00 0.00 46.19 45.31 3kyh s LEU 432 CO 0.08 0.20 0.65 -0.62 0.23 0.00 0.00 176.35 176.89 3kyh n GLU 433 N 1.74 2.19 -2.94 1.70 1.02 0.47 -1.23 120.64 123.58 3kyh n GLU 433 Ca -0.17 -4.53 -0.41 0.00 -0.02 0.00 0.00 57.16 52.02 3kyh n GLU 433 Cb 0.53 -2.22 -0.04 0.00 -0.02 0.00 0.00 31.44 29.68 3kyh n GLU 433 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3kyh s LEU 434 N -2.05 4.21 0.84 -4.62 1.43 -1.02 -4.81 118.68 112.67 3kyh s LEU 434 Ca 0.34 1.16 -0.11 0.00 -1.03 0.00 0.00 54.13 54.49 3kyh s LEU 434 Cb 0.08 -3.17 0.13 0.00 0.03 0.00 0.00 46.19 43.26 3kyh s LEU 434 CO -0.07 -0.32 1.19 -2.16 0.23 0.00 0.00 176.35 175.22 3kyh s PRO 435 N 1.78 1.45 0.05 1.29 0.04 -1.26 0.68 135.00 139.04 3kyh s PRO 435 Ca 0.38 -0.28 -0.17 0.00 0.04 0.00 0.00 61.00 60.96 3kyh s PRO 435 Cb -0.17 -1.99 -0.06 0.00 0.04 0.00 0.00 34.50 32.32 3kyh s PRO 435 CO 0.14 -1.84 0.50 0.08 0.04 0.00 0.00 177.00 175.92 3kyh s VAL 436 N -3.60 4.86 1.01 -0.36 1.01 -1.25 -4.81 120.40 117.26 3kyh s VAL 436 Ca 0.67 1.05 -0.12 0.00 0.00 0.00 0.00 61.98 63.58 3kyh s VAL 436 Cb -0.08 -3.82 0.17 0.00 0.00 0.00 0.00 36.38 32.66 3kyh s VAL 436 CO 0.49 0.55 0.92 -0.81 0.00 0.00 0.00 175.10 176.25 3kyh n PRO 437 N 1.71 -1.11 -1.84 2.72 -0.04 -1.26 -4.74 135.00 130.45 3kyh n PRO 437 Ca -0.12 -0.27 -0.21 0.00 -0.04 0.00 0.00 63.50 62.86 3kyh n PRO 437 Cb 0.51 -2.19 -0.07 0.00 -0.04 0.00 0.00 33.50 31.71 3kyh n PRO 437 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 3kyh s ASP 438 N -2.42 4.48 -0.05 3.54 3.84 -1.26 -4.76 116.67 120.04 3kyh s ASP 438 Ca 0.65 -0.63 -0.18 0.00 -0.00 0.00 0.00 52.55 52.40 3kyh s ASP 438 Cb -0.23 -2.57 0.04 0.00 -1.38 0.00 0.00 42.92 38.78 3kyh s ASP 438 CO 0.62 -3.44 0.41 0.20 -0.00 0.00 0.00 175.17 172.95 3kyh s ASN 439 N 8.80 -0.33 -1.20 2.11 0.01 -1.26 -5.11 114.94 117.96 3kyh s ASN 439 Ca 0.79 0.36 -0.05 0.00 -0.71 0.00 0.00 52.86 53.25 3kyh s ASN 439 Cb -0.08 0.47 0.10 0.00 0.41 0.00 0.00 41.25 42.16 3kyh s ASN 439 CO 0.07 -0.42 2.46 0.47 -1.51 0.00 0.00 177.10 178.17 3kyh n ASP 440 N 1.51 7.83 -0.38 -1.22 8.00 -1.26 -4.64 116.55 126.39 3kyh n ASP 440 Ca -0.19 -3.13 0.35 0.00 0.71 0.00 0.00 54.79 52.52 3kyh n ASP 440 Cb 0.56 -1.35 0.62 0.00 -0.02 0.00 0.00 41.12 40.94 3kyh n ASP 440 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 3kyh h PRO 441 N 4.37 0.01 0.00 -0.24 0.11 -1.95 -2.22 132.00 132.08 3kyh h PRO 441 Ca 0.66 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.77 3kyh h PRO 441 Cb 0.37 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.48 3kyh h PRO 441 CO 1.39 0.01 0.01 -2.30 -0.21 0.00 0.00 178.00 176.90 3kyh n PRO 442 N -5.05 0.00 -0.07 1.05 -0.02 -1.26 -0.24 135.00 129.40 3kyh n PRO 442 Ca 0.39 0.17 -0.11 0.00 -2.02 0.00 0.00 63.50 61.94 3kyh n PRO 442 Cb 1.39 -1.51 -0.06 0.00 -0.02 0.00 0.00 33.50 33.30 3kyh n PRO 442 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3kyh n GLU 443 N -1.15 0.35 0.00 -0.52 4.71 -0.87 -4.51 120.64 118.65 3kyh n GLU 443 Ca 0.00 0.09 0.09 0.00 -0.01 0.00 0.00 57.16 57.33 3kyh n GLU 443 Cb 0.01 -1.26 0.55 0.00 -1.01 0.00 0.00 31.44 29.73 3kyh n GLU 443 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 3kyh n LYS 444 N -3.01 0.98 -1.29 3.49 5.02 -0.01 -4.42 118.16 118.92 3kyh n LYS 444 Ca -0.26 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 55.80 3kyh n LYS 444 Cb 0.76 -1.29 -0.05 0.00 -0.02 0.00 0.00 35.03 34.43 3kyh n LYS 444 