#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 2.03 0.17 12.58 -1.09 -0.32 -2.21 121.20 132.35 3h6i s ILE 303 Ca 0.00 -1.01 0.10 0.00 -2.23 0.00 0.00 60.65 57.51 3h6i s ILE 303 Cb 0.00 -1.75 -0.04 0.00 -1.58 0.00 0.00 42.46 39.09 3h6i s ILE 303 CO 0.00 0.56 -0.21 0.68 -1.23 0.00 0.00 174.94 174.74 3h6i s VAL 304 N 0.25 2.57 -0.06 2.92 -7.23 -0.20 -1.26 120.40 117.38 3h6i s VAL 304 Ca -0.16 -1.83 -0.05 0.00 -1.81 0.00 0.00 61.98 58.14 3h6i s VAL 304 Cb -0.17 -2.22 0.02 0.00 0.56 0.00 0.00 36.38 34.58 3h6i s VAL 304 CO 0.08 -0.04 0.16 0.00 -0.31 0.00 0.00 175.10 174.99 3h6i s ALA 305 N -1.48 -0.38 0.03 1.32 0.00 -0.34 -1.14 121.76 119.78 3h6i s ALA 305 Ca 0.20 0.54 -0.03 0.00 0.00 0.00 0.00 51.96 52.67 3h6i s ALA 305 Cb -0.09 -0.33 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 3h6i s ALA 305 CO 0.10 -0.10 0.04 -0.48 0.00 0.00 0.00 175.76 175.32 3h6i s LEU 306 N 0.41 2.01 -0.09 0.00 0.05 0.40 -1.36 118.68 120.11 3h6i s LEU 306 Ca -0.03 -0.53 -0.12 0.00 0.05 0.00 0.00 54.13 53.50 3h6i s LEU 306 Cb -0.04 0.38 -0.05 0.00 -2.05 0.00 0.00 46.19 44.43 3h6i s LEU 306 CO -0.02 -0.42 0.29 -0.54 -0.55 0.00 0.00 176.35 175.11 3h6i s LYS 307 N -2.16 3.89 0.16 1.48 1.02 0.12 -0.67 119.74 123.58 3h6i s LYS 307 Ca -0.09 0.14 0.03 0.00 0.02 0.00 0.00 55.97 56.07 3h6i s LYS 307 Cb -0.04 -3.28 -0.05 0.00 -0.52 0.00 0.00 37.83 33.94 3h6i s LYS 307 CO -0.03 0.57 -0.05 1.52 -0.92 0.00 0.00 175.35 176.44 3h6i s TYR 308 N -0.54 1.25 0.01 3.18 -0.85 -0.06 -4.95 117.35 115.38 3h6i s TYR 308 Ca 0.18 -0.88 -0.30 0.00 -0.52 0.00 0.00 57.07 55.55 3h6i s TYR 308 Cb -0.14 -0.69 -0.08 0.00 0.38 0.00 0.00 41.96 41.44 3h6i s TYR 308 CO 0.07 -0.05 1.81 -2.14 -1.52 0.00 0.00 175.55 173.72 3h6i s PRO 309 N -3.83 4.16 0.00 -3.49 0.02 -1.26 -0.81 135.00 129.80 3h6i s PRO 309 Ca 0.20 2.42 0.00 0.00 0.02 0.00 0.00 61.00 63.64 3h6i s PRO 309 Cb 0.04 -4.02 0.00 0.00 0.02 0.00 0.00 34.50 30.55 3h6i s PRO 309 CO 0.02 -0.89 0.00 0.41 -0.33 0.00 0.00 177.00 176.21 3h6i n GLY 310 N 4.32 0.78 3.35 0.52 0.00 0.70 -4.73 105.19 110.13 3h6i n GLY 310 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.36 0.66 3.04 -0.02 0.00 0.01 -4.12 105.19 102.40 3h6i n GLY 311 Ca 0.00 -1.11 -0.12 0.00 0.00 0.00 0.00 46.02 44.79 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 -2.12 0.40 0.00 1.61 0.11 0.22 -0.89 120.40 119.74 3h6i s VAL 312 Ca 0.20 -1.04 0.05 0.00 -2.93 0.00 0.00 61.98 58.26 3h6i s VAL 312 Cb -0.02 -0.52 -0.01 0.00 -1.53 0.00 0.00 36.38 34.29 3h6i s VAL 312 CO 0.04 -0.43 -0.14 0.54 -3.33 0.00 0.00 175.10 171.78 3h6i s VAL 313 N -1.45 1.14 -0.05 2.04 0.11 0.16 -0.16 120.40 122.19 3h6i s VAL 313 Ca -0.12 -0.73 0.02 0.00 -2.93 0.00 0.00 61.98 58.22 3h6i s VAL 313 Cb -0.10 -0.98 0.01 0.00 -1.53 0.00 0.00 36.38 33.79 3h6i s VAL 313 CO -0.00 0.23 -0.10 -0.32 -3.33 0.00 0.00 175.10 171.58 3h6i s MET 314 N -0.58 1.34 0.02 1.54 1.75 0.03 -0.45 119.30 122.96 3h6i s MET 314 Ca 0.05 -0.35 0.02 0.00 -1.25 0.00 0.00 55.69 54.16 3h6i s MET 314 Cb -0.06 -1.17 -0.02 0.00 2.84 0.00 0.00 34.83 36.42 3h6i s MET 314 CO 0.00 0.06 -0.07 0.00 -0.65 0.00 0.00 175.02 174.35 3h6i s ALA 315 N 0.51 0.57 0.04 4.11 0.00 -0.29 -0.57 121.76 126.13 3h6i s ALA 315 Ca -0.10 -0.57 0.04 0.00 0.00 0.00 0.00 51.96 51.33 3h6i s ALA 315 Cb -0.13 -0.03 -0.02 0.00 0.00 0.00 0.00 23.12 22.93 3h6i s ALA 315 CO 0.02 0.05 -0.11 0.20 0.00 0.00 0.00 175.76 175.92 3h6i s GLY 316 N -0.99 0.67 0.92 0.00 0.00 -0.44 -1.03 107.32 106.44 3h6i s GLY 316 Ca -0.04 -0.79 -0.15 0.00 0.00 0.00 0.00 44.72 43.73 3h6i s GLY 316 CO 0.00 -0.81 0.94 2.09 0.00 0.00 0.00 173.10 175.33 3h6i n ASP 317 N 1.71 -1.21 -0.01 1.64 5.75 -0.94 -1.94 116.55 121.54 3h6i n ASP 317 Ca -0.20 -1.16 0.00 0.00 -0.01 0.00 0.00 54.79 53.43 3h6i n ASP 317 Cb 0.55 -0.81 0.00 0.00 -1.03 0.00 0.00 41.12 39.83 3h6i n ASP 317 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3h6i n ARG 318 N -3.87 1.36 -3.15 0.11 5.12 -1.26 -4.54 116.66 110.43 3h6i n ARG 318 Ca 0.13 -1.10 -0.30 0.00 -1.93 0.00 0.00 57.85 54.65 3h6i n ARG 318 Cb 0.47 -1.01 -0.03 0.00 -1.16 0.00 0.00 32.46 30.73 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 -0.60 3.72 -0.01 5.56 3.52 -1.26 -0.84 118.95 129.04 3h6i s ARG 319 Ca 0.00 0.23 -0.02 0.00 -0.13 0.00 0.00 55.73 55.82 3h6i s ARG 319 Cb 0.00 -2.54 -0.00 0.00 -1.56 0.00 0.00 34.95 30.85 3h6i s ARG 319 CO 0.00 0.12 0.04 -1.54 -0.81 0.00 0.00 175.30 173.12 3h6i s SER 320 N -3.06 0.02 0.08 -2.12 1.04 -0.89 -4.83 113.70 103.94 3h6i s SER 320 Ca 0.47 -0.07 0.05 0.00 0.48 0.00 0.00 55.95 56.88 3h6i s SER 320 Cb -0.11 0.12 -0.03 0.00 0.10 0.00 0.00 66.02 66.10 3h6i s SER 320 CO 0.29 -0.12 -0.14 0.42 0.98 0.00 0.00 173.24 174.67 3h6i s THR 321 N -0.48 1.14 -0.41 2.02 -4.23 -1.26 -1.51 115.64 110.91 3h6i s THR 321 Ca -0.05 -1.41 0.02 0.00 -1.18 0.00 0.00 61.69 59.06 3h6i s THR 321 Cb -0.03 -1.19 0.12 0.00 1.34 0.00 0.00 72.50 72.74 3h6i s THR 321 CO -0.00 -0.29 0.19 -1.58 -0.54 0.00 0.00 174.62 172.40 3h6i s GLN 322 N -2.01 1.24 7.36 3.99 0.74 -0.64 -4.87 119.66 125.48 3h6i s GLN 322 Ca 0.01 -1.84 0.00 0.00 0.05 0.00 0.00 55.36 53.58 3h6i s GLN 322 Cb -0.08 -2.44 0.00 0.00 1.10 0.00 0.00 33.01 31.59 3h6i s GLN 322 CO 0.02 -1.09 0.00 0.41 -0.55 0.00 0.00 175.29 174.08 3h6i n GLY 323 N 3.87 2.32 0.03 2.59 0.00 -1.26 -2.21 105.19 110.53 3h6i n GLY 323 Ca 0.05 -0.34 0.12 0.00 0.00 0.00 0.00 46.02 45.85 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 7.47 0.54 -4.77 1.61 3.02 -1.26 -4.93 115.26 116.94 3h6i n ASN 324 Ca 0.00 -0.01 -0.39 0.00 -0.03 0.00 0.00 54.58 54.15 3h6i n ASN 324 Cb 0.00 0.12 -0.06 0.00 -0.61 0.00 0.00 39.78 39.23 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 -3.07 4.65 -0.48 3.52 -1.94 -0.94 -5.01 119.30 116.03 3h6i s MET 325 Ca 0.09 1.28 -0.27 0.00 -1.71 0.00 0.00 55.69 55.08 3h6i s MET 325 Cb 0.16 -3.16 0.03 0.00 2.01 0.00 0.00 34.83 33.87 3h6i s MET 325 CO 0.69 0.49 1.02 0.42 -0.01 0.00 0.00 175.02 177.63 3h6i s ILE 326 N -1.27 4.34 -0.45 2.53 1.01 -1.26 -1.61 121.20 124.49 3h6i s ILE 326 Ca 0.41 0.93 0.22 0.00 0.00 0.00 0.00 60.65 62.21 3h6i s ILE 326 Cb -0.23 -4.52 -0.21 0.00 0.01 0.00 0.00 42.46 37.52 3h6i s ILE 326 CO 0.27 -0.94 0.81 -1.54 0.00 0.00 0.00 174.94 173.55 3h6i n SER 327 N 7.50 0.49 -3.75 3.58 3.41 -0.57 -4.97 113.62 119.31 3h6i n SER 327 Ca 0.08 -0.24 -0.13 0.00 -0.26 0.00 0.00 58.87 58.32 3h6i n SER 327 Cb 0.49 1.24 -0.10 0.00 -0.26 0.00 0.00 64.21 65.58 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 -3.90 -0.24 0.00 5.00 0.00 -1.05 -4.91 107.32 102.22 3h6i s GLY 328 Ca -0.00 0.81 0.00 0.00 0.00 0.00 0.00 44.72 45.53 3h6i s GLY 328 CO 0.85 0.64 0.00 0.54 0.00 0.00 0.00 173.10 175.14 3h6i n ARG 329 N 2.35 5.87 -1.44 2.90 1.74 -1.24 -2.09 116.66 124.75 3h6i n ARG 329 Ca -0.16 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 56.94 3h6i n ARG 329 Cb 0.57 -0.44 0.09 0.00 -1.02 0.00 0.00 32.46 31.65 3h6i n ARG 329 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3h6i n ASP 330 N -0.87 1.70 -4.70 0.55 5.75 -1.08 -4.63 116.55 113.27 3h6i n ASP 330 Ca 0.00 -2.80 -0.42 0.00 -0.01 0.00 0.00 54.79 51.56 3h6i n ASP 330 Cb 0.00 -0.40 -0.03 