#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nrt s LEU 342 N 0.00 4.34 0.10 0.99 1.43 0.35 -5.01 118.68 120.88 2nrt s LEU 342 Ca 0.00 1.26 -0.31 0.00 -1.03 0.00 0.00 54.13 54.05 2nrt s LEU 342 Cb 0.00 -3.14 -0.07 0.00 0.03 0.00 0.00 46.19 43.01 2nrt s LEU 342 CO 0.00 -0.11 1.28 -0.13 0.23 0.00 0.00 176.35 177.62 2nrt s ARG 343 N 0.73 4.39 0.16 1.70 0.52 -1.26 -4.63 118.95 120.56 2nrt s ARG 343 Ca 0.39 1.92 -0.15 0.00 -0.52 0.00 0.00 55.73 57.37 2nrt s ARG 343 Cb -0.18 -3.29 0.09 0.00 0.52 0.00 0.00 34.95 32.09 2nrt s ARG 343 CO 0.19 -0.32 1.77 -0.22 0.02 0.00 0.00 175.30 176.74 2nrt h LYS 344 N 6.60 0.36 -0.98 3.54 3.64 -1.95 0.35 116.57 128.13 2nrt h LYS 344 Ca -0.42 -0.02 0.17 0.00 -1.27 0.00 0.00 60.65 59.11 2nrt h LYS 344 Cb 1.21 -0.08 -0.17 0.00 -0.41 0.00 0.00 32.23 32.78 2nrt h LYS 344 CO 0.83 0.24 -0.32 1.49 -2.27 0.00 0.00 179.45 179.42 2nrt h GLU 345 N 0.37 -0.00 0.00 1.90 4.81 -2.00 -0.48 114.58 119.18 2nrt h GLU 345 Ca 0.18 0.00 -0.18 0.00 -0.13 0.00 0.00 59.36 59.24 2nrt h GLU 345 Cb 0.13 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 2nrt h GLU 345 CO -0.15 -0.00 -0.83 0.00 -0.73 0.00 0.00 179.01 177.29 2nrt h ALA 346 N 1.68 0.63 -0.77 2.92 0.00 -0.87 -2.49 119.26 120.35 2nrt h ALA 346 Ca 0.41 -0.75 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 2nrt h ALA 346 Cb 0.66 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 2nrt h ALA 346 CO -1.00 1.02 0.42 -0.07 0.00 0.00 0.00 179.25 179.63 2nrt h LEU 347 N 0.01 0.95 -0.39 0.00 3.38 -0.15 0.16 115.31 119.27 2nrt h LEU 347 Ca -0.01 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 2nrt h LEU 347 Cb 1.47 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.96 2nrt h LEU 347 CO 0.11 0.76 0.05 -0.08 0.09 0.00 0.00 178.44 179.37 2nrt h GLU 348 N 1.07 0.65 -0.76 1.13 4.57 -0.88 -1.03 114.58 119.33 2nrt h GLU 348 Ca 0.27 -0.18 -0.04 0.00 -1.18 0.00 0.00 59.36 58.23 2nrt h GLU 348 Cb 0.02 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.50 2nrt h GLU 348 CO -0.04 0.71 0.31 0.93 -1.18 0.00 0.00 179.01 179.74 2nrt h GLU 349 N 0.50 1.13 -0.58 1.92 5.08 -0.99 -2.49 114.58 119.14 2nrt h GLU 349 Ca 0.12 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 2nrt h GLU 349 Cb 0.38 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 2nrt h GLU 349 CO 0.01 0.91 0.24 1.25 -1.00 0.00 0.00 179.01 180.42 2nrt h LEU 350 N 1.10 0.79 -0.61 1.33 5.85 -0.34 -1.60 115.31 121.83 2nrt h LEU 350 Ca 0.26 -0.16 0.08 0.00 0.84 0.00 0.00 57.88 58.89 2nrt h LEU 350 Cb 0.20 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 40.96 2nrt h LEU 350 CO -0.02 0.73 0.28 -0.03 -0.34 0.00 0.00 178.44 179.05 2nrt h MET 351 N 0.79 0.49 0.04 1.25 4.05 -0.93 -1.53 114.93 119.08 2nrt h MET 351 Ca 0.19 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.58 2nrt h MET 351 Cb 0.18 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 30.87 2nrt h MET 351 CO -0.02 0.32 -0.02 0.87 0.23 0.00 0.00 176.91 178.29 2nrt h LYS 352 N 0.50 -0.05 -0.81 0.39 1.57 -1.18 -0.39 116.57 116.60 2nrt h LYS 352 Ca 0.29 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 59.16 2nrt h LYS 352 Cb 0.29 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.56 2nrt h LYS 352 CO -0.24 0.09 0.53 1.25 -0.57 0.00 0.00 179.45 180.50 2nrt h LEU 353 N -0.18 0.73 -1.69 2.94 5.85 -0.91 -1.28 115.31 120.77 2nrt h LEU 353 Ca -0.01 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2nrt h LEU 353 Cb 0.16 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.05 2nrt h LEU 353 CO 0.01 0.45 0.00 0.18 -0.34 0.00 0.00 178.44 178.74 2nrt n LEU 354 N -4.50 2.55 -3.97 2.25 4.77 -0.61 -4.95 117.00 112.54 2nrt n LEU 354 Ca 0.13 -1.04 -0.29 0.00 -0.03 0.00 0.00 56.01 54.78 2nrt n LEU 354 Cb 0.27 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 2nrt n LEU 354 CO 0.32 0.52 -0.04 -3.20 -1.33 0.00 0.00 177.39 173.66 2nrt n ASN 355 N 0.92 -2.72 -4.74 -1.43 4.05 -0.48 -4.95 115.26 105.90 2nrt n ASN 355 Ca 0.17 -0.90 -0.41 0.00 0.45 0.00 0.00 54.58 53.89 2nrt n ASN 355 Cb 0.48 -3.42 -0.05 0.00 1.23 0.00 0.00 39.78 38.02 2nrt n ASN 355 CO 0.00 0.00 0.00 -0.04 -3.05 0.00 0.00 177.26 174.17 2nrt s MET 356 N -6.58 4.74 0.18 1.20 -1.94 -0.26 -4.94 119.30 111.70 2nrt s MET 356 Ca 0.41 1.51 0.02 0.00 -1.71 0.00 0.00 55.69 55.92 2nrt s MET 356 Cb -0.22 -3.33 0.07 0.00 2.01 0.00 0.00 34.83 33.37 2nrt s MET 356 CO 0.87 0.30 1.43 -0.22 -0.01 0.00 0.00 175.02 177.39 2nrt h LYS 357 N 5.01 0.26 -5.78 2.03 3.64 -1.92 -3.45 116.57 116.36 2nrt h LYS 357 Ca -0.44 -0.24 -0.67 0.00 -1.27 0.00 0.00 60.65 58.04 2nrt h LYS 357 Cb 1.21 0.06 -0.09 0.00 -0.41 0.00 0.00 32.23 32.99 2nrt h LYS 357 CO 0.70 0.91 -0.53 -0.51 -2.27 0.00 0.00 179.45 177.76 2nrt s ASP 358 N -6.94 6.03 0.30 4.20 1.01 -1.26 -5.08 116.67 114.92 2nrt s ASP 358 Ca -0.04 0.34 -0.30 0.00 0.71 0.00 0.00 52.55 53.26 2nrt s ASP 358 Cb 0.11 -1.87 -0.11 0.00 1.01 0.00 0.00 42.92 42.06 2nrt s ASP 358 CO 0.82 0.37 1.59 0.12 0.21 0.00 0.00 175.17 178.28 2nrt s PHE 359 N -1.05 2.74 -1.16 4.23 5.36 -1.26 -4.88 117.98 121.96 2nrt s PHE 359 Ca 0.17 0.80 -0.16 0.00 -0.96 0.00 0.00 56.93 56.78 2nrt s PHE 359 Cb -0.12 -4.07 -0.05 0.00 -0.34 0.00 0.00 43.02 38.44 2nrt s PHE 359 CO 0.06 -3.57 2.16 -0.35 -1.46 0.00 0.00 175.22 172.06 2nrt n PRO 360 N 2.08 2.32 -0.10 10.12 -0.04 -1.26 -4.67 135.00 143.45 2nrt n PRO 360 Ca 0.08 -2.19 -0.12 0.00 -0.04 0.00 0.00 63.50 61.24 2nrt n PRO 360 Cb 0.37 -3.04 -0.04 0.00 -0.04 0.00 0.00 33.50 30.75 2nrt n PRO 360 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 2nrt h TYR 361 N 6.70 0.65 -3.26 0.54 3.20 -1.92 -3.41 116.97 119.47 