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3kyh n TYR 445 N -0.79 1.39 0.00 2.13 0.53 0.66 -3.94 117.16 117.14 3kyh n TYR 445 Ca 0.14 -1.89 0.00 0.00 -1.02 0.00 0.00 57.90 55.13 3kyh n TYR 445 Cb 0.06 -1.30 0.00 0.00 -1.03 0.00 0.00 39.34 37.07 3kyh n TYR 445 CO 0.00 0.00 0.00 1.63 -1.02 0.00 0.00 176.86 177.47 3kyh n LYS 446 N 0.94 1.30 0.00 -0.72 4.01 -1.26 -4.24 118.16 118.19 3kyh n LYS 446 Ca 0.43 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 58.23 3kyh n LYS 446 Cb 0.60 -0.99 0.00 0.00 -0.51 0.00 0.00 35.03 34.13 3kyh n LYS 446 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 3kyh n SER 447 N -1.62 0.00 -3.64 4.39 2.88 -1.25 -4.49 113.62 109.89 3kyh n SER 447 Ca 0.00 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.51 3kyh n SER 447 Cb 0.15 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.54 3kyh n SER 447 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 3kyh s GLN 448 N -1.17 0.29 0.13 -1.46 2.00 -1.26 -5.12 119.66 113.08 3kyh s GLN 448 Ca 0.00 0.44 0.01 0.00 -2.00 0.00 0.00 55.36 53.81 3kyh s GLN 448 Cb 0.00 0.09 -0.04 0.00 0.80 0.00 0.00 33.01 33.86 3kyh s GLN 448 CO 0.00 -0.05 0.28 -1.54 -0.50 0.00 0.00 175.29 173.48 3kyh s SER 449 N 0.84 6.36 0.61 6.67 1.04 -1.26 -4.94 113.70 123.02 3kyh s SER 449 Ca -0.04 0.26 -0.17 0.00 0.48 0.00 0.00 55.95 56.48 3kyh s SER 449 Cb -0.04 -1.95 -0.03 0.00 0.10 0.00 0.00 66.02 64.10 3kyh s SER 449 CO -0.12 0.07 1.14 -2.84 0.98 0.00 0.00 173.24 172.47 3kyh s PRO 450 N -2.99 3.00 -0.15 4.02 0.02 -1.26 -4.73 135.00 132.90 3kyh s PRO 450 Ca 0.36 1.57 0.17 0.00 0.02 0.00 0.00 61.00 63.11 3kyh s PRO 450 Cb -0.12 -1.96 0.71 0.00 0.02 0.00 0.00 34.50 33.15 3kyh s PRO 450 CO 0.28 -1.12 1.62 0.44 -0.33 0.00 0.00 177.00 177.89 3kyh n ILE 451 N -1.87 2.13 -3.57 2.83 -6.64 -0.93 -4.94 119.36 106.38 3kyh n ILE 451 Ca 0.12 -1.34 -0.16 0.00 -1.77 0.00 0.00 62.75 59.60 3kyh n ILE 451 Cb 0.51 -0.02 -0.06 0.00 -1.44 0.00 0.00 39.64 38.63 3kyh n ILE 451 CO 0.00 0.00 0.00 -0.44 -1.77 0.00 0.00 176.55 174.34 3kyh s SER 452 N -1.01 -0.68 -0.27 7.28 0.01 -1.26 -4.94 113.70 112.83 3kyh s SER 452 Ca 0.50 0.99 -0.01 0.00 1.31 0.00 0.00 55.95 58.73 3kyh s SER 452 Cb 0.35 0.89 0.16 0.00 0.21 0.00 0.00 66.02 67.63 3kyh s SER 452 CO 0.20 -0.45 0.46 -0.70 0.41 0.00 0.00 173.24 173.15 3kyh s GLU 453 N -0.56 0.43 0.39 12.44 2.12 -1.26 -3.34 118.70 128.93 3kyh s GLU 453 Ca -0.06 0.64 0.08 0.00 0.36 0.00 0.00 54.97 55.99 3kyh s GLU 453 Cb -0.02 -0.11 -0.00 0.00 0.26 0.00 0.00 34.13 34.26 3kyh s GLU 453 CO 0.06 -0.69 0.48 1.03 -0.54 0.00 0.00 175.26 175.60 3kyh s ARG 454 N 2.66 2.83 -0.07 4.30 0.52 -1.09 -2.94 118.95 125.15 3kyh s ARG 454 Ca 0.15 -1.25 -0.02 0.00 -0.52 0.00 0.00 55.73 54.09 3kyh s ARG 454 Cb -0.15 -2.67 0.03 0.00 0.52 0.00 0.00 34.95 32.68 3kyh s ARG 454 CO -0.19 -0.15 0.04 0.99 0.02 0.00 0.00 175.30 176.01 3kyh s THR 455 N -2.33 0.12 -0.29 0.02 2.01 0.07 -3.08 115.64 112.16 3kyh s THR 455 Ca 0.50 0.22 -0.01 0.00 0.31 0.00 0.00 61.69 62.71 3kyh s THR 455 Cb -0.08 -0.38 0.05 0.00 0.01 0.00 0.00 72.50 72.10 3kyh s THR 455 CO 0.31 0.17 -0.03 -0.54 -0.69 0.00 0.00 174.62 173.84 3kyh s LYS 456 N 2.07 2.44 -1.47 4.92 1.02 -1.02 -0.38 119.74 127.32 3kyh s LYS 456 Ca 0.05 -1.25 -0.09 0.00 0.02 0.00 0.00 55.97 54.69 3kyh s LYS 456 Cb -0.13 -3.10 0.02 0.00 -0.52 0.00 0.00 37.83 34.11 3kyh s LYS 456 CO -0.05 -0.59 2.53 -3.47 -0.92 0.00 0.00 175.35 172.86 3kyh n ASP 457 N 4.59 7.15 -4.73 2.83 2.03 