#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mi0 s THR 302 N 0.00 -0.13 -0.08 12.58 2.01 -1.26 -1.58 115.64 127.18 3mi0 s THR 302 Ca 0.00 0.23 0.04 0.00 0.31 0.00 0.00 61.69 62.27 3mi0 s THR 302 Cb 0.00 -0.28 0.00 0.00 0.01 0.00 0.00 72.50 72.23 3mi0 s THR 302 CO 0.00 0.10 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.20 3mi0 s ILE 303 N 1.57 1.73 0.23 1.82 1.01 -0.43 -1.99 121.20 125.14 3mi0 s ILE 303 Ca -0.05 -0.84 0.11 0.00 0.00 0.00 0.00 60.65 59.87 3mi0 s ILE 303 Cb -0.12 -1.51 -0.05 0.00 0.01 0.00 0.00 42.46 40.80 3mi0 s ILE 303 CO -0.06 0.49 -0.20 0.68 0.00 0.00 0.00 174.94 175.84 3mi0 s VAL 304 N 0.38 2.28 -0.08 2.92 -7.23 0.07 -1.50 120.40 117.23 3mi0 s VAL 304 Ca -0.15 -2.23 -0.11 0.00 -1.81 0.00 0.00 61.98 57.68 3mi0 s VAL 304 Cb -0.17 -2.17 0.02 0.00 0.56 0.00 0.00 36.38 34.63 3mi0 s VAL 304 CO 0.07 -0.34 0.28 0.00 -0.31 0.00 0.00 175.10 174.79 3mi0 s ALA 305 N -2.29 -0.69 -0.01 1.32 0.00 -0.31 -1.21 121.76 118.58 3mi0 s ALA 305 Ca 0.25 0.63 -0.16 0.00 0.00 0.00 0.00 51.96 52.68 3mi0 s ALA 305 Cb -0.05 -0.32 0.03 0.00 0.00 0.00 0.00 23.12 22.78 3mi0 s ALA 305 CO 0.12 -0.17 0.34 -0.48 0.00 0.00 0.00 175.76 175.57 3mi0 s LEU 306 N -0.27 0.73 0.09 0.00 0.05 -0.08 -1.32 118.68 117.89 3mi0 s LEU 306 Ca -0.04 0.12 -0.13 0.00 0.05 0.00 0.00 54.13 54.14 3mi0 s LEU 306 Cb -0.03 1.38 -0.06 0.00 -2.05 0.00 0.00 46.19 45.43 3mi0 s LEU 306 CO 0.01 -0.47 0.46 -0.54 -0.55 0.00 0.00 176.35 175.26 3mi0 s LYS 307 N -1.39 3.88 0.13 1.48 1.02 0.38 -1.02 119.74 124.21 3mi0 s LYS 307 Ca -0.13 0.35 0.02 0.00 0.02 0.00 0.00 55.97 56.23 3mi0 s LYS 307 Cb -0.05 -3.02 -0.04 0.00 -0.52 0.00 0.00 37.83 34.20 3mi0 s LYS 307 CO 0.04 0.56 -0.04 1.52 -0.92 0.00 0.00 175.35 176.51 3mi0 s TYR 308 N -1.36 1.01 -0.33 3.18 -0.85 -0.51 -4.96 117.35 113.54 3mi0 s TYR 308 Ca 0.33 -0.95 -0.34 0.00 -0.52 0.00 0.00 57.07 55.59 3mi0 s TYR 308 Cb -0.15 -0.58 -0.11 0.00 0.38 0.00 0.00 41.96 41.51 3mi0 s TYR 308 CO 0.18 -0.17 2.19 -2.30 -1.52 0.00 0.00 175.55 173.93 3mi0 n PRO 309 N -0.12 1.20 -0.12 -3.49 -0.02 -1.26 -0.71 135.00 130.48 3mi0 n PRO 309 Ca -0.10 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 3mi0 n PRO 309 Cb 0.62 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 3mi0 n PRO 309 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mi0 n GLY 310 N 6.41 0.55 0.00 -1.23 0.00 0.49 -4.78 105.19 106.64 3mi0 n GLY 310 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.42 3mi0 n GLY 310 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mi0 n GLY 311 N -2.00 1.15 3.28 -0.02 0.00 0.11 -4.14 105.19 103.58 3mi0 n GLY 311 Ca 0.00 -0.66 -0.14 0.00 0.00 0.00 0.00 46.02 45.22 3mi0 n GLY 311 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mi0 s VAL 312 N -2.22 0.04 0.00 1.61 0.11 -0.28 -1.42 120.40 118.24 3mi0 s VAL 312 Ca 0.00 -0.36 0.05 0.00 -2.93 0.00 0.00 61.98 58.74 3mi0 s VAL 312 Cb 0.00 -0.66 -0.01 0.00 -1.53 0.00 0.00 36.38 34.17 3mi0 s VAL 312 CO 0.00 -0.20 -0.15 0.54 -3.33 0.00 0.00 175.10 171.96 3mi0 s VAL 313 N -1.16 1.18 -0.03 2.04 0.11 -0.19 -0.65 120.40 121.70 3mi0 s VAL 313 Ca -0.12 -0.73 0.03 0.00 -2.93 0.00 0.00 61.98 58.23 3mi0 s VAL 313 Cb -0.04 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.81 3mi0 s VAL 313 CO 0.05 0.26 -0.12 -0.32 -3.33 0.00 0.00 175.10 171.64 3mi0 s MET 314 N -0.54 1.28 0.02 1.54 1.75 -0.53 -0.90 119.30 121.91 3mi0 s MET 314 Ca 0.05 -0.42 0.01 0.00 -1.25 0.00 0.00 55.69 54.07 3mi0 s MET 314 Cb -0.06 -1.15 -0.02 0.00 2.84 0.00 0.00 34.83 36.44 3mi0 s MET 314 CO -0.00 0.16 -0.04 0.00 -0.65 0.00 0.00 175.02 174.49 3mi0 s ALA 315 N 0.14 0.22 0.03 4.11 0.00 -0.35 -0.53 121.76 125.39 3mi0 s ALA 315 Ca -0.03 -0.60 0.00 0.00 0.00 0.00 0.00 51.96 51.33 3mi0 s ALA 315 Cb -0.10 0.12 -0.03 0.00 0.00 0.00 0.00 23.12 23.11 3mi0 s ALA 315 CO 0.01 -0.12 -0.04 0.20 0.00 0.00 0.00 175.76 175.81 3mi0 s GLY 316 N -1.41 0.36 1.04 0.00 0.00 -0.32 -0.75 107.32 106.24 3mi0 s GLY 316 Ca -0.14 -0.78 -0.17 0.00 0.00 0.00 0.00 44.72 43.63 3mi0 s GLY 316 CO -0.01 -0.86 1.28 0.51 0.00 0.00 0.00 173.10 174.02 3mi0 s ASP 317 N -1.86 2.40 0.00 1.64 -4.77 -0.84 -2.13 116.67 111.11 3mi0 s ASP 317 Ca -0.09 0.30 0.02 0.00 -3.30 0.00 0.00 52.55 49.48 3mi0 s ASP 317 Cb -0.06 -0.35 0.04 0.00 -1.09 0.00 0.00 42.92 41.47 3mi0 s ASP 317 CO -0.03 -3.18 0.96 0.54 0.70 0.00 0.00 175.17 174.16 3mi0 n ARG 318 N -4.07 2.38 -3.19 2.11 5.12 -1.26 -4.49 116.66 113.25 3mi0 n ARG 318 Ca 0.15 -1.43 -0.36 0.00 -1.93 0.00 0.00 57.85 54.29 3mi0 n ARG 318 Cb 0.59 -1.04 -0.06 0.00 -1.16 0.00 0.00 32.46 30.79 3mi0 n ARG 318 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 3mi0 s ARG 319 N -0.86 4.16 0.01 5.56 3.52 -1.26 -2.10 118.95 127.97 3mi0 s ARG 319 Ca 0.03 0.74 0.02 0.00 -0.13 0.00 0.00 55.73 56.39 3mi0 s ARG 319 Cb 0.02 -2.90 -0.01 0.00 -1.56 0.00 0.00 34.95 30.50 3mi0 s ARG 319 CO 0.02 0.42 -0.07 -1.54 -0.81 0.00 0.00 175.30 173.33 3mi0 s SER 320 N -1.67 0.84 0.24 -2.12 1.04 -0.83 -4.84 113.70 106.37 3mi0 s SER 320 Ca 0.41 -0.23 0.03 0.00 0.48 0.00 0.00 55.95 56.63 3mi0 s SER 320 Cb -0.16 -0.06 -0.05 0.00 0.10 0.00 0.00 66.02 65.85 3mi0 s SER 320 CO 0.20 0.02 0.03 0.42 0.98 0.00 0.00 173.24 174.89 3mi0 s THR 321 N -0.46 0.87 -0.29 2.02 -4.23 -1.26 -0.65 115.64 111.64 3mi0 s THR 321 Ca -0.00 -2.01 -0.03 0.00 -1.18 0.00 0.00 61.69 58.46 3mi0 s THR 321 Cb -0.04 -2.44 0.10 0.00 1.34 0.00 0.00 72.50 71.45 3mi0 s THR 321 CO 0.00 -0.22 0.12 -1.10 -0.54 0.00 0.00 174.62 172.88 3mi0 s GLN 322 N -3.92 0.29 6.87 3.99 -0.21 -0.29 -4.78 119.66 121.61 3mi0 s GLN 322 Ca 0.31 -0.61 0.00 0.00 0.02 0.00 0.00 55.36 55.08 3mi0 s GLN 322 Cb 0.07 -1.36 0.00 0.00 1.00 0.00 0.00 33.01 32.72 3mi0 s GLN 322 CO 0.10 -0.99 0.00 0.41 -2.12 0.00 0.00 175.29 172.69 3mi0 n GLY 323 N 5.17 2.61 0.12 3.09 0.00 -1.26 -1.65 105.19 113.27 3mi0 n GLY 323 Ca -0.05 -0.34 0.13 0.00 0.00 0.00 0.00 46.02 45.76 3mi0 n GLY 323 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3mi0 h ASN 324 N 2.91 0.00 -3.51 1.61 2.35 -2.03 -3.46 115.58 113.45 3mi0 h ASN 324 Ca 0.00 -0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.23 3mi0 h ASN 324 Cb 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 3mi0 h ASN 324 CO 0.00 0.00 0.42 -0.04 -1.65 0.00 0.00 177.43 176.16 3mi0 s MET 325 N -3.12 4.62 -0.42 0.81 -1.94 -0.66 -5.00 119.30 113.61 3mi0 s MET 325 Ca 0.10 1.57 -0.29 0.00 -1.71 0.00 0.00 55.69 55.36 3mi0 s MET 325 Cb 0.11 -3.35 0.02 0.00 2.01 0.00 0.00 34.83 33.63 3mi0 s MET 325 CO 0.61 0.10 1.14 0.42 -0.01 0.00 0.00 175.02 177.27 3mi0 s ILE 326 N 0.12 4.28 -0.80 2.53 1.01 -1.26 -1.14 121.20 125.94 3mi0 s ILE 326 Ca 0.49 1.38 0.18 0.00 0.00 0.00 0.00 60.65 62.70 3mi0 s ILE 326 Cb -0.26 -4.51 -0.21 0.00 0.01 0.00 0.00 42.46 37.50 3mi0 s ILE 326 CO 0.31 -0.81 0.75 -1.54 0.00 0.00 0.00 174.94 173.66 3mi0 n SER 327 N 7.58 0.85 -3.65 3.58 3.41 0.18 -4.94 113.62 120.62 3mi0 n SER 327 Ca 0.12 -0.87 -0.15 0.00 -0.26 0.00 0.00 58.87 57.71 3mi0 n SER 327 Cb 0.48 1.06 -0.08 0.00 -0.26 0.00 0.00 64.21 65.42 3mi0 n SER 327 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3mi0 s GLY 328 N -2.83 -0.35 0.00 5.00 0.00 -0.87 -4.93 107.32 103.34 3mi0 s GLY 328 Ca 0.06 0.83 0.00 0.00 0.00 0.00 0.00 44.72 45.61 3mi0 s GLY 328 CO 0.75 0.56 0.39 0.54 0.00 0.00 0.00 173.10 175.34 3mi0 n ARG 329 N 1.23 0.03 -0.89 2.90 1.74 -1.25 -1.96 116.66 118.47 3mi0 n ARG 329 Ca -0.20 -0.46 0.02 0.00 -0.77 0.00 0.00 57.85 56.45 3mi0 n ARG 329 Cb 0.56 -0.76 0.02 0.00 -1.02 0.00 0.00 32.46 31.27 3mi0 n ARG 329 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3mi0 n ASP 330 N -0.07 0.54 -4.77 0.55 5.68 -1.04 -4.68 116.55 112.76 3mi0 n ASP 330 Ca 0.00 -2.09 -0.40 0.00 -0.50 0.00 0.00 54.79 51.80 3mi0 n ASP 330 Cb 0.19 -0.26 0.01 0.00 -1.14 0.00 0.00 41.12 39.92 3mi0 n ASP 330 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 3mi0 s VAL 331 N -0.20 2.29 -0.22 2.12 1.01 -0.89 -5.00 120.40 119.51 3mi0 s VAL 331 Ca 0.16 0.26 -0.05 0.00 0.00 0.00 0.00 61.98 62.35 3mi0 s VAL 331 Cb 0.18 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.38 3mi0 s VAL 331 CO -0.07 0.04 0.01 -0.13 0.00 0.00 0.00 175.10 174.95 3mi0 s ARG 332 N -2.33 3.57 0.00 2.72 0.52 -1.26 -4.34 118.95 117.83 3mi0 s ARG 332 Ca 0.58 -0.53 0.11 0.00 -0.52 0.00 0.00 55.73 55.37 3mi0 s ARG 332 Cb -0.42 -3.12 -0.04 0.00 0.52 0.00 0.00 34.95 31.89 3mi0 s ARG 332 CO 0.54 -0.09 0.61 1.63 0.02 0.00 0.00 175.30 178.01 3mi0 n LYS 333 N 4.55 2.43 -4.24 3.54 5.02 -1.26 -4.94 118.16 123.27 3mi0 n LYS 333 Ca -0.17 -0.46 -0.34 0.00 -2.02 0.00 0.00 58.31 55.32 3mi0 n LYS 333 Cb 0.51 -1.09 -0.14 0.00 -0.02 0.00 0.00 35.03 34.30 3mi0 n LYS 333 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3mi0 s VAL 334 N -1.62 3.19 0.02 -0.18 1.01 -1.26 -2.40 120.40 119.16 3mi0 s VAL 334 Ca 0.08 -0.58 0.08 0.00 0.00 0.00 0.00 61.98 61.56 3mi0 s VAL 334 Cb 0.09 -2.40 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 3mi0 s VAL 334 CO 0.33 0.47 -0.24 -0.31 0.00 0.00 0.00 175.10 175.35 3mi0 s TYR 335 N 1.02 2.39 -0.26 5.22 2.02 0.50 -4.96 117.35 123.27 3mi0 s TYR 335 Ca -0.00 -0.38 -0.28 0.00 -0.37 0.00 0.00 57.07 56.04 3mi0 s TYR 335 Cb -0.15 -1.45 0.01 0.00 -0.40 0.00 0.00 41.96 39.97 3mi0 s TYR 335 CO -0.01 0.10 1.01 0.42 -1.57 0.00 0.00 175.55 175.50 3mi0 s ILE 336 N -0.76 4.65 -0.17 2.71 1.01 -1.26 -0.74 121.20 126.64 3mi0 s ILE 336 Ca 0.12 1.82 0.22 0.00 0.00 0.00 0.00 60.65 62.81 3mi0 s ILE 336 Cb -0.10 -4.31 -0.21 0.00 0.01 0.00 0.00 42.46 37.86 3mi0 s ILE 336 CO 0.02 -0.26 0.72 0.35 0.00 0.00 0.00 174.94 175.76 3mi0 n THR 337 N 5.50 0.22 -3.86 2.92 -2.24 0.19 -4.94 114.28 112.07 3mi0 n THR 337 Ca 0.11 -0.48 -0.05 0.00 -2.27 0.00 0.00 64.05 61.35 3mi0 n THR 337 Cb 0.47 -0.07 0.02 0.00 -2.10 0.00 0.00 70.33 68.65 3mi0 n THR 337 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3mi0 s ASP 338 N -4.72 0.01 0.62 3.42 -4.77 -1.17 -4.50 116.67 105.57 3mi0 s ASP 338 Ca -0.04 -0.86 0.31 0.00 -3.30 0.00 0.00 52.55 48.66 3mi0 s ASP 338 Cb 0.13 0.62 1.71 0.00 -1.09 0.00 0.00 42.92 44.29 3mi0 s ASP 338 CO 0.86 -1.24 2.05 0.44 0.70 0.00 0.00 175.17 177.98 3mi0 h ASP 339 N 2.00 0.00 0.00 2.11 3.32 -1.95 -2.94 116.42 118.96 3mi0 h ASP 339 Ca -0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.76 3mi0 h ASP 339 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 3mi0 h ASP 339 CO 0.38 0.00 -0.14 -1.22 -1.72 0.00 0.00 179.24 176.54 3mi0 n TYR 340 N -3.49 0.00 -3.83 4.55 4.01 -1.26 0.26 117.16 117.40 3mi0 n TYR 340 Ca 0.01 -0.66 -0.12 0.00 -0.16 0.00 0.00 57.90 56.98 3mi0 n TYR 340 Cb 0.37 -0.11 -0.10 0.00 -0.31 0.00 0.00 39.34 39.19 3mi0 n TYR 340 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3mi0 s THR 341 N -1.86 0.07 0.05 -0.72 -4.23 -1.11 -1.39 115.64 106.45 3mi0 s THR 341 Ca 0.20 -0.57 0.04 0.00 -1.18 0.00 0.00 61.69 60.18 3mi0 s THR 341 Cb 0.18 -0.48 -0.02 0.00 1.34 0.00 0.00 72.50 73.51 3mi0 s THR 341 CO 0.02 -0.31 -0.12 0.00 -0.54 0.00 0.00 174.62 173.67 3mi0 s ALA 342 N -1.25 0.97 -0.05 3.99 0.00 0.50 -0.64 121.76 125.28 3mi0 s ALA 342 Ca -0.13 -0.84 0.04 0.00 0.00 0.00 0.00 51.96 51.03 3mi0 s ALA 342 Cb -0.06 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 22.97 3mi0 s ALA 342 CO 0.02 0.13 -0.17 0.99 0.00 0.00 0.00 175.76 176.73 3mi0 s THR 343 N -1.11 1.45 -0.06 0.00 2.01 0.08 -0.96 115.64 117.05 3mi0 s THR 343 Ca -0.03 -0.71 0.06 0.00 0.31 0.00 0.00 61.69 61.32 3mi0 s THR 343 Cb -0.09 -1.26 -0.01 0.00 0.01 0.00 0.00 72.50 71.15 3mi0 s THR 343 CO 0.01 0.42 -0.24 -0.83 -0.69 0.00 0.00 174.62 173.29 3mi0 s GLY 344 N 0.21 1.25 0.01 4.40 0.00 -0.39 -0.37 107.32 112.42 3mi0 s GLY 344 Ca -0.08 -1.00 0.06 0.00 0.00 0.00 0.00 44.72 43.69 3mi0 s GLY 344 CO 0.03 -0.60 -0.17 -0.42 0.00 0.00 0.00 173.10 171.94 3mi0 s ILE 345 N -0.12 1.34 0.28 0.90 1.01 -1.01 -0.48 121.20 123.13 3mi0 s ILE 345 Ca -0.04 -0.87 0.10 0.00 0.00 0.00 0.00 60.65 59.84 3mi0 s ILE 345 Cb -0.14 -1.15 -0.05 0.00 0.01 0.00 0.00 42.46 41.13 3mi0 s ILE 345 CO 0.04 0.26 -0.15 0.00 0.00 0.00 0.00 174.94 175.09 3mi0 s ALA 346 N -0.57 2.61 0.00 9.38 0.00 -0.56 -4.96 121.76 127.66 3mi0 s ALA 346 Ca 0.06 -1.89 0.00 0.00 0.00 0.00 0.00 51.96 50.13 3mi0 s ALA 346 Cb -0.07 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 22.92 3mi0 s ALA 346 CO 0.00 0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.33 3mi0 n GLY 347 N -0.61 0.33 3.66 0.00 0.00 -1.26 -1.01 105.19 106.31 3mi0 n GLY 347 Ca -0.06 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 43.70 3mi0 n GLY 347 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mi0 s THR 348 N 0.00 3.48 0.18 2.61 2.01 0.10 -4.91 115.64 119.11 3mi0 s THR 348 Ca 0.00 0.62 -0.15 0.00 0.31 0.00 0.00 61.69 62.47 3mi0 s THR 348 Cb 0.00 -3.40 0.11 0.00 0.01 0.00 0.00 72.50 69.22 3mi0 s THR 348 CO 0.00 -0.05 1.68 0.00 -0.69 0.00 0.00 174.62 175.56 3mi0 h ALA 349 N 9.52 0.39 -0.39 7.40 0.00 -1.93 -0.77 119.26 133.48 3mi0 h ALA 349 Ca -0.41 0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.69 3mi0 h ALA 349 Cb 1.19 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 19.20 3mi0 h ALA 349 CO 0.95 -0.41 0.16 0.00 0.00 0.00 0.00 179.25 179.95 3mi0 h ALA 350 N 1.41 0.47 -0.20 0.00 0.00 -1.98 -1.89 119.26 117.07 3mi0 h ALA 350 Ca 0.22 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 55.02 3mi0 h ALA 350 Cb 0.33 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3mi0 h ALA 350 CO -0.40 -0.22 -0.48 0.28 0.00 0.00 0.00 179.25 178.43 3mi0 h VAL 351 N 0.34 1.31 0.17 0.00 2.07 -1.76 -2.94 116.25 115.44 3mi0 h VAL 351 Ca 0.17 -1.70 -0.01 0.00 0.82 0.00 0.00 66.70 65.99 3mi0 h VAL 351 Cb 0.12 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 3mi0 h VAL 351 CO -0.15 0.53 -0.08 0.00 0.02 0.00 0.00 177.57 177.89 3mi0 h ALA 352 N 1.04 -0.23 -0.73 1.67 0.00 -0.68 0.21 119.26 120.54 3mi0 h ALA 352 Ca 0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3mi0 h ALA 352 Cb 1.01 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 3mi0 h ALA 352 CO 0.09 -0.61 0.42 0.28 0.00 0.00 0.00 179.25 179.43 3mi0 h VAL 353 N -0.26 1.21 -0.50 0.00 2.07 -1.42 -2.50 116.25 114.85 3mi0 h VAL 353 Ca -0.02 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 66.98 3mi0 h VAL 353 Cb 0.20 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 3mi0 h VAL 353 CO 0.04 0.23 0.23 -0.08 0.02 0.00 0.00 177.57 178.00 3mi0 h GLU 354 N 1.00 0.74 -0.37 1.57 4.81 -1.31 -1.39 114.58 119.62 3mi0 h GLU 354 Ca 0.26 -0.12 0.04 0.00 -0.13 0.00 0.00 59.36 59.41 3mi0 h GLU 354 Cb -0.01 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.21 3mi0 h GLU 354 CO -0.05 0.63 0.15 0.74 -0.73 0.00 0.00 179.01 179.75 3mi0 h PHE 355 N 0.67 0.26 -0.41 0.92 0.04 -0.71 0.40 116.94 118.11 3mi0 h PHE 355 Ca 0.17 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.94 3mi0 h PHE 355 Cb 0.15 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.22 3mi0 h PHE 355 CO -0.00 0.12 0.17 0.00 -0.60 0.00 0.00 178.31 178.00 3mi0 h ALA 356 N 1.23 0.53 -0.15 2.45 0.00 -1.18 -0.54 119.26 121.59 3mi0 h ALA 356 Ca 0.17 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3mi0 h ALA 356 Cb 0.12 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3mi0 h ALA 356 CO -0.15 0.13 0.03 -0.09 0.00 0.00 0.00 179.25 179.16 3mi0 h ARG 357 N 0.52 0.25 -0.55 0.00 2.43 -0.95 -2.31 114.38 113.76 3mi0 h ARG 357 Ca 0.14 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.16 3mi0 h ARG 357 Cb 0.18 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 3mi0 h ARG 357 CO -0.01 0.42 0.04 1.25 -1.51 0.00 0.00 179.97 180.16 3mi0 h LEU 358 N 0.03 0.92 -0.64 3.80 5.85 -0.93 -2.80 115.31 121.55 3mi0 h LEU 358 Ca 0.05 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.46 3mi0 h LEU 358 Cb 0.29 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 3mi0 h LEU 358 CO 0.00 0.98 0.32 0.22 -0.34 0.00 0.00 178.44 179.62 3mi0 h TYR 359 N 0.83 0.91 -0.68 1.25 3.20 -1.07 0.21 116.97 121.63 3mi0 h TYR 359 Ca 0.16 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.97 3mi0 h TYR 359 Cb 0.48 -0.28 -0.03 0.00 1.54 0.00 0.00 36.73 38.44 3mi0 h TYR 359 CO 0.04 0.68 0.31 0.00 -1.64 0.00 0.00 178.16 177.55 3mi0 h ALA 360 N 1.14 0.88 -0.52 1.82 0.00 -1.40 -1.17 119.26 120.01 3mi0 h ALA 360 Ca 0.22 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3mi0 h ALA 360 Cb 0.10 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3mi0 h ALA 360 CO -0.03 0.45 0.23 0.28 0.00 0.00 0.00 179.25 180.19 3mi0 h VAL 361 N 0.95 1.21 -0.58 0.00 2.07 -1.19 -2.30 116.25 116.40 3mi0 h VAL 361 