#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 2.50 0.15 12.58 -1.09 -0.64 -2.33 121.20 132.38 3h6i s ILE 303 Ca 0.00 -0.89 0.10 0.00 -2.23 0.00 0.00 60.65 57.63 3h6i s ILE 303 Cb 0.00 -1.97 -0.04 0.00 -1.58 0.00 0.00 42.46 38.87 3h6i s ILE 303 CO 0.00 0.56 -0.24 0.68 -1.23 0.00 0.00 174.94 174.72 3h6i s VAL 304 N -0.10 2.14 -0.07 2.92 -7.23 -0.26 -1.10 120.40 116.69 3h6i s VAL 304 Ca -0.04 -1.85 -0.09 0.00 -1.81 0.00 0.00 61.98 58.19 3h6i s VAL 304 Cb -0.14 -1.95 0.02 0.00 0.56 0.00 0.00 36.38 34.87 3h6i s VAL 304 CO 0.04 -0.07 0.24 0.00 -0.31 0.00 0.00 175.10 174.99 3h6i s ALA 305 N -1.45 -0.59 -0.01 1.32 0.00 -0.50 -1.11 121.76 119.42 3h6i s ALA 305 Ca 0.16 0.53 -0.15 0.00 0.00 0.00 0.00 51.96 52.50 3h6i s ALA 305 Cb -0.09 -0.28 0.02 0.00 0.00 0.00 0.00 23.12 22.78 3h6i s ALA 305 CO 0.07 -0.15 0.32 -0.48 0.00 0.00 0.00 175.76 175.53 3h6i s LEU 306 N -0.25 0.82 -0.03 0.00 0.05 0.14 -1.44 118.68 117.97 3h6i s LEU 306 Ca -0.04 0.07 -0.08 0.00 0.05 0.00 0.00 54.13 54.13 3h6i s LEU 306 Cb -0.03 1.31 -0.05 0.00 -2.05 0.00 0.00 46.19 45.37 3h6i s LEU 306 CO 0.01 -0.47 0.26 -0.54 -0.55 0.00 0.00 176.35 175.06 3h6i s LYS 307 N -1.46 3.61 0.14 1.48 1.02 0.10 -0.79 119.74 123.83 3h6i s LYS 307 Ca -0.13 0.02 0.01 0.00 0.02 0.00 0.00 55.97 55.89 3h6i s LYS 307 Cb -0.05 -3.14 -0.04 0.00 -0.52 0.00 0.00 37.83 34.08 3h6i s LYS 307 CO 0.04 0.70 0.01 1.52 -0.92 0.00 0.00 175.35 176.69 3h6i s TYR 308 N -1.17 0.98 0.01 3.18 -0.85 -0.59 -4.95 117.35 113.96 3h6i s TYR 308 Ca 0.23 -1.08 -0.30 0.00 -0.52 0.00 0.00 57.07 55.40 3h6i s TYR 308 Cb -0.14 -0.57 -0.08 0.00 0.38 0.00 0.00 41.96 41.56 3h6i s TYR 308 CO 0.12 -0.33 1.91 -2.14 -1.52 0.00 0.00 175.55 173.59 3h6i s PRO 309 N -3.95 4.12 0.00 -3.49 0.02 -1.26 -1.19 135.00 129.25 3h6i s PRO 309 Ca 0.21 2.51 0.00 0.00 0.02 0.00 0.00 61.00 63.73 3h6i s PRO 309 Cb 0.07 -4.13 0.00 0.00 0.02 0.00 0.00 34.50 30.46 3h6i s PRO 309 CO 0.01 -0.96 0.00 0.41 -0.33 0.00 0.00 177.00 176.12 3h6i n GLY 310 N 4.49 0.97 0.00 0.52 0.00 0.01 -4.64 105.19 106.54 3h6i n GLY 310 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -1.74 1.16 3.23 -0.02 0.00 -0.33 -4.18 105.19 103.31 3h6i n GLY 311 Ca 0.00 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.82 0.05 -0.04 1.61 0.11 -0.13 -1.54 120.40 119.63 3h6i s VAL 312 Ca 0.00 -0.38 0.04 0.00 -2.93 0.00 0.00 61.98 58.71 3h6i s VAL 312 Cb 0.00 -0.58 0.00 0.00 -1.53 0.00 0.00 36.38 34.27 3h6i s VAL 312 CO 0.00 -0.21 -0.15 0.54 -3.33 0.00 0.00 175.10 171.95 3h6i s VAL 313 N -1.01 1.28 -0.08 2.04 0.11 0.03 -0.63 120.40 122.14 3h6i s VAL 313 Ca -0.11 -0.62 0.04 0.00 -2.93 0.00 0.00 61.98 58.36 3h6i s VAL 313 Cb -0.05 -1.11 0.00 0.00 -1.53 0.00 0.00 36.38 33.69 3h6i s VAL 313 CO 0.03 0.38 -0.19 -0.32 -3.33 0.00 0.00 175.10 171.67 3h6i s MET 314 N 0.17 2.38 -0.01 1.54 1.75 -0.44 -0.68 119.30 124.00 3h6i s MET 314 Ca -0.06 -0.68 0.03 0.00 -1.25 0.00 0.00 55.69 53.73 3h6i s MET 314 Cb -0.12 -1.88 -0.01 0.00 2.84 0.00 0.00 34.83 35.67 3h6i s MET 314 CO 0.02 0.15 -0.09 0.00 -0.65 0.00 0.00 175.02 174.45 3h6i s ALA 315 N 0.38 0.78 0.07 4.11 0.00 -0.27 -0.97 121.76 125.87 3h6i s ALA 315 Ca -0.14 -0.39 0.06 0.00 0.00 0.00 0.00 51.96 51.49 3h6i s ALA 315 Cb -0.16 -0.22 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 3h6i s ALA 315 CO 0.06 0.18 -0.16 0.20 0.00 0.00 0.00 175.76 176.04 3h6i s GLY 316 N -0.14 0.95 0.99 0.00 0.00 -0.32 -1.10 107.32 107.69 3h6i s GLY 316 Ca 0.02 -1.04 -0.15 0.00 0.00 0.00 0.00 44.72 43.55 3h6i s GLY 316 CO -0.00 -1.05 1.21 0.51 0.00 0.00 0.00 173.10 173.76 3h6i s ASP 317 N -1.70 2.86 0.00 1.64 -4.77 -0.98 -1.56 116.67 112.15 3h6i s ASP 317 Ca 0.00 0.61 0.08 0.00 -3.30 0.00 0.00 52.55 49.94 3h6i s ASP 317 Cb -0.10 -0.90 0.19 0.00 -1.09 0.00 0.00 42.92 41.02 3h6i s ASP 317 CO 0.03 -2.92 1.08 0.54 0.70 0.00 0.00 175.17 174.59 3h6i n ARG 318 N -3.95 2.19 -3.28 2.11 5.12 -1.26 -4.54 116.66 113.05 3h6i n ARG 318 Ca 0.11 -1.67 -0.28 0.00 -1.93 0.00 0.00 57.85 54.08 3h6i n ARG 318 Cb 0.60 -1.19 -0.03 0.00 -1.16 0.00 0.00 32.46 30.68 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 -0.92 3.61 -0.11 5.56 3.52 -1.26 -1.30 118.95 128.06 3h6i s ARG 319 Ca 0.15 -0.01 -0.07 0.00 -0.13 0.00 0.00 55.73 55.68 3h6i s ARG 319 Cb 0.08 -2.62 0.04 0.00 -1.56 0.00 0.00 34.95 30.89 3h6i s ARG 319 CO 0.11 0.17 0.26 -1.54 -0.81 0.00 0.00 175.30 173.49 3h6i s SER 320 N -3.35 -0.28 0.11 -2.12 1.04 -1.06 -4.81 113.70 103.23 3h6i s SER 320 Ca 0.44 0.54 0.09 0.00 0.48 0.00 0.00 55.95 57.50 3h6i s SER 320 Cb -0.10 0.47 -0.04 0.00 0.10 0.00 0.00 66.02 66.45 3h6i s SER 320 CO 0.32 -0.14 -0.22 0.42 0.98 0.00 0.00 173.24 174.60 3h6i s THR 321 N 0.89 1.83 -0.42 2.02 -4.23 -1.26 -0.94 115.64 113.53 3h6i s THR 321 Ca -0.06 -1.58 0.03 0.00 -1.18 0.00 0.00 61.69 58.89 3h6i s THR 321 Cb -0.07 -1.65 0.12 0.00 1.34 0.00 0.00 72.50 72.24 3h6i s THR 321 CO -0.06 -0.02 0.18 -1.58 -0.54 0.00 0.00 174.62 172.60 3h6i s GLN 322 N -1.92 1.46 7.74 3.99 0.74 0.59 -4.84 119.66 127.42 3h6i s GLN 322 Ca 0.08 -2.04 0.00 0.00 0.05 0.00 0.00 55.36 53.45 3h6i s GLN 322 Cb -0.10 -2.78 0.00 0.00 1.10 0.00 0.00 33.01 31.23 3h6i s GLN 322 CO 0.05 -1.07 0.00 0.41 -0.55 0.00 0.00 175.29 174.12 3h6i n GLY 323 N 3.75 2.67 0.01 2.59 0.00 -1.26 -1.26 105.19 111.69 3h6i n GLY 323 Ca 0.05 -0.30 0.12 0.00 0.00 0.00 0.00 46.02 45.88 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 8.48 0.62 -4.74 1.61 3.02 -1.26 -4.91 115.26 118.09 3h6i n ASN 324 Ca 0.00 -0.38 -0.40 0.00 -0.03 0.00 0.00 54.58 53.76 3h6i n ASN 324 Cb 0.00 0.46 -0.05 0.00 -0.61 0.00 0.00 39.78 39.58 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 -3.03 4.59 -0.36 3.52 -1.94 -0.39 -5.00 119.30 116.69 3h6i s MET 325 Ca 0.09 1.24 -0.29 0.00 -1.71 0.00 0.00 55.69 55.02 3h6i s MET 325 Cb 0.17 -3.37 0.01 0.00 2.01 0.00 0.00 34.83 33.65 3h6i s MET 325 CO 0.75 0.25 1.29 0.42 -0.01 0.00 0.00 175.02 177.71 3h6i s ILE 326 N -0.02 4.11 -0.71 2.53 1.01 -1.26 -0.30 121.20 126.57 3h6i s ILE 326 Ca 0.42 1.21 0.21 0.00 0.00 0.00 0.00 60.65 62.49 3h6i s ILE 326 Cb -0.22 -4.27 -0.26 0.00 0.01 0.00 0.00 42.46 37.73 3h6i s ILE 326 CO 0.26 -0.65 0.77 -1.54 0.00 0.00 0.00 174.94 173.78 3h6i n SER 327 N 7.95 0.72 -3.68 3.58 3.41 -0.11 -4.91 113.62 120.58 3h6i n SER 327 Ca 0.15 -0.70 -0.14 0.00 -0.26 0.00 0.00 58.87 57.91 3h6i n SER 327 Cb 0.47 1.29 -0.08 0.00 -0.26 0.00 0.00 64.21 65.63 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 -3.41 -0.33 0.00 5.00 0.00 -0.95 -4.93 107.32 102.70 3h6i s GLY 328 Ca 0.03 0.95 0.00 0.00 0.00 0.00 0.00 44.72 45.70 3h6i s GLY 328 CO 0.87 0.71 0.13 0.54 0.00 0.00 0.00 173.10 175.34 3h6i n ARG 329 N 1.73 2.36 -0.21 2.90 1.74 -1.24 -2.55 116.66 121.39 3h6i n ARG 329 Ca -0.18 -0.13 0.06 0.00 -0.77 0.00 0.00 57.85 56.83 3h6i n ARG 329 Cb 0.56 -0.52 0.08 0.00 -1.02 0.00 0.00 32.46 31.57 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 -0.37 1.46 -4.68 0.55 8.00 -1.06 -4.67 116.55 115.79 3h6i n ASP 330 Ca 0.00 -2.61 -0.42 0.00 0.71 0.00 0.00 54.79 52.47 3h6i n ASP 330 Cb 0.04 -0.32 -0.03 0.00 -0.02 0.00 0.00 41.12 40.79 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 -1.73 2.82 -0.26 2.53 1.01 -0.42 -4.95 120.40 119.41 3h6i