0.91 -1.96 116.55 127.37 3kyh n ASP 457 Ca -0.14 -2.84 -0.41 0.00 0.52 0.00 0.00 54.79 51.92 3kyh n ASP 457 Cb 0.43 -1.52 -0.04 0.00 -0.72 0.00 0.00 41.12 39.28 3kyh n ASP 457 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 3kyh s ARG 458 N 1.26 4.60 0.00 -0.67 3.52 -1.11 -3.17 118.95 123.38 3kyh s ARG 458 Ca 0.57 1.65 0.03 0.00 -0.13 0.00 0.00 55.73 57.86 3kyh s ARG 458 Cb 0.16 -3.32 -0.01 0.00 -1.56 0.00 0.00 34.95 30.23 3kyh s ARG 458 CO -0.07 0.06 -0.11 0.08 -0.81 0.00 0.00 175.30 174.46 3kyh s VAL 459 N 0.03 0.82 -0.01 7.11 1.01 0.13 -2.22 120.40 127.27 3kyh s VAL 459 Ca 0.50 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 61.93 3kyh s VAL 459 Cb -0.28 -0.71 0.00 0.00 0.00 0.00 0.00 36.38 35.39 3kyh s VAL 459 CO 0.33 0.14 -0.05 -0.55 0.00 0.00 0.00 175.10 174.97 3kyh s SER 460 N -0.48 0.66 -0.15 3.32 0.15 -0.82 -0.16 113.70 116.22 3kyh s SER 460 Ca 0.03 -0.10 -0.01 0.00 0.70 0.00 0.00 55.95 56.57 3kyh s SER 460 Cb -0.05 -0.13 0.04 0.00 -1.71 0.00 0.00 66.02 64.17 3kyh s SER 460 CO -0.00 0.04 -0.04 -0.31 1.20 0.00 0.00 173.24 174.13 3kyh s TYR 461 N 0.09 1.52 0.24 3.44 1.51 -0.90 -0.47 117.35 122.78 3kyh s TYR 461 Ca -0.01 -0.93 0.07 0.00 -1.01 0.00 0.00 57.07 55.19 3kyh s TYR 461 Cb -0.05 -1.23 -0.04 0.00 -0.11 0.00 0.00 41.96 40.53 3kyh s TYR 461 CO -0.00 -0.58 0.15 0.42 -1.11 0.00 0.00 175.55 174.43 3kyh s ILE 462 N 1.69 4.29 -0.42 2.71 1.09 -0.93 0.12 121.20 129.74 3kyh s ILE 462 Ca 0.02 -1.43 0.07 0.00 -1.10 0.00 0.00 60.65 58.20 3kyh s ILE 462 Cb -0.15 -3.29 0.18 0.00 -1.06 0.00 0.00 42.46 38.14 3kyh s ILE 462 CO -0.08 -0.31 0.60 -2.28 -0.10 0.00 0.00 174.94 172.78 3kyh s HIS 463 N -2.09 -1.45 -0.98 3.97 2.46 -0.65 -2.99 115.29 113.56 3kyh s HIS 463 Ca 0.32 -0.10 0.16 0.00 0.47 0.00 0.00 55.06 55.91 3kyh s HIS 463 Cb -0.08 0.19 0.67 0.00 -0.13 0.00 0.00 32.58 33.23 3kyh s HIS 463 CO 0.24 -1.16 1.50 0.09 -2.47 0.00 0.00 174.74 172.94 3kyh n ASN 464 N 4.10 0.03 0.04 9.88 3.02 -1.26 -2.35 115.26 128.72 3kyh n ASN 464 Ca 0.13 0.51 -0.09 0.00 -0.03 0.00 0.00 54.58 55.10 3kyh n ASN 464 Cb 0.55 -0.51 -0.13 0.00 -0.61 0.00 0.00 39.78 39.08 3kyh n ASN 464 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 3kyh h ASP 465 N 0.00 0.05 -1.90 6.41 3.45 -1.94 -3.40 116.42 119.09 3kyh h ASP 465 Ca 0.00 -0.06 0.00 0.00 0.43 0.00 0.00 57.03 57.40 3kyh h ASP 465 Cb 0.27 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.02 3kyh h ASP 465 CO 0.00 1.05 0.00 -1.54 -1.57 0.00 0.00 179.24 177.18 3kyh n SER 466 N -3.30 0.00 -2.95 6.45 3.41 -1.22 -5.07 113.62 110.94 3kyh n SER 466 Ca -0.06 -0.15 -0.20 0.00 -0.26 0.00 0.00 58.87 58.20 3kyh n SER 466 Cb 0.98 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.91 3kyh n SER 466 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kyh s THR 468 N -3.48 -0.04 -0.05 0.00 2.01 -0.99 -1.21 115.64 111.88 3kyh s THR 468 Ca 0.41 0.15 0.05 0.00 0.31 0.00 0.00 61.69 62.61 3kyh s THR 468 Cb 0.35 -0.15 -0.02 0.00 0.01 0.00 0.00 72.50 72.70 3kyh s THR 468 CO -0.09 0.06 -0.19 -0.60 -0.69 0.00 0.00 174.62 173.11 3kyh s ARG 469 N 0.84 2.44 -0.33 4.92 3.52 -0.69 -1.64 118.95 128.00 3kyh s ARG 469 Ca -0.07 -0.79 -0.02 0.00 -0.13 0.00 0.00 55.73 54.72 3kyh s ARG 469 Cb -0.09 -2.27 0.07 0.00 -1.56 0.00 0.00 34.95 31.10 3kyh s ARG 469 CO -0.03 0.56 0.07 0.42 -0.81 0.00 0.00 175.30 175.51 3kyh s ILE 470 N -0.58 3.15 -0.93 4.11 1.01 0.32 -1.11 121.20 127.16 3kyh s ILE 470 Ca 0.08 -1.56 -0.15 0.00 0.00 0.00 0.00 60.65 59.03 3kyh s ILE 470 Cb -0.11 -2.91 0.20 0.00 0.01 0.00 0.00 42.46 39.65 3kyh s ILE 470 CO 0.01 -0.28 0.97 -1.81 0.00 0.00 0.00 174.94 173.82 3kyh s ASP 471 N 1.42 6.84 -0.51 3.58 1.11 0.18 -2.11 116.67 127.18 3kyh s ASP 471 Ca -0.01 -2.68 -0.28 0.00 0.18 0.00 0.00 52.55 49.76 3kyh s ASP 471 Cb -0.20 -2.28 0.02 0.00 1.07 0.00 0.00 42.92 41.53 3kyh s ASP 471 CO -0.02 -0.67 1.36 -0.63 1.18 0.00 0.00 175.17 176.39 3kyh s ILE 472 N 0.73 3.89 -0.19 0.77 -1.09 0.78 -2.68 121.20 123.42 3kyh s ILE 472 Ca 0.26 0.84 -0.02 0.00 -2.23 0.00 0.00 60.65 59.50 3kyh s ILE 472 Cb -0.08 -4.42 0.05 0.00 -1.58 0.00 0.00 42.46 36.44 3kyh s ILE 472 CO -0.08 -1.04 -0.00 -0.89 -1.23 0.00 0.00 174.94 171.69 3kyh s THR 473 N 5.57 0.83 -0.16 2.92 2.01 -0.79 0.19 115.64 126.21 3kyh s THR 473 Ca 0.54 -0.64 -0.22 0.00 0.31 0.00 0.00 61.69 61.67 3kyh s THR 473 Cb -0.11 -1.19 -0.03 0.00 0.01 0.00 0.00 72.50 71.19 3kyh s THR 473 CO 0.28 -0.08 0.69 -0.75 -0.69 0.00 0.00 174.62 174.07 3kyh s LYS 474 N 1.73 4.29 -0.16 4.92 2.36 -1.19 -1.44 119.74 130.25 3kyh s LYS 474 Ca -0.01 0.76 0.01 0.00 -2.55 0.00 0.00 55.97 54.19 3kyh s LYS 474 Cb -0.17 -3.54 0.02 0.00 -1.05 0.00 0.00 37.83 33.09 3kyh s LYS 474 CO -0.07 -0.17 -0.19 0.54 1.55 0.00 0.00 175.35 177.01 3kyh s VAL 475 N 1.65 1.93 -0.18 4.02 0.11 0.10 -0.06 120.40 127.96 3kyh s VAL 475 Ca 0.33 -0.87 -0.11 0.00 -2.93 0.00 0.00 61.98 58.40 3kyh s VAL 475 Cb -0.16 -1.75 -0.05 0.00 -1.53 0.00 0.00 36.38 32.89 3kyh s VAL 475 CO 0.13 0.52 0.19 -1.61 -3.33 0.00 0.00 175.10 170.99 3kyh s GLU 476 N 1.24 4.19 0.13 1.54 2.02 0.49 0.14 118.70 128.44 3kyh s GLU 476 Ca 0.03 -0.10 0.07 0.00 0.02 0.00 0.00 54.97 54.98 3kyh s GLU 476 Cb -0.13 -3.41 -0.04 0.00 0.10 0.00 0.00 34.13 30.64 3kyh s GLU 476 CO -0.10 0.30 -0.05 -0.80 0.02 0.00 0.00 175.26 174.63 3kyh s ASN 477 N 0.35 4.64 -0.36 -0.19 -0.87 -1.13 -0.75 114.94 116.63 3kyh s ASN 477 Ca 0.11 -0.36 0.01 0.00 -1.57 0.00 0.00 52.86 51.06 3kyh s ASN 477 Cb -0.12 -0.96 0.15 0.00 -0.02 0.00 0.00 41.25 40.30 3kyh s ASN 477 CO 0.00 0.14 0.29 -1.00 -2.57 0.00 0.00 177.10 173.97 3kyh s HIS 478 N -1.45 0.19 -3.15 2.20 3.76 -1.15 -4.60 115.29 111.10 3kyh s HIS 478 Ca 0.25 -1.20 0.00 0.00 -0.15 0.00 0.00 55.06 53.95 3kyh s HIS 478 Cb -0.10 -0.65 0.00 0.00 1.11 0.00 0.00 32.58 32.93 3kyh s HIS 478 CO 0.16 -0.90 0.00 0.45 -0.85 0.00 0.00 174.74 173.60 3kyh n SER 487 N 4.17 0.00 -3.60 1.40 2.88 -1.26 -4.99 113.62 112.22 3kyh n SER 487 Ca 0.11 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.60 3kyh n SER 487 Cb 0.41 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.84 3kyh n SER 487 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 3kyh s GLU 488 N -1.42 0.35 0.10 -1.46 2.56 -1.26 -5.16 118.70 112.41 3kyh s GLU 488 Ca 0.00 -0.02 0.01 0.00 0.00 0.00 0.00 54.97 54.96 3kyh s GLU 488 Cb 0.00 0.16 -0.04 0.00 2.00 0.00 0.00 34.13 36.25 3kyh s GLU 488 CO 0.00 -0.13 0.22 0.95 -0.56 0.00 0.00 175.26 175.74 3kyh s THR 489 N -1.73 5.23 -0.02 -1.70 -4.23 -1.26 -2.84 115.64 109.09 3kyh s THR 489 Ca 0.06 -0.56 0.04 0.00 -1.18 0.00 0.00 61.69 60.05 3kyh s THR 489 Cb -0.01 -3.60 -0.01 0.00 1.34 0.00 0.00 72.50 70.22 3kyh s THR 489 CO -0.04 0.05 -0.16 -0.89 -0.54 0.00 0.00 174.62 173.04 3kyh s THR 490 N -1.59 1.26 -0.38 3.99 2.01 0.36 -4.96 115.64 116.34 3kyh s THR 490 Ca 0.34 -0.66 -0.03 0.00 0.31 0.00 0.00 61.69 61.65 3kyh s THR 490 Cb -0.12 -1.06 0.09 