#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6i s ILE 303 N 0.00 2.33 0.17 12.58 -1.09 -0.52 -2.06 121.20 132.60 3h6i s ILE 303 Ca 0.00 -0.95 0.11 0.00 -2.23 0.00 0.00 60.65 57.58 3h6i s ILE 303 Cb 0.00 -1.89 -0.04 0.00 -1.58 0.00 0.00 42.46 38.95 3h6i s ILE 303 CO 0.00 0.56 -0.23 0.68 -1.23 0.00 0.00 174.94 174.72 3h6i s VAL 304 N -0.02 2.42 -0.10 2.92 -7.23 0.15 -0.98 120.40 117.57 3h6i s VAL 304 Ca -0.07 -1.88 -0.07 0.00 -1.81 0.00 0.00 61.98 58.16 3h6i s VAL 304 Cb -0.15 -2.13 0.04 0.00 0.56 0.00 0.00 36.38 34.69 3h6i s VAL 304 CO 0.05 -0.03 0.24 0.00 -0.31 0.00 0.00 175.10 175.05 3h6i s ALA 305 N -1.44 -0.58 -0.06 1.32 0.00 -0.41 -0.27 121.76 120.33 3h6i s ALA 305 Ca 0.19 0.85 -0.08 0.00 0.00 0.00 0.00 51.96 52.92 3h6i s ALA 305 Cb -0.09 -0.52 0.02 0.00 0.00 0.00 0.00 23.12 22.52 3h6i s ALA 305 CO 0.09 -0.16 0.21 -0.48 0.00 0.00 0.00 175.76 175.42 3h6i s LEU 306 N 0.73 1.22 -0.06 0.00 0.05 -0.03 -0.85 118.68 119.74 3h6i s LEU 306 Ca -0.05 0.28 -0.17 0.00 0.05 0.00 0.00 54.13 54.24 3h6i s LEU 306 Cb -0.06 0.78 -0.05 0.00 -2.05 0.00 0.00 46.19 44.80 3h6i s LEU 306 CO -0.04 -0.16 0.45 -0.54 -0.55 0.00 0.00 176.35 175.50 3h6i s LYS 307 N -0.30 4.17 0.34 1.48 1.02 0.12 -0.95 119.74 125.62 3h6i s LYS 307 Ca -0.04 0.44 0.07 0.00 0.02 0.00 0.00 55.97 56.46 3h6i s LYS 307 Cb -0.03 -3.34 -0.07 0.00 -0.52 0.00 0.00 37.83 33.87 3h6i s LYS 307 CO 0.01 0.40 -0.02 1.52 -0.92 0.00 0.00 175.35 176.34 3h6i s TYR 308 N -0.17 2.22 0.07 3.18 -0.85 -0.26 -4.90 117.35 116.64 3h6i s TYR 308 Ca 0.25 -0.71 -0.31 0.00 -0.52 0.00 0.00 57.07 55.78 3h6i s TYR 308 Cb -0.16 -1.41 -0.09 0.00 0.38 0.00 0.00 41.96 40.68 3h6i s TYR 308 CO 0.12 0.33 1.76 -2.14 -1.52 0.00 0.00 175.55 174.10 3h6i s PRO 309 N -3.74 4.17 0.00 -3.49 0.02 -1.26 -1.23 135.00 129.47 3h6i s PRO 309 Ca 0.33 2.45 0.00 0.00 0.02 0.00 0.00 61.00 63.80 3h6i s PRO 309 Cb 0.07 -3.73 0.00 0.00 0.02 0.00 0.00 34.50 30.86 3h6i s PRO 309 CO 0.15 -0.81 0.00 0.41 -0.33 0.00 0.00 177.00 176.42 3h6i n GLY 310 N 4.17 0.87 2.67 0.52 0.00 0.45 -4.75 105.19 109.13 3h6i n GLY 310 Ca 0.17 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.16 3h6i n GLY 310 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h6i n GLY 311 N -2.21 0.98 3.08 -0.02 0.00 -0.36 -4.22 105.19 102.43 3h6i n GLY 311 Ca 0.00 -1.12 -0.12 0.00 0.00 0.00 0.00 46.02 44.78 3h6i n GLY 311 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h6i s VAL 312 N -2.27 0.01 -0.04 1.61 0.11 -0.36 -1.10 120.40 118.37 3h6i s VAL 312 Ca 0.14 -0.12 0.05 0.00 -2.93 0.00 0.00 61.98 59.12 3h6i s VAL 312 Cb -0.03 -0.30 -0.01 0.00 -1.53 0.00 0.00 36.38 34.52 3h6i s VAL 312 CO 0.05 -0.07 -0.19 0.54 -3.33 0.00 0.00 175.10 172.11 3h6i s VAL 313 N -0.16 1.53 -0.09 2.04 0.11 -0.13 -1.06 120.40 122.63 3h6i s VAL 313 Ca -0.03 -0.78 0.02 0.00 -2.93 0.00 0.00 61.98 58.27 3h6i s VAL 313 Cb -0.02 -1.30 0.01 0.00 -1.53 0.00 0.00 36.38 33.53 3h6i s VAL 313 CO 0.01 0.44 -0.16 -0.32 -3.33 0.00 0.00 175.10 171.73 3h6i s MET 314 N -0.06 2.20 -0.00 1.54 1.75 -0.59 -0.85 119.30 123.29 3h6i s MET 314 Ca -0.02 -0.58 0.04 0.00 -1.25 0.00 0.00 55.69 53.88 3h6i s MET 314 Cb -0.11 -1.78 -0.01 0.00 2.84 0.00 0.00 34.83 35.77 3h6i s MET 314 CO 0.02 0.04 -0.12 0.00 -0.65 0.00 0.00 175.02 174.31 3h6i s ALA 315 N 0.69 0.97 0.08 4.11 0.00 0.63 -1.67 121.76 126.57 3h6i s ALA 315 Ca -0.13 -0.53 0.05 0.00 0.00 0.00 0.00 51.96 51.35 3h6i s ALA 315 Cb -0.16 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.70 3h6i s ALA 315 CO 0.03 0.23 -0.15 0.20 0.00 0.00 0.00 175.76 176.08 3h6i s GLY 316 N -0.38 0.90 1.00 0.00 0.00 -0.83 0.32 107.32 108.33 3h6i s GLY 316 Ca 0.04 -1.04 -0.17 0.00 0.00 0.00 0.00 44.72 43.55 3h6i s GLY 316 CO -0.00 -1.07 1.35 0.51 0.00 0.00 0.00 173.10 173.89 3h6i s ASP 317 N -1.82 2.75 0.00 1.64 -4.77 -0.88 -2.23 116.67 111.37 3h6i s ASP 317 Ca -0.01 0.17 0.03 0.00 -3.30 0.00 0.00 52.55 49.44 3h6i s ASP 317 Cb -0.09 -0.12 0.06 0.00 -1.09 0.00 0.00 42.92 41.67 3h6i s ASP 317 CO 0.02 -2.95 0.92 0.54 0.70 0.00 0.00 175.17 174.40 3h6i n ARG 318 N -3.90 1.94 -3.31 2.11 5.12 -1.26 -4.60 116.66 112.77 3h6i n ARG 318 Ca 0.17 -1.35 -0.28 0.00 -1.93 0.00 0.00 57.85 54.46 3h6i n ARG 318 Cb 0.59 -1.06 -0.03 0.00 -1.16 0.00 0.00 32.46 30.81 3h6i n ARG 318 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 3h6i s ARG 319 N -0.78 3.59 -0.05 5.56 3.52 -1.26 -1.15 118.95 128.38 3h6i s ARG 319 Ca 0.05 -0.06 -0.04 0.00 -0.13 0.00 0.00 55.73 55.55 3h6i s ARG 319 Cb 0.03 -2.64 0.02 0.00 -1.56 0.00 0.00 34.95 30.80 3h6i s ARG 319 CO 0.04 0.18 0.14 -1.54 -0.81 0.00 0.00 175.30 173.30 3h6i s SER 320 N -3.40 -0.13 0.21 -2.12 1.04 -1.00 -4.82 113.70 103.48 3h6i s SER 320 Ca 0.43 0.28 0.09 0.00 0.48 0.00 0.00 55.95 57.23 3h6i s SER 320 Cb -0.10 0.24 -0.05 0.00 0.10 0.00 0.00 66.02 66.21 3h6i s SER 320 CO 0.32 -0.08 -0.18 0.42 0.98 0.00 0.00 173.24 174.70 3h6i s THR 321 N 0.45 2.02 -0.38 2.02 -4.23 -1.26 -1.02 115.64 113.24 3h6i s THR 321 Ca -0.03 -2.12 0.01 0.00 -1.18 0.00 0.00 61.69 58.36 3h6i s THR 321 Cb -0.05 -2.04 0.13 0.00 1.34 0.00 0.00 72.50 71.88 3h6i s THR 321 CO -0.02 -0.38 0.19 -1.58 -0.54 0.00 0.00 174.62 172.29 3h6i s GLN 322 N -3.16 0.89 7.71 3.99 0.74 0.14 -4.81 119.66 125.16 3h6i s GLN 322 Ca 0.21 -1.53 0.00 0.00 0.05 0.00 0.00 55.36 54.10 3h6i s GLN 322 Cb -0.05 -1.90 0.00 0.00 1.10 0.00 0.00 33.01 32.16 3h6i s GLN 322 CO 0.09 -1.13 0.00 0.41 -0.55 0.00 0.00 175.29 174.11 3h6i n GLY 323 N 4.07 2.69 0.01 2.59 0.00 -1.26 -1.48 105.19 111.80 3h6i n GLY 323 Ca 0.06 -0.29 0.11 0.00 0.00 0.00 0.00 46.02 45.90 3h6i n GLY 323 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3h6i n ASN 324 N 8.37 0.68 -4.73 1.61 3.02 -1.26 -4.94 115.26 118.01 3h6i n ASN 324 Ca 0.00 -0.47 -0.41 0.00 -0.03 0.00 0.00 54.58 53.66 3h6i n ASN 324 Cb 0.00 0.60 -0.04 0.00 -0.61 0.00 0.00 39.78 39.73 3h6i n ASN 324 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3h6i s MET 325 N -3.04 4.66 -0.36 3.52 -1.94 -0.55 -5.01 119.30 116.58 3h6i s MET 325 Ca 0.08 1.54 -0.29 0.00 -1.71 0.00 0.00 55.69 55.31 3h6i s MET 325 Cb 0.16 -3.35 0.01 0.00 2.01 0.00 0.00 34.83 33.67 3h6i s MET 325 CO 0.77 0.16 1.23 0.42 -0.01 0.00 0.00 175.02 177.60 3h6i s ILE 326 N -0.05 4.20 -0.51 2.53 1.01 -1.26 -0.68 121.20 126.44 3h6i s ILE 326 Ca 0.48 1.32 0.22 0.00 0.00 0.00 0.00 60.65 62.66 3h6i s ILE 326 Cb -0.25 -4.32 -0.28 0.00 0.01 0.00 0.00 42.46 37.61 3h6i s ILE 326 CO 0.31 -0.64 0.70 -1.54 0.00 0.00 0.00 174.94 173.77 3h6i n SER 327 N 7.69 0.50 -3.73 3.58 3.41 -0.18 -4.94 113.62 119.95 3h6i n SER 327 Ca 0.14 -0.49 -0.14 0.00 -0.26 0.00 0.00 58.87 58.12 3h6i n SER 327 Cb 0.47 1.49 -0.09 0.00 -0.26 0.00 0.00 64.21 65.82 3h6i n SER 327 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3h6i s GLY 328 N -3.77 -0.28 0.00 5.00 0.00 -1.09 -4.92 107.32 102.27 3h6i s GLY 328 Ca 0.00 0.91 0.00 0.00 0.00 0.00 0.00 44.72 45.63 3h6i s GLY 328 CO 0.89 0.72 0.15 0.54 0.00 0.00 0.00 173.10 175.40 3h6i n ARG 329 N 2.22 3.99 -0.08 2.90 1.74 -1.25 -2.37 116.66 123.81 3h6i n ARG 329 Ca -0.16 -0.15 0.06 0.00 -0.77 0.00 0.00 57.85 56.83 3h6i n ARG 329 Cb 0.57 -0.62 0.08 0.00 -1.02 0.00 0.00 32.46 31.47 3h6i n ARG 329 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3h6i n ASP 330 N -0.61 1.97 -4.74 0.55 8.00 -1.01 -4.61 116.55 116.10 3h6i n ASP 330 Ca 0.00 -2.60 -0.42 0.00 0.71 0.00 0.00 54.79 52.48 3h6i n ASP 330 Cb 0.01 -0.27 -0.02 0.00 -0.02 0.00 0.00 41.12 40.81 3h6i n ASP 330 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3h6i s VAL 331 N -1.99 2.50 -0.25 2.53 1.01 -0.30 -4.97 120.40 118.94 3h6i s VAL 331 Ca 0.19 0.41 -0.08 0.00 0.00 0.00 0.00 61.98 62.49 3h6i s VAL 331 Cb 0.17 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 3h6i s VAL 331 CO 0.02 0.06 0.11 -0.60 0.00 0.00 0.00 175.10 174.68 3h6i s ARG 332 N 0.02 3.81 -0.00 2.72 3.52 -1.26 -4.30 118.95 123.47 3h6i s ARG 332 Ca 0.63 -0.40 0.05 0.00 -0.13 0.00 0.00 55.73 55.88 3h6i s ARG 332 Cb -0.44 -3.41 -0.06 0.00 -1.56 0.00 0.00 34.95 29.49 3h6i s ARG 332 CO 0.41 -0.09 0.22 1.63 -0.81 0.00 0.00 175.30 176.65 3h6i n LYS 333 N 4.68 5.20 -4.33 5.12 5.02 -1.26 -4.66 118.16 127.92 3h6i n LYS 333 Ca -0.16 -0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.80 3h6i n LYS 333 Cb 0.52 -0.75 -0.15 0.00 -0.02 0.00 0.00 35.03 34.63 3h6i n LYS 333 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3h6i s VAL 334 N -1.50 2.81 -0.01 -0.18 1.01 -1.26 -2.20 120.40 119.06 3h6i s VAL 334 Ca 0.02 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.32 3h6i s VAL 334 Cb 0.04 -2.21 -0.00 0.00 0.00 0.00 0.00 36.38 34.20 3h6i s VAL 334 CO 0.21 0.50 -0.09 -0.31 0.00 0.00 0.00 175.10 175.40 3h6i s TYR 335 N 1.00 0.89 0.02 5.22 1.51 -0.18 -4.94 117.35 120.87 3h6i s TYR 335 Ca -0.01 -0.19 -0.30 0.00 -1.01 0.00 0.00 57.07 55.56 3h6i s TYR 335 Cb -0.15 -0.60 -0.06 0.00 -0.11 0.00 0.00 41.96 41.05 3h6i s TYR 335 CO -0.02 -0.04 1.35 0.42 -1.11 0.00 0.00 175.55 176.15 3h6i s ILE 336 N -0.10 3.74 -0.03 2.71 1.01 -1.26 -0.89 121.20 126.38 3h6i s ILE 336 Ca 0.02 1.17 0.17 0.00 0.00 0.00 0.00 60.65 62.00 3h6i s ILE 336 Cb -0.05 -3.75 -0.26 0.00 0.01 0.00 0.00 42.46 38.41 3h6i s ILE 336 CO -0.00 0.03 0.37 0.35 0.00 0.00 0.00 174.94 175.69 3h6i n THR 337 N 4.43 0.00 -3.86 2.92 -2.24 0.47 -4.92 114.28 111.07 3h6i n THR 337 Ca 0.12 -0.38 -0.03 0.00 -2.27 0.00 0.00 64.05 61.49 3h6i n THR 337 Cb 0.44 0.12 0.01 0.00 -2.10 0.00 0.00 70.33 68.80 3h6i n THR 337 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3h6i s ASP 338 N -3.94 -0.02 0.59 3.42 -4.77 -1.15 -4.31 116.67 106.48 3h6i s ASP 338 Ca -0.06 -0.61 0.29 0.00 -3.30 0.00 0.00 52.55 48.87 3h6i s ASP 338 Cb 0.11 0.48 1.66 0.00 -1.09 0.00 0.00 42.92 44.08 3h6i s ASP 338 CO 0.70 -0.94 2.10 0.44 0.70 0.00 0.00 175.17 178.17 3h6i h ASP 339 N 2.00 0.00 0.00 2.11 3.32 -1.97 -2.71 116.42 119.17 3h6i h ASP 339 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 3h6i h ASP 339 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 3h6i h ASP 339 CO 0.34 0.00 -0.04 -1.22 -1.72 0.00 0.00 179.24 176.60 3h6i n TYR 340 N -3.79 0.00 -3.95 4.55 4.02 -1.26 -0.06 117.16 116.66 3h6i n TYR 340 Ca 0.02 -0.66 -0.09 0.00 -0.01 0.00 0.00 57.90 57.16 3h6i n TYR 340 Cb 0.33 -0.09 -0.10 0.00 -0.02 0.00 0.00 39.34 39.46 3h6i n TYR 340 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 3h6i s THR 341 N -1.72 0.14 -0.01 -0.72 -4.23 -1.02 -1.24 115.64 106.84 3h6i s THR 341 Ca 0.15 -1.12 -0.08 0.00 -1.18 0.00 0.00 61.69 59.46 3h6i s THR 341 Cb 0.13 -0.82 0.01 0.00 1.34 0.00 0.00 72.50 73.16 3h6i s THR 341 CO 0.01 -0.62 0.17 0.00 -0.54 0.00 0.00 174.62 173.64 3h6i s ALA 342 N -2.47 -0.41 0.08 3.99 0.00 0.18 -0.39 121.76 122.74 3h6i s ALA 342 Ca -0.06 0.04 0.08 0.00 0.00 0.00 0.00 51.96 52.02 3h6i s ALA 342 Cb -0.02 0.03 -0.03 0.00 0.00 0.00 0.00 23.12 23.10 3h6i s ALA 342 CO -0.04 -0.19 -0.22 0.95 0.00 0.00 0.00 175.76 176.26 3h6i s THR 343 N -1.11 1.76 -0.03 0.00 -4.23 -0.07 -1.20 115.64 110.75 3h6i s THR 343 Ca -0.12 -1.42 0.01 0.00 -1.18 0.00 0.00 61.69 58.98 3h6i s THR 343 Cb -0.06 -1.56 0.02 0.00 1.34 0.00 0.00 72.50 72.24 3h6i s THR 343 CO 0.02 0.08 -0.03 -0.83 -0.54 0.00 0.00 174.62 173.32 3h6i s GLY 344 N -1.60 0.35 -0.09 3.99 0.00 -0.68 -1.01 107.32 108.28 3h6i s GLY 344 Ca 0.08 0.02 0.02 0.00 0.00 0.00 0.00 44.72 44.84 3h6i s GLY 344 CO 0.03 0.44 -0.16 -0.42 0.00 0.00 0.00 173.10 172.99 3h6i s ILE 345 N 0.85 1.49 -1.37 0.90 1.01 -0.94 -1.37 121.20 121.77 3h6i s ILE 345 Ca -0.10 -0.66 -0.12 0.00 0.00 0.00 0.00 60.65 59.77 3h6i s ILE 345 Cb -0.13 -1.34 0.10 0.00 0.01 0.00 0.00 42.46 41.10 3h6i s ILE 345 CO -0.00 0.44 2.06 0.00 0.00 0.00 0.00 174.94 177.43 3h6i n ALA 346 N 3.95 5.49 -3.00 9.38 0.00 -1.26 -4.76 120.51 130.31 3h6i n ALA 346 Ca -0.20 -4.10 0.00 0.00 0.00 0.00 0.00 53.44 49.14 3h6i n ALA 346 Cb 0.52 -3.25 0.00 0.00 0.00 0.00 0.00 19.45 16.71 3h6i n ALA 346 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h6i n GLY 347 N 3.43 4.23 3.68 0.00 0.00 -1.26 -4.83 105.19 110.43 3h6i n GLY 347 Ca 0.46 -1.27 -0.30 0.00 0.00 0.00 0.00 46.02 44.91 3h6i n GLY 347 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h6i s THR 348 N -1.80 2.55 0.27 2.61 -4.23 -1.26 -4.82 115.64 108.96 3h6i s THR 348 Ca 0.00 0.18 -0.01 0.00 -1.18 0.00 0.00 61.69 60.68 3h6i s THR 348 Cb 0.00 -2.50 0.27 0.00 1.34 0.00 0.00 72.50 71.61 3h6i s THR 348 CO 0.00 -0.23 1.85 0.00 -0.54 0.00 0.00 174.62 175.69 3h6i h ALA 349 N -1.71 1.41 -0.04 3.99 0.00 -1.96 -2.07 119.26 118.89 3h6i h ALA 349 Ca -0.49 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 3h6i h ALA 349 Cb 1.28 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 3h6i h ALA 349 CO 0.50 0.27 -0.01 0.00 0.00 0.00 0.00 179.25 180.02 3h6i h ALA 350 N 1.50 0.05 -0.62 0.00 0.00 -1.92 -1.42 119.26 116.84 3h6i h ALA 350 Ca 0.46 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.18 3h6i h ALA 350 Cb 0.36 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3h6i h ALA 350 CO -0.23 -0.25 0.41 0.28 0.00 0.00 0.00 179.25 179.46 3h6i h VAL 351 N -0.29 1.16 -0.09 0.00 2.07 -1.87 0.81 116.25 118.04 3h6i h VAL 351 Ca 0.01 -0.29 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 3h6i h VAL 351 Cb 0.39 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 30.40 3h6i h VAL 351 CO 0.00 0.15 0.05 0.00 0.02 0.00 0.00 177.57 177.80 3h6i h ALA 352 N 1.23 0.12 -0.14 1.67 0.00 -1.31 -1.86 119.26 118.96 3h6i h ALA 352 Ca 0.23 -0.04 -0.20 0.00 0.00 0.00 0.00 54.91 54.90 3h6i h ALA 352 Cb -0.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3h6i h ALA 352 CO -0.05 -0.36 -0.72 -0.24 0.00 0.00 0.00 179.25 177.88 3h6i h VAL 353 N 0.07 1.32 -0.38 0.00 3.04 -1.13 -2.65 116.25 116.50 3h6i h VAL 353 Ca 0.03 -1.99 -0.15 0.00 -1.01 0.00 0.00 66.70 63.58 3h6i h VAL 353 Cb 0.05 1.98 -0.01 0.00 -2.01 0.00 0.00 31.29 31.30 3h6i h VAL 353 CO -0.01 0.62 -0.34 -0.33 -1.01 0.00 0.00 177.57 176.51 3h6i h GLU 354 N 0.45 0.88 -0.02 4.17 4.39 -0.81 -0.62 114.58 123.02 3h6i h GLU 354 Ca -0.03 -0.43 -0.00 0.00 0.34 0.00 0.00 59.36 59.23 3h6i h GLU 354 Cb 1.32 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.97 3h6i h GLU 354 CO 0.14 1.08 -0.00 0.35 -1.16 0.00 0.00 179.01 179.42 3h6i h PHE 355 N 0.73 0.04 -0.78 4.33 3.04 -1.40 -1.98 116.94 120.92 3h6i h PHE 355 Ca 0.07 -0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.06 3h6i h PHE 355 Cb 0.91 -0.01 -0.05 0.00 2.56 0.00 0.00 35.95 39.36 3h6i h PHE 355 CO 0.05 0.36 0.48 0.00 -2.02 0.00 0.00 178.31 177.18 3h6i h ALA 356 N 0.68 1.04 -0.13 2.41 0.00 -1.41 -0.77 119.26 121.07 3h6i h ALA 356 Ca 0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3h6i h ALA 356 Cb 0.35 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3h6i h ALA 356 CO 0.00 0.24 0.05 -0.09 0.00 0.00 0.00 179.25 179.45 3h6i h ARG 357 N 0.90 0.20 -0.74 0.00 2.43 -1.04 