s VAL 331 Ca 0.19 0.08 -0.17 0.00 0.00 0.00 0.00 61.98 62.08 3h6i s VAL 331 Cb 0.16 -3.05 -0.03 0.00 0.00 0.00 0.00 36.38 33.46 3h6i s VAL 331 CO 0.02 -0.00 0.47 -0.60 0.00 0.00 0.00 175.10 174.98 3h6i s ARG 332 N 3.58 4.06 -0.01 2.72 3.52 -1.26 -4.23 118.95 127.33 3h6i s ARG 332 Ca 0.84 0.24 0.10 0.00 -0.13 0.00 0.00 55.73 56.77 3h6i s ARG 332 Cb -0.44 -3.65 -0.14 0.00 -1.56 0.00 0.00 34.95 29.17 3h6i s ARG 332 CO 0.38 -0.32 0.28 1.63 -0.81 0.00 0.00 175.30 176.46 3h6i n LYS 333 N 5.45 1.53 -4.10 5.12 5.02 -1.26 -4.71 118.16 125.20 3h6i n LYS 333 Ca -0.05 -0.06 -0.35 0.00 -2.02 0.00 0.00 58.31 55.83 3h6i n LYS 333 Cb 0.50 -1.14 -0.13 0.00 -0.02 0.00 0.00 35.03 34.24 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 -2.42 3.67 -0.02 -0.18 1.01 -1.26 -2.33 120.40 118.88 3h6i s VAL 334 Ca -0.01 -0.41 0.03 0.00 0.00 0.00 0.00 61.98 61.59 3h6i s VAL 334 Cb 0.07 -2.65 -0.00 0.00 0.00 0.00 0.00 36.38 33.79 3h6i s VAL 334 CO 0.41 0.44 -0.10 -0.31 0.00 0.00 0.00 175.10 175.54 3h6i s TYR 335 N 1.08 0.93 0.12 5.22 1.51 -0.07 -4.93 117.35 121.19 3h6i s TYR 335 Ca 0.02 -0.20 -0.31 0.00 -1.01 0.00 0.00 57.07 55.56 3h6i s TYR 335 Cb -0.15 -0.63 -0.08 0.00 -0.11 0.00 0.00 41.96 41.00 3h6i s TYR 335 CO 0.01 -0.05 1.43 0.42 -1.11 0.00 0.00 175.55 176.24 3h6i s ILE 336 N -0.04 3.21 -0.05 2.71 1.01 -1.26 -0.80 121.20 125.98 3h6i s ILE 336 Ca 0.01 0.85 0.13 0.00 0.00 0.00 0.00 60.65 61.64 3h6i s ILE 336 Cb -0.06 -3.55 -0.20 0.00 0.01 0.00 0.00 42.46 38.67 3h6i s ILE 336 CO 0.00 0.06 0.23 0.35 0.00 0.00 0.00 174.94 175.58 3h6i n THR 337 N 4.02 0.24 -3.83 2.92 -2.24 0.55 -4.90 114.28 111.03 3h6i n THR 337 Ca 0.12 -0.38 -0.07 0.00 -2.27 0.00 0.00 64.05 61.46 3h6i n THR 337 Cb 0.42 -0.05 0.03 0.00 -2.10 0.00 0.00 70.33 68.62 3h6i n THR 337 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3h6i n ASP 338 N -2.12 -2.08 0.21 3.42 5.75 -1.13 -4.37 116.55 116.24 3h6i n ASP 338 Ca -0.08 -2.32 0.15 0.00 -0.01 0.00 0.00 54.79 52.53 3h6i n ASP 338 Cb 0.51 3.43 0.80 0.00 -1.03 0.00 0.00 41.12 44.83 3h6i n ASP 338 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 3h6i h ASP 339 N 1.97 0.00 0.00 -1.12 3.32 -1.97 -2.79 116.42 115.83 3h6i h ASP 339 Ca -0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.74 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 0.40 0.00 -0.02 -1.22 -1.72 0.00 0.00 179.24 176.68 3h6i n TYR 340 N -4.02 0.00 -4.05 4.55 4.02 -1.26 0.10 117.16 116.50 3h6i n TYR 340 Ca 0.01 -0.45 -0.08 0.00 -0.01 0.00 0.00 57.90 57.37 3h6i n TYR 340 Cb 0.26 -0.05 -0.10 0.00 -0.02 0.00 0.00 39.34 39.43 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 -1.00 0.19 -0.06 -0.72 -4.23 -1.05 -1.25 115.64 107.52 3h6i s THR 341 Ca 0.04 -1.57 -0.09 0.00 -1.18 0.00 0.00 61.69 58.89 3h6i s THR 341 Cb 0.03 -1.21 0.02 0.00 1.34 0.00 0.00 72.50 72.69 3h6i s THR 341 CO 0.00 -0.86 0.23 0.00 -0.54 0.00 0.00 174.62 173.44 3h6i s ALA 342 N -3.31 -0.56 0.10 3.99 0.00 -0.39 -0.33 121.76 121.26 3h6i s ALA 342 Ca 0.01 0.44 0.08 0.00 0.00 0.00 0.00 51.96 52.49 3h6i s ALA 342 Cb 0.04 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.91 3h6i s ALA 342 CO -0.08 -0.16 -0.18 0.95 0.00 0.00 0.00 175.76 176.30 3h6i s THR 343 N -0.43 2.85 -0.04 0.00 -4.23 0.02 -1.15 115.64 112.66 3h6i s THR 343 Ca -0.05 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 59.05 3h6i s THR 343 Cb -0.04 -2.28 0.02 0.00 1.34 0.00 0.00 72.50 71.55 3h6i s THR 343 CO 0.01 0.16 -0.02 -0.83 -0.54 0.00 0.00 174.62 173.41 3h6i s GLY 344 N -1.96 0.36 -0.08 3.99 0.00 -0.49 -0.89 107.32 108.24 3h6i s GLY 344 Ca 0.17 0.03 0.03 0.00 0.00 0.00 0.00 44.72 44.95 3h6i s GLY 344 CO 0.09 0.65 -0.18 -0.42 0.00 0.00 0.00 173.10 173.24 3h6i s ILE 345 N 1.17 1.58 -1.36 0.90 1.01 -0.99 -1.41 121.20 122.10 3h6i s ILE 345 Ca -0.07 -0.73 -0.11 0.00 0.00 0.00 0.00 60.65 59.73 3h6i s ILE 345 Cb -0.14 -1.40 0.11 0.00 0.01 0.00 0.00 42.46 41.05 3h6i s ILE 345 CO -0.02 0.45 2.06 0.00 0.00 0.00 0.00 174.94 177.44 3h6i n ALA 346 N 3.72 5.54 -3.00 9.38 0.00 -1.26 -4.79 120.51 130.10 3h6i n ALA 346 Ca -0.21 -4.12 0.00 0.00 0.00 0.00 0.00 53.44 49.11 3h6i n ALA 346 Cb 0.52 -3.21 0.00 0.00 0.00 0.00 0.00 19.45 16.76 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 3.30 4.47 3.74 0.00 0.00 -1.26 -4.82 105.19 110.62 3h6i n GLY 347 Ca 0.46 -1.18 -0.31 0.00 0.00 0.00 0.00 46.02 44.99 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 -1.57 2.95 0.30 2.61 -4.23 -1.26 -4.82 115.64 109.62 3h6i s THR 348 Ca 0.00 0.31 0.02 0.00 -1.18 0.00 0.00 61.69 60.83 3h6i s THR 348 Cb 0.00 -2.71 0.29 0.00 1.34 0.00 0.00 72.50 71.41 3h6i s THR 348 CO 0.00 -0.40 1.87 0.00 -0.54 0.00 0.00 174.62 175.55 3h6i h ALA 349 N -1.38 1.54 -0.14 3.99 0.00 -1.96 -1.39 119.26 119.93 3h6i h ALA 349 Ca -0.45 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 3h6i h ALA 349 Cb 1.25 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 3h6i h ALA 349 CO 0.51 0.26 -0.20 0.00 0.00 0.00 0.00 179.25 179.82 3h6i h ALA 350 N 1.52 0.21 -0.64 0.00 0.00 -1.92 -1.13 119.26 117.30 3h6i h ALA 350 Ca 0.45 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3h6i h ALA 350 Cb 0.38 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3h6i h ALA 350 CO -0.21 0.15 0.36 0.28 0.00 0.00 0.00 179.25 179.83 3h6i h VAL 351 N -0.01 1.20 -0.51 0.00 2.07 -1.81 0.93 116.25 118.13 3h6i h VAL 351 Ca 0.01 -0.48 -0.08 0.00 0.82 0.00 0.00 66.70 66.97 3h6i h VAL 351 Cb 0.76 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 3h6i h VAL 351 CO 0.05 0.21 -0.02 0.00 0.02 0.00 0.00 177.57 177.83 3h6i h ALA 352 N 1.18 1.00 0.08 1.67 0.00 -1.24 -1.95 119.26 120.00 3h6i h ALA 352 Ca 0.23 -0.29 -0.29 0.00 0.00 0.00 0.00 54.91 54.56 3h6i h ALA 352 Cb 0.02 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3h6i h ALA 352 CO -0.04 0.61 -1.48 -0.24 0.00 0.00 0.00 179.25 178.10 3h6i h VAL 353 N 0.81 1.18 -0.27 0.00 3.04 -0.86 -2.89 116.25 117.26 3h6i h VAL 353 Ca 0.15 -2.87 -0.13 0.00 -1.01 0.00 0.00 66.70 62.84 3h6i h VAL 353 Cb 0.51 2.72 -0.01 0.00 -2.01 0.00 0.00 31.29 32.50 3h6i h VAL 353 CO 0.03 0.80 -0.35 -0.33 -1.01 0.00 0.00 177.57 176.70 3h6i h GLU 354 N 0.05 0.60 0.07 4.17 4.39 -0.81 -1.00 114.58 122.05 3h6i h GLU 354 Ca -0.22 -0.28 -0.00 0.00 0.34 0.00 0.00 59.36 59.20 3h6i h GLU 354 Cb 1.98 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 30.62 3h6i h GLU 354 CO 0.14 0.87 -0.04 0.35 -1.16 0.00 0.00 179.01 179.17 3h6i h PHE 355 N 0.50 -0.09 -0.87 4.33 3.04 -1.45 -1.93 116.94 120.47 3h6i h PHE 355 Ca 0.05 -0.00 0.06 0.00 3.98 0.00 0.00 57.97 62.06 3h6i h PHE 355 Cb 0.85 0.03 -0.06 0.00 2.56 0.00 0.00 35.95 39.33 3h6i h PHE 355 CO 0.04 0.37 0.57 0.00 -2.02 0.00 0.00 178.31 177.26 3h6i h ALA 356 N 0.27 1.53 -0.26 2.41 0.00 -1.50 -0.30 119.26 121.41 3h6i h ALA 356 Ca -0.01 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 3h6i h ALA 356 Cb 0.50 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3h6i h ALA 356 CO 0.02 0.34 -0.13 -0.09 0.00 0.00 0.00 179.25 179.39 3h6i h ARG 357 N 1.00 0.56 -0.53 0.00 2.43 -1.09 0.13 114.38 116.87 3h6i h ARG 357 Ca 0.37 -0.25 -0.12 0.00 -0.81 0.00 0.00 59.98 59.18 3h6i h ARG 357 Cb 0.18 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 3h6i h