#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kke n GLN 251 N 0.00 1.14 -3.15 3.49 -0.06 -1.26 -4.94 117.38 112.61 1kke n GLN 251 Ca 0.00 -2.43 0.05 0.00 -2.00 0.00 0.00 57.00 52.62 1kke n GLN 251 Cb 0.00 -1.39 -0.01 0.00 -4.06 0.00 0.00 30.24 24.79 1kke n GLN 251 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 1kke s SER 252 N -2.68 -0.81 0.11 1.69 0.15 -1.26 -5.16 113.70 105.73 1kke s SER 252 Ca 0.29 0.24 -0.26 0.00 0.70 0.00 0.00 55.95 56.92 1kke s SER 252 Cb 0.25 1.57 0.08 0.00 -1.71 0.00 0.00 66.02 66.22 1kke s SER 252 CO 0.02 -0.15 1.08 -0.72 1.20 0.00 0.00 173.24 174.67 1kke s TYR 253 N 2.92 -0.05 -0.25 3.44 -0.85 -1.26 -5.15 117.35 116.14 1kke s TYR 253 Ca 0.15 -0.22 -0.07 0.00 -0.52 0.00 0.00 57.07 56.42 1kke s TYR 253 Cb -0.07 0.63 -0.02 0.00 0.38 0.00 0.00 41.96 42.87 1kke s TYR 253 CO -0.20 -0.68 0.06 0.08 -1.52 0.00 0.00 175.55 173.29 1kke s VAL 254 N -2.73 4.18 -0.18 -3.49 1.01 -1.26 -4.98 120.40 112.95 1kke s VAL 254 Ca 0.16 -0.27 -0.14 0.00 0.00 0.00 0.00 61.98 61.73 1kke s VAL 254 Cb 0.00 -2.97 -0.08 0.00 0.00 0.00 0.00 36.38 33.33 1kke s VAL 254 CO 0.01 0.32 -0.15 0.00 0.00 0.00 0.00 175.10 175.28 1kke n ALA 255 N 4.91 0.67 -2.52 5.51 0.00 -1.26 -5.02 120.51 122.80 1kke n ALA 255 Ca -0.16 -0.57 -0.26 0.00 0.00 0.00 0.00 53.44 52.44 1kke n ALA 255 Cb 0.51 -0.09 -0.09 0.00 0.00 0.00 0.00 19.45 19.78 1kke n ALA 255 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1kke s SER 256 N -6.16 4.17 -0.21 0.00 0.01 -1.26 -5.03 113.70 105.22 1kke s SER 256 Ca -0.23 -1.20 -0.04 0.00 1.31 0.00 0.00 55.95 55.79 1kke s SER 256 Cb 0.04 -0.45 0.11 0.00 0.21 0.00 0.00 66.02 65.93 1kke s SER 256 CO 0.36 -0.48 0.34 0.00 0.41 0.00 0.00 173.24 173.88 1kke s ALA 257 N -2.64 -0.90 0.21 1.44 0.00 -1.26 -4.98 121.76 113.64 1kke s ALA 257 Ca 0.38 0.93 -0.30 0.00 0.00 0.00 0.00 51.96 52.97 1kke s ALA 257 Cb 0.06 -1.45 -0.08 0.00 0.00 0.00 0.00 23.12 21.65 1kke s ALA 257 CO 0.20 -1.06 0.98 0.08 0.00 0.00 0.00 175.76 175.96 1kke s VAL 258 N 2.51 4.08 0.69 0.00 1.01 -1.26 -4.49 120.40 122.94 1kke s VAL 258 Ca 0.07 1.98 -0.17 0.00 0.00 0.00 0.00 61.98 63.86 1kke s VAL 258 Cb -0.14 -4.26 -0.01 0.00 0.00 0.00 0.00 36.38 31.97 1kke s VAL 258 CO -0.13 0.42 0.97 0.35 0.00 0.00 0.00 175.10 176.70 1kke n THR 259 N 1.83 3.13 0.65 3.92 -2.24 -1.26 -1.41 114.28 118.90 1kke n THR 259 Ca -0.01 -0.41 0.05 0.00 -2.27 0.00 0.00 64.05 61.42 1kke n THR 259 Cb 0.47 -1.12 0.31 0.00 -2.10 0.00 0.00 70.33 67.90 1kke n THR 259 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1kke n PRO 260 N -1.63 0.30 -2.85 -0.78 -0.04 -1.26 -5.05 135.00 123.69 1kke n PRO 260 Ca 0.13 0.04 -0.33 0.00 -0.04 0.00 0.00 63.50 63.31 1kke n PRO 260 Cb 0.49 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.39 1kke n PRO 260 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1kke s LEU 261 N -2.12 3.92 -0.22 1.53 1.43 -0.50 -0.05 118.68 122.67 1kke s LEU 261 Ca 0.15 1.54 -0.10 0.00 -1.03 0.00 0.00 54.13 54.69 1kke s LEU 261 Cb 0.07 -4.39 0.08 0.00 0.03 0.00 0.00 46.19 41.99 1kke s LEU 261 CO 0.13 -0.35 0.51 0.00 0.23 0.00 0.00 176.35 176.87 1kke s ARG 262 N -3.29 0.47 -0.30 1.70 1.70 -0.69 -4.23 118.95 114.31 1kke s ARG 262 Ca 0.59 1.07 -0.11 0.00 -0.47 0.00 0.00 55.73 56.81 1kke s ARG 262 Cb -0.09 0.27 -0.03 0.00 -0.57 0.00 0.00 34.95 34.52 1kke s ARG 262 CO 0.18 -0.19 0.18 -1.17 -1.08 0.00 0.00 175.30 173.21 1kke s LEU 263 N 2.07 4.09 -0.23 -1.89 2.96 -1.26 -2.09 118.68 122.33 1kke s LEU 263 Ca -0.07 -0.29 -0.29 0.00 -0.22 0.00 0.00 54.13 53.26 1kke s LEU 263 Cb -0.09 -2.06 -0.02 0.00 0.50 0.00 0.00 46.19 44.51 1kke s LEU 263 CO -0.15 -0.14 1.46 0.21 -1.32 0.00 0.00 176.35 176.41 1kke s ASN 264 N 1.69 6.58 0.60 3.68 3.84 -0.62 -4.90 114.94 125.81 1kke s ASN 264 Ca 0.06 1.53 0.32 0.00 0.21 0.00 0.00 52.86 54.99 1kke s ASN 264 Cb -0.17 -2.54 1.93 0.00 -0.55 0.00 0.00 41.25 39.92 1kke s ASN 264 CO 0.08 -1.11 2.27 0.77 -2.79 0.00 0.00 177.10 176.33 1kke h SER 265 N 9.81 0.00 0.00 -4.21 4.64 -1.97 0.21 113.55 122.03 1kke h SER 265 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1kke h SER 265 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1kke h SER 265 CO 1.00 0.00 -0.21 0.28 -0.87 0.00 0.00 176.83 177.04 1kke h SER 266 N 0.00 0.00 1.56 4.97 0.02 -1.98 -3.39 113.55 114.73 1kke h SER 266 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1kke h SER 266 Cb 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.55 1kke h SER 266 CO -0.00 0.50 0.00 0.71 -1.14 0.00 0.00 176.83 176.90 1kke h THR 267 N -0.79 0.00 -2.24 -2.27 1.35 -1.99 -3.47 112.91 103.49 1kke h THR 267 Ca 0.00 -0.62 -0.31 0.00 -0.55 0.00 0.00 66.41 64.93 1kke h THR 267 Cb 0.21 1.60 -0.01 0.00 -1.73 0.00 0.00 68.15 68.21 1kke h THR 267 CO 0.00 0.00 -0.40 0.29 -0.25 0.00 0.00 175.52 175.16 1kke n LYS 268 N -2.56 -1.26 -3.27 4.72 4.76 0.74 -4.99 118.16 116.31 1kke n LYS 268 Ca 0.05 0.76 -0.38 0.00 -2.87 0.00 0.00 58.31 55.86 1kke n LYS 268 Cb 0.44 -5.13 -0.06 0.00 -1.84 0.00 0.00 35.03 28.44 1kke n LYS 268 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1kke s VAL 269 N -2.78 5.05 -0.23 -0.18 1.01 -1.25 -4.81 120.40 117.20 1kke s VAL 269 Ca 0.00 1.10 -0.08 0.00 0.00 0.00 0.00 61.98 63.01 1kke s VAL 269 Cb -0.00 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 1kke s VAL 269 CO 0.00 0.38 0.08 -0.22 0.00 0.00 0.00 175.10 175.34 1kke s LEU 270 N 0.13 3.60 0.00 3.92 2.96 -1.26 -1.59 118.68 126.44 1kke s LEU 270 Ca 0.29 -0.11 0.05 0.00 -0.22 0.00 0.00 54.13 54.14 1kke s LEU 270 Cb -0.17 -1.95 -0.02 0.00 0.50 0.00 0.00 46.19 44.55 1kke s LEU 270 CO 0.14 0.02 0.18 -0.90 -1.32 0.00 0.00 176.35 174.47 1kke n ASP 271 N 4.54 0.13 -4.09 3.68 5.75 -0.89 -5.01 116.55 120.67 1kke n ASP 271 Ca -0.16 -2.73 -0.20 0.00 -0.01 0.00 0.00 54.79 51.70 1kke n ASP 271 Cb 0.52 1.12 -0.14 0.00 -1.03 0.00 0.00 41.12 41.59 1kke n ASP 271 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 1kke s MET 272 N -3.13 0.89 -0.23 0.11 1.75 -1.26 -1.70 119.30 115.73 1kke s MET 272 Ca 0.25 -0.55 -0.16 0.00 -1.25 0.00 0.00 55.69 53.99 1kke s MET 272 Cb 0.01 -0.86 -0.04 0.00 2.84 0.00 0.00 34.83 36.78 1kke s MET 272 CO 0.18 0.23 0.42 -0.51 -0.65 0.00 0.00 175.02 174.69 1kke s LEU 273 N -0.65 4.10 0.04 4.11 1.43 0.93 -5.00 118.68 123.64 1kke s LEU 273 Ca 0.03 0.47 0.05 0.00 -1.03 0.00 0.00 54.13 53.65 1kke s LEU 273 Cb -0.06 -2.53 -0.02 0.00 0.03 0.00 0.00 46.19 43.61 1kke s LEU 273 CO 0.00 -0.15 -0.16 0.27 0.23 0.00 0.00 176.35 176.54 1kke s ILE 274 N 1.74 1.26 -0.62 -0.59 -4.36 -1.26 -4.80 121.20 112.56 1kke s ILE 274 Ca 0.19 -1.04 -0.28 0.00 -0.26 0.00 0.00 60.65 59.26 1kke s ILE 274 Cb -0.15 -1.13 0.03 0.00 1.25 0.00 0.00 42.46 42.46 1kke s ILE 274 CO 0.09 0.07 1.24 -0.62 0.24 0.00 0.00 174.94 175.96 1kke s ASP 275 N -1.12 6.33 0.66 4.36 3.68 -1.26 -4.88 116.67 124.44 1kke s ASP 275 Ca 0.03 -0.03 0.42 0.00 2.13 0.00 0.00 52.55 55.11 1kke s ASP 275 Cb -0.08 -2.55 