2nrt h TYR 361 Ca 0.53 -0.14 -0.66 0.00 3.14 0.00 0.00 58.73 61.60 2nrt h TYR 361 Cb 0.59 -0.16 -0.31 0.00 1.54 0.00 0.00 36.73 38.40 2nrt h TYR 361 CO 1.44 0.77 -0.79 0.50 -1.64 0.00 0.00 178.16 178.44 2nrt s ARG 362 N -4.77 3.22 -0.08 1.82 3.52 -1.26 -0.33 118.95 121.07 2nrt s ARG 362 Ca -0.13 -0.73 0.04 0.00 -0.13 0.00 0.00 55.73 54.79 2nrt s ARG 362 Cb 0.08 -2.75 -0.00 0.00 -1.56 0.00 0.00 34.95 30.72 2nrt s ARG 362 CO 0.78 -0.12 -0.23 0.42 -0.81 0.00 0.00 175.30 175.35 2nrt s ILE 363 N 1.17 1.93 0.02 4.11 1.01 -0.31 -0.67 121.20 128.46 2nrt s ILE 363 Ca 0.01 -0.96 0.06 0.00 0.00 0.00 0.00 60.65 59.76 2nrt s ILE 363 Cb -0.14 -1.66 -0.03 0.00 0.01 0.00 0.00 42.46 40.64 2nrt s ILE 363 CO -0.05 0.53 -0.14 -1.61 0.00 0.00 0.00 174.94 173.67 2nrt s GLU 364 N 0.20 2.25 0.00 2.79 2.02 -0.69 -0.48 118.70 124.78 2nrt s GLU 364 Ca -0.13 -0.88 0.03 0.00 0.02 0.00 0.00 54.97 54.00 2nrt s GLU 364 Cb -0.16 -2.29 -0.01 0.00 0.10 0.00 0.00 34.13 31.77 2nrt s GLU 364 CO 0.06 0.56 -0.09 0.20 0.02 0.00 0.00 175.26 176.02 2nrt s GLY 365 N -1.38 0.45 -0.14 -1.39 0.00 -0.33 -0.32 107.32 104.22 2nrt s GLY 365 Ca 0.15 -0.44 0.01 0.00 0.00 0.00 0.00 44.72 44.44 2nrt s GLY 365 CO 0.06 -0.39 -0.18 -0.42 0.00 0.00 0.00 173.10 172.17 2nrt s ILE 366 N -0.37 2.53 -0.14 0.90 1.01 -0.41 -1.00 121.20 123.72 2nrt s ILE 366 Ca 0.02 -0.83 -0.06 0.00 0.00 0.00 0.00 60.65 59.78 2nrt s ILE 366 Cb -0.04 -2.04 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 2nrt s ILE 366 CO -0.00 0.53 0.08 -0.62 0.00 0.00 0.00 174.94 174.93 2nrt s ASP 367 N 0.63 5.85 -0.24 3.58 2.15 -0.24 -2.49 116.67 125.92 2nrt s ASP 367 Ca -0.09 0.25 -0.05 0.00 0.43 0.00 0.00 52.55 53.09 2nrt s ASP 367 Cb -0.16 -1.88 -0.01 0.00 -0.30 0.00 0.00 42.92 40.56 2nrt s ASP 367 CO 0.03 0.31 0.00 -0.63 -0.17 0.00 0.00 175.17 174.71 2nrt s ILE 368 N -0.47 3.73 -0.02 4.11 -1.09 -1.26 -0.88 121.20 125.31 2nrt s ILE 368 Ca 0.10 -0.40 0.02 0.00 -2.23 0.00 0.00 60.65 58.14 2nrt s ILE 368 Cb -0.12 -2.74 0.00 0.00 -1.58 0.00 0.00 42.46 38.03 2nrt s ILE 368 CO 0.02 0.37 -0.08 -0.44 -1.23 0.00 0.00 174.94 173.58 2nrt s SER 369 N 1.53 1.07 -0.08 3.58 0.01 -0.53 -5.02 113.70 114.26 2nrt s SER 369 Ca 0.06 -0.16 -0.00 0.00 1.31 0.00 0.00 55.95 57.15 2nrt s SER 369 Cb -0.15 -0.26 -0.03 0.00 0.21 0.00 0.00 66.02 65.79 2nrt s SER 369 CO -0.01 0.06 -0.05 -2.28 0.41 0.00 0.00 173.24 171.38 2nrt s HIS 370 N 0.15 3.00 -0.37 2.43 2.46 -1.26 -0.21 115.29 121.49 2nrt s HIS 370 Ca -0.02 0.02 -0.06 0.00 0.47 0.00 0.00 55.06 55.46 2nrt s HIS 370 Cb -0.07 -1.76 0.07 0.00 -0.13 0.00 0.00 32.58 30.68 2nrt s HIS 370 CO 0.00 0.31 0.16 -0.51 -2.47 0.00 0.00 174.74 172.23 2nrt s LEU 371 N -0.66 4.69 0.18 8.88 1.02 0.26 -4.97 118.68 128.07 2nrt s LEU 371 Ca 0.10 -1.43 -0.33 0.00 0.02 0.00 0.00 54.13 52.49 2nrt s LEU 371 Cb -0.12 -1.88 -0.14 0.00 0.02 0.00 0.00 46.19 44.08 2nrt s LEU 371 CO 0.02 -0.42 1.47 1.67 0.02 0.00 0.00 176.35 179.11 2nrt n GLN 372 N 4.78 1.94 -0.97 1.70 -0.06 -1.26 -1.37 117.38 122.13 2nrt n GLN 372 Ca -0.10 0.70 0.00 0.00 -2.00 0.00 0.00 57.00 55.60 2nrt n GLN 372 Cb 0.43 -2.40 0.00 0.00 -4.06 0.00 0.00 30.24 24.21 2nrt n GLN 372 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2nrt n GLY 373 N 2.82 0.53 0.56 1.69 0.00 -0.12 -4.80 105.19 105.88 2nrt n GLY 373 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2nrt n GLY 373 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2nrt n LYS 374 N -2.20 0.00 -3.56 1.61 5.02 -0.47 -4.77 118.16 113.78 2nrt n LYS 374 Ca 0.00 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.22 2nrt n LYS 374 Cb 0.06 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.05 2nrt n LYS 374 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 2nrt s TYR 375 N -0.34 -0.24 0.02 2.13 -0.85 -0.80 -2.73 117.35 114.54 2nrt s TYR 375 Ca 0.00 0.21 -0.24 0.00 -0.52 0.00 0.00 57.07 56.51 2nrt s TYR 375 Cb 0.00 0.51 -0.05 0.00 0.38 0.00 0.00 41.96 42.80 2nrt s TYR 375 CO 0.00 -0.33 0.74 0.99 -1.52 0.00 0.00 175.55 175.43 2nrt s THR 376 N -2.38 4.82 -0.29 -3.49 2.01 0.14 -0.58 115.64 115.87 2nrt s THR 376 Ca 0.06 1.57 -0.09 0.00 0.31 0.00 0.00 61.69 63.55 2nrt s THR 376 Cb -0.01 -4.09 -0.01 0.00 0.01 0.00 0.00 72.50 68.40 2nrt s THR 376 CO -0.05 0.34 0.12 -0.69 -0.69 0.00 0.00 174.62 173.65 2nrt s VAL 377 N 0.14 4.51 -0.21 3.82 1.01 0.71 -0.82 120.40 129.56 2nrt s VAL 377 Ca 0.38 -0.33 -0.12 0.00 0.00 0.00 0.00 61.98 61.91 2nrt s VAL 377 Cb -0.20 -3.24 -0.05 0.00 0.00 0.00 0.00 36.38 32.90 2nrt s VAL 377 CO 0.22 0.16 0.23 0.00 0.00 0.00 0.00 175.10 175.71 2nrt s ALA 378 N 1.61 3.61 -0.15 5.51 0.00 0.72 -1.45 121.76 131.61 2nrt s ALA 378 Ca 0.05 -0.72 -0.02 0.00 0.00 0.00 0.00 51.96 51.28 2nrt s ALA 378 Cb -0.16 -2.39 -0.02 0.00 0.00 0.00 0.00 23.12 20.55 2nrt s ALA 378 CO 0.05 -0.14 -0.10 -1.12 0.00 0.00 0.00 175.76 174.46 2nrt s SER 379 N 0.89 4.21 -0.18 0.00 0.01 -0.06 -0.61 113.70 117.96 2nrt s SER 379 Ca 0.12 -0.30 0.00 0.00 1.31 0.00 0.00 55.95 57.08 2nrt s SER 379 Cb -0.13 -1.67 0.01 0.00 0.21 0.00 0.00 66.02 64.44 2nrt s SER 379 CO 0.04 0.13 -0.17 -0.22 0.41 0.00 0.00 173.24 173.43 2nrt s LEU 380 N 0.57 2.28 0.24 2.44 0.20 0.24 -1.08 118.68 123.58 2nrt s LEU 380 Ca -0.06 -0.58 0.07 0.00 0.69 0.00 0.00 54.13 54.25 2nrt s LEU 380 Cb -0.15 -1.52 -0.04 0.00 -0.43 0.00 0.00 46.19 44.05 2nrt s LEU 380 CO 0.03 0.02 0.18 0.68 -0.29 0.00 0.00 176.35 176.98 2nrt s VAL 381 N 1.18 4.40 -0.07 1.68 -7.23 -0.17 -1.81 120.40 118.38 2nrt s VAL 381 Ca 0.02 -1.40 0.01 0.00 -1.81 0.00 0.00 61.98 58.79 2nrt s VAL 381 Cb -0.14 -3.37 0.02 0.00 0.56 0.00 0.00 36.38 33.45 