ARG 357 CO -0.13 0.81 -0.14 1.25 -1.51 0.00 0.00 179.97 180.25 3h6i h LEU 358 N 0.29 1.05 -0.52 3.80 5.85 -0.96 -1.90 115.31 122.92 3h6i h LEU 358 Ca 0.06 -0.36 -0.09 0.00 0.84 0.00 0.00 57.88 58.32 3h6i h LEU 358 Cb 0.65 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 3h6i h LEU 358 CO 0.04 1.17 -0.03 0.22 -0.34 0.00 0.00 178.44 179.50 3h6i h TYR 359 N 0.91 1.02 -0.22 1.25 3.20 -0.87 -1.33 116.97 120.93 3h6i h TYR 359 Ca 0.13 -0.19 -0.09 0.00 3.14 0.00 0.00 58.73 61.72 3h6i h TYR 359 Cb 0.72 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 3h6i h TYR 359 CO 0.05 0.96 -0.27 0.00 -1.64 0.00 0.00 178.16 177.25 3h6i h ALA 360 N 0.93 1.12 -0.18 1.82 0.00 -0.57 -1.28 119.26 121.10 3h6i h ALA 360 Ca 0.14 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 3h6i h ALA 360 Cb 0.57 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3h6i h ALA 360 CO 0.03 0.55 -0.01 0.28 0.00 0.00 0.00 179.25 180.10 3h6i h VAL 361 N 0.37 1.26 -1.01 0.00 2.07 -1.04 -2.15 116.25 115.77 3h6i h VAL 361 Ca 0.05 -0.90 0.01 0.00 0.82 0.00 0.00 66.70 66.69 3h6i h VAL 361 Cb 0.68 1.51 -0.05 0.00 -1.52 0.00 0.00 31.29 31.90 3h6i h VAL 361 CO 0.05 0.27 0.67 -0.08 0.02 0.00 0.00 177.57 178.50 3h6i h GLU 362 N 0.06 1.31 -0.46 1.57 4.81 -0.76 0.11 114.58 121.22 3h6i h GLU 362 Ca 0.05 -0.08 -0.08 0.00 -0.13 0.00 0.00 59.36 59.12 3h6i h GLU 362 Cb 0.41 -0.30 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 3h6i h GLU 362 CO 0.01 0.87 -0.02 -0.07 -0.73 0.00 0.00 179.01 179.07 3h6i h LEU 363 N 1.35 0.82 -0.56 1.64 3.38 -1.10 -2.33 115.31 118.50 3h6i h LEU 363 Ca 0.37 -0.32 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 3h6i h LEU 363 Cb -0.13 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.38 3h6i h LEU 363 CO -0.09 0.94 -0.56 -0.08 0.09 0.00 0.00 178.44 178.74 3h6i h GLU 364 N 0.68 0.00 -0.49 1.13 4.81 -1.07 -2.54 114.58 117.10 3h6i h GLU 364 Ca 0.13 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.26 3h6i h GLU 364 Cb 0.53 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 3h6i h GLU 364 CO 0.03 0.56 -0.10 1.25 -0.73 0.00 0.00 179.01 180.02 3h6i h HIS 365 N 0.00 1.00 -0.21 0.92 2.76 -0.46 -1.11 115.15 118.05 3h6i h HIS 365 Ca -0.01 -0.19 -0.09 0.00 -2.20 0.00 0.00 60.37 57.89 3h6i h HIS 365 Cb 1.18 -0.25 -0.00 0.00 1.55 0.00 0.00 27.41 29.89 3h6i h HIS 365 CO 0.00 0.95 -0.21 -0.92 -1.30 0.00 0.00 177.93 176.45 3h6i h TYR 366 N 0.81 0.62 -0.90 5.26 3.20 -1.22 -1.68 116.97 123.06 3h6i h TYR 366 Ca 0.13 -0.19 0.04 0.00 3.14 0.00 0.00 58.73 61.85 3h6i h TYR 366 Cb 0.62 -0.13 -0.05 0.00 1.54 0.00 0.00 36.73 38.71 3h6i h TYR 366 CO 0.04 0.86 0.59 1.49 -1.64 0.00 0.00 178.16 179.50 3h6i h GLU 367 N 0.19 1.09 -0.00 1.82 4.81 -1.03 0.12 114.58 121.58 3h6i h GLU 367 Ca 0.03 -0.07 -0.22 0.00 -0.13 0.00 0.00 59.36 58.98 3h6i h GLU 367 Cb 0.76 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 29.89 3h6i h GLU 367 CO 0.05 0.72 -0.91 0.87 -0.73 0.00 0.00 179.01 179.01 3h6i h LYS 368 N 1.12 0.36 -0.09 1.92 1.57 -1.11 0.25 116.57 120.58 3h6i h LYS 368 Ca 0.36 -0.38 -0.14 0.00 -1.87 0.00 0.00 60.65 58.62 3h6i h LYS 368 Cb 0.02 0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.45 3h6i h LYS 368 CO -0.11 1.06 -0.47 -0.07 -0.57 0.00 0.00 179.45 179.29 3h6i h LEU 369 N 0.20 0.57 -0.21 2.94 3.38 -0.72 -3.34 115.31 118.13 3h6i h LEU 369 Ca -0.07 -0.65 0.00 0.00 0.09 0.00 0.00 57.88 57.25 3h6i h LEU 369 Cb 1.54 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.13 3h6i h LEU 369 CO 0.15 1.13 -0.89 -0.62 0.09 0.00 0.00 178.44 178.30 3h6i n GLU 370 N -4.27 0.25 -0.46 1.13 -0.58 0.37 -4.99 120.64 112.09 3h6i n GLU 370 Ca -0.08 -0.21 0.00 0.00 -0.42 0.00 0.00 57.16 56.45 3h6i n GLU 370 Cb 0.59 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.96 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 1.48 1.40 3.27 0.62 0.00 0.07 -5.00 105.19 107.03 3h6i n GLY 371 Ca 0.05 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 -3.21 0.06 0.87 1.61 0.11 -1.20 -4.98 120.40 113.66 3h6i s VAL 372 Ca 0.00 -0.46 -0.12 0.00 -2.93 0.00 0.00 61.98 58.47 3h6i s VAL 372 Cb 0.00 -0.71 0.11 0.00 -1.53 0.00 0.00 36.38 34.25 3h6i s VAL 372 CO 0.00 -0.26 1.10 -2.84 -3.33 0.00 0.00 175.10 169.77 3h6i s PRO 373 N -1.56 1.50 0.65 1.54 0.02 -1.26 -4.10 135.00 131.78 3h6i s PRO 373 Ca -0.12 0.74 -0.14 0.00 0.02 0.00 0.00 61.00 61.50 3h6i s PRO 373 Cb -0.04 -1.84 -0.00 0.00 0.02 0.00 0.00 34.50 32.63 3h6i s PRO 373 CO 0.03 -2.05 1.09 -0.51 -0.33 0.00 0.00 177.00 175.23 3h6i s LEU 374 N -6.08 3.37 0.90 -5.54 1.43 -1.26 -5.01 118.68 106.49 3h6i s LEU 374 Ca 0.63 1.90 -0.12 0.00 -1.03 0.00 0.00 54.13 55.51 3h6i s LEU 374 Cb -0.17 -4.54 0.13 0.00 0.03 0.00 0.00 46.19 41.65 3h6i s LEU 374 CO 0.56 -1.52 1.09 0.42 0.23 0.00 0.00 176.35 177.13 3h6i s THR 375 N -2.47 2.59 0.28 5.49 -4.23 -1.26 -4.75 115.64 111.27 3h6i s THR 375 Ca 0.65 0.19 0.01 0.00 -1.18 0.00 0.00 61.69 61.35 3h6i s THR 375 Cb -0.18 -2.71 0.27 0.00 1.34 0.00 0.00 72.50 71.21 3h6i s THR 375 CO 0.42 -0.25 1.83 0.15 -0.54 0.00 0.00 174.62 176.23 3h6i h PHE 376 N -1.55 1.10 -0.71 3.99 3.57 -1.95 -0.57 116.94 120.81 3h6i h PHE 376 Ca -0.50 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 60.97 3h6i h PHE 376 Cb 1.29 -0.34 -0.03 0.00 2.79 0.00 0.00 35.95 39.66 3h6i h PHE 376 CO 0.40 0.42 0.20 0.00 -2.23 0.00 0.00 178.31 177.11 3h6i h ALA 377 N 1.53 1.02 -0.18 2.41 0.00 -2.00 -1.15 119.26 120.90 3h6i h ALA 377 Ca 0.49 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 55.11 3h6i h ALA 377 Cb 0.49 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3h6i h ALA 377 CO -0.27 0.65 -0.14 0.78 0.00 0.00 0.00 179.25 180.27 3h6i h GLY 378 N 1.09 0.31 0.90 0.00 0.00 -1.51 -1.04 103.07 102.84 3h6i h GLY 378 Ca 0.23 -0.20 -0.09 0.00 0.00 0.00 0.00 47.33 47.27 3h6i h GLY 378 CO -0.00 0.19 -0.16 0.50 0.00 0.00 0.00 176.54 177.06 3h6i h LYS 379 N 0.28 0.60 -0.72 4.80 1.57 0.01 -1.65 116.57 121.46 3h6i h LYS 379 Ca 0.05 -0.27 -0.00 0.00 -1.87 0.00 0.00 60.65 58.56 3h6i h LYS 379 Cb 0.42 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.68 3h6i h LYS 379 CO 0.02 0.85 0.44 0.82 -0.57 0.00 0.00 179.45 181.02 3h6i h ILE 380 N 0.34 1.20 -0.25 1.86 2.04 -1.07 -1.36 117.51 120.28 3h6i h ILE 380 Ca 0.06 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 3h6i h ILE 380 Cb 0.68 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 3h6i h ILE 380 CO 0.05 0.20 0.12 -1.13 0.00 0.00 0.00 178.15 177.39 3h6i h ASN 381 N 0.98 0.33 -0.82 1.72 -1.24 -1.02 0.21 115.58 115.74 3h6i h ASN 381 Ca 0.26 -0.13 -0.01 0.00 0.71 0.00 0.00 56.30 57.13 3h6i h ASN 381 Cb -0.05 -0.08 -0.04 0.00 0.73 0.00 0.00 38.32 38.87 3h6i h ASN 381 CO -0.05 0.37 0.48 0.03 -1.29 0.00 0.00 177.43 176.96 3h6i h ARG 382 N 0.27 1.12 -0.38 6.67 2.47 -1.04 -0.41 114.38 123.09 3h6i h ARG 382 Ca 0.09 -0.11 -0.01 0.00 -1.26 0.00 0.00 59.98 58.68 3h6i h ARG 382 Cb 0.13 -0.23 -0.02 0.00 -1.65 0.00 0.00 29.97 28.20 3h6i h ARG 382 CO -0.01 0.81 0.19 1.25 0.56 0.00 0.00 179.97 182.77 3h6i h LEU 383 N 1.13 0.48 -1.15 3.04 5.85 -0.64 -1.65 115.31 122.38 3h6i h LEU 383 Ca 0.29 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 3h6i h LEU 383 Cb -0.01 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 