2.31 0.00 -1.45 0.00 0.00 42.92 41.14 1kke s ASP 275 CO 0.01 -1.61 2.32 0.77 0.13 0.00 0.00 175.17 176.79 1kke h SER 276 N 9.86 0.00 1.52 -0.34 4.64 -1.99 0.99 113.55 128.22 1kke h SER 276 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1kke h SER 276 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1kke h SER 276 CO 1.21 0.00 0.00 0.77 -0.87 0.00 0.00 176.83 177.94 1kke h SER 277 N 0.00 0.00 0.00 4.97 4.64 -2.03 -3.33 113.55 117.80 1kke h SER 277 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1kke h SER 277 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1kke h SER 277 CO -0.00 0.00 -0.59 0.35 -0.87 0.00 0.00 176.83 175.72 1kke n THR 278 N -3.01 0.00 -4.17 2.95 -2.24 -0.63 -4.91 114.28 102.26 1kke n THR 278 Ca 0.03 -0.18 -0.13 0.00 -2.27 0.00 0.00 64.05 61.50 1kke n THR 278 Cb 0.42 0.67 -0.11 0.00 -2.10 0.00 0.00 70.33 69.22 1kke n THR 278 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1kke s LEU 279 N -2.50 2.43 0.20 3.22 1.43 0.25 -1.24 118.68 122.47 1kke s LEU 279 Ca 0.00 -0.86 -0.12 0.00 -1.03 0.00 0.00 54.13 52.12 1kke s LEU 279 Cb 0.00 -0.22 -0.00 0.00 0.03 0.00 0.00 46.19 46.00 1kke s LEU 279 CO 0.00 -0.32 0.40 -1.83 0.23 0.00 0.00 176.35 174.82 1kke s GLU 280 N -3.07 1.35 -0.20 1.70 -1.05 -0.75 -4.01 118.70 112.66 1kke s GLU 280 Ca 0.07 -1.16 -0.03 0.00 -0.15 0.00 0.00 54.97 53.70 1kke s GLU 280 Cb -0.01 0.44 -0.01 0.00 -0.44 0.00 0.00 34.13 34.11 1kke s GLU 280 CO -0.01 -0.54 -0.07 0.42 0.95 0.00 0.00 175.26 176.01 1kke s ILE 281 N -3.98 3.26 1.13 1.83 -1.09 -1.26 -1.43 121.20 119.67 1kke s ILE 281 Ca 0.19 -0.54 -0.18 0.00 -2.23 0.00 0.00 60.65 57.88 1kke s ILE 281 Cb 0.01 -2.45 0.13 0.00 -1.58 0.00 0.00 42.46 38.57 1kke s ILE 281 CO 0.03 0.45 0.07 0.59 -1.23 0.00 0.00 174.94 174.86 1kke n ASN 282 N 4.46 -2.46 0.20 3.58 5.03 0.56 -4.80 115.26 121.83 1kke n ASN 282 Ca -0.18 -0.18 0.08 0.00 0.87 0.00 0.00 54.58 55.17 1kke n ASN 282 Cb 0.51 -0.94 0.33 0.00 -1.02 0.00 0.00 39.78 38.66 1kke n ASN 282 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 1kke h SER 283 N -2.20 0.00 -0.18 6.41 0.02 -2.00 -1.10 113.55 114.50 1kke h SER 283 Ca -0.51 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 1kke h SER 283 Cb 1.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.85 1kke h SER 283 CO 0.36 0.27 0.00 -1.20 -1.14 0.00 0.00 176.83 175.12 1kke n SER 284 N -3.31 1.46 -0.17 3.07 7.64 -1.26 -4.91 113.62 116.14 1kke n SER 284 Ca 0.01 -1.73 -0.02 0.00 1.01 0.00 0.00 58.87 58.13 1kke n SER 284 Cb 0.51 -0.11 -0.01 0.00 -1.01 0.00 0.00 64.21 63.59 1kke n SER 284 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1kke n GLY 285 N 1.06 0.54 3.85 0.23 0.00 -0.42 -5.02 105.19 105.44 1kke n GLY 285 Ca 0.15 -0.30 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 1kke n GLY 285 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1kke s GLN 286 N -1.29 3.95 -0.08 1.61 -0.21 -1.26 -4.73 119.66 117.64 1kke s GLN 286 Ca 0.00 0.66 -0.23 0.00 0.02 0.00 0.00 55.36 55.81 1kke s GLN 286 Cb 0.00 -2.38 -0.03 0.00 1.00 0.00 0.00 33.01 31.60 1kke s GLN 286 CO 0.00 0.05 0.69 -1.17 -2.12 0.00 0.00 175.29 172.74 1kke s LEU 287 N -3.34 4.29 0.09 2.90 2.96 -1.26 -0.32 118.68 124.00 1kke s LEU 287 Ca 0.54 1.14 0.00 0.00 -0.22 0.00 0.00 54.13 55.60 1kke s LEU 287 Cb -0.10 -3.05 -0.04 0.00 0.50 0.00 0.00 46.19 43.49 1kke s LEU 287 CO 0.22 -0.14 -0.03 0.28 -1.32 0.00 0.00 176.35 175.37 1kke s THR 288 N 0.94 0.45 -0.13 3.68 -1.32 -0.51 -4.95 115.64 113.80 1kke s THR 288 Ca 0.36 -1.89 -0.17 0.00 -1.21 0.00 0.00 61.69 58.78 1kke s THR 288 Cb -0.17 -1.72 -0.04 0.00 -1.51 0.00 0.00 72.50 69.05 1kke s THR 288 CO 0.17 -0.82 0.41 -0.69 -2.21 0.00 0.00 174.62 171.48 1kke s VAL 289 N -3.78 5.23 -0.26 5.08 1.01 -1.26 -1.81 120.40 124.60 1kke s VAL 289 Ca 0.13 0.81 -0.29 0.00 0.00 0.00 0.00 61.98 62.63 1kke s VAL 289 Cb 0.07 -3.75 -0.01 0.00 0.00 0.00 0.00 36.38 32.68 1kke s VAL 289 CO -0.05 0.35 1.51 -0.13 0.00 0.00 0.00 175.10 176.78 1kke s ARG 290 N 0.57 3.79 0.31 2.72 0.52 -0.37 -4.90 118.95 121.59 1kke s ARG 290 Ca 0.23 1.47 -0.29 0.00 -0.52 0.00 0.00 55.73 56.61 1kke s ARG 290 Cb -0.14 -3.99 -0.11 0.00 0.52 0.00 0.00 34.95 31.22 1kke s ARG 290 CO 0.08 -1.29 1.50 -1.54 0.02 0.00 0.00 175.30 174.07 1kke s SER 291 N 3.85 6.46 0.01 0.23 1.04 -1.26 -4.90 113.70 119.13 1kke s SER 291 Ca 0.66 2.90 0.01 0.00 0.48 0.00 0.00 55.95 60.00 1kke s SER 291 Cb -0.21 -2.64 -0.01 0.00 0.10 0.00 0.00 66.02 63.25 1kke s SER 291 CO 0.28 -0.82 -0.05 0.42 0.98 0.00 0.00 173.24 174.05 1kke s THR 292 N -0.44 0.33 0.32 2.02 -4.23 -1.26 -5.15 115.64 107.23 1kke s THR 292 Ca 0.58 -0.44 -0.14 0.00 -1.18 0.00 0.00 61.69 60.51 1kke s THR 292 Cb -0.45 -0.33 -0.09 0.00 1.34 0.00 0.00 72.50 72.96 1kke s THR 292 CO 0.52 -0.08 0.72 -0.94 -0.54 0.00 0.00 174.62 174.30 1kke s SER 293 N -0.55 6.76 0.41 3.99 1.04 -1.26 -5.03 113.70 119.05 1kke s SER 293 Ca -0.03 1.25 -0.27 0.00 0.48 0.00 0.00 55.95 57.38 1kke s SER 293 Cb -0.04 -2.36 -0.10 0.00 0.10 0.00 0.00 66.02 63.62 1kke s SER 293 CO -0.00 -0.20 1.48 -2.16 0.98 0.00 0.00 173.24 173.34 1kke s PRO 294 N -2.98 3.92 -0.42 4.02 0.04 -1.26 -4.96 135.00 133.37 1kke s PRO 294 Ca 0.54 2.54 -0.23 0.00 0.04 0.00 0.00 61.00 63.89 1kke s PRO 294 Cb -0.10 -2.84 0.02 0.00 0.04 0.00 0.00 34.50 31.62 1kke s PRO 294 CO 0.18 -0.67 0.77 -0.80 0.04 0.00 0.00 177.00 176.52 1kke s ASN 295 N -0.26 6.45 0.02 6.66 0.01 -1.26 -5.04 114.94 121.52 1kke s ASN 295 Ca 0.56 0.03 0.06 0.00 -0.71 0.00 0.00 52.86 52.81 1kke s ASN 295 Cb -0.46 -2.38 -0.03 0.00 0.41 0.00 0.00 41.25 38.79 1kke s ASN 295 CO 0.61 -0.85 -0.18 -0.76 -1.51 0.00 0.00 177.10 174.42 1kke s LEU 296 N 3.20 2.59 -0.17 0.60 1.43 -1.26 -5.12 118.68 119.95 1kke s LEU 296 Ca 0.30 -0.38 -0.04 0.00 -1.03 0.00 0.00 54.13 52.98 1kke s LEU 296 Cb -0.13 -1.51 -0.02 0.00 0.03 0.00 0.00 46.19 44.56 1kke s LEU 296 CO 0.21 0.28 -0.04 -0.13 0.23 0.00 0.00 176.35 176.90 1kke s ARG 297 N -1.24 3.62 0.42 1.70 1.81 -1.25 -4.94 118.95 119.07 1kke s ARG 297 Ca 0.14 -0.54 -0.26 0.00 -1.72 0.00 0.00 55.73 53.35 1kke s ARG 297 Cb -0.10 -2.93 -0.10 0.00 -0.45 0.00 0.00 34.95 31.37 1kke s ARG 297 CO 0.04 0.17 1.28 0.98 -0.68 0.00 0.00 175.30 177.08 1kke n TYR 298 N 3.75 2.17 0.59 -0.53 9.36 -1.26 0.16 117.16 131.40 1kke n TYR 298 Ca -0.17 0.50 0.07 0.00 3.32 0.00 0.00 57.90 61.62 1kke n TYR 298 Cb 0.52 -2.38 0.33 0.00 -0.63 0.00 0.00 39.34 37.18 1kke n TYR 298 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1kke n PRO 299 N 0.07 0.11 -2.39 2.98 -0.04 -1.26 -5.05 135.00 129.42 1kke n PRO 299 Ca 0.06 0.20 -0.41 0.00 -0.04 0.00 0.00 63.50 63.31 1kke n PRO 299 Cb 0.39 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.32 1kke n PRO 299 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1kke s ILE 300 N -2.78 3.65 0.33 0.52 -1.09 0.12 -0.44 121.20 121.51 1kke s ILE 300 Ca 0.10 1.35 -0.12 0.00 -2.23 0.00 0.00 60.65 59.76 1kke s ILE 300 Cb 0.10 -3.86 0.02 0.00 -1.58 0.00 0.00 42.46 37.13 1kke s ILE 300 CO 0.24 0.20 0.63 0.00 -1.23 0.00 0.00 174.94 174.78 1kke s ALA 301 N 0.10 -0.27 -0.72 9.38 0.00 -0.19 -3.81 121.76 126.25 1kke s ALA 301 Ca 0.54 -0.94 -0.23 0.00 0.00 0.00 0.00 51.96 51.33 1kke s ALA 301 Cb -0.32 0.91 0.07 0.00 0.00 0.00 0.00 23.12 23.78 1kke s ALA 301 CO 0.35 -0.91 1.05 0.34 0.00 0.00 0.00 175.76 176.59 1kke s ASP 302 N -3.09 6.24 -0.24 0.00 -1.08 -1.26 -0.75 116.67 116.49 1kke s ASP 302 Ca 0.21 -1.07 -0.06 0.00 -0.52 0.00 0.00 52.55 51.10 1kke s ASP 302 Cb -0.03 -2.44 -0.02 0.00 -1.46 0.00 0.00 42.92 38.97 1kke s ASP 302 CO 0.13 -1.45 0.03 -0.69 0.52 0.00 0.00 175.17 173.71 1kke s VAL 303 N 4.16 3.98 -1.47 1.11 1.01 -0.68 -4.56 120.40 123.94 1kke s VAL 303 Ca 0.26 -0.29 -0.09 0.00 0.00 0.00 0.00 61.98 61.87 1kke s VAL 303 Cb -0.14 -2.84 0.06 0.00 0.00 0.00 0.00 36.38 33.46 1kke s VAL 303 CO 0.07 0.37 0.82 -1.20 0.00 0.00 0.00 175.10 175.17 1kke n SER 304 N 4.86 -3.13 0.00 3.32 7.64 -1.26 -1.69 113.62 123.36 1kke n SER 304 Ca -0.17 -0.84 0.00 0.00 1.01 0.00 0.00 58.87 58.87 1kke n SER 304 Cb 0.51 -3.73 0.00 0.00 -1.01 0.00 0.00 64.21 59.99 1kke n SER 304 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1kke n GLY 305 N -1.67 1.41 3.61 0.23 0.00 -1.26 -4.94 105.19 102.57 1kke n GLY 305 Ca -0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 1kke n GLY 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kke n GLY 306 N 0.00 -1.23 3.58 -0.02 0.00 -0.68 -5.00 105.19 101.83 1kke n GLY 306 Ca 0.00 -1.74 -0.40 0.00 0.00 0.00 0.00 46.02 43.88 1kke n GLY 306 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1kke s ILE 307 N -3.62 5.17 0.00 -0.61 1.01 -1.26 -1.69 121.20 120.20 1kke s ILE 307 Ca 0.70 0.33 0.00 0.00 0.00 0.00 0.00 60.65 61.67 1kke s ILE 307 Cb -0.02 -3.75 0.00 0.00 0.01 0.00 0.00 42.46 38.70 1kke s ILE 307 CO 0.48 0.04 0.00 0.61 0.00 0.00 0.00 174.94 176.08 1kke n GLY 308 N 4.82 5.36 3.55 6.18 0.00 0.07 -4.88 105.19 120.29 1kke n GLY 308 Ca -0.09 -1.44 -0.34 0.00 0.00 0.00 0.00 46.02 44.15 1kke n GLY 308 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1kke s MET 309 N 1.06 3.78 0.10 1.61 1.75 -1.26 -1.02 119.30 125.32 1kke s MET 309 Ca 0.00 -0.46 -0.32 0.00 -1.25 0.00 0.00 55.69 53.66 1kke s MET 309 Cb 0.00 -3.02 -0.11 0.00 2.84 0.00 0.00 34.83 34.53 1kke s MET 309 CO 0.00 0.25 1.80 0.45 -0.65 0.00 0.00 175.02 176.87 1kke n SER 310 N 3.53 3.77 0.30 1.11 2.88 0.42 -4.87 113.62 120.76 1kke n SER 310 Ca -0.17 1.00 0.19 0.00 -1.33 0.00 0.00 58.87 58.57 1kke n SER 310 Cb 0.52 -1.50 0.91 0.00 -0.75 0.00 0.00 64.21 63.40 1kke n SER 310 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1kke h PRO 311 N 8.15 0.00 -0.46 -1.46 0.13 -1.95 -2.20 132.00 134.21 1kke h PRO 311 Ca -0.46 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.55 1kke h PRO 311 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 1kke h PRO 311 CO 0.94 0.00 -0.19 -0.91 -0.23 0.00 0.00 178.00 177.61 1kke h ASN 312 N 0.00 0.93 -0.41 1.44 4.21 -1.89 -2.13 115.58 117.73 1kke h ASN 312 Ca 0.00 -0.33 -0.13 0.00 1.21 0.00 0.00 56.30 57.05 1kke h ASN 312 Cb 0.28 -0.25 -0.01 0.00 -1.12 0.00 0.00 38.32 37.21 1kke h ASN 312 CO 0.00 1.09 -0.22 0.22 -1.29 0.00 0.00 177.43 177.23 1kke h TYR 313 N 0.80 1.05 -0.26 1.19 3.20 -1.78 -3.23 116.97 117.93 1kke h TYR 313 Ca 0.11 -0.25 -0.13 0.00 3.14 0.00 0.00 58.73 61.61 1kke h TYR 313 Cb 0.73 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 1kke h TYR 313 CO 0.04 1.04 -0.36 0.00 -1.64 0.00 0.00 178.16 177.24 1kke h ARG 314 N 0.79 0.59 -1.95 1.82 3.08 -1.28 0.35 114.38 117.78 1kke h ARG 314 Ca 0.10 -0.28 0.03 0.00 0.07 0.00 0.00 59.98 59.90 1kke h ARG 314 Cb 0.77 -0.00 -0.22 0.00 0.08 0.00 0.00 29.97 30.60 1kke h ARG 314 CO 0.06 0.86 0.07 0.12 -1.07 0.00 0.00 179.97 180.01 1kke s PHE 315 N -4.32 -1.00 -0.10 3.04 5.36 -0.82 -3.63 117.98 116.51 1kke s PHE 315 Ca -0.08 2.02 -0.09 0.00 -0.96 0.00 0.00 56.93 57.83 1kke s PHE 315 Cb 0.13 0.59 0.03 0.00 -0.34 0.00 0.00 43.02 43.42 1kke s PHE 315 CO 0.82 -0.49 0.27 0.50 -1.46 0.00 0.00 175.22 174.86 1kke s ARG 316 N 1.53 0.30 0.07 10.12 3.52 -0.13 -4.46 118.95 129.90 1kke s ARG 316 Ca -0.09 0.42 0.05 0.00 -0.13 0.00 0.00 55.73 55.98 1kke s ARG 316 Cb -0.05 0.09 -0.03 0.00 -1.56 0.00 0.00 34.95 33.41 1kke s ARG 316 CO -0.18 -0.07 -0.14 -1.14 -0.81 0.00 0.00 175.30 172.96 1kke s GLN 317 N 0.41 0.83 0.00 5.12 0.74 -1.26 -0.68 119.66 124.81 1kke s GLN 317 Ca -0.02 -0.92 0.00 0.00 0.05 0.00 0.00 55.36 54.47 1kke s GLN 317 Cb -0.04 -0.84 0.00 0.00 1.10 0.00 0.00 33.01 33.23 1kke s GLN 317 CO -0.02 0.19 0.00 0.45 -0.55 0.00 0.00 175.29 175.36 1kke n SER 318 N 1.38 0.00 -3.65 6.67 2.88 -0.62 -5.01 113.62 115.27 1kke n SER 318 Ca -0.21 -0.87 -0.11 0.00 -1.33 0.00 0.00 58.87 56.35 1kke n SER 318 Cb 0.54 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.95 1kke n SER 318 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1kke s MET 319 N -1.62 1.01 -0.11 -1.46 0.23 -1.26 -0.30 119.30 115.79 1kke s MET 319 Ca 0.00 -0.59 0.03 0.00 -1.03 0.00 0.00 55.69 54.10 1kke s MET 319 Cb 0.00 0.44 0.01 0.00 -1.53 0.00 0.00 34.83 33.75 1kke s MET 319 CO 0.00 -0.38 -0.20 -0.46 -2.03 0.00 0.00 175.02 171.95 1kke s TRP 320 N -3.31 2.37 -0.53 3.16 -0.00 0.17 -2.36 118.94 118.45 1kke s TRP 320 Ca -0.00 -1.07 0.03 0.00 -0.00 0.00 0.00 56.10 55.06 1kke s TRP 320 Cb 0.01 -1.62 0.13 0.00 -0.00 0.00 0.00 33.47 31.99 1kke s TRP 320 CO -0.08 -0.48 0.27 0.42 -0.00 0.00 0.00 176.95 177.08 1kke s ILE 321 N 0.66 2.71 0.00 5.86 1.01 -0.11 -0.98 121.20 130.34 1kke s ILE 321 Ca -0.12 -3.25 0.00 0.00 0.00 0.00 0.00 60.65 57.27 1kke s ILE 321 Cb -0.16 -2.87 0.00 0.00 0.01 0.00 0.00 42.46 39.44 1kke s ILE 321 CO 0.03 -0.80 0.00 0.61 0.00 0.00 0.00 174.94 174.78 1kke n GLY 322 N 3.18 4.09 3.68 6.18 0.00 -0.88 -4.15 105.19 117.29 1kke n GLY 322 Ca 0.05 -1.50 -0.36 0.00 0.00 0.00 0.00 46.02 44.21 1kke n GLY 322 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1kke s ILE 323 N -1.88 5.30 -0.20 -0.61 -1.09 -1.26 -0.66 121.20 120.80 1kke s ILE 323 Ca 0.00 0.16 -0.06 0.00 -2.23 0.00 0.00 60.65 58.52 1kke s ILE 323 Cb 0.00 -3.44 -0.03 0.00 -1.58 0.00 0.00 42.46 37.41 1kke s ILE 323 CO 0.00 0.40 0.03 -0.69 -1.23 0.00 0.00 174.94 173.45 1kke s VAL 324 N 0.69 4.26 -0.04 2.92 1.01 0.21 -2.35 120.40 127.10 1kke s VAL 324 Ca 0.07 -0.21 0.04 0.00 0.00 0.00 0.00 61.98 61.89 1kke s VAL 324 Cb -0.12 -2.93 -0.00 0.00 0.00 0.00 0.00 36.38 33.32 1kke s VAL 324 CO 0.01 0.42 -0.18 -0.94 0.00 0.00 0.00 175.10 174.42 1kke s SER 325 N 0.88 2.23 -0.07 3.32 1.04 -0.24 -0.65 113.70 120.20 1kke s SER 325 Ca 0.02 -0.37 -0.04 0.00 0.48 0.00 0.00 55.95 56.05 1kke s SER 325 Cb -0.14 -0.62 -0.04 0.00 0.10 0.00 0.00 66.02 65.32 1kke s SER 325 CO 0.02 0.16 0.10 -0.47 0.98 0.00 0.00 173.24 174.03 1kke s TYR 326 N 0.02 3.42 -0.04 5.02 5.04 0.54 -0.29 117.35 131.06 1kke s TYR 326 Ca -0.04 0.35 -0.01 0.00 -2.44 