2nrt s VAL 381 CO -0.08 -0.33 -0.06 -0.69 -0.31 0.00 0.00 175.10 173.62 2nrt s VAL 382 N -2.11 0.76 -0.14 1.32 1.01 -1.26 -1.18 120.40 118.79 2nrt s VAL 382 Ca 0.33 -0.21 -0.02 0.00 0.00 0.00 0.00 61.98 62.08 2nrt s VAL 382 Cb -0.08 -0.77 -0.02 0.00 0.00 0.00 0.00 36.38 35.51 2nrt s VAL 382 CO 0.25 0.29 -0.08 -0.36 0.00 0.00 0.00 175.10 175.19 2nrt s PHE 383 N 1.14 2.92 -0.19 5.22 0.08 0.37 -0.97 117.98 126.55 2nrt s PHE 383 Ca -0.07 -0.44 0.01 0.00 0.12 0.00 0.00 56.93 56.55 2nrt s PHE 383 Cb -0.14 -1.89 0.03 0.00 -0.57 0.00 0.00 43.02 40.44 2nrt s PHE 383 CO -0.01 -0.10 -0.19 -2.00 -0.10 0.00 0.00 175.22 172.83 2nrt s GLU 384 N 0.30 2.85 -1.45 0.44 2.12 0.55 -1.16 118.70 122.35 2nrt s GLU 384 Ca -0.07 -0.88 -0.12 0.00 0.36 0.00 0.00 54.97 54.27 2nrt s GLU 384 Cb -0.15 -2.58 0.08 0.00 0.26 0.00 0.00 34.13 31.74 2nrt s GLU 384 CO 0.04 -0.26 0.72 -3.47 -0.54 0.00 0.00 175.26 171.75 2nrt n ASP 385 N 4.61 -4.37 0.00 -1.70 2.03 0.56 -1.40 116.55 116.27 2nrt n ASP 385 Ca -0.20 -0.59 0.00 0.00 0.52 0.00 0.00 54.79 54.53 2nrt n ASP 385 Cb 0.49 -3.55 0.00 0.00 -0.72 0.00 0.00 41.12 37.34 2nrt n ASP 385 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2nrt n GLY 386 N -1.43 0.85 3.48 0.27 0.00 -1.26 -4.90 105.19 102.20 2nrt n GLY 386 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2nrt n GLY 386 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2nrt s PHE 387 N -3.36 2.68 0.29 1.61 0.08 -0.49 -0.49 117.98 118.31 2nrt s PHE 387 Ca 0.00 -0.17 -0.30 0.00 0.12 0.00 0.00 56.93 56.58 2nrt s PHE 387 Cb 0.00 -1.60 -0.13 0.00 -0.57 0.00 0.00 43.02 40.73 2nrt s PHE 387 CO 0.00 0.21 1.40 -2.30 -0.10 0.00 0.00 175.22 174.43 2nrt n PRO 388 N 2.12 2.21 -3.88 0.24 -0.02 -1.26 -0.33 135.00 134.08 2nrt n PRO 388 Ca -0.17 0.78 -0.29 0.00 -2.02 0.00 0.00 63.50 61.80 2nrt n PRO 388 Cb 0.52 -2.44 -0.12 0.00 -0.02 0.00 0.00 33.50 31.45 2nrt n PRO 388 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2nrt s LYS 389 N -1.04 2.50 0.46 -0.52 2.20 -0.14 -4.82 119.74 118.38 2nrt s LYS 389 Ca 0.62 -3.28 0.14 0.00 -0.36 0.00 0.00 55.97 53.09 2nrt s LYS 389 Cb -0.59 -3.47 1.04 0.00 -1.51 0.00 0.00 37.83 33.31 2nrt s LYS 389 CO 0.55 -1.27 2.03 0.87 -0.36 0.00 0.00 175.35 177.17 2nrt h LYS 390 N 5.56 0.05 -0.01 4.03 1.57 -1.93 -1.59 116.57 124.26 2nrt h LYS 390 Ca 0.13 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2nrt h LYS 390 Cb 0.77 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.07 2nrt h LYS 390 CO 0.73 0.16 0.01 0.78 -0.57 0.00 0.00 179.45 180.57 2nrt h GLY 391 N 0.42 0.00 -1.11 3.86 0.00 -1.97 -2.39 103.07 101.88 2nrt h GLY 391 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2nrt h GLY 391 CO 0.01 0.00 -0.25 1.22 0.00 0.00 0.00 176.54 177.53 2nrt n ASP 392 N -3.37 2.19 -4.76 0.19 9.92 -0.60 -4.96 116.55 115.16 2nrt n ASP 392 Ca -0.03 -1.60 -0.38 0.00 -0.53 0.00 0.00 54.79 52.25 2nrt n ASP 392 Cb 0.09 0.23 0.02 0.00 -0.64 0.00 0.00 41.12 40.82 2nrt n ASP 392 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 2nrt s TYR 393 N -2.27 2.53 0.07 1.24 1.51 -0.90 -4.83 117.35 114.70 2nrt s TYR 393 Ca 0.24 1.45 -0.08 0.00 -1.01 0.00 0.00 57.07 57.67 2nrt s TYR 393 Cb 0.19 -3.60 -0.00 0.00 -0.11 0.00 0.00 41.96 38.44 2nrt s TYR 393 CO 0.45 -2.28 0.17 1.03 -1.11 0.00 0.00 175.55 173.82 2nrt s ARG 394 N -2.85 0.76 0.29 -0.62 1.81 -0.75 -5.02 118.95 112.56 2nrt s ARG 394 Ca 0.69 -0.84 0.11 0.00 -1.72 0.00 0.00 55.73 53.97 2nrt s ARG 394 Cb -0.35 0.31 -0.05 0.00 -0.45 0.00 0.00 34.95 34.41 2nrt s ARG 394 CO 0.41 -0.23 -0.18 1.03 -0.68 0.00 0.00 175.30 175.66 2nrt s ARG 395 N -3.32 1.69 -0.03 3.54 0.52 -1.26 -0.59 118.95 119.50 2nrt s ARG 395 Ca 0.01 -1.79 0.01 0.00 -0.52 0.00 0.00 55.73 53.44 2nrt s ARG 395 Cb 0.03 -1.73 0.01 0.00 0.52 0.00 0.00 34.95 33.78 2nrt s ARG 395 CO -0.08 0.29 -0.05 0.71 0.02 0.00 0.00 175.30 176.19 2nrt s TYR 396 N -2.55 0.63 -0.14 -0.53 2.02 0.22 -4.98 117.35 112.02 2nrt s TYR 396 Ca 0.30 -0.14 -0.02 0.00 -0.37 0.00 0.00 57.07 56.84 2nrt s TYR 396 Cb -0.03 -0.51 -0.02 0.00 -0.40 0.00 0.00 41.96 40.99 2nrt s TYR 396 CO 0.15 -0.11 -0.07 0.15 -1.57 0.00 0.00 175.55 174.10 2nrt s LYS 397 N 0.48 3.52 -0.30 -0.62 1.02 -1.26 -0.20 119.74 122.38 2nrt s LYS 397 Ca -0.06 -0.58 0.03 0.00 0.02 0.00 0.00 55.97 55.38 2nrt s LYS 397 Cb -0.10 -2.79 0.07 0.00 -0.52 0.00 0.00 37.83 34.49 2nrt s LYS 397 CO -0.00 0.26 -0.04 0.42 -0.92 0.00 0.00 175.35 175.07 2nrt s ILE 398 N 0.28 2.34 -0.06 2.17 1.09 0.00 -4.97 121.20 122.05 2nrt s ILE 398 Ca -0.06 -1.85 -0.30 0.00 -1.10 0.00 0.00 60.65 57.35 2nrt s ILE 398 Cb -0.15 -2.50 -0.04 0.00 -1.06 0.00 0.00 42.46 38.72 2nrt s ILE 398 CO 0.04 -0.24 1.30 -1.61 -0.10 0.00 0.00 174.94 174.33 2nrt s GLU 399 N 1.06 4.30 -0.30 2.79 2.02 -1.26 -0.68 118.70 126.62 2nrt s GLU 399 Ca -0.02 1.79 -0.25 0.00 0.02 0.00 0.00 54.97 56.52 2nrt s GLU 399 Cb -0.20 -3.62 0.20 0.00 0.10 0.00 0.00 34.13 30.61 2nrt s GLU 399 CO -0.05 -0.56 1.48 1.14 0.02 0.00 0.00 175.26 177.29 2nrt s GLN 400 N 2.61 0.01 0.20 1.61 -2.07 -1.10 -4.96 119.66 115.96 2nrt s GLN 400 Ca 0.59 0.01 -0.03 0.00 -1.82 0.00 0.00 55.36 54.11 2nrt s GLN 400 Cb -0.27 0.01 0.15 0.00 -1.09 0.00 0.00 33.01 31.81 2nrt s GLN 400 CO 0.22 -0.00 1.55 -0.44 -1.32 0.00 0.00 175.29 175.31 2nrt h ASP 401 N 3.08 0.67 -3.58 12.60 3.32 -1.86 -3.14 116.42 127.50 2nrt h ASP 401 Ca -0.27 -0.31 -0.67 0.00 0.02 0.00 0.00 57.03 55.80 2nrt h ASP 401 Cb 1.20 -0.19 -0.16 0.00 0.22 0.00 0.00 39.33 40.40 2nrt h ASP 401 CO 0.19 1.01 -0.74 -1.00 -1.72 0.00 0.00 179.24 176.98 2nrt s HIS 402 N -4.21 2.75 0.52 4.55 3.76 -1.26 -0.94 115.29 120.45 2nrt