#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kke n SER 252 N 0.00 0.00 -4.72 1.69 2.88 -1.26 -5.15 113.62 107.06 1kke n SER 252 Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 1kke n SER 252 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 1kke n SER 252 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1kke s TYR 253 N 0.00 2.89 -0.35 0.66 5.04 -1.26 -4.97 117.35 119.36 1kke s TYR 253 Ca 0.00 0.38 0.02 0.00 -2.44 0.00 0.00 57.07 55.03 1kke s TYR 253 Cb 0.00 -4.14 0.15 0.00 0.35 0.00 0.00 41.96 38.32 1kke s TYR 253 CO 0.00 -4.26 0.31 0.08 -1.34 0.00 0.00 175.55 170.35 1kke s VAL 254 N 1.06 -0.21 -0.27 3.14 1.01 -1.26 -5.11 120.40 118.76 1kke s VAL 254 Ca 0.74 -1.09 -0.13 0.00 0.00 0.00 0.00 61.98 61.50 1kke s VAL 254 Cb -0.50 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 1kke s VAL 254 CO 0.34 -0.68 0.29 0.00 0.00 0.00 0.00 175.10 175.05 1kke s ALA 255 N 1.51 3.56 0.04 5.51 0.00 -1.26 -4.94 121.76 126.17 1kke s ALA 255 Ca 0.16 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.21 1kke s ALA 255 Cb -0.17 -2.59 0.00 0.00 0.00 0.00 0.00 23.12 20.36 1kke s ALA 255 CO -0.08 -0.55 0.00 0.45 0.00 0.00 0.00 175.76 175.58 1kke n SER 256 N 5.08 -1.34 -3.61 0.00 2.88 -1.26 -5.06 113.62 110.32 1kke n SER 256 Ca -0.11 0.10 -0.22 0.00 -1.33 0.00 0.00 58.87 57.31 1kke n SER 256 Cb 0.51 0.57 -0.16 0.00 -0.75 0.00 0.00 64.21 64.38 1kke n SER 256 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1kke s ALA 257 N -2.58 0.15 0.21 -1.46 0.00 -1.26 -5.00 121.76 111.81 1kke s ALA 257 Ca 0.00 0.06 -0.30 0.00 0.00 0.00 0.00 51.96 51.72 1kke s ALA 257 Cb 0.00 -0.97 -0.08 0.00 0.00 0.00 0.00 23.12 22.07 1kke s ALA 257 CO 0.00 -0.94 0.98 0.08 0.00 0.00 0.00 175.76 175.88 1kke s VAL 258 N 2.21 4.09 0.69 0.00 1.01 -1.26 -4.49 120.40 122.65 1kke s VAL 258 Ca 0.04 1.98 -0.17 0.00 0.00 0.00 0.00 61.98 63.84 1kke s VAL 258 Cb -0.14 -4.26 -0.01 0.00 0.00 0.00 0.00 36.38 31.96 1kke s VAL 258 CO -0.08 0.42 0.97 0.35 0.00 0.00 0.00 175.10 176.77 1kke n THR 259 N 1.84 3.15 0.67 3.92 -2.24 -1.26 -1.40 114.28 118.96 1kke n THR 259 Ca -0.00 -0.41 0.06 0.00 -2.27 0.00 0.00 64.05 61.42 1kke n THR 259 Cb 0.47 -1.12 0.32 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 -1.64 0.32 -2.85 -0.78 -0.04 -1.26 -5.05 135.00 123.69 1kke n PRO 260 Ca 0.13 0.03 -0.33 0.00 -0.04 0.00 0.00 63.50 63.30 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 -2.10 3.92 -0.22 1.53 1.43 -0.49 -0.04 118.68 122.70 1kke s LEU 261 Ca 0.16 1.53 -0.10 0.00 -1.03 0.00 0.00 54.13 54.69 1kke s LEU 261 Cb 0.08 -4.38 0.08 0.00 0.03 0.00 0.00 46.19 42.00 1kke s LEU 261 CO 0.14 -0.35 0.51 0.00 0.23 0.00 0.00 176.35 176.88 1kke s ARG 262 N -3.29 0.47 -0.30 1.70 1.70 -0.68 -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 -0.10 0.27 -0.03 0.00 -0.57 0.00 0.00 34.95 34.53 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 2.08 4.10 -0.23 -1.89 2.96 -1.26 -2.09 118.68 122.35 1kke s LEU 263 Ca -0.07 -0.29 -0.29 0.00 -0.22 0.00 0.00 54.13 53.27 1kke s LEU 263 Cb -0.09 -2.07 -0.02 0.00 0.50 0.00 0.00 46.19 44.51 1kke s LEU 263 CO -0.15 -0.14 1.47 0.21 -1.32 0.00 0.00 176.35 176.42 1kke s ASN 264 N 1.69 6.57 0.64 3.68 3.84 -0.62 -4.89 114.94 125.85 1kke s ASN 264 Ca 0.06 1.54 0.39 0.00 0.21 0.00 0.00 52.86 55.06 1kke s ASN 264 Cb -0.17 -2.54 2.18 0.00 -0.55 0.00 0.00 41.25 40.18 1kke s ASN 264 CO 0.09 -1.11 2.33 0.77 -2.79 0.00 0.00 177.10 176.39 1kke h SER 265 N 9.82 0.00 0.00 -4.21 4.64 -1.97 0.32 113.55 122.15 1kke h SER 265 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 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 -0.20 0.28 -0.87 0.00 0.00 176.83 177.05 1kke h SER 266 N 0.00 0.00 0.62 4.97 0.02 -1.98 -3.40 113.55 113.78 1kke h SER 266 Ca 0.00 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.88 1kke h SER 266 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1kke h SER 266 CO -0.00 0.32 -0.31 0.71 -1.14 0.00 0.00 176.83 176.41 1kke h THR 267 N -0.44 0.90 -2.47 -2.27 1.35 -1.99 -3.46 112.91 104.53 1kke h THR 267 Ca 0.00 -1.23 -0.26 0.00 -0.55 0.00 0.00 66.41 64.37 1kke h THR 267 Cb 0.20 1.73 0.01 0.00 -1.73 0.00 0.00 68.15 68.36 1kke h THR 267 CO 0.00 0.31 -0.37 0.29 -0.25 0.00 0.00 175.52 175.50 1kke n LYS 268 N -3.69 -2.11 -3.60 4.72 5.02 0.11 -4.99 118.16 113.62 1kke n LYS 268 Ca -0.01 0.62 -0.37 0.00 -2.02 0.00 0.00 58.31 56.53 1kke n LYS 268 Cb 0.42 -4.83 -0.07 0.00 -0.02 0.00 0.00 35.03 30.53 1kke n LYS 268 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1kke s VAL 269 N -2.81 5.31 -0.23 -0.18 1.01 -1.25 -4.86 120.40 117.39 1kke s VAL 269 Ca 0.10 0.51 -0.08 0.00 0.00 0.00 0.00 61.98 62.51 1kke s VAL 269 Cb -0.04 -3.59 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 1kke s VAL 269 CO 0.12 0.46 0.08 -0.22 0.00 0.00 0.00 175.10 175.54 1kke s LEU 270 N 0.01 3.61 0.00 3.92 2.96 -1.26 -1.59 118.68 126.33 1kke s LEU 270 Ca 0.16 -0.10 0.05 0.00 -0.22 0.00 0.00 54.13 54.02 1kke s LEU 270 Cb -0.13 -1.95 -0.02 0.00 0.50 0.00 0.00 46.19 44.58 1kke s LEU 270 CO 0.05 0.02 0.18 -0.90 -1.32 0.00 0.00 176.35 174.38 1kke n ASP 271 N 4.54 0.12 -4.09 3.68 5.75 -0.89 -5.01 116.55 120.65 1kke n ASP 271 Ca -0.16 -2.75 -0.20 0.00 -0.01 0.00 0.00 54.79 51.67 1kke n ASP 271 Cb 0.52 1.14 -0.14 0.00 -1.03 0.00 0.00 41.12 41.61 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 -3.15 0.90 -0.21 0.11 1.75 -1.26 -1.69 119.30 115.74 1kke s MET 272 Ca 0.26 -0.55 -0.16 0.00 -1.25 0.00 0.00 55.69 53.99 1kke s MET 272 Cb 0.01 -0.87 -0.04 0.00 2.84 0.00 0.00 34.83 36.77 1kke s MET 272 CO 0.18 0.23 0.41 -0.51 -0.65 0.00 0.00 175.02 174.69 1kke s LEU 273 N -0.65 4.14 0.03 4.11 1.43 0.94 -5.00 118.68 123.68 1kke s LEU 273 Ca 0.03 0.51 0.04 0.00 -1.03 0.00 0.00 54.13 53.68 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 -0.11 -0.13 0.27 0.23 0.00 0.00 176.35 176.61 1kke s ILE 274 N 1.48 1.05 -0.62 -0.59 -4.36 -1.26 -4.80 121.20 112.09 1kke s ILE 274 Ca 0.19 -0.91 -0.28 0.00 -0.26 0.00 0.00 60.65 59.39 1kke s ILE 274 Cb -0.15 -0.94 0.03 0.00 1.25 0.00 0.00 42.46 42.64 1kke s ILE 274 CO 0.08 0.03 1.23 -0.62 0.24 0.00 0.00 174.94 175.91 1kke s ASP 275 N -1.01 6.34 0.66 4.36 3.68 -1.26 -4.88 116.67 124.56 1kke s ASP 275 Ca 0.01 -0.03 0.42 0.00 2.13 0.00 0.00 52.55 55.08 1kke s ASP 275 Cb -0.07 -2.55 2.31 0.00 -1.45 0.00 0.00 42.92 41.15 1kke s ASP 275 CO 0.01 -1.60 2.32 0.77 0.13 0.00 0.00 175.17 176.80 1kke h SER 276 N 9.79 0.00 1.41 -0.34 4.64 -1.99 0.10 113.55 127.16 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 -2.01 -3.33 113.55 117.82 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 -1.03 0.35 -0.87 0.00 0.00 176.83 175.28 1kke n THR 278 N -2.79 0.01 -4.26 2.95 -2.24 -0.61 -4.91 114.28 102.42 1kke n THR 278 Ca 0.03 -0.02 -0.17 0.00 -2.27 0.00 0.00 64.05 61.62 1kke n THR 278 Cb 0.40 -0.09 -0.11 0.00 -2.10 0.00 0.00 70.33 68.43 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 -3.43 2.46 0.28 3.22 1.43 0.25 -0.19 118.68 122.70 1kke s LEU 279 Ca -0.00 -0.89 -0.09 0.00 -1.03 0.00 0.00 54.13 52.11 1kke s LEU 279 Cb 0.00 -0.53 -0.00 0.00 0.03 0.00 0.00 46.19 45.69 1kke s LEU 279 CO 0.02 -0.19 0.47 -1.83 0.23 0.00 0.00 176.35 175.05 1kke s GLU 280 N -3.08 1.65 -0.14 1.70 -1.05 -0.67 -4.02 118.70 113.09 1kke s GLU 280 Ca 0.13 -1.42 0.01 0.00 -0.15 0.00 0.00 54.97 53.54 1kke s GLU 280 Cb -0.02 0.46 -0.00 0.00 -0.44 0.00 0.00 34.13 34.12 1kke s GLU 280 CO 0.03 -0.69 -0.17 0.42 0.95 0.00 0.00 175.26 175.81 1kke s ILE 281 N -3.69 2.61 1.22 1.83 1.01 -1.26 -1.07 121.20 121.85 1kke s ILE 281 Ca 0.25 -0.80 -0.15 0.00 0.00 0.00 0.00 60.65 59.95 1kke s ILE 281 Cb -0.00 -2.08 0.29 0.00 0.01 0.00 0.00 42.46 40.68 1kke s ILE 281 CO 0.12 0.53 0.87 0.59 0.00 0.00 0.00 174.94 177.05 1kke n ASN 282 N 3.82 -2.20 0.20 3.58 5.03 0.14 -4.85 115.26 120.98 1kke n ASN 282 Ca -0.19 -0.27 0.09 0.00 0.87 0.00 0.00 54.58 55.08 1kke n ASN 282 Cb 0.52 -1.18 0.33 0.00 -1.02 0.00 0.00 39.78 38.43 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 -2.79 0.00 -0.18 6.41 0.02 -2.00 -1.11 113.55 113.91 1kke h SER 283 Ca -0.61 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.34 1kke h SER 283 Cb 1.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.88 1kke h SER 283 CO 0.46 0.25 0.00 -1.20 -1.14 0.00 0.00 176.83 175.21 1kke n SER 284 N -3.30 1.47 -0.40 3.07 7.64 -1.26 -4.91 113.62 115.93 1kke n SER 284 Ca 0.01 -1.73 -0.05 0.00 1.01 0.00 0.00 58.87 58.10 1kke n SER 284 Cb 0.51 -0.11 -0.02 0.00 -1.01 0.00 0.00 64.21 63.57 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 0.78 3.85 0.23 0.00 -0.42 -5.02 105.19 105.67 1kke n GLY 285 Ca 0.15 -0.71 -0.37 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.29 3.67 0.08 1.61 -0.21 -1.26 -4.73 119.66 116.52 1kke s GLN 286 Ca 0.00 0.00 -0.31 0.00 0.02 0.00 0.00 55.36 55.08 1kke s GLN 286 Cb 0.00 -3.23 -0.06 0.00 1.00 0.00 0.00 33.01 30.71 1kke s GLN 286 CO 0.00 0.68 1.23 -1.17 -2.12 0.00 0.00 175.29 173.91 1kke s LEU 287 N -0.82 4.38 0.04 2.90 2.96 -1.26 0.24 118.68 127.12 1kke s LEU 287 Ca 0.17 2.09 -0.02 0.00 -0.22 0.00 0.00 54.13 56.14 1kke s LEU 287 Cb -0.13 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 42.95 1kke s LEU 287 CO 0.06 -0.49 0.00 0.28 -1.32 0.00 0.00 176.35 174.88 1kke s THR 288 N 0.96 0.16 0.01 3.68 -1.32 -0.23 -4.92 115.64 113.97 1kke s THR 288 Ca 0.59 -1.30 -0.30 0.00 -1.21 0.00 0.00 61.69 59.47 1kke s THR 288 Cb -0.31 -0.91 -0.06 0.00 -1.51 0.00 0.00 72.50 69.71 1kke s THR 288 CO 0.30 -0.72 1.49 -0.69 -2.21 0.00 0.00 174.62 172.79 1kke s VAL 289 N -2.71 3.52 -0.10 5.08 1.01 -1.26 -1.67 120.40 124.27 1kke s VAL 289 Ca -0.04 0.90 -0.29 0.00 0.00 0.00 0.00 61.98 62.54 1kke s VAL 289 Cb -0.01 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.75 1kke s VAL 289 CO -0.05 -0.01 1.64 -0.60 0.00 0.00 0.00 175.10 176.07 1kke s ARG 290 N 2.61 4.09 -0.42 2.72 3.52 0.74 -4.84 118.95 127.36 1kke s ARG 290 Ca 0.67 2.05 -0.29 0.00 -0.13 0.00 0.00 55.73 58.04 1kke s ARG 290 Cb -0.34 -3.99 0.02 0.00 -1.56 0.00 0.00 34.95 29.09 1kke s ARG 290 CO 0.28 -0.95 1.16 -1.12 -0.81 0.00 0.00 175.30 173.86 1kke s SER 291 N 3.54 6.67 0.12 -2.12 0.01 -1.26 -4.84 113.70 115.83 1kke s SER 291 Ca 0.72 0.68 0.08 0.00 1.31 0.00 0.00 55.95 58.75 1kke s SER 291 Cb -0.31 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.34 1kke s SER 291 CO 0.29 -1.18 -0.21 0.42 0.41 0.00 0.00 173.24 172.97 1kke s THR 292 N 4.37 1.78 0.09 1.44 -4.23 -1.26 -5.14 115.64 112.69 1kke s THR 292 Ca 0.49 -1.66 -0.08 0.00 -1.18 0.00 0.00 61.69 59.26 1kke s THR 292 Cb -0.09 -1.66 -0.06 0.00 1.34 0.00 0.00 72.50 72.03 1kke s THR 292 CO 0.28 -0.12 0.38 -0.94 -0.54 0.00 0.00 174.62 173.68 1kke s SER 293 N -2.12 6.58 0.85 3.99 1.04 -1.26 -5.09 113.70 117.70 1kke s SER 293 Ca 0.09 0.72 -0.12 0.00 0.48 0.00 0.00 55.95 57.12 1kke s SER 293 Cb -0.09 -2.15 0.10 0.00 0.10 0.00 0.00 66.02 63.99 1kke s SER 293 CO 0.05 0.14 1.10 -2.16 0.98 0.00 0.00 173.24 173.35 1kke s PRO 294 N -2.11 1.65 -0.61 4.02 0.04 -1.26 -4.95 135.00 131.78 1kke s PRO 294 Ca 0.35 0.67 -0.27 0.00 0.04 0.00 0.00 61.00 61.78 1kke s PRO 294 Cb -0.13 -1.87 0.01 0.00 0.04 0.00 0.00 34.50 32.55 1kke s PRO 294 CO 0.20 -1.93 1.52 1.21 0.04 0.00 0.00 177.00 178.04 1kke s ASN 295 N -3.73 5.88 -0.01 6.66 3.04 -1.26 -4.98 114.94 120.55 1kke s ASN 295 Ca 0.62 0.16 0.00 0.00 0.04 0.00 