3h6i h LEU 383 CO -0.05 0.46 0.29 0.00 -0.34 0.00 0.00 178.44 178.79 3h6i h ALA 384 N 1.05 1.34 -0.49 1.25 0.00 0.06 -0.42 119.26 122.05 3h6i h ALA 384 Ca 0.13 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 3h6i h ALA 384 Cb 0.09 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3h6i h ALA 384 CO -0.02 0.51 -0.15 0.82 0.00 0.00 0.00 179.25 180.41 3h6i h ILE 385 N 0.88 1.27 -0.24 0.00 2.04 -0.87 -0.71 117.51 119.88 3h6i h ILE 385 Ca 0.22 -1.29 -0.07 0.00 1.00 0.00 0.00 64.86 64.72 3h6i h ILE 385 Cb 0.11 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 3h6i h ILE 385 CO -0.03 0.45 -0.12 -0.03 0.00 0.00 0.00 178.15 178.42 3h6i h MET 386 N 0.84 0.51 -0.44 2.37 4.05 -0.65 -1.33 114.93 120.27 3h6i h MET 386 Ca 0.12 -0.22 -0.03 0.00 -0.28 0.00 0.00 59.70 59.29 3h6i h MET 386 Cb 0.70 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.46 3h6i h MET 386 CO 0.05 0.77 0.17 0.28 0.23 0.00 0.00 176.91 178.42 3h6i h VAL 387 N 0.23 1.21 0.00 -5.77 2.07 -0.96 -2.53 116.25 110.49 3h6i h VAL 387 Ca 0.05 -0.65 -0.10 0.00 0.82 0.00 0.00 66.70 66.83 3h6i h VAL 387 Cb 0.62 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 3h6i h VAL 387 CO 0.04 0.24 -0.48 0.03 0.02 0.00 0.00 177.57 177.42 3h6i h ARG 388 N 0.57 0.00 0.00 1.57 3.08 -1.09 -2.81 114.38 115.71 3h6i h ARG 388 Ca 0.15 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.18 3h6i h ARG 388 Cb 0.20 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 3h6i h ARG 388 CO -0.01 0.48 -0.07 0.78 -1.07 0.00 0.00 179.97 180.07 3h6i h GLY 389 N 1.47 0.00 0.97 0.04 0.00 -1.03 -2.85 103.07 101.68 3h6i h GLY 389 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3h6i h GLY 389 CO 0.06 0.00 -1.07 0.70 0.00 0.00 0.00 176.54 176.23 3h6i n ASN 390 N -3.16 0.84 0.00 0.19 4.13 -0.97 -3.92 115.26 112.36 3h6i n ASN 390 Ca 0.02 0.33 0.11 0.00 1.68 0.00 0.00 54.58 56.72 3h6i n ASN 390 Cb 0.42 0.45 0.09 0.00 -1.54 0.00 0.00 39.78 39.20 3h6i n ASN 390 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3h6i n LEU 391 N -2.69 0.69 -0.82 3.41 4.77 -1.13 -5.06 117.00 116.17 3h6i n LEU 391 Ca -0.01 -0.18 0.06 0.00 -0.03 0.00 0.00 56.01 55.84 3h6i n LEU 391 Cb 0.58 -0.14 0.16 0.00 -2.33 0.00 0.00 43.42 41.68 3h6i n LEU 391 CO 0.40 0.16 0.29 0.00 -1.33 0.00 0.00 177.39 176.91 3h6i n ALA 392 N -1.53 3.27 0.01 -1.18 0.00 -1.08 -5.12 120.51 114.88 3h6i n ALA 392 Ca 0.05 -3.01 0.00 0.00 0.00 0.00 0.00 53.44 50.47 3h6i n ALA 392 Cb 0.34 -0.46 -0.00 0.00 0.00 0.00 0.00 19.45 19.34 3h6i n ALA 392 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3h6i n LEU 399 N -0.69 0.01 -4.76 0.00 4.32 -1.26 -4.91 117.00 109.71 3h6i n LEU 399 Ca 0.15 -0.36 -0.40 0.00 -0.02 0.00 0.00 56.01 55.38 3h6i n LEU 399 Cb 0.81 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.57 3h6i n LEU 399 CO -0.04 0.00 0.80 0.00 -1.22 0.00 0.00 177.39 176.94 3h6i s ALA 400 N -1.30 3.34 -0.04 -1.18 0.00 -1.26 -5.07 121.76 116.24 3h6i s ALA 400 Ca 0.00 0.90 -0.00 0.00 0.00 0.00 0.00 51.96 52.86 3h6i s ALA 400 Cb 0.00 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.75 3h6i s ALA 400 CO 0.02 -0.24 0.01 -0.51 0.00 0.00 0.00 175.76 175.03 3h6i s LEU 401 N -1.76 3.58 0.55 0.00 1.43 -1.26 -4.94 118.68 116.28 3h6i s LEU 401 Ca 0.48 0.08 -0.18 0.00 -1.03 0.00 0.00 54.13 53.48 3h6i s LEU 401 Cb -0.31 -1.95 -0.06 0.00 0.03 0.00 0.00 46.19 43.91 3h6i s LEU 401 CO 0.40 0.33 1.06 -2.84 0.23 0.00 0.00 176.35 175.53 3h6i s PRO 402 N -1.25 3.48 -0.15 1.29 0.02 -1.26 -4.34 135.00 132.79 3h6i s PRO 402 Ca 0.17 1.33 0.02 0.00 0.02 0.00 0.00 61.00 62.54 3h6i s PRO 402 Cb -0.11 -2.05 0.01 0.00 0.02 0.00 0.00 34.50 32.37 3h6i s PRO 402 CO 0.07 -0.69 -0.21 -1.17 -0.33 0.00 0.00 177.00 174.67 3h6i s LEU 403 N -4.03 2.07 -0.13 -5.54 2.96 -0.50 -3.30 118.68 110.22 3h6i s LEU 403 Ca 0.66 -0.60 -0.02 0.00 -0.22 0.00 0.00 54.13 53.95 3h6i s LEU 403 Cb -0.17 -1.42 -0.03 0.00 0.50 0.00 0.00 46.19 45.07 3h6i s LEU 403 CO 0.29 0.05 -0.06 -0.22 -1.32 0.00 0.00 176.35 175.09 3h6i s LEU 404 N 0.98 3.15 -0.06 -0.68 2.96 0.82 -1.40 118.68 124.46 3h6i s LEU 404 Ca -0.03 -0.13 0.03 0.00 -0.22 0.00 0.00 54.13 53.78 3h6i s LEU 404 Cb -0.15 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 3h6i s LEU 404 CO -0.05 0.22 -0.14 0.00 -1.32 0.00 0.00 176.35 175.05 3h6i s ALA 405 N 0.08 2.68 0.26 5.97 0.00 -0.30 -0.91 121.76 129.53 3h6i s ALA 405 Ca -0.01 -0.97 -0.17 0.00 0.00 0.00 0.00 51.96 50.81 3h6i s ALA 405 Cb -0.14 -1.00 0.01 0.00 0.00 0.00 0.00 23.12 21.99 3h6i s ALA 405 CO 0.03 0.53 0.59 0.20 0.00 0.00 0.00 175.76 177.11 3h6i s GLY 406 N -0.66 0.22 -0.07 0.00 0.00 0.76 -1.26 107.32 106.31 3h6i s GLY 406 Ca 0.10 -0.58 -0.00 0.00 0.00 0.00 0.00 44.72 44.23 3h6i s GLY 406 CO 0.01 -0.36 -0.04 -0.47 0.00 0.00 0.00 173.10 172.24 3h6i s TYR 407 N -3.96 0.93 -0.46 1.90 5.04 -0.38 0.42 117.35 120.83 3h6i s TYR 407 Ca 0.16 -0.34 -0.22 0.00 -2.44 0.00 0.00 57.07 54.24 3h6i s TYR 407 Cb -0.03 -0.89 0.03 0.00 0.35 0.00 0.00 41.96 41.42 3h6i s TYR 407 CO 0.07 -0.34 0.74 0.34 -1.34 0.00 0.00 175.55 175.03 3h6i s ASP 408 N 1.56 6.36 0.21 4.32 -1.08 -0.14 -4.86 116.67 123.03 3h6i s ASP 408 Ca -0.00 -0.27 0.24 0.00 -0.52 0.00 0.00 52.55 51.99 3h6i s ASP 408 Cb -0.13 -2.36 0.91 0.00 -1.46 0.00 0.00 42.92 39.88 3h6i s ASP 408 CO -0.04 -0.89 1.71 0.00 0.52 0.00 0.00 175.17 176.47 3h6i n ILE 409 N 6.01 0.75 1.02 4.11 0.13 -1.26 -2.82 119.36 127.30 3h6i n ILE 409 Ca 0.00 0.09 0.11 0.00 -1.10 0.00 0.00 62.75 61.86 3h6i n ILE 409 Cb 0.48 -0.97 0.02 0.00 -0.84 0.00 0.00 39.64 38.33 3h6i n ILE 409 CO 0.00 0.00 0.00 1.41 2.80 0.00 0.00 176.55 180.76 3h6i n HIS 410 N -2.13 0.00 -2.07 9.51 8.25 -1.26 -4.96 115.22 122.56 3h6i n HIS 410 Ca 0.03 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.08 3h6i n HIS 410 Cb 0.28 -0.01 -0.02 0.00 1.12 0.00 0.00 29.99 31.36 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 -2.51 3.57 0.31 -1.41 0.00 -1.13 -4.94 121.76 115.65 3h6i s ALA 411 Ca 0.18 1.29 -0.01 0.00 0.00 0.00 0.00 51.96 53.42 3h6i s ALA 411 Cb 0.18 -3.52 0.49 0.00 0.00 0.00 0.00 23.12 20.27 3h6i s ALA 411 CO 0.58 -0.69 1.95 0.66 0.00 0.00 0.00 175.76 178.26 3h6i h SER 412 N 4.42 0.85 -3.20 0.00 4.64 -1.93 -3.38 113.55 114.96 3h6i h SER 412 Ca -0.47 -0.05 -0.75 0.00 -0.47 0.00 0.00 61.79 60.05 3h6i h SER 412 Cb 1.22 -0.21 -0.26 0.00 -0.31 0.00 0.00 62.40 62.83 3h6i h SER 412 CO 0.73 0.66 -0.28 -0.62 -0.87 0.00 0.00 176.83 176.44 3h6i s ASP 413 N -6.41 6.00 0.46 4.97 2.15 -1.26 -4.97 116.67 117.61 3h6i s ASP 413 Ca -0.11 -1.87 0.19 0.00 0.43 0.00 0.00 52.55 51.19 3h6i s ASP 413 Cb 0.17 -2.13 1.17 0.00 -0.30 0.00 0.00 42.92 41.83 3h6i s ASP 413 CO 0.79 -0.78 1.94 -0.65 -0.17 0.00 0.00 175.17 176.29 3h6i h PRO 414 N 8.67 0.27 0.00 4.34 0.11 -1.95 -1.60 132.00 141.85 3h6i h PRO 414 Ca -0.25 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.81 3h6i h PRO 414 Cb 1.09 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 3h6i h PRO 414 CO 0.96 0.18 -0.17 1.96 -0.21 0.00 0.00 178.00 180.72 3h6i h GLN 415 N 0.28 0.00 0.00 1.05 1.08 -1.93 -3.03 115.11 112.56 3h6i h GLN 415 Ca 0.34 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.54 3h6i h GLN 415 Cb 0.94 