0.00 0.00 57.07 54.93 1kke s TYR 326 Cb -0.12 -1.84 0.03 0.00 0.35 0.00 0.00 41.96 40.39 1kke s TYR 326 CO 0.02 0.62 0.08 0.45 -1.34 0.00 0.00 175.55 175.39 1kke s SER 327 N -1.28 0.20 0.23 4.32 0.15 -0.29 -1.66 113.70 115.36 1kke s SER 327 Ca 0.18 0.16 -0.07 0.00 0.70 0.00 0.00 55.95 56.92 1kke s SER 327 Cb -0.12 0.04 0.03 0.00 -1.71 0.00 0.00 66.02 64.26 1kke s SER 327 CO 0.08 -0.16 0.44 0.61 1.20 0.00 0.00 173.24 175.41 1kke n GLY 328 N 4.43 1.63 3.61 9.45 0.00 -0.95 -0.39 105.19 122.97 1kke n GLY 328 Ca -0.23 -1.24 -0.43 0.00 0.00 0.00 0.00 46.02 44.12 1kke n GLY 328 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1kke n SER 329 N -1.43 3.50 -0.05 1.61 2.88 -1.26 -1.48 113.62 117.38 1kke n SER 329 Ca -0.04 0.42 -0.01 0.00 -1.33 0.00 0.00 58.87 57.91 1kke n SER 329 Cb 0.36 -1.54 -0.00 0.00 -0.75 0.00 0.00 64.21 62.28 1kke n SER 329 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1kke n GLY 330 N 5.42 0.34 3.19 0.46 0.00 -1.26 -4.82 105.19 108.52 1kke n GLY 330 Ca 0.27 -0.04 -0.20 0.00 0.00 0.00 0.00 46.02 46.05 1kke n GLY 330 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1kke s LEU 331 N -0.14 2.26 -0.30 0.99 1.43 -0.55 -5.12 118.68 117.26 1kke s LEU 331 Ca 0.00 -0.61 -0.10 0.00 -1.03 0.00 0.00 54.13 52.39 1kke s LEU 331 Cb 0.00 -0.62 0.18 0.00 0.03 0.00 0.00 46.19 45.78 1kke s LEU 331 CO 0.00 -0.03 0.90 0.21 0.23 0.00 0.00 176.35 177.67 1kke s ASN 332 N -1.67 -0.76 0.21 2.29 3.84 -1.26 -2.24 114.94 115.35 1kke s ASN 332 Ca 0.01 0.62 -0.12 0.00 0.21 0.00 0.00 52.86 53.57 1kke s ASN 332 Cb -0.10 1.69 -0.00 0.00 -0.55 0.00 0.00 41.25 42.29 1kke s ASN 332 CO 0.03 -0.14 0.41 -1.66 -2.79 0.00 0.00 177.10 172.94 1kke s TRP 333 N 2.80 0.30 0.01 0.43 1.48 -0.66 -5.00 118.94 118.30 1kke s TRP 333 Ca 0.04 -0.66 -0.11 0.00 -1.06 0.00 0.00 56.10 54.32 1kke s TRP 333 Cb -0.11 0.12 0.01 0.00 -1.16 0.00 0.00 33.47 32.34 1kke s TRP 333 CO -0.15 -0.87 0.22 -0.98 -4.06 0.00 0.00 176.95 171.11 1kke s ARG 334 N -3.98 0.64 0.03 3.25 1.70 -1.26 -0.34 118.95 118.99 1kke s ARG 334 Ca 0.18 -0.42 0.02 0.00 -0.47 0.00 0.00 55.73 55.04 1kke s ARG 334 Cb 0.01 0.27 -0.02 0.00 -0.57 0.00 0.00 34.95 34.64 1kke s ARG 334 CO 0.04 -0.18 -0.06 0.08 -1.08 0.00 0.00 175.30 174.10 1kke s VAL 335 N -1.85 0.42 0.00 4.99 1.01 0.17 -4.98 120.40 120.17 1kke s VAL 335 Ca -0.10 -0.81 -0.18 0.00 0.00 0.00 0.00 61.98 60.88 1kke s VAL 335 Cb -0.04 -0.47 -0.06 0.00 0.00 0.00 0.00 36.38 35.81 1kke s VAL 335 CO 0.00 -0.27 0.52 -1.58 0.00 0.00 0.00 175.10 173.77 1kke s GLN 336 N -1.16 4.19 0.05 2.72 0.74 -1.26 -0.62 119.66 124.31 1kke s GLN 336 Ca -0.08 0.61 0.03 0.00 0.05 0.00 0.00 55.36 55.97 1kke s GLN 336 Cb -0.08 -3.30 -0.03 0.00 1.10 0.00 0.00 33.01 30.71 1kke s GLN 336 CO 0.00 0.50 -0.09 0.08 -0.55 0.00 0.00 175.29 175.23 1kke s VAL 337 N -0.56 0.66 -0.31 1.34 1.01 0.17 -4.95 120.40 117.76 1kke s VAL 337 Ca 0.28 -1.17 -0.00 0.00 0.00 0.00 0.00 61.98 61.09 1kke s VAL 337 Cb -0.18 -0.75 0.06 0.00 0.00 0.00 0.00 36.38 35.52 1kke s VAL 337 CO 0.16 -0.38 0.00 0.20 0.00 0.00 0.00 175.10 175.08 1kke s ASN 338 N -1.68 4.82 0.04 3.32 0.02 -1.26 -2.07 114.94 118.13 1kke s ASN 338 Ca -0.07 -1.48 0.07 0.00 -1.02 0.00 0.00 52.86 50.35 1kke s ASN 338 Cb -0.09 -1.68 -0.02 0.00 0.02 0.00 0.00 41.25 39.47 1kke s ASN 338 CO 0.01 -0.29 -0.19 -0.94 0.02 0.00 0.00 177.10 175.71 1kke s SER 339 N 1.25 2.22 0.38 -1.22 1.04 -0.16 -4.47 113.70 112.74 1kke s SER 339 Ca -0.03 -0.51 -0.22 0.00 0.48 0.00 0.00 55.95 55.67 1kke s SER 339 Cb -0.20 -0.17 -0.10 0.00 0.10 0.00 0.00 66.02 65.64 1kke s SER 339 CO -0.03 0.12 0.92 -1.81 0.98 0.00 0.00 173.24 173.42 1kke s ASP 340 N -1.19 7.06 -0.11 7.02 1.01 -1.18 -0.66 116.67 128.62 1kke s ASP 340 Ca 0.06 1.69 0.04 0.00 0.71 0.00 0.00 52.55 55.05 1kke s ASP 340 Cb -0.09 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.31 1kke s ASP 340 CO 0.02 -0.24 -0.24 -0.63 0.21 0.00 0.00 175.17 174.29 1kke s ILE 341 N -1.96 2.05 -0.12 0.77 1.01 0.59 -0.90 121.20 122.64 1kke s ILE 341 Ca 0.57 -1.01 0.00 0.00 0.00 0.00 0.00 60.65 60.21 1kke s ILE 341 Cb -0.12 -1.78 0.02 0.00 0.01 0.00 0.00 42.46 40.59 1kke s ILE 341 CO 0.17 0.56 -0.10 -0.36 0.00 0.00 0.00 174.94 175.21 1kke s PHE 342 N 0.41 1.70 -0.32 3.97 0.40 -0.07 -1.58 117.98 122.49 1kke s PHE 342 Ca -0.17 -0.87 -0.08 0.00 -0.60 0.00 0.00 56.93 55.21 1kke s PHE 342 Cb -0.18 -1.34 0.02 0.00 0.51 0.00 0.00 43.02 42.04 1kke s PHE 342 CO 0.07 -0.54 0.12 0.42 0.70 0.00 0.00 175.22 175.99 1kke s ILE 343 N 1.53 4.11 -0.16 0.64 1.01 0.14 0.36 121.20 128.83 1kke s ILE 343 Ca 0.03 -0.81 0.00 0.00 0.00 0.00 0.00 60.65 59.87 1kke s ILE 343 Cb -0.13 -3.21 0.03 0.00 0.01 0.00 0.00 42.46 39.17 1kke s ILE 343 CO -0.08 -0.05 -0.10 -0.69 0.00 0.00 0.00 174.94 174.03 1kke s VAL 344 N 1.50 1.36 0.00 2.92 1.01 -0.49 -0.95 120.40 125.75 1kke s VAL 344 Ca 0.02 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.34 1kke s VAL 344 Cb -0.18 -1.40 0.00 0.00 0.00 0.00 0.00 36.38 34.80 1kke s VAL 344 CO 0.04 0.28 0.00 0.47 0.00 0.00 0.00 175.10 175.89 1kke n ASP 345 N 4.81 0.00 -1.76 3.32 8.00 0.11 -1.72 116.55 129.32 1kke n ASP 345 Ca -0.14 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.22 1kke n ASP 345 Cb 0.49 0.00 0.13 0.00 -0.02 0.00 0.00 41.12 41.71 1kke n ASP 345 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1kke n ASP 346 N 3.09 3.53 -4.27 -2.24 8.00 -1.26 -4.88 116.55 118.53 1kke n ASP 346 Ca 0.00 -2.99 -0.24 0.00 0.71 0.00 0.00 54.79 52.27 1kke n ASP 346 Cb 0.00 -0.71 -0.13 0.00 -0.02 0.00 0.00 41.12 40.26 1kke n ASP 346 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1kke s TYR 347 N -2.12 1.76 -0.03 1.24 1.51 -0.70 -0.78 117.35 118.23 1kke s TYR 347 Ca 0.36 -0.41 0.07 0.00 -1.01 0.00 0.00 57.07 56.09 1kke s TYR 347 Cb 0.30 -0.99 -0.02 0.00 -0.11 0.00 0.00 41.96 41.15 1kke s TYR 347 CO 0.07 0.17 -0.24 -1.50 -1.11 0.00 0.00 175.55 172.94 1kke s ILE 348 N -1.08 2.21 -0.16 2.71 2.07 -0.74 -1.40 121.20 124.81 1kke s ILE 348 Ca 0.06 -1.04 0.00 0.00 -1.41 0.00 0.00 60.65 58.26 1kke s ILE 348 Cb -0.10 -1.78 0.03 0.00 0.13 0.00 0.00 42.46 40.74 1kke s ILE 348 CO 0.04 0.58 -0.10 -1.00 -1.91 0.00 0.00 174.94 172.55 1kke s HIS 349 N -0.54 2.04 -0.44 3.50 3.76 0.16 -2.51 115.29 121.26 1kke s HIS 349 Ca 0.08 -1.24 -0.15 0.00 -0.15 0.00 0.00 55.06 53.59 1kke s HIS 349 Cb -0.11 -1.49 0.05 0.00 1.11 0.00 0.00 32.58 32.14 1kke s HIS 349 CO 0.00 -0.66 0.35 0.42 -0.85 0.00 0.00 174.74 174.00 1kke s ILE 350 N 1.53 5.21 -0.95 0.60 1.09 0.48 -0.89 121.20 128.26 1kke s ILE 350 Ca 0.02 -0.89 -0.18 0.00 -1.10 0.00 0.00 60.65 58.51 1kke s ILE 350 Cb -0.14 -4.01 0.15 0.00 -1.06 0.00 0.00 42.46 37.39 1kke s ILE 350 CO -0.09 -0.45 1.12 0.00 -0.10 0.00 0.00 174.94 175.43 1kke s LEU 352 N 2.27 4.55 0.64 0.00 1.43 0.77 -3.13 118.68 125.19 1kke s LEU 352 Ca 0.32 2.20 -0.04 0.00 -1.03 0.00 0.00 54.13 55.59 1kke s LEU 352 Cb -0.05 -3.62 0.05 0.00 0.03 0.00 0.00 46.19 42.59 