0.00 52.86 53.68 1kke s ASN 295 Cb -0.16 -2.54 -0.04 0.00 -1.54 0.00 0.00 41.25 36.97 1kke s ASN 295 CO 0.55 -1.93 0.05 -0.76 -3.04 0.00 0.00 177.10 171.97 1kke s LEU 296 N 6.87 3.74 -0.14 3.21 1.43 -1.26 -5.11 118.68 127.42 1kke s LEU 296 Ca 0.53 0.09 -0.01 0.00 -1.03 0.00 0.00 54.13 53.72 1kke s LEU 296 Cb -0.11 -2.14 -0.01 0.00 0.03 0.00 0.00 46.19 43.95 1kke s LEU 296 CO 0.22 0.28 -0.12 -0.13 0.23 0.00 0.00 176.35 176.83 1kke s ARG 297 N -1.60 3.40 0.43 1.70 1.81 -1.23 -4.99 118.95 118.47 1kke s ARG 297 Ca 0.21 -0.67 -0.25 0.00 -1.72 0.00 0.00 55.73 53.30 1kke s ARG 297 Cb -0.12 -2.67 -0.09 0.00 -0.45 0.00 0.00 34.95 31.62 1kke s ARG 297 CO 0.12 0.19 1.27 0.98 -0.68 0.00 0.00 175.30 177.18 1kke n TYR 298 N 3.59 2.11 0.98 -0.53 9.36 -1.26 -0.13 117.16 131.28 1kke n TYR 298 Ca -0.18 0.50 0.10 0.00 3.32 0.00 0.00 57.90 61.63 1kke n TYR 298 Cb 0.53 -2.37 0.51 0.00 -0.63 0.00 0.00 39.34 37.38 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 -0.03 0.34 -2.42 2.98 -0.04 -1.26 -5.05 135.00 129.52 1kke n PRO 299 Ca 0.07 0.08 -0.43 0.00 -0.04 0.00 0.00 63.50 63.18 1kke n PRO 299 Cb 0.40 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.34 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 -2.48 4.17 0.38 0.52 -1.09 0.81 -0.56 121.20 122.96 1kke s ILE 300 Ca 0.21 1.35 0.04 0.00 -2.23 0.00 0.00 60.65 60.02 1kke s ILE 300 Cb 0.13 -4.11 -0.05 0.00 -1.58 0.00 0.00 42.46 36.85 1kke s ILE 300 CO 0.29 -0.39 0.05 0.00 -1.23 0.00 0.00 174.94 173.67 1kke s ALA 301 N 4.17 2.82 -0.74 9.38 0.00 0.45 -3.52 121.76 134.31 1kke s ALA 301 Ca 0.56 -1.78 -0.21 0.00 0.00 0.00 0.00 51.96 50.53 1kke s ALA 301 Cb -0.18 0.51 0.09 0.00 0.00 0.00 0.00 23.12 23.54 1kke s ALA 301 CO 0.21 -0.24 0.99 0.34 0.00 0.00 0.00 175.76 177.06 1kke s ASP 302 N -3.60 6.32 -0.43 0.00 -1.08 -1.26 -0.42 116.67 116.20 1kke s ASP 302 Ca 0.31 -1.36 -0.21 0.00 -0.52 0.00 0.00 52.55 50.76 1kke s ASP 302 Cb 0.07 -2.40 0.02 0.00 -1.46 0.00 0.00 42.92 39.15 1kke s ASP 302 CO 0.14 -1.30 0.66 -0.69 0.52 0.00 0.00 175.17 174.50 1kke s VAL 303 N 3.52 4.82 -0.29 1.11 1.01 -0.48 -4.66 120.40 125.43 1kke s VAL 303 Ca 0.25 0.19 -0.01 0.00 0.00 0.00 0.00 61.98 62.41 1kke s VAL 303 Cb -0.14 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.04 1kke s VAL 303 CO 0.04 -0.58 0.20 -1.54 0.00 0.00 0.00 175.10 173.22 1kke n SER 304 N 6.28 -1.56 0.00 3.32 3.41 -1.26 -1.18 113.62 122.63 1kke n SER 304 Ca -0.01 -0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.26 1kke n SER 304 Cb 0.48 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 1kke n SER 304 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1kke n GLY 305 N -0.92 3.04 0.00 5.00 0.00 -1.26 -5.03 105.19 106.02 1kke n GLY 305 Ca -0.10 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.12 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 5.27 3.59 -0.02 0.00 -0.33 -5.10 105.19 108.60 1kke n GLY 306 Ca 0.00 -2.11 -0.39 0.00 0.00 0.00 0.00 46.02 43.53 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 0.41 5.22 0.06 -0.61 1.01 -1.26 -1.38 121.20 124.65 1kke s ILE 307 Ca 0.00 0.35 0.01 0.00 0.00 0.00 0.00 60.65 61.01 1kke s ILE 307 Cb 0.00 -3.65 -0.00 0.00 0.01 0.00 0.00 42.46 38.81 1kke s ILE 307 CO 0.00 0.16 0.06 0.61 0.00 0.00 0.00 174.94 175.77 1kke n GLY 308 N 4.86 3.68 3.59 6.18 0.00 0.44 -4.82 105.19 119.12 1kke n GLY 308 Ca -0.11 -1.65 -0.35 0.00 0.00 0.00 0.00 46.02 43.91 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 -2.22 3.90 0.08 1.61 1.75 -1.26 -0.42 119.30 122.75 1kke s MET 309 Ca 0.07 -0.37 -0.34 0.00 -1.25 0.00 0.00 55.69 53.80 1kke s MET 309 Cb 0.00 -3.31 -0.13 0.00 2.84 0.00 0.00 34.83 34.23 1kke s MET 309 CO 0.05 0.10 1.65 0.45 -0.65 0.00 0.00 175.02 176.62 1kke n SER 310 N 4.08 3.11 0.30 1.11 2.88 0.28 -4.83 113.62 120.55 1kke n SER 310 Ca -0.16 1.05 0.17 0.00 -1.33 0.00 0.00 58.87 58.60 1kke n SER 310 Cb 0.52 -1.40 0.95 0.00 -0.75 0.00 0.00 64.21 63.53 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 6.77 0.00 -0.03 -1.46 0.13 -1.94 -1.20 132.00 134.27 1kke h PRO 311 Ca -0.46 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.62 1kke h PRO 311 Cb 1.26 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 1kke h PRO 311 CO 0.90 0.03 -0.22 -0.97 -0.23 0.00 0.00 178.00 177.51 1kke h ASN 312 N 0.00 0.05 0.31 1.44 -1.24 -1.89 -0.80 115.58 113.45 1kke h ASN 312 Ca -0.00 -0.01 -0.29 0.00 0.71 0.00 0.00 56.30 56.70 1kke h ASN 312 Cb 0.11 -0.01 0.02 0.00 0.73 0.00 0.00 38.32 39.17 1kke h ASN 312 CO 0.00 0.27 -1.27 0.22 -1.29 0.00 0.00 177.43 175.37 1kke h TYR 313 N 0.05 0.84 -0.34 0.67 3.20 -1.58 -3.35 116.97 116.46 1kke h TYR 313 Ca 0.01 -0.56 -0.16 0.00 3.14 0.00 0.00 58.73 61.16 1kke h TYR 313 Cb 0.42 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 1kke h TYR 313 CO 0.00 1.41 -0.41 0.00 -1.64 0.00 0.00 178.16 177.53 1kke h ARG 314 N 0.19 0.84 -2.20 1.82 3.08 -1.22 0.35 114.38 117.24 1kke h ARG 314 Ca -0.18 -0.45 -0.02 0.00 0.07 0.00 0.00 59.98 59.40 1kke h ARG 314 Cb 1.95 0.02 -0.23 0.00 0.08 0.00 0.00 29.97 31.80 1kke h ARG 314 CO 0.23 1.09 -0.09 0.12 -1.07 0.00 0.00 179.97 180.25 1kke s PHE 315 N -4.33 -0.94 -0.13 3.04 5.36 -0.36 -3.30 117.98 117.32 1kke s PHE 315 Ca -0.10 1.89 -0.07 0.00 -0.96 0.00 0.00 56.93 57.69 1kke s PHE 315 Cb 0.11 0.53 0.05 0.00 -0.34 0.00 0.00 43.02 43.38 1kke s PHE 315 CO 0.87 -0.48 0.31 0.50 -1.46 0.00 0.00 175.22 174.96 1kke s ARG 316 N 1.66 0.27 0.11 10.12 3.52 -0.08 -4.41 118.95 130.15 1kke s ARG 316 Ca -0.09 0.66 0.10 0.00 -0.13 0.00 0.00 55.73 56.26 1kke s ARG 316 Cb -0.07 -0.06 -0.04 0.00 -1.56 0.00 0.00 34.95 33.22 1kke s ARG 316 CO -0.18 -0.18 -0.22 -1.14 -0.81 0.00 0.00 175.30 