Ca 0.23 -0.61 -0.04 0.00 0.82 0.00 0.00 66.70 67.10 3mi0 h VAL 361 Cb 0.14 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 3mi0 h VAL 361 CO -0.03 0.24 0.19 -0.08 0.02 0.00 0.00 177.57 177.91 3mi0 h GLU 362 N 0.70 0.87 -0.33 1.57 4.81 -0.41 0.44 114.58 122.23 3mi0 h GLU 362 Ca 0.18 -0.16 -0.06 0.00 -0.13 0.00 0.00 59.36 59.19 3mi0 h GLU 362 Cb 0.15 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 3mi0 h GLU 362 CO -0.02 0.75 -0.04 -0.07 -0.73 0.00 0.00 179.01 178.90 3mi0 h LEU 363 N 0.85 0.60 -0.79 1.64 4.07 -0.97 -2.36 115.31 118.34 3mi0 h LEU 363 Ca 0.19 -0.34 -0.13 0.00 0.08 0.00 0.00 57.88 57.69 3mi0 h LEU 363 Cb 0.23 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 41.80 3mi0 h LEU 363 CO -0.01 0.79 -0.53 -0.08 -1.08 0.00 0.00 178.44 177.53 3mi0 h GLU 364 N 0.39 0.18 -0.23 1.13 4.81 -1.23 -2.51 114.58 117.12 3mi0 h GLU 364 Ca 0.09 -0.11 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3mi0 h GLU 364 Cb 0.51 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 3mi0 h GLU 364 CO 0.02 0.67 0.14 1.25 -0.73 0.00 0.00 179.01 180.37 3mi0 h HIS 365 N 0.14 0.31 -0.52 0.92 2.76 -0.79 -0.06 115.15 117.91 3mi0 h HIS 365 Ca 0.00 -0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.14 3mi0 h HIS 365 Cb 0.99 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 29.83 3mi0 h HIS 365 CO 0.01 0.24 0.20 -0.92 -1.30 0.00 0.00 177.93 176.17 3mi0 h TYR 366 N 0.29 0.80 -0.72 5.26 3.20 -1.34 -1.41 116.97 123.05 3mi0 h TYR 366 Ca 0.08 -0.06 0.02 0.00 3.14 0.00 0.00 58.73 61.91 3mi0 h TYR 366 Cb 0.02 -0.24 -0.04 0.00 1.54 0.00 0.00 36.73 38.01 3mi0 h TYR 366 CO -0.05 0.66 0.47 1.49 -1.64 0.00 0.00 178.16 179.10 3mi0 h GLU 367 N 0.71 0.92 -0.28 1.82 4.81 -1.03 0.11 114.58 121.63 3mi0 h GLU 367 Ca 0.17 -0.06 -0.17 0.00 -0.13 0.00 0.00 59.36 59.17 3mi0 h GLU 367 Cb 0.21 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 3mi0 h GLU 367 CO -0.01 0.61 -0.51 0.87 -0.73 0.00 0.00 179.01 179.23 3mi0 h LYS 368 N 0.95 0.81 -0.20 1.92 1.57 -0.86 0.45 116.57 121.21 3mi0 h LYS 368 Ca 0.27 -0.50 -0.09 0.00 -1.87 0.00 0.00 60.65 58.47 3mi0 h LYS 368 Cb -0.06 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 3mi0 h LYS 368 CO -0.08 1.13 -0.21 -0.07 -0.57 0.00 0.00 179.45 179.65 3mi0 h LEU 369 N 0.63 0.53 -0.17 2.94 3.38 -0.98 -3.33 115.31 118.31 3mi0 h LEU 369 Ca 0.02 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3mi0 h LEU 369 Cb 1.10 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.71 3mi0 h LEU 369 CO 0.11 0.91 -0.71 -0.62 0.09 0.00 0.00 178.44 178.22 3mi0 n GLU 370 N -4.43 0.22 0.00 1.13 -0.58 0.35 -4.97 120.64 112.36 3mi0 n GLU 370 Ca -0.05 -0.17 0.00 0.00 -0.42 0.00 0.00 57.16 56.52 3mi0 n GLU 370 Cb 0.41 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.79 3mi0 n GLU 370 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3mi0 n GLY 371 N 1.48 2.30 3.06 0.62 0.00 0.14 -4.99 105.19 107.80 3mi0 n GLY 371 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.98 3mi0 n GLY 371 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mi0 s VAL 372 N -2.68 0.11 0.69 1.61 0.11 -1.20 -4.98 120.40 114.06 3mi0 s VAL 372 Ca 0.00 -0.94 -0.12 0.00 -2.93 0.00 0.00 61.98 58.00 3mi0 s VAL 372 Cb 0.00 -0.56 0.01 0.00 -1.53 0.00 0.00 36.38 34.30 3mi0 s VAL 372 CO 0.00 -0.52 1.06 -2.16 -3.33 0.00 0.00 175.10 170.16 3mi0 s PRO 373 N -1.89 2.90 0.69 1.54 0.04 -1.26 -4.07 135.00 132.95 3mi0 s PRO 373 Ca -0.11 1.03 -0.17 0.00 0.04 0.00 0.00 61.00 61.79 3mi0 s PRO 373 Cb -0.06 -1.98 0.01 0.00 0.04 0.00 0.00 34.50 32.51 3mi0 s PRO 373 CO -0.02 -1.13 1.24 -0.51 0.04 0.00 0.00 177.00 176.62 3mi0 s LEU 374 N -5.43 3.45 0.80 -3.56 1.43 -1.26 -4.99 118.68 109.12 3mi0 s LEU 374 Ca 0.59 2.47 -0.11 0.00 -1.03 0.00 0.00 54.13 56.06 3mi0 s LEU 374 Cb -0.15 -4.60 0.07 0.00 0.03 0.00 0.00 46.19 41.54 3mi0 s LEU 374 CO 0.52 -2.11 1.09 0.42 0.23 0.00 0.00 176.35 176.50 3mi0 s THR 375 N -1.71 3.19 0.27 5.49 -4.23 -1.26 -4.78 115.64 112.61 3mi0 s THR 375 Ca 0.78 0.39 -0.03 0.00 -1.18 0.00 0.00 61.69 61.65 3mi0 s THR 375 Cb -0.33 -2.88 0.27 0.00 1.34 0.00 0.00 72.50 70.90 3mi0 s THR 375 CO 0.42 -0.50 1.90 0.15 -0.54 0.00 0.00 174.62 176.05 3mi0 h PHE 376 N -1.21 1.21 -0.99 3.99 3.57 -1.98 -0.55 116.94 120.98 3mi0 h PHE 376 Ca -0.45 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.10 3mi0 h PHE 376 Cb 1.24 -0.40 -0.05 0.00 2.79 0.00 0.00 35.95 39.53 3mi0 h PHE 376 CO 0.54 0.67 0.65 0.00 -2.23 0.00 0.00 178.31 177.94 3mi0 h ALA 377 N 1.44 1.33 -0.26 2.41 0.00 -2.00 -1.25 119.26 120.93 3mi0 h ALA 377 Ca 0.41 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.15 3mi0 h ALA 377 Cb 0.07 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3mi0 h ALA 377 CO -0.14 0.60 -0.31 0.78 0.00 0.00 0.00 179.25 180.18 3mi0 h GLY 378 N 1.29 0.59 1.00 0.00 0.00 -1.50 -1.84 103.07 102.62 3mi0 h GLY 378 Ca 0.38 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 47.15 3mi0 h GLY 378 CO -0.10 0.48 0.28 0.50 0.00 0.00 0.00 176.54 177.70 3mi0 h LYS 379 N 0.47 0.90 -0.33 4.80 1.57 -0.54 -1.39 116.57 122.06 3mi0 h LYS 379 Ca 0.06 -0.14 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3mi0 h LYS 379 Cb 0.77 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 3mi0 h LYS 379 CO 0.06 0.74 0.20 0.82 -0.57 0.00 0.00 179.45 180.70 3mi0 h ILE 380 N 0.86 1.11 -0.83 1.86 2.04 -0.94 -2.26 117.51 119.33 3mi0 h ILE 380 Ca 0.21 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 3mi0 h ILE 380 Cb 0.14 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 3mi0 h ILE 380 CO -0.02 0.11 0.46 -1.13 0.00 0.00 0.00 178.15 177.56 3mi0 h ASN 381 N 0.43 1.04 -0.68 1.72 -1.24 -0.97 -0.43 115.58 115.44 3mi0 h ASN 381 Ca 0.12 -0.10 -0.06 0.00 0.71 0.00 0.00 56.30 56.98 3mi0 h ASN 381 Cb -0.00 -0.26 -0.03 0.00 0.73 0.00 0.00 38.32 38.76 3mi0 h ASN 381 CO -0.02 0.84 0.21 0.03 -1.29 0.00 0.00 177.43 177.19 3mi0 h ARG 382 N 1.16 1.07 -0.47 6.67 2.47 -1.02 -0.74 114.38 123.53 3mi0 h ARG 382 Ca 0.29 -0.23 -0.12 0.00 -1.26 0.00 0.00 59.98 58.66 3mi0 h ARG 382 Cb 0.02 -0.15 -0.01 0.00 -1.65 0.00 0.00 29.97 28.18 3mi0 h ARG 382 CO -0.05 0.93 -0.19 1.25 0.56 0.00 0.00 179.97 182.47 3mi0 h LEU 383 N 1.00 0.94 -0.74 3.04 5.85 -1.01 -1.61 115.31 122.78 3mi0 h LEU 383 Ca 0.22 -0.34 -0.04 0.00 0.84 0.00 0.00 57.88 58.56 3mi0 h LEU 383 Cb 0.31 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 3mi0 h LEU 383 CO -0.01 1.10 0.30 0.00 -0.34 0.00 0.00 178.44 179.50 3mi0 h ALA 384 N 0.97 0.96 -0.53 1.25 0.00 -0.78 -0.73 119.26 120.40 3mi0 h ALA 384 Ca 0.11 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 3mi0 h ALA 384 Cb 0.74 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3mi0 h ALA 384 CO 0.06 0.58 0.01 0.82 0.00 0.00 0.00 179.25 180.72 3mi0 h ILE 385 N 1.07 1.26 -0.59 0.00 2.04 -0.95 -0.31 117.51 120.03 3mi0 h ILE 385 Ca 0.25 -1.09 0.00 0.00 1.00 0.00 0.00 64.86 65.02 3mi0 h ILE 385 Cb 0.20 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 3mi0 h ILE 385 CO -0.02 0.39 0.37 -0.03 0.00 0.00 0.00 178.15 178.85 3mi0 h MET 386 N 0.80 0.80 -0.19 2.37 4.05 -0.83 0.03 114.93 121.96 3mi0 h MET 386 Ca 0.15 -0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 59.50 3mi0 h MET 386 Cb 0.52 -0.17 -0.01 0.00 -0.80 0.00 0.00 31.60 31.14 3mi0 h MET 386 CO 0.03 0.56 0.08 0.28 0.23 0.00 0.00 176.91 178.08 3mi0 h VAL 387 N 0.80 1.15 -0.75 -5.77 2.07 -0.82 -2.56 116.25 110.37 3mi0 h VAL 387 Ca 0.21 -0.44 0.11 0.00 0.82 0.00 0.00 66.70 67.40 3mi0 h VAL 387 Cb -0.05 1.10 -0.08 0.00 -1.52 0.00 0.00 31.29 30.74 3mi0 h VAL 387 CO -0.04 0.14 0.37 -0.09 0.02 0.00 0.00 177.57 177.98 3mi0 h ARG 388 N 0.16 0.59 -0.02 1.57 9.65 -0.75 -0.05 114.38 125.54 3mi0 h ARG 388 Ca 0.06 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.91 3mi0 h ARG 388 Cb 0.15 -0.13 -0.00 0.00 -1.39 0.00 0.00 29.97 28.60 3mi0 h ARG 388 CO -0.01 0.39 0.11 0.78 2.80 0.00 0.00 179.97 184.05 3mi0 h GLY 389 N 0.61 0.00 -1.80 2.80 0.00 -0.57 -1.08 103.07 103.04 3mi0 h GLY 389 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 3mi0 h GLY 389 CO -0.29 0.00 0.00 -2.01 0.00 0.00 0.00 176.54 174.24 3mi0 n ASN 390 N -3.12 2.86 -0.20 0.19 5.15 -0.04 -4.59 115.26 115.52 3mi0 n ASN 390 Ca -0.02 -1.90 -0.00 0.00 -0.60 0.00 0.00 54.58 52.05 3mi0 n