0.00 0.01 0.00 0.00 72.50 71.41 3kyh s THR 490 CO 0.27 0.36 0.15 -1.00 -0.69 0.00 0.00 174.62 173.71 3kyh s HIS 491 N -0.19 3.47 0.20 4.92 3.76 -1.26 -0.73 115.29 125.46 3kyh s HIS 491 Ca 0.02 -2.15 0.10 0.00 -0.15 0.00 0.00 55.06 52.88 3kyh s HIS 491 Cb -0.08 -2.86 -0.04 0.00 1.11 0.00 0.00 32.58 30.71 3kyh s HIS 491 CO 0.00 -0.90 -0.17 -1.83 -0.85 0.00 0.00 174.74 170.98 3kyh s GLU 492 N 1.21 1.76 -0.05 1.40 -1.05 -0.52 -0.16 118.70 121.29 3kyh s GLU 492 Ca 0.04 -1.45 0.01 0.00 -0.15 0.00 0.00 54.97 53.42 3kyh s GLU 492 Cb -0.22 -1.97 0.02 0.00 -0.44 0.00 0.00 34.13 31.52 3kyh s GLU 492 CO -0.03 0.41 -0.07 0.08 0.95 0.00 0.00 175.26 176.60 3kyh s VAL 493 N -1.78 0.68 0.13 1.83 1.01 -1.26 -1.88 120.40 119.13 3kyh s VAL 493 Ca 0.23 -0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.00 3kyh s VAL 493 Cb -0.08 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 3kyh s VAL 493 CO 0.13 0.25 0.02 -1.61 0.00 0.00 0.00 175.10 173.89 3kyh s GLU 494 N 0.80 0.93 -0.03 2.72 2.02 -1.09 -2.56 118.70 121.49 3kyh s GLU 494 Ca -0.12 -1.43 0.01 0.00 0.02 0.00 0.00 54.97 53.45 3kyh s GLU 494 Cb -0.14 0.05 0.03 0.00 0.10 0.00 0.00 34.13 34.16 3kyh s GLU 494 CO 0.01 -0.18 -0.01 -0.51 0.02 0.00 0.00 175.26 174.59 3kyh s LEU 495 N -3.07 1.22 0.10 1.80 1.02 0.32 -0.64 118.68 119.43 3kyh s LEU 495 Ca 0.21 -0.05 0.08 0.00 0.02 0.00 0.00 54.13 54.39 3kyh s LEU 495 Cb 0.07 -0.26 -0.04 0.00 0.02 0.00 0.00 46.19 45.98 3kyh s LEU 495 CO 0.00 -0.09 -0.14 -0.70 0.02 0.00 0.00 176.35 175.44 3kyh s GLU 496 N 0.97 1.98 -0.20 1.70 2.56 -0.27 -0.05 118.70 125.39 3kyh s GLU 496 Ca -0.10 -1.08 -0.01 0.00 0.00 0.00 0.00 54.97 53.78 3kyh s GLU 496 Cb -0.14 -2.22 0.01 0.00 2.00 0.00 0.00 34.13 33.79 3kyh s GLU 496 CO -0.01 0.50 -0.14 -1.50 -0.56 0.00 0.00 175.26 173.55 3kyh s ILE 497 N -1.15 2.56 -0.90 -3.70 2.07 -1.17 -1.70 121.20 117.21 3kyh s ILE 497 Ca 0.19 -0.79 -0.30 0.00 -1.41 0.00 0.00 60.65 58.34 3kyh s ILE 497 Cb -0.11 -2.13 -0.20 0.00 0.13 0.00 0.00 42.46 40.15 3kyh s ILE 497 CO 0.11 0.47 2.49 -3.20 -1.91 0.00 0.00 174.94 172.91 3kyh n ASN 498 N 4.68 0.30 0.04 4.50 4.05 -0.35 -4.65 115.26 123.84 3kyh n ASN 498 Ca -0.20 0.20 -0.02 0.00 0.45 0.00 0.00 54.58 55.02 3kyh n ASN 498 Cb 0.50 -0.86 0.25 0.00 1.23 0.00 0.00 39.78 40.90 3kyh n ASN 498 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 177.26 174.95 3kyh h THR 499 N 7.43 1.25 0.72 -0.44 2.02 -1.90 -2.06 112.91 119.92 3kyh h THR 499 Ca -0.05 -1.14 -0.04 0.00 0.77 0.00 0.00 66.41 65.95 3kyh h THR 499 Cb 1.23 1.31 0.01 0.00 -1.74 0.00 0.00 68.15 68.96 3kyh h THR 499 CO 1.28 0.36 -0.34 -0.65 0.37 0.00 0.00 175.52 176.54 3kyh h PRO 500 N 0.37 -0.93 -0.96 6.66 0.11 -1.93 0.13 132.00 135.45 3kyh h PRO 500 Ca 0.06 0.06 0.13 0.00 0.11 0.00 0.00 66.00 66.37 3kyh h PRO 500 Cb 0.58 0.21 -0.14 0.00 0.11 0.00 0.00 31.00 31.76 3kyh h PRO 500 CO 0.04 -0.61 -0.43 0.00 -0.21 0.00 0.00 178.00 176.80 3kyh n ALA 501 N -2.53 -0.25 -0.05 -0.75 0.00 -1.18 0.22 120.51 115.97 3kyh n ALA 501 Ca -0.14 0.92 -0.14 0.00 0.00 0.00 0.00 53.44 54.08 3kyh n ALA 501 Cb 0.39 -0.35 -0.09 0.00 0.00 0.00 0.00 19.45 19.40 3kyh n ALA 501 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3kyh h LEU 502 N 0.00 -1.70 -0.81 0.00 5.85 -1.24 0.82 115.31 118.23 3kyh h LEU 502 Ca 0.29 0.21 -0.10 0.00 0.84 0.00 0.00 57.88 59.12 3kyh h LEU 502 Cb 0.53 0.68 -0.02 0.00 0.37 0.00 0.00 40.66 42.22 3kyh h LEU 502 CO -0.94 -0.45 -0.17 -0.07 -0.34 0.00 0.00 178.44 176.46 3kyh h LEU 503 N -0.52 0.70 0.00 2.25 3.38 0.21 -0.65 115.31 120.69 3kyh h LEU 503 Ca 0.05 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.80 3kyh h LEU 503 Cb 0.65 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.21 3kyh h LEU 503 CO -0.48 0.88 0.00 -3.20 0.09 0.00 0.00 178.44 175.73 3kyh n ASN 504 N -4.14 0.00 -0.50 -0.43 2.85 0.13 -0.01 115.26 113.16 3kyh n ASN 504 Ca 0.01 0.80 0.41 0.00 -0.11 0.00 0.00 54.58 55.68 3kyh n ASN 504 Cb 0.39 -0.30 0.70 0.00 1.24 0.00 0.00 39.78 41.82 3kyh n ASN 504 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3kyh h ALA 505 N -1.95 3.06 0.19 5.20 0.00 -0.37 1.52 119.26 126.91 3kyh h ALA 505 Ca 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3kyh h ALA 505 Cb 0.00 0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3kyh h ALA 505 CO 0.00 -1.65 -0.09 0.35 0.00 0.00 0.00 179.25 177.86 3kyh h PHE 506 N 0.06 -0.23 -0.02 0.00 3.57 -0.94 -3.04 116.94 116.34 3kyh h PHE 506 Ca 0.83 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 62.35 3kyh h PHE 506 Cb 2.85 0.08 -0.06 0.00 2.79 0.00 0.00 35.95 41.61 3kyh h PHE 506 CO -0.00 -0.04 -0.47 -0.44 -2.23 0.00 0.00 178.31 175.13 3kyh h ASP 507 N -0.38 -1.44 -0.73 0.41 3.32 0.59 -1.82 116.42 116.38 3kyh h ASP 507 Ca -0.03 0.17 -0.62 0.00 0.02 0.00 0.00 57.03 56.58 3kyh h ASP 507 Cb 0.29 0.56 -0.09 0.00 0.22 0.00 0.00 39.33 40.31 3kyh h ASP 507 CO 0.04 -0.48 2.10 0.59 -1.72 0.00 0.00 179.24 179.77 3kyh n ASN 508 N -5.46 7.64 0.00 6.45 5.03 -0.97 -4.76 115.26 123.19 3kyh n ASN 508 Ca -0.06 -2.94 0.00 0.00 0.87 0.00 0.00 54.58 52.45 3kyh n ASN 508 Cb 0.38 -1.39 0.00 0.00 -1.02 0.00 0.00 39.78 37.75 3kyh n ASN 508 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3kyh n ILE 509 N 2.11 0.00 0.00 2.41 0.13 -0.69 -3.13 119.36 120.19 3kyh n ILE 509 Ca 0.62 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 62.27 3kyh n ILE 509 Cb 0.37 -0.52 0.00 0.00 -0.84 0.00 0.00 39.64 38.65 3kyh n ILE 509 CO 0.00 0.00 0.00 0.35 2.80 0.00 0.00 176.55 179.70 3kyh n THR 510 N 0.00 0.00 0.00 9.51 -2.24 -1.26 -1.37 114.28 118.91 3kyh n THR 510 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3kyh n THR 510 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 3kyh n THR 510 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3kyh n ASN 511 N -0.96 0.00 -4.40 3.42 2.85 -1.26 -4.69 115.26 110.22 3kyh n ASN 511 Ca 0.00 0.08 -0.44 0.00 -0.11 0.00 0.00 54.58 54.10 3kyh n ASN 511 Cb 0.00 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 40.98 3kyh n ASN 511 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 3kyh s ASP 512 N -1.45 6.29 -0.01 1.20 -1.08 -0.47 -4.88 116.67 116.27 3kyh s ASP 512 Ca 0.00 -1.51 -0.24 0.00 -0.52 0.00 0.00 52.55 50.28 3kyh s ASP 512 Cb 0.00 -2.34 -0.17 0.00 -1.46 0.00 0.00 42.92 38.95 3kyh s ASP 512 CO 0.00 -1.15 1.15 -1.28 0.52 0.00 0.00 175.17 174.41 3kyh h SER 513 N 9.13 -0.23 -0.82 -0.34 0.87 -1.73 -3.34 113.55 117.09 3kyh h SER 513 Ca -0.19 -0.28 0.24 0.00 -1.23 0.00 0.00 61.79 60.33 3kyh h SER 513 Cb 1.07 0.06 -0.15 0.00 -0.44 0.00 0.00 62.40 62.94 3kyh h SER 513 CO 1.10 0.20 0.09 0.29 -0.53 0.00 0.00 176.83 177.98 3kyh n LYS 514 N -5.02 -0.06 -0.10 2.24 5.02 -1.26 -0.19 118.16 118.79 3kyh n LYS 514 Ca -0.09 1.21 -0.08 0.00 -2.02 0.00 0.00 58.31 57.33 3kyh n LYS 514 Cb 0.26 -1.96 -0.01 0.00 -0.02 0.00 0.00 35.03 33.30 3kyh n LYS 514 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 