172.78 1kke s GLN 317 N 1.47 1.65 0.00 5.12 0.74 -1.26 -0.44 119.66 126.94 1kke s GLN 317 Ca -0.08 -1.23 0.00 0.00 0.05 0.00 0.00 55.36 54.10 1kke s GLN 317 Cb -0.10 -2.03 0.00 0.00 1.10 0.00 0.00 33.01 31.98 1kke s GLN 317 CO -0.10 0.47 0.00 0.45 -0.55 0.00 0.00 175.29 175.56 1kke n SER 318 N 0.93 0.00 -3.65 6.67 2.88 -0.47 -4.78 113.62 115.19 1kke n SER 318 Ca -0.17 -0.87 -0.11 0.00 -1.33 0.00 0.00 58.87 56.39 1kke n SER 318 Cb 0.53 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.93 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 -0.37 119.30 115.71 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 -3.33 2.37 -0.53 3.16 -0.00 0.17 -1.98 118.94 118.81 1kke s TRP 320 Ca 0.00 -1.08 0.03 0.00 -0.00 0.00 0.00 56.10 55.06 1kke s TRP 320 Cb 0.01 -1.63 0.13 0.00 -0.00 0.00 0.00 33.47 31.99 1kke s TRP 320 CO -0.09 -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 -0.77 -0.99 121.20 129.68 1kke s ILE 321 Ca -0.12 -3.26 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 0.00 174.94 174.77 1kke n GLY 322 N 3.18 4.09 3.68 6.18 0.00 -0.88 -4.16 105.19 117.28 1kke n GLY 322 Ca 0.05 -1.51 -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 -0.65 121.20 120.80 1kke s ILE 323 Ca 0.00 0.16 -0.06 0.00 -2.23 0.00 0.00 60.65 58.51 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 0.70 4.27 -0.04 2.92 1.01 0.20 -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 -2.94 -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 0.89 2.25 -0.05 3.32 1.04 -0.24 -0.66 113.70 120.24 1kke s SER 325 Ca 0.02 -0.37 -0.03 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 0.00 173.24 174.04 1kke s TYR 326 N 0.02 3.41 -0.11 5.02 5.04 0.55 -0.29 117.35 130.99 1kke s TYR 326 Ca -0.04 0.33 -0.07 0.00 -2.44 0.00 0.00 57.07 54.85 1kke s TYR 326 Cb -0.12 -1.83 0.04 0.00 0.35 0.00 0.00 41.96 40.41 1kke s TYR 326 CO 0.02 0.61 0.27 -1.54 -1.34 0.00 0.00 175.55 173.57 1kke s SER 327 N -1.41 -0.29 -0.30 4.32 1.04 -0.46 -1.66 113.70 114.94 1kke s SER 327 Ca 0.20 0.57 -0.18 0.00 0.48 0.00 0.00 55.95 57.01 1kke s SER 327 Cb -0.12 0.50 0.20 0.00 0.10 0.00 0.00 66.02 66.69 1kke s SER 327 CO 0.10 -0.14 1.25 -0.83 0.98 0.00 0.00 173.24 174.60 1kke s GLY 328 N 0.84 0.33 -1.36 7.32 0.00 0.65 -0.32 107.32 114.78 1kke s GLY 328 Ca -0.06 3.66 -0.08 0.00 0.00 0.00 0.00 44.72 48.24 1kke s GLY 328 CO -0.05 3.21 0.43 1.44 0.00 0.00 0.00 173.10 178.13 1kke n SER 329 N 4.22 -1.38 0.00 1.64 7.64 -1.26 -0.83 113.62 123.64 1kke n SER 329 Ca -0.09 -1.10 0.00 0.00 1.01 0.00 0.00 58.87 58.69 1kke n SER 329 Cb 0.56 -2.65 0.00 0.00 -1.01 0.00 0.00 64.21 61.11 1kke n SER 329 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1kke n GLY 330 N -2.07 2.82 3.68 0.23 0.00 -1.26 -4.99 105.19 103.60 1kke n GLY 330 Ca -0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 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 0.00 4.26 -0.01 0.99 1.43 -0.01 -5.01 118.68 120.33 1kke s LEU 331 Ca 0.00 1.83 0.00 0.00 -1.03 0.00 0.00 54.13 54.93 1kke s LEU 331 Cb 0.00 -3.55 0.01 0.00 0.03 0.00 0.00 46.19 42.67 1kke s LEU 331 CO 0.00 -0.65 -0.00 0.20 0.23 0.00 0.00 176.35 176.12 1kke s ASN 332 N 1.69 0.14 0.10 2.29 0.01 -1.26 -0.25 114.94 117.66 1kke s ASN 332 Ca 0.57 -0.01 -0.26 0.00 -0.71 0.00 0.00 52.86 52.45 1kke s ASN 332 Cb -0.25 -0.04 0.08 0.00 0.41 0.00 0.00 41.25 41.45 1kke s ASN 332 CO 0.21 -0.02 0.94 -1.66 -1.51 0.00 0.00 177.10 175.06 1kke s TRP 333 N 0.25 -0.20 0.04 2.20 1.48 -0.66 -5.00 118.94 117.04 1kke s TRP 333 Ca -0.02 -0.05 -0.06 0.00 -1.06 0.00 0.00 56.10 54.91 1kke s TRP 333 Cb -0.04 0.61 -0.01 0.00 -1.16 0.00 0.00 33.47 32.87 1kke s TRP 333 CO -0.01 -0.73 0.10 -0.98 -4.06 0.00 0.00 176.95 171.27 1kke s ARG 334 N -3.22 0.59 0.02 3.25 1.70 -1.26 -0.33 118.95 119.69 1kke s ARG 334 Ca 0.10 -0.73 0.00 0.00 -0.47 0.00 0.00 55.73 54.63 1kke s ARG 334 Cb -0.01 0.23 -0.01 0.00 -0.57 0.00 0.00 34.95 34.58 1kke s ARG 334 CO -0.02 -0.15 -0.02 0.08 -1.08 0.00 0.00 175.30 174.11 1kke s VAL 335 N -2.54 0.10 0.00 4.99 1.01 0.16 -4.99 120.40 119.14 1kke s VAL 335 Ca -0.06 -0.67 -0.18 0.00 0.00 0.00 0.00 61.98 61.08 1kke s VAL 335 Cb -0.02 -0.21 -0.06 0.00 0.00 0.00 0.00 36.38 36.10 1kke s VAL 335 CO -0.04 -0.36 0.52 -1.58 0.00 0.00 0.00 175.10 173.64 1kke s GLN 336 N -1.06 4.18 0.05 2.72 0.74 -1.26 -0.63 119.66 124.39 1kke s GLN 336 Ca -0.11 0.60 0.03 0.00 0.05 0.00 0.00 55.36 55.92 1kke s GLN 336 Cb -0.07 -3.29 -0.03 0.00 1.10 0.00 0.00 33.01 30.72 1kke s GLN 336 CO -0.01 0.50 -0.09 0.08 -0.55 0.00 0.00 175.29 175.23 1kke s VAL 337 N -0.57 0.65 -0.31 1.34 1.01 0.17 -4.95 120.40 117.74 1kke s VAL 337 Ca 0.27 -1.16 -0.00 0.00 0.00 0.00 0.00 61.98 61.09 1kke s VAL 337 Cb -0.18 -0.74 0.06 0.00 0.00 0.00 0.00 36.38 35.53 1kke s VAL 337 CO 0.15 -0.37 0.01 0.20 0.00 0.00 0.00 175.10 175.09 1kke s ASN 338 N -1.67 4.83 0.04 3.32 0.02 -1.26 -2.08 114.94 118.15 1kke s ASN 338 Ca -0.08 -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 1.26 2.21 0.36 -1.22 1.04 -0.16 -4.47 113.70 112.72 1kke s SER 339 Ca -0.03 -0.50 -0.23 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 65.65 1kke s SER 339 CO -0.03 0.12 0.92 -1.81 0.98 0.00 0.00 173.24 173.41 1kke s ASP 340 N -1.18 7.10 -0.10 7.02 1.01 -1.18 -0.65 116.67 128.68 1kke s ASP 340 Ca 0.06 1.70 0.03 0.00 0.71 0.00 0.00 52.55 55.05 1kke s ASP 340 Cb -0.08 -2.54 0.01 0.00 1.01 0.00 0.00 42.92 41.32 1kke s ASP 340 CO 0.02 -0.20 -0.20 -0.63 0.21 0.00 0.00 175.17 174.36 1kke s ILE 341 N -1.89 1.81 -0.13 0.77 1.01 0.50 -0.89 121.20 122.37 1kke s ILE 341 Ca 0.55 -0.86 0.01 0.00 0.00 0.00 0.00 60.65 60.35 1kke s ILE 341 Cb -0.14 -1.58 0.02 0.00 0.01 0.00 0.00 42.46 