0.00 -1.03 0.00 0.00 41.12 39.66 3h6i n ASP 330 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3h6i s VAL 331 N -2.02 3.42 -0.33 2.12 1.01 -0.02 -4.98 120.40 119.60 3h6i s VAL 331 Ca 0.36 0.91 -0.14 0.00 0.00 0.00 0.00 61.98 63.10 3h6i s VAL 331 Cb 0.38 -3.58 -0.02 0.00 0.00 0.00 0.00 36.38 33.15 3h6i s VAL 331 CO -0.10 0.02 0.33 -0.60 0.00 0.00 0.00 175.10 174.76 3h6i s ARG 332 N 1.99 3.66 -0.01 2.72 3.52 -1.26 -4.23 118.95 125.34 3h6i s ARG 332 Ca 0.66 -0.37 0.15 0.00 -0.13 0.00 0.00 55.73 56.04 3h6i s ARG 332 Cb -0.35 -3.77 -0.20 0.00 -1.56 0.00 0.00 34.95 29.07 3h6i s ARG 332 CO 0.29 -0.44 0.44 1.63 -0.81 0.00 0.00 175.30 176.41 3h6i n LYS 333 N 5.31 1.16 -4.32 5.12 5.02 -1.26 -4.66 118.16 124.53 3h6i n LYS 333 Ca -0.10 -0.08 -0.34 0.00 -2.02 0.00 0.00 58.31 55.77 3h6i n LYS 333 Cb 0.50 -1.29 -0.14 0.00 -0.02 0.00 0.00 35.03 34.08 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 -2.77 3.28 0.00 -0.18 1.01 -1.26 -2.52 120.40 117.96 3h6i s VAL 334 Ca -0.01 -0.55 0.03 0.00 0.00 0.00 0.00 61.98 61.45 3h6i s VAL 334 Cb 0.10 -2.44 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 3h6i s VAL 334 CO 0.61 0.48 -0.10 -0.31 0.00 0.00 0.00 175.10 175.78 3h6i s TYR 335 N 0.88 0.87 0.04 5.22 1.51 -0.20 -4.95 117.35 120.71 3h6i s TYR 335 Ca -0.02 -0.20 -0.30 0.00 -1.01 0.00 0.00 57.07 55.53 3h6i s TYR 335 Cb -0.15 -0.55 -0.05 0.00 -0.11 0.00 0.00 41.96 41.10 3h6i s TYR 335 CO 0.01 -0.01 1.23 0.42 -1.11 0.00 0.00 175.55 176.08 3h6i s ILE 336 N -0.37 4.01 -0.15 2.71 1.01 -1.26 -1.28 121.20 125.88 3h6i s ILE 336 Ca 0.03 1.42 0.13 0.00 0.00 0.00 0.00 60.65 62.23 3h6i s ILE 336 Cb -0.04 -3.91 -0.19 0.00 0.01 0.00 0.00 42.46 38.32 3h6i s ILE 336 CO -0.00 0.08 0.35 0.35 0.00 0.00 0.00 174.94 175.72 3h6i n THR 337 N 4.12 0.00 -3.84 2.92 -2.24 -0.22 -4.93 114.28 110.08 3h6i n THR 337 Ca 0.10 -0.28 -0.05 0.00 -2.27 0.00 0.00 64.05 61.55 3h6i n THR 337 Cb 0.46 0.38 0.01 0.00 -2.10 0.00 0.00 70.33 69.08 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 -3.23 -0.03 0.52 3.42 -4.77 -1.19 -4.32 116.67 107.07 3h6i s ASP 338 Ca -0.03 -0.81 0.23 0.00 -3.30 0.00 0.00 52.55 48.64 3h6i s ASP 338 Cb 0.09 0.63 1.35 0.00 -1.09 0.00 0.00 42.92 43.90 3h6i s ASP 338 CO 0.55 -1.25 2.03 0.44 0.70 0.00 0.00 175.17 177.64 3h6i h ASP 339 N 2.00 0.02 -0.01 2.11 3.32 -1.97 -2.84 116.42 119.05 3h6i h ASP 339 Ca -0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.77 3h6i h ASP 339 Cb 1.23 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 3h6i h ASP 339 CO 0.36 0.01 0.00 -1.22 -1.72 0.00 0.00 179.24 176.67 3h6i n TYR 340 N -4.42 0.02 -4.03 4.55 4.02 -1.26 0.48 117.16 116.52 3h6i n TYR 340 Ca 0.07 -0.70 -0.08 0.00 -0.01 0.00 0.00 57.90 57.18 3h6i n TYR 340 Cb 0.48 -0.09 -0.10 0.00 -0.02 0.00 0.00 39.34 39.61 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 -1.75 0.18 -0.07 -0.72 -4.23 -1.07 -1.44 115.64 106.54 3h6i s THR 341 Ca 0.13 -1.50 -0.09 0.00 -1.18 0.00 0.00 61.69 59.05 3h6i s THR 341 Cb 0.12 -1.21 0.02 0.00 1.34 0.00 0.00 72.50 72.76 3h6i s THR 341 CO 0.02 -0.83 0.23 0.00 -0.54 0.00 0.00 174.62 173.50 3h6i s ALA 342 N -3.33 -0.57 0.12 3.99 0.00 -0.13 -1.06 121.76 120.78 3h6i s ALA 342 Ca 0.01 0.51 0.10 0.00 0.00 0.00 0.00 51.96 52.59 3h6i s ALA 342 Cb 0.04 -0.27 -0.04 0.00 0.00 0.00 0.00 23.12 22.85 3h6i s ALA 342 CO -0.08 -0.14 -0.24 0.95 0.00 0.00 0.00 175.76 176.25 3h6i s THR 343 N -0.26 2.43 -0.02 0.00 -4.23 -0.40 -0.67 115.64 112.49 3h6i s THR 343 Ca -0.04 -1.68 0.00 0.00 -1.18 0.00 0.00 61.69 58.80 3h6i s THR 343 Cb -0.03 -2.09 0.03 0.00 1.34 0.00 0.00 72.50 71.75 3h6i s THR 343 CO 0.01 0.10 0.02 -0.83 -0.54 0.00 0.00 174.62 173.38 3h6i s GLY 344 N -2.07 0.16 -0.10 3.99 0.00 -0.40 -1.03 107.32 107.86 3h6i s GLY 344 Ca 0.15 0.25 0.03 0.00 0.00 0.00 0.00 44.72 45.15 3h6i s GLY 344 CO 0.07 0.69 -0.19 -0.42 0.00 0.00 0.00 173.10 173.25 3h6i s ILE 345 N 1.10 1.73 -1.40 0.90 1.01 -1.05 -0.72 121.20 122.76 3h6i s ILE 345 Ca -0.09 -0.80 -0.12 0.00 0.00 0.00 0.00 60.65 59.64 3h6i s ILE 345 Cb -0.13 -1.53 0.08 0.00 0.01 0.00 0.00 42.46 40.89 3h6i s ILE 345 CO -0.03 0.49 2.13 0.00 0.00 0.00 0.00 174.94 177.53 3h6i n ALA 346 N 3.85 5.57 -3.00 9.38 0.00 -1.26 -4.78 120.51 130.27 3h6i n ALA 346 Ca -0.20 -4.03 0.00 0.00 0.00 0.00 0.00 53.44 49.22 3h6i n ALA 346 Cb 0.52 -3.33 0.00 0.00 0.00 0.00 0.00 19.45 16.64 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 3.59 3.98 3.74 0.00 0.00 -1.26 -4.70 105.19 110.54 3h6i n GLY 347 Ca 0.49 -1.17 -0.31 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.02 2.99 0.29 2.61 -4.23 -1.26 -4.82 115.64 109.20 3h6i s THR 348 Ca 0.00 0.32 0.03 0.00 -1.18 0.00 0.00 61.69 60.87 3h6i s THR 348 Cb 0.00 -2.75 0.28 0.00 1.34 0.00 0.00 72.50 71.37 3h6i s THR 348 CO 0.00 -0.42 1.76 0.00 -0.54 0.00 0.00 174.62 175.42 3h6i h ALA 349 N -1.35 1.51 -0.18 3.99 0.00 -1.95 -1.75 119.26 119.53 3h6i h ALA 349 Ca -0.45 0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.45 3h6i h ALA 349 Cb 1.25 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 3h6i h ALA 349 CO 0.51 -0.11 -0.27 0.00 0.00 0.00 0.00 179.25 179.37 3h6i h ALA 350 N 1.63 0.28 -0.65 0.00 0.00 -1.92 -1.21 119.26 117.38 3h6i h ALA 350 Ca 0.54 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 3h6i h ALA 350 Cb 0.86 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 3h6i h ALA 350 CO -0.40 0.28 0.19 0.28 0.00 0.00 0.00 179.25 179.60 3h6i h VAL 351 N 0.17 1.25 -0.37 0.00 2.07 -1.76 -0.63 116.25 116.98 3h6i h VAL 351 Ca 0.02 -0.88 -0.05 0.00 0.82 0.00 0.00 66.70 66.61 3h6i h VAL 351 Cb 0.85 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 3h6i h VAL 351 CO 0.06 0.34 0.04 0.00 0.02 0.00 0.00 177.57 178.03 3h6i h ALA 352 N 1.08 0.49 -0.09 1.67 0.00 -1.31 -1.26 119.26 119.84 3h6i h ALA 352 Ca 0.21 -0.22 -0.23 0.00 0.00 0.00 0.00 54.91 54.67 3h6i h ALA 352 Cb 0.31 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.98 3h6i h ALA 352 CO -0.00 0.22 -0.84 -0.24 0.00 0.00 0.00 179.25 178.38 3h6i h VAL 353 N 0.46 1.29 -0.41 0.00 3.04 -1.14 -2.73 116.25 116.75 3h6i h VAL 353 Ca 0.11 -2.06 -0.11 0.00 -1.01 0.00 0.00 66.70 63.63 3h6i h VAL 353 Cb 0.39 2.16 -0.01 0.00 -2.01 0.00 0.00 31.29 31.82 3h6i h VAL 353 CO 0.01 0.64 -0.17 -0.33 -1.01 0.00 0.00 177.57 176.72 3h6i h GLU 354 N 0.44 0.84 -0.08 4.17 4.39 -1.07 -0.61 114.58 122.66 3h6i h GLU 354 Ca -0.08 -0.35 -0.00 0.00 0.34 0.00 0.00 59.36 59.26 3h6i h GLU 354 Cb 1.49 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 30.10 3h6i h GLU 354 CO 0.17 0.99 0.04 0.35 -1.16 0.00 0.00 179.01 179.40 3h6i h PHE 355 N 0.66 0.12 -0.70 4.33 3.04 -1.31 -1.40 116.94 121.69 3h6i h PHE 355 Ca 0.10 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 62.02 3h6i h PHE 355 Cb 0.72 -0.04 -0.03 0.00 2.56 0.00 0.00 35.95 39.16 3h6i h PHE 355 CO 0.05 0.20 0.34 0.00 -2.02 0.00 0.00 178.31 176.88 3h6i h ALA 356 N 0.91 1.29 -0.37 2.41 0.00 -1.39 -0.51 119.26 121.60 3h6i h ALA 356 Ca 0.03 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 3h6i h ALA 356 Cb 0.12 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3h6i h ALA 356 CO -0.00 0.55 -0.13 -0.09 0.00 0.00 0.00 179.25 179.58 3h6i