0.98 114.38 117.11 3h6i h ARG 357 Ca 0.33 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.42 3h6i h ARG 357 Cb 0.10 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 3h6i h ARG 357 CO -0.15 0.31 0.30 1.25 -1.51 0.00 0.00 179.97 180.18 3h6i h LEU 358 N 0.05 1.01 -0.47 3.80 5.85 -1.11 -1.04 115.31 123.40 3h6i h LEU 358 Ca 0.04 -0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.55 3h6i h LEU 358 Cb 0.19 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 3h6i h LEU 358 CO -0.00 0.90 0.12 0.22 -0.34 0.00 0.00 178.44 179.34 3h6i h TYR 359 N 1.06 0.78 -0.38 1.25 3.20 -0.96 -0.96 116.97 120.96 3h6i h TYR 359 Ca 0.25 -0.09 -0.05 0.00 3.14 0.00 0.00 58.73 61.97 3h6i h TYR 359 Cb 0.20 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 3h6i h TYR 359 CO 0.02 0.71 0.02 0.00 -1.64 0.00 0.00 178.16 177.27 3h6i h ALA 360 N 0.98 1.32 -0.18 1.82 0.00 -0.58 -1.06 119.26 121.57 3h6i h ALA 360 Ca 0.15 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 3h6i h ALA 360 Cb 0.32 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3h6i h ALA 360 CO 0.00 0.46 -0.05 0.28 0.00 0.00 0.00 179.25 179.94 3h6i h VAL 361 N 0.57 1.29 -0.80 0.00 2.07 -0.70 -1.96 116.25 116.71 3h6i h VAL 361 Ca 0.12 -1.05 0.01 0.00 0.82 0.00 0.00 66.70 66.60 3h6i h VAL 361 Cb 0.33 1.62 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 3h6i h VAL 361 CO 0.01 0.31 0.53 -0.08 0.02 0.00 0.00 177.57 178.36 3h6i h GLU 362 N 0.06 1.06 -0.49 1.57 4.81 -0.67 0.14 114.58 121.06 3h6i h GLU 362 Ca 0.04 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 3h6i h GLU 362 Cb 0.51 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 3h6i h GLU 362 CO 0.02 0.70 0.02 -0.07 -0.73 0.00 0.00 179.01 178.95 3h6i h LEU 363 N 1.09 0.82 -0.62 1.64 3.38 -1.11 -2.05 115.31 118.47 3h6i h LEU 363 Ca 0.29 -0.30 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 3h6i h LEU 363 Cb -0.12 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 3h6i h LEU 363 CO -0.06 0.92 -0.68 -0.08 0.09 0.00 0.00 178.44 178.62 3h6i h GLU 364 N 0.71 0.04 -0.39 1.13 4.81 -1.05 -2.43 114.58 117.40 3h6i h GLU 364 Ca 0.14 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 3h6i h GLU 364 Cb 0.48 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 3h6i h GLU 364 CO 0.02 0.71 0.20 1.25 -0.73 0.00 0.00 179.01 180.46 3h6i h HIS 365 N 0.03 0.55 -0.09 0.92 2.76 -0.42 -1.03 115.15 117.88 3h6i h HIS 365 Ca -0.01 -0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.14 3h6i h HIS 365 Cb 1.21 -0.17 -0.00 0.00 1.55 0.00 0.00 27.41 30.00 3h6i h HIS 365 CO 0.00 0.44 0.03 -0.92 -1.30 0.00 0.00 177.93 176.18 3h6i h TYR 366 N 0.50 0.13 -0.94 5.26 3.20 -1.21 -1.73 116.97 122.19 3h6i h TYR 366 Ca 0.14 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.11 3h6i h TYR 366 Cb 0.08 -0.04 -0.08 0.00 1.54 0.00 0.00 36.73 38.23 3h6i h TYR 366 CO -0.02 0.27 0.57 1.49 -1.64 0.00 0.00 178.16 178.83 3h6i h GLU 367 N -0.04 0.87 -0.04 1.82 4.81 -1.18 0.11 114.58 120.93 3h6i h GLU 367 Ca 0.03 -0.05 -0.18 0.00 -0.13 0.00 0.00 59.36 59.02 3h6i h GLU 367 Cb 0.20 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 3h6i h GLU 367 CO -0.00 0.58 -0.77 0.87 -0.73 0.00 0.00 179.01 178.96 3h6i h LYS 368 N 0.90 0.31 -0.07 1.92 1.57 -0.99 0.10 116.57 120.31 3h6i h LYS 368 Ca 0.47 -0.28 -0.10 0.00 -1.87 0.00 0.00 60.65 58.87 3h6i h LYS 368 Cb 0.47 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.85 3h6i h LYS 368 CO -0.27 0.94 -0.36 -0.07 -0.57 0.00 0.00 179.45 179.12 3h6i h LEU 369 N 0.20 0.44 0.00 2.94 3.38 -0.70 -3.35 115.31 118.22 3h6i h LEU 369 Ca -0.03 -0.65 0.00 0.00 0.09 0.00 0.00 57.88 57.29 3h6i h LEU 369 Cb 1.35 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.97 3h6i h LEU 369 CO 0.13 1.02 -0.95 -0.62 0.09 0.00 0.00 178.44 178.10 3h6i n GLU 370 N -4.39 0.01 -0.23 1.13 -0.58 0.34 -4.98 120.64 111.95 3h6i n GLU 370 Ca -0.08 -0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.65 3h6i n GLU 370 Cb 0.52 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.89 3h6i n GLU 370 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h6i n GLY 371 N 1.50 1.75 3.22 0.62 0.00 0.34 -5.00 105.19 107.63 3h6i n GLY 371 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 3h6i n GLY 371 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h6i s VAL 372 N -2.96 0.07 0.71 1.61 0.11 -1.20 -4.97 120.40 113.77 3h6i s VAL 372 Ca 0.00 -0.57 -0.12 0.00 -2.93 0.00 0.00 61.98 58.37 3h6i s VAL 372 Cb 0.00 -0.68 0.02 0.00 -1.53 0.00 0.00 36.38 34.19 3h6i s VAL 372 CO 0.00 -0.31 1.08 -2.84 -3.33 0.00 0.00 175.10 169.70 3h6i s PRO 373 N -1.66 2.66 0.72 1.54 0.02 -1.26 -4.01 135.00 133.01 3h6i s PRO 373 Ca -0.11 1.13 -0.15 0.00 0.02 0.00 0.00 61.00 61.89 3h6i s PRO 373 Cb -0.04 -1.95 0.03 0.00 0.02 0.00 0.00 34.50 32.56 3h6i s PRO 373 CO 0.02 -1.33 1.17 -0.51 -0.33 0.00 0.00 177.00 176.02 3h6i s LEU 374 N -5.52 3.30 0.94 -5.54 1.43 -1.26 -5.00 118.68 107.04 3h6i s LEU 374 Ca 0.61 2.24 -0.12 0.00 -1.03 0.00 0.00 54.13 55.83 3h6i s LEU 374 Cb -0.16 -4.58 0.15 0.00 0.03 0.00 0.00 46.19 41.63 3h6i s LEU 374 CO 0.52 -2.13 1.10 0.42 0.23 0.00 0.00 176.35 176.48 3h6i s THR 375 N -2.14 2.31 0.27 5.49 -4.23 -1.26 -4.79 115.64 111.29 3h6i s THR 375 Ca 0.72 0.10 -0.02 0.00 -1.18 0.00 0.00 61.69 61.30 3h6i s THR 375 Cb -0.26 -2.65 0.27 0.00 1.34 0.00 0.00 72.50 71.20 3h6i s THR 375 CO 0.45 -0.13 1.88 0.15 -0.54 0.00 0.00 174.62 176.43 3h6i h PHE 376 N -1.67 1.20 -0.40 3.99 3.57 -1.96 -0.65 116.94 121.03 3h6i h PHE 376 Ca -0.52 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 60.96 3h6i h PHE 376 Cb 1.31 -0.40 -0.02 0.00 2.79 0.00 0.00 35.95 39.64 3h6i h PHE 376 CO 0.34 0.62 0.02 0.00 -2.23 0.00 0.00 178.31 177.06 3h6i h ALA 377 N 1.46 1.29 -0.16 2.41 0.00 -2.00 -1.06 119.26 121.20 3h6i h ALA 377 Ca 0.44 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 3h6i h ALA 377 Cb 0.18 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3h6i h ALA 377 CO -0.18 0.48 -0.41 0.78 0.00 0.00 0.00 179.25 179.93 3h6i h GLY 378 N 0.89 0.41 1.03 0.00 0.00 -1.52 -1.66 103.07 102.22 3h6i h GLY 378 Ca 0.13 -0.40 -0.08 0.00 0.00 0.00 0.00 47.33 46.98 3h6i h GLY 378 CO 0.01 0.36 0.05 0.50 0.00 0.00 0.00 176.54 177.46 3h6i h LYS 379 N 0.31 0.96 -0.48 4.80 1.57 -0.06 -1.05 116.57 122.61 3h6i h LYS 379 Ca 0.03 -0.28 -0.06 0.00 -1.87 0.00 0.00 60.65 58.47 3h6i h LYS 379 Cb 0.86 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.05 3h6i h LYS 379 CO 0.07 0.94 0.07 0.82 -0.57 0.00 0.00 179.45 180.78 3h6i h ILE 380 N 0.84 1.25 -0.61 1.86 2.04 -1.14 -1.40 117.51 120.36 3h6i h ILE 380 Ca 0.16 -0.94 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 3h6i h ILE 380 Cb 0.48 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 3h6i h ILE 380 CO 0.02 0.33 0.34 -1.13 0.00 0.00 0.00 178.15 177.71 3h6i h ASN 381 N 0.67 0.75 -0.64 1.72 -1.24 -1.01 0.10 115.58 115.94 3h6i h ASN 381 Ca 0.15 -0.09 -0.07 0.00 0.71 0.00 0.00 56.30 57.00 3h6i h ASN 381 Cb 0.41 -0.19 -0.03 0.00 0.73 0.00 0.00 38.32 39.24 3h6i h ASN 381 CO 0.01 0.63 0.14 0.03 -1.29 0.00 0.00 177.43 176.95 3h6i h ARG 382 N 0.82 1.06 -0.51 6.67 2.47 -1.01 -1.80 114.38 122.08 3h6i h ARG 382 Ca 0.21 -0.26 -0.03 0.00 -1.26 0.00 0.00 59.98 58.65 3h6i h ARG 382 Cb 0.04 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.20 3h6i h ARG 382 CO -0.04 0.95 0.20 1.25 0.56 0.00 0.00 179.97 182.89 3h6i h LEU 383 N 1.00 0.71 -0.87 3.04 5.85 -0.42 -1.96 115.31 122.66 3h6i h LEU 383 Ca 0.21 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 3h6i h LEU 383 Cb 0.38 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 3h6i h LEU 383 CO 0.01 0.69 0.49 0.00 -0.34 0.00 0.00 178.44 179.29 3h6i h ALA 384 N 1.05 1.12 -0.49 1.25 0.00 -0.72 -0.30 119.26 121.17 3h6i h ALA 384 Ca 0.17 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 3h6i h ALA 384 Cb 0.21 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3h6i h ALA 384 CO -0.01 0.61 0.00 0.82 0.00 0.00 0.00 179.25 180.67 3h6i h ILE 385 N 1.21 1.24 -0.30 0.00 2.04 -1.20 -0.43 117.51 120.08 3h6i h ILE 385 Ca 0.31 -1.01 -0.13 0.00 1.00 0.00 0.00 64.86 65.04 3h6i h ILE 385 Cb 0.01 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 36.95 3h6i h ILE 385 CO -0.05 0.36 -0.31 -0.03 0.00 0.00 0.00 178.15 178.12 3h6i h MET 386 N 0.75 0.74 -0.35 2.37 4.05 -0.84 -1.98 114.93 119.66 3h6i h MET 386 Ca 0.15 -0.39 -0.05 0.00 -0.28 0.00 0.00 59.70 59.12 3h6i h MET 386 Cb 0.45 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.26 3h6i h MET 386 CO 0.02 1.01 0.02 0.28 0.23 0.00 0.00 176.91 178.47 3h6i h VAL 387 N 0.49 1.25 0.00 -5.77 2.07 -0.83 -2.63 116.25 110.83 3h6i h VAL 387 Ca 0.05 -0.94 -0.08 0.00 0.82 0.00 0.00 66.70 66.55 3h6i h VAL 387 Cb 0.88 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 3h6i h VAL 387 CO 0.08 0.31 -0.37 0.03 0.02 0.00 0.00 177.57 177.64 3h6i h ARG 388 N 0.43 0.00 0.00 1.57 3.08 -1.08 -2.58 114.38 115.80 3h6i h ARG 388 Ca 0.10 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 3h6i h ARG 388 Cb 0.43 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 3h6i h ARG 388 CO 0.02 0.37 -0.16 0.78 -1.07 0.00 0.00 179.97 179.91 3h6i h GLY 389 N 1.54 0.00 0.99 0.04 0.00 -1.21 -1.80 103.07 102.62 3h6i h GLY 389 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 3h6i h GLY 389 CO 0.05 0.00 -1.20 0.70 0.00 0.00 0.00 176.54 176.09 3h6i n ASN 390 N -3.19 0.85 0.11 0.19 4.13 -1.01 -4.05 115.26 112.30 3h6i n ASN 390 Ca 0.02 0.35 -0.22 0.00 1.68 0.00 0.00 54.58 56.41 3h6i n ASN 390 Cb 0.51 0.32 -0.15 0.00 -1.54 0.00 0.00 39.78 38.91 3h6i n ASN 390 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 3h6i h LEU 391 N 0.00 0.67 -4.14 3.41 3.38 -1.39 -3.52 115.31 113.72 3h6i h LEU 391 Ca -0.08 -0.82 -0.67 0.00 0.09 0.00 0.00 57.88 56.41 3h6i h LEU 391 Cb 1.27 -0.22 -0.32 0.00 0.09 0.00 0.00 40.66 41.49 3h6i h LEU 391 CO 0.02 1.67 0.50 0.00 0.09 0.00 0.00 178.44 180.72 3h6i n ALA 392 N -2.74 6.06 0.00 1.53 0.00 -0.69 -5.11 120.51 119.56 3h6i n ALA 392 Ca -0.19 -3.69 0.00 0.00 0.00 0.00 0.00 53.44 49.57 3h6i n ALA 392 Cb 1.08 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 19.06 3h6i n ALA 392 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3h6i n LEU 399 N -0.79 0.00 -4.82 0.00 7.94 -1.26 -4.92 117.00 113.14 3h6i n LEU 399 Ca 0.57 0.00 -0.37 0.00 -1.11 0.00 0.00 56.01 55.10 3h6i n LEU 399 Cb 0.65 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.53 3h6i n LEU 399 CO 0.65 0.00 -0.08 0.00 -1.11 0.00 0.00 177.39 176.85 3h6i s ALA 400 N -1.69 3.76 -0.08 1.96 0.00 -1.26 -5.10 121.76 119.36 3h6i s ALA 400 Ca 0.00 -0.52 -0.11 0.00 0.00 0.00 0.00 51.96 51.33 3h6i s ALA 400 Cb 0.00 -2.17 -0.05 0.00 0.00 0.00 0.00 23.12 20.91 3h6i s ALA 400 CO 0.00 0.43 0.26 -0.51 0.00 0.00 0.00 175.76 175.94 3h6i s LEU 401 N -0.57 4.41 0.64 0.00 1.43 -1.26 -4.93 118.68 118.39 3h6i s LEU 401 Ca 0.16 0.67 -0.11 0.00 -1.03 0.00 0.00 54.13 53.82 3h6i s LEU 401 Cb -0.13 -2.31 -0.03 0.00 0.03 0.00 0.00 46.19 43.75 3h6i s LEU 401 CO 0.05 0.34 1.04 -2.16 0.23 0.00 0.00 176.35 175.85 3h6i s PRO 402 N -0.88 3.40 -0.21 1.29 0.04 -1.26 -4.46 135.00 132.91 3h6i s PRO 402 Ca 0.19 0.84 0.01 0.00 0.04 0.00 0.00 61.00 62.07 3h6i s PRO 402 Cb -0.14 -2.05 0.03 0.00 0.04 0.00 0.00 34.50 32.38 3h6i s PRO 402 CO 0.08 -0.73 -0.14 -1.17 0.04 0.00 0.00 177.00 175.08 3h6i s LEU 403 N -5.21 2.69 -0.15 -3.56 2.96 -0.47 -3.45 118.68 111.49 3h6i s LEU 403 Ca 0.56 -0.84 -0.06 0.00 -0.22 0.00 0.00 54.13 53.57 3h6i s LEU 403 Cb -0.12 -1.55 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 3h6i s LEU 403 CO 0.52 -0.07 0.07 -0.22 -1.32 0.00 0.00 176.35 175.34 3h6i s LEU 404 N 1.27 3.92 -0.05 -0.68 2.96 0.36 -1.69 118.68 124.77 3h6i s LEU 404 Ca 0.01 0.19 0.07 0.00 -0.22 0.00 0.00 54.13 54.18 3h6i s LEU 404 Cb -0.15 -1.97 -0.01 0.00 0.50 0.00 0.00 46.19 44.56 3h6i s LEU 404 CO -0.09 0.27 -0.25 0.00 -1.32 0.00 0.00 176.35 174.96 3h6i s ALA 405 N -0.21 2.16 0.35 5.97 0.00 -0.34 -0.70 121.76 128.99 3h6i s ALA 405 Ca 0.08 -1.07 -0.10 0.00 0.00 0.00 0.00 51.96 50.87 3h6i s ALA 405 Cb -0.12 -0.64 0.03 0.00 0.00 0.00 0.00 23.12 22.39 3h6i s ALA 405 CO 0.01 0.45 0.62 0.20 0.00 0.00 0.00 175.76 177.04 3h6i s GLY 406 N -0.29 0.86 -0.09 0.00 0.00 0.59 -0.65 107.32 107.74 3h6i s GLY 406 Ca 0.00 -1.08 -0.02 0.00 0.00 0.00 0.00 44.72 43.63 3h6i s GLY 406 CO 0.02 -0.63 0.00 -0.47 0.00 0.00 0.00 173.10 172.03 3h6i s TYR 407 N -2.87 0.75 -0.64 1.90 5.04 -0.37 0.67 117.35 121.84 3h6i s TYR 407 Ca 0.22 -0.29 -0.24 0.00 -2.44 0.00 0.00 57.07 54.33 3h6i s TYR 407 Cb -0.03 -0.85 0.05 0.00 0.35 0.00 0.00 41.96 41.49 3h6i s TYR 407 CO 0.15 -0.38 1.02 0.34 -1.34 0.00 0.00 175.55 175.35 3h6i s ASP 408 N 1.95 6.23 0.57 4.32 -1.08 0.10 -4.87 116.67 123.89 3h6i s ASP 408 Ca 0.04 -0.68 0.38 0.00 -0.52 0.00 0.00 52.55 51.77 3h6i s ASP 408 Cb -0.13 -2.45 1.87 0.00 -1.46 0.00 0.00 42.92 40.75 3h6i s ASP 408 CO -0.06 -1.46 2.14 -0.29 0.52 0.00 0.00 175.17 176.02 3h6i h ILE 409 N 6.00 0.00 -0.28 4.11 6.09 -1.97 -1.96 117.51 129.51 3h6i h ILE 409 Ca -0.28 -0.19 0.00 0.00 -1.37 0.00 0.00 64.86 63.02 3h6i h ILE 409 Cb 1.07 1.13 0.00 0.00 0.47 0.00 0.00 36.82 39.49 3h6i h ILE 409 CO 1.17 0.00 0.00 1.41 -3.07 0.00 0.00 178.15 177.66 3h6i n HIS 410 N -2.96 0.34 -2.37 2.19 8.25 -1.26 -4.96 115.22 114.45 3h6i n HIS 410 Ca -0.01 -0.17 -0.35 0.00 -0.26 0.00 0.00 57.72 56.93 3h6i n HIS 410 Cb 0.16 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.26 3h6i n HIS 410 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h6i s ALA 411 N -1.66 2.77 0.07 -1.41 0.00 -0.74 -4.98 121.76 115.82 3h6i s ALA 411 Ca 0.36 0.73 -0.20 0.00 0.00 0.00 0.00 51.96 52.84 3h6i s ALA 411 Cb 0.22 -3.31 -0.10 0.00 0.00 0.00 0.00 23.12 19.92 3h6i s ALA 411 CO 0.31 -0.58 1.52 0.66 0.00 0.00 0.00 175.76 177.67 3h6i h SER 412 N 1.33 0.31 -3.17 0.00 4.64 -1.93 -3.40 113.55 111.34 3h6i h SER 412 Ca -0.50 -0.28 -0.75 0.00 -0.47 0.00 0.00 61.79 59.79 3h6i h SER 412 Cb 1.24 -0.08 -0.24 0.00 -0.31 0.00 0.00 62.40 63.01 3h6i h SER 412 CO 0.58 0.52 -0.27 -0.62 -0.87 0.00 0.00 176.83 176.17 3h6i s ASP 413 N -5.79 6.14 0.60 4.97 2.15 -1.26 -4.96 116.67 118.53 3h6i s ASP 413 Ca -0.14 -1.65 0.30 0.00 0.43 0.00 0.00 52.55 51.50 3h6i s ASP 413 Cb 0.07 -2.19 1.71 0.00 -0.30 0.00 0.00 42.92 42.20 3h6i s ASP 413 CO 0.72 -0.78 2.10 -0.65 -0.17 0.00 0.00 175.17 176.39 3h6i h PRO 414 N 8.82 0.00 0.00 4.34 0.11 -1.94 -1.87 132.00 141.46 3h6i h PRO 414 Ca -0.29 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.76 3h6i h PRO 414 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 3h6i h PRO 414 CO 0.98 0.00 -0.30 1.96 -0.21 0.00 0.00 178.00 180.43 3h6i h GLN 415 N 0.00 0.00 0.00 1.05 1.08 -1.92 -3.05 115.11 112.26 3h6i h GLN 415 Ca 0.08 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.25 3h6i h GLN 415 Cb 0.50 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.87 