40.77 1kke s ILE 341 CO 0.18 0.50 -0.13 -0.36 0.00 0.00 0.00 174.94 175.13 1kke s PHE 342 N 0.53 2.02 -0.32 3.97 0.40 -0.08 -1.37 117.98 123.13 1kke s PHE 342 Ca -0.15 -1.08 -0.08 0.00 -0.60 0.00 0.00 56.93 55.01 1kke s PHE 342 Cb -0.17 -1.50 0.02 0.00 0.51 0.00 0.00 43.02 41.88 1kke s PHE 342 CO 0.05 -0.61 0.12 0.42 0.70 0.00 0.00 175.22 175.91 1kke s ILE 343 N 1.41 4.11 -0.16 0.64 1.01 0.41 0.34 121.20 128.97 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 -3.20 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 0.00 174.94 174.02 1kke s VAL 344 N 1.50 1.36 0.00 2.92 1.01 -0.49 -0.90 120.40 125.80 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 -1.75 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 3.07 3.53 -4.27 -2.24 8.00 -1.26 -4.88 116.55 118.50 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 -2.11 1.76 -0.03 1.24 1.51 -0.70 -0.79 117.35 118.23 1kke s TYR 347 Ca 0.36 -0.41 0.07 0.00 -1.01 0.00 0.00 57.07 56.08 1kke s TYR 347 Cb 0.30 -0.98 -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 2.20 -0.16 2.71 2.07 -0.74 -1.40 121.20 124.80 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 40.75 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 -0.53 2.03 -0.44 3.50 3.76 0.15 -2.51 115.29 121.25 1kke s HIS 349 Ca 0.07 -1.24 -0.15 0.00 -0.15 0.00 0.00 55.06 53.60 1kke s HIS 349 Cb -0.11 -1.48 0.05 0.00 1.11 0.00 0.00 32.58 32.14 1kke s HIS 349 CO 0.00 -0.66 0.34 0.42 -0.85 0.00 0.00 174.74 174.00 1kke s ILE 350 N 1.53 5.20 -0.95 0.60 1.09 0.48 -0.90 121.20 128.25 1kke s ILE 350 Ca 0.02 -0.88 -0.18 0.00 -1.10 0.00 0.00 60.65 58.51 1kke s ILE 350 Cb -0.15 -4.00 0.15 0.00 -1.06 0.00 0.00 42.46 37.40 1kke s ILE 350 CO -0.09 -0.44 1.12 0.00 -0.10 0.00 0.00 174.94 175.43 1kke s LEU 352 N 2.22 4.54 0.64 0.00 1.43 0.76 -3.13 118.68 125.14 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 0.00 176.35 175.11 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 60.82 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 3.22 0.17 8.56 0.00 -1.26 -4.37 121.76 125.03 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 0.32 -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 -0.58 116.67 120.03 1kke s ASP 356 Ca 0.17 0.03 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 42.27 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 -0.12 -4.94 105.19 108.96 1kke n GLY 357 Ca -0.18 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 43.99 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 -1.68 117.46 117.36 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 4.83 0.04 4.37 0.01 -1.06 -3.56 113.70 118.63 1kke s SER 359 Ca 0.00 2.64 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 -1.86 -0.11 0.27 0.41 0.00 0.00 173.24 171.96 1kke s ILE 360 N -1.39 0.80 0.75 1.44 -4.36 -1.26 -4.90 121.20 112.29 1kke s ILE 360 Ca 0.79 -0.99 -0.04 0.00 -0.26 0.00 0.00 60.65 60.15 1kke s ILE 360 Cb -0.38 -0.78 0.13 0.00 1.25 0.00 0.00 42.46 42.68 1kke s ILE 360 CO 0.41 -0.18 1.04 0.00 0.24 0.00 0.00 174.94 176.45 1kke s ALA 361 N -1.04 3.41 0.30 2.27 0.00 -1.26 -4.98 121.76 120.45 1kke s ALA 361 Ca -0.04 -1.54 -0.01 0.00 0.00 0.00 0.00 51.96 50.37 1kke s ALA 361 Cb -0.08 -2.20 0.45 0.00 0.00 0.00 0.00 23.12 21.29 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 -3.78 0.00 3.32 -1.92 -3.41 116.42 110.78 1kke h ASP 362 Ca -0.39 -0.08 -0.48 0.00 0.02 0.00 0.00 57.03 56.11 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 0.42 0.70 -0.80 -0.83 -1.72 0.00 0.00 179.24 177.01 1kke s GLY 363 N -3.47 0.67 0.31 2.75 0.00 -1.26 -2.70 107.32 103.62 1kke s GLY 363 Ca -0.11 -0.43 -0.18 0.00 0.00 0.00 0.00 44.72 44.00 1kke s GLY 363 CO 0.79 -0.12 0.87 -0.32 0.00 0.00 0.00 173.10 174.33 1kke s GLY 364 N 0.23 0.25 -0.01 0.20 0.00 -0.06 -4.38 107.32 103.55 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 0.61 -0.22 0.99 0.00 0.00 0.00 173.10 174.49 1kke s ASP 365 N -3.17 2.59 -0.25 1.64 1.01 0.57 -1.17 116.67 117.89 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 0.26 -0.05 -0.22 0.21 0.00 0.00 175.17 175.47 1kke s LEU 366 N -0.58 3.23 -0.16 1.23 2.96 0.69 -1.36 118.68 124.68 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 0.61 -0.27 113.70 123.81 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 0.15 -1.08 118.68 125.41 1kke s LEU 368 Ca -0.02 -0.12 -0.21 0.00 -1.03 0.00 0.00 54.13 52.74 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 -1.26 114.94 125.36 1kke s ASN 369 Ca 0.07 -1.09 0.19 0.00 0.42 0.00 0.00 52.86 52.45 1kke s ASN 369 Cb -0.16 -2.38 0.72 0.00 -1.45 0.00 0.00 41.25 37.98 1kke s ASN 369 CO 0.10 -1.31 1.52 0.49 -3.72 0.00 0.00 177.10 174.17 1kke n PHE 370 N 7.22 0.22 0.24 0.43 0.99 0.28 -3.91 117.46 122.94 1kke n PHE 370 Ca -0.05 -0.11 0.07 0.00 -0.00 0.00 0.00 57.45 57.36 1kke n PHE 370 Cb 0.45 0.00 0.57 0.00 -1.00 0.00 0.00 39.48 39.50 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 2.02 1.01 -4.20 -4.37 2.07 -1.88 -3.39 116.25 107.51 1kke h VAL 371 Ca 0.00 -0.50 -0.15 0.00 0.82 0.00 0.00 66.70 66.88 1kke h VAL 371 Cb 0.44 1.27 -0.14 0.00 -1.52 0.00 0.00 31.29 31.35 1kke h VAL 371 CO 0.00 0.14 -0.52 0.42 0.02 0.00 0.00 177.57 177.63 1kke s THR 372 N -4.64 0.10 0.00 2.57 -4.23 -1.25 -4.91 115.64 103.27 1kke s THR 372 Ca -0.04 -1.69 0.00 0.00 -1.18 0.00 0.00 61.69 58.78 1kke s THR 372 Cb 0.16 -1.91 0.00 0.00 1.34 0.00 0.00 72.50 72.08 1kke s THR 372 CO 0.67 -0.44 0.00 0.61 -0.54 0.00 0.00 174.62 174.92 1kke n GLY 373 N -0.12 2.97 3.68 3.99 0.00 -1.26 -4.70 105.19 109.75 1kke n GLY 373 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 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 4.28 