ASN 390 Cb 0.18 -0.15 0.10 0.00 -0.53 0.00 0.00 39.78 39.39 3mi0 n ASN 390 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 3mi0 h LEU 391 N 3.91 0.18 0.75 1.20 5.85 -1.13 0.64 115.31 126.71 3mi0 h LEU 391 Ca 0.00 0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.77 3mi0 h LEU 391 Cb 0.85 0.07 0.01 0.00 0.37 0.00 0.00 40.66 41.96 3mi0 h LEU 391 CO 0.00 0.11 -0.36 0.00 -0.34 0.00 0.00 178.44 177.85 3mi0 h ALA 392 N 1.42 -1.01 -0.97 1.25 0.00 -1.82 -1.42 119.26 116.70 3mi0 h ALA 392 Ca 0.30 -0.22 0.18 0.00 0.00 0.00 0.00 54.91 55.17 3mi0 h ALA 392 Cb 0.38 0.40 -0.09 0.00 0.00 0.00 0.00 17.79 18.48 3mi0 h ALA 392 CO -0.32 -1.07 0.61 0.00 0.00 0.00 0.00 179.25 178.47 3mi0 h ALA 393 N -0.75 1.81 -0.43 0.00 0.00 -1.83 -0.88 119.26 117.17 3mi0 h ALA 393 Ca -0.10 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 3mi0 h ALA 393 Cb 0.78 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 3mi0 h ALA 393 CO 0.17 -0.14 -0.13 0.00 0.00 0.00 0.00 179.25 179.15 3mi0 h ALA 394 N 1.62 0.97 0.00 0.00 0.00 -0.57 -0.70 119.26 120.57 3mi0 h ALA 394 Ca 0.53 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3mi0 h ALA 394 Cb 0.91 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.53 3mi0 h ALA 394 CO -0.30 0.61 0.00 -1.33 0.00 0.00 0.00 179.25 178.23 3mi0 n MET 395 N -4.15 0.14 -0.91 0.00 2.81 -0.36 -1.60 117.12 113.05 3mi0 n MET 395 Ca 0.01 0.41 -0.06 0.00 -1.81 0.00 0.00 57.70 56.25 3mi0 n MET 395 Cb 0.38 -1.78 0.26 0.00 -0.71 0.00 0.00 33.22 31.36 3mi0 n MET 395 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 3mi0 n GLN 396 N -2.05 2.94 -0.74 0.03 6.02 -0.53 -4.93 117.38 118.12 3mi0 n GLN 396 Ca 0.02 -3.06 0.00 0.00 -0.01 0.00 0.00 57.00 53.95 3mi0 n GLN 396 Cb 0.19 -2.06 0.00 0.00 1.02 0.00 0.00 30.24 29.39 3mi0 n GLN 396 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3mi0 n GLY 397 N -0.59 0.66 1.62 1.08 0.00 -0.63 -4.95 105.19 102.38 3mi0 n GLY 397 Ca 0.39 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.48 3mi0 n GLY 397 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mi0 n LEU 398 N 0.00 5.25 -4.75 0.99 4.32 -0.38 -4.90 117.00 117.53 3mi0 n LEU 398 Ca 0.00 -2.97 -0.41 0.00 -0.02 0.00 0.00 56.01 52.60 3mi0 n LEU 398 Cb 0.00 -0.65 -0.02 0.00 -1.62 0.00 0.00 43.42 41.13 3mi0 n LEU 398 CO 0.00 0.65 1.16 -0.22 -1.22 0.00 0.00 177.39 177.76 3mi0 s LEU 399 N -2.80 4.36 -0.00 2.23 2.96 -1.25 -4.47 118.68 119.70 3mi0 s LEU 399 Ca 0.51 2.83 0.00 0.00 -0.22 0.00 0.00 54.13 57.25 3mi0 s LEU 399 Cb 0.40 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 43.46 3mi0 s LEU 399 CO 0.14 -0.80 -0.00 0.00 -1.32 0.00 0.00 176.35 174.36 3mi0 s ALA 400 N -0.17 0.06 -0.10 5.97 0.00 -1.26 -0.72 121.76 125.55 3mi0 s ALA 400 Ca 0.60 0.00 0.02 0.00 0.00 0.00 0.00 51.96 52.58 3mi0 s ALA 400 Cb -0.45 -0.04 0.02 0.00 0.00 0.00 0.00 23.12 22.65 3mi0 s ALA 400 CO 0.48 0.00 -0.14 -0.51 0.00 0.00 0.00 175.76 175.59 3mi0 s LEU 401 N 0.09 1.63 0.35 0.00 1.43 -0.18 -4.91 118.68 117.10 3mi0 s LEU 401 Ca -0.01 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.71 3mi0 s LEU 401 Cb -0.02 -1.00 -0.03 0.00 0.03 0.00 0.00 46.19 45.17 3mi0 s LEU 401 CO -0.00 0.00 0.56 -2.16 0.23 0.00 0.00 176.35 174.97 3mi0 s PRO 402 N 1.02 3.49 -0.08 1.29 0.04 -1.26 -1.50 135.00 138.00 3mi0 s PRO 402 Ca -0.07 -0.31 0.02 0.00 0.04 0.00 0.00 61.00 60.69 3mi0 s PRO 402 Cb -0.15 -2.65 0.01 0.00 0.04 0.00 0.00 34.50 31.75 3mi0 s PRO 402 CO -0.02 0.14 -0.13 -1.17 0.04 0.00 0.00 177.00 175.86 3mi0 s LEU 403 N -4.32 1.65 -0.09 -3.56 2.96 0.37 -3.69 118.68 112.01 3mi0 s LEU 403 Ca 0.40 -0.33 0.00 0.00 -0.22 0.00 0.00 54.13 53.98 3mi0 s LEU 403 Cb -0.10 -0.90 -0.03 0.00 0.50 0.00 0.00 46.19 45.67 3mi0 s LEU 403 CO 0.36 0.03 -0.09 -0.22 -1.32 0.00 0.00 176.35 175.11 3mi0 s LEU 404 N 0.76 2.99 -0.00 -0.68 2.96 -0.20 -1.27 118.68 123.25 3mi0 s LEU 404 Ca -0.12 -0.14 0.05 0.00 -0.22 0.00 0.00 54.13 53.69 3mi0 s LEU 404 Cb -0.16 -1.66 -0.01 0.00 0.50 0.00 0.00 46.19 44.86 3mi0 s LEU 404 CO 0.03 0.28 -0.15 0.00 -1.32 0.00 0.00 176.35 175.19 3mi0 s ALA 405 N -0.34 1.23 0.33 5.97 0.00 -0.14 -0.41 121.76 128.41 3mi0 s ALA 405 Ca 0.04 -0.67 -0.16 0.00 0.00 0.00 0.00 51.96 51.17 3mi0 s ALA 405 Cb -0.13 -0.30 0.03 0.00 0.00 0.00 0.00 23.12 22.73 3mi0 s ALA 405 CO 0.02 0.29 0.71 0.20 0.00 0.00 0.00 175.76 176.98 3mi0 s GLY 406 N -0.48 0.34 -0.10 0.00 0.00 0.39 -0.37 107.32 107.10 3mi0 s GLY 406 Ca 0.05 -0.69 0.01 0.00 0.00 0.00 0.00 44.72 44.09 3mi0 s GLY 406 CO -0.00 -0.34 -0.14 -0.47 0.00 0.00 0.00 173.10 172.15 3mi0 s TYR 407 N -3.08 1.84 -0.49 1.90 5.04 -0.48 0.57 117.35 122.65 3mi0 s TYR 407 Ca 0.16 -0.86 -0.19 0.00 -2.44 0.00 0.00 57.07 53.74 3mi0 s TYR 407 Cb -0.05 -1.35 0.05 0.00 0.35 0.00 0.00 41.96 40.96 3mi0 s TYR 407 CO 0.11 -0.46 0.62 0.34 -1.34 0.00 0.00 175.55 174.82 3mi0 s ASP 408 N 1.04 6.24 0.54 4.32 -1.08 -0.05 -4.86 116.67 122.82 3mi0 s ASP 408 Ca -0.06 -0.81 0.24 0.00 -0.52 0.00 0.00 52.55 51.40 3mi0 s ASP 408 Cb -0.15 -2.29 1.52 0.00 -1.46 0.00 0.00 42.92 40.54 3mi0 s ASP 408 CO -0.02 -0.87 2.17 0.16 0.52 0.00 0.00 175.17 177.13 3mi0 h ILE 409 N 5.86 0.73 -0.09 4.11 3.07 -1.97 -2.19 117.51 127.03 3mi0 h ILE 409 Ca -0.27 -0.18 0.00 0.00 1.55 0.00 0.00 64.86 65.96 3mi0 h ILE 409 Cb 1.10 1.11 0.00 0.00 -0.27 0.00 0.00 36.82 38.75 3mi0 h ILE 409 CO 0.95 0.04 0.00 1.41 -1.05 0.00 0.00 178.15 179.50 3mi0 n HIS 410 N -4.04 0.10 -2.18 0.16 8.25 -1.26 -4.93 115.22 111.33 3mi0 n HIS 410 Ca -0.03 -0.05 -0.36 0.00 -0.26 0.00 0.00 57.72 57.02 3mi0 n HIS 410 Cb 0.13 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.25 3mi0 n HIS 410 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3mi0 s ALA 411 N -1.90 2.82 0.05 -1.41 0.00 -0.83 -4.95 121.76 115.54 3mi0 s ALA 411 Ca 0.35 0.95 -0.30 0.00 0.00 0.00 0.00 51.96 52.97 3mi0 s ALA 411 Cb 0.19 -3.40 -0.18 0.00 0.00 0.00 0.00 23.12 19.73 3mi0 s ALA 411 CO 0.30 -0.83 1.46 0.66 0.00 0.00 0.00 175.76 177.36 3mi0 h SER 412 N 1.59 -0.68 -3.42 0.00 4.64 -1.91 -3.40 113.55 110.36 3mi0 h SER 412 Ca -0.50 -0.02 -0.71 0.00 -0.47 0.00 0.00 61.79 60.09 3mi0 h SER 412 Cb 1.26 0.18 -0.20 0.00 -0.31 0.00 0.00 62.40 63.33 3mi0 h SER 412 CO 0.58 -0.41 -0.28 -0.62 -0.87 0.00 0.00 176.83 175.24 3mi0 s ASP 413 N -4.55 6.16 0.33 4.97 2.15 -1.26 -4.97 116.67 119.50 3mi0 s ASP 413 Ca -0.16 -0.96 0.09 0.00 0.43 0.00 0.00 52.55 51.94 3mi0 s ASP 413 Cb 0.03 -2.20 0.81 0.00 -0.30 0.00 0.00 42.92 41.26 3mi0 s ASP 413 CO 0.57 -0.60 1.81 -0.65 -0.17 0.00 0.00 175.17 176.13 3mi0 h PRO 414 N 8.74 0.68 0.00 4.34 0.11 -1.95 -1.88 132.00 142.04 3mi0 h PRO 414 Ca -0.27 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.76 3mi0 h PRO 414 Cb 1.11 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 3mi0 h PRO 414 CO 0.82 0.45 -0.17 1.96 -0.21 0.00 0.00 178.00 180.85 3mi0 h GLN 415 N 0.70 0.00 -0.23 1.05 1.08 -1.93 -2.91 115.11 112.87 3mi0 h GLN 415 Ca 0.53 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.73 3mi0 h GLN 415 Cb 0.91 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.34 3mi0 h GLN 415 CO -0.30 0.17 0.00 -1.13 -0.95 0.00 0.00 178.83 176.61 3mi0 n SER 416 N -3.96 3.06 0.00 1.46 3.41 -0.75 -0.38 113.62 116.46 3mi0 n SER 416 Ca -0.02 -2.48 0.05 0.00 -0.26 0.00 0.00 58.87 56.16 3mi0 n SER 416 Cb 0.25 -0.33 0.27 0.00 -0.26 0.00 0.00 64.21 64.15 3mi0 n SER 416 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mi0 n ALA 417 N -0.22 1.67 -1.77 7.33 0.00 -0.92 -4.76 120.51 121.84 3mi0 n ALA 417 Ca 0.14 -0.05 -0.39 0.00 0.00 0.00 0.00 53.44 53.14 3mi0 n ALA 417 Cb 0.59 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.86 3mi0 n ALA 417 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3mi0 s GLY 418 N -2.60 2.91 -0.01 0.00 0.00 -1.26 -0.87 107.32 105.49 3mi0 s GLY 418 Ca 0.10 1.26 0.02 0.00 0.00 0.00 0.00 44.72 46.10 3mi0 s GLY 418 CO 0.17 1.83 -0.05 0.50 0.00 0.00 0.00 173.10 175.55 3mi0 s ARG 419 N -2.38 0.50 -0.07 2.90 1.81 0.19 -4.90 118.95 117.00 3mi0 s ARG 419 Ca 0.60 -0.18 0.01 0.00 -1.72 0.00 0.00 55.73 54.44 3mi0 s ARG 419 Cb -0.39 -0.49 0.02 0.00 -0.45 0.00 0.00 34.95 33.64 3mi0 s ARG 419 CO 0.49 0.09 -0.08 0.42 -0.68 0.00 0.00 175.30 175.54 3mi0 s ILE 420 N 0.04 0.89 -0.05 1.52 1.01 -1.26 -0.46 121.20 122.88 3mi0 