h ARG 357 N 0.98 0.74 -0.32 0.00 2.43 -0.94 0.19 114.38 117.46 3h6i h ARG 357 Ca 0.24 -0.30 -0.11 0.00 -0.81 0.00 0.00 59.98 59.00 3h6i h ARG 357 Cb 0.09 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 3h6i h ARG 357 CO -0.03 0.91 -0.27 1.25 -1.51 0.00 0.00 179.97 180.31 3h6i h LEU 358 N 0.54 0.67 -0.27 3.80 5.85 -0.94 -1.21 115.31 123.75 3h6i h LEU 358 Ca 0.09 -0.25 -0.10 0.00 0.84 0.00 0.00 57.88 58.46 3h6i h LEU 358 Cb 0.66 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 3h6i h LEU 358 CO 0.04 0.92 -0.22 0.22 -0.34 0.00 0.00 178.44 179.06 3h6i h TYR 359 N 0.57 0.74 -0.83 1.25 3.20 -0.75 -1.42 116.97 119.73 3h6i h TYR 359 Ca 0.07 -0.21 -0.02 0.00 3.14 0.00 0.00 58.73 61.72 3h6i h TYR 359 Cb 0.76 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.83 3h6i h TYR 359 CO 0.03 0.92 0.45 0.00 -1.64 0.00 0.00 178.16 177.92 3h6i h ALA 360 N 0.70 1.23 -0.52 1.82 0.00 -0.51 -0.89 119.26 121.10 3h6i h ALA 360 Ca 0.05 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 3h6i h ALA 360 Cb 0.77 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 3h6i h ALA 360 CO 0.06 0.62 -0.12 0.28 0.00 0.00 0.00 179.25 180.08 3h6i h VAL 361 N 1.16 1.27 -0.66 0.00 2.07 -1.00 -2.05 116.25 117.03 3h6i h VAL 361 Ca 0.29 -1.27 -0.08 0.00 0.82 0.00 0.00 66.70 66.46 3h6i h VAL 361 Cb 0.04 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 3h6i h VAL 361 CO -0.05 0.45 0.09 -0.08 0.02 0.00 0.00 177.57 178.00 3h6i h GLU 362 N 0.88 1.11 -0.53 1.57 4.81 -0.56 -0.50 114.58 121.34 3h6i h GLU 362 Ca 0.13 -0.31 -0.12 0.00 -0.13 0.00 0.00 59.36 58.94 3h6i h GLU 362 Cb 0.68 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.92 3h6i h GLU 362 CO 0.05 1.02 -0.12 -0.07 -0.73 0.00 0.00 179.01 179.16 3h6i h LEU 363 N 1.03 1.03 -0.61 1.64 3.38 -1.04 -2.41 115.31 118.33 3h6i h LEU 363 Ca 0.20 -0.36 -0.11 0.00 0.09 0.00 0.00 57.88 57.70 3h6i h LEU 363 Cb 0.46 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3h6i h LEU 363 CO 0.02 1.15 -0.51 -0.08 0.09 0.00 0.00 178.44 179.10 3h6i h GLU 364 N 0.90 0.00 -0.43 1.13 4.81 -1.29 -2.57 114.58 117.12 3h6i h GLU 364 Ca 0.14 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.28 3h6i h GLU 364 Cb 0.69 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.06 3h6i h GLU 364 CO 0.05 0.51 -0.07 1.25 -0.73 0.00 0.00 179.01 180.03 3h6i h HIS 365 N 0.00 0.90 -0.22 0.92 2.76 -0.82 -1.23 115.15 117.46 3h6i h HIS 365 Ca -0.01 -0.18 -0.04 0.00 -2.20 0.00 0.00 60.37 57.94 3h6i h HIS 365 Cb 1.13 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 29.86 3h6i h HIS 365 CO 0.00 0.90 -0.03 -0.92 -1.30 0.00 0.00 177.93 176.58 3h6i h TYR 366 N 0.64 0.46 -0.79 5.26 3.20 -1.30 -2.49 116.97 121.95 3h6i h TYR 366 Ca 0.11 -0.09 0.02 0.00 3.14 0.00 0.00 58.73 61.91 3h6i h TYR 366 Cb 0.59 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.71 3h6i h TYR 366 CO 0.05 0.63 0.52 1.49 -1.64 0.00 0.00 178.16 179.21 3h6i h GLU 367 N 0.15 1.00 0.01 1.82 4.81 -1.10 0.84 114.58 122.12 3h6i h GLU 367 Ca 0.06 -0.06 -0.20 0.00 -0.13 0.00 0.00 59.36 59.02 3h6i h GLU 367 Cb 0.47 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 3h6i h GLU 367 CO 0.02 0.66 -0.90 0.87 -0.73 0.00 0.00 179.01 178.93 3h6i h LYS 368 N 1.03 0.23 0.05 1.92 1.57 -1.20 0.31 116.57 120.49 3h6i h LYS 368 Ca 0.30 -0.26 -0.23 0.00 -1.87 0.00 0.00 60.65 58.59 3h6i h LYS 368 Cb -0.07 0.07 0.02 0.00 0.08 0.00 0.00 32.23 32.34 3h6i h LYS 368 CO -0.07 0.99 -0.94 -0.07 -0.57 0.00 0.00 179.45 178.78 3h6i h LEU 369 N 0.13 0.74 0.00 2.94 3.38 -0.98 -3.36 115.31 118.15 3h6i h LEU 369 Ca -0.05 -0.79 0.00 0.00 0.09 0.00 0.00 57.88 57.12 3h6i h LEU 369 Cb 1.53 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.05 3h6i h LEU 369 CO 0.14 1.44 -1.21 -0.62 0.09 0.00 0.00 178.44 178.28 3h6i n GLU 370 N -3.98 0.15 -0.56 1.13 -0.58 0.25 -4.99 120.64 112.05 3h6i n GLU 370 Ca -0.12 -0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.58 3h6i n GLU 370 Cb 0.84 -1.51 0.00 0.00 -0.57 0.00 0.00 31.44 30.20 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 1.44 1.42 3.16 0.62 0.00 0.11 -5.00 105.19 106.95 3h6i n GLY 371 Ca 0.02 0.00 -0.11 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 -3.40 0.10 0.78 1.61 0.11 -1.21 -4.98 120.40 113.41 3h6i s VAL 372 Ca 0.00 -0.84 -0.11 0.00 -2.93 0.00 0.00 61.98 58.09 3h6i s VAL 372 Cb 0.00 -0.79 0.06 0.00 -1.53 0.00 0.00 36.38 34.12 3h6i s VAL 372 CO 0.00 -0.46 1.09 -2.84 -3.33 0.00 0.00 175.10 169.55 3h6i s PRO 373 N -2.24 2.25 0.78 1.54 0.02 -1.26 -4.04 135.00 132.05 3h6i s PRO 373 Ca -0.08 0.75 -0.11 0.00 0.02 0.00 0.00 61.00 61.59 3h6i s PRO 373 Cb -0.03 -1.93 0.06 0.00 0.02 0.00 0.00 34.50 32.63 3h6i s PRO 373 CO -0.02 -1.53 1.10 -0.51 -0.33 0.00 0.00 177.00 175.71 3h6i s LEU 374 N -5.75 3.03 0.84 -5.54 1.43 -1.26 -5.01 118.68 106.42 3h6i s LEU 374 Ca 0.60 1.88 -0.12 0.00 -1.03 0.00 0.00 54.13 55.47 3h6i s LEU 374 Cb -0.15 -4.53 0.09 0.00 0.03 0.00 0.00 46.19 41.64 3h6i s LEU 374 CO 0.55 -2.15 1.12 0.42 0.23 0.00 0.00 176.35 176.52 3h6i s THR 375 N -2.83 2.58 0.24 5.49 -4.23 -1.26 -4.80 115.64 110.83 3h6i s THR 375 Ca 0.62 0.19 -0.06 0.00 -1.18 0.00 0.00 61.69 61.26 3h6i s THR 375 Cb -0.18 -2.98 0.21 0.00 1.34 0.00 0.00 72.50 70.88 3h6i s THR 375 CO 0.55 -0.25 1.85 0.15 -0.54 0.00 0.00 174.62 176.39 3h6i h PHE 376 N -1.21 0.96 -0.56 3.99 3.57 -1.97 0.05 116.94 121.78 3h6i h PHE 376 Ca -0.48 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.03 3h6i h PHE 376 Cb 1.30 -0.31 -0.03 0.00 2.79 0.00 0.00 35.95 39.70 3h6i h PHE 376 CO 0.39 0.50 0.30 0.00 -2.23 0.00 0.00 178.31 177.26 3h6i h ALA 377 N 1.39 1.48 -0.08 2.41 0.00 -2.00 -1.20 119.26 121.27 3h6i h ALA 377 Ca 0.36 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 55.04 3h6i h ALA 377 Cb 0.14 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3h6i h ALA 377 CO -0.16 0.43 -0.59 0.78 0.00 0.00 0.00 179.25 179.71 3h6i h GLY 378 N 0.84 0.27 0.93 0.00 0.00 -1.44 -1.07 103.07 102.60 3h6i h GLY 378 Ca 0.20 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 47.15 3h6i h GLY 378 CO -0.03 0.30 0.07 0.50 0.00 0.00 0.00 176.54 177.38 3h6i h LYS 379 N 0.19 0.63 -0.65 4.80 1.57 0.07 -1.67 116.57 121.51 3h6i h LYS 379 Ca -0.00 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.59 3h6i h LYS 379 Cb 1.08 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 33.29 3h6i h LYS 379 CO 0.09 0.68 0.30 0.82 -0.57 0.00 0.00 179.45 180.77 3h6i h ILE 380 N 0.48 1.23 -0.59 1.86 2.04 -1.10 -1.62 117.51 119.81 3h6i h ILE 380 Ca 0.12 -0.65 -0.00 0.00 1.00 0.00 0.00 64.86 65.32 3h6i h ILE 380 Cb 0.34 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 36.85 3h6i h ILE 380 CO 0.01 0.27 0.36 -1.13 0.00 0.00 0.00 178.15 177.65 3h6i h ASN 381 N 0.90 0.70 -0.31 1.72 -1.24 -1.02 0.24 115.58 116.57 3h6i h ASN 381 Ca 0.22 -0.05 -0.07 0.00 0.71 0.00 0.00 56.30 57.10 3h6i h ASN 381 Cb 0.14 -0.18 -0.02 0.00 0.73 0.00 0.00 38.32 38.99 3h6i h ASN 381 CO -0.03 0.55 -0.05 0.03 -1.29 0.00 0.00 177.43 176.65 3h6i h ARG 382 N 0.79 0.69 -0.44 6.67 2.47 -1.02 -0.49 114.38 123.06 3h6i h ARG 382 Ca 0.21 -0.19 -0.10 0.00 -1.26 0.00 0.00 59.98 58.64 3h6i h ARG 382 Cb -0.03 -0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 28.20 3h6i h ARG 382 CO -0.04 0.74 -0.12 1.25 0.56 0.00 0.00 179.97 182.36 3h6i h LEU 383 N 0.65 0.87 -0.81 3.04 5.85 -0.56 -1.63 115.31 122.71 3h6i h LEU 383 Ca 0.12 -0.37 -0.10 0.00 0.84 0.00 0.00 57.88 58.37 3h6i h LEU 383 Cb 0.47 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 3h6i h LEU 383 CO 0.02 1.04 -0.23 0.00 -0.34 0.00 0.00 178.44 178.93 3h6i h ALA 384 N 0.86 0.99 -0.49 1.25 0.00 0.04 -0.60 119.26 121.31 3h6i h ALA 384 Ca 0.11 -0.36 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 3h6i h ALA 384 Cb 0.67 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 3h6i h ALA 384 CO 0.05 0.60 -0.10 0.82 0.00 0.00 0.00 179.25 180.62 3h6i h ILE 385 N 0.55 1.26 -0.38 0.00 2.04 -0.89 -0.64 117.51 119.45 3h6i h ILE 385 Ca 0.08 -1.20 -0.16 0.00 1.00 0.00 0.00 64.86 64.58 3h6i h ILE 385 Cb 0.70 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 3h6i h ILE 385 CO 0.05 0.42 -0.39 -0.03 0.00 0.00 0.00 178.15 178.20 3h6i h MET 386 N 0.80 0.93 -0.30 2.37 4.05 -0.73 -1.86 114.93 120.19 3h6i h MET 386 Ca 0.13 -0.50 -0.09 0.00 -0.28 0.00 0.00 59.70 58.97 3h6i h MET 386 Cb 0.61 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.42 3h6i h MET 386 CO 0.04 1.15 -0.17 0.28 0.23 0.00 0.00 176.91 178.44 3h6i h VAL 387 N 0.75 1.30 0.00 -5.77 2.07 -0.83 -2.86 116.25 110.90 3h6i h VAL 387 Ca 0.06 -1.28 -0.07 0.00 0.82 0.00 0.00 66.70 66.22 3h6i h VAL 387 Cb 0.99 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 32.23 3h6i h VAL 387 CO 0.10 0.41 -0.35 0.03 0.02 0.00 0.00 177.57 177.77 3h6i h ARG 388 N 0.39 0.00 0.00 1.57 3.08 -1.09 -2.71 114.38 115.62 3h6i h ARG 388 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3h6i h ARG 388 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.75 3h6i h ARG 388 CO 0.05 0.35 0.00 0.78 -1.07 0.00 0.00 179.97 180.08 3h6i h GLY 389 N 1.50 0.00 0.91 0.04 0.00 -1.24 -3.21 103.07 101.06 3h6i h GLY 389 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 3h6i h GLY 389 CO 0.05 0.00 -1.24 0.70 0.00 0.00 0.00 176.54 176.05 3h6i n ASN 390 N -2.90 0.78 0.08 0.19 4.13 -1.04 -3.82 115.26 112.68 3h6i n ASN 390 Ca 0.04 0.32 0.13 0.00 1.68 0.00 0.00 54.58 56.75 3h6i n ASN 390 Cb 0.48 0.46 0.37 0.00 -1.54 0.00 0.00 39.78 39.55 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 -2.73 0.68 -1.02 3.41 4.77 -1.09 -5.11 117.00 115.91 3h6i n LEU 391 Ca -0.04 0.47 0.08 0.00 -0.03 0.00 0.00 56.01 56.49 3h6i n LEU 391 Cb 0.66 -0.31 0.27 0.00 -2.33 0.00 0.00 43.42 41.72 3h6i n LEU 391 CO 0.41 -0.12 0.72 0.00 -1.33 0.00 0.00 177.39 177.08 3h6i n ALA 392 N -1.75 2.99 -1.00 -1.18 0.00 -1.22 -5.13 120.51 113.22 3h6i n ALA 392 Ca 0.05 -2.05 0.00 0.00 0.00 0.00 0.00 53.44 51.45 3h6i n ALA 392 Cb 0.42 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 19.13 3h6i n ALA 392 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h6i n ALA 400 N -0.12 0.00 -2.81 0.00 0.00 -1.26 -5.05 120.51 111.27 3h6i n ALA 400 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.30 3h6i n ALA 400 Cb 0.86 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 20.22 3h6i n ALA 400 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3h6i s LEU 401 N 0.00 3.85 0.63 0.00 1.43 -1.26 -5.00 118.68 118.33 3h6i s LEU 401 Ca 0.00 0.11 -0.11 0.00 -1.03 0.00 0.00 54.13 53.10 3h6i s LEU 401 Cb 0.00 -1.97 -0.03 0.00 0.03 0.00 0.00 46.19 44.22 3h6i s LEU 401 CO 0.00 0.20 1.03 -2.16 0.23 0.00 0.00 176.35 175.66 3h6i s PRO 402 N 0.20 3.50 -0.17 1.29 0.04 -1.26 -4.38 135.00 134.23 3h6i s PRO 402 Ca 0.04 0.79 0.01 0.00 0.04 0.00 0.00 61.00 61.88 3h6i s PRO 402 Cb -0.12 -2.07 0.02 0.00 0.04 0.00 0.00 34.50 32.37 3h6i s PRO 402 CO 0.00 -0.65 -0.16 -1.17 0.04 0.00 0.00 177.00 175.06 3h6i s LEU 403 N -5.20 1.93 -0.16 -3.56 2.96 0.10 -3.46 118.68 111.29 3h6i s LEU 403 Ca 0.56 -0.59 -0.06 0.00 -0.22 0.00 0.00 54.13 53.82 3h6i s LEU 403 Cb -0.11 -1.32 -0.03 0.00 0.50 0.00 0.00 46.19 45.22 3h6i s LEU 403 CO 0.53 -0.04 0.02 -0.22 -1.32 0.00 0.00 176.35 175.32 3h6i s LEU 404 N 1.39 3.58 -0.04 -0.68 2.96 0.60 -1.28 118.68 125.22 3h6i s LEU 404 Ca 0.04 0.01 0.04 0.00 -0.22 0.00 0.00 54.13 54.01 3h6i s LEU 404 Cb -0.13 -1.88 -0.03 0.00 0.50 0.00 0.00 46.19 44.65 3h6i s LEU 404 CO -0.11 0.19 -0.16 0.00 -1.32 0.00 0.00 176.35 174.94 3h6i s ALA 405 N 0.25 2.58 0.31 5.97 0.00 0.16 -1.11 121.76 129.93 3h6i s ALA 405 Ca 0.01 -1.01 -0.09 0.00 0.00 0.00 0.00 51.96 50.87 3h6i s ALA 405 Cb -0.13 -0.89 0.01 0.00 0.00 0.00 0.00 23.12 22.11 3h6i s ALA 405 CO 0.01 0.55 0.52 0.20 0.00 0.00 0.00 175.76 177.05 3h6i s GLY 406 N -0.75 0.89 -0.05 0.00 0.00 0.34 -0.95 107.32 106.80 3h6i s GLY 406 Ca 0.11 -1.12 -0.02 0.00 0.00 0.00 0.00 44.72 43.70 3h6i s GLY 406 CO 0.01 -0.73 0.04 -0.47 0.00 0.00 0.00 173.10 171.94 3h6i s TYR 407 N -3.38 0.29 -0.53 1.90 5.04 -0.52 0.08 117.35 120.24 3h6i s TYR 407 Ca 0.25 0.09 -0.21 0.00 -2.44 0.00 0.00 57.07 54.76 3h6i s TYR 407 Cb -0.01 -0.60 0.05 0.00 0.35 0.00 0.00 41.96 41.75 3h6i s TYR 407 CO 0.14 -0.24 0.76 0.34 -1.34 0.00 0.00 175.55 175.21 3h6i s ASP 408 N 2.06 6.27 0.30 4.32 -1.08 -0.09 -4.86 116.67 123.58 3h6i s ASP 408 Ca 0.05 -0.68 0.23 0.00 -0.52 0.00 0.00 52.55 51.63 3h6i s ASP 408 Cb -0.12 -2.35 1.08 0.00 -1.46 0.00 0.00 42.92 40.07 3h6i s ASP 408 CO -0.04 -1.04 1.71 0.00 0.52 0.00 0.00 175.17 176.32 3h6i n ILE 409 N 5.86 0.90 1.00 4.11 0.13 -1.26 -2.55 119.36 127.55 3h6i n ILE 409 Ca -0.03 0.44 0.10 0.00 -1.10 0.00 0.00 62.75 62.16 3h6i n ILE 409 Cb 0.46 -1.41 -0.08 0.00 -0.84 0.00 0.00 39.64 37.78 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 -2.28 0.00 -2.12 9.51 8.25 -1.26 -4.97 115.22 122.35 3h6i n HIS 410 Ca 0.01 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.08 3h6i n HIS 410 Cb 0.15 -0.02 -0.00 0.00 1.12 0.00 0.00 29.99 31.24 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 -2.94 3.13 0.41 -1.41 0.00 -1.06 -4.95 121.76 114.93 3h6i s ALA 411 Ca 0.09 1.12 0.19 0.00 0.00 0.00 0.00 51.96 53.37 3h6i s ALA 411 Cb 0.16 -3.45 1.10 0.00 0.00 0.00 0.00 23.12 20.93 3h6i s ALA 411 CO 0.82 -0.78 1.98 0.66 0.00 0.00 0.00 175.76 178.44 3h6i h SER 412 N 2.42 0.00 -3.51 0.00 4.64 -1.93 -3.39 113.55 111.79 3h6i h SER 412 Ca -0.49 0.00 -0.70 0.00 -0.47 0.00 0.00 61.79 60.13 3h6i h SER 412 Cb 1.25 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 63.01 3h6i h SER 412 CO 0.62 0.21 -0.54 -0.62 -0.87 0.00 0.00 176.83 175.62 3h6i s ASP 413 N -6.64 5.32 0.33 4.97 -1.08 -1.26 -4.99 116.67 113.32 3h6i s ASP 413 Ca -0.03 -1.80 0.05 0.00 -0.52 0.00 0.00 52.55 50.25 3h6i s ASP 413 Cb 0.14 -1.86 0.70 0.00 -1.46 0.00 0.00 42.92 40.44 3h6i s ASP 413 CO 0.66 -0.51 1.89 -0.65 0.52 0.00 0.00 175.17 177.08 3h6i h PRO 414 N 8.15 0.80 0.00 4.34 0.11 -1.95 -2.38 132.00 141.07 3h6i h PRO 414 Ca -0.17 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.88 3h6i h PRO 414 Cb 1.06 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.99 3h6i h PRO 414 CO 0.70 0.53 -0.07 0.37 -0.21 0.00 0.00 178.00 179.32 3h6i h GLN 415 N 0.82 0.00 -0.06 1.05 5.75 -1.93 -2.75 115.11 117.99 3h6i h GLN 415 Ca 0.42 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.90 3h6i h GLN 415 Cb 