0.35 0.99 1.43 -1.26 -1.84 118.68 122.63 1kke s LEU 374 Ca 0.00 1.95 -0.05 0.00 -1.03 0.00 0.00 54.13 55.00 1kke s LEU 374 Cb 0.00 -3.55 -0.05 0.00 0.03 0.00 0.00 46.19 42.62 1kke s LEU 374 CO 0.00 -0.69 0.62 -0.76 0.23 0.00 0.00 176.35 175.75 1kke s LEU 375 N 2.63 3.95 0.60 1.79 1.02 -0.84 -4.87 118.68 122.96 1kke s LEU 375 Ca 0.60 0.76 -0.18 0.00 0.02 0.00 0.00 54.13 55.33 1kke s LEU 375 Cb -0.28 -3.62 -0.05 0.00 0.02 0.00 0.00 46.19 42.26 1kke s LEU 375 CO 0.23 -0.31 0.94 -2.65 0.02 0.00 0.00 176.35 174.59 1kke n PRO 376 N -1.36 0.86 -0.38 1.29 -0.02 -1.26 -1.42 135.00 132.71 1kke n PRO 376 Ca -0.01 0.34 0.01 0.00 -2.02 0.00 0.00 63.50 61.82 1kke n PRO 376 Cb 0.54 -2.15 0.15 0.00 -0.02 0.00 0.00 33.50 32.03 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 -0.99 2.47 -2.84 0.52 -0.04 -1.26 -4.83 135.00 128.02 1kke n PRO 377 Ca 0.14 -1.28 -0.32 0.00 -0.04 0.00 0.00 63.50 62.00 1kke n PRO 377 Cb 0.47 -1.78 -0.05 0.00 -0.04 0.00 0.00 33.50 32.11 1kke n PRO 377 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1kke s LEU 378 N -1.15 3.88 0.05 1.53 1.02 -0.51 -5.09 118.68 118.41 1kke s LEU 378 Ca 0.22 1.37 -0.01 0.00 0.02 0.00 0.00 54.13 55.74 1kke s LEU 378 Cb 0.17 -4.23 -0.04 0.00 0.02 0.00 0.00 46.19 42.11 1kke s LEU 378 CO 0.06 -0.37 -0.03 -0.76 0.02 0.00 0.00 176.35 175.27 1kke s LEU 379 N -3.50 2.47 0.27 1.79 1.43 -1.26 -4.62 118.68 115.26 1kke s LEU 379 Ca 0.56 -0.95 -0.00 0.00 -1.03 0.00 0.00 54.13 52.70 1kke s LEU 379 Cb -0.10 0.17 0.60 0.00 0.03 0.00 0.00 46.19 46.89 1kke s LEU 379 CO 0.24 -0.56 1.71 0.74 0.23 0.00 0.00 176.35 178.70 1kke h THR 380 N 3.28 0.55 -0.09 5.49 2.02 -1.91 0.93 112.91 123.17 1kke h THR 380 Ca -0.34 -0.14 0.03 0.00 0.77 0.00 0.00 66.41 66.72 1kke h THR 380 Cb 1.15 0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 67.65 1kke h THR 380 CO 0.63 0.08 0.08 1.23 0.37 0.00 0.00 175.52 177.91 1kke h GLY 381 N 0.42 0.00 2.00 2.16 0.00 -1.96 -1.77 103.07 103.91 1kke h GLY 381 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.82 1kke h GLY 381 CO -0.48 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.28 1kke n ASP 382 N -4.18 0.25 -0.56 0.19 8.00 0.32 -2.16 116.55 118.40 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 0.19 -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 -1.97 -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 0.93 -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 -4.91 118.70 116.93 1kke s GLU 384 Ca 0.27 2.33 -0.11 0.00 0.36 0.00 0.00 54.97 57.83 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 0.43 -0.51 1.07 -2.14 -0.54 0.00 0.00 175.26 173.57 1kke s PRO 385 N 0.33 2.74 0.49 4.30 0.02 -1.26 -0.32 135.00 141.30 1kke s PRO 385 Ca 0.64 0.80 0.20 0.00 0.02 0.00 0.00 61.00 62.67 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 -1.20 2.06 0.00 -0.33 0.00 0.00 177.00 177.91 1kke h ALA 386 N -0.79 1.57 -0.33 -1.55 0.00 -0.84 0.20 119.26 117.51 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 0.59 0.16 0.00 1.97 0.00 0.00 0.00 179.25 181.97 1kke n PHE 387 N -4.06 0.94 0.00 0.00 1.16 -1.26 -4.88 117.46 109.35 1kke n PHE 387 Ca -0.02 -0.35 0.00 0.00 -1.87 0.00 0.00 57.45 55.21 1kke n PHE 387 Cb 0.21 -0.23 0.00 0.00 -1.61 0.00 0.00 39.48 37.85 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 0.42 0.00 -1.63 2.97 8.25 0.06 -1.75 115.22 123.54 1kke n HIS 388 Ca 0.14 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.28 1kke n HIS 388 Cb 0.63 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.80 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 3.89 6.78 -4.81 0.41 6.94 -1.26 -4.29 115.26 122.92 1kke n ASN 389 Ca 0.00 -3.78 -0.36 0.00 -0.02 0.00 0.00 54.58 50.42 1kke n ASN 389 Cb 0.00 -0.78 -0.06 0.00 -2.36 0.00 0.00 39.78 36.57 1kke n ASN 389 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 1kke s ASP 390 N -2.34 7.12 -0.21 0.53 -0.00 -0.71 -4.80 116.67 116.26 1kke s ASP 390 Ca 0.59 1.49 -0.27 0.00 -0.00 0.00 0.00 52.55 54.37 1kke s ASP 390 Cb 0.47 -2.45 -0.00 0.00 -0.00 0.00 0.00 42.92 40.94 1kke s ASP 390 CO -0.04 0.03 0.92 -0.69 -0.00 0.00 0.00 175.17 175.39 1kke s VAL 391 N -1.51 4.79 0.29 -1.27 1.01 -1.26 -4.56 120.40 117.88 1kke s VAL 391 Ca 0.44 1.79 0.03 0.00 0.00 0.00 0.00 61.98 64.24 1kke s VAL 391 Cb -0.17 -4.21 -0.01 0.00 0.00 0.00 0.00 36.38 31.99 1kke s VAL 391 CO 0.22 -0.08 0.11 1.33 0.00 0.00 0.00 175.10 176.68 1kke n VAL 392 N 5.07 0.00 -3.09 2.92 0.24 0.34 -5.03 118.33 118.78 1kke n VAL 392 Ca 0.08 -1.70 -0.21 0.00 -2.04 0.00 0.00 64.34 60.46 1kke n VAL 392 Cb 0.47 0.63 -0.03 0.00 -1.47 0.00 0.00 33.84 33.44 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 -4.23 114.28 108.38 1kke n THR 393 Ca -0.03 -4.96 -0.35 0.00 -2.04 0.00 0.00 64.05 56.67 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 1.30 -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 0.00 175.55 175.66 1kke n GLY 395 N 0.60 -0.43 3.77 8.97 0.00 -1.26 -0.90 105.19 115.95 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 3.51 0.15 4.61 0.00 -1.26 -4.58 121.76 120.78 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 0.26 -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 31.91 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 -0.88 115.64 120.64 1kke s THR 398 Ca 0.07 0.34 0.03 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 0.12 1.00 -0.32 3.82 1.01 0.03 -4.98 120.40 121.07 1kke s VAL 399 Ca 0.12 -0.51 -0.12 0.00 0.00 0.00 0.00 61.98 61.48 1kke s VAL 399 Cb -0.12 -0.85 -0.02 0.00 0.00 0.00 0.00 36.38 35.39 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 -1.34 -0.02 0.00 0.00 0.00 0.00 51.96 50.61 1kke s ALA 400 Cb -0.07 -2.57 -0.03 0.00 