3h6i h GLN 415 CO -0.00 0.30 -0.49 -1.13 -0.95 0.00 0.00 178.83 176.55 3h6i n SER 416 N -3.49 1.67 -0.03 1.46 3.41 -0.73 0.17 113.62 116.07 3h6i n SER 416 Ca -0.00 -3.48 0.14 0.00 -0.26 0.00 0.00 58.87 55.27 3h6i n SER 416 Cb 0.46 -0.47 0.66 0.00 -0.26 0.00 0.00 64.21 64.60 3h6i n SER 416 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h6i n ALA 417 N -0.92 2.60 -1.77 7.33 0.00 -1.03 -4.84 120.51 121.89 3h6i n ALA 417 Ca 0.16 -0.18 -0.40 0.00 0.00 0.00 0.00 53.44 53.02 3h6i n ALA 417 Cb 0.74 -1.42 -0.02 0.00 0.00 0.00 0.00 19.45 18.76 3h6i n ALA 417 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3h6i s GLY 418 N -2.64 2.97 -0.00 0.00 0.00 -1.26 0.02 107.32 106.40 3h6i s GLY 418 Ca 0.25 1.23 0.03 0.00 0.00 0.00 0.00 44.72 46.24 3h6i s GLY 418 CO 0.49 1.85 -0.11 0.50 0.00 0.00 0.00 173.10 175.84 3h6i s ARG 419 N -1.96 0.85 -0.10 2.90 1.81 0.21 -4.88 118.95 117.78 3h6i s ARG 419 Ca 0.52 -0.43 0.00 0.00 -1.72 0.00 0.00 55.73 54.10 3h6i s ARG 419 Cb -0.39 -0.82 0.02 0.00 -0.45 0.00 0.00 34.95 33.32 3h6i s ARG 419 CO 0.51 0.22 -0.08 0.42 -0.68 0.00 0.00 175.30 175.69 3h6i s ILE 420 N -0.35 0.99 -0.11 1.52 1.01 -1.26 -0.30 121.20 122.71 3h6i s ILE 420 Ca 0.03 -0.31 0.02 0.00 0.00 0.00 0.00 60.65 60.40 3h6i s ILE 420 Cb -0.05 -0.99 0.01 0.00 0.01 0.00 0.00 42.46 41.45 3h6i s ILE 420 CO -0.00 0.35 -0.15 -0.69 0.00 0.00 0.00 174.94 174.45 3h6i s VAL 421 N 1.41 1.48 0.37 2.92 1.01 0.13 -0.86 120.40 126.87 3h6i s VAL 421 Ca -0.01 -0.64 0.08 0.00 0.00 0.00 0.00 61.98 61.42 3h6i s VAL 421 Cb -0.13 -1.35 -0.06 0.00 0.00 0.00 0.00 36.38 34.83 3h6i s VAL 421 CO -0.05 0.44 0.03 -0.94 0.00 0.00 0.00 175.10 174.58 3h6i s SER 422 N 0.95 4.10 -0.07 3.32 1.04 -0.25 -0.48 113.70 122.31 3h6i s SER 422 Ca -0.07 -1.13 0.01 0.00 0.48 0.00 0.00 55.95 55.24 3h6i s SER 422 Cb -0.15 -0.46 0.02 0.00 0.10 0.00 0.00 66.02 65.52 3h6i s SER 422 CO -0.01 -0.35 -0.09 -0.36 0.98 0.00 0.00 173.24 173.42 3h6i s PHE 423 N -2.59 1.25 0.66 5.02 0.40 -1.22 -1.45 117.98 120.05 3h6i s PHE 423 Ca 0.36 -0.48 -0.07 0.00 -0.60 0.00 0.00 56.93 56.14 3h6i s PHE 423 Cb 0.03 -0.99 0.04 0.00 0.51 0.00 0.00 43.02 42.61 3h6i s PHE 423 CO 0.19 -0.31 0.98 0.16 0.70 0.00 0.00 175.22 176.95 3h6i s ASP 424 N 0.99 5.13 0.34 1.36 1.47 -0.75 -4.85 116.67 120.37 3h6i s ASP 424 Ca -0.09 0.59 0.15 0.00 1.18 0.00 0.00 52.55 54.38 3h6i s ASP 424 Cb -0.15 -1.37 1.12 0.00 -0.34 0.00 0.00 42.92 42.18 3h6i s ASP 424 CO 0.00 -1.39 1.64 0.00 0.68 0.00 0.00 175.17 176.10 3h6i h ALA 425 N -0.45 1.93 0.00 2.11 0.00 -1.99 0.33 119.26 121.19 3h6i h ALA 425 Ca -0.45 0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3h6i h ALA 425 Cb 1.29 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.31 3h6i h ALA 425 CO 0.61 -0.66 0.00 0.00 0.00 0.00 0.00 179.25 179.19 3h6i n ALA 426 N -2.34 2.31 -0.67 0.00 0.00 -1.26 -4.89 120.51 113.66 3h6i n ALA 426 Ca 0.32 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.64 3h6i n ALA 426 Cb 1.03 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 19.07 3h6i n ALA 426 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h6i n GLY 427 N 0.81 0.64 3.85 0.00 0.00 0.11 -4.99 105.19 105.61 3h6i n GLY 427 Ca 0.13 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 45.12 3h6i n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h6i s GLY 428 N -2.62 2.44 0.24 -0.02 0.00 -1.25 -4.71 107.32 101.40 3h6i s GLY 428 Ca 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 44.72 44.49 3h6i s GLY 428 CO 0.00 0.09 0.49 0.66 0.00 0.00 0.00 173.10 174.34 3h6i s TRP 429 N -1.43 3.47 -0.13 1.90 1.48 -1.26 -1.80 118.94 121.17 3h6i s TRP 429 Ca 0.36 0.58 -0.05 0.00 -1.06 0.00 0.00 56.10 55.93 3h6i s TRP 429 Cb -0.15 -2.04 0.06 0.00 -1.16 0.00 0.00 33.47 30.18 3h6i s TRP 429 CO 0.19 0.27 0.26 1.21 -4.06 0.00 0.00 176.95 174.81 3h6i s ASN 430 N -2.99 0.33 -0.38 -2.66 3.84 -0.53 -4.98 114.94 107.58 3h6i s ASN 430 Ca 0.43 0.59 -0.29 0.00 0.21 0.00 0.00 52.86 53.80 3h6i s ASN 430 Cb -0.11 0.68 0.02 0.00 -0.55 0.00 0.00 41.25 41.29 3h6i s ASN 430 CO 0.28 -0.24 1.08 -0.63 -2.79 0.00 0.00 177.10 174.81 3h6i s ILE 431 N 2.37 4.41 -0.00 -5.21 1.01 -1.26 -1.09 121.20 121.42 3h6i s ILE 431 Ca 0.01 1.51 -0.30 0.00 0.00 0.00 0.00 60.65 61.87 3h6i s ILE 431 Cb -0.12 -4.48 -0.06 0.00 0.01 0.00 0.00 42.46 37.82 3h6i s ILE 431 CO -0.08 -0.67 1.44 -1.61 0.00 0.00 0.00 174.94 174.01 3h6i s GLU 432 N 3.92 4.26 0.00 2.79 0.41 -0.04 -4.93 118.70 125.12 3h6i s GLU 432 Ca 0.46 2.01 0.15 0.00 -0.41 0.00 0.00 54.97 57.17 3h6i s GLU 432 Cb -0.10 -3.62 0.16 0.00 -1.78 0.00 0.00 34.13 28.79 3h6i s GLU 432 CO 0.21 -0.62 1.02 0.39 -0.49 0.00 0.00 175.26 175.78 3h6i n GLU 433 N 5.59 1.32 -0.29 1.61 -0.58 -1.26 -4.56 120.64 122.47 3h6i n GLU 433 Ca 0.14 -1.51 0.11 0.00 -0.42 0.00 0.00 57.16 55.48 3h6i n GLU 433 Cb 0.43 -1.29 0.28 0.00 -0.57 0.00 0.00 31.44 30.29 3h6i n GLU 433 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3h6i n GLU 434 N 0.83 2.54 0.00 3.49 1.02 -1.26 -4.97 120.64 122.29 3h6i n GLU 434 Ca 0.10 -2.37 0.00 0.00 -0.02 0.00 0.00 57.16 54.87 3h6i n GLU 434 Cb 0.39 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.28 3h6i n GLU 434 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3h6i n GLY 435 N 1.55 2.79 3.29 0.62 0.00 -1.26 -5.01 105.19 107.18 3h6i n GLY 435 Ca 0.22 -0.20 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 3h6i n GLY 435 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3h6i s TYR 436 N -2.36 0.15 0.15 1.61 1.13 -1.26 0.13 117.35 116.90 3h6i s TYR 436 Ca 0.00 -0.53 -0.17 0.00 -1.41 0.00 0.00 57.07 54.96 3h6i s TYR 436 Cb 0.00 0.03 0.04 0.00 -1.10 0.00 0.00 41.96 40.92 3h6i s TYR 436 CO 0.00 -0.65 0.45 -1.14 -2.51 0.00 0.00 175.55 171.70 3h6i s GLN 437 N -3.89 1.18 -0.04 -3.49 2.00 -0.03 -4.97 119.66 110.42 3h6i s GLN 437 Ca 0.09 -0.73 -0.13 0.00 -2.00 0.00 0.00 55.36 52.59 3h6i s GLN 437 Cb 0.03 0.50 0.02 0.00 0.80 0.00 0.00 33.01 34.36 3h6i s GLN 437 CO -0.07 -0.48 0.28 0.00 -0.50 0.00 0.00 175.29 174.52 3h6i s ALA 438 N -3.82 -0.71 0.13 1.58 0.00 -1.26 -1.29 121.76 116.40 3h6i s ALA 438 Ca 0.05 0.40 0.08 0.00 0.00 0.00 0.00 51.96 52.48 3h6i s ALA 438 Cb 0.01 -0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 3h6i s ALA 438 CO -0.09 -0.22 -0.18 0.14 0.00 0.00 0.00 175.76 175.40 3h6i s VAL 439 N -0.95 1.66 0.00 0.00 -7.23 -0.15 -4.86 120.40 108.87 3h6i s VAL 439 Ca -0.10 -1.74 0.00 0.00 -1.81 0.00 0.00 61.98 58.33 3h6i s VAL 439 Cb -0.05 -1.66 0.00 0.00 0.56 0.00 0.00 36.38 35.23 3h6i s VAL 439 CO 0.03 -0.26 0.00 0.61 -0.31 0.00 0.00 175.10 175.17 3h6i n GLY 440 N 0.62 -1.02 0.30 2.32 0.00 -1.26 -1.44 105.19 104.70 3h6i n GLY 440 Ca -0.16 -2.25 0.19 0.00 0.00 0.00 0.00 46.02 43.80 3h6i n GLY 440 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3h6i h SER 441 N 0.00 0.00 -0.34 1.61 4.64 -1.95 -2.30 113.55 115.20 3h6i h SER 441 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h6i h SER 441 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3h6i h SER 441 CO 0.00 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 3h6i n GLY 442 N -0.46 3.06 0.26 -0.77 0.00 -1.26 -4.79 105.19 101.23 3h6i n GLY 442 Ca -0.01 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.46 3h6i n GLY 442 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3h6i h SER 443 N 2.09 0.46 -0.78 1.61 4.64 -1.62 -1.07 113.55 118.88 3h6i h SER 443 Ca 0.00 