1kke s LEU 352 CO -0.08 -0.14 0.92 -2.16 0.23 0.00 0.00 176.35 175.12 1kke s PRO 353 N -1.15 2.39 0.39 1.29 0.04 -1.26 -1.54 135.00 135.16 1kke s PRO 353 Ca 0.45 -0.41 -0.26 0.00 0.04 0.00 0.00 61.00 60.83 1kke s PRO 353 Cb -0.31 -2.29 -0.09 0.00 0.04 0.00 0.00 34.50 31.85 1kke s PRO 353 CO 0.39 -1.00 1.22 0.00 0.04 0.00 0.00 177.00 177.65 1kke s ALA 354 N -3.05 3.21 0.17 8.56 0.00 -1.26 -4.37 121.76 125.02 1kke s ALA 354 Ca 0.58 1.07 -0.10 0.00 0.00 0.00 0.00 51.96 53.52 1kke s ALA 354 Cb -0.11 -3.42 -0.00 0.00 0.00 0.00 0.00 23.12 19.59 1kke s ALA 354 CO 0.42 -0.63 0.33 -0.59 0.00 0.00 0.00 175.76 175.29 1kke s PHE 355 N -1.33 0.34 -0.13 0.00 -0.12 -0.84 -4.90 117.98 110.99 1kke s PHE 355 Ca 0.56 -0.70 -0.04 0.00 -0.05 0.00 0.00 56.93 56.71 1kke s PHE 355 Cb -0.34 0.01 -0.03 0.00 -0.63 0.00 0.00 43.02 42.03 1kke s PHE 355 CO 0.43 -0.76 0.00 -0.51 -0.05 0.00 0.00 175.22 174.33 1kke s ASP 356 N -2.96 5.17 0.00 1.98 1.01 -1.26 -0.57 116.67 120.04 1kke s ASP 356 Ca 0.17 0.04 0.00 0.00 0.71 0.00 0.00 52.55 53.46 1kke s ASP 356 Cb 0.03 -1.69 0.00 0.00 1.01 0.00 0.00 42.92 42.26 1kke s ASP 356 CO 0.00 0.26 0.00 0.61 0.21 0.00 0.00 175.17 176.25 1kke n GLY 357 N 2.94 5.69 0.00 0.21 0.00 -0.14 -4.94 105.19 108.94 1kke n GLY 357 Ca -0.18 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 43.98 1kke n GLY 357 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1kke n PHE 358 N 0.00 0.00 -1.78 1.61 3.01 -1.26 -1.71 117.46 117.33 1kke n PHE 358 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.09 1kke n PHE 358 Cb 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 39.48 39.53 1kke n PHE 358 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1kke s SER 359 N 0.30 4.81 0.04 4.37 0.01 -1.06 -3.63 113.70 118.55 1kke s SER 359 Ca 0.00 2.63 0.03 0.00 1.31 0.00 0.00 55.95 59.93 1kke s SER 359 Cb 0.00 -2.62 -0.02 0.00 0.21 0.00 0.00 66.02 63.59 1kke s SER 359 CO 0.00 -1.87 -0.10 0.27 0.41 0.00 0.00 173.24 171.95 1kke s ILE 360 N -1.39 0.80 0.75 1.44 -4.36 -1.26 -4.90 121.20 112.27 1kke s ILE 360 Ca 0.80 -0.98 -0.04 0.00 -0.26 0.00 0.00 60.65 60.17 1kke s ILE 360 Cb -0.37 -0.78 0.13 0.00 1.25 0.00 0.00 42.46 42.69 1kke s ILE 360 CO 0.41 -0.17 1.04 0.00 0.24 0.00 0.00 174.94 176.45 1kke s ALA 361 N -1.04 3.40 0.30 2.27 0.00 -1.26 -4.98 121.76 120.45 1kke s ALA 361 Ca -0.04 -1.53 -0.01 0.00 0.00 0.00 0.00 51.96 50.38 1kke s ALA 361 Cb -0.08 -2.20 0.45 0.00 0.00 0.00 0.00 23.12 21.28 1kke s ALA 361 CO 0.01 -1.57 1.91 -0.44 0.00 0.00 0.00 175.76 175.67 1kke h ASP 362 N -0.69 0.84 -3.79 0.00 3.32 -1.92 -3.41 116.42 110.77 1kke h ASP 362 Ca -0.39 -0.08 -0.48 0.00 0.02 0.00 0.00 57.03 56.10 1kke h ASP 362 Cb 1.27 -0.21 -0.31 0.00 0.22 0.00 0.00 39.33 40.29 1kke h ASP 362 CO 0.43 0.70 -0.80 -0.83 -1.72 0.00 0.00 179.24 177.01 1kke s GLY 363 N -3.47 0.68 0.31 2.75 0.00 -1.26 -2.44 107.32 103.88 1kke s GLY 363 Ca -0.11 -0.44 -0.18 0.00 0.00 0.00 0.00 44.72 43.99 1kke s GLY 363 CO 0.79 -0.13 0.87 -0.32 0.00 0.00 0.00 173.10 174.32 1kke s GLY 364 N 0.22 0.25 -0.01 0.20 0.00 -0.05 -4.32 107.32 103.61 1kke s GLY 364 Ca -0.05 -0.57 0.07 0.00 0.00 0.00 0.00 44.72 44.17 1kke s GLY 364 CO 0.01 0.60 -0.22 0.99 0.00 0.00 0.00 173.10 174.48 1kke s ASP 365 N -3.17 2.60 -0.25 1.64 1.01 0.47 -1.17 116.67 117.80 1kke s ASP 365 Ca 0.17 -0.41 -0.02 0.00 0.71 0.00 0.00 52.55 53.00 1kke s ASP 365 Cb -0.04 -0.28 0.02 0.00 1.01 0.00 0.00 42.92 43.63 1kke s ASP 365 CO 0.09 0.27 -0.05 -0.22 0.21 0.00 0.00 175.17 175.47 1kke s LEU 366 N -0.58 3.23 -0.17 1.23 2.96 0.69 -1.14 118.68 124.91 1kke s LEU 366 Ca 0.09 -0.83 -0.05 0.00 -0.22 0.00 0.00 54.13 53.12 1kke s LEU 366 Cb -0.09 -1.69 -0.03 0.00 0.50 0.00 0.00 46.19 44.89 1kke s LEU 366 CO -0.01 -0.13 -0.01 -0.44 -1.32 0.00 0.00 176.35 174.45 1kke s SER 367 N 1.35 5.02 -0.29 3.68 0.01 0.60 -0.28 113.70 123.80 1kke s SER 367 Ca 0.01 -0.08 -0.11 0.00 1.31 0.00 0.00 55.95 57.08 1kke s SER 367 Cb -0.17 -1.83 -0.04 0.00 0.21 0.00 0.00 66.02 64.19 1kke s SER 367 CO -0.04 0.16 0.18 -0.76 0.41 0.00 0.00 173.24 173.20 1kke s LEU 368 N 0.40 4.02 -0.63 2.44 1.43 0.16 -1.08 118.68 125.42 1kke s LEU 368 Ca -0.02 -0.12 -0.21 0.00 -1.03 0.00 0.00 54.13 52.75 1kke s LEU 368 Cb -0.14 -2.09 0.08 0.00 0.03 0.00 0.00 46.19 44.07 1kke s LEU 368 CO 0.02 -0.08 0.87 0.21 0.23 0.00 0.00 176.35 177.60 1kke s ASN 369 N 1.73 6.18 0.00 2.29 2.47 -0.99 -1.27 114.94 125.35 1kke s ASN 369 Ca 0.07 -1.10 0.28 0.00 0.42 0.00 0.00 52.86 52.53 1kke s ASN 369 Cb -0.16 -2.38 1.02 0.00 -1.45 0.00 0.00 41.25 38.28 1kke s ASN 369 CO 0.10 -1.32 1.72 0.49 -3.72 0.00 0.00 177.10 174.38 1kke n PHE 370 N 7.23 0.00 0.17 0.43 0.99 0.28 -3.89 117.46 122.67 1kke n PHE 370 Ca -0.05 0.00 0.09 0.00 -0.00 0.00 0.00 57.45 57.48 1kke n PHE 370 Cb 0.45 -0.05 0.60 0.00 -1.00 0.00 0.00 39.48 39.47 1kke n PHE 370 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 1kke h VAL 371 N 1.72 0.98 -4.02 -4.37 2.07 -1.86 -3.39 116.25 107.38 1kke h VAL 371 Ca 0.00 -0.04 -0.17 0.00 0.82 0.00 0.00 66.70 67.31 1kke h VAL 371 Cb 0.46 0.86 -0.20 0.00 -1.52 0.00 0.00 31.29 30.89 1kke h VAL 371 CO 0.00 0.02 -0.70 0.42 0.02 0.00 0.00 177.57 177.33 1kke s THR 372 N -5.15 0.17 0.00 2.57 -4.23 -1.25 -4.88 115.64 102.87 1kke s THR 372 Ca -0.06 -1.09 0.00 0.00 -1.18 0.00 0.00 61.69 59.37 1kke s THR 372 Cb 0.17 -0.52 0.00 0.00 1.34 0.00 0.00 72.50 73.50 1kke s THR 372 CO 0.69 -0.58 0.00 0.61 -0.54 0.00 0.00 174.62 174.80 1kke n GLY 373 N 1.32 2.17 3.72 3.99 0.00 -1.26 -4.66 105.19 110.46 1kke n GLY 373 Ca -0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 1kke n GLY 373 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1kke s LEU 374 N 0.00 4.39 -0.10 0.99 1.43 -1.26 -0.93 118.68 123.20 1kke s LEU 374 Ca 0.00 1.62 -0.30 0.00 -1.03 0.00 0.00 54.13 54.42 1kke s LEU 374 Cb 0.00 -3.50 -0.03 0.00 0.03 0.00 0.00 46.19 42.69 1kke s LEU 374 CO 0.00 -0.20 1.25 -0.22 0.23 0.00 0.00 176.35 177.41 1kke s LEU 375 N 0.77 4.24 0.90 1.79 2.96 -0.99 -4.86 118.68 123.49 1kke s LEU 375 Ca 0.49 1.80 -0.11 0.00 -0.22 0.00 0.00 54.13 56.09 1kke s LEU 375 Cb -0.21 -3.55 0.13 0.00 0.50 0.00 0.00 46.19 43.06 1kke s LEU 375 CO 0.27 -0.68 1.11 -2.65 -1.32 0.00 0.00 176.35 173.08 1kke n PRO 376 N 5.84 -0.32 -0.10 0.98 -0.02 -1.26 -2.23 135.00 137.90 1kke n PRO 376 Ca 0.12 -0.02 -0.01 0.00 -2.02 0.00 0.00 63.50 61.57 1kke n PRO 376 Cb 0.45 -2.35 0.03 0.00 -0.02 0.00 0.00 33.50 31.61 1kke n PRO 376 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1kke n PRO 377 N -3.86 1.24 -2.85 0.52 -0.04 -1.26 -5.08 135.00 123.67 1kke n PRO 377 Ca 0.12 -0.28 -0.37 0.00 -0.04 0.00 0.00 63.50 62.93 1kke n PRO 377 Cb 0.52 -1.35 -0.06 0.00 -0.04 0.00 0.00 33.50 32.57 1kke n PRO 377 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1kke s LEU 378 N -0.27 4.37 0.17 1.53 2.96 -0.94 -5.07 118.68 121.42 1kke s LEU 378 Ca 0.05 1.75 0.05 0.00 -0.22 0.00 0.00 54.13 55.76 1kke s LEU 