0.00 0.00 0.00 23.12 20.44 1kke s ALA 400 CO 0.00 -0.89 -0.02 0.42 0.00 0.00 0.00 175.76 175.28 1kke s ILE 401 N 1.70 4.14 -0.32 0.00 1.01 -0.31 -4.32 121.20 123.12 1kke s ILE 401 Ca 0.06 -0.30 -0.20 0.00 0.00 0.00 0.00 60.65 60.21 1kke s ILE 401 Cb -0.17 -2.76 -0.01 0.00 0.01 0.00 0.00 42.46 39.53 1kke s ILE 401 CO 0.10 0.57 0.63 -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 -0.09 -0.75 107.32 113.83 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 1.46 0.08 1.08 0.00 0.00 0.00 173.10 175.74 1kke s LEU 403 N 2.62 4.00 0.23 0.66 1.43 0.75 0.73 118.68 129.11 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 -0.81 -0.46 113.70 115.20 1kke s SER 404 Ca 0.10 -0.99 0.16 0.00 0.48 0.00 0.00 55.95 55.71 1kke s SER 404 Cb -0.12 0.54 0.38 0.00 0.10 0.00 0.00 66.02 66.93 1kke s SER 404 CO 0.02 -1.07 1.18 -1.20 0.98 0.00 0.00 173.24 173.14 1kke n SER 405 N -0.35 1.39 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 -0.47 1.88 0.00 0.23 0.00 -1.26 -4.94 105.19 100.63 1kke n GLY 406 Ca 0.13 -0.43 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 -0.26 3.72 -0.02 0.00 -1.26 -4.99 105.19 102.38 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 1.89 -1.47 4.61 0.00 -1.26 -4.86 120.51 116.42 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 0.06 0.00 0.00 0.00 0.00 19.45 17.14 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 -0.80 2.76 -0.14 0.00 0.02 -1.26 -4.82 135.00 130.77 1kke s PRO 409 Ca 0.63 1.17 0.03 0.00 0.02 0.00 0.00 61.00 62.85 1kke s PRO 409 Cb -0.55 -1.96 0.01 0.00 0.02 0.00 0.00 34.50 32.01 1kke s PRO 409 CO 0.52 -1.25 -0.22 -0.65 -0.33 0.00 0.00 177.00 175.07 1kke s GLN 410 N -4.60 3.03 -0.29 5.54 -1.52 0.39 -4.88 119.66 117.34 1kke s GLN 410 Ca 0.62 -0.85 -0.20 0.00 -1.95 0.00 0.00 55.36 52.98 1kke s GLN 410 Cb -0.17 -2.43 -0.01 0.00 -0.22 0.00 0.00 33.01 30.18 1kke s GLN 410 CO 0.49 0.01 0.62 0.71 -0.25 0.00 0.00 175.29 176.86 1kke s TYR 411 N 0.77 3.23 -0.11 0.91 1.51 -1.26 -0.18 117.35 122.22 1kke s TYR 411 Ca -0.08 0.62 -0.04 0.00 -1.01 0.00 0.00 57.07 56.56 1kke s TYR 411 Cb -0.16 -2.94 -0.04 0.00 -0.11 0.00 0.00 41.96 38.72 1kke s TYR 411 CO -0.01 -0.43 0.04 -1.64 -1.11 0.00 0.00 175.55 172.39 1kke s MET 412 N 2.56 3.28 -0.34 -0.62 -1.94 0.07 -4.89 119.30 117.42 1kke s MET 412 Ca 0.25 -0.35 -0.21 0.00 -1.71 0.00 0.00 55.69 53.67 1kke s MET 412 Cb -0.15 -2.95 0.00 0.00 2.01 0.00 0.00 34.83 33.74 1kke s MET 412 CO 0.11 0.62 0.69 -1.12 -0.01 0.00 0.00 175.02 175.31 1kke s SER 413 N -0.63 6.50 0.18 3.03 0.01 -1.26 -1.16 113.70 120.36 1kke s SER 413 Ca 0.11 0.32 0.09 0.00 1.31 0.00 0.00 55.95 57.78 1kke s SER 413 Cb -0.12 -2.35 -0.04 0.00 0.21 0.00 0.00 66.02 63.72 1kke s SER 413 CO 0.02 -0.60 -0.12 -0.54 0.41 0.00 0.00 173.24 172.41 1kke s LYS 414 N 2.80 1.97 -0.15 12.44 1.02 0.62 -3.98 119.74 134.46 1kke s LYS 414 Ca 0.27 -1.30 -0.16 0.00 0.02 0.00 0.00 55.97 54.80 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 0.00 175.35 176.62 1kke s ASN 415 N -2.75 6.55 0.00 2.83 2.47 0.98 -0.79 114.94 124.24 1kke s ASN 415 Ca 0.24 0.65 0.04 0.00 0.42 0.00 0.00 52.86 54.21 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 -0.06 -0.83 118.68 124.12 1kke s LEU 416 Ca 0.21 -0.29 -0.21 0.00 0.69 0.00 0.00 54.13 54.54 1kke s LEU 416 Cb -0.14 -0.61 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 -0.46 -0.43 -0.20 5.38 -2.14 -0.73 -0.58 118.94 119.78 1kke s TRP 417 Ca 0.04 0.18 -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 30.77 1kke s TRP 417 CO 0.00 -0.81 1.20 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 -0.62 120.40 120.40 1kke s VAL 418 Ca 0.02 1.65 -0.13 0.00 0.00 0.00 0.00 61.98 63.53 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 -1.52 -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 0.82 -0.12 5.31 0.74 -1.05 -0.51 119.66 122.35 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 0.00 175.29 174.29 1kke s TRP 421 N -1.73 2.62 -0.05 1.67 -0.00 -1.26 -0.08 118.94 120.11 1kke s TRP 421 Ca -0.03 -1.09 -0.02 0.00 -0.00 0.00 0.00 56.10 54.97 1kke s TRP 421 Cb -0.00 -1.76 0.04 0.00 -0.00 0.00 0.00 33.47 31.74 1kke s TRP 421 CO 0.01 -0.45 0.11 -1.14 -0.00 0.00 0.00 176.95 175.47 1kke s GLN 422 N 0.49 0.03 -1.87 5.86 2.00 -0.23 -4.04 119.66 121.91 1kke s GLN 422 Ca -0.14 0.34 -0.23 0.00 -2.00 0.00 0.00 55.36 53.32 1kke s GLN 422 Cb -0.17 -0.24 0.23 0.00 0.80 0.00 0.00 33.01 33.63 1kke s GLN 422 CO 0.05 -0.20 0.61 -0.25 -0.50 0.00 0.00 175.29 175.01 1kke n ASP 423 N 4.41 -1.94 0.00 6.67 8.00 -1.26 -0.02 116.55 132.41 1kke n ASP 423 Ca -0.23 -1.23 0.00 0.00 0.71 0.00 0.00 54.79 54.05 1kke n ASP 423 Cb 0.51 -1.72 0.00 0.00 -0.02 0.00 0.00 41.12 39.89 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 -1.12 0.75 3.12 0.44 0.00 -1.26 -4.84 105.19 102.28 1kke n GLY 424 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.41 2.09 -0.27 1.61 1.01 0.97 -0.56 120.40 122.85 1kke s VAL 425 Ca 0.00 -0.97 -0.19 0.00 0.00 0.00 0.00 61.98 60.82 1kke s VAL 425 Cb 0.00 -1.89 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 1kke s VAL 425 CO 0.00 0.51 0.57 -0.22 0.00 0.00 0.00 175.10 175.96 1kke s LEU 426 N 1.28 4.09 -0.24 3.92 2.96 -0.39 -1.06 118.68 129.24 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 -0.36 0.16 -0.60 -1.32 0.00 0.00 176.35 174.10 1kke s ARG 427 N 2.43 4.04 -0.12 1.98 3.52 0.89 -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 0.03 -0.07 -0.51 -0.81 0.00 0.00 175.30 174.03 1kke s LEU 428 N 1.15 3.11 -0.04 -0.88 1.43 0.62 -1.42 118.68 122.66 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 0.00 176.35 176.79 1kke s ARG 429 N -0.04 4.26 -0.13 1.70 6.06 0.21 -0.22 