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.37 3h6i h GLN 415 CO -0.08 0.17 -0.07 -1.13 -0.95 0.00 0.00 178.83 176.77 3h6i n SER 416 N -3.61 2.15 0.00 1.46 3.41 -0.63 -0.81 113.62 115.58 3h6i n SER 416 Ca -0.01 -3.05 0.09 0.00 -0.26 0.00 0.00 58.87 55.63 3h6i n SER 416 Cb 0.30 -0.42 0.41 0.00 -0.26 0.00 0.00 64.21 64.24 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 -1.31 1.89 -1.77 7.33 0.00 -1.01 -4.80 120.51 120.84 3h6i n ALA 417 Ca 0.15 -0.07 -0.39 0.00 0.00 0.00 0.00 53.44 53.13 3h6i n ALA 417 Cb 0.65 -1.28 -0.01 0.00 0.00 0.00 0.00 19.45 18.81 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 -2.75 2.91 -0.01 0.00 0.00 -1.26 -0.97 107.32 105.24 3h6i s GLY 418 Ca 0.13 1.16 0.02 0.00 0.00 0.00 0.00 44.72 46.02 3h6i s GLY 418 CO 0.29 1.72 -0.05 0.50 0.00 0.00 0.00 173.10 175.56 3h6i s ARG 419 N -2.25 0.45 -0.12 2.90 1.81 0.17 -4.89 118.95 117.02 3h6i s ARG 419 Ca 0.57 -0.17 0.01 0.00 -1.72 0.00 0.00 55.73 54.42 3h6i s ARG 419 Cb -0.36 -0.45 0.02 0.00 -0.45 0.00 0.00 34.95 33.71 3h6i s ARG 419 CO 0.46 0.09 -0.13 0.42 -0.68 0.00 0.00 175.30 175.45 3h6i s ILE 420 N 0.02 1.38 -0.09 1.52 1.01 -1.26 -0.17 121.20 123.61 3h6i s ILE 420 Ca 0.00 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.13 3h6i s ILE 420 Cb -0.04 -1.30 0.01 0.00 0.01 0.00 0.00 42.46 41.15 3h6i s ILE 420 CO -0.00 0.42 -0.16 -0.69 0.00 0.00 0.00 174.94 174.51 3h6i s VAL 421 N 1.23 1.52 0.32 2.92 1.01 -0.09 -1.02 120.40 126.30 3h6i s VAL 421 Ca -0.02 -0.68 0.09 0.00 0.00 0.00 0.00 61.98 61.37 3h6i s VAL 421 Cb -0.14 -1.37 -0.05 0.00 0.00 0.00 0.00 36.38 34.82 3h6i s VAL 421 CO -0.05 0.44 0.02 -0.94 0.00 0.00 0.00 175.10 174.57 3h6i s SER 422 N 0.74 4.29 -0.07 3.32 1.04 -0.08 -0.13 113.70 122.81 3h6i s SER 422 Ca -0.12 -0.90 0.04 0.00 0.48 0.00 0.00 55.95 55.45 3h6i s SER 422 Cb -0.16 -0.60 0.00 0.00 0.10 0.00 0.00 66.02 65.36 3h6i s SER 422 CO 0.02 -0.19 -0.18 -0.36 0.98 0.00 0.00 173.24 173.52 3h6i s PHE 423 N -2.47 1.88 0.75 5.02 0.40 -1.21 -0.73 117.98 121.63 3h6i s PHE 423 Ca 0.34 -0.66 -0.06 0.00 -0.60 0.00 0.00 56.93 55.95 3h6i s PHE 423 Cb -0.02 -1.29 0.11 0.00 0.51 0.00 0.00 43.02 42.33 3h6i s PHE 423 CO 0.20 -0.27 1.06 0.16 0.70 0.00 0.00 175.22 177.06 3h6i s ASP 424 N 0.32 4.35 0.37 1.36 1.47 -0.67 -4.85 116.67 119.02 3h6i s ASP 424 Ca -0.11 0.15 0.16 0.00 1.18 0.00 0.00 52.55 53.93 3h6i s ASP 424 Cb -0.15 -0.61 1.05 0.00 -0.34 0.00 0.00 42.92 42.87 3h6i s ASP 424 CO 0.05 -1.88 1.74 0.00 0.68 0.00 0.00 175.17 175.76 3h6i h ALA 425 N -0.75 2.10 -0.00 2.11 0.00 -1.97 -0.27 119.26 120.48 3h6i h ALA 425 Ca -0.42 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3h6i h ALA 425 Cb 1.28 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3h6i h ALA 425 CO 0.49 -0.55 -0.01 0.00 0.00 0.00 0.00 179.25 179.19 3h6i n ALA 426 N -2.41 2.60 -0.78 0.00 0.00 -1.26 -4.88 120.51 113.77 3h6i n ALA 426 Ca 0.27 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3h6i n ALA 426 Cb 0.87 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.83 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 1.14 0.79 3.77 0.00 0.00 -0.11 -4.98 105.19 105.80 3h6i n GLY 427 Ca 0.19 -0.59 -0.37 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.58 2.35 0.56 -0.02 0.00 -1.25 -4.66 107.32 101.72 3h6i s GLY 428 Ca 0.00 -0.31 -0.17 0.00 0.00 0.00 0.00 44.72 44.24 3h6i s GLY 428 CO 0.00 0.39 1.05 0.66 0.00 0.00 0.00 173.10 175.20 3h6i s TRP 429 N -0.08 3.04 -0.18 1.90 1.48 -1.26 -1.68 118.94 122.15 3h6i s TRP 429 Ca 0.22 1.52 -0.05 0.00 -1.06 0.00 0.00 56.10 56.73 3h6i s TRP 429 Cb -0.15 -3.00 0.09 0.00 -1.16 0.00 0.00 33.47 29.26 3h6i s TRP 429 CO 0.09 -0.98 0.33 1.21 -4.06 0.00 0.00 176.95 173.54 3h6i s ASN 430 N -2.65 0.28 -0.13 -2.66 3.84 0.09 -4.95 114.94 108.77 3h6i s ASN 430 Ca 0.64 0.52 -0.29 0.00 0.21 0.00 0.00 52.86 53.93 3h6i s ASN 430 Cb -0.15 0.94 -0.01 0.00 -0.55 0.00 0.00 41.25 41.48 3h6i s ASN 430 CO 0.33 -0.26 1.08 -0.63 -2.79 0.00 0.00 177.10 174.83 3h6i s ILE 431 N 2.49 4.59 -0.17 -5.21 1.01 -1.26 -0.90 121.20 121.74 3h6i s ILE 431 Ca 0.04 1.89 -0.29 0.00 0.00 0.00 0.00 60.65 62.28 3h6i s ILE 431 Cb -0.13 -4.22 -0.01 0.00 0.01 0.00 0.00 42.46 38.12 3h6i s ILE 431 CO -0.12 -0.06 1.14 -1.61 0.00 0.00 0.00 174.94 174.30 3h6i s GLU 432 N 2.51 4.27 0.00 2.79 0.41 -0.19 -4.92 118.70 123.57 3h6i s GLU 432 Ca 0.50 1.52 0.10 0.00 -0.41 0.00 0.00 54.97 56.68 3h6i s GLU 432 Cb -0.19 -3.67 0.10 0.00 -1.78 0.00 0.00 34.13 28.59 3h6i s GLU 432 CO 0.16 -0.61 0.87 0.39 -0.49 0.00 0.00 175.26 175.57 3h6i n GLU 433 N 6.19 0.67 -0.12 1.61 -0.58 -1.26 -4.56 120.64 122.59 3h6i n GLU 433 Ca 0.12 -1.21 0.10 0.00 -0.42 0.00 0.00 57.16 55.76 3h6i n GLU 433 Cb 0.46 -1.21 0.32 0.00 -0.57 0.00 0.00 31.44 30.44 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 0.58 1.88 0.00 3.49 1.02 -1.26 -4.96 120.64 121.39 3h6i n GLU 434 Ca 0.07 -1.33 0.00 0.00 -0.02 0.00 0.00 57.16 55.88 3h6i n GLU 434 Cb 0.28 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.30 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 1.19 3.17 3.54 0.62 0.00 -1.26 -5.02 105.19 107.43 3h6i n GLY 435 Ca 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.09 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 -2.69 -0.15 0.19 1.61 1.13 -1.26 -0.72 117.35 115.46 3h6i s TYR 436 Ca 0.00 -0.19 -0.20 0.00 -1.41 0.00 0.00 57.07 55.27 3h6i s TYR 436 Cb 0.00 0.43 0.04 0.00 -1.10 0.00 0.00 41.96 41.33 3h6i s TYR 436 CO 0.00 -0.94 0.57 -1.14 -2.51 0.00 0.00 175.55 171.53 3h6i s GLN 437 N -3.87 1.40 -0.10 -3.49 2.00 -0.52 -4.97 119.66 110.10 3h6i s GLN 437 Ca 0.09 -0.76 -0.17 0.00 -2.00 0.00 0.00 55.36 52.52 3h6i s GLN 437 Cb -0.01 0.55 0.04 0.00 0.80 0.00 0.00 33.01 34.39 3h6i s GLN 437 CO -0.03 -0.60 0.43 0.00 -0.50 0.00 0.00 175.29 174.59 3h6i s ALA 438 N -3.84 -1.07 0.17 1.58 0.00 -1.26 -1.40 121.76 115.93 3h6i s ALA 438 Ca 0.07 0.94 0.08 0.00 0.00 0.00 0.00 51.96 53.05 3h6i s ALA 438 Cb -0.02 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.70 3h6i s ALA 438 CO -0.05 -0.25 -0.16 0.14 0.00 0.00 0.00 175.76 175.44 3h6i s VAL 439 N -0.47 1.71 0.00 0.00 -7.23 -0.26 -4.85 120.40 109.29 3h6i s VAL 439 Ca -0.06 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.12 3h6i s VAL 439 Cb -0.03 -1.86 0.00 0.00 0.56 0.00 0.00 36.38 35.04 3h6i s VAL 439 CO 0.03 -0.44 0.00 0.61 -0.31 0.00 0.00 175.10 174.99 3h6i n GLY 440 N 0.09 -3.04 0.29 2.32 0.00 -1.26 -1.63 105.19 101.96 3h6i n GLY 440 Ca -0.12 -2.16 0.16 0.00 0.00 0.00 0.00 46.02 43.91 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 -0.45 1.61 4.64 -1.96 -1.17 113.55 116.23 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 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 3h6i n GLY 442 N -0.78 3.04 0.33 -0.77 0.00 -1.26 -4.74 105.19 101.00 3h6i n GLY 442 Ca -0.02 -0.71 0.08 0.00 0.00 0.00 0.00 46.02 45.38 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 2.78 0.70 -0.31 1.61 4.64 -1.41 -1.33 113.55 120.22 3h6i h SER 443 Ca 0.00 0.08 -0.07 0.00 -0.47 0.00 0.00 61.79 61.33 3h6i h SER 443 Cb 1.14 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.17 3h6i h SER 443 CO 0.12 0.31 -0.07 -0.07 -0.87 0.00 0.00 176.83 176.25 3h6i h LEU 444 N 0.76 0.61 -0.69 5.97 4.07 -1.85 0.24 115.31 124.41 3h6i h LEU 444 Ca 0.50 -0.36 -0.08 0.00 0.08 0.00 0.00 57.88 58.01 3h6i h LEU 444 Cb 0.66 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 42.21 3h6i h LEU 444 CO -0.34 0.83 0.09 -0.26 -1.08 0.00 0.00 178.44 177.69 3h6i h PHE 445 N 0.38 1.18 -0.32 1.13 0.04 -1.80 -1.26 116.94 116.29 3h6i h PHE 445 Ca 0.08 -0.17 -0.02 0.00 2.80 0.00 0.00 57.97 60.66 3h6i h PHE 445 Cb 0.56 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 3h6i h PHE 445 CO 0.05 0.99 0.10 0.00 -0.60 0.00 0.00 178.31 178.85 3h6i h ALA 446 N 1.06 0.41 -0.46 2.45 0.00 -1.05 -1.96 119.26 119.72 3h6i h ALA 446 Ca 0.20 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 3h6i h ALA 446 Cb 0.46 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 3h6i h ALA 446 CO 0.02 0.05 -0.05 0.87 0.00 0.00 0.00 179.25 180.13 3h6i h LYS 447 N 0.35 0.78 0.00 0.00 1.57 -0.84 -0.63 116.57 117.81 3h6i h LYS 447 Ca 0.10 -0.23 -0.07 0.00 -1.87 0.00 0.00 60.65 58.57 3h6i h LYS 447 Cb 0.24 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 3h6i h LYS 447 CO -0.00 0.83 -0.35 0.77 -0.57 0.00 0.00 179.45 180.12 3h6i h SER 448 N 0.72 0.00 0.11 0.86 0.02 -1.14 -0.12 113.55 114.00 3h6i h SER 448 Ca 0.13 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.89 3h6i h SER 448 Cb 0.52 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.08 3h6i h SER 448 CO 0.03 0.35 -0.83 -1.28 -1.14 0.00 0.00 176.83 173.96 3h6i h SER 449 N 0.00 0.54 -0.38 3.07 0.87 -1.04 -3.24 113.55 113.36 3h6i h SER 449 Ca -0.00 -0.89 -0.05 0.00 -1.23 0.00 0.00 61.79 59.61 3h6i h SER 449 Cb 0.79 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.56 3h6i h SER 449 CO 0.05 1.38 0.08 0.24 -0.53 0.00 0.00 176.83 178.05 3h6i h MET 450 N -0.22 0.71 -0.76 2.24 2.07 -0.80 -2.14 114.93 116.02 3h6i h MET 450 Ca -0.14 -0.15 0.12 0.00 -2.07 0.00 0.00 59.70 57.46 3h6i h MET 450 Cb 1.61 -0.11 -0.08 0.00 -1.87 0.00 0.00 31.60 31.15 3h6i h MET 450 CO 0.16 0.67 0.37 -0.22 1.07 0.00 0.00 176.91 178.96 3h6i h LYS 451 N 0.68 0.57 0.00 1.72 3.64 -1.07 0.65 116.57 122.76 3h6i h LYS 451 Ca 0.15 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 3h6i h LYS 451 Cb 0.30 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 3h6i h LYS 451 CO 0.00 0.38 -0.26 0.87 -2.27 0.00 0.00 179.45 178.17 3h6i h LYS 452 N 0.59 0.00 0.00 1.90 1.79 -1.48 -3.37 116.57 116.00 3h6i h LYS 452 Ca 0.39 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.86 3h6i h LYS 452 Cb 0.48 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.13 3h6i h LYS 452 CO -0.32 0.00 -1.24 1.28 -1.08 0.00 0.00 179.45 178.09 3h6i n LEU 453 N -2.43 0.18 -0.15 2.94 4.77 -0.34 -4.63 117.00 117.33 3h6i n LEU 453 Ca 0.04 -0.16 0.23 0.00 -0.03 0.00 0.00 56.01 56.09 3h6i n LEU 453 Cb 0.46 0.00 0.64 0.00 -2.33 0.00 0.00 43.42 42.19 3h6i n LEU 453 CO 0.34 0.04 1.23 0.22 -1.33 0.00 0.00 177.39 177.89 3h6i h TYR 454 N 0.00 0.19 0.00 -1.77 3.20 0.08 -1.02 116.97 117.65 3h6i h TYR 454 Ca 0.00 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 3h6i h TYR 454 Cb 0.47 -0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.68 3h6i h TYR 454 CO 0.00 0.06 -0.00 0.66 -1.64 0.00 0.00 178.16 177.23 3h6i h SER 455 N 0.15 0.00 0.05 -2.11 4.64 -1.84 -1.04 113.55 113.40 3h6i h SER 455 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 3h6i h SER 455 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3h6i h SER 455 CO -0.06 0.00 -0.01 0.00 -0.87 0.00 0.00 176.83 175.89 3h6i n GLN 456 N -3.10 1.14 -2.93 4.77 6.02 -0.39 -4.78 117.38 118.11 3h6i n GLN 456 Ca -0.03 -0.28 -0.43 0.00 -0.01 0.00 0.00 57.00 56.25 3h6i n GLN 456 Cb 0.10 -1.49 -0.05 0.00 1.02 0.00 0.00 30.24 29.82 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 -2.06 4.56 0.00 5.09 1.01 -0.40 -4.78 120.40 123.82 3h6i s VAL 457 Ca 0.43 0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.68 3h6i s VAL 457 Cb 0.22 -4.42 0.00 0.00 0.00 0.00 0.00 36.38 32.18 3h6i s VAL 457 CO 0.37 -0.91 0.04 0.35 0.00 0.00 0.00 175.10 174.95 3h6i n THR 458 N 6.11 0.00 -3.85 3.92 -2.24 -1.26 -4.81 114.28 112.15 3h6i n THR 458 Ca 0.01 -0.42 -0.03 0.00 -2.27 0.00 0.00 64.05 61.34 3h6i n THR 458 Cb 0.48 1.01 0.01 0.00 -2.10 0.00 0.00 70.33 69.73 3h6i n THR 458 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3h6i s ASP 459 N -0.77 -0.02 0.21 3.42 1.47 -1.26 -4.62 116.67 115.10 3h6i s ASP 459 Ca 0.00 -0.66 -0.10 0.00 1.18 0.00 0.00 52.55 52.97 3h6i s ASP 459 Cb 0.00 0.52 0.30 0.00 -0.34 0.00 0.00 42.92 43.40 3h6i s ASP 459 CO 0.00 -1.02 1.68 1.23 0.68 0.00 0.00 175.17 177.74 3h6i h GLY 460 N 2.00 0.70 1.07 2.12 0.00 -1.95 0.07 103.07 107.08 3h6i h GLY 460 Ca -0.27 0.04 -0.11 0.00 0.00 0.00 0.00 47.33 46.99 3h6i h GLY 460 CO 0.35 -0.17 -0.11 -0.55 0.00 0.00 0.00 176.54 176.05 3h6i h ASP 461 N 0.16 0.97 0.55 0.19 3.32 -1.99 -2.44 116.42 117.18 3h6i h ASP 461 Ca 0.32 -0.36 -0.14 0.00 0.02 0.00 0.00 57.03 56.88 3h6i h ASP 461 Cb 0.51 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 3h6i h ASP 461 CO -0.48 1.11 -0.62 0.77 -1.72 0.00 0.00 179.24 178.29 3h6i h SER 462 N 0.83 0.08 0.32 6.45 4.64 -1.83 -1.65 113.55 122.38 3h6i h SER 462 Ca 0.13 -0.05 -0.12 0.00 -0.47 0.00 0.00 61.79 61.28 3h6i h SER 462 Cb 0.68 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.73 3h6i h SER 462 CO 0.05 0.68 -0.49 1.23 -0.87 0.00 0.00 176.83 177.43 3h6i h GLY 463 N 1.75 0.22 1.12 -0.77 0.00 -0.93 -2.53 103.07 101.92 3h6i h GLY 463 Ca -0.01 -0.23 -0.22 0.00 0.00 0.00 0.00 47.33 46.87 3h6i h GLY 463 CO 0.09 0.21 -0.81 -2.00 0.00 0.00 0.00 176.54 174.02 3h6i h LEU 464 N 0.16 0.87 -0.45 3.11 5.85 -1.15 -2.50 115.31 121.20 3h6i h LEU 464 Ca 0.01 -0.67 0.01 0.00 0.84 0.00 0.00 57.88 58.06 3h6i h LEU 464 Cb 0.93 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 3h6i h LEU 464 CO 0.07 1.41 0.29 -0.09 -0.34 0.00 0.00 178.44 179.78 3h6i h ARG 465 N 0.39 0.57 -0.74 1.25 9.65 -1.22 -1.00 114.38 123.29 3h6i h ARG 465 Ca -0.08 -0.03 -0.05 0.00 -1.10 0.00 0.00 59.98 58.72 3h6i h ARG 465 Cb 1.46 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 29.87 3h6i h ARG 465 CO 0.16 0.38 0.25 0.28 2.80 0.00 0.00 179.97 183.85 3h6i h VAL 466 N 0.59 1.26 -0.60 0.20 2.07 -1.48 0.27 116.25 118.57 3h6i h VAL 466 Ca 0.17 -0.86 -0.08 0.00 0.82 0.00 0.00 66.70 66.75 3h6i h VAL 466 Cb -0.05 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 3h6i h VAL 466 CO -0.04 0.34 0.07 0.00 0.02 0.00 0.00 177.57 177.96 3h6i h ALA 467 N 1.18 0.99 -0.16 1.67 0.00 -1.01 0.05 119.26 121.99 3h6i h ALA 467 Ca 0.24 -0.27 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 3h6i h ALA 467 Cb 0.27 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3h6i h ALA 467 CO -0.01 0.63 -0.49 0.28 0.00 0.00 0.00 179.25 179.66 3h6i h VAL 468 N 0.92 1.34 -0.15 0.00 2.07 -0.04 -2.07 116.25 118.32 3h6i h VAL 468 Ca 0.18 -1.75 -0.04 0.00 0.82 0.00 0.00 66.70 65.91 3h6i h VAL 468 Cb 0.44 2.01 -0.01 0.00 -1.52 0.00 0.00 31.29 32.21 3h6i h VAL 468 CO 0.02 0.54 -0.09 -0.08 0.02 0.00 0.00 177.57 177.97 3h6i h GLU 469 N 0.26 0.23 -0.24 1.57 4.81 -0.31 -0.79 114.58 120.11 3h6i h GLU 469 Ca -0.02 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.12 3h6i h GLU 469 Cb 1.11 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 