378 Cb 0.04 -3.88 -0.05 0.00 0.50 0.00 0.00 46.19 42.81 1kke s LEU 378 CO 0.01 -0.02 -0.10 -0.76 -1.32 0.00 0.00 176.35 174.16 1kke s LEU 379 N -1.95 2.51 0.28 -0.68 1.43 -1.26 -4.67 118.68 114.34 1kke s LEU 379 Ca 0.48 -1.03 0.02 0.00 -1.03 0.00 0.00 54.13 52.57 1kke s LEU 379 Cb -0.19 -0.40 0.69 0.00 0.03 0.00 0.00 46.19 46.32 1kke s LEU 379 CO 0.24 -0.32 1.69 0.74 0.23 0.00 0.00 176.35 178.93 1kke h THR 380 N 2.71 0.46 -0.08 5.49 2.02 -1.90 0.11 112.91 121.71 1kke h THR 380 Ca -0.37 -0.12 0.02 0.00 0.77 0.00 0.00 66.41 66.71 1kke h THR 380 Cb 1.20 0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.68 1kke h THR 380 CO 0.63 0.06 0.07 1.23 0.37 0.00 0.00 175.52 177.89 1kke h GLY 381 N 0.35 0.00 2.00 2.16 0.00 -1.96 -1.76 103.07 103.87 1kke h GLY 381 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1kke h GLY 381 CO -0.54 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.22 1kke n ASP 382 N -4.17 0.25 -0.56 0.19 8.00 0.37 -2.16 116.55 118.48 1kke n ASP 382 Ca -0.01 0.57 0.12 0.00 0.71 0.00 0.00 54.79 56.19 1kke n ASP 382 Cb 0.18 -0.62 0.25 0.00 -0.02 0.00 0.00 41.12 40.91 1kke n ASP 382 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1kke n THR 383 N -1.79 0.00 -1.98 -3.53 -2.24 -0.66 -4.82 114.28 99.27 1kke n THR 383 Ca 0.02 -0.29 -0.42 0.00 -2.27 0.00 0.00 64.05 61.09 1kke n THR 383 Cb 0.16 0.94 -0.03 0.00 -2.10 0.00 0.00 70.33 69.30 1kke n THR 383 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1kke s GLU 384 N -2.23 4.24 0.72 -0.78 2.12 -0.92 -4.91 118.70 116.94 1kke s GLU 384 Ca 0.27 2.33 -0.11 0.00 0.36 0.00 0.00 54.97 57.82 1kke s GLU 384 Cb 0.20 -3.13 0.02 0.00 0.26 0.00 0.00 34.13 31.48 1kke s GLU 384 CO 0.42 -0.51 1.07 -2.14 -0.54 0.00 0.00 175.26 173.57 1kke s PRO 385 N 0.34 2.71 0.49 4.30 0.02 -1.26 -0.33 135.00 141.28 1kke s PRO 385 Ca 0.64 0.81 0.20 0.00 0.02 0.00 0.00 61.00 62.68 1kke s PRO 385 Cb -0.43 -1.98 1.26 0.00 0.02 0.00 0.00 34.50 33.38 1kke s PRO 385 CO 0.38 -1.22 2.06 0.00 -0.33 0.00 0.00 177.00 177.88 1kke h ALA 386 N -0.80 1.56 -0.35 -1.55 0.00 -0.84 0.52 119.26 117.80 1kke h ALA 386 Ca -0.45 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1kke h ALA 386 Cb 1.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1kke h ALA 386 CO 0.58 0.16 0.00 1.97 0.00 0.00 0.00 179.25 181.97 1kke n PHE 387 N -4.06 0.80 0.00 0.00 1.16 -1.26 -4.88 117.46 109.21 1kke n PHE 387 Ca -0.02 -0.32 0.00 0.00 -1.87 0.00 0.00 57.45 55.24 1kke n PHE 387 Cb 0.21 -0.15 0.00 0.00 -1.61 0.00 0.00 39.48 37.93 1kke n PHE 387 CO 0.00 0.00 0.00 0.72 -1.87 0.00 0.00 176.76 175.61 1kke n HIS 388 N 0.50 0.00 -1.65 2.97 8.25 0.17 -1.74 115.22 123.73 1kke n HIS 388 Ca 0.14 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.49 1kke n HIS 388 Cb 0.53 0.00 0.14 0.00 1.12 0.00 0.00 29.99 31.77 1kke n HIS 388 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1kke n ASN 389 N 7.67 3.53 -4.79 0.41 0.23 -1.26 -4.20 115.26 116.85 1kke n ASN 389 Ca 0.00 -3.81 -0.37 0.00 -0.53 0.00 0.00 54.58 49.87 1kke n ASN 389 Cb 0.00 -0.56 -0.06 0.00 -2.08 0.00 0.00 39.78 37.08 1kke n ASN 389 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 1kke s ASP 390 N -2.94 7.24 -0.20 0.53 -0.00 -0.71 -4.78 116.67 115.80 1kke s ASP 390 Ca 0.47 1.67 -0.27 0.00 -0.00 0.00 0.00 52.55 54.43 1kke s ASP 390 Cb 0.41 -2.52 -0.00 0.00 -0.00 0.00 0.00 42.92 40.81 1kke s ASP 390 CO -0.01 -0.02 0.92 -0.69 -0.00 0.00 0.00 175.17 175.38 1kke s VAL 391 N -1.56 4.79 0.29 -1.27 1.01 -1.26 -4.56 120.40 117.83 1kke s VAL 391 Ca 0.47 1.80 0.03 0.00 0.00 0.00 0.00 61.98 64.28 1kke s VAL 391 Cb -0.18 -4.21 -0.01 0.00 0.00 0.00 0.00 36.38 31.98 1kke s VAL 391 CO 0.23 -0.08 0.11 1.33 0.00 0.00 0.00 175.10 176.70 1kke n VAL 392 N 5.07 0.00 -3.09 2.92 0.24 0.33 -5.03 118.33 118.77 1kke n VAL 392 Ca 0.08 -1.71 -0.21 0.00 -2.04 0.00 0.00 64.34 60.46 1kke n VAL 392 Cb 0.47 0.64 -0.03 0.00 -1.47 0.00 0.00 33.84 33.45 1kke n VAL 392 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1kke n THR 393 N -0.64 1.08 -3.15 3.34 -1.04 -1.25 -4.23 114.28 108.39 1kke n THR 393 Ca -0.03 -4.96 -0.36 0.00 -2.04 0.00 0.00 64.05 56.66 1kke n THR 393 Cb 0.44 -0.69 -0.06 0.00 -1.82 0.00 0.00 70.33 68.20 1kke n THR 393 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 1kke s TYR 394 N -2.84 3.61 -1.56 -1.42 5.04 -0.83 -4.35 117.35 115.00 1kke s TYR 394 Ca 0.43 1.31 -0.13 0.00 -2.44 0.00 0.00 57.07 56.24 1kke s TYR 394 Cb 0.32 -2.56 0.09 0.00 0.35 0.00 0.00 41.96 40.17 1kke s TYR 394 CO -0.10 0.32 0.82 0.41 -1.34 0.00 0.00 175.55 175.67 1kke n GLY 395 N 0.61 -0.43 3.77 8.97 0.00 -1.26 -0.89 105.19 115.96 1kke n GLY 395 Ca -0.02 0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1kke n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kke s ALA 396 N -3.41 3.52 0.15 4.61 0.00 -1.26 -4.59 121.76 120.78 1kke s ALA 396 Ca 0.55 1.45 -0.15 0.00 0.00 0.00 0.00 51.96 53.81 1kke s ALA 396 Cb -0.29 -3.56 0.03 0.00 0.00 0.00 0.00 23.12 19.30 1kke s ALA 396 CO 0.87 -0.92 0.42 1.14 0.00 0.00 0.00 175.76 177.27 1kke s GLN 397 N -2.03 1.18 -0.17 0.00 -2.07 0.25 -4.99 119.66 111.84 1kke s GLN 397 Ca 0.52 -0.83 -0.11 0.00 -1.82 0.00 0.00 55.36 53.12 1kke s GLN 397 Cb -0.44 0.47 -0.05 0.00 -1.09 0.00 0.00 33.01 31.90 1kke s GLN 397 CO 0.59 -0.47 0.20 0.99 -1.32 0.00 0.00 175.29 175.27 1kke s THR 398 N -3.85 5.38 -0.02 3.63 2.01 -1.26 -0.87 115.64 120.65 1kke s THR 398 Ca 0.07 0.33 0.04 0.00 0.31 0.00 0.00 61.69 62.44 1kke s THR 398 Cb 0.01 -3.52 -0.00 0.00 0.01 0.00 0.00 72.50 69.00 1kke s THR 398 CO -0.07 0.46 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.50 1kke s VAL 399 N 0.13 1.01 -0.32 3.82 1.01 0.03 -4.98 120.40 121.10 1kke s VAL 399 Ca 0.12 -0.51 -0.12 0.00 0.00 0.00 0.00 61.98 61.47 1kke s VAL 399 Cb -0.12 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.38 1kke s VAL 399 CO 0.01 0.29 0.21 0.00 0.00 0.00 0.00 175.10 175.62 1kke s ALA 400 N -0.08 3.46 -0.11 5.51 0.00 -1.26 -0.27 121.76 129.01 1kke s ALA 400 Ca 0.01 -1.33 -0.02 0.00 0.00 0.00 0.00 51.96 50.62 1kke s ALA 400 Cb -0.07 -2.57 -0.03 0.00 0.00 0.00 0.00 23.12 20.45 1kke s ALA 400 CO 0.00 -0.87 -0.02 0.42 0.00 0.00 0.00 175.76 175.29 1kke s ILE 401 N 1.71 4.12 -0.32 0.00 1.01 -0.12 -4.31 121.20 123.28 1kke s ILE 401 Ca 0.06 -0.31 -0.20 0.00 0.00 0.00 0.00 60.65 60.20 1kke s ILE 401 Cb -0.17 -2.75 -0.01 0.00 0.01 0.00 0.00 42.46 39.55 1kke s ILE 401 CO 0.10 0.57 0.62 -0.83 0.00 0.00 0.00 174.94 175.40 1kke s GLY 402 N -0.47 1.77 -0.14 6.18 0.00 -0.07 -0.67 107.32 113.92 1kke s GLY 402 Ca 0.08 -0.70 -0.06 0.00 0.00 0.00 0.00 44.72 44.04 1kke s GLY 402 CO 0.02 1.45 0.08 1.08 0.00 0.00 0.00 173.10 175.74 1kke s LEU 403 N 2.61 4.00 0.23 0.66 1.43 -0.10 0.74 118.68 128.27 1kke s LEU 403 Ca 0.25 0.25 -0.11 0.00 -1.03 0.00 0.00 54.13 53.48 1kke s LEU 403 Cb -0.15 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 44.08 1kke s LEU 403 CO 0.12 0.30 0.41 -0.94 0.23 