118.95 130.79 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 -0.04 1.10 0.32 7.11 1.01 -0.32 -1.78 120.40 127.79 1kke s VAL 430 Ca 0.28 -0.43 -0.18 0.00 0.00 0.00 0.00 61.98 61.65 1kke s VAL 430 Cb -0.17 -1.16 0.06 0.00 0.00 0.00 0.00 36.38 35.11 1kke s VAL 430 CO 0.14 0.29 0.88 -1.83 0.00 0.00 0.00 175.10 174.59 1kke s GLU 431 N 1.67 1.92 0.06 2.72 -1.05 -0.01 -0.88 118.70 123.12 1kke s GLU 431 Ca 0.04 -1.24 0.00 0.00 -0.15 0.00 0.00 54.97 53.61 1kke s GLU 431 Cb -0.13 0.53 0.00 0.00 -0.44 0.00 0.00 34.13 34.09 1kke s GLU 431 CO -0.08 -0.90 0.00 0.41 0.95 0.00 0.00 175.26 175.64 1kke n GLY 432 N -0.60 -1.60 2.65 -3.83 0.00 -1.10 -0.01 105.19 100.70 1kke n GLY 432 Ca -0.06 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.93 1.46 6.20 -0.02 0.00 -1.26 -4.53 105.19 105.11 1kke n GLY 433 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.00 -1.68 3.75 -0.02 0.00 -1.26 -4.71 105.19 99.26 1kke n GLY 434 Ca 0.00 -1.42 -0.02 0.00 0.00 0.00 0.00 46.02 44.58 1kke n GLY 434 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1kke s SER 435 N -4.00 -0.10 0.20 1.61 0.15 -1.26 -4.82 113.70 105.48 1kke s SER 435 Ca 0.00 -0.37 -0.09 0.00 0.70 0.00 0.00 55.95 56.20 1kke s SER 435 Cb 0.00 0.38 -0.01 0.00 -1.71 0.00 0.00 66.02 64.68 1kke s SER 435 CO 0.00 -0.72 0.32 0.27 1.20 0.00 0.00 173.24 174.31 1kke s ILE 436 N -2.78 0.03 0.07 6.45 -4.36 -1.26 -5.13 121.20 114.22 1kke s ILE 436 Ca 0.15 -1.50 -0.30 0.00 -0.26 0.00 0.00 60.65 58.73 1kke s ILE 436 Cb 0.00 -2.07 -0.06 0.00 1.25 0.00 0.00 42.46 41.58 1kke s ILE 436 CO 0.01 -0.15 1.18 -0.89 0.24 0.00 0.00 174.94 175.32 1kke s THR 437 N -4.02 4.07 0.24 8.37 2.01 -1.26 -4.98 115.64 120.07 1kke s THR 437 Ca 0.23 1.51 -0.22 0.00 0.31 0.00 0.00 61.69 63.52 1kke s THR 437 Cb 0.03 -3.97 0.03 0.00 0.01 0.00 0.00 72.50 68.60 1kke s THR 437 CO 0.05 0.13 0.79 -1.38 -0.69 0.00 0.00 174.62 173.52 1kke s HIS 438 N 0.93 -0.18 0.00 4.92 -0.00 -1.26 -4.76 115.29 114.93 1kke s HIS 438 Ca 0.57 -0.23 0.00 0.00 -0.00 0.00 0.00 55.06 55.40 1kke s HIS 438 Cb -0.29 0.69 0.00 0.00 -0.00 0.00 0.00 32.58 32.98 1kke s HIS 438 CO 0.30 -1.12 0.00 -1.13 -0.00 0.00 0.00 174.74 172.79 1kke n SER 439 N -0.46 2.22 -4.25 7.38 3.41 -0.19 -4.73 113.62 117.00 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 1.90 0.00 4.04 0.01 -0.70 -2.56 114.94 116.62 1kke s ASN 440 Ca 0.00 -0.96 0.01 0.00 -0.71 0.00 0.00 52.86 51.20 1kke s ASN 440 Cb 0.00 -0.04 -0.00 0.00 0.41 0.00 0.00 41.25 41.62 1kke s ASN 440 CO 0.00 -0.27 -0.02 -0.94 -1.51 0.00 0.00 177.10 174.36 1kke s SER 441 N -2.99 0.25 -0.41 -1.22 1.04 -0.68 -1.92 113.70 107.77 1kke s SER 441 Ca 0.15 -0.09 -0.07 0.00 0.48 0.00 0.00 55.95 56.42 1kke s SER 441 Cb 0.00 -0.01 0.09 0.00 0.10 0.00 0.00 66.02 66.19 1kke s SER 441 CO 0.02 -0.01 0.23 -0.54 0.98 0.00 0.00 173.24 173.92 1kke s LYS 442 N -0.20 2.44 0.02 4.02 -0.14 0.22 -0.94 119.74 125.16 1kke s LYS 442 Ca -0.01 -1.55 -0.20 0.00 -1.36 0.00 0.00 55.97 52.86 1kke s LYS 442 Cb -0.02 -3.69 -0.06 0.00 -1.68 0.00 0.00 37.83 32.39 1kke s LYS 442 CO -0.00 -0.97 0.58 -1.58 -0.76 0.00 0.00 175.35 172.62 1kke s TRP 443 N 1.34 3.73 0.67 3.18 0.52 0.25 -0.91 118.94 127.71 1kke s TRP 443 Ca 0.04 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 -1.99 135.00 139.43 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 -0.10 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 3.51 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 -0.82 -0.01 -1.64 0.00 0.00 0.00 175.76 173.78 1kke s MET 446 N -1.94 0.11 -0.20 0.00 -1.94 -0.59 -4.89 119.30 109.84 1kke s MET 446 Ca 0.51 -0.13 -0.04 0.00 -1.71 0.00 0.00 55.69 54.32 1kke s MET 446 Cb -0.42 -0.04 -0.02 0.00 2.01 0.00 0.00 34.83 36.36 1kke s MET 446 CO 0.57 0.01 -0.03 0.99 -0.01 0.00 0.00 175.02 176.54 1kke s THR 447 N -0.26 3.62 -0.25 2.05 2.01 -1.26 -0.17 115.64 121.38 1kke s THR 447 Ca -0.02 -0.42 -0.07 0.00 0.31 0.00 0.00 61.69 61.48 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 0.44 0.07 -0.69 -0.69 0.00 0.00 174.62 173.74 1kke s VAL 448 N 1.14 4.28 0.06 3.82 1.01 -0.21 -4.94 120.40 125.56 1kke s VAL 448 Ca 0.02 -0.18 0.07 0.00 0.00 0.00 0.00 61.98 61.89 1kke s VAL 448 Cb -0.15 -3.00 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 1kke s VAL 448 CO 0.00 0.34 -0.19 -0.44 0.00 0.00 0.00 175.10 174.81 1kke s SER 449 N 1.60 2.32 -0.05 3.32 0.01 -1.26 -0.39 113.70 119.26 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 -0.95 -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 56.78 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 -0.50 1.60 -1.25 -1.52 0.00 0.00 175.55 173.90 1kke s PRO 451 N -2.21 4.20 0.16 -3.49 0.04 -1.26 -1.79 135.00 130.65 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 -3.19 -0.08 0.00 0.04 0.00 0.00 34.50 31.27 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 1.30 4.21 0.43 4.56 3.52 0.03 -0.33 118.95 132.68 1kke s ARG 452 Ca 0.71 0.78 -0.24 0.00 -0.13 0.00 0.00 55.73 56.86 1kke s ARG 452 Cb -0.44 -3.02 -0.08 0.00 -1.56 0.00 0.00 34.95 29.85 1kke s ARG 452 CO 0.31 0.49 1.15 0.45 -0.81 0.00 0.00 175.30 176.90 1kke s SER 453 N -1.49 6.36 -0.00 -2.12 0.15 0.56 -4.18 113.70 112.99 1kke s SER 453 Ca 0.38 2.29 0.01 0.00 0.70 0.00 0.00 55.95 59.33 1kke s SER 453 Cb -0.18 -2.61 -0.00 0.00 -1.71 0.00 0.00 66.02 61.52 1kke s SER 453 CO 0.21 -0.78 -0.04 0.72 1.20 0.00 0.00 173.24 174.54 1kke s PHE 454 N -1.51 0.40 0.00 3.44 -0.12 -1.26 -4.93 117.98 114.00 1kke s PHE 454 Ca 0.60 -0.10 0.00 0.00 -0.05 0.00 0.00 56.93 57.38 1kke s PHE 454 Cb -0.29 -0.26 0.00 0.00 -0.63 0.00 0.00 43.02 41.85 1kke s PHE 454 CO 0.35 -0.01 0.02 2.41 -0.05 0.00 0.00 175.22 177.94