0.48 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.02 3h6i h GLN 415 CO -0.18 0.07 -0.19 -1.13 -2.65 0.00 0.00 178.83 174.75 3h6i n SER 416 N -4.31 2.27 0.00 -0.69 3.41 -0.92 -0.22 113.62 113.17 3h6i n SER 416 Ca -0.03 -3.45 0.14 0.00 -0.26 0.00 0.00 58.87 55.27 3h6i n SER 416 Cb 0.15 -0.50 0.69 0.00 -0.26 0.00 0.00 64.21 64.30 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 -1.21 2.37 -1.77 7.33 0.00 -1.04 -4.82 120.51 121.38 3h6i n ALA 417 Ca 0.19 -0.13 -0.39 0.00 0.00 0.00 0.00 53.44 53.11 3h6i n ALA 417 Cb 0.72 -1.45 -0.00 0.00 0.00 0.00 0.00 19.45 18.72 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 -2.58 2.90 0.02 0.00 0.00 -1.26 -0.92 107.32 105.48 3h6i s GLY 418 Ca 0.26 1.18 0.03 0.00 0.00 0.00 0.00 44.72 46.18 3h6i s GLY 418 CO 0.42 1.74 -0.09 0.50 0.00 0.00 0.00 173.10 175.67 3h6i s ARG 419 N -2.31 0.66 -0.06 2.90 1.81 0.11 -4.88 118.95 117.18 3h6i s ARG 419 Ca 0.58 -0.54 -0.01 0.00 -1.72 0.00 0.00 55.73 54.04 3h6i s ARG 419 Cb -0.36 -0.59 0.03 0.00 -0.45 0.00 0.00 34.95 33.58 3h6i s ARG 419 CO 0.46 0.15 0.00 0.42 -0.68 0.00 0.00 175.30 175.65 3h6i s ILE 420 N -0.71 0.31 -0.09 1.52 1.01 -1.26 -0.50 121.20 121.49 3h6i s ILE 420 Ca -0.01 0.13 0.02 0.00 0.00 0.00 0.00 60.65 60.79 3h6i s ILE 420 Cb -0.06 -0.46 0.01 0.00 0.01 0.00 0.00 42.46 41.96 3h6i s ILE 420 CO 0.00 0.23 -0.15 -0.69 0.00 0.00 0.00 174.94 174.34 3h6i s VAL 421 N 1.76 1.38 0.42 2.92 1.01 -0.26 -0.38 120.40 127.26 3h6i s VAL 421 Ca 0.01 -0.60 0.07 0.00 0.00 0.00 0.00 61.98 61.46 3h6i s VAL 421 Cb -0.13 -1.26 -0.06 0.00 0.00 0.00 0.00 36.38 34.94 3h6i s VAL 421 CO -0.04 0.41 0.09 -0.94 0.00 0.00 0.00 175.10 174.63 3h6i s SER 422 N 0.78 4.15 -0.04 3.32 1.04 -0.30 -0.29 113.70 122.37 3h6i s SER 422 Ca -0.11 -1.26 0.02 0.00 0.48 0.00 0.00 55.95 55.08 3h6i s SER 422 Cb -0.16 -0.35 0.01 0.00 0.10 0.00 0.00 66.02 65.62 3h6i s SER 422 CO 0.02 -0.54 -0.09 -0.36 0.98 0.00 0.00 173.24 173.26 3h6i s PHE 423 N -2.68 1.04 0.71 5.02 0.40 -1.22 -1.02 117.98 120.22 3h6i s PHE 423 Ca 0.36 -0.30 -0.05 0.00 -0.60 0.00 0.00 56.93 56.34 3h6i s PHE 423 Cb 0.06 -0.77 0.09 0.00 0.51 0.00 0.00 43.02 42.91 3h6i s PHE 423 CO 0.19 -0.16 1.00 0.16 0.70 0.00 0.00 175.22 177.11 3h6i s ASP 424 N 0.43 4.61 0.33 1.36 1.47 -0.26 -4.85 116.67 119.77 3h6i s ASP 424 Ca -0.07 0.15 0.10 0.00 1.18 0.00 0.00 52.55 53.91 3h6i s ASP 424 Cb -0.11 -0.72 0.89 0.00 -0.34 0.00 0.00 42.92 42.63 3h6i s ASP 424 CO 0.01 -1.70 1.75 0.00 0.68 0.00 0.00 175.17 175.91 3h6i h ALA 425 N -0.57 1.84 0.00 2.11 0.00 -2.02 0.99 119.26 121.62 3h6i h ALA 425 Ca -0.42 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3h6i h ALA 425 Cb 1.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3h6i h ALA 425 CO 0.52 -0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.49 3h6i n ALA 426 N -2.34 2.57 -0.84 0.00 0.00 -1.26 -4.88 120.51 113.75 3h6i n ALA 426 Ca 0.26 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.56 3h6i n ALA 426 Cb 0.72 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.81 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 0.76 0.48 3.79 0.00 0.00 0.34 -5.00 105.19 105.57 3h6i n GLY 427 Ca 0.17 -0.87 -0.38 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.79 2.48 0.53 -0.02 0.00 -1.25 -4.68 107.32 101.60 3h6i s GLY 428 Ca 0.00 -0.16 -0.14 0.00 0.00 0.00 0.00 44.72 44.41 3h6i s GLY 428 CO 0.00 0.42 0.98 0.66 0.00 0.00 0.00 173.10 175.16 3h6i s TRP 429 N -0.48 3.50 -0.20 1.90 1.48 -1.26 -1.10 118.94 122.79 3h6i s TRP 429 Ca 0.25 1.38 -0.05 0.00 -1.06 0.00 0.00 56.10 56.62 3h6i s TRP 429 Cb -0.17 -2.74 0.10 0.00 -1.16 0.00 0.00 33.47 29.51 3h6i s TRP 429 CO 0.13 -0.43 0.37 1.21 -4.06 0.00 0.00 176.95 174.17 3h6i s ASN 430 N -3.39 0.10 -0.16 -2.66 3.84 -0.19 -4.95 114.94 107.53 3h6i s ASN 430 Ca 0.57 0.60 -0.27 0.00 0.21 0.00 0.00 52.86 53.96 3h6i s ASN 430 Cb -0.10 1.11 -0.01 0.00 -0.55 0.00 0.00 41.25 41.70 3h6i s ASN 430 CO 0.38 -0.26 0.93 -0.63 -2.79 0.00 0.00 177.10 174.73 3h6i s ILE 431 N 2.54 4.80 0.14 -5.21 1.01 -1.26 -1.15 121.20 122.08 3h6i s ILE 431 Ca 0.04 1.85 -0.30 0.00 0.00 0.00 0.00 60.65 62.24 3h6i s ILE 431 Cb -0.13 -4.23 -0.07 0.00 0.01 0.00 0.00 42.46 38.04 3h6i s ILE 431 CO -0.13 -0.03 1.02 -1.61 0.00 0.00 0.00 174.94 174.19 3h6i s GLU 432 N 2.36 4.66 0.00 2.79 0.41 0.49 -4.95 118.70 124.46 3h6i s GLU 432 Ca 0.43 1.57 0.05 0.00 -0.41 0.00 0.00 54.97 56.61 3h6i s GLU 432 Cb -0.17 -3.33 -0.04 0.00 -1.78 0.00 0.00 34.13 28.81 3h6i s GLU 432 CO 0.13 0.16 0.29 0.39 -0.49 0.00 0.00 175.26 175.73 3h6i n GLU 433 N 2.60 4.44 -0.04 1.61 1.02 -1.26 -4.65 120.64 124.36 3h6i n GLU 433 Ca 0.02 -0.13 0.12 0.00 -0.02 0.00 0.00 57.16 57.15 3h6i n GLU 433 Cb 0.48 -0.80 0.48 0.00 -0.02 0.00 0.00 31.44 31.57 3h6i n GLU 433 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3h6i n GLU 434 N -0.90 1.63 0.00 3.49 1.02 -1.26 -4.96 120.64 119.67 3h6i n GLU 434 Ca 0.01 -0.93 0.00 0.00 -0.02 0.00 0.00 57.16 56.22 3h6i n GLU 434 Cb 0.09 -1.43 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 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 1.12 3.38 3.36 0.62 0.00 -1.26 -5.04 105.19 107.37 3h6i n GLY 435 Ca 0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.97 -0.34 0.12 1.61 1.13 -1.26 -0.70 117.35 114.93 3h6i s TYR 436 Ca 0.00 0.18 -0.14 0.00 -1.41 0.00 0.00 57.07 55.70 3h6i s TYR 436 Cb 0.00 0.34 0.03 0.00 -1.10 0.00 0.00 41.96 41.23 3h6i s TYR 436 CO 0.00 -0.70 0.35 -1.14 -2.51 0.00 0.00 175.55 171.55 3h6i s GLN 437 N -3.26 1.02 -0.06 -3.49 2.00 -0.46 -4.96 119.66 110.45 3h6i s GLN 437 Ca -0.01 -0.78 -0.12 0.00 -2.00 0.00 0.00 55.36 52.45 3h6i s GLN 437 Cb 0.00 0.44 0.02 0.00 0.80 0.00 0.00 33.01 34.28 3h6i s GLN 437 CO -0.08 -0.39 0.29 0.00 -0.50 0.00 0.00 175.29 174.61 3h6i s ALA 438 N -3.82 -0.73 0.12 1.58 0.00 -1.26 -1.19 121.76 116.46 3h6i s ALA 438 Ca 0.04 0.52 0.06 0.00 0.00 0.00 0.00 51.96 52.58 3h6i s ALA 438 Cb 0.03 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.93 3h6i s ALA 438 CO -0.11 -0.20 -0.15 0.14 0.00 0.00 0.00 175.76 175.44 3h6i s VAL 439 N -0.68 1.36 0.00 0.00 -7.23 -0.39 -4.87 120.40 108.59 3h6i s VAL 439 Ca -0.08 -1.70 0.00 0.00 -1.81 0.00 0.00 61.98 58.39 3h6i s VAL 439 Cb -0.04 -1.52 0.00 0.00 0.56 0.00 0.00 36.38 35.37 3h6i s VAL 439 CO 0.02 -0.39 0.00 0.61 -0.31 0.00 0.00 175.10 175.04 3h6i n GLY 440 N 0.58 -0.95 0.29 2.32 0.00 -1.26 -1.18 105.19 104.99 3h6i n GLY 440 Ca -0.16 -2.25 0.17 0.00 0.00 0.00 0.00 46.02 43.78 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 -0.30 1.61 4.64 -1.95 -2.05 113.55 115.49 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 -0.73 3.61 0.33 -0.77 0.00 -1.26 -4.73 105.19 101.63 3h6i n GLY 442 Ca -0.02 -0.84 -0.02 0.00 0.00 0.00 0.00 46.02 45.15 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 1.96 0.87 -0.61 1.61 4.64 -1.60 -1.54 113.55 118.89 3h6i h SER 443 Ca 0.00 -0.10 -0.04 0.00 -0.47 0.00 0.00 61.79 61.18 3h6i h SER 443 Cb 1.24 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 63.08 3h6i h SER 443 CO 0.16 0.75 0.21 -0.07 -0.87 0.00 0.00 176.83 177.02 3h6i h LEU 444 N 0.95 0.87 -0.64 5.97 4.07 -1.85 -0.14 115.31 124.54 3h6i h LEU 444 Ca 