3kyh h GLU 515 N 0.00 0.42 -0.28 1.97 4.81 -1.93 0.26 114.58 119.83 3kyh h GLU 515 Ca 0.53 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.76 3kyh h GLU 515 Cb 1.16 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.42 3kyh h GLU 515 CO -0.75 0.28 0.12 -0.92 -0.73 0.00 0.00 179.01 177.01 3kyh h TYR 516 N 0.43 0.22 0.00 0.92 3.20 -0.74 -2.50 116.97 118.50 3kyh h TYR 516 Ca 0.13 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.01 3kyh h TYR 516 Cb -0.03 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.18 3kyh h TYR 516 CO -0.06 0.12 0.00 0.00 -1.64 0.00 0.00 178.16 176.57 3kyh n ALA 517 N -2.25 -0.17 0.33 1.82 0.00 -0.94 -1.09 120.51 118.21 3kyh n ALA 517 Ca -0.01 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.54 3kyh n ALA 517 Cb 0.08 0.08 0.57 0.00 0.00 0.00 0.00 19.45 20.18 3kyh n ALA 517 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3kyh h SER 518 N 0.00 0.00 0.50 0.00 0.87 -1.02 0.16 113.55 114.06 3kyh h SER 518 Ca 0.00 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.26 3kyh h SER 518 Cb 0.00 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 61.98 3kyh h SER 518 CO 0.00 0.00 -1.34 0.25 -0.53 0.00 0.00 176.83 175.21 3kyh h LEU 519 N 0.00 0.57 0.24 2.23 5.85 -0.95 -2.08 115.31 121.17 3kyh h LEU 519 Ca 0.00 -0.61 -0.01 0.00 0.84 0.00 0.00 57.88 58.10 3kyh h LEU 519 Cb 1.07 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.92 3kyh h LEU 519 CO 0.00 1.48 -0.13 0.40 -0.34 0.00 0.00 178.44 179.85 3kyh h ILE 520 N 0.10 0.00 -0.61 4.05 1.08 0.95 -2.50 117.51 120.57 3kyh h ILE 520 Ca -0.18 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.42 3kyh h ILE 520 Cb 2.04 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 35.68 3kyh h ILE 520 CO 0.23 0.00 -0.06 0.03 -0.69 0.00 0.00 178.15 177.66 3kyh h ARG 521 N -0.34 0.06 0.00 2.37 3.08 -1.56 1.60 114.38 119.59 3kyh h ARG 521 Ca -0.03 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 3kyh h ARG 521 Cb 0.26 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 3kyh h ARG 521 CO 0.05 0.04 -0.04 0.00 -1.07 0.00 0.00 179.97 178.95 3kyh h THR 522 N 0.07 0.80 0.34 2.04 1.03 -1.50 2.23 112.91 117.92 3kyh h THR 522 Ca 0.31 -0.15 -0.02 0.00 -0.01 0.00 0.00 66.41 66.55 3kyh h THR 522 Cb 0.50 1.08 0.00 0.00 -1.07 0.00 0.00 68.15 68.67 3kyh h THR 522 CO -0.57 0.04 -0.16 0.15 -0.01 0.00 0.00 175.52 174.97 3kyh h PHE 523 N 0.00 -0.42 -1.15 0.00 3.57 0.28 -3.05 116.94 116.17 3kyh h PHE 523 Ca -0.00 -0.01 0.33 0.00 3.53 0.00 0.00 57.97 61.82 3kyh h PHE 523 Cb 0.08 0.14 -0.11 0.00 2.79 0.00 0.00 35.95 38.86 3kyh h PHE 523 CO 0.00 -0.26 0.74 -0.07 -2.23 0.00 0.00 178.31 176.49 3kyh h LEU 524 N -0.51 0.35 -2.44 0.59 3.38 -0.77 0.15 115.31 116.06 3kyh h LEU 524 Ca -0.05 0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 3kyh h LEU 524 Cb 0.35 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 3kyh h LEU 524 CO 0.08 -0.02 -0.02 0.78 0.09 0.00 0.00 178.44 179.34 3kyh h ASN 525 N 0.26 0.00 0.55 -0.43 2.35 0.37 -3.00 115.58 115.68 3kyh h ASN 525 Ca 0.68 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 56.14 3kyh h ASN 525 Cb 1.93 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 40.29 3kyh h ASN 525 CO -0.33 0.02 -1.39 0.78 -1.65 0.00 0.00 177.43 174.86 3kyh h ASN 526 N 0.00 0.38 -0.07 5.81 4.21 -0.59 -3.15 115.58 122.17 3kyh h ASN 526 Ca -0.00 -0.47 0.03 0.00 1.21 0.00 0.00 56.30 57.07 3kyh h ASN 526 Cb 0.16 -0.12 -0.06 