3h6i h GLU 469 CO 0.10 0.34 -0.04 0.00 -0.73 0.00 0.00 179.01 178.68 3h6i h ALA 470 N 1.69 0.33 -0.34 2.92 0.00 -0.72 -0.59 119.26 122.55 3h6i h ALA 470 Ca 0.05 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3h6i h ALA 470 Cb 0.31 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3h6i h ALA 470 CO 0.02 0.11 0.08 -0.07 0.00 0.00 0.00 179.25 179.39 3h6i h LEU 471 N 0.21 0.45 -0.34 0.00 3.38 -0.89 -0.14 115.31 117.98 3h6i h LEU 471 Ca 0.06 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 3h6i h LEU 471 Cb 0.49 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 3h6i h LEU 471 CO 0.02 0.46 -0.13 0.22 0.09 0.00 0.00 178.44 179.10 3h6i h TYR 472 N 0.49 0.79 -0.26 1.13 3.20 -0.87 -1.00 116.97 120.44 3h6i h TYR 472 Ca 0.12 -0.19 -0.09 0.00 3.14 0.00 0.00 58.73 61.71 3h6i h TYR 472 Cb 0.19 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 3h6i h TYR 472 CO 0.01 0.88 -0.21 -0.44 -1.64 0.00 0.00 178.16 176.76 3h6i h ASP 473 N 0.47 0.48 -0.51 -2.11 3.32 -0.54 -0.17 116.42 117.36 3h6i h ASP 473 Ca 0.08 -0.15 -0.04 0.00 0.02 0.00 0.00 57.03 56.94 3h6i h ASP 473 Cb 0.66 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.06 3h6i h ASP 473 CO 0.04 0.70 0.16 0.00 -1.72 0.00 0.00 179.24 178.42 3h6i h ALA 474 N 1.35 0.67 -0.12 3.45 0.00 -0.61 -2.79 119.26 121.21 3h6i h ALA 474 Ca 0.07 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.64 3h6i h ALA 474 Cb 0.61 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3h6i h ALA 474 CO 0.04 0.33 -0.59 0.00 0.00 0.00 0.00 179.25 179.04 3h6i h ALA 475 N 1.02 0.76 -0.08 0.00 0.00 -0.93 0.27 119.26 120.30 3h6i h ALA 475 Ca 0.17 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3h6i h ALA 475 Cb 0.27 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 3h6i h ALA 475 CO -0.01 0.71 0.05 0.22 0.00 0.00 0.00 179.25 180.22 3h6i h ASP 476 N 0.30 0.09 0.00 0.00 3.58 -0.82 -3.28 116.42 116.29 3h6i h ASP 476 Ca -0.00 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 3h6i h ASP 476 Cb 1.11 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 42.14 3h6i h ASP 476 CO 0.10 0.07 -0.98 0.47 -2.88 0.00 0.00 179.24 176.01 3h6i n ASP 477 N -4.53 2.40 -4.13 2.28 8.00 -0.98 -4.94 116.55 114.65 3h6i n ASP 477 Ca -0.02 -0.22 -0.33 0.00 0.71 0.00 0.00 54.79 54.93 3h6i n ASP 477 Cb 0.08 1.21 -0.15 0.00 -0.02 0.00 0.00 41.12 42.24 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 -2.41 3.94 0.41 -2.24 2.15 0.91 -4.98 116.67 114.45 3h6i s ASP 478 Ca -0.01 -0.97 0.29 0.00 0.43 0.00 0.00 52.55 52.30 3h6i s ASP 478 Cb 0.05 -1.56 1.36 0.00 -0.30 0.00 0.00 42.92 42.47 3h6i s ASP 478 CO 0.28 -0.10 1.88 0.77 -0.17 0.00 0.00 175.17 177.82 3h6i h SER 479 N 7.91 0.00 0.43 -0.34 4.64 -1.85 -1.00 113.55 123.34 3h6i h SER 479 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 3h6i h SER 479 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3h6i h SER 479 CO 0.56 0.00 -0.15 0.00 -0.87 0.00 0.00 176.83 176.37 3h6i n ALA 480 N -1.90 2.83 -2.81 5.18 0.00 -1.26 -4.76 120.51 117.79 3h6i n ALA 480 Ca 0.00 -0.27 -0.34 0.00 0.00 0.00 0.00 53.44 52.84 3h6i n ALA 480 Cb 0.17 -1.31 -0.12 0.00 0.00 0.00 0.00 19.45 18.19 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 -2.59 3.59 -0.13 0.00 2.01 -0.38 -4.74 115.64 113.40 3h6i s THR 481 Ca 0.25 -0.49 -0.22 0.00 0.31 0.00 0.00 61.69 61.53 3h6i s THR 481 Cb 0.20 -2.51 -0.03 0.00 0.01 0.00 0.00 72.50 70.17 3h6i s THR 481 CO 0.51 0.55 0.68 -0.83 -0.69 0.00 0.00 174.62 174.83 3h6i s GLY 482 N -0.16 2.34 0.93 4.40 0.00 -1.26 -4.48 107.32 109.09 3h6i s GLY 482 Ca 0.02 -0.04 -0.15 0.00 0.00 0.00 0.00 44.72 44.55 3h6i s GLY 482 CO 0.03 1.26 1.26 -0.32 0.00 0.00 0.00 173.10 175.32 3h6i s GLY 483 N 0.96 1.70 0.21 0.20 0.00 -1.26 -4.49 107.32 104.64 3h6i s GLY 483 Ca 0.34 -0.99 -0.32 0.00 0.00 0.00 0.00 44.72 43.75 3h6i s GLY 483 CO 0.14 -0.31 1.72 -1.05 0.00 0.00 0.00 173.10 173.60 3h6i n PRO 484 N -3.69 2.77 -3.59 2.90 -0.02 -1.26 -4.92 135.00 127.19 3h6i n PRO 484 Ca 0.12 1.00 -0.40 0.00 -2.02 0.00 0.00 63.50 62.20 3h6i n PRO 484 Cb 0.60 -2.84 -0.09 0.00 -0.02 0.00 0.00 33.50 31.15 3h6i n PRO 484 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3h6i s ASP 485 N 1.12 5.65 0.36 2.55 -1.08 0.24 -4.92 116.67 120.59 3h6i s ASP 485 Ca 0.74 -2.03 0.18 0.00 -0.52 0.00 0.00 52.55 50.92 3h6i s ASP 485 Cb -0.51 -1.98 0.62 0.00 -1.46 0.00 0.00 42.92 39.59 3h6i s ASP 485 CO 0.33 -0.65 1.70 -0.07 0.52 0.00 0.00 175.17 177.01 3h6i h LEU 486 N 8.27 0.00 -0.03 -1.34 3.38 -1.93 0.18 115.31 123.83 3h6i h LEU 486 Ca -0.17 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 3h6i h LEU 486 Cb 1.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 3h6i h LEU 486 CO 0.82 0.40 -0.02 0.58 0.09 0.00 0.00 178.44 180.31 3h6i h VAL 487 N 0.00 1.37 -0.01 1.22 2.07 -1.97 -3.28 116.25 115.66 3h6i h VAL 487 Ca -0.00 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.38 3h6i h VAL 487 Cb 0.95 2.07 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 3h6i h VAL 487 CO 0.05 0.30 -0.40 0.54 0.02 0.00 0.00 177.57 178.09 3h6i n ARG 488 N -4.81 0.58 -3.03 1.57 1.74 -1.21 -4.96 116.66 106.54 3h6i n ARG 488 Ca -0.08 -0.37 -0.12 0.00 -0.77 0.00 0.00 57.85 56.52 3h6i n ARG 488 Cb 0.26 -1.49 0.04 0.00 -1.02 0.00 0.00 32.46 30.25 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 1.40 0.22 3.31 -0.13 0.00 0.43 -5.02 105.19 105.40 3h6i n GLY 489 Ca 0.09 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 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 -3.15 2.83 0.14 -0.61 1.01 -0.08 -4.99 121.20 116.35 3h6i s ILE 490 Ca 0.29 -0.73 0.04 0.00 0.00 0.00 0.00 60.65 60.25 3h6i s ILE 490 Cb -0.13 -2.19 -0.04 0.00 0.01 0.00 0.00 42.46 40.11 3h6i s ILE 490 CO 0.36 0.52 -0.08 -0.36 0.00 0.00 0.00 174.94 175.37 3h6i s PHE 491 N 0.61 1.20 0.43 3.97 0.40 -1.26 -0.59 117.98 122.73 3h6i s PHE 491 Ca -0.08 -0.82 -0.24 0.00 -0.60 0.00 0.00 56.93 55.19 3h6i s PHE 491 Cb -0.16 -0.64 -0.10 0.00 0.51 0.00 0.00 43.02 42.63 3h6i s PHE 491 CO 0.03 0.00 0.95 -2.30 0.70 0.00 0.00 175.22 174.60 3h6i n PRO 492 N -0.18 1.21 -3.05 0.24 -0.02 -1.26 -4.83 135.00 127.11 3h6i n PRO 492 Ca -0.10 0.44 -0.24 0.00 -2.02 0.00 0.00 63.50 61.58 3h6i n PRO 492 Cb 0.61 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.11 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 -1.32 4.55 -0.09 3.45 -4.23 -0.60 -4.91 115.64 112.49 3h6i s THR 493 Ca 0.64 -0.35 -0.30 0.00 -1.18 0.00 0.00 61.69 60.50 3h6i s THR 493 Cb -0.55 -3.69 0.08 0.00 1.34 0.00 0.00 72.50 69.68 3h6i s THR 493 CO 0.56 -0.51 0.72 0.00 -0.54 0.00 0.00 174.62 174.85 3h6i s ALA 494 N -2.52 -1.79 0.04 3.99 0.00 -1.26 -1.18 121.76 119.05 3h6i s ALA 494 Ca 0.45 1.43 0.08 0.00 0.00 0.00 0.00 51.96 53.92 3h6i s ALA 494 Cb -0.10 -0.22 -0.03 0.00 0.00 0.00 0.00 23.12 22.77 3h6i s ALA 494 CO 0.39 -0.36 -0.23 0.08 0.00 0.00 0.00 175.76 175.64 3h6i s VAL 495 N -0.99 1.83 -0.06 0.00 1.01 -0.14 -1.11 120.40 120.94 3h6i s VAL 495 Ca -0.09 -1.25 0.02 0.00 0.00 0.00 0.00 61.98 60.66 3h6i s VAL 495 Cb -0.01 -1.58 0.01 0.00 0.00 0.00 0.00 36.38 34.81 3h6i s VAL 495 CO 0.08 0.27 -0.11 -0.51 0.00 0.00 0.00 175.10 174.83 3h6i s ILE 496 N -0.79 1.03 -0.07 2.22 2.07 -0.57 -1.33 121.20 123.77 