s ILE 420 Ca -0.00 -0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.37 3mi0 s ILE 420 Cb -0.04 -0.86 0.02 0.00 0.01 0.00 0.00 42.46 41.58 3mi0 s ILE 420 CO -0.00 0.31 -0.07 -0.69 0.00 0.00 0.00 174.94 174.49 3mi0 s VAL 421 N 1.03 0.76 0.26 2.92 1.01 0.46 0.41 120.40 127.24 3mi0 s VAL 421 Ca -0.08 -0.25 0.07 0.00 0.00 0.00 0.00 61.98 61.72 3mi0 s VAL 421 Cb -0.14 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.45 3mi0 s VAL 421 CO -0.00 0.28 0.20 -0.94 0.00 0.00 0.00 175.10 174.63 3mi0 s SER 422 N 0.89 5.48 0.03 3.32 1.04 -0.57 -1.03 113.70 122.85 3mi0 s SER 422 Ca -0.11 -0.28 0.02 0.00 0.48 0.00 0.00 55.95 56.07 3mi0 s SER 422 Cb -0.15 -1.37 -0.02 0.00 0.10 0.00 0.00 66.02 64.59 3mi0 s SER 422 CO 0.01 -0.05 -0.08 -0.36 0.98 0.00 0.00 173.24 173.74 3mi0 s PHE 423 N -2.15 0.66 0.48 5.02 0.08 -1.24 -1.47 117.98 119.36 3mi0 s PHE 423 Ca 0.33 -0.34 0.07 0.00 0.12 0.00 0.00 56.93 57.12 3mi0 s PHE 423 Cb -0.08 -0.40 0.02 0.00 -0.57 0.00 0.00 43.02 41.99 3mi0 s PHE 423 CO 0.25 -0.04 0.48 0.16 -0.10 0.00 0.00 175.22 175.97 3mi0 s ASP 424 N -1.01 4.99 0.63 1.36 1.47 -0.19 -4.75 116.67 119.17 3mi0 s ASP 424 Ca -0.04 -0.88 0.36 0.00 1.18 0.00 0.00 52.55 53.16 3mi0 s ASP 424 Cb -0.07 -0.13 2.06 0.00 -0.34 0.00 0.00 42.92 44.44 3mi0 s ASP 424 CO 0.00 -0.92 2.28 0.00 0.68 0.00 0.00 175.17 177.21 3mi0 h ALA 425 N 0.75 1.33 -0.07 2.11 0.00 -1.91 -1.39 119.26 120.08 3mi0 h ALA 425 Ca -0.38 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3mi0 h ALA 425 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3mi0 h ALA 425 CO 0.53 -0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.74 3mi0 n ALA 426 N -2.20 2.53 -0.18 0.00 0.00 -1.26 -4.47 120.51 114.93 3mi0 n ALA 426 Ca -0.02 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.87 3mi0 n ALA 426 Cb 0.11 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.50 3mi0 n ALA 426 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mi0 n GLY 427 N 1.22 0.78 3.76 0.00 0.00 -0.52 -4.40 105.19 106.03 3mi0 n GLY 427 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 3mi0 n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3mi0 s GLY 428 N -1.66 3.02 0.21 -0.02 0.00 -1.26 -4.75 107.32 102.86 3mi0 s GLY 428 Ca 0.00 0.97 0.08 0.00 0.00 0.00 0.00 44.72 45.77 3mi0 s GLY 428 CO 0.00 1.57 -0.15 0.66 0.00 0.00 0.00 173.10 175.18 3mi0 s TRP 429 N -1.21 1.73 -0.12 1.90 1.48 -1.26 -1.02 118.94 120.45 3mi0 s TRP 429 Ca 0.47 -0.56 -0.05 0.00 -1.06 0.00 0.00 56.10 54.90 3mi0 s TRP 429 Cb -0.33 -0.80 0.06 0.00 -1.16 0.00 0.00 33.47 31.24 3mi0 s TRP 429 CO 0.43 0.37 0.25 1.21 -4.06 0.00 0.00 176.95 175.15 3mi0 s ASN 430 N -3.32 0.25 -0.20 -2.66 2.47 -0.54 -4.98 114.94 105.95 3mi0 s ASN 430 Ca 0.23 0.55 -0.29 0.00 0.42 0.00 0.00 52.86 53.77 3mi0 s ASN 430 Cb -0.01 0.59 -0.01 0.00 -1.45 0.00 0.00 41.25 40.37 3mi0 s ASN 430 CO 0.07 -0.22 1.26 -0.63 -3.72 0.00 0.00 177.10 173.86 3mi0 s ILE 431 N 2.14 4.26 0.19 -5.21 1.01 -1.26 -1.52 121.20 120.81 3mi0 s ILE 431 Ca -0.01 1.50 -0.30 0.00 0.00 0.00 0.00 60.65 61.84 3mi0 s ILE 431 Cb -0.12 -4.05 -0.08 0.00 0.01 0.00 0.00 42.46 38.22 3mi0 s ILE 431 CO -0.08 -0.23 1.17 -0.70 0.00 0.00 0.00 174.94 175.10 3mi0 s GLU 432 N 3.67 4.52 -0.02 2.79 2.56 0.16 -4.95 118.70 127.44 3mi0 s GLU 432 Ca 0.55 1.84 0.02 0.00 0.00 0.00 0.00 54.97 57.38 3mi0 s GLU 432 Cb -0.20 -3.24 0.04 0.00 2.00 0.00 0.00 34.13 32.72 3mi0 s GLU 432 CO 0.16 -0.04 0.93 -0.85 -0.56 0.00 0.00 175.26 174.91 3mi0 n GLU 433 N 2.38 2.18 -0.03 4.30 0.28 -1.26 -4.62 120.64 123.87 3mi0 n GLU 433 Ca 0.04 -1.45 0.13 0.00 -0.16 0.00 0.00 57.16 55.71 3mi0 n GLU 433 Cb 0.45 -0.96 0.41 0.00 1.43 0.00 0.00 31.44 32.77 3mi0 n GLU 433 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3mi0 n GLU 434 N -0.52 1.83 0.00 3.44 -0.58 -1.26 -4.97 120.64 118.58 3mi0 n GLU 434 Ca 0.02 -1.22 0.00 0.00 -0.42 0.00 0.00 57.16 55.54 3mi0 n GLU 434 Cb 0.36 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.77 3mi0 n GLU 434 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3mi0 n GLY 435 N 1.21 3.24 3.50 0.62 0.00 -1.26 -5.03 105.19 107.47 3mi0 n GLY 435 Ca 0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 3mi0 n GLY 435 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3mi0 s TYR 436 N -2.97 -0.02 0.22 1.61 -0.85 -1.26 -0.47 117.35 113.61 3mi0 s TYR 436 Ca 0.00 -0.33 -0.22 0.00 -0.52 0.00 0.00 57.07 56.00 3mi0 s TYR 436 Cb 0.00 0.32 0.05 0.00 0.38 0.00 0.00 41.96 42.71 3mi0 s TYR 436 CO 0.00 -0.90 0.66 -1.14 -1.52 0.00 0.00 175.55 172.65 3mi0 s GLN 437 N -3.90 1.52 0.00 -3.49 2.00 -0.43 -4.95 119.66 110.41 3mi0 s GLN 437 Ca 0.11 -0.71 -0.23 0.00 -2.00 0.00 0.00 55.36 52.52 3mi0 s GLN 437 Cb -0.00 0.60 0.05 0.00 0.80 0.00 0.00 33.01 34.45 3mi0 s GLN 437 CO -0.02 -0.68 0.52 0.00 -0.50 0.00 0.00 175.29 174.61 3mi0 s ALA 438 N -3.83 -1.33 0.06 1.58 0.00 -1.26 -1.16 121.76 115.83 3mi0 s ALA 438 Ca 0.06 0.74 0.02 0.00 0.00 0.00 0.00 51.96 52.78 3mi0 s ALA 438 Cb -0.03 0.20 -0.03 0.00 0.00 0.00 0.00 23.12 23.26 3mi0 s ALA 438 CO -0.04 -0.41 -0.08 0.14 0.00 0.00 0.00 175.76 175.38 3mi0 s VAL 439 N -1.83 0.60 0.00 0.00 -7.23 -0.56 -4.88 120.40 106.50 3mi0 s VAL 439 Ca -0.09 -1.34 0.00 0.00 -1.81 0.00 0.00 61.98 58.74 3mi0 s VAL 439 Cb -0.01 -0.94 0.00 0.00 0.56 0.00 0.00 36.38 35.98 3mi0 s VAL 439 CO 0.03 -0.52 0.00 0.61 -0.31 0.00 0.00 175.10 174.91 3mi0 n GLY 440 N 1.01 1.70 0.30 2.32 0.00 -1.26 -1.32 105.19 107.94 3mi0 n GLY 440 Ca -0.20 -2.19 0.20 0.00 0.00 0.00 0.00 46.02 43.83 3mi0 n GLY 440 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3mi0 h SER 441 N 0.00 0.00 -0.55 1.61 4.64 -1.69 -1.40 113.55 116.16 3mi0 h SER 441 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3mi0 h SER 441 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3mi0 h SER 441 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3mi0 n GLY 442 N -0.79 2.91 0.26 -0.77 0.00 -0.94 -4.67 105.19 101.19 3mi0 n GLY 442 Ca -0.02 -0.78 -0.01 0.00 0.00 0.00 0.00 46.02 45.21 3mi0 n GLY 442 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3mi0 h SER 443 N 3.41 0.49 -0.35 1.61 4.64 -1.48 -1.77 113.55 120.09 3mi0 h SER 443 Ca 0.00 -0.11 -0.13 0.00 -0.47 0.00 0.00 61.79 61.08 3mi0 h SER 443 Cb 1.27 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 3mi0 h SER 443 CO 0.16 0.61 -0.28 -0.07 -0.87 0.00 0.00 176.83 176.38 3mi0 h LEU 444 N 0.49 0.90 -0.68 5.97 4.07 -1.83 -0.28 115.31 123.95 3mi0 h LEU 444 Ca 0.10 -0.36 -0.11 0.00 0.08 0.00 0.00 57.88 57.58 3mi0 h LEU 444 Cb 0.42 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.89 3mi0 h LEU 444 CO 0.02 1.12 -0.19 -0.26 -1.08 0.00 0.00 178.44 178.05 3mi0 h PHE 445 N 0.74 0.93 -0.41 1.13 0.04 -1.82 -1.75 116.94 115.80 3mi0 h PHE 445 Ca 0.09 -0.20 -0.07 0.00 2.80 0.00 0.00 57.97 60.58 3mi0 h PHE 445 Cb 0.83 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.74 3mi0 h PHE 445 CO 0.05 0.94 -0.01 0.00 -0.60 0.00 0.00 178.31 178.69 3mi0 h ALA 446 N 1.06 0.56 -0.38 2.45 0.00 -1.10 -1.63 119.26 120.21 3mi0 h ALA 446 Ca 0.11 -0.27 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 3mi0 h ALA 446 Cb 0.71 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3mi0 h ALA 446 CO 0.05 0.35 -0.28 0.87 0.00 0.00 0.00 179.25 180.24 3mi0 h LYS 447 N 0.56 0.80 -0.01 0.00 1.57 -0.99 0.56 116.57 119.07 3mi0 h LYS 447 Ca 0.12 -0.36 -0.10 0.00 -1.87 0.00 0.00 60.65 58.44 3mi0 h LYS 447 Cb 0.50 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 3mi0 h LYS 447 CO 0.02 0.99 -0.47 0.77 -0.57 0.00 0.00 179.45 180.19 3mi0 h SER 448 N 0.69 0.02 0.01 0.86 0.02 -1.22 0.20 113.55 114.13 3mi0 h SER 448 Ca 0.08 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 3mi0 h SER 448 Cb 0.82 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.35 3mi0 h SER 448 CO 0.07 0.49 -0.01 -1.28 -1.14 0.00 0.00 176.83 174.96 3mi0 h SER 449 N 0.02 -0.01 -0.26 3.07 0.87 -0.97 -3.17 113.55 113.08 3mi0 h SER 449 Ca -0.00 -0.52 0.00 0.00 -1.23 0.00 0.00 61.79 60.04 3mi0 h SER 449 Cb 0.84 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.79 3mi0 h SER 449 CO 0.06 0.52 0.17 0.24 -0.53 0.00 0.00 176.83 177.29 3mi0 h MET 450 N -0.55 0.36 -0.88 2.24 2.07 -0.65 -1.27 114.93 116.25 3mi0 h MET 450 Ca -0.00 -0.02 0.07 0.00 -2.07 0.00 