s HIS 402 Ca -0.08 -0.15 -0.21 0.00 -0.15 0.00 0.00 55.06 54.48 2nrt s HIS 402 Cb 0.12 -1.45 -0.06 0.00 1.11 0.00 0.00 32.58 32.29 2nrt s HIS 402 CO 0.84 0.41 1.15 -1.25 -0.85 0.00 0.00 174.74 175.04 2nrt s PRO 403 N -2.08 3.46 -0.45 8.40 0.04 -1.26 -4.97 135.00 138.15 2nrt s PRO 403 Ca 0.21 1.70 0.05 0.00 0.04 0.00 0.00 61.00 63.00 2nrt s PRO 403 Cb -0.11 -2.15 0.18 0.00 0.04 0.00 0.00 34.50 32.46 2nrt s PRO 403 CO 0.13 -0.78 0.51 0.34 0.04 0.00 0.00 177.00 177.24 2nrt s ASP 404 N -1.59 0.13 0.29 6.66 -1.08 -1.26 -5.05 116.67 114.77 2nrt s ASP 404 Ca 0.70 -2.22 0.01 0.00 -0.52 0.00 0.00 52.55 50.52 2nrt s ASP 404 Cb -0.26 0.74 0.44 0.00 -1.46 0.00 0.00 42.92 42.38 2nrt s ASP 404 CO 0.31 -0.14 1.79 0.44 0.52 0.00 0.00 175.17 178.09 2nrt h ASP 405 N 5.66 0.60 -0.45 -0.34 5.19 -1.98 -0.11 116.42 124.99 2nrt h ASP 405 Ca 0.14 -0.15 -0.12 0.00 -0.62 0.00 0.00 57.03 56.29 2nrt h ASP 405 Cb 1.02 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 40.36 2nrt h ASP 405 CO 0.19 0.71 -0.17 1.88 -3.12 0.00 0.00 179.24 178.74 2nrt h TYR 406 N 0.59 1.04 -0.19 4.55 0.05 -1.97 -0.64 116.97 120.40 2nrt h TYR 406 Ca 0.11 -0.24 -0.12 0.00 0.05 0.00 0.00 58.73 58.53 2nrt h TYR 406 Cb 0.46 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 37.94 2nrt h TYR 406 CO 0.02 1.03 -0.38 1.49 -1.05 0.00 0.00 178.16 179.27 2nrt h GLU 407 N 0.75 0.41 -0.40 4.88 4.57 -1.88 -1.81 114.58 121.11 2nrt h GLU 407 Ca 0.11 -0.19 -0.00 0.00 -1.18 0.00 0.00 59.36 58.09 2nrt h GLU 407 Cb 0.73 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.29 2nrt h GLU 407 CO 0.06 0.74 0.25 0.77 -1.18 0.00 0.00 179.01 179.64 2nrt h SER 408 N 0.35 0.47 -0.62 1.04 0.02 -0.79 -0.67 113.55 113.35 2nrt h SER 408 Ca 0.03 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2nrt h SER 408 Cb 0.83 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.22 2nrt h SER 408 CO 0.07 0.37 0.35 0.40 -1.14 0.00 0.00 176.83 176.88 2nrt h ILE 409 N 0.52 1.19 -0.35 3.27 2.04 -0.92 -1.00 117.51 122.26 2nrt h ILE 409 Ca 0.14 -0.45 0.04 0.00 1.00 0.00 0.00 64.86 65.59 2nrt h ILE 409 Cb -0.02 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 36.40 2nrt h ILE 409 CO -0.03 0.20 0.14 -0.09 0.00 0.00 0.00 178.15 178.38 2nrt h ARG 410 N 0.84 0.30 -0.34 2.37 2.43 -1.08 -1.62 114.38 117.27 2nrt h ARG 410 Ca 0.22 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.37 2nrt h ARG 410 Cb 0.01 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 2nrt h ARG 410 CO -0.04 0.20 0.20 1.15 -1.51 0.00 0.00 179.97 179.97 2nrt h THR 411 N 0.31 1.12 -0.40 0.20 2.02 -0.91 -1.65 112.91 113.59 2nrt h THR 411 Ca 0.16 -0.27 0.05 0.00 0.77 0.00 0.00 66.41 67.12 2nrt h THR 411 Cb 0.11 0.68 -0.05 0.00 -1.74 0.00 0.00 68.15 67.15 2nrt h THR 411 CO -0.14 0.12 0.13 0.58 0.37 0.00 0.00 175.52 176.58 2nrt h VAL 412 N 0.44 0.87 -0.56 3.16 2.07 -0.93 -0.30 116.25 120.99 2nrt h VAL 412 Ca 0.12 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.52 2nrt h VAL 412 Cb 0.01 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 2nrt h VAL 412 CO -0.02 0.05 0.25 0.58 0.02 0.00 0.00 177.57 178.46 2nrt h VAL 413 N 0.29 1.21 -0.30 2.57 2.07 -0.99 0.42 116.25 121.52 2nrt h VAL 413 Ca 0.19 -0.61 -0.09 0.00 0.82 0.00 0.00 66.70 67.01 2nrt h VAL 413 Cb 0.18 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2nrt h VAL 413 CO -0.20 0.24 -0.15 0.11 0.02 0.00 0.00 177.57 177.59 2nrt h LYS 414 N 0.76 0.64 -0.00 1.57 1.57 -1.13 -1.19 116.57 118.78 2nrt h LYS 414 Ca 0.19 -0.28 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2nrt h LYS 414 Cb 0.14 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 2nrt h LYS 414 CO -0.02 0.87 0.00 0.00 -0.57 0.00 0.00 179.45 179.73 2nrt h ARG 415 N 0.39 0.00 -0.03 3.15 3.08 -0.88 -2.65 114.38 117.44 2nrt h ARG 415 Ca 0.07 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 2nrt h ARG 415 Cb 0.68 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.73 2nrt h ARG 415 CO 0.05 0.07 -0.05 -0.09 -1.07 0.00 0.00 179.97 178.88 2nrt h ARG 416 N -0.07 0.09 -0.00 0.04 2.43 -0.90 -3.27 114.38 112.70 2nrt h ARG 416 Ca 0.00 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2nrt h ARG 416 Cb 0.07 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 2nrt h ARG 416 CO -0.00 0.61 -0.05 0.66 -1.51 0.00 0.00 179.97 179.67 2nrt n TYR 417 N -4.75 0.00 0.34 2.20 4.01 -0.45 -0.46 117.16 118.05 2nrt n TYR 417 Ca -0.08 0.00 0.15 0.00 -0.16 0.00 0.00 57.90 57.81 2nrt n TYR 417 Cb 0.31 -0.10 0.56 0.00 -0.31 0.00 0.00 39.34 39.79 2nrt n TYR 417 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2nrt h SER 418 N 0.74 0.00 0.00 7.72 4.64 -1.52 -3.38 113.55 121.75 2nrt h SER 418 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 2nrt h SER 418 Cb 0.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 2nrt h SER 418 CO 0.00 0.00 -1.22 1.17 -0.87 0.00 0.00 176.83 175.91 2nrt n LYS 419 N -2.75 0.25 -4.12 4.77 4.81 -0.70 -5.07 118.16 115.35 2nrt n LYS 419 Ca 0.02 0.02 -0.29 0.00 -0.87 0.00 0.00 58.31 57.19 2nrt n LYS 419 Cb 0.31 -1.08 -0.07 0.00 0.02 0.00 0.00 35.03 34.21 2nrt n LYS 419 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 2nrt s HIS 420 N -2.08 3.04 0.77 5.64 3.76 0.40 -5.10 115.29 121.71 2nrt s HIS 420 Ca -0.05 -0.03 -0.12 0.00 -0.15 0.00 0.00 55.06 54.72 2nrt s HIS 420 Cb 0.01 -1.52 0.06 0.00 1.11 0.00 0.00 32.58 32.24 2nrt s HIS 420 CO 0.09 0.50 1.11 -1.25 -0.85 0.00 0.00 174.74 174.34 2nrt s PRO 421 N -2.63 2.17 0.47 8.40 0.04 -1.26 -4.42 135.00 137.78 2nrt s PRO 421 Ca 0.28 1.31 -0.22 0.00 0.04 0.00 0.00 61.00 62.41 2nrt s PRO 421 Cb -0.11 -1.88 -0.07 0.00 0.04 0.00 0.00 