0.00 0.00 176.35 176.48 1kke s SER 404 N -0.40 -0.05 -0.11 2.29 1.04 -0.80 -0.32 113.70 115.34 1kke s SER 404 Ca 0.10 -0.99 0.17 0.00 0.48 0.00 0.00 55.95 55.70 1kke s SER 404 Cb -0.12 0.54 0.39 0.00 0.10 0.00 0.00 66.02 66.93 1kke s SER 404 CO 0.02 -1.08 1.18 -1.20 0.98 0.00 0.00 173.24 173.14 1kke n SER 405 N -0.35 1.38 0.00 7.02 7.64 -1.26 -1.02 113.62 127.03 1kke n SER 405 Ca -0.02 -3.00 0.00 0.00 1.01 0.00 0.00 58.87 56.87 1kke n SER 405 Cb 0.63 -0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 1kke n SER 405 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1kke n GLY 406 N -0.46 1.90 0.00 0.23 0.00 -1.26 -4.94 105.19 100.65 1kke n GLY 406 Ca 0.13 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1kke n GLY 406 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kke n GLY 407 N 0.00 -0.27 3.72 -0.02 0.00 -1.26 -4.99 105.19 102.37 1kke n GLY 407 Ca 0.00 -1.76 -0.43 0.00 0.00 0.00 0.00 46.02 43.83 1kke n GLY 407 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kke n ALA 408 N -3.00 1.90 -1.51 4.61 0.00 -1.26 -4.86 120.51 116.40 1kke n ALA 408 Ca 0.00 0.38 -0.32 0.00 0.00 0.00 0.00 53.44 53.50 1kke n ALA 408 Cb 0.00 -2.37 0.05 0.00 0.00 0.00 0.00 19.45 17.13 1kke n ALA 408 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1kke s PRO 409 N -0.78 2.85 -0.22 0.00 0.02 -1.26 -4.82 135.00 130.78 1kke s PRO 409 Ca 0.63 1.21 -0.01 0.00 0.02 0.00 0.00 61.00 62.86 1kke s PRO 409 Cb -0.55 -1.97 0.02 0.00 0.02 0.00 0.00 34.50 32.02 1kke s PRO 409 CO 0.52 -1.19 -0.10 -0.65 -0.33 0.00 0.00 177.00 175.24 1kke s GLN 410 N -4.43 2.92 -0.29 5.54 -1.52 0.56 -4.88 119.66 117.56 1kke s GLN 410 Ca 0.63 -0.91 -0.24 0.00 -1.95 0.00 0.00 55.36 52.90 1kke s GLN 410 Cb -0.17 -2.86 0.00 0.00 -0.22 0.00 0.00 33.01 29.76 1kke s GLN 410 CO 0.46 -0.32 0.81 0.71 -0.25 0.00 0.00 175.29 176.69 1kke s TYR 411 N 1.32 3.22 -0.14 0.91 1.51 -1.26 -0.92 117.35 121.99 1kke s TYR 411 Ca 0.02 0.89 -0.07 0.00 -1.01 0.00 0.00 57.07 56.90 1kke s TYR 411 Cb -0.15 -3.21 -0.04 0.00 -0.11 0.00 0.00 41.96 38.45 1kke s TYR 411 CO -0.07 -0.54 0.10 -1.64 -1.11 0.00 0.00 175.55 172.29 1kke s MET 412 N 2.96 3.58 -0.34 -0.62 -1.94 0.15 -4.89 119.30 118.21 1kke s MET 412 Ca 0.33 -0.23 -0.21 0.00 -1.71 0.00 0.00 55.69 53.88 1kke s MET 412 Cb -0.14 -3.17 -0.00 0.00 2.01 0.00 0.00 34.83 33.53 1kke s MET 412 CO 0.12 0.60 0.65 -1.12 -0.01 0.00 0.00 175.02 175.26 1kke s SER 413 N -0.53 6.46 0.18 3.03 0.01 -1.26 -0.94 113.70 120.64 1kke s SER 413 Ca 0.12 0.26 0.09 0.00 1.31 0.00 0.00 55.95 57.73 1kke s SER 413 Cb -0.12 -2.34 -0.04 0.00 0.21 0.00 0.00 66.02 63.73 1kke s SER 413 CO 0.02 -0.57 -0.12 -0.54 0.41 0.00 0.00 173.24 172.44 1kke s LYS 414 N 2.72 1.96 -0.15 12.44 1.02 0.62 -3.47 119.74 134.89 1kke s LYS 414 Ca 0.25 -1.30 -0.16 0.00 0.02 0.00 0.00 55.97 54.78 1kke s LYS 414 Cb -0.14 -2.11 -0.04 0.00 -0.52 0.00 0.00 37.83 35.01 1kke s LYS 414 CO 0.14 0.43 0.40 1.21 -0.92 0.00 0.00 175.35 176.61 1kke s ASN 415 N -2.75 6.56 0.01 2.83 2.47 0.10 -0.79 114.94 123.36 1kke s ASN 415 Ca 0.24 0.66 0.04 0.00 0.42 0.00 0.00 52.86 54.22 1kke s ASN 415 Cb -0.09 -2.24 -0.01 0.00 -1.45 0.00 0.00 41.25 37.46 1kke s ASN 415 CO 0.14 0.02 -0.13 -0.22 -3.72 0.00 0.00 177.10 173.19 1kke s LEU 416 N 0.70 2.07 0.15 3.21 0.20 -0.05 -0.83 118.68 124.14 1kke s LEU 416 Ca 0.22 -0.30 -0.21 0.00 0.69 0.00 0.00 54.13 54.53 1kke s LEU 416 Cb -0.14 -0.62 0.06 0.00 -0.43 0.00 0.00 46.19 45.06 1kke s LEU 416 CO 0.08 0.11 0.54 -1.66 -0.29 0.00 0.00 176.35 175.13 1kke s TRP 417 N -0.47 -0.43 -0.20 5.38 -2.14 -0.74 -0.58 118.94 119.77 1kke s TRP 417 Ca 0.04 0.19 -0.29 0.00 2.66 0.00 0.00 56.10 58.69 1kke s TRP 417 Cb -0.06 0.47 -0.01 0.00 -3.10 0.00 0.00 33.47 30.78 1kke s TRP 417 CO 0.00 -0.81 1.21 0.08 -2.66 0.00 0.00 176.95 174.77 1kke s VAL 418 N -3.77 4.38 -0.27 -0.66 1.01 -0.07 -0.62 120.40 120.41 1kke s VAL 418 Ca 0.02 1.65 -0.13 0.00 0.00 0.00 0.00 61.98 63.52 1kke s VAL 418 Cb -0.00 -4.10 -0.14 0.00 0.00 0.00 0.00 36.38 32.14 1kke s VAL 418 CO -0.12 -0.18 -0.27 1.21 0.00 0.00 0.00 175.10 175.73 1kke n GLU 419 N 6.60 0.60 -3.54 2.72 2.13 -0.50 -1.97 120.64 126.68 1kke n GLU 419 Ca 0.13 0.28 -0.12 0.00 0.66 0.00 0.00 57.16 58.11 1kke n GLU 419 Cb 0.45 -1.53 -0.04 0.00 0.27 0.00 0.00 31.44 30.59 1kke n GLU 419 CO 0.00 0.00 0.00 -1.14 -0.41 0.00 0.00 177.13 175.58 1kke s GLN 420 N -2.50 0.81 -0.12 5.31 0.74 -1.05 -0.51 119.66 122.34 1kke s GLN 420 Ca -0.37 0.04 0.03 0.00 0.05 0.00 0.00 55.36 55.11 1kke s GLN 420 Cb 0.13 0.38 0.00 0.00 1.10 0.00 0.00 33.01 34.63 1kke s GLN 420 CO 0.52 -0.29 -0.22 -0.46 -0.55 0.00 0.00 175.29 174.30 1kke s TRP 421 N -1.73 2.64 -0.10 1.67 -0.00 -1.26 -0.08 118.94 120.08 1kke s TRP 421 Ca -0.03 -1.15 -0.05 0.00 -0.00 0.00 0.00 56.10 54.88 1kke s TRP 421 Cb -0.00 -1.78 0.05 0.00 -0.00 0.00 0.00 33.47 31.74 1kke s TRP 421 CO 0.01 -0.50 0.22 -1.14 -0.00 0.00 0.00 176.95 175.54 1kke s GLN 422 N 0.58 0.15 -1.63 5.86 0.74 -0.39 -4.04 119.66 120.94 1kke s GLN 422 Ca -0.12 0.56 -0.17 0.00 0.05 0.00 0.00 55.36 55.68 1kke s GLN 422 Cb -0.17 -0.13 0.13 0.00 1.10 0.00 0.00 33.01 33.95 1kke s GLN 422 CO 0.03 -0.21 0.85 -0.25 -0.55 0.00 0.00 175.29 175.16 1kke n ASP 423 N 4.60 -3.90 0.00 6.67 8.00 -1.26 -1.08 116.55 129.58 1kke n ASP 423 Ca -0.19 -0.89 0.00 0.00 0.71 0.00 0.00 54.79 54.42 1kke n ASP 423 Cb 0.52 -3.16 0.00 0.00 -0.02 0.00 0.00 41.12 38.45 1kke n ASP 423 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1kke n GLY 424 N -1.48 0.74 3.12 0.44 0.00 -1.26 -4.82 105.19 101.94 1kke n GLY 424 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 1kke n GLY 424 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kke s VAL 425 N -2.55 2.10 -0.27 1.61 1.01 -0.24 -0.55 120.40 121.51 1kke s VAL 425 Ca 0.00 -0.96 -0.19 0.00 0.00 0.00 0.00 61.98 60.83 1kke s VAL 425 Cb 0.00 -1.90 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 1kke s VAL 425 CO 0.00 0.51 0.58 -0.22 0.00 0.00 0.00 175.10 175.96 1kke s LEU 426 N 1.29 4.09 -0.24 3.92 2.96 -0.40 -1.26 118.68 129.04 1kke s LEU 426 Ca 0.04 0.53 -0.10 0.00 -0.22 0.00 0.00 54.13 54.38 1kke s LEU 426 Cb -0.13 -2.75 -0.05 0.00 0.50 0.00 0.00 46.19 43.76 1kke s LEU 426 CO -0.12 -0.37 0.16 -0.60 -1.32 0.00 0.00 176.35 174.10 1kke s ARG 427 N 2.44 4.04 -0.12 1.98 3.52 0.88 -0.67 118.95 131.02 1kke s ARG 427 Ca 0.23 -0.29 -0.01 0.00 -0.13 0.00 0.00 55.73 55.53 1kke s ARG 427 Cb -0.15 -3.54 -0.03 0.00 -1.56 0.00 0.00 34.95 29.67 1kke s ARG 427 CO 0.10 0.02 -0.07 -0.51 -0.81 0.00 0.00 175.30 174.03 1kke s LEU 428 N 1.16 3.11 -0.04 -0.88 1.43 0.62 -1.42 118.68 122.67 1kke s LEU 428 Ca 0.07 -0.13 -0.19 0.00 -1.03 0.00 0.00 54.13 52.85 1kke s LEU 428 Cb -0.14 -1.72 -0.05 0.00 0.03 0.00 0.00 46.19 44.32 1kke s LEU 428 CO 0.05 0.23 0.53 -0.60 0.23 0.00 0.00 176.35 176.80 1kke s ARG 429 N -0.04 4.27 -0.13 1.70 6.06 0.21 -0.22 118.95 130.80 1kke s ARG 429 Ca -0.00 0.59 -0.00 0.00 -2.50 