0.00 -1.12 0.00 0.00 38.32 37.17 3kyh h ASN 526 CO 0.00 1.38 -0.49 1.23 -1.29 0.00 0.00 177.43 178.26 3kyh h GLY 527 N 1.74 -0.95 0.00 2.83 0.00 -1.39 -2.76 103.07 102.55 3kyh h GLY 527 Ca -0.19 0.61 0.00 0.00 0.00 0.00 0.00 47.33 47.75 3kyh h GLY 527 CO 0.18 -0.23 0.00 2.41 0.00 0.00 0.00 176.54 178.90 3kyh n THR 528 N -5.45 0.00 -0.23 4.70 -1.04 -1.17 0.73 114.28 111.82 3kyh n THR 528 Ca -0.06 1.23 -0.03 0.00 -2.04 0.00 0.00 64.05 63.16 3kyh n THR 528 Cb 0.38 -1.90 -0.01 0.00 -1.82 0.00 0.00 70.33 66.99 3kyh n THR 528 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 3kyh n ILE 529 N -1.67 -0.33 0.29 12.58 5.41 -1.19 0.94 119.36 135.38 3kyh n ILE 529 Ca 0.00 1.35 -0.16 0.00 1.00 0.00 0.00 62.75 64.94 3kyh n ILE 529 Cb 0.00 -1.74 -0.08 0.00 -0.71 0.00 0.00 39.64 37.10 3kyh n ILE 529 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3kyh h ILE 530 N 0.00 0.48 -0.92 1.39 1.08 -1.12 0.49 117.51 118.91 3kyh h ILE 530 Ca 0.16 -0.06 0.09 0.00 -0.39 0.00 0.00 64.86 64.66 3kyh h ILE 530 Cb 0.30 0.51 -0.07 0.00 -3.07 0.00 0.00 36.82 34.49 3kyh h ILE 530 CO -0.56 0.01 0.57 -0.09 -0.69 0.00 0.00 178.15 177.39 3kyh h ARG 531 N -0.74 0.93 0.30 2.37 2.43 0.66 0.77 114.38 121.10 3kyh h ARG 531 Ca -0.07 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.03 3kyh h ARG 531 Cb 0.55 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 3kyh h ARG 531 CO 0.12 0.61 -0.14 0.00 -1.51 0.00 0.00 179.97 179.05 3kyh h ARG 532 N 0.96 -0.39 -0.86 0.20 2.47 0.25 -2.88 114.38 114.13 3kyh h ARG 532 Ca 0.43 0.03 0.19 0.00 -1.26 0.00 0.00 59.98 59.37 3kyh h ARG 532 Cb 0.34 0.09 -0.16 0.00 -1.65 0.00 0.00 29.97 28.59 3kyh h ARG 532 CO -0.23 -0.26 -0.11 -0.22 0.56 0.00 0.00 179.97 179.71 3kyh h LYS 533 N -0.73 0.03 -0.77 0.04 1.63 0.82 0.56 116.57 118.15 3kyh h LYS 533 Ca -0.04 -0.00 0.15 0.00 -0.85 0.00 0.00 60.65 59.91 3kyh h LYS 533 Cb 0.31 -0.01 -0.10 0.00 -0.60 0.00 0.00 32.23 31.83 3kyh h LYS 533 CO 0.07 0.02 0.30 1.25 -3.45 0.00 0.00 179.45 177.63 3kyh h LEU 534 N 0.03 0.26 -0.05 5.20 5.85 0.42 -2.00 115.31 125.01 3kyh h LEU 534 Ca 0.45 0.12 -0.03 0.00 0.84 0.00 0.00 57.88 59.26 3kyh h LEU 534 Cb 0.78 0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.91 3kyh h LEU 534 CO -0.84 0.08 -0.10 0.28 -0.34 0.00 0.00 178.44 177.52 3kyh h SER 535 N 0.42 0.18 0.00 1.25 0.02 0.27 -3.10 113.55 112.59 3kyh h SER 535 Ca 0.43 -0.56 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 3kyh h SER 535 Cb 0.68 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.16 3kyh h SER 535 CO -0.43 0.70 0.11 -1.54 -1.14 0.00 0.00 176.83 174.54 3kyh n SER 536 N -4.67 0.33 -0.44 3.07 3.41 -0.17 -1.75 113.62 113.40 3kyh n SER 536 Ca -0.08 0.60 0.09 0.00 -0.26 0.00 0.00 58.87 59.23 3kyh n SER 536 Cb 0.35 -0.62 -0.00 0.00 -0.26 0.00 0.00 64.21 63.68 3kyh n SER 536 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3kyh n LEU 537 N -1.95 1.84 -4.67 1.04 4.77 -0.84 -4.76 117.00 112.44 3kyh n LEU 537 Ca -0.01 -0.77 -0.42 0.00 -0.03 0.00 0.00 56.01 54.78 3kyh n LEU 537 Cb 0.13 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 3kyh n LEU 537 CO 0.06 0.35 1.59 -1.20 -1.33 0.00 0.00 177.39 176.85 3kyh n SER 538 N -0.06 4.15 0.00 -1.43 7.64 -0.72 -4.87 113.62 118.33 3kyh n SER 538 Ca 0.08 0.92 0.00 0.00 1.01 0.00 0.00 58.87 60.88 3kyh n SER 538 Cb 0.41 -1.53 0.00 0.00 -1.01 0.00 0.00 64.21 62.08 3kyh n SER 538 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03