34.50 32.48 2nrt s PRO 421 CO 0.20 -1.72 1.12 -0.51 0.04 0.00 0.00 177.00 176.12 2nrt s LEU 422 N -5.76 3.94 1.00 -3.56 1.43 -1.26 -4.98 118.68 109.51 2nrt s LEU 422 Ca 0.64 2.17 -0.16 0.00 -1.03 0.00 0.00 54.13 55.75 2nrt s LEU 422 Cb -0.19 -4.36 0.21 0.00 0.03 0.00 0.00 46.19 41.87 2nrt s LEU 422 CO 0.53 -0.90 1.26 -2.16 0.23 0.00 0.00 176.35 175.31 2nrt s PRO 423 N -2.89 0.33 0.35 1.29 0.04 -1.26 -4.96 135.00 127.89 2nrt s PRO 423 Ca 0.65 -0.29 0.18 0.00 0.04 0.00 0.00 61.00 61.58 2nrt s PRO 423 Cb -0.24 -1.80 0.56 0.00 0.04 0.00 0.00 34.50 33.06 2nrt s PRO 423 CO 0.29 -2.64 1.68 -0.91 0.04 0.00 0.00 177.00 175.46 2nrt h ASN 424 N -1.81 0.00 -3.67 6.66 4.21 -1.26 -3.45 115.58 116.26 2nrt h ASN 424 Ca -0.45 0.00 -0.10 0.00 1.21 0.00 0.00 56.30 56.96 2nrt h ASN 424 Cb 1.26 0.00 -0.24 0.00 -1.12 0.00 0.00 38.32 38.21 2nrt h ASN 424 CO 0.39 0.42 -0.19 -0.22 -1.29 0.00 0.00 177.43 176.54 2nrt s LEU 425 N -6.99 0.06 -0.18 1.61 2.96 -1.09 -4.30 118.68 110.75 2nrt s LEU 425 Ca 0.01 0.96 -0.03 0.00 -0.22 0.00 0.00 54.13 54.84 2nrt s LEU 425 Cb 0.11 1.58 -0.02 0.00 0.50 0.00 0.00 46.19 48.36 2nrt s LEU 425 CO 0.70 -0.18 -0.04 -0.22 -1.32 0.00 0.00 176.35 175.29 2nrt s LEU 426 N 0.63 3.07 -0.17 -0.68 2.96 -0.51 -1.71 118.68 122.27 2nrt s LEU 426 Ca -0.03 -0.25 -0.08 0.00 -0.22 0.00 0.00 54.13 53.55 2nrt s LEU 426 Cb -0.05 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.85 2nrt s LEU 426 CO -0.04 0.09 0.09 0.12 -1.32 0.00 0.00 176.35 175.29 2nrt s PHE 427 N 0.82 3.34 -0.05 5.38 5.36 0.57 -0.80 117.98 132.60 2nrt s PHE 427 Ca -0.01 0.22 0.06 0.00 -0.96 0.00 0.00 56.93 56.23 2nrt s PHE 427 Cb -0.15 -2.07 -0.02 0.00 -0.34 0.00 0.00 43.02 40.45 2nrt s PHE 427 CO 0.02 0.29 -0.22 0.14 -1.46 0.00 0.00 175.22 173.99 2nrt s VAL 428 N 0.11 2.37 -1.22 3.12 -7.23 -0.29 -1.29 120.40 115.97 2nrt s VAL 428 Ca 0.07 -0.97 -0.19 0.00 -1.81 0.00 0.00 61.98 59.07 2nrt s VAL 428 Cb -0.12 -1.87 0.07 0.00 0.56 0.00 0.00 36.38 35.02 2nrt s VAL 428 CO 0.00 0.58 1.64 -0.62 -0.31 0.00 0.00 175.10 176.39 2nrt s ASP 429 N -0.45 6.77 0.00 4.85 2.15 -1.04 -3.29 116.67 125.66 2nrt s ASP 429 Ca 0.05 -2.24 0.00 0.00 0.43 0.00 0.00 52.55 50.79 2nrt s ASP 429 Cb -0.12 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.94 2nrt s ASP 429 CO 0.01 -1.22 0.00 0.61 -0.17 0.00 0.00 175.17 174.40 2nrt n GLY 430 N 5.68 -0.61 0.00 2.66 0.00 -0.77 -4.89 105.19 107.26 2nrt n GLY 430 Ca 0.44 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 45.08 2nrt n GLY 430 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nrt n GLY 431 N -1.10 1.79 0.26 -0.02 0.00 -1.25 -2.04 105.19 102.84 2nrt n GLY 431 Ca 0.00 -1.74 0.01 0.00 0.00 0.00 0.00 46.02 44.30 2nrt n GLY 431 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2nrt h ILE 432 N 0.00 0.83 -0.37 -0.61 1.08 -1.96 -0.65 117.51 115.83 2nrt h ILE 432 Ca 0.00 -0.20 -0.02 0.00 -0.39 0.00 0.00 64.86 64.26 2nrt h ILE 432 Cb 0.00 0.21 -0.02 0.00 -3.07 0.00 0.00 36.82 33.94 2nrt h ILE 432 CO 0.00 0.10 0.17 1.23 -0.69 0.00 0.00 178.15 178.96 2nrt h GLY 433 N 0.57 0.57 0.85 5.37 0.00 -1.99 -0.42 103.07 108.02 2nrt h GLY 433 Ca 0.35 -0.29 -0.06 0.00 0.00 0.00 0.00 47.33 47.33 2nrt h GLY 433 CO -0.28 0.28 -0.07 1.46 0.00 0.00 0.00 176.54 177.93 2nrt h GLN 434 N 0.45 0.49 -0.37 4.80 7.50 -1.71 -1.67 115.11 124.61 2nrt h GLN 434 Ca 0.12 -0.19 -0.00 0.00 0.50 0.00 0.00 58.65 59.08 2nrt h GLN 434 Cb 0.14 -0.03 -0.02 0.00 0.05 0.00 0.00 27.48 27.62 2nrt h GLN 434 CO -0.01 0.72 0.22 0.28 -1.50 0.00 0.00 178.83 178.53 2nrt h VAL 435 N 0.24 1.13 -0.13 -0.54 2.07 -1.07 -2.11 116.25 115.84 2nrt h VAL 435 Ca 0.06 -0.31 -0.08 0.00 0.82 0.00 0.00 66.70 67.19 2nrt h VAL 435 Cb 0.54 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2nrt h VAL 435 CO 0.03 0.13 -0.29 0.78 0.02 0.00 0.00 177.57 178.23 2nrt h ASN 436 N 0.48 0.25 -0.52 0.57 2.35 -1.03 -1.33 115.58 116.34 2nrt h ASN 436 Ca 0.13 -0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 2nrt h ASN 436 Cb 0.02 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 2nrt h ASN 436 CO -0.02 0.54 0.30 0.00 -1.65 0.00 0.00 177.43 176.60 2nrt h ALA 437 N 1.48 0.67 -0.39 -0.83 0.00 -0.87 -1.17 119.26 118.15 2nrt h ALA 437 Ca 0.03 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 2nrt h ALA 437 Cb 0.64 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2nrt h ALA 437 CO 0.05 0.16 0.02 0.00 0.00 0.00 0.00 179.25 179.48 2nrt h ALA 438 N 1.14 0.52 -0.50 0.00 0.00 -0.88 -1.91 119.26 117.63 2nrt h ALA 438 Ca 0.19 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.86 2nrt h ALA 438 Cb 0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2nrt h ALA 438 CO -0.03 0.28 0.33 0.82 0.00 0.00 0.00 179.25 180.64 2nrt h ILE 439 N 0.50 1.12 -0.49 0.00 2.04 -1.06 -0.80 117.51 118.82 2nrt h ILE 439 Ca 0.11 -0.23 -0.11 0.00 1.00 0.00 0.00 64.86 65.63 2nrt h ILE 439 Cb 0.45 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 2nrt h ILE 439 CO 0.02 0.12 -0.12 -0.33 0.00 0.00 0.00 178.15 177.84 2nrt h GLU 440 N 0.67 0.92 -0.73 2.37 4.39 -1.17 -0.94 114.58 120.09 2nrt h GLU 440 Ca 0.18 -0.34 -0.02 0.00 0.34 0.00 0.00 59.36 59.53 2nrt h GLU 440 Cb -0.07 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.48 2nrt h GLU 440 CO -0.04 0.99 0.38 0.00 -1.16 0.00 0.00 179.01 179.18 2nrt h ALA 441 N 1.03 0.94 -0.76 3.43 0.00 -1.05 -1.80 119.26 121.05 2nrt h ALA 441 Ca 0.13 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2nrt h ALA 441 Cb 0.66 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 2nrt h ALA 441 CO 0.05 0.47 0.44 -0.07 0.00 0.00 0.00 179.25 180.14 2nrt h LEU 442 N 1.02 0.92 -0.97 0.00 3.38 -0.69 -2.25 115.31 116.71 2nrt h LEU 442 Ca 0.26 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 2nrt h LEU 442 Cb 0.07 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 2nrt h LEU 442 CO -0.04 0.73 0.41 0.11 0.09 0.00 0.00 178.44 179.75 2nrt h LYS 443 N 1.04 1.14 -0.96 1.13 1.57 -0.87 -0.74 116.57 118.88 2nrt h LYS 443 Ca 0.27 -0.15 0.06 0.00 -1.87 0.00 0.00 60.65 58.96 2nrt h LYS 443 Cb -0.00 -0.22 -0.07 0.00 0.08 0.00 0.00 32.23 32.02 2nrt h LYS 443 CO -0.05 0.86 0.62 0.93 -0.57 0.00 0.00 179.45 181.24 2nrt h GLU 444 N 1.14 1.09 -0.69 3.15 5.08 -0.75 -2.53 114.58 121.07 2nrt h GLU 444 Ca 0.28 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2nrt h GLU 444 Cb 0.07 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.08 2nrt h GLU 444 CO -0.04 0.72 0.00 0.44 -1.00 0.00 0.00 179.01 179.13 2nrt n ILE 445 N -4.53 1.25 -2.76 3.13 -5.35 -1.03 -4.95 119.36 105.12 2nrt n ILE 445 Ca 0.14 -1.01 -0.12 0.00 -0.27 0.00 0.00 62.75 61.49 2nrt n ILE 445 Cb 0.18 0.33 0.02 0.00 -1.74 0.00 0.00 39.64 38.43 2nrt n ILE 445 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2nrt n GLY 446 N 1.44 0.07 3.41 3.28 0.00 -0.95 -5.03 105.19 107.40 2nrt n GLY 446 Ca 0.24 -0.27 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 2nrt n GLY 446 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nrt s LYS 447 N -5.27 1.49 -0.12 1.61 -0.14 -0.32 -5.03 119.74 111.96 2nrt s LYS 447 Ca 0.20 -1.60 -0.04 0.00 -1.36 0.00 0.00 55.97 53.17 2nrt s LYS 447 Cb -0.09 -1.59 0.06 0.00 -1.68 0.00 0.00 37.83 34.53 2nrt s LYS 447 CO 0.24 0.31 0.19 0.34 -0.76 0.00 0.00 175.35 175.68 2nrt s ASP 448 N -3.08 0.83 0.04 2.83 2.15 -1.26 -4.02 116.67 114.16 2nrt s ASP 448 Ca 0.23 0.25 -0.14 0.00 0.43 0.00 0.00 52.55 53.33 2nrt s ASP 448 Cb -0.05 0.38 0.02 0.00 -0.30 0.00 0.00 42.92 42.97 2nrt s ASP 448 CO 0.11 -0.26 0.31 0.00 -0.17 0.00 0.00 175.17 175.15 2nrt s PRO 450 N -2.42 4.15 -0.10 0.00 0.02 -1.26 -4.90 135.00 130.49 2nrt s PRO 450 Ca -0.06 2.51 0.02 0.00 0.02 0.00 0.00 61.00 63.50 2nrt s PRO 450 Cb -0.01 -2.99 0.01 0.00 0.02 0.00 0.00 34.50 31.53 2nrt s PRO 450 CO -0.02 -0.49 -0.15 0.08 -0.33 0.00 0.00 177.00 176.08 2nrt s VAL 451 N -0.95 1.46 0.02 3.83 1.01 -1.26 -1.42 120.40 123.09 2nrt s VAL 451 Ca 0.54 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.94 2nrt s VAL 451 Cb -0.46 -1.33 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 2nrt s VAL 451 CO 0.59 0.43 -0.19 0.54 0.00 0.00 0.00 175.10 176.47 2nrt s VAL 452 N 0.83 1.53 0.38 2.92 0.11 0.02 -4.52 120.40 121.67 2nrt s VAL 452 Ca -0.10 -1.00 0.04 0.00 -2.93 0.00 0.00 61.98 57.98 2nrt s VAL 452 Cb -0.16 -1.31 -0.05 0.00 -1.53 0.00 0.00 36.38 33.33 2nrt s VAL 452 CO 0.01 0.28 0.06 -0.83 -3.33 0.00 0.00 175.10 171.29 2nrt s GLY 453 N -0.85 2.38 -0.09 6.54 0.00 -0.26 -1.14 107.32 113.91 2nrt s GLY 453 Ca 0.07 -1.72 -0.01 0.00 0.00 0.00 0.00 44.72 43.07 2nrt s GLY 453 CO 0.01 -1.91 -0.04 -2.27 0.00 0.00 0.00 173.10 168.88 2nrt s LEU 454 N -3.60 0.94 0.43 0.66 2.96 -0.86 -1.11 118.68 118.09 2nrt s LEU 454 Ca 0.30 -0.18 -0.26 0.00 -0.22 0.00 0.00 54.13 53.76 2nrt s LEU 454 Cb 0.07 -0.62 -0.09 0.00 0.50 0.00 0.00 46.19 46.05 2nrt s LEU 454 CO 0.14 -0.14 1.42 0.00 -1.32 0.00 0.00 176.35 176.45 2nrt s ALA 455 N 1.72 3.31 0.13 5.97 0.00 0.58 -1.86 121.76 131.61 2nrt s ALA 455 Ca 0.03 1.45 -0.14 0.00 0.00 0.00 0.00 51.96 53.30 2nrt s ALA 455 Cb -0.13 -3.58 -0.02 0.00 0.00 0.00 0.00 23.12 19.40 2nrt s ALA 455 CO -0.06 -1.10 1.56 0.87 0.00 0.00 0.00 175.76 177.04 2nrt h LYS 456 N 2.53 0.75 0.06 0.00 1.57 -1.90 -2.81 116.57 116.76 2nrt h LYS 456 Ca -0.51 -0.25 -0.34 0.00 -1.87 0.00 0.00 60.65 57.69 2nrt h LYS 456 Cb 1.26 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 33.47 2nrt h LYS 456 CO 0.62 0.84 -1.93 1.17 -0.57 0.00 0.00 179.45 179.58 2nrt n LYS 457 N -4.40 0.70 -0.00 3.15 4.81 -1.26 -4.53 118.16 116.62 2nrt n LYS 457 Ca -0.01 0.26 0.09 0.00 -0.87 0.00 0.00 58.31 57.78 2nrt n LYS 457 Cb 0.31 -1.72 -0.12 0.00 0.02 0.00 0.00 35.03 33.52 2nrt n LYS 457 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2nrt n GLU 458 N -3.26 0.59 -3.10 1.64 -0.58 -1.25 -4.97 120.64 109.71 2nrt n GLU 458 Ca -0.27 -0.04 -0.22 0.00 -0.42 0.00 0.00 57.16 56.21 2nrt n GLU 458 Cb 1.05 -1.43 0.02 0.00 -0.57 0.00 0.00 31.44 30.51 2nrt n GLU 458 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2nrt n GLU 459 N -1.63 -4.18 -2.89 3.49 1.02 -1.06 -4.96 120.64 110.43 2nrt n GLU 459 Ca 0.02 0.75 -0.38 0.00 -0.02 0.00 0.00 57.16 57.53 2nrt n GLU 459 Cb 0.35 -5.54 -0.06 0.00 -0.02 0.00 0.00 31.44 26.17 2nrt n GLU 459 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2nrt s THR 460 N -3.06 4.29 -0.01 2.62 2.01 -1.26 -4.80 115.64 115.43 2nrt s THR 460 Ca 0.32 1.73 -0.22 0.00 0.31 0.00 0.00 61.69 63.83 2nrt s THR 460 Cb -0.15 -4.06 -0.05 0.00 0.01 0.00 0.00 72.50 68.25 2nrt s THR 460 CO 0.39 0.30 0.66 -0.69 -0.69 0.00 0.00 174.62 174.58 2nrt s VAL 461 N -1.42 4.90 -0.13 3.82 1.01 -0.45 -0.30 120.40 127.82 2nrt s VAL 461 Ca 0.44 1.37 0.02 0.00 0.00 0.00 0.00 61.98 63.81 2nrt s VAL 461 Cb -0.20 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.18 2nrt s VAL 461 CO 0.25 0.37 -0.20 -0.69 0.00 0.00 0.00 175.10 174.84 2nrt s VAL 462 N 0.05 2.37 -0.28 2.92 1.01 -0.27 0.05 120.40 126.25 2nrt s VAL 462 Ca 0.34 -0.89 -0.18 0.00 0.00 0.00 0.00 61.98 61.25 2nrt s VAL 462 Cb -0.19 -1.96 0.08 0.00 0.00 0.00 0.00 36.38 34.32 2nrt s VAL 462 CO 0.19 0.54 0.72 0.12 0.00 0.00 0.00 175.10 176.67 2nrt s PHE 463 N 0.59 -0.97 -1.45 5.22 5.36 -0.52 -1.10 117.98 125.12 2nrt s PHE 463 Ca -0.11 