3h6i s ILE 496 Ca 0.09 -0.43 0.03 0.00 -1.41 0.00 0.00 60.65 58.92 3h6i s ILE 496 Cb -0.09 -0.95 0.01 0.00 0.13 0.00 0.00 42.46 41.56 3h6i s ILE 496 CO 0.02 0.33 -0.13 -0.63 -1.91 0.00 0.00 174.94 172.61 3h6i s ILE 497 N 0.61 1.22 0.00 2.00 1.01 0.20 -0.83 121.20 125.40 3h6i s ILE 497 Ca -0.12 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 59.99 3h6i s ILE 497 Cb -0.15 -1.10 0.00 0.00 0.01 0.00 0.00 42.46 41.22 3h6i s ILE 497 CO 0.03 0.37 0.00 -0.90 0.00 0.00 0.00 174.94 174.44 3h6i n ASP 498 N 3.73 0.00 0.12 3.58 5.68 -1.14 -0.96 116.55 127.56 3h6i n ASP 498 Ca -0.22 -0.48 0.18 0.00 -0.50 0.00 0.00 54.79 53.77 3h6i n ASP 498 Cb 0.52 0.00 0.74 0.00 -1.14 0.00 0.00 41.12 41.24 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 2.14 -0.08 2.12 0.00 -1.93 -0.42 119.26 122.19 3h6i h ALA 499 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3h6i h ALA 499 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3h6i h ALA 499 CO 0.00 -0.44 0.00 -0.25 0.00 0.00 0.00 179.25 178.56 3h6i n ASP 500 N -4.11 1.19 0.00 0.00 8.00 -1.26 -5.03 116.55 115.33 3h6i n ASP 500 Ca 0.05 -1.53 0.00 0.00 0.71 0.00 0.00 54.79 54.02 3h6i n ASP 500 Cb 0.44 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.49 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 1.08 0.73 3.70 0.44 0.00 -0.17 -5.00 105.19 105.97 3h6i n GLY 501 Ca 0.17 -2.19 -0.39 0.00 0.00 0.00 0.00 46.02 43.61 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 -1.11 3.42 0.01 4.61 0.00 0.12 -2.89 121.76 125.91 3h6i s ALA 502 Ca 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 51.96 51.96 3h6i s ALA 502 Cb 0.00 -2.90 -0.01 0.00 0.00 0.00 0.00 23.12 20.21 3h6i s ALA 502 CO 0.00 -0.20 -0.09 0.14 0.00 0.00 0.00 175.76 175.62 3h6i s VAL 503 N 1.05 0.67 0.17 0.00 -7.23 -0.01 -4.99 120.40 110.06 3h6i s VAL 503 Ca 0.33 -0.59 -0.30 0.00 -1.81 0.00 0.00 61.98 59.61 3h6i s VAL 503 Cb -0.17 -0.61 -0.08 0.00 0.56 0.00 0.00 36.38 36.09 3h6i s VAL 503 CO 0.14 0.03 1.22 -1.81 -0.31 0.00 0.00 175.10 174.38 3h6i s ASP 504 N -0.63 7.04 0.03 4.85 1.01 -1.26 -1.52 116.67 126.19 3h6i s ASP 504 Ca 0.00 2.25 -0.28 0.00 0.71 0.00 0.00 52.55 55.23 3h6i s ASP 504 Cb -0.05 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.23 3h6i s ASP 504 CO 0.00 -0.42 0.89 -0.69 0.21 0.00 0.00 175.17 175.16 3h6i s VAL 505 N 0.11 4.77 0.28 -1.27 1.01 -0.27 -4.91 120.40 120.13 3h6i s VAL 505 Ca 0.54 1.89 -0.30 0.00 0.00 0.00 0.00 61.98 64.11 3h6i s VAL 505 Cb -0.33 -4.24 -0.11 0.00 0.00 0.00 0.00 36.38 31.69 3h6i s VAL 505 CO 0.36 0.25 1.61 -2.84 0.00 0.00 0.00 175.10 174.48 3h6i s PRO 506 N 0.51 4.12 0.44 2.72 0.02 -1.26 -4.64 135.00 136.92 3h6i s PRO 506 Ca 0.46 2.58 0.23 0.00 0.02 0.00 0.00 61.00 64.29 3h6i s PRO 506 Cb -0.21 -3.03 1.23 0.00 0.02 0.00 0.00 34.50 32.51 3h6i s PRO 506 CO 0.26 -0.65 1.78 1.49 -0.33 0.00 0.00 177.00 179.55 3h6i h GLU 507 N 5.13 0.27 -0.59 5.54 4.81 -1.95 -1.36 114.58 126.42 3h6i h GLU 507 Ca -0.46 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 58.67 3h6i h GLU 507 Cb 1.22 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.51 3h6i h GLU 507 CO 0.82 0.18 0.07 0.66 -0.73 0.00 0.00 179.01 180.00 3h6i h SER 508 N 0.28 0.97 -0.25 1.04 4.64 -1.99 -0.73 113.55 117.51 3h6i h SER 508 Ca 0.58 -0.28 -0.01 0.00 -0.47 0.00 0.00 61.79 61.61 3h6i h SER 508 Cb 1.70 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 63.52 3h6i h SER 508 CO -0.22 1.00 0.11 -0.09 -0.87 0.00 0.00 176.83 176.76 3h6i h ARG 509 N 0.90 0.37 -0.77 4.77 9.65 -1.62 -1.66 114.38 126.02 3h6i h ARG 509 Ca 0.18 -0.06 -0.03 0.00 -1.10 0.00 0.00 59.98 58.96 3h6i h ARG 509 Cb 0.46 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 28.95 3h6i h ARG 509 CO 0.02 0.40 0.36 0.82 2.80 0.00 0.00 179.97 184.37 3h6i h ILE 510 N 0.26 1.24 -0.84 1.20 2.04 -1.40 -1.58 117.51 118.43 3h6i h ILE 510 Ca 0.08 -0.69 -0.00 0.00 1.00 0.00 0.00 64.86 65.26 3h6i h ILE 510 Cb 0.16 0.26 -0.04 0.00 -0.74 0.00 0.00 36.82 36.46 3h6i h ILE 510 CO -0.01 0.29 0.51 0.00 0.00 0.00 0.00 178.15 178.95 3h6i h ALA 511 N 1.30 1.07 -0.28 1.87 0.00 -0.82 0.22 119.26 122.63 3h6i h ALA 511 Ca 0.27 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 3h6i h ALA 511 Cb 0.12 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3h6i h ALA 511 CO -0.03 0.53 -0.38 1.49 0.00 0.00 0.00 179.25 180.86 3h6i h GLU 512 N 1.15 0.64 -0.22 0.00 4.81 -0.92 -0.03 114.58 120.02 3h6i h GLU 512 Ca 0.30 -0.31 -0.10 0.00 -0.13 0.00 0.00 59.36 59.12 3h6i h GLU 512 Cb -0.06 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 3h6i h GLU 512 CO -0.06 0.91 -0.24 -0.07 -0.73 0.00 0.00 179.01 178.82 3h6i h LEU 513 N 0.53 0.59 -0.71 1.64 3.38 -0.69 -1.35 115.31 118.71 3h6i h LEU 513 Ca 0.05 -0.49 -0.01 0.00 0.09 0.00 0.00 57.88 57.52 3h6i h LEU 513 Cb 0.89 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 3h6i h LEU 513 CO 0.08 0.96 0.39 0.00 0.09 0.00 0.00 178.44 179.96 3h6i h ALA 514 N 0.65 0.90 -0.05 1.53 0.00 -0.45 -1.14 119.26 120.70 3h6i h ALA 514 Ca 0.03 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 3h6i h ALA 514 Cb 0.80 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 3h6i h ALA 514 CO 0.06 0.41 -0.55 0.00 0.00 0.00 0.00 179.25 179.18 3h6i h ARG 515 N 0.97 0.14 -0.43 0.00 3.08 -0.94 -1.10 114.38 116.10 3h6i h ARG 515 Ca 0.25 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 60.18 3h6i h ARG 515 Cb 0.03 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 3h6i h ARG 515 CO -0.04 0.65 0.14 0.00 -1.07 0.00 0.00 179.97 179.65 3h6i h ALA 516 N 1.33 0.56 -0.23 0.04 0.00 -0.65 0.59 119.26 120.91 3h6i h ALA 516 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3h6i h ALA 516 Cb 1.00 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 3h6i h ALA 516 CO 0.08 0.20 0.15 0.82 0.00 0.00 0.00 179.25 180.50 3h6i h ILE 517 N 0.56 1.06 -0.71 0.00 2.04 -0.88 0.25 117.51 119.83 3h6i h ILE 517 Ca 0.14 -0.11 -0.05 0.00 1.00 0.00 0.00 64.86 65.84 3h6i h ILE 517 Cb 0.25 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 3h6i h ILE 517 CO -0.01 0.06 0.25 0.40 0.00 0.00 0.00 178.15 178.85 3h6i h ILE 518 N 0.31 1.25 -0.61 -0.67 2.04 -0.75 0.34 117.51 119.43 3h6i h ILE 518 Ca 0.08 -0.84 -0.10 0.00 1.00 0.00 0.00 64.86 65.01 3h6i h ILE 518 Cb -0.03 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.49 3h6i h ILE 518 CO -0.02 0.33 0.00 -0.08 0.00 0.00 0.00 178.15 178.38 3h6i h GLU 519 N 1.03 1.07 -0.49 2.37 4.81 0.88 -1.70 114.58 122.55 3h6i h GLU 519 Ca 0.23 -0.34 -0.04 0.00 -0.13 0.00 0.00 59.36 59.08 3h6i h GLU 519 Cb 0.26 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 3h6i h GLU 519 CO -0.01 1.05 0.16 1.03 -0.73 0.00 0.00 179.01 180.51 3h6i h SER 520 N 0.97 0.71 1.27 1.04 0.87 -0.05 -2.65 113.55 115.71 3h6i h SER 520 Ca 0.17 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 3h6i h SER 520 Cb 0.56 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 3h6i h SER 520 CO 0.03 0.72 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 -0.74 -3.51 114.38 116.11 3h6i h ARG 521 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 3h6i h ARG 521 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 3h6i h ARG 521 CO -0.01 0.00 0.00 0.43 -1.07 0.00 0.00 179.97 179.32