0.00 59.70 57.68 3mi0 h MET 450 Cb 0.53 -0.08 -0.06 0.00 -1.87 0.00 0.00 31.60 30.12 3mi0 h MET 450 CO 0.00 0.25 0.57 -0.22 1.07 0.00 0.00 176.91 178.58 3mi0 h LYS 451 N 0.37 0.93 0.00 1.72 3.64 -0.94 0.41 116.57 122.70 3mi0 h LYS 451 Ca 0.10 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 3mi0 h LYS 451 Cb -0.02 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.58 3mi0 h LYS 451 CO -0.02 0.61 -0.82 0.87 -2.27 0.00 0.00 179.45 177.82 3mi0 h LYS 452 N 0.96 0.00 0.00 1.90 1.79 -1.26 -3.38 116.57 116.58 3mi0 h LYS 452 Ca 0.39 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.86 3mi0 h LYS 452 Cb 0.26 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 3mi0 h LYS 452 CO -0.15 0.14 -1.60 1.28 -1.08 0.00 0.00 179.45 178.03 3mi0 n LEU 453 N -2.89 0.39 -0.09 2.94 4.77 -0.68 -4.60 117.00 116.85 3mi0 n LEU 453 Ca -0.01 -0.20 0.17 0.00 -0.03 0.00 0.00 56.01 55.94 3mi0 n LEU 453 Cb 0.64 0.00 0.58 0.00 -2.33 0.00 0.00 43.42 42.31 3mi0 n LEU 453 CO 0.40 0.10 1.20 0.22 -1.33 0.00 0.00 177.39 177.97 3mi0 h TYR 454 N 0.00 0.28 0.00 -1.77 3.20 -0.39 0.44 116.97 118.72 3mi0 h TYR 454 Ca 0.00 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 3mi0 h TYR 454 Cb 0.80 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.98 3mi0 h TYR 454 CO 0.00 0.11 0.00 -1.13 -1.64 0.00 0.00 178.16 175.50 3mi0 n SER 455 N -4.43 0.38 -0.07 -2.11 3.41 -1.26 -1.23 113.62 108.30 3mi0 n SER 455 Ca 0.12 0.64 0.13 0.00 -0.26 0.00 0.00 58.87 59.50 3mi0 n SER 455 Cb 0.55 -0.70 0.43 0.00 -0.26 0.00 0.00 64.21 64.22 3mi0 n SER 455 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mi0 n GLN 456 N -1.97 0.31 -2.60 4.33 6.02 0.15 -4.81 117.38 118.82 3mi0 n GLN 456 Ca 0.01 -0.14 -0.43 0.00 -0.01 0.00 0.00 57.00 56.42 3mi0 n GLN 456 Cb 0.11 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.85 3mi0 n GLN 456 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3mi0 s VAL 457 N -2.78 4.29 0.00 5.09 1.01 -0.37 -4.79 120.40 122.85 3mi0 s VAL 457 Ca 0.18 1.39 0.00 0.00 0.00 0.00 0.00 61.98 63.55 3mi0 s VAL 457 Cb 0.19 -4.53 0.00 0.00 0.00 0.00 0.00 36.38 32.04 3mi0 s VAL 457 CO 0.58 -0.82 0.10 0.35 0.00 0.00 0.00 175.10 175.31 3mi0 n THR 458 N 6.52 0.00 -3.55 3.92 -2.24 -1.26 -4.81 114.28 112.86 3mi0 n THR 458 Ca 0.12 -0.43 -0.02 0.00 -2.27 0.00 0.00 64.05 61.45 3mi0 n THR 458 Cb 0.48 1.03 0.01 0.00 -2.10 0.00 0.00 70.33 69.75 3mi0 n THR 458 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3mi0 n ASP 459 N -0.67 -0.89 -0.26 3.42 5.68 -1.26 -4.60 116.55 117.98 3mi0 n ASP 459 Ca 0.00 -1.53 -0.05 0.00 -0.50 0.00 0.00 54.79 52.71 3mi0 n ASP 459 Cb 0.01 1.46 0.06 0.00 -1.14 0.00 0.00 41.12 41.50 3mi0 n ASP 459 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 3mi0 h GLY 460 N 0.91 1.07 1.10 6.12 0.00 -1.94 -0.45 103.07 109.87 3mi0 h GLY 460 Ca -0.14 -0.46 -0.17 0.00 0.00 0.00 0.00 47.33 46.56 3mi0 h GLY 460 CO 0.18 0.45 -0.47 -1.80 0.00 0.00 0.00 176.54 174.89 3mi0 h ASP 461 N 1.00 0.93 0.31 0.19 3.58 -1.99 0.06 116.42 120.49 3mi0 h ASP 461 Ca 0.26 -0.52 -0.11 0.00 0.42 0.00 0.00 57.03 57.08 3mi0 h ASP 461 Cb -0.00 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 40.77 3mi0 h ASP 461 CO -0.05 1.27 -0.46 0.77 -2.88 0.00 0.00 179.24 177.89 3mi0 h SER 462 N 0.63 0.21 -0.38 2.28 4.64 -1.89 -1.85 113.55 117.18 3mi0 h SER 462 Ca 0.03 -0.09 -0.04 0.00 -0.47 0.00 0.00 61.79 61.22 3mi0 h SER 462 Cb 1.08 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 63.09 3mi0 h SER 462 CO 0.11 0.64 0.09 1.23 -0.87 0.00 0.00 176.83 178.04 3mi0 h GLY 463 N 1.32 0.66 0.92 -0.77 0.00 -0.88 -0.78 103.07 103.53 3mi0 h GLY 463 Ca 0.01 -0.41 0.02 0.00 0.00 0.00 0.00 47.33 46.95 3mi0 h GLY 463 CO 0.07 0.38 0.33 -2.00 0.00 0.00 0.00 176.54 175.32 3mi0 h LEU 464 N 0.47 0.54 -0.32 3.11 5.85 -0.81 -0.58 115.31 123.57 3mi0 h LEU 464 Ca 0.12 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 3mi0 h LEU 464 Cb 0.30 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 3mi0 h LEU 464 CO 0.00 0.39 0.19 -0.09 -0.34 0.00 0.00 178.44 178.58 3mi0 h ARG 465 N 0.66 0.44 -0.70 1.25 2.43 -0.99 0.04 114.38 117.51 3mi0 h ARG 465 Ca 0.21 -0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.27 3mi0 h ARG 465 Cb -0.01 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.42 3mi0 h ARG 465 CO -0.08 0.36 0.19 0.28 -1.51 0.00 0.00 179.97 179.21 3mi0 h VAL 466 N 0.41 1.26 -0.77 0.20 2.07 -0.87 0.12 116.25 118.66 3mi0 h VAL 466 Ca 0.11 -0.93 -0.02 0.00 0.82 0.00 0.00 66.70 66.69 3mi0 h VAL 466 Cb 0.03 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.28 3mi0 h VAL 466 CO -0.02 0.36 0.41 0.00 0.02 0.00 0.00 177.57 178.34 3mi0 h ALA 467 N 1.15 0.98 -0.39 1.67 0.00 -0.58 0.23 119.26 122.33 3mi0 h ALA 467 Ca 0.22 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 3mi0 h ALA 467 Cb 0.33 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3mi0 h ALA 467 CO -0.00 0.50 -0.28 0.28 0.00 0.00 0.00 179.25 179.74 3mi0 h VAL 468 N 1.06 1.28 -0.26 0.00 2.07 -0.51 -1.55 116.25 118.33 3mi0 h VAL 468 Ca 0.27 -1.43 -0.11 0.00 0.82 0.00 0.00 66.70 66.25 3mi0 h VAL 468 Cb 0.04 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 3mi0 h VAL 468 CO -0.04 0.48 -0.29 -0.08 0.02 0.00 0.00 177.57 177.65 3mi0 h GLU 469 N 0.71 0.54 -0.61 1.57 4.81 -0.34 -0.30 114.58 120.95 3mi0 h GLU 469 Ca 0.08 -0.22 -0.05 0.00 -0.13 0.00 0.00 59.36 59.04 3mi0 h GLU 469 Cb 0.83 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.16 3mi0 h GLU 469 CO 0.07 0.77 0.20 0.00 -0.73 0.00 0.00 179.01 179.32 3mi0 h ALA 470 N 1.22 0.79 -0.45 2.92 0.00 -0.61 -0.16 119.26 122.96 3mi0 h ALA 470 Ca 0.06 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 3mi0 h ALA 470 Cb 0.74 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 3mi0 h ALA 470 CO 0.06 0.45 0.01 -0.07 0.00 0.00 0.00 179.25 179.69 3mi0 h LEU 471 N 0.86 0.71 -0.21 0.00 3.38 -0.92 -0.14 115.31 118.99 3mi0 h LEU 471 Ca 0.20 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3mi0 h LEU 471 Cb 0.27 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3mi0 h LEU 471 CO -0.01 0.77 0.09 0.22 0.09 0.00 0.00 178.44 179.60 3mi0 h TYR 472 N 0.70 0.31 -0.48 1.13 3.20 -0.50 -0.27 116.97 121.06 3mi0 h TYR 472 Ca 0.14 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.94 3mi0 h TYR 472 Cb 0.42 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 3mi0 h TYR 472 CO 0.02 0.34 0.08 -0.44 -1.64 0.00 0.00 178.16 176.52 3mi0 h ASP 473 N 0.19 0.69 -0.23 -2.11 3.32 -0.78 -0.28 116.42 117.22 3mi0 h ASP 473 Ca 0.07 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 3mi0 h ASP 473 Cb 0.15 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 3mi0 h ASP 473 CO -0.01 0.70 0.10 0.00 -1.72 0.00 0.00 179.24 178.32 3mi0 h ALA 474 N 1.39 0.29 -0.15 3.45 0.00 -0.62 -2.67 119.26 120.95 3mi0 h ALA 474 Ca 0.15 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3mi0 h ALA 474 Cb 0.31 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3mi0 h ALA 474 CO 0.00 -0.14 -0.13 0.00 0.00 0.00 0.00 179.25 178.99 3mi0 h ALA 475 N 0.96 1.51 0.00 0.00 0.00 -0.68 0.16 119.26 121.21 3mi0 h ALA 475 Ca 0.08 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 3mi0 h ALA 475 Cb 0.13 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3mi0 h ALA 475 CO -0.01 0.35 -0.21 0.22 0.00 0.00 0.00 179.25 179.60 3mi0 h ASP 476 N 0.22 0.00 0.00 0.00 3.58 -0.74 -3.27 116.42 116.21 3mi0 h ASP 476 Ca 0.05 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.50 3mi0 h ASP 476 Cb 0.37 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.42 3mi0 h ASP 476 CO 0.02 0.21 -0.80 0.47 -2.88 0.00 0.00 179.24 176.26 3mi0 n ASP 477 N -4.11 1.91 -4.06 2.28 8.00 -0.86 -4.94 116.55 114.78 3mi0 n ASP 477 Ca -0.02 -0.32 -0.32 0.00 0.71 0.00 0.00 54.79 54.84 3mi0 n ASP 477 Cb 0.28 1.15 -0.15 0.00 -0.02 0.00 0.00 41.12 42.38 3mi0 n ASP 477 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3mi0 s ASP 478 N -2.18 4.39 0.37 -2.24 2.15 0.49 -4.99 116.67 114.66 3mi0 s ASP 478 Ca -0.00 -1.38 0.25 0.00 0.43 0.00 0.00 52.55 51.86 3mi0 s ASP 478 Cb 0.04 -1.51 1.33 0.00 -0.30 0.00 0.00 42.92 42.48 3mi0 s ASP 478 CO 0.27 -0.20 1.78 0.77 -0.17 0.00 0.00 175.17 177.62 3mi0 h SER 479 N 7.79 0.00 0.26 -0.34 4.64 -1.86 -0.63 113.55 123.41 3mi0 h SER 479 Ca -0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 3mi0 h SER 479 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 3mi0 h SER 479 CO 0.45 0.00 -0.17 0.00 -0.87 0.00 0.00 176.83 176.24 3mi0 n ALA 480 N -1.83 2.90 -2.77 5.18 0.00 -1.26 -4.80 120.51 117.93 3mi0 n ALA 480 Ca -0.01 -0.35 -0.34 0.00 0.00 0.00 0.00 53.44 52.74 3mi0 n ALA 480 Cb 0.07 -1.22 -0.11 0.00 0.00 0.00 0.00 19.45 18.20 3mi0 n ALA 480 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3mi0 s THR 481 N -2.44 4.06 -0.12 0.00 2.01 -0.25 -1.40 115.64 117.51 3mi0 s THR 481 Ca 0.28 -0.32 -0.21 0.00 0.31 0.00 0.00 61.69 61.74 3mi0 s THR 481 Cb 0.20 -2.73 -0.03 0.00 0.01 0.00 0.00 72.50 69.94 3mi0 s THR 481 CO 0.48 0.55 0.62 -0.83 -0.69 0.00 0.00 174.62 174.76 3mi0 s GLY 482 N -0.34 2.37 0.94 4.40 0.00 -1.26 -4.52 107.32 108.92 3mi0 s GLY 482 Ca 0.06 -0.08 -0.14 0.00 0.00 0.00 0.00 44.72 44.56 3mi0 s GLY 482 CO 0.02 1.12 1.29 -0.32 0.00 0.00 0.00 173.10 175.22 3mi0 s GLY 483 N 0.88 1.79 0.28 0.20 0.00 -1.26 -4.51 107.32 104.69 3mi0 s GLY 483 Ca 0.32 -1.28 -0.30 0.00 0.00 0.00 0.00 44.72 43.46 3mi0 s GLY 483 CO 0.13 -0.52 1.57 -4.14 0.00 0.00 0.00 173.10 170.14 3mi0 s PRO 484 N -5.82 4.15 -0.55 2.90 0.02 -1.26 -4.91 135.00 129.52 3mi0 s PRO 484 Ca 0.74 2.52 -0.08 0.00 0.02 0.00 0.00 61.00 64.20 3mi0 s PRO 484 Cb -0.04 -3.05 0.14 0.00 0.02 0.00 0.00 34.50 31.58 3mi0 s PRO 484 CO 0.52 -0.59 0.42 0.34 -0.33 0.00 0.00 177.00 177.35 3mi0 s ASP 485 N 0.51 5.70 0.39 2.53 -1.08 0.37 -4.94 116.67 120.15 3mi0 s ASP 485 Ca 0.63 -2.26 0.15 0.00 -0.52 0.00 0.00 52.55 50.55 3mi0 s ASP 485 Cb -0.47 -1.99 0.81 0.00 -1.46 0.00 0.00 42.92 39.82 3mi0 s ASP 485 CO 0.46 -0.59 1.85 -0.07 0.52 0.00 0.00 175.17 177.34 3mi0 h LEU 486 N 7.98 0.00 -0.14 -1.34 4.07 -1.92 0.20 115.31 124.16 3mi0 h LEU 486 Ca -0.11 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.80 3mi0 h LEU 486 Cb 1.04 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.77 3mi0 h LEU 486 CO 0.80 0.34 -0.10 0.58 -1.08 0.00 0.00 178.44 178.97 3mi0 h VAL 487 N 0.00 1.33 0.00 1.22 2.07 -1.96 -3.23 116.25 115.68 3mi0 h VAL 487 Ca -0.00 -1.21 0.00 0.00 0.82 0.00 0.00 66.70 66.31 3mi0 h VAL 487 Cb 0.63 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 32.23 3mi0 h VAL 487 CO 0.04 0.35 -0.54 0.54 0.02 0.00 0.00 177.57 177.98 3mi0 n ARG 488 N -4.61 0.07 -3.05 1.57 1.74 -1.20 -4.96 116.66 106.22 3mi0 n ARG 488 Ca -0.06 0.02 -0.12 0.00 -0.77 0.00 0.00 57.85 56.92 3mi0 n ARG 488 Cb 0.32 -1.54 0.04 0.00 -1.02 0.00 0.00 32.46 30.26 3mi0 n ARG 488 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3mi0 n GLY 489 N 1.46 0.21 3.41 -0.13 0.00 0.62 -5.04 105.19 105.72 3mi0 n GLY 489 Ca 0.05 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 3mi0 n GLY 489 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mi0 s ILE 490 N -3.16 3.18 0.22 -0.61 1.01 -0.58 -4.99 121.20 116.26 3mi0 s ILE 490 Ca 0.29 -0.63 0.02 0.00 0.00 0.00 0.00 60.65 60.34 3mi0 s ILE 490 Cb -0.13 -2.33 -0.05 0.00 0.01 0.00 0.00 42.46 39.97 3mi0 s ILE 490 CO 0.36 0.53 0.03 -0.36 0.00 0.00 0.00 174.94 175.51 3mi0 s PHE 491 N 0.13 1.41 0.75 3.97 0.08 -1.26 -0.48 117.98 122.58 3mi0 s PHE 491 Ca -0.06 -1.03 -0.15 0.00 0.12 0.00 0.00 56.93 55.80 3mi0 s PHE 491 Cb -0.15 -0.82 0.02 0.00 -0.57 0.00 0.00 43.02 41.50 3mi0 s PHE 491 CO 0.04 -0.19 0.94 -2.30 -0.10 0.00 0.00 175.22 173.61 3mi0 n PRO 492 N -0.36 0.38 -4.05 0.24 -0.02 -1.26 -4.84 135.00 125.09 3mi0 n PRO 492 Ca -0.04 0.19 -0.22 0.00 -2.02 0.00 0.00 63.50 61.41 3mi0 n PRO 492 Cb 0.64 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.89 3mi0 n PRO 492 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3mi0 s THR 493 N -1.92 4.82 0.06 3.45 -4.23 -0.91 -4.93 115.64 111.98 3mi0 s THR 493 Ca 0.72 -1.21 -0.15 0.00 -1.18 0.00 0.00 61.69 59.87 3mi0 s THR 493 Cb -0.33 -3.61 0.02 0.00 1.34 0.00 0.00 72.50 69.93 3mi0 s THR 493 CO 0.52 -0.33 0.33 0.00 -0.54 0.00 0.00 174.62 174.60 3mi0 s ALA 494 N -2.06 -0.76 -0.02 3.99 0.00 -1.26 -1.18 121.76 120.48 3mi0 s ALA 494 Ca 0.33 0.03 0.03 0.00 0.00 0.00 0.00 51.96 52.36 3mi0 s ALA 494 Cb -0.08 0.38 -0.00 0.00 0.00 0.00 0.00 23.12 23.41 3mi0 s ALA 494 CO 0.27 -0.46 -0.12 0.08 0.00 0.00 0.00 175.76 175.53 3mi0 s VAL 495 N -2.76 0.99 -0.04 0.00 1.01 0.32 -0.79 120.40 119.11 3mi0 s VAL 495 Ca -0.03 -0.50 0.06 0.00 0.00 0.00 0.00 61.98 61.50 3mi0 s VAL 495 Cb -0.00 -0.85 -0.02 0.00 0.00 0.00 0.00 36.38 35.51 3mi0 s VAL 495 CO -0.05 0.29 -0.21 -0.63 0.00 0.00 0.00 175.10 174.50 3mi0 s ILE 496 N -0.05 2.44 -0.06 2.22 1.01 -0.42 -1.46 121.20 124.89 3mi0 s ILE 496 Ca 0.00 -0.95 0.02 0.00 0.00 0.00 0.00 60.65 59.72 3mi0 s ILE 496 Cb -0.07 -1.91 0.02 0.00 0.01 0.00 0.00 42.46 40.51 3mi0 s ILE 496 CO 0.00 0.58 -0.10 -0.63 0.00 0.00 0.00 174.94 174.80 3mi0 s ILE 497 N -0.50 0.94 0.00 2.92 1.01 0.17 -1.00 121.20 124.74 3mi0 s ILE 497 Ca 0.06 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.36 3mi0 s ILE 497 Cb -0.11 -0.89 0.00 0.00 0.01 0.00 0.00 42.46 41.47 3mi0 s ILE 497 CO 0.01 0.31 0.00 -0.90 0.00 0.00 0.00 174.94 174.36 3mi0 n ASP 498 N 3.93 0.00 0.03 3.58 5.68 -1.14 -1.12 116.55 127.51 3mi0 n ASP 498 Ca -0.23 -0.64 0.21 0.00 -0.50 0.00 0.00 54.79 53.63 3mi0 n ASP 498 Cb 0.51 0.00 0.73 0.00 -1.14 0.00 0.00 41.12 41.22 3mi0 n ASP 498 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3mi0 h ALA 499 N 1.12 2.34 -0.10 2.12 0.00 -1.94 0.17 119.26 122.98 3mi0 h ALA 499 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3mi0 h ALA 499 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3mi0 h ALA 499 CO 0.00 -0.68 0.00 -0.25 0.00 0.00 0.00 179.25 178.32 3mi0 n ASP 500 N -4.06 1.10 0.00 0.00 8.00 -1.26 -5.03 116.55 115.30 3mi0 n ASP 500 Ca 0.09 -1.58 0.00 0.00 0.71 0.00 0.00 54.79 54.02 3mi0 n ASP 500 Cb 0.64 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.67 3mi0 n ASP 500 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mi0 n GLY 501 N 1.03 0.98 3.73 0.44 0.00 0.61 -5.00 105.19 106.98 3mi0 n GLY 501 Ca 0.16 -2.14 -0.40 0.00 0.00 0.00 0.00 46.02 43.65 3mi0 n GLY 501 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mi0 s ALA 502 N -1.35 3.36 0.01 4.61 0.00 0.14 -2.86 121.76 125.66 3mi0 s ALA 502 Ca 0.00 0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.10 3mi0 s ALA 502 Cb 0.00 -2.93 -0.01 0.00 0.00 0.00 0.00 23.12 20.18 3mi0 s ALA 502 CO 0.00 -0.05 -0.03 0.14 0.00 0.00 0.00 175.76 175.82 3mi0 s VAL 503 N 0.57 0.20 0.29 0.00 -7.23 -0.17 -4.97 120.40 109.09 3mi0 s VAL 503 Ca 0.37 -0.40 -0.29 0.00 -1.81 0.00 0.00 61.98 59.85 3mi0 s VAL 503 Cb -0.18 -0.23 -0.10 0.00 0.56 0.00 0.00 36.38 36.43 3mi0 s VAL 503 CO 0.18 -0.13 1.23 -1.81 -0.31 0.00 0.00 175.10 174.27 3mi0 s ASP 504 N -0.55 6.98 0.04 4.85 1.01 -1.26 -1.30 116.67 126.44 3mi0 s ASP 504 Ca -0.04 2.49 -0.27 0.00 0.71 0.00 0.00 52.55 55.44 3mi0 s ASP 504 Cb -0.04 -2.63 -0.05 0.00 1.01 0.00 0.00 42.92 41.21 3mi0 s ASP 504 CO -0.00 -0.39 0.85 -0.69 0.21 0.00 0.00 175.17 175.15 3mi0 s VAL 505 N -0.95 4.72 0.36 -1.27 1.01 0.03 -4.88 120.40 119.43 3mi0 s VAL 505 Ca 0.48 1.81 -0.28 0.00 0.00 0.00 0.00 61.98 64.00 3mi0 s VAL 505 Cb -0.36 -4.20 -0.10 0.00 0.00 0.00 0.00 36.38 31.71 3mi0 s VAL 505 CO 0.46 0.30 1.35 -2.16 0.00 0.00 0.00 175.10 175.06 3mi0 s PRO 506 N 0.23 4.18 0.33 2.72 0.04 -1.26 -4.67 135.00 136.58 3mi0 s PRO 506 Ca 0.43 2.29 0.08 0.00 0.04 0.00 0.00 61.00 63.84 3mi0 s PRO 506 Cb -0.21 -2.96 0.81 0.00 0.04 0.00 0.00 34.50 32.18 3mi0 s PRO 506 CO 0.25 -0.36 1.79 1.49 0.04 0.00 0.00 177.00 180.21 3mi0 h GLU 507 N 3.09 0.67 -0.59 4.56 4.81 -1.95 -2.57 114.58 122.60 3mi0 h GLU 507 Ca -0.50 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 58.67 3mi0 h GLU 507 Cb 1.24 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.44 3mi0 h GLU 507 CO 0.64 0.44 0.26 0.66 -0.73 0.00 0.00 179.01 180.29 3mi0 h SER 508 N 0.69 0.76 -0.30 1.04 4.64 -1.99 0.16 113.55 118.56 3mi0 h SER 508 Ca 0.57 -0.09 -0.17 0.00 -0.47 0.00 0.00 61.79 61.63 3mi0 h SER 508 Cb 0.98 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 62.87 3mi0 h SER 508 CO -0.35 0.67 -0.46 -0.09 -0.87 0.00 0.00 176.83 175.73 3mi0 h ARG 509 N 0.84 0.87 -0.74 4.77 9.65 -1.85 -1.72 114.38 126.20 3mi0 h ARG 509 Ca 0.20 -0.50 -0.06 0.00 -1.10 