2.01 -0.02 0.00 -0.96 0.00 0.00 56.93 57.84 2nrt s PHE 463 Cb -0.16 0.54 0.02 0.00 -0.34 0.00 0.00 43.02 43.08 2nrt s PHE 463 CO 0.03 -0.48 0.44 0.39 -1.46 0.00 0.00 175.22 174.15 2nrt n GLU 464 N 3.92 -3.19 -2.40 10.12 1.02 -1.26 -1.48 120.64 127.37 2nrt n GLU 464 Ca -0.19 0.39 -0.20 0.00 -0.02 0.00 0.00 57.16 57.14 2nrt n GLU 464 Cb 0.58 -4.55 -0.01 0.00 -0.02 0.00 0.00 31.44 27.44 2nrt n GLU 464 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2nrt n ASN 465 N -2.95 -5.79 -4.09 1.62 5.15 -1.26 -4.98 115.26 102.96 2nrt n ASN 465 Ca -0.27 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 53.59 2nrt n ASN 465 Cb 0.66 -4.83 -0.11 0.00 -0.53 0.00 0.00 39.78 34.97 2nrt n ASN 465 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2nrt s ARG 466 N -5.04 0.61 -0.01 1.20 0.52 -0.55 -5.14 118.95 110.55 2nrt s ARG 466 Ca 0.00 -0.90 -0.15 0.00 -0.52 0.00 0.00 55.73 54.16 2nrt s ARG 466 Cb 0.00 -0.30 -0.06 0.00 0.52 0.00 0.00 34.95 35.11 2nrt s ARG 466 CO 0.00 0.04 0.41 -1.21 0.02 0.00 0.00 175.30 174.56 2nrt s GLU 467 N -2.11 3.96 -0.21 3.54 2.02 -1.26 -1.44 118.70 123.19 2nrt s GLU 467 Ca -0.05 0.41 0.02 0.00 0.02 0.00 0.00 54.97 55.37 2nrt s GLU 467 Cb -0.06 -3.24 0.04 0.00 0.10 0.00 0.00 34.13 30.96 2nrt s GLU 467 CO -0.01 0.64 -0.16 0.42 0.02 0.00 0.00 175.26 176.18 2nrt s ILE 468 N -0.93 2.14 -0.44 -1.63 1.01 0.11 -4.99 121.20 116.46 2nrt s ILE 468 Ca 0.24 -1.21 -0.14 0.00 0.00 0.00 0.00 60.65 59.54 2nrt s ILE 468 Cb -0.17 -2.04 0.06 0.00 0.01 0.00 0.00 42.46 40.32 2nrt s ILE 468 CO 0.13 0.31 0.34 -1.00 0.00 0.00 0.00 174.94 174.72 2nrt s HIS 469 N 1.22 3.26 0.25 3.97 3.76 -1.26 -1.34 115.29 125.14 2nrt s HIS 469 Ca -0.01 -0.95 0.01 0.00 -0.15 0.00 0.00 55.06 53.97 2nrt s HIS 469 Cb -0.16 -2.96 -0.04 0.00 1.11 0.00 0.00 32.58 30.53 2nrt s HIS 469 CO -0.10 -0.75 0.42 -0.51 -0.85 0.00 0.00 174.74 172.95 2nrt s LEU 470 N 1.61 4.20 0.71 0.89 1.43 -1.26 -5.07 118.68 121.19 2nrt s LEU 470 Ca 0.04 0.31 -0.16 0.00 -1.03 0.00 0.00 54.13 53.29 2nrt s LEU 470 Cb -0.23 -3.11 0.03 0.00 0.03 0.00 0.00 46.19 42.91 2nrt s LEU 470 CO 0.07 -0.11 1.22 -2.84 0.23 0.00 0.00 176.35 174.92 2nrt s PRO 471 N -3.75 2.25 0.40 1.29 0.02 -1.26 -4.91 135.00 129.05 2nrt s PRO 471 Ca 0.37 1.82 0.07 0.00 0.02 0.00 0.00 61.00 63.28 2nrt s PRO 471 Cb -0.10 -1.84 0.82 0.00 0.02 0.00 0.00 34.50 33.40 2nrt s PRO 471 CO 0.31 -1.76 2.04 1.12 -0.33 0.00 0.00 177.00 178.37 2nrt h HIS 472 N -0.08 0.53 -0.57 6.54 2.07 -2.00 -1.42 115.15 120.22 2nrt h HIS 472 Ca -0.48 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.04 2nrt h HIS 472 Cb 1.30 -0.18 0.00 0.00 2.57 0.00 0.00 27.41 31.11 2nrt h HIS 472 CO 0.46 0.35 0.00 -0.40 -3.07 0.00 0.00 177.93 175.27 2nrt n ASP 473 N -4.45 3.73 -4.76 3.10 5.68 -1.26 -4.75 116.55 113.84 2nrt n ASP 473 Ca 0.03 -2.22 -0.41 0.00 -0.50 0.00 0.00 54.79 51.69 2nrt n ASP 473 Cb 0.07 -0.48 -0.01 0.00 -1.14 0.00 0.00 41.12 39.56 2nrt n ASP 473 CO 0.00 0.00 0.00 -2.28 -1.33 0.00 0.00 177.20 173.59 2nrt s HIS 474 N -1.54 2.73 0.42 2.11 2.46 -0.54 -4.86 115.29 116.07 2nrt s HIS 474 Ca 0.42 0.88 0.08 0.00 0.47 0.00 0.00 55.06 56.91 2nrt s HIS 474 Cb 0.25 -4.05 0.91 0.00 -0.13 0.00 0.00 32.58 29.56 2nrt s HIS 474 CO 0.24 -3.42 2.07 -1.00 -2.47 0.00 0.00 174.74 170.15 2nrt h PRO 475 N 4.45 0.47 -0.20 2.88 0.13 -1.92 -1.63 132.00 136.18 2nrt h PRO 475 Ca -0.48 -0.03 -0.17 0.00 -0.87 0.00 0.00 66.00 64.45 2nrt h PRO 475 Cb 1.22 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 2nrt h PRO 475 CO 0.76 0.31 -0.57 0.28 -0.23 0.00 0.00 178.00 178.55 2nrt h VAL 476 N 0.49 1.31 -0.61 1.56 2.07 -1.89 -1.31 116.25 117.87 2nrt h VAL 476 Ca 0.14 -1.81 -0.03 0.00 0.82 0.00 0.00 66.70 65.82 2nrt h VAL 476 Cb -0.04 1.76 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 2nrt h VAL 476 CO -0.03 0.57 0.26 0.25 0.02 0.00 0.00 177.57 178.64 2nrt h LEU 477 N 0.48 0.83 -0.76 2.57 5.85 -1.78 -1.15 115.31 121.35 2nrt h LEU 477 Ca 0.00 -0.16 -0.06 0.00 0.84 0.00 0.00 57.88 58.50 2nrt h LEU 477 Cb 1.13 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 2nrt h LEU 477 CO 0.11 0.76 0.21 0.03 -0.34 0.00 0.00 178.44 179.20 2nrt h ARG 478 N 0.84 1.14 -0.37 1.25 2.47 -1.14 -1.24 114.38 117.33 2nrt h ARG 478 Ca 0.21 -0.25 -0.01 0.00 -1.26 0.00 0.00 59.98 58.66 2nrt h ARG 478 Cb 0.18 -0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 28.32 2nrt h ARG 478 CO -0.02 0.98 0.17 1.25 0.56 0.00 0.00 179.97 182.92 2nrt h LEU 479 N 1.09 0.48 -0.98 3.04 6.46 -1.04 -1.53 115.31 122.84 2nrt h LEU 479 Ca 0.23 -0.13 -0.09 0.00 -0.12 0.00 0.00 57.88 57.77 2nrt h LEU 479 Cb 0.33 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.12 2nrt h LEU 479 CO -0.00 0.48 -0.21 -0.07 -0.62 0.00 0.00 178.44 178.02 2nrt h LEU 480 N 0.46 0.49 -1.15 2.25 3.38 -0.76 -1.76 115.31 118.22 2nrt h LEU 480 Ca 0.13 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2nrt h LEU 480 Cb 0.12 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2nrt h LEU 480 CO -0.02 0.71 0.18 0.58 0.09 0.00 0.00 178.44 179.98 2nrt h VAL 481 N 0.45 1.21 -0.65 1.22 2.07 -1.09 -0.33 116.25 119.12 2nrt h VAL 481 Ca 0.07 -0.68 -0.06 0.00 0.82 0.00 0.00 66.70 66.84 2nrt h VAL 481 Cb 0.61 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 2nrt h VAL 481 CO 0.04 0.26 0.16 1.56 0.02 0.00 0.00 177.57 179.61 2nrt h GLN 482 N 0.76 1.05 -0.27 1.57 4.20 -0.46 0.14 115.11 122.09 2nrt h GLN 482 Ca 0.18 -0.25 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 2nrt h GLN 482 Cb 0.21 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 2nrt h GLN 482 CO -0.01 0.94 0.10 0.82 -0.67 0.00 0.00 178.83 