0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 61.32 3h6i h SER 443 Cb 0.93 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 62.96 3h6i h SER 443 CO 0.06 0.27 0.29 -0.07 -0.87 0.00 0.00 176.83 176.51 3h6i h LEU 444 N 0.60 1.10 -0.55 5.97 4.07 -1.86 0.31 115.31 124.94 3h6i h LEU 444 Ca 0.33 -0.19 -0.13 0.00 0.08 0.00 0.00 57.88 57.98 3h6i h LEU 444 Cb 0.32 -0.29 -0.01 0.00 1.08 0.00 0.00 40.66 41.76 3h6i h LEU 444 CO -0.25 0.99 -0.22 -0.26 -1.08 0.00 0.00 178.44 177.61 3h6i h PHE 445 N 1.14 1.06 -0.52 1.13 0.04 -1.84 -1.01 116.94 116.94 3h6i h PHE 445 Ca 0.26 -0.26 -0.09 0.00 2.80 0.00 0.00 57.97 60.68 3h6i h PHE 445 Cb 0.25 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 38.13 3h6i h PHE 445 CO 0.02 1.05 -0.04 0.00 -0.60 0.00 0.00 178.31 178.74 3h6i h ALA 446 N 0.93 0.71 -0.38 2.45 0.00 -0.89 -2.11 119.26 119.97 3h6i h ALA 446 Ca 0.10 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.55 3h6i h ALA 446 Cb 0.78 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3h6i h ALA 446 CO 0.07 0.56 -0.36 0.87 0.00 0.00 0.00 179.25 180.39 3h6i h LYS 447 N 0.82 0.91 0.00 0.00 1.57 -0.78 -0.51 116.57 118.59 3h6i h LYS 447 Ca 0.14 -0.47 -0.08 0.00 -1.87 0.00 0.00 60.65 58.36 3h6i h LYS 447 Cb 0.59 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 3h6i h LYS 447 CO 0.04 1.13 -0.40 0.77 -0.57 0.00 0.00 179.45 180.41 3h6i h SER 448 N 0.73 0.00 0.02 0.86 0.02 -1.20 -0.13 113.55 113.85 3h6i h SER 448 Ca 0.06 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3h6i h SER 448 Cb 0.95 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.49 3h6i h SER 448 CO 0.09 0.40 -0.01 -1.28 -1.14 0.00 0.00 176.83 174.89 3h6i h SER 449 N 0.00 -0.03 -0.22 3.07 0.87 -1.15 -3.24 113.55 112.86 3h6i h SER 449 Ca -0.00 -0.63 0.06 0.00 -1.23 0.00 0.00 61.79 59.99 3h6i h SER 449 Cb 0.73 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.69 3h6i h SER 449 CO 0.05 0.64 0.16 0.24 -0.53 0.00 0.00 176.83 177.39 3h6i h MET 450 N -0.71 0.00 -0.90 2.24 2.07 -0.85 -1.75 114.93 115.03 3h6i h MET 450 Ca -0.00 0.00 0.03 0.00 -2.07 0.00 0.00 59.70 57.65 3h6i h MET 450 Cb 0.66 0.00 -0.05 0.00 -1.87 0.00 0.00 31.60 30.34 3h6i h MET 450 CO 0.01 0.00 0.60 -0.22 1.07 0.00 0.00 176.91 178.36 3h6i h LYS 451 N 0.00 1.13 0.00 1.72 3.64 -1.04 0.45 116.57 122.46 3h6i h LYS 451 Ca 0.10 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 3h6i h LYS 451 Cb 0.42 -0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 31.99 3h6i h LYS 451 CO -0.00 0.75 -0.78 0.87 -2.27 0.00 0.00 179.45 178.02 3h6i h LYS 452 N 1.16 0.00 -0.00 1.90 1.79 -1.40 -3.37 116.57 116.65 3h6i h LYS 452 Ca 0.35 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.82 3h6i h LYS 452 Cb -0.03 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.62 3h6i h LYS 452 CO -0.10 0.04 -0.52 1.28 -1.08 0.00 0.00 179.45 179.07 3h6i n LEU 453 N -2.81 0.71 0.03 2.94 4.77 -0.66 -4.59 117.00 117.39 3h6i n LEU 453 Ca 0.00 -0.54 0.05 0.00 -0.03 0.00 0.00 56.01 55.48 3h6i n LEU 453 Cb 0.57 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 42.12 3h6i n LEU 453 CO 0.39 0.16 1.15 0.22 -1.33 0.00 0.00 177.39 177.98 3h6i h TYR 454 N 0.24 0.44 -0.20 -1.77 3.20 -0.31 -2.01 116.97 116.55 3h6i h TYR 454 Ca 0.00 0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.94 3h6i h TYR 454 Cb 0.31 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.42 3h6i h TYR 454 CO 0.00 0.28 0.21 0.66 -1.64 0.00 0.00 178.16 177.66 3h6i h SER 455 N 0.48 0.00 1.18 -2.11 4.64 -1.83 0.28 113.55 116.18 3h6i h SER 455 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3h6i h SER 455 Cb -0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 3h6i h SER 455 CO -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.93 3h6i n GLN 456 N -3.88 0.18 -2.56 4.77 6.02 -0.76 -4.63 117.38 116.52 3h6i n GLN 456 Ca 0.02 0.21 -0.41 0.00 -0.01 0.00 0.00 57.00 56.81 3h6i n GLN 456 Cb 0.34 -1.73 -0.03 0.00 1.02 0.00 0.00 30.24 29.83 3h6i n GLN 456 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3h6i s VAL 457 N -3.11 3.88 -0.83 5.09 1.01 0.97 -4.72 120.40 122.69 3h6i s VAL 457 Ca 0.10 -0.55 0.12 0.00 0.00 0.00 0.00 61.98 61.64 3h6i s VAL 457 Cb 0.13 -5.03 -0.06 0.00 0.00 0.00 0.00 36.38 31.42 3h6i s VAL 457 CO 0.53 -1.92 0.59 0.35 0.00 0.00 0.00 175.10 174.65 3h6i n THR 458 N 6.80 0.00 -3.66 3.92 -2.24 -1.26 -4.76 114.28 113.08 3h6i n THR 458 Ca 0.28 -0.31 -0.03 0.00 -2.27 0.00 0.00 64.05 61.72 3h6i n THR 458 Cb 0.51 1.07 0.01 0.00 -2.10 0.00 0.00 70.33 69.83 3h6i n THR 458 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3h6i n ASP 459 N -0.71 -1.19 -0.07 3.42 5.68 -1.26 -4.62 116.55 117.79 3h6i n ASP 459 Ca 0.04 -1.69 -0.02 0.00 -0.50 0.00 0.00 54.79 52.62 3h6i n ASP 459 Cb 0.21 1.95 0.23 0.00 -1.14 0.00 0.00 41.12 42.37 3h6i n ASP 459 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 3h6i h GLY 460 N 1.24 0.75 0.81 6.12 0.00 -1.95 -2.05 103.07 108.00 3h6i h GLY 460 Ca -0.18 -0.45 -0.11 0.00 0.00 0.00 0.00 47.33 46.59 3h6i h GLY 460 CO 0.24 0.42 -0.35 -0.55 0.00 0.00 0.00 176.54 176.30 3h6i h ASP 461 N 0.67 0.53 0.42 0.19 3.32 -1.99 -0.64 116.42 118.92 3h6i h ASP 461 Ca 0.14 -0.59 -0.10 0.00 0.02 0.00 0.00 57.03 56.51 3h6i h ASP 461 Cb 0.34 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 3h6i h ASP 461 CO 0.01 1.02 -0.44 0.77 -1.72 0.00 0.00 179.24 178.88 3h6i h SER 462 N 0.07 0.04 -0.41 6.45 4.64 -1.89 -1.19 113.55 121.26 3h6i h SER 462 Ca -0.01 -0.02 -0.14 0.00 -0.47 0.00 0.00 61.79 61.16 3h6i h SER 462 Cb 0.96 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.03 3h6i h SER 462 CO 0.08 0.48 -0.27 1.23 -0.87 0.00 0.00 176.83 177.47 3h6i h GLY 463 N 1.33 1.02 1.09 -0.77 0.00 -1.10 -0.77 103.07 103.87 3h6i h GLY 463 Ca -0.00 -0.94 -0.12 0.00 0.00 0.00 0.00 47.33 46.27 3h6i h GLY 463 CO 0.06 0.85 -0.16 -2.00 0.00 0.00 0.00 176.54 175.29 3h6i h LEU 464 N 0.80 1.01 -0.43 3.11 5.85 -0.77 -1.76 115.31 123.11 3h6i h LEU 464 Ca 0.09 -0.37 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 3h6i h LEU 464 Cb 0.84 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 3h6i h LEU 464 CO 0.07 1.16 0.22 -0.09 -0.34 0.00 0.00 178.44 179.46 3h6i h ARG 465 N 0.86 0.61 -0.50 1.25 2.43 -0.96 -1.72 114.38 116.34 3h6i h ARG 465 Ca 0.12 -0.08 -0.08 0.00 -0.81 0.00 0.00 59.98 59.13 3h6i h ARG 465 Cb 0.73 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.15 3h6i h ARG 465 CO 0.06 0.50 -0.02 0.28 -1.51 0.00 0.00 179.97 179.29 3h6i h VAL 466 N 0.55 1.26 -0.54 0.20 2.07 -1.10 -1.03 116.25 117.67 3h6i h VAL 466 Ca 0.15 -1.11 0.06 0.00 0.82 0.00 0.00 66.70 66.62 3h6i h VAL 466 Cb 0.09 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 30.78 3h6i h VAL 466 CO -0.02 0.39 0.25 0.00 0.02 0.00 0.00 177.57 178.21 3h6i h ALA 467 N 0.93 0.69 -0.61 1.67 0.00 -1.00 0.11 119.26 121.05 3h6i h ALA 467 Ca 0.14 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 3h6i h ALA 467 Cb 0.54 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 3h6i h ALA 467 CO 0.03 -0.12 0.19 0.28 0.00 0.00 0.00 179.25 179.63 3h6i h VAL 468 N 0.48 1.24 -0.02 0.00 2.07 -1.15 -1.76 116.25 117.12 3h6i h VAL 468 Ca 0.25 -0.84 -0.09 0.00 0.82 0.00 0.00 66.70 66.84 3h6i h VAL 468 Cb 0.21 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 3h6i h VAL 468 CO -0.20 0.32 -0.41 -0.08 0.02 0.00 0.00 177.57 177.21 3h6i h GLU 469 N 0.87 0.05 -0.36 1.57 4.81 -0.55 -1.08 114.58 119.89 3h6i h GLU 469 Ca 0.20 