0.23 -0.19 -0.13 0.00 0.08 0.00 0.00 57.88 57.87 3h6i h LEU 444 Cb 0.12 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.63 3h6i h LEU 444 CO -0.03 0.83 -0.37 -0.26 -1.08 0.00 0.00 178.44 177.53 3h6i h PHE 445 N 0.86 0.76 -0.34 1.13 0.04 -1.78 -1.22 116.94 116.38 3h6i h PHE 445 Ca 0.20 -0.21 -0.06 0.00 2.80 0.00 0.00 57.97 60.69 3h6i h PHE 445 Cb 0.26 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 38.23 3h6i h PHE 445 CO 0.02 0.92 -0.03 0.00 -0.60 0.00 0.00 178.31 178.62 3h6i h ALA 446 N 1.05 0.46 -0.56 2.45 0.00 -1.10 -1.67 119.26 119.90 3h6i h ALA 446 Ca 0.05 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 3h6i h ALA 446 Cb 0.89 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 3h6i h ALA 446 CO 0.08 0.26 0.06 0.87 0.00 0.00 0.00 179.25 180.52 3h6i h LYS 447 N 0.42 0.94 0.00 0.00 1.57 -0.67 -0.39 116.57 118.44 3h6i h LYS 447 Ca 0.09 -0.27 -0.06 0.00 -1.87 0.00 0.00 60.65 58.55 3h6i h LYS 447 Cb 0.50 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 3h6i h LYS 447 CO 0.02 0.92 -0.27 0.77 -0.57 0.00 0.00 179.45 180.32 3h6i h SER 448 N 0.83 0.00 0.04 0.86 0.02 -1.19 -0.87 113.55 113.23 3h6i h SER 448 Ca 0.17 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.02 3h6i h SER 448 Cb 0.45 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.00 3h6i h SER 448 CO 0.02 0.27 -0.40 -1.28 -1.14 0.00 0.00 176.83 174.29 3h6i h SER 449 N 0.00 0.28 0.05 3.07 0.87 -0.94 -3.23 113.55 113.65 3h6i h SER 449 Ca -0.00 -0.88 -0.01 0.00 -1.23 0.00 0.00 61.79 59.67 3h6i h SER 449 Cb 0.67 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.54 3h6i h SER 449 CO 0.03 1.13 -0.05 0.24 -0.53 0.00 0.00 176.83 177.66 3h6i h MET 450 N -0.52 0.00 -0.97 2.24 2.07 -0.91 -2.02 114.93 114.82 3h6i h MET 450 Ca -0.06 0.00 0.03 0.00 -2.07 0.00 0.00 59.70 57.59 3h6i h MET 450 Cb 1.23 0.00 -0.05 0.00 -1.87 0.00 0.00 31.60 30.91 3h6i h MET 450 CO 0.08 0.05 0.64 -0.22 1.07 0.00 0.00 176.91 178.53 3h6i h LYS 451 N 0.00 1.23 0.00 1.72 3.64 -1.18 0.26 116.57 122.24 3h6i h LYS 451 Ca -0.00 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3h6i h LYS 451 Cb 0.09 -0.28 0.00 0.00 -0.41 0.00 0.00 32.23 31.63 3h6i h LYS 451 CO 0.01 0.81 -0.58 1.63 -2.27 0.00 0.00 179.45 179.05 3h6i n LYS 452 N -4.42 0.15 -0.00 1.90 4.76 -0.81 -4.28 118.16 115.47 3h6i n LYS 452 Ca 0.12 0.04 0.05 0.00 -2.87 0.00 0.00 58.31 55.65 3h6i n LYS 452 Cb 0.06 -1.59 -0.08 0.00 -1.84 0.00 0.00 35.03 31.59 3h6i n LYS 452 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3h6i n LEU 453 N -1.81 0.08 -0.20 -0.35 4.77 -0.58 -4.66 117.00 114.25 3h6i n LEU 453 Ca 0.04 -0.09 0.16 0.00 -0.03 0.00 0.00 56.01 56.09 3h6i n LEU 453 Cb 0.39 0.00 0.49 0.00 -2.33 0.00 0.00 43.42 41.96 3h6i n LEU 453 CO 0.36 0.02 1.21 0.22 -1.33 0.00 0.00 177.39 177.87 3h6i h TYR 454 N 0.00 0.55 0.00 -1.77 3.20 -0.72 -1.17 116.97 117.06 3h6i h TYR 454 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 3h6i h TYR 454 Cb 0.43 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.53 3h6i h TYR 454 CO 0.00 0.19 0.07 0.66 -1.64 0.00 0.00 178.16 177.44 3h6i h SER 455 N 0.46 0.00 0.54 -2.11 4.64 -1.85 0.84 113.55 116.07 3h6i h SER 455 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 3h6i h SER 455 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 3h6i h SER 455 CO -0.15 0.00 -0.15 0.00 -0.87 0.00 0.00 176.83 175.66 3h6i n GLN 456 N -2.98 0.39 -2.68 4.77 6.02 -0.44 -4.78 117.38 117.68 3h6i n GLN 456 Ca -0.03 -0.13 -0.43 0.00 -0.01 0.00 0.00 57.00 56.40 3h6i n GLN 456 Cb 0.13 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.87 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 -2.70 4.28 0.00 5.09 1.01 0.28 -4.78 120.40 123.58 3h6i s VAL 457 Ca 0.22 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.19 3h6i s VAL 457 Cb 0.19 -4.56 0.00 0.00 0.00 0.00 0.00 36.38 32.01 3h6i s VAL 457 CO 0.53 -1.00 0.00 0.35 0.00 0.00 0.00 175.10 174.98 3h6i n THR 458 N 6.67 0.00 -3.82 3.92 -2.24 -1.26 -4.85 114.28 112.70 3h6i n THR 458 Ca 0.09 -0.22 -0.08 0.00 -2.27 0.00 0.00 64.05 61.57 3h6i n THR 458 Cb 0.49 0.72 0.02 0.00 -2.10 0.00 0.00 70.33 69.46 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 -1.50 0.00 0.24 3.42 1.47 -1.26 -4.55 116.67 114.49 3h6i s ASP 459 Ca 0.00 -1.08 -0.05 0.00 1.18 0.00 0.00 52.55 52.60 3h6i s ASP 459 Cb 0.00 0.81 0.46 0.00 -0.34 0.00 0.00 42.92 43.85 3h6i s ASP 459 CO 0.00 -1.60 1.70 1.23 0.68 0.00 0.00 175.17 177.18 3h6i h GLY 460 N 2.00 1.05 0.70 2.12 0.00 -1.94 -0.15 103.07 106.84 3h6i h GLY 460 Ca -0.31 -0.07 -0.04 0.00 0.00 0.00 0.00 47.33 46.91 3h6i h GLY 460 CO 0.40 -0.17 -0.07 -1.80 0.00 0.00 0.00 176.54 174.89 3h6i h ASP 461 N 0.31 0.26 0.86 0.19 3.58 -1.99 -0.68 116.42 118.94 3h6i h ASP 461 Ca 0.41 -0.44 -0.02 0.00 0.42 0.00 0.00 57.03 57.41 3h6i h ASP 461 Cb 0.68 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 41.66 3h6i h ASP 461 CO -0.48 0.64 -0.08 0.77 -2.88 0.00 0.00 179.24 177.21 3h6i h SER 462 N -0.12 0.00 -0.17 2.28 4.64 -1.84 -1.17 113.55 117.16 3h6i h SER 462 Ca 0.02 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.29 3h6i h SER 462 Cb 0.55 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.64 3h6i h SER 462 CO 0.02 0.08 -0.11 1.23 -0.87 0.00 0.00 176.83 177.17 3h6i h GLY 463 N 1.80 0.41 1.01 -0.77 0.00 -0.48 -2.17 103.07 102.88 3h6i h GLY 463 Ca -0.00 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 3h6i h GLY 463 CO 0.01 0.35 0.44 -2.00 0.00 0.00 0.00 176.54 175.35 3h6i h LEU 464 N 0.05 0.99 -0.55 3.11 5.85 -0.74 -0.34 115.31 123.66 3h6i h LEU 464 Ca 0.04 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.59 3h6i h LEU 464 Cb 0.61 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 3h6i h LEU 464 CO 0.03 0.79 0.08 -0.09 -0.34 0.00 0.00 178.44 178.91 3h6i h ARG 465 N 1.10 0.92 -0.29 1.25 1.12 -1.17 -1.30 114.38 116.02 3h6i h ARG 465 Ca 0.28 -0.25 -0.13 0.00 -1.11 0.00 0.00 59.98 58.76 3h6i h ARG 465 Cb 0.02 -0.10 -0.01 0.00 -0.01 0.00 0.00 29.97 29.86 3h6i h ARG 465 CO -0.05 0.90 -0.36 0.28 -3.11 0.00 0.00 179.97 177.63 3h6i h VAL 466 N 0.81 1.29 -0.64 0.20 2.07 -0.77 -0.36 116.25 118.85 3h6i h VAL 466 Ca 0.17 -1.51 -0.03 0.00 0.82 0.00 0.00 66.70 66.15 3h6i h VAL 466 Cb 0.43 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 3h6i h VAL 466 CO 0.01 0.49 0.30 0.00 0.02 0.00 0.00 177.57 178.39 3h6i h ALA 467 N 1.05 0.82 -0.48 1.67 0.00 -0.79 0.22 119.26 121.75 3h6i h ALA 467 Ca 0.05 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 3h6i h ALA 467 Cb 0.88 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 3h6i h ALA 467 CO 0.08 0.40 -0.09 0.28 0.00 0.00 0.00 179.25 179.91 3h6i h VAL 468 N 0.88 1.27 -0.12 0.00 2.07 -1.00 -1.61 116.25 117.74 3h6i h VAL 468 Ca 0.22 -1.22 -0.11 0.00 0.82 0.00 0.00 66.70 66.41 3h6i h VAL 468 Cb 0.13 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 3h6i h VAL 468 CO -0.03 0.42 -0.42 -0.08 0.02 0.00 0.00 177.57 177.48 3h6i h GLU 469 N 0.77 0.27 -0.41 1.57 4.81 -0.77 -1.07 114.58 119.74 3h6i h GLU 469 Ca 0.13 -0.13 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 3h6i h GLU 469 Cb 0.64 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 3h6i h GLU 