0.00 0.00 55.73 53.82 1kke s ARG 429 Cb -0.13 -3.36 0.03 0.00 0.06 0.00 0.00 34.95 31.55 1kke s ARG 429 CO 0.03 0.34 -0.07 0.08 -2.50 0.00 0.00 175.30 173.18 1kke s VAL 430 N -0.03 1.10 0.22 7.11 1.01 -0.32 -1.78 120.40 127.71 1kke s VAL 430 Ca 0.28 -0.43 -0.23 0.00 0.00 0.00 0.00 61.98 61.61 1kke s VAL 430 Cb -0.17 -1.16 0.04 0.00 0.00 0.00 0.00 36.38 35.09 1kke s VAL 430 CO 0.14 0.30 0.82 -1.83 0.00 0.00 0.00 175.10 174.53 1kke s GLU 431 N 1.67 1.53 0.19 2.72 -1.05 -0.01 -0.87 118.70 122.88 1kke s GLU 431 Ca 0.04 -0.84 0.00 0.00 -0.15 0.00 0.00 54.97 54.01 1kke s GLU 431 Cb -0.13 0.52 0.00 0.00 -0.44 0.00 0.00 34.13 34.08 1kke s GLU 431 CO -0.08 -0.70 0.00 0.41 0.95 0.00 0.00 175.26 175.84 1kke n GLY 432 N -0.46 -1.84 3.92 -3.83 0.00 -1.02 0.00 105.19 101.95 1kke n GLY 432 Ca -0.05 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1kke n GLY 432 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kke n GLY 433 N 0.00 0.00 0.40 -0.02 0.00 -1.23 -4.75 105.19 99.59 1kke n GLY 433 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1kke n GLY 433 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kke n GLY 434 N -1.48 -1.76 3.22 -0.02 0.00 -1.26 -4.71 105.19 99.17 1kke n GLY 434 Ca 0.00 -1.41 -0.12 0.00 0.00 0.00 0.00 46.02 44.48 1kke n GLY 434 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1kke s SER 435 N -4.43 -0.12 0.26 1.61 1.04 -1.26 -4.95 113.70 105.85 1kke s SER 435 Ca 0.00 -0.07 0.12 0.00 0.48 0.00 0.00 55.95 56.48 1kke s SER 435 Cb 0.00 0.30 -0.05 0.00 0.10 0.00 0.00 66.02 66.37 1kke s SER 435 CO 0.00 -0.48 -0.19 0.27 0.98 0.00 0.00 173.24 173.81 1kke s ILE 436 N -1.73 2.53 0.16 -1.02 -4.36 -1.26 -5.09 121.20 110.41 1kke s ILE 436 Ca -0.11 -2.29 -0.31 0.00 -0.26 0.00 0.00 60.65 57.68 1kke s ILE 436 Cb -0.04 -2.30 -0.09 0.00 1.25 0.00 0.00 42.46 41.27 1kke s ILE 436 CO 0.01 -0.33 1.48 -0.89 0.24 0.00 0.00 174.94 175.45 1kke s THR 437 N -2.31 2.88 0.24 8.37 2.01 -1.26 -4.97 115.64 120.61 1kke s THR 437 Ca 0.28 0.65 -0.22 0.00 0.31 0.00 0.00 61.69 62.70 1kke s THR 437 Cb -0.06 -3.41 0.03 0.00 0.01 0.00 0.00 72.50 69.07 1kke s THR 437 CO 0.14 0.06 0.79 -1.38 -0.69 0.00 0.00 174.62 173.53 1kke s HIS 438 N 0.97 -0.18 0.00 4.92 -0.00 -1.26 -4.76 115.29 114.98 1kke s HIS 438 Ca 0.67 -0.23 0.00 0.00 -0.00 0.00 0.00 55.06 55.49 1kke s HIS 438 Cb -0.41 0.69 0.00 0.00 -0.00 0.00 0.00 32.58 32.86 1kke s HIS 438 CO 0.32 -1.12 0.00 -1.13 -0.00 0.00 0.00 174.74 172.82 1kke n SER 439 N -0.46 2.20 -4.27 7.38 3.41 -0.18 -4.73 113.62 116.97 1kke n SER 439 Ca -0.05 -0.07 -0.15 0.00 -0.26 0.00 0.00 58.87 58.34 1kke n SER 439 Cb 0.60 0.58 -0.10 0.00 -0.26 0.00 0.00 64.21 65.02 1kke n SER 439 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1kke s ASN 440 N -1.02 1.93 -0.01 4.04 0.01 -0.70 -2.56 114.94 116.63 1kke s ASN 440 Ca 0.00 -1.03 -0.01 0.00 -0.71 0.00 0.00 52.86 51.11 1kke s ASN 440 Cb 0.00 -0.03 0.00 0.00 0.41 0.00 0.00 41.25 41.63 1kke s ASN 440 CO 0.00 -0.32 0.03 -0.94 -1.51 0.00 0.00 177.10 174.36 1kke s SER 441 N -3.20 -0.02 -0.40 -1.22 1.04 -0.69 -1.91 113.70 107.29 1kke s SER 441 Ca 0.19 0.03 -0.07 0.00 0.48 0.00 0.00 55.95 56.58 1kke s SER 441 Cb 0.02 0.08 0.09 0.00 0.10 0.00 0.00 66.02 66.31 1kke s SER 441 CO 0.02 -0.04 0.22 -0.54 0.98 0.00 0.00 173.24 173.88 1kke s LYS 442 N -0.11 2.41 0.02 4.02 -0.14 0.23 -0.97 119.74 125.21 1kke s LYS 442 Ca -0.01 -1.55 -0.20 0.00 -1.36 0.00 0.00 55.97 52.85 1kke s LYS 442 Cb -0.01 -3.66 -0.06 0.00 -1.68 0.00 0.00 37.83 32.42 1kke s LYS 442 CO 0.00 -0.96 0.58 -1.58 -0.76 0.00 0.00 175.35 172.63 1kke s TRP 443 N 1.32 3.73 0.67 3.18 0.52 0.26 -0.89 118.94 127.73 1kke s TRP 443 Ca 0.03 1.22 -0.09 0.00 0.02 0.00 0.00 56.10 57.28 1kke s TRP 443 Cb -0.23 -2.56 0.01 0.00 -1.15 0.00 0.00 33.47 29.55 1kke s TRP 443 CO -0.00 0.44 1.03 -1.25 0.02 0.00 0.00 176.95 177.19 1kke s PRO 444 N -0.54 2.85 0.35 4.98 0.04 -1.26 -1.98 135.00 139.43 1kke s PRO 444 Ca 0.30 0.28 -0.28 0.00 0.04 0.00 0.00 61.00 61.34 1kke s PRO 444 Cb -0.19 -2.11 -0.11 0.00 0.04 0.00 0.00 34.50 32.14 1kke s PRO 444 CO 0.18 -0.94 1.38 0.00 0.04 0.00 0.00 177.00 177.66 1kke s ALA 445 N -3.24 3.52 0.00 8.56 0.00 -1.26 -4.38 121.76 124.96 1kke s ALA 445 Ca 0.57 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.92 1kke s ALA 445 Cb -0.11 -3.53 -0.00 0.00 0.00 0.00 0.00 23.12 19.48 1kke s ALA 445 CO 0.49 -0.81 -0.01 -1.64 0.00 0.00 0.00 175.76 173.78 1kke s MET 446 N -1.93 0.12 -0.20 0.00 -1.94 -0.59 -4.89 119.30 109.87 1kke s MET 446 Ca 0.51 -0.13 -0.04 0.00 -1.71 0.00 0.00 55.69 54.31 1kke s MET 446 Cb -0.42 -0.05 -0.02 0.00 2.01 0.00 0.00 34.83 36.35 1kke s MET 446 CO 0.57 0.01 -0.03 0.99 -0.01 0.00 0.00 175.02 176.55 1kke s THR 447 N -0.26 3.63 -0.25 2.05 2.01 -1.26 -0.16 115.64 121.40 1kke s THR 447 Ca -0.02 -0.42 -0.07 0.00 0.31 0.00 0.00 61.69 61.49 1kke s THR 447 Cb -0.02 -2.63 -0.03 0.00 0.01 0.00 0.00 72.50 69.83 1kke s THR 447 CO -0.00 0.43 0.07 -0.69 -0.69 0.00 0.00 174.62 173.74 1kke s VAL 448 N 1.13 4.27 0.06 3.82 1.01 -0.21 -4.94 120.40 125.54 1kke s VAL 448 Ca 0.02 -0.19 0.07 0.00 0.00 0.00 0.00 61.98 61.88 1kke s VAL 448 Cb -0.15 -3.00 -0.03 0.00 0.00 0.00 0.00 36.38 33.21 1kke s VAL 448 CO 0.00 0.34 -0.20 -0.44 0.00 0.00 0.00 175.10 174.81 1kke s SER 449 N 1.61 2.34 -0.05 3.32 0.01 -1.26 -0.39 113.70 119.28 1kke s SER 449 Ca 0.06 -0.57 -0.29 0.00 1.31 0.00 0.00 55.95 56.46 1kke s SER 449 Cb -0.15 -0.16 0.10 0.00 0.21 0.00 0.00 66.02 66.02 1kke s SER 449 CO 0.03 0.10 0.88 -0.72 0.41 0.00 0.00 173.24 173.94 1kke s TYR 450 N -0.94 -0.41 0.16 2.43 -0.85 -1.04 -4.75 117.35 111.94 1kke s TYR 450 Ca 0.06 0.49 -0.32 0.00 -0.52 0.00 0.00 57.07 56.79 1kke s TYR 450 Cb -0.09 0.49 -0.10 0.00 0.38 0.00 0.00 41.96 42.64 1kke s TYR 450 CO 0.02 -0.51 1.60 -1.25 -1.52 0.00 0.00 175.55 173.90 1kke s PRO 451 N -2.20 4.20 0.16 -3.49 0.04 -1.26 -1.79 135.00 130.67 1kke s PRO 451 Ca 0.00 2.39 -0.19 0.00 0.04 0.00 0.00 61.00 63.25 1kke s PRO 451 Cb -0.01 -3.18 -0.08 0.00 0.04 0.00 0.00 34.50 31.28 1kke s PRO 451 CO -0.03 -0.64 0.65 0.50 0.04 0.00 0.00 177.00 177.52 1kke s ARG 452 N 1.27 4.20 0.21 4.56 3.52 0.04 -0.32 118.95 132.43 1kke s ARG 452 Ca 0.71 0.77 -0.30 0.00 -0.13 0.00 0.00 55.73 56.79 1kke s ARG 452 Cb -0.44 -3.01 -0.09 0.00 -1.56 0.00 0.00 34.95 29.85 1kke s ARG 452 CO 0.31 0.49 1.27 0.45 -0.81 0.00 0.00 175.30 177.01 1kke s SER 453 N -1.49 6.95 0.25 -2.12 0.15 0.56 -4.18 113.70 113.81 1kke s SER 453 Ca 0.38 2.38 0.09 0.00 0.70 0.00 0.00 55.95 59.50 1kke s SER 453 Cb -0.18 -2.61 -0.05 0.00 -1.71 0.00 0.00 66.02 61.47 1kke s SER 453 CO 0.21 -0.47 -0.14 0.72 1.20 0.00 0.00 173.24 174.75 1kke s PHE 454 N -0.12 1.98 0.00 3.44 -0.71 -1.26 -4.93 117.98 116.38 1kke s PHE 454 Ca 0.54 -0.51 0.00 0.00 -1.04 0.00 0.00 56.93 55.92 1kke s PHE 454 Cb -0.36 -0.95 0.00 0.00 -1.21 0.00 0.00 43.02 40.50 1kke s PHE 454 CO 0.39 0.47 0.00 2.41 -1.34 0.00 0.00 175.22 177.16