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.25 3h6i h GLU 469 Cb 0.29 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 3h6i h GLU 469 CO -0.01 0.45 -0.41 0.00 -0.73 0.00 0.00 179.01 178.32 3h6i h ALA 470 N 1.55 0.60 -0.22 2.92 0.00 -0.42 -1.35 119.26 122.33 3h6i h ALA 470 Ca 0.00 -0.46 -0.10 0.00 0.00 0.00 0.00 54.91 54.35 3h6i h ALA 470 Cb 0.75 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3h6i h ALA 470 CO 0.06 0.68 -0.30 -0.07 0.00 0.00 0.00 179.25 179.61 3h6i h LEU 471 N 0.72 0.45 -0.46 0.00 3.38 -1.11 0.28 115.31 118.55 3h6i h LEU 471 Ca 0.05 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.76 3h6i h LEU 471 Cb 0.99 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 3h6i h LEU 471 CO 0.10 0.73 -0.12 0.22 0.09 0.00 0.00 178.44 179.46 3h6i h TYR 472 N 0.38 1.00 -0.31 1.13 3.20 -0.98 -0.98 116.97 120.41 3h6i h TYR 472 Ca 0.05 -0.22 -0.12 0.00 3.14 0.00 0.00 58.73 61.58 3h6i h TYR 472 Cb 0.72 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 3h6i h TYR 472 CO 0.02 0.98 -0.30 -0.44 -1.64 0.00 0.00 178.16 176.79 3h6i h ASP 473 N 0.73 0.67 -0.48 -2.11 3.32 -0.48 -1.41 116.42 116.65 3h6i h ASP 473 Ca 0.12 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 3h6i h ASP 473 Cb 0.66 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 3h6i h ASP 473 CO 0.05 0.93 0.28 0.00 -1.72 0.00 0.00 179.24 178.78 3h6i h ALA 474 N 1.11 0.62 -0.13 3.45 0.00 -0.60 -2.72 119.26 121.00 3h6i h ALA 474 Ca 0.07 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 3h6i h ALA 474 Cb 0.79 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 3h6i h ALA 474 CO 0.06 0.13 -0.39 0.00 0.00 0.00 0.00 179.25 179.06 3h6i h ALA 475 N 1.12 1.11 0.00 0.00 0.00 -1.08 0.22 119.26 120.63 3h6i h ALA 475 Ca 0.17 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 3h6i h ALA 475 Cb 0.03 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 3h6i h ALA 475 CO -0.03 0.58 -0.14 0.22 0.00 0.00 0.00 179.25 179.88 3h6i h ASP 476 N 0.23 0.00 0.00 0.00 3.58 -0.96 -3.31 116.42 115.97 3h6i h ASP 476 Ca 0.02 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.47 3h6i h ASP 476 Cb 0.79 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.84 3h6i h ASP 476 CO 0.06 0.14 -0.54 0.47 -2.88 0.00 0.00 179.24 176.49 3h6i n ASP 477 N -3.45 2.34 -4.03 2.28 8.00 -0.82 -4.95 116.55 115.91 3h6i n ASP 477 Ca -0.01 -0.27 -0.31 0.00 0.71 0.00 0.00 54.79 54.91 3h6i n ASP 477 Cb 0.31 1.03 -0.16 0.00 -0.02 0.00 0.00 41.12 42.28 3h6i n ASP 477 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3h6i s ASP 478 N -1.61 3.84 0.55 -2.24 2.15 0.72 -5.00 116.67 115.08 3h6i s ASP 478 Ca 0.00 -1.10 0.37 0.00 0.43 0.00 0.00 52.55 52.24 3h6i s ASP 478 Cb 0.01 -1.38 1.91 0.00 -0.30 0.00 0.00 42.92 43.16 3h6i s ASP 478 CO 0.05 -0.16 2.11 0.77 -0.17 0.00 0.00 175.17 177.77 3h6i h SER 479 N 7.89 0.00 0.29 -0.34 4.64 -1.85 -1.28 113.55 122.90 3h6i h SER 479 Ca -0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 3h6i h SER 479 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 3h6i h SER 479 CO 0.48 0.00 -0.08 0.00 -0.87 0.00 0.00 176.83 176.36 3h6i n ALA 480 N -1.99 2.72 -2.88 5.18 0.00 -1.26 -4.76 120.51 117.51 3h6i n ALA 480 Ca -0.02 -0.27 -0.33 0.00 0.00 0.00 0.00 53.44 52.82 3h6i n ALA 480 Cb 0.10 -1.35 -0.13 0.00 0.00 0.00 0.00 19.45 18.07 3h6i n ALA 480 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3h6i s THR 481 N -2.38 3.43 -0.06 0.00 2.01 -0.48 -4.76 115.64 113.41 3h6i s THR 481 Ca 0.32 -0.54 -0.23 0.00 0.31 0.00 0.00 61.69 61.55 3h6i s THR 481 Cb 0.20 -2.45 -0.04 0.00 0.01 0.00 0.00 72.50 70.23 3h6i s THR 481 CO 0.45 0.54 0.68 -0.83 -0.69 0.00 0.00 174.62 174.76 3h6i s GLY 482 N 0.03 2.61 0.85 4.40 0.00 -1.26 -4.49 107.32 109.46 3h6i s GLY 482 Ca -0.02 0.11 -0.13 0.00 0.00 0.00 0.00 44.72 44.68 3h6i s GLY 482 CO 0.04 1.10 1.21 -0.32 0.00 0.00 0.00 173.10 175.13 3h6i s GLY 483 N 0.66 1.68 0.24 0.20 0.00 -1.26 -4.53 107.32 104.30 3h6i s GLY 483 Ca 0.36 -0.93 -0.31 0.00 0.00 0.00 0.00 44.72 43.85 3h6i s GLY 483 CO 0.18 -0.34 1.61 -4.14 0.00 0.00 0.00 173.10 170.41 3h6i s PRO 484 N -5.65 4.15 -0.52 2.90 0.02 -1.26 -4.92 135.00 129.72 3h6i s PRO 484 Ca 0.66 2.52 -0.10 0.00 0.02 0.00 0.00 61.00 64.11 3h6i s PRO 484 Cb -0.08 -3.07 0.13 0.00 0.02 0.00 0.00 34.50 31.50 3h6i s PRO 484 CO 0.50 -0.64 0.41 0.34 -0.33 0.00 0.00 177.00 177.27 3h6i s ASP 485 N 0.80 5.82 0.35 2.53 -1.08 0.08 -4.94 116.67 120.23 3h6i s ASP 485 Ca 0.68 -2.02 0.18 0.00 -0.52 0.00 0.00 52.55 50.86 3h6i s ASP 485 Cb -0.47 -2.04 0.58 0.00 -1.46 0.00 0.00 42.92 39.53 3h6i s ASP 485 CO 0.40 -0.69 1.69 -0.07 0.52 0.00 0.00 175.17 177.02 3h6i h LEU 486 N 8.36 0.00 -0.17 -1.34 3.38 -1.93 0.74 115.31 124.36 3h6i h LEU 486 Ca -0.19 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 3h6i h LEU 486 Cb 1.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 3h6i h LEU 486 CO 0.87 0.42 -0.09 0.58 0.09 0.00 0.00 178.44 180.31 3h6i h VAL 487 N 0.00 1.31 -0.00 1.22 2.07 -1.96 -3.28 116.25 115.61 3h6i h VAL 487 Ca -0.00 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.37 3h6i h VAL 487 Cb 0.97 1.71 0.00 0.00 -1.52 0.00 0.00 31.29 32.45 3h6i h VAL 487 CO 0.05 0.34 -0.64 0.54 0.02 0.00 0.00 177.57 177.88 3h6i n ARG 488 N -4.60 0.06 -2.88 1.57 1.74 -1.20 -4.98 116.66 106.36 3h6i n ARG 488 Ca -0.05 -0.04 -0.09 0.00 -0.77 0.00 0.00 57.85 56.89 3h6i n ARG 488 Cb 0.31 -1.50 0.03 0.00 -1.02 0.00 0.00 32.46 30.28 3h6i n ARG 488 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h6i n GLY 489 N 1.49 0.34 3.35 -0.13 0.00 0.13 -5.04 105.19 105.33 3h6i n GLY 489 Ca 0.05 -0.33 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 3h6i n GLY 489 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h6i s ILE 490 N -3.08 3.03 0.17 -0.61 1.01 -0.48 -5.01 121.20 116.23 3h6i s ILE 490 Ca 0.22 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 60.24 3h6i s ILE 490 Cb -0.10 -2.28 -0.05 0.00 0.01 0.00 0.00 42.46 40.04 3h6i s ILE 490 CO 0.27 0.51 -0.05 -0.36 0.00 0.00 0.00 174.94 175.31 3h6i s PHE 491 N 0.56 1.29 0.62 3.97 0.40 -1.26 -0.74 117.98 122.80 3h6i s PHE 491 Ca -0.08 -0.87 -0.18 0.00 -0.60 0.00 0.00 56.93 55.20 3h6i s PHE 491 Cb -0.16 -0.70 -0.03 0.00 0.51 0.00 0.00 43.02 42.64 3h6i s PHE 491 CO 0.04 -0.03 1.11 -2.30 0.70 0.00 0.00 175.22 174.74 3h6i n PRO 492 N -0.24 1.01 -3.57 0.24 -0.02 -1.26 -4.84 135.00 126.31 3h6i n PRO 492 Ca -0.08 0.39 -0.24 0.00 -2.02 0.00 0.00 63.50 61.55 3h6i n PRO 492 Cb 0.62 -2.33 -0.02 0.00 -0.02 0.00 0.00 33.50 31.75 3h6i n PRO 492 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3h6i s THR 493 N -1.45 5.16 -0.04 3.45 -4.23 -0.95 -4.94 115.64 112.63 3h6i s THR 493 Ca 0.78 -0.54 -0.26 0.00 -1.18 0.00 0.00 61.69 60.50 3h6i s THR 493 Cb -0.40 -3.83 0.06 0.00 1.34 0.00 0.00 72.50 69.66 3h6i s THR 493 CO 0.44 -0.42 0.56 0.00 -0.54 0.00 0.00 174.62 174.67 3h6i s ALA 494 N -2.14 -1.46 -0.03 3.99 0.00 -1.26 -1.97 121.76 118.88 3h6i s ALA 494 Ca 0.38 1.01 0.05 0.00 0.00 0.00 0.00 51.96 53.40 3h6i s ALA 494 Cb -0.10 0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 3h6i s ALA 494 CO 0.33 -0.34 -0.18 0.08 0.00 0.00 0.00 175.76 175.66 3h6i s VAL 495 N -1.23 1.43 -0.08 0.00 1.01 -0.67 -0.84 120.40 120.02 3h6i s VAL 495 Ca -0.12 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.16 3h6i s VAL 495 Cb -0.02 -1.22 -0.01 0.00 0.00 0.00 0.00 36.38 35.13 3h6i s VAL 495 CO 0.08 0.41 -0.20 -0.63 0.00 0.00 0.00 175.10 174.77 3h6i s ILE 496 N -0.12 2.51 -0.07 2.22 1.01 -0.43 -1.55 121.20 124.76 3h6i s ILE 496 Ca -0.00 -0.89 0.02 0.00 0.00 0.00 0.00 60.65 59.79 3h6i s ILE 496 Cb -0.10 -1.98 0.01 0.00 0.01 0.00 0.00 42.46 40.41 3h6i s ILE 496 CO 0.01 0.56 -0.14 -0.63 0.00 0.00 0.00 174.94 174.75 3h6i s ILE 497 N -0.03 1.26 0.00 2.92 1.01 -0.23 -0.88 121.20 125.25 3h6i s ILE 497 Ca -0.06 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.05 3h6i s ILE 497 Cb -0.15 -1.14 0.00 0.00 0.01 0.00 0.00 42.46 41.18 3h6i s ILE 497 CO 0.05 0.38 0.00 -0.90 0.00 0.00 0.00 174.94 174.47 3h6i n ASP 498 N 3.84 0.00 0.27 3.58 5.68 -1.08 -1.22 116.55 127.62 3h6i n ASP 498 Ca -0.22 -0.78 0.18 0.00 -0.50 0.00 0.00 54.79 53.46 3h6i n ASP 498 Cb 0.52 0.00 0.88 0.00 -1.14 0.00 0.00 41.12 41.38 3h6i n ASP 498 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3h6i h ALA 499 N 1.11 1.50 -0.24 2.12 0.00 -1.94 0.11 119.26 121.92 3h6i h ALA 499 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h6i h ALA 499 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3h6i h ALA 499 CO 0.00 -0.32 0.00 -0.25 0.00 0.00 0.00 179.25 178.68 3h6i n ASP 500 N -3.25 2.44 0.00 0.00 8.00 -1.26 -5.05 116.55 117.44 3h6i n ASP 500 Ca 0.00 -1.83 0.00 0.00 0.71 0.00 0.00 54.79 53.67 3h6i n ASP 500 Cb 0.35 -0.15 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 3h6i n ASP 500 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h6i n GLY 501 N 1.29 0.95 3.70 0.44 0.00 0.36 -5.00 105.19 106.93 3h6i n GLY 501 Ca 0.17 -2.17 -0.39 0.00 0.00 0.00 0.00 46.02 43.63 3h6i n GLY 501 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6i s ALA 502 N -1.27 3.45 0.05 4.61 0.00 0.91 -2.64 121.76 126.88 3h6i s ALA 502 Ca 0.00 -0.10 0.04 0.00 0.00 0.00 0.00 51.96 51.90 3h6i s ALA 502 Cb 0.00 -2.88 -0.02 0.00 0.00 0.00 0.00 23.12 20.22 3h6i s ALA 502 CO 0.00 -0.24 -0.13 0.14 0.00 0.00 0.00 175.76 175.53 3h6i s VAL 503 N 1.17 0.99 0.06 0.00 -7.23 -0.06 -4.99 120.40 110.34 3h6i s VAL 503 Ca 0.31 -1.08 -0.30 0.00 -1.81 0.00 0.00 61.98 59.10 3h6i s VAL 503 Cb -0.16 -0.93 -0.05 0.00 0.56 0.00 0.00 36.38 35.79 3h6i s VAL 503 CO 0.13 -0.13 1.06 -1.81 -0.31 0.00 0.00 175.10 174.03 3h6i s ASP 504 N -1.37 7.29 0.04 4.85 1.01 -1.26 -1.31 116.67 125.92 3h6i s ASP 504 Ca -0.01 1.84 -0.30 0.00 0.71 0.00 0.00 52.55 54.79 3h6i s ASP 504 Cb -0.09 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.22 3h6i s ASP 504 CO 0.01 -0.28 1.00 -0.69 0.21 0.00 0.00 175.17 175.43 3h6i s VAL 505 N 0.69 4.64 0.29 -1.27 1.01 -0.02 -4.92 120.40 120.83 3h6i s VAL 505 Ca 0.53 1.98 -0.30 0.00 0.00 0.00 0.00 61.98 64.19 3h6i s VAL 505 Cb -0.25 -4.27 -0.11 0.00 0.00 0.00 0.00 36.38 31.76 3h6i s VAL 505 CO 0.30 0.20 1.54 -2.84 0.00 0.00 0.00 175.10 174.29 3h6i s PRO 506 N 0.71 4.17 0.41 2.72 0.02 -1.26 -4.65 135.00 137.11 3h6i s PRO 506 Ca 0.51 2.49 0.17 0.00 0.02 0.00 0.00 61.00 64.20 3h6i s PRO 506 Cb -0.23 -3.04 1.07 0.00 0.02 0.00 0.00 34.50 32.32 3h6i s PRO 506 CO 0.29 -0.56 1.85 1.49 -0.33 0.00 0.00 177.00 179.75 3h6i h GLU 507 N 4.73 0.41 -0.48 5.54 4.81 -1.94 -0.66 114.58 127.00 3h6i h GLU 507 Ca -0.47 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 58.68 3h6i h GLU 507 Cb 1.22 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 3h6i h GLU 507 CO 0.77 0.27 0.06 0.66 -0.73 0.00 0.00 179.01 180.04 3h6i h SER 508 N 0.42 0.71 -0.45 1.04 4.64 -1.99 0.11 113.55 118.02 3h6i h SER 508 Ca 0.47 -0.14 -0.14 0.00 -0.47 0.00 0.00 61.79 61.51 3h6i h SER 508 Cb 1.16 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 63.05 3h6i h SER 508 CO -0.18 0.74 -0.26 -0.09 -0.87 0.00 0.00 176.83 176.17 3h6i h ARG 509 N 0.72 0.98 -0.23 4.77 2.43 -1.50 -2.55 114.38 119.00 3h6i h ARG 509 Ca 0.15 -0.45 -0.10 0.00 -0.81 0.00 0.00 59.98 58.78 3h6i h ARG 509 Cb 0.35 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 3h6i h ARG 509 CO 0.01 1.12 -0.27 0.82 -1.51 0.00 0.00 179.97 180.14 3h6i h ILE 510 N 0.82 1.27 -0.52 1.20 2.04 -1.15 -2.75 117.51 118.41 3h6i h ILE 510 Ca 0.10 -1.28 -0.01 0.00 1.00 0.00 0.00 64.86 64.67 3h6i h ILE 510 Cb 0.85 1.38 -0.02 0.00 -0.74 0.00 0.00 36.82 38.28 3h6i h ILE 510 CO 0.07 0.40 0.29 0.00 0.00 0.00 0.00 178.15 178.91 3h6i h ALA 511 N 1.33 0.67 -0.50 1.87 0.00 -0.57 -0.36 119.26 121.70 3h6i h ALA 511 Ca 0.06 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 3h6i h ALA 511 Cb 0.67 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3h6i h ALA 511 CO 0.05 0.19 -0.15 0.93 0.00 0.00 0.00 179.25 180.27 3h6i h GLU 512 N 0.70 0.95 -0.69 0.00 5.08 -1.32 -0.60 114.58 118.71 3h6i h GLU 512 Ca 0.18 -0.36 -0.07 0.00 -1.00 0.00 0.00 59.36 58.11 3h6i h GLU 512 Cb 0.05 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 3h6i h GLU 512 CO -0.03 1.03 0.14 -0.07 -1.00 0.00 0.00 179.01 179.08 3h6i h LEU 513 N 0.84 1.07 -0.43 1.33 3.38 -1.19 -0.44 115.31 119.87 3h6i h LEU 513 Ca 0.13 -0.24 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 3h6i h LEU 513 Cb 0.70 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3h6i h LEU 513 CO 0.05 1.04 -0.20 0.00 0.09 0.00 0.00 178.44 179.42 3h6i h ALA 514 N 1.09 0.61 -0.70 1.53 0.00 -0.78 -1.68 119.26 119.33 3h6i h ALA 514 Ca 0.21 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 3h6i h ALA 514 Cb 0.41 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 3h6i h ALA 514 CO 0.01 0.57 0.30 0.00 0.00 0.00 0.00 179.25 180.13 3h6i h ARG 515 N 0.73 1.01 -0.24 0.00 3.08 -0.80 -1.34 114.38 116.82 3h6i h ARG 515 Ca 0.10 -0.15 -0.16 0.00 0.07 0.00 0.00 59.98 59.83 3h6i h ARG 515 Cb 0.76 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 3h6i h ARG 515 CO 0.06 0.80 -0.51 0.00 -1.07 0.00 0.00 179.97 179.25 3h6i h ALA 516 N 1.34 0.65 -0.60 0.04 0.00 -0.85 -1.27 119.26 118.57 3h6i h ALA 516 Ca 0.24 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3h6i h ALA 516 Cb 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3h6i h ALA 516 CO -0.03 0.68 0.32 0.82 0.00 0.00 0.00 179.25 181.04 3h6i h ILE 517 N 0.53 1.20 -0.01 0.00 2.04 -0.84 0.37 117.51 120.79 3h6i h ILE 517 Ca 0.02 -0.51 -0.00 0.00 1.00 0.00 0.00 64.86 65.37 3h6i h ILE 517 Cb 1.07 0.44 -0.00 0.00 -0.74 0.00 0.00 36.82 37.59 3h6i h ILE 517 CO 0.10 0.22 -0.00 0.40 0.00 0.00 0.00 178.15 178.87 3h6i h ILE 518 N 0.81 1.26 -0.89 -0.67 2.04 -1.06 -2.06 117.51 116.94 3h6i h ILE 518 Ca 0.21 -0.76 0.04 0.00 1.00 0.00 0.00 64.86 65.35 3h6i h ILE 518 Cb 0.06 1.76 -0.06 0.00 -0.74 0.00 0.00 36.82 37.84 3h6i h ILE 518 CO -0.03 0.20 0.57 -0.08 0.00 0.00 0.00 178.15 178.81 3h6i h GLU 519 N -0.31 1.05 -0.47 2.37 4.81 -1.21 -1.53 114.58 119.29 3h6i h GLU 519 Ca 0.00 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.10 3h6i h GLU 519 Cb 0.32 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 3h6i h GLU 519 CO 0.00 0.70 0.03 1.03 -0.73 0.00 0.00 179.01 180.03 3h6i h SER 520 N 1.08 0.79 1.07 1.04 0.87 -0.76 -2.97 113.55 114.67 3h6i h SER 520 Ca 0.36 -0.29 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 3h6i h SER 520 Cb 0.06 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.81 3h6i h SER 520 CO -0.14 0.88 0.00 0.03 -0.53 0.00 0.00 176.83 177.08 3h6i h ARG 521 N 0.66 0.00 0.00 2.24 3.08 -0.98 -3.51 114.38 115.87 3h6i h ARG 521 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 3h6i h ARG 521 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.51 3h6i h ARG 521 CO 0.02 0.00 0.00 0.43 -1.07 0.00 0.00 179.97 179.35