0.00 0.00 59.98 58.53 3mi0 h ARG 509 Cb 0.12 0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 28.71 3mi0 h ARG 509 CO -0.02 1.14 0.23 0.82 2.80 0.00 0.00 179.97 184.94 3mi0 h ILE 510 N 0.69 1.26 -0.35 1.20 2.04 -1.35 -0.12 117.51 120.89 3mi0 h ILE 510 Ca 0.04 -0.91 -0.01 0.00 1.00 0.00 0.00 64.86 64.98 3mi0 h ILE 510 Cb 1.05 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 3mi0 h ILE 510 CO 0.11 0.36 0.18 0.00 0.00 0.00 0.00 178.15 178.80 3mi0 h ALA 511 N 1.12 0.46 0.01 1.87 0.00 -0.60 -0.55 119.26 121.57 3mi0 h ALA 511 Ca 0.24 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.08 3mi0 h ALA 511 Cb 0.31 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3mi0 h ALA 511 CO -0.01 0.00 -0.13 0.93 0.00 0.00 0.00 179.25 180.04 3mi0 h GLU 512 N 0.44 -0.22 -0.71 0.00 5.08 -1.04 -1.10 114.58 117.03 3mi0 h GLU 512 Ca 0.12 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.56 3mi0 h GLU 512 Cb 0.09 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.33 3mi0 h GLU 512 CO -0.02 -0.15 0.41 -0.07 -1.00 0.00 0.00 179.01 178.18 3mi0 h LEU 513 N -0.23 0.61 0.12 1.33 3.38 -0.83 -0.62 115.31 119.07 3mi0 h LEU 513 Ca 0.04 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 3mi0 h LEU 513 Cb 0.28 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3mi0 h LEU 513 CO -0.12 0.39 -0.06 0.00 0.09 0.00 0.00 178.44 178.74 3mi0 h ALA 514 N 1.36 -0.16 -0.88 1.53 0.00 -0.78 0.12 119.26 120.45 3mi0 h ALA 514 Ca 0.32 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.19 3mi0 h ALA 514 Cb 0.19 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 3mi0 h ALA 514 CO -0.18 -0.54 0.58 0.00 0.00 0.00 0.00 179.25 179.11 3mi0 h ARG 515 N -0.25 1.04 -0.49 0.00 3.08 -0.93 -1.12 114.38 115.71 3mi0 h ARG 515 Ca -0.02 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 59.91 3mi0 h ARG 515 Cb 0.20 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 3mi0 h ARG 515 CO 0.03 0.69 0.05 0.00 -1.07 0.00 0.00 179.97 179.67 3mi0 h ALA 516 N 1.49 1.18 -0.29 0.04 0.00 -0.57 0.12 119.26 121.24 3mi0 h ALA 516 Ca 0.36 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3mi0 h ALA 516 Cb 0.07 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3mi0 h ALA 516 CO -0.12 0.54 -0.04 0.82 0.00 0.00 0.00 179.25 180.46 3mi0 h ILE 517 N 0.74 1.27 0.01 0.00 2.04 0.05 -1.54 117.51 120.08 3mi0 h ILE 517 Ca 0.15 -1.03 -0.00 0.00 1.00 0.00 0.00 64.86 64.98 3mi0 h ILE 517 Cb 0.37 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 37.82 3mi0 h ILE 517 CO 0.01 0.33 -0.00 0.40 0.00 0.00 0.00 178.15 178.89 3mi0 h ILE 518 N 0.30 1.00 -1.00 -0.67 2.04 -0.83 -0.43 117.51 117.92 3mi0 h ILE 518 Ca 0.08 -0.02 0.02 0.00 1.00 0.00 0.00 64.86 65.94 3mi0 h ILE 518 Cb 0.50 1.02 -0.05 0.00 -0.74 0.00 0.00 36.82 37.55 3mi0 h ILE 518 CO 0.02 0.01 0.66 -0.33 0.00 0.00 0.00 178.15 178.51 3mi0 h GLU 519 N -0.02 1.28 -0.65 2.37 5.08 -0.75 0.16 114.58 122.05 3mi0 h GLU 519 Ca -0.00 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 3mi0 h GLU 519 Cb 0.01 -0.29 -0.03 0.00 0.50 0.00 0.00 28.75 28.95 3mi0 h GLU 519 CO 0.00 0.85 0.29 0.77 -1.00 0.00 0.00 179.01 179.91 3mi0 h SER 520 N 1.32 0.88 0.56 1.42 0.02 -0.90 1.00 113.55 117.85 3mi0 h SER 520 Ca 0.38 -0.15 -0.14 0.00 -0.84 0.00 0.00 61.79 61.03 3mi0 h SER 520 Cb -0.10 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.20 3mi0 h SER 520 CO -0.10 0.79 -0.65 0.03 -1.14 0.00 0.00 176.83 175.77 3mi0 h ARG 521 N 0.91 0.08 -0.40 3.45 2.47 -0.61 -1.63 114.38 118.65 3mi0 h ARG 521 Ca 0.22 -0.06 -0.03 0.00 -1.26 0.00 0.00 59.98 58.85 3mi0 h ARG 521 Cb 0.17 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.48 3mi0 h ARG 521 CO -0.02 0.69 0.12 1.03 0.56 0.00 0.00 179.97 182.35 3mi0 h SER 522 N 0.05 0.59 0.13 7.04 0.87 -0.20 0.43 113.55 122.47 3mi0 h SER 522 Ca -0.01 -0.21 -0.01 0.00 -1.23 0.00 0.00 61.79 60.33 3mi0 h SER 522 Cb 1.15 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.96 3mi0 h SER 522 CO 0.09 0.65 -0.06 1.23 -0.53 0.00 0.00 176.83 178.21 3mi0 h GLY 523 N 0.50 -0.18 0.91 5.77 0.00 -0.56 -2.58 103.07 106.93 3mi0 h GLY 523 Ca 0.13 0.07 0.04 0.00 0.00 0.00 0.00 47.33 47.56 3mi0 h GLY 523 CO -0.00 -0.07 0.64 0.00 0.00 0.00 0.00 176.54 177.12 3mi0 h ALA 524 N 0.60 1.36 -0.63 3.60 0.00 -1.23 -0.90 119.26 122.07 3mi0 h ALA 524 Ca -0.02 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.85 3mi0 h ALA 524 Cb 0.21 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3mi0 h ALA 524 CO 0.03 0.54 0.41 0.22 0.00 0.00 0.00 179.25 180.46 3mi0 h ASP 525 N 1.24 0.71 -0.50 0.00 1.82 -0.74 0.19 116.42 119.14 3mi0 h ASP 525 Ca 0.39 -0.02 -0.10 0.00 -0.39 0.00 0.00 57.03 56.91 3mi0 h ASP 525 Cb 0.00 -0.17 -0.02 0.00 0.68 0.00 0.00 39.33 39.82 3mi0 h ASP 525 CO -0.12 0.51 -0.07 0.74 -1.61 0.00 0.00 179.24 178.69 3mi0 h THR 526 N 0.84 1.26 -0.61 2.25 2.02 -0.93 -2.82 112.91 114.92 3mi0 h THR 526 Ca 0.23 -1.20 -0.05 0.00 0.77 0.00 0.00 66.41 66.16 3mi0 h THR 526 Cb -0.09 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 3mi0 h THR 526 CO -0.06 0.42 0.16 -0.26 0.37 0.00 0.00 175.52 176.16 3mi0 h PHE 527 N 0.87 0.98 -2.30 3.16 0.04 -0.72 -3.44 116.94 115.52 3mi0 h PHE 527 Ca 0.15 -0.09 -0.12 0.00 2.80 0.00 0.00 57.97 60.70 3mi0 h PHE 527 Cb 0.61 -0.28 0.06 0.00 2.20 0.00 0.00 35.95 38.53 3mi0 h PHE 527 CO 0.04 0.80 0.08 0.41 -0.60 0.00 0.00 178.31 179.04 3mi0 n GLY 528 N -0.82 -1.88 3.82 -1.45 0.00 0.62 -5.09 105.19 100.39 3mi0 n GLY 528 Ca 0.05 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.49 3mi0 n GLY 528 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3mi0 s SER 529 N -2.41 -0.04 -0.94 1.61 1.04 -1.26 -4.88 113.70 106.81 3mi0 s SER 529 Ca 0.22 -0.32 -0.14 0.00 0.48 0.00 0.00 55.95 56.19 3mi0 s SER 529 Cb -0.01 0.27 0.20 0.00 0.10 0.00 0.00 66.02 66.58 3mi0 s SER 529 CO 0.16 -0.53 0.99 -0.62 0.98 0.00 0.00 173.24 174.22 3mi0 s ASP 530 N -3.34 6.86 -1.48 7.02 2.15 0.54 -4.49 116.67 123.93 3mi0 s ASP 530 Ca 0.21 -2.71 -0.12 0.00 0.43 0.00 0.00 52.55 50.35 3mi0 s ASP 530 Cb 0.01 -2.28 0.08 0.00 -0.30 0.00 0.00 42.92 40.42 3mi0 s ASP 530 CO 0.00 -0.67 0.82 0.61 -0.17 0.00 0.00 175.17 175.76 3mi0 n GLY 531 N 4.17 -0.50 0.00 2.66 0.00 -1.26 -2.00 105.19 108.25 3mi0 n GLY 531 Ca 0.21 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.39 3mi0 n GLY 531 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mi0 n GLY 532 N -1.55 2.20 3.78 -0.02 0.00 -1.26 -5.09 105.19 103.25 3mi0 n GLY 532 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 3mi0 n GLY 532 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3mi0 s GLU 533 N -0.23 4.00 -0.30 1.61 2.56 -0.85 -4.98 118.70 120.52 3mi0 s GLU 533 Ca 0.00 0.06 -0.04 0.00 0.00 0.00 0.00 54.97 54.99 3mi0 s GLU 533 Cb 0.00 -3.34 0.04 0.00 2.00 0.00 0.00 34.13 32.83 3mi0 s GLU 533 CO 0.00 0.45 0.03 0.15 -0.56 0.00 0.00 175.26 175.33 3mi0 s LYS 534 N -0.15 2.67 0.30 4.30 1.02 -1.26 0.20 119.74 126.82 3mi0 s LYS 534 Ca 0.16 -1.12 0.23 0.00 0.02 0.00 0.00 55.97 55.26 3mi0 s LYS 534 Cb -0.13 -3.25 0.15 0.00 -0.52 0.00 0.00 37.83 34.08 3mi0 s LYS 534 CO 0.05 -0.56 1.28 0.45 -0.92 0.00 0.00 175.35 175.65 3mi0 h HIS 535 N 8.10 0.00 -3.97 3.18 3.86 -1.97 -3.47 115.15 120.87 3mi0 h HIS 535 Ca -0.26 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 58.73 3mi0 h HIS 535 Cb 1.09 0.00 -0.20 0.00 1.06 0.00 0.00 27.41 29.35 3mi0 h HIS 535 CO 0.60 0.00 -0.72 -1.01 0.86 0.00 0.00 177.93 177.66 3mi0 s HIS 536 N -3.30 0.54 0.00 2.45 3.76 -1.26 -5.15 115.29 112.33 3mi0 s HIS 536 Ca 0.03 -0.57 0.04 0.00 -0.15 0.00 0.00 55.06 54.41 3mi0 s HIS 536 Cb 0.08 -0.34 -0.01 0.00 1.11 0.00 0.00 32.58 33.42 3mi0 s HIS 536 CO 0.74 -0.14 -0.14 -1.01 -0.85 0.00 0.00 174.74 173.34 3mi0 s HIS 537 N -1.71 1.26 0.73 1.40 0.09 -1.26 -5.03 115.29 110.77 3mi0 s HIS 537 Ca -0.10 -0.27 -0.11 0.00 -0.00 0.00 0.00 55.06 54.58 3mi0 s HIS 537 Cb -0.08 -0.79 0.03 0.00 -0.00 0.00 0.00 32.58 31.74 3mi0 s HIS 537 CO -0.01 -0.00 1.09 -1.01 -0.00 0.00 0.00 174.74 174.81 3mi0 s HIS 538 N -0.46 3.18 0.00 1.40 3.76 -1.26 -5.22 115.29 116.69 3mi0 s HIS 538 Ca 0.05 1.10 0.00 0.00 -0.15 0.00 0.00 55.06 56.05 3mi0 s HIS 538 Cb -0.06 -3.07 0.00 0.00 1.11 0.00 0.00 32.58 30.56 3mi0 s HIS 538 CO -0.00 -1.34 0.34 0.72 -0.85 0.00 0.00 174.74 173.61