469 CO 0.04 0.65 -0.01 0.00 -0.73 0.00 0.00 179.01 178.96 3h6i h ALA 470 N 1.34 0.55 -0.26 2.92 0.00 -0.46 -0.21 119.26 123.13 3h6i h ALA 470 Ca 0.02 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 3h6i h ALA 470 Cb 0.84 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3h6i h ALA 470 CO 0.07 0.35 -0.04 -0.07 0.00 0.00 0.00 179.25 179.55 3h6i h LEU 471 N 0.56 0.37 -0.31 0.00 3.38 -0.96 -0.12 115.31 118.24 3h6i h LEU 471 Ca 0.12 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 3h6i h LEU 471 Cb 0.50 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3h6i h LEU 471 CO 0.02 0.47 -0.24 0.22 0.09 0.00 0.00 178.44 179.01 3h6i h TYR 472 N 0.39 0.84 -0.24 1.13 3.20 -0.81 -0.53 116.97 120.95 3h6i h TYR 472 Ca 0.08 -0.24 -0.11 0.00 3.14 0.00 0.00 58.73 61.60 3h6i h TYR 472 Cb 0.33 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 3h6i h TYR 472 CO 0.01 0.97 -0.34 -0.44 -1.64 0.00 0.00 178.16 176.72 3h6i h ASP 473 N 0.47 0.52 -0.57 -2.11 3.32 -0.48 -0.80 116.42 116.77 3h6i h ASP 473 Ca 0.06 -0.21 -0.02 0.00 0.02 0.00 0.00 57.03 56.88 3h6i h ASP 473 Cb 0.80 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.18 3h6i h ASP 473 CO 0.06 0.82 0.28 0.00 -1.72 0.00 0.00 179.24 178.68 3h6i h ALA 474 N 1.21 0.73 -0.13 3.45 0.00 -0.63 -2.79 119.26 121.10 3h6i h ALA 474 Ca 0.05 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 3h6i h ALA 474 Cb 0.79 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3h6i h ALA 474 CO 0.06 0.29 -0.46 0.00 0.00 0.00 0.00 179.25 179.14 3h6i h ALA 475 N 1.11 0.98 -0.25 0.00 0.00 -0.76 0.14 119.26 120.47 3h6i h ALA 475 Ca 0.19 -0.45 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 3h6i h ALA 475 Cb 0.11 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3h6i h ALA 475 CO -0.03 0.64 0.03 0.22 0.00 0.00 0.00 179.25 180.11 3h6i h ASP 476 N 0.25 0.33 0.00 0.00 3.58 -0.92 -3.19 116.42 116.48 3h6i h ASP 476 Ca 0.02 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.42 3h6i h ASP 476 Cb 0.92 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.88 3h6i h ASP 476 CO 0.08 0.37 -1.06 0.47 -2.88 0.00 0.00 179.24 176.21 3h6i n ASP 477 N -4.36 1.45 -4.08 2.28 8.00 -1.04 -4.93 116.55 113.87 3h6i n ASP 477 Ca 0.01 -0.37 -0.32 0.00 0.71 0.00 0.00 54.79 54.81 3h6i n ASP 477 Cb 0.18 1.28 -0.15 0.00 -0.02 0.00 0.00 41.12 42.41 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 -2.75 4.38 0.39 -2.24 2.15 0.46 -4.99 116.67 114.07 3h6i s ASP 478 Ca -0.00 -1.34 0.27 0.00 0.43 0.00 0.00 52.55 51.91 3h6i s ASP 478 Cb 0.08 -1.55 1.38 0.00 -0.30 0.00 0.00 42.92 42.53 3h6i s ASP 478 CO 0.48 -0.18 1.83 0.77 -0.17 0.00 0.00 175.17 177.91 3h6i h SER 479 N 7.79 0.00 0.29 -0.34 4.64 -1.85 -0.04 113.55 124.04 3h6i h SER 479 Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 3h6i h SER 479 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 3h6i h SER 479 CO 0.48 0.00 -0.17 0.00 -0.87 0.00 0.00 176.83 176.26 3h6i n ALA 480 N -1.86 2.90 -2.74 5.18 0.00 -1.26 -4.77 120.51 117.96 3h6i n ALA 480 Ca -0.01 -0.33 -0.34 0.00 0.00 0.00 0.00 53.44 52.76 3h6i n ALA 480 Cb 0.11 -1.24 -0.11 0.00 0.00 0.00 0.00 19.45 18.21 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 -2.47 3.81 -0.12 0.00 2.01 -0.03 -4.78 115.64 114.06 3h6i s THR 481 Ca 0.27 -0.42 -0.17 0.00 0.31 0.00 0.00 61.69 61.68 3h6i s THR 481 Cb 0.20 -2.60 -0.04 0.00 0.01 0.00 0.00 72.50 70.06 3h6i s THR 481 CO 0.49 0.56 0.43 -0.83 -0.69 0.00 0.00 174.62 174.58 3h6i s GLY 482 N -0.38 2.36 0.88 4.40 0.00 -1.26 -4.49 107.32 108.83 3h6i s GLY 482 Ca 0.06 -0.25 -0.13 0.00 0.00 0.00 0.00 44.72 44.40 3h6i s GLY 482 CO 0.02 0.65 1.24 -0.32 0.00 0.00 0.00 173.10 174.69 3h6i s GLY 483 N 0.46 1.69 0.20 0.20 0.00 -1.26 -4.49 107.32 104.12 3h6i s GLY 483 Ca 0.24 -0.96 -0.32 0.00 0.00 0.00 0.00 44.72 43.68 3h6i s GLY 483 CO 0.09 -0.33 1.70 -4.14 0.00 0.00 0.00 173.10 170.42 3h6i s PRO 484 N -5.70 4.14 -0.49 2.90 0.02 -1.26 -4.93 135.00 129.67 3h6i s PRO 484 Ca 0.68 2.57 -0.14 0.00 0.02 0.00 0.00 61.00 64.13 3h6i s PRO 484 Cb -0.07 -3.10 0.10 0.00 0.02 0.00 0.00 34.50 31.45 3h6i s PRO 484 CO 0.51 -0.73 0.41 0.34 -0.33 0.00 0.00 177.00 177.19 3h6i s ASP 485 N 1.20 6.03 0.24 2.53 -1.08 0.10 -4.93 116.67 120.76 3h6i s ASP 485 Ca 0.74 -1.61 0.10 0.00 -0.52 0.00 0.00 52.55 51.27 3h6i s ASP 485 Cb -0.49 -2.14 0.22 0.00 -1.46 0.00 0.00 42.92 39.05 3h6i s ASP 485 CO 0.32 -0.72 1.53 -0.07 0.52 0.00 0.00 175.17 176.75 3h6i h LEU 486 N 8.71 0.00 -0.29 -1.34 3.38 -1.93 0.16 115.31 124.01 3h6i h LEU 486 Ca -0.27 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 3h6i h LEU 486 Cb 1.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 3h6i h LEU 486 CO 0.92 0.70 -0.01 0.58 0.09 0.00 0.00 178.44 180.72 3h6i h VAL 487 N 0.00 1.26 0.00 1.22 2.07 -1.97 -3.24 116.25 115.59 3h6i h VAL 487 Ca -0.01 -0.96 0.00 0.00 0.82 0.00 0.00 66.70 66.55 3h6i h VAL 487 Cb 1.27 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 3h6i h VAL 487 CO 0.09 0.31 -0.82 0.54 0.02 0.00 0.00 177.57 177.71 3h6i n ARG 488 N -4.56 0.09 -2.93 1.57 1.74 -1.22 -4.98 116.66 106.37 3h6i n ARG 488 Ca -0.03 -0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.95 3h6i n ARG 488 Cb 0.27 -1.53 0.03 0.00 -1.02 0.00 0.00 32.46 30.21 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 1.46 0.33 3.36 -0.13 0.00 0.43 -5.03 105.19 105.61 3h6i n GLY 489 Ca 0.04 -0.29 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 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 -3.13 3.26 0.19 -0.61 1.01 -0.38 -5.01 121.20 116.54 3h6i s ILE 490 Ca 0.23 -0.56 0.05 0.00 0.00 0.00 0.00 60.65 60.36 3h6i s ILE 490 Cb -0.10 -2.42 -0.05 0.00 0.01 0.00 0.00 42.46 39.90 3h6i s ILE 490 CO 0.30 0.48 -0.08 -0.36 0.00 0.00 0.00 174.94 175.28 3h6i s PHE 491 N 0.80 1.50 0.64 3.97 0.40 -1.26 -0.72 117.98 123.31 3h6i s PHE 491 Ca -0.03 -0.77 -0.17 0.00 -0.60 0.00 0.00 56.93 55.36 3h6i s PHE 491 Cb -0.15 -0.79 -0.04 0.00 0.51 0.00 0.00 43.02 42.55 3h6i s PHE 491 CO 0.01 0.12 0.90 -2.30 0.70 0.00 0.00 175.22 174.65 3h6i n PRO 492 N -0.33 0.72 -3.80 0.24 -0.02 -1.26 -4.84 135.00 125.72 3h6i n PRO 492 Ca -0.08 0.29 -0.24 0.00 -2.02 0.00 0.00 63.50 61.46 3h6i n PRO 492 Cb 0.62 -2.12 -0.02 0.00 -0.02 0.00 0.00 33.50 31.95 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 -1.62 5.23 -0.06 3.45 -4.23 -0.82 -4.92 115.64 112.67 3h6i s THR 493 Ca 0.75 -0.72 -0.20 0.00 -1.18 0.00 0.00 61.69 60.34 3h6i s THR 493 Cb -0.40 -3.82 0.04 0.00 1.34 0.00 0.00 72.50 69.67 3h6i s THR 493 CO 0.48 -0.31 0.45 0.00 -0.54 0.00 0.00 174.62 174.70 3h6i s ALA 494 N -1.99 -1.14 -0.02 3.99 0.00 -1.26 -1.33 121.76 120.01 3h6i s ALA 494 Ca 0.36 0.80 0.06 0.00 0.00 0.00 0.00 51.96 53.19 3h6i s ALA 494 Cb -0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 3h6i s ALA 494 CO 0.30 -0.28 -0.20 0.08 0.00 0.00 0.00 175.76 175.66 3h6i s VAL 495 N -0.98 1.59 -0.10 0.00 1.01 0.26 -0.72 120.40 121.46 3h6i s VAL 495 Ca -0.10 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.05 3h6i s VAL 495 Cb -0.03 -1.33 0.01 0.00 0.00 0.00 0.00 36.38 35.03 3h6i s VAL 495 CO 0.05 0.45 -0.18 -0.51 0.00 0.00 0.00 175.10 174.91 3h6i s ILE 496 N -0.42 1.67 -0.08 2.22 2.07 -0.44 -0.79 121.20 125.43 3h6i s ILE 496 Ca 0.07 -0.77 0.02 0.00 -1.41 0.00 0.00 60.65 58.56 3h6i s ILE 496 Cb -0.08 -1.48 0.01 0.00 0.13 0.00 0.00 42.46 41.04 3h6i s ILE 496 CO -0.00 0.47 -0.14 -0.63 -1.91 0.00 0.00 174.94 172.73 3h6i s ILE 497 N 0.67 1.29 0.00 2.00 1.01 0.78 -0.98 121.20 125.96 3h6i s ILE 497 Ca -0.13 -0.56 0.00 0.00 0.00 0.00 0.00 60.65 59.97 3h6i s ILE 497 Cb -0.16 -1.17 0.00 0.00 0.01 0.00 0.00 42.46 41.14 3h6i s ILE 497 CO 0.03 0.39 0.00 -0.90 0.00 0.00 0.00 174.94 174.46 3h6i n ASP 498 N 3.88 0.17 0.27 3.58 5.68 -1.15 -0.61 116.55 128.37 3h6i n ASP 498 Ca -0.21 -0.45 0.18 0.00 -0.50 0.00 0.00 54.79 53.80 3h6i n ASP 498 Cb 0.52 0.00 0.94 0.00 -1.14 0.00 0.00 41.12 41.44 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 1.00 1.51 -0.01 2.12 0.00 -1.94 -0.42 119.26 121.51 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 -0.16 -0.04 -0.25 0.00 0.00 0.00 179.25 178.81 3h6i n ASP 500 N -3.56 1.10 0.00 0.00 8.00 -1.26 -5.03 116.55 115.80 3h6i n ASP 500 Ca -0.01 -1.27 0.00 0.00 0.71 0.00 0.00 54.79 54.22 3h6i n ASP 500 Cb 0.21 0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.32 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 1.17 -2.18 3.71 0.44 0.00 -0.17 -5.01 105.19 103.16 3h6i n GLY 501 Ca 0.19 -2.19 -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 -1.16 3.42 0.01 4.61 0.00 0.18 -2.92 121.76 125.89 3h6i s ALA 502 Ca 0.00 -0.05 0.03 0.00 0.00 0.00 0.00 51.96 51.94 3h6i s ALA 502 Cb 0.00 -2.82 -0.01 0.00 0.00 0.00 0.00 23.12 20.29 3h6i s ALA 502 CO 0.00 -0.10 -0.11 0.14 0.00 0.00 0.00 175.76 175.69 3h6i s VAL 503 N 0.83 0.84 0.24 0.00 -7.23 -0.15 -4.99 120.40 109.94 3h6i s VAL 503 Ca 0.31 -0.61 -0.30 0.00 -1.81 0.00 0.00 61.98 59.58 3h6i s VAL 503 Cb -0.16 -0.73 -0.09 0.00 0.56 0.00 0.00 36.38 35.95 3h6i s VAL 503 CO 0.14 0.12 1.22 -1.81 -0.31 0.00 0.00 175.10 174.46 3h6i s ASP 504 N -0.55 7.03 0.04 4.85 1.01 -1.26 -1.32 116.67 126.47 3h6i s ASP 504 Ca 0.02 2.37 -0.28 0.00 0.71 0.00 0.00 52.55 55.38 3h6i s ASP 504 Cb -0.05 -2.62 -0.05 0.00 1.01 0.00 0.00 42.92 41.21 3h6i s ASP 504 CO 0.00 -0.38 0.87 -0.69 0.21 0.00 0.00 175.17 175.18 3h6i s VAL 505 N -0.52 4.72 0.36 -1.27 1.01 0.10 -4.90 120.40 119.91 3h6i s VAL 505 Ca 0.51 1.85 -0.28 0.00 0.00 0.00 0.00 61.98 64.06 3h6i s VAL 505 Cb -0.35 -4.22 -0.10 0.00 0.00 0.00 0.00 36.38 31.71 3h6i s VAL 505 CO 0.41 0.29 1.33 -2.84 0.00 0.00 0.00 175.10 174.30 3h6i s PRO 506 N 0.29 4.19 0.37 2.72 0.02 -1.26 -4.65 135.00 136.68 3h6i s PRO 506 Ca 0.44 2.25 0.12 0.00 0.02 0.00 0.00 61.00 63.84 3h6i s PRO 506 Cb -0.21 -2.95 0.92 0.00 0.02 0.00 0.00 34.50 32.28 3h6i s PRO 506 CO 0.26 -0.34 1.85 1.49 -0.33 0.00 0.00 177.00 179.92 3h6i h GLU 507 N 3.09 0.56 -0.69 5.54 4.81 -1.94 -2.78 114.58 123.15 3h6i h GLU 507 Ca -0.49 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 58.74 3h6i h GLU 507 Cb 1.23 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 30.44 3h6i h GLU 507 CO 0.64 0.37 0.42 0.66 -0.73 0.00 0.00 179.01 180.37 3h6i h SER 508 N 0.58 0.66 -0.23 1.04 4.64 -1.99 -0.03 113.55 118.21 3h6i h SER 508 Ca 0.48 0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.78 3h6i h SER 508 Cb 0.95 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.91 3h6i h SER 508 CO -0.22 0.44 0.01 -0.09 -0.87 0.00 0.00 176.83 176.10 3h6i h ARG 509 N 0.79 0.40 -0.74 4.77 9.65 -1.89 -1.21 114.38 126.15 3h6i h ARG 509 Ca 0.29 -0.12 0.05 0.00 -1.10 0.00 0.00 59.98 59.10 3h6i h ARG 509 Cb 0.09 -0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 28.58 3h6i h ARG 509 CO -0.14 0.57 0.45 0.82 2.80 0.00 0.00 179.97 184.46 3h6i h ILE 510 N 0.18 1.04 -0.75 1.20 2.04 -1.41 -0.78 117.51 119.02 3h6i h ILE 510 Ca 0.07 -0.29 -0.03 0.00 1.00 0.00 0.00 64.86 65.61 3h6i h ILE 510 Cb 0.38 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.55 3h6i h ILE 510 CO 0.01 0.15 0.36 0.00 0.00 0.00 0.00 178.15 178.67 3h6i h ALA 511 N 1.35 0.97 -0.39 1.87 0.00 -0.82 0.17 119.26 122.40 3h6i h ALA 511 Ca 0.32 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3h6i h ALA 511 Cb 0.12 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3h6i h ALA 511 CO -0.15 0.53 0.12 0.93 0.00 0.00 0.00 179.25 180.68 3h6i h GLU 512 N 1.05 0.60 -0.43 0.00 5.08 -0.50 -0.57 114.58 119.81 3h6i h GLU 512 Ca 0.26 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 3h6i h GLU 512 Cb 0.12 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 3h6i h GLU 512 CO -0.03 0.61 0.04 -0.07 -1.00 0.00 0.00 179.01 178.55 3h6i h LEU 513 N 0.48 0.71 -0.99 1.33 3.38 -0.82 -1.47 115.31 117.93 3h6i h LEU 513 Ca 0.13 -0.28 0.01 0.00 0.09 0.00 0.00 57.88 57.82 3h6i h LEU 513 Cb 0.25 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 3h6i h LEU 513 CO -0.00 0.82 0.64 0.00 0.09 0.00 0.00 178.44 179.99 3h6i h ALA 514 N 0.92 1.25 -0.50 1.53 0.00 -0.56 -0.75 119.26 121.16 3h6i h ALA 514 Ca 0.13 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 3h6i h ALA 514 Cb 0.43 -0.40 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3h6i h ALA 514 CO 0.01 0.66 -0.04 0.00 0.00 0.00 0.00 179.25 179.89 3h6i h ARG 515 N 1.34 0.86 -0.17 0.00 3.08 -0.73 -1.34 114.38 117.43 3h6i h ARG 515 Ca 0.36 -0.26 -0.18 0.00 0.07 0.00 0.00 59.98 59.97 3h6i h ARG 515 Cb -0.14 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 29.82 3h6i h ARG 515 CO -0.08 0.89 -0.63 0.00 -1.07 0.00 0.00 179.97 179.08 3h6i h ALA 516 N 1.16 0.59 -0.53 0.04 0.00 -0.77 -0.09 119.26 119.66 3h6i h ALA 516 Ca 0.14 -0.55 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 3h6i h ALA 516 Cb 0.53 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3h6i h ALA 516 CO 0.03 0.70 0.24 0.82 0.00 0.00 0.00 179.25 181.04 3h6i h ILE 517 N 0.44 1.21 -0.21 0.00 2.04 -0.81 0.17 117.51 120.34 3h6i h ILE 517 Ca -0.01 -0.61 -0.02 0.00 1.00 0.00 0.00 64.86 65.22 3h6i h ILE 517 Cb 1.20 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 3h6i h ILE 517 CO 0.12 0.24 0.05 0.40 0.00 0.00 0.00 178.15 178.96 3h6i h ILE 518 N 0.72 1.21 -0.79 -0.67 2.04 -1.05 -0.06 117.51 118.91 3h6i h ILE 518 Ca 0.18 -0.68 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 3h6i h ILE 518 Cb 0.15 1.26 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 3h6i h ILE 518 CO -0.02 0.21 0.44 -0.08 0.00 0.00 0.00 178.15 178.71 3h6i h GLU 519 N 0.16 1.09 -0.78 2.37 4.57 -0.83 0.79 114.58 121.95 3h6i h GLU 519 Ca 0.07 -0.12 -0.03 0.00 -1.18 0.00 0.00 59.36 58.10 3h6i h GLU 519 Cb 0.28 -0.22 -0.04 0.00 -0.16 0.00 0.00 28.75 28.62 3h6i h GLU 519 CO 0.00 0.80 0.37 1.03 -1.18 0.00 0.00 179.01 180.03 3h6i h SER 520 N 1.09 1.03 1.03 1.04 0.87 -0.22 -2.61 113.55 115.77 3h6i h SER 520 Ca 0.28 -0.14 -0.10 0.00 -1.23 0.00 0.00 61.79 60.60 3h6i h SER 520 Cb 0.01 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 3h6i h SER 520 CO -0.05 0.88 -0.48 0.03 -0.53 0.00 0.00 176.83 176.68 3h6i h ARG 521 N 1.11 0.00 0.00 2.24 2.47 -0.35 -3.51 114.38 116.34 3h6i h ARG 521 Ca 0.27 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.99 3h6i h ARG 521 Cb 0.13 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.45 3h6i h ARG 521 CO -0.03 0.48 0.00 0.43 0.56 0.00 0.00 179.97 181.40