180.01 2nrt h ILE 483 N 0.97 1.18 -0.73 2.54 2.04 -0.93 -2.25 117.51 120.33 2nrt h ILE 483 Ca 0.20 -0.56 0.03 0.00 1.00 0.00 0.00 64.86 65.54 2nrt h ILE 483 Cb 0.37 1.04 -0.05 0.00 -0.74 0.00 0.00 36.82 37.44 2nrt h ILE 483 CO 0.00 0.19 0.46 -0.09 0.00 0.00 0.00 178.15 178.71 2nrt h ARG 484 N 0.29 0.86 -0.45 2.37 2.43 -0.74 -0.94 114.38 118.20 2nrt h ARG 484 Ca 0.09 -0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.15 2nrt h ARG 484 Cb 0.20 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 2nrt h ARG 484 CO -0.01 0.57 0.03 -0.44 -1.51 0.00 0.00 179.97 178.62 2nrt h ASP 485 N 0.89 0.67 0.09 -3.80 3.32 -0.56 -0.91 116.42 116.13 2nrt h ASP 485 Ca 0.30 -0.14 -0.17 0.00 0.02 0.00 0.00 57.03 57.04 2nrt h ASP 485 Cb 0.04 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 2nrt h ASP 485 CO -0.12 0.72 -0.61 -0.08 -1.72 0.00 0.00 179.24 177.43 2nrt h GLU 486 N 0.68 0.52 -0.73 3.56 4.57 -0.88 -0.10 114.58 122.19 2nrt h GLU 486 Ca 0.14 -0.35 -0.02 0.00 -1.18 0.00 0.00 59.36 57.95 2nrt h GLU 486 Cb 0.37 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.98 2nrt h GLU 486 CO 0.01 0.97 0.39 1.79 -1.18 0.00 0.00 179.01 180.98 2nrt h THR 487 N 0.38 1.23 -0.29 0.32 1.35 -0.75 -1.33 112.91 113.83 2nrt h THR 487 Ca -0.01 -0.59 -0.03 0.00 -0.55 0.00 0.00 66.41 65.23 2nrt h THR 487 Cb 1.16 0.28 -0.01 0.00 -1.73 0.00 0.00 68.15 67.85 2nrt h THR 487 CO 0.11 0.26 0.06 0.45 -0.25 0.00 0.00 175.52 176.14 2nrt h HIS 488 N 1.02 0.50 -0.49 4.73 3.86 -1.04 -0.28 115.15 123.45 2nrt h HIS 488 Ca 0.26 -0.07 0.04 0.00 -1.16 0.00 0.00 60.37 59.44 2nrt h HIS 488 Cb 0.06 -0.14 -0.04 0.00 1.06 0.00 0.00 27.41 28.35 2nrt h HIS 488 CO 0.00 0.56 0.25 -0.09 0.86 0.00 0.00 177.93 179.51 2nrt h ARG 489 N 0.30 0.47 -0.49 2.45 2.43 -0.82 -0.36 114.38 118.36 2nrt h ARG 489 Ca 0.09 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.13 2nrt h ARG 489 Cb 0.32 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 2nrt h ARG 489 CO 0.00 0.31 -0.07 0.35 -1.51 0.00 0.00 179.97 179.05 2nrt h PHE 490 N 0.48 1.01 -0.50 2.20 3.57 -1.13 -2.54 116.94 120.03 2nrt h PHE 490 Ca 0.22 -0.20 0.05 0.00 3.53 0.00 0.00 57.97 61.57 2nrt h PHE 490 Cb 0.13 -0.25 -0.05 0.00 2.79 0.00 0.00 35.95 38.57 2nrt h PHE 490 CO -0.10 0.97 0.23 0.00 -2.23 0.00 0.00 178.31 177.17 2nrt h ALA 491 N 0.90 0.63 0.00 2.41 0.00 -0.58 -2.51 119.26 120.11 2nrt h ALA 491 Ca 0.13 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 2nrt h ALA 491 Cb 0.61 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2nrt h ALA 491 CO 0.04 -0.14 -0.22 0.28 0.00 0.00 0.00 179.25 179.22 2nrt h VAL 492 N 0.45 1.05 0.00 0.00 2.07 -0.92 -1.84 116.25 117.06 2nrt h VAL 492 Ca 0.23 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 66.98 2nrt h VAL 492 Cb 0.18 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 31.37 2nrt h VAL 492 CO -0.19 0.21 0.00 -1.54 0.02 0.00 0.00 177.57 176.08 2nrt n SER 493 N -4.13 0.00 -0.25 0.57 3.41 -0.95 -2.53 113.62 109.74 2nrt n SER 493 Ca -0.02 0.33 0.08 0.00 -0.26 0.00 0.00 58.87 59.00 2nrt n SER 493 Cb 0.28 -0.42 0.34 0.00 -0.26 0.00 0.00 64.21 64.15 2nrt n SER 493 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2nrt h TYR 494 N 0.00 0.86 -0.13 7.33 3.20 -1.37 -1.95 116.97 124.92 2nrt h TYR 494 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2nrt h TYR 494 Cb 0.26 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.25 2nrt h TYR 494 CO 0.00 0.39 0.00 0.72 -1.64 0.00 0.00 178.16 177.63 2nrt n HIS 495 N -4.52 0.17 0.23 -3.82 8.25 -1.05 -4.68 115.22 109.80 2nrt n HIS 495 Ca 0.15 -0.08 -0.15 0.00 -0.26 0.00 0.00 57.72 57.37 2nrt n HIS 495 Cb 0.34 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.37 2nrt n HIS 495 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 2nrt h ARG 496 N 0.93 -0.51 -0.72 -0.41 2.43 -1.52 -1.19 114.38 113.40 2nrt h ARG 496 Ca 0.00 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 2nrt h ARG 496 Cb 0.21 0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.84 2nrt h ARG 496 CO 0.00 -0.33 0.33 0.87 -1.51 0.00 0.00 179.97 179.33 2nrt h LYS 497 N -0.53 1.03 0.32 0.20 1.57 -1.83 -0.02 116.57 117.31 2nrt h LYS 497 Ca -0.05 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.56 2nrt h LYS 497 Cb 0.40 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.53 2nrt h LYS 497 CO 0.09 0.81 -0.15 0.07 -0.57 0.00 0.00 179.45 179.69 2nrt h ARG 498 N 1.02 -0.41 -0.98 3.15 -0.00 -1.85 -2.46 114.38 112.85 2nrt h ARG 498 Ca 0.25 0.03 0.19 0.00 -0.00 0.00 0.00 59.98 60.44 2nrt h ARG 498 Cb 0.13 0.09 -0.11 0.00 -0.00 0.00 0.00 29.97 30.08 2nrt h ARG 498 CO -0.03 -0.10 0.58 0.07 -0.00 0.00 0.00 179.97 180.50 2nrt h ARG 499 N -0.76 0.71 -0.23 0.08 0.11 -0.91 -1.75 114.38 111.63 2nrt h ARG 499 Ca -0.04 -0.04 -0.07 0.00 0.10 0.00 0.00 59.98 59.92 2nrt h ARG 499 Cb 0.50 -0.16 -0.01 0.00 1.11 0.00 0.00 29.97 31.42 2nrt h ARG 499 CO 0.07 0.47 -0.15 0.93 0.10 0.00 0.00 179.97 181.39 2nrt h GLU 500 N 0.73 0.51 -0.70 0.08 5.08 -0.94 -0.84 114.58 118.50 2nrt h GLU 500 Ca 0.57 -0.24 -0.02 0.00 -1.00 0.00 0.00 59.36 58.68 2nrt h GLU 500 Cb 0.90 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.11 2nrt h GLU 500 CO -0.39 0.80 0.37 0.87 -1.00 0.00 0.00 179.01 179.65 2nrt h LYS 501 N 0.21 0.98 -0.63 2.33 1.57 -1.02 -1.17 116.57 118.84 2nrt h LYS 501 Ca 0.05 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.66 2nrt h LYS 501 Cb 0.66 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 2nrt h LYS 501 CO 0.04 0.75 0.22 0.93 -0.57 0.00 0.00 179.45 180.82 2nrt h GLU 502 N 0.96 0.97 -0.20 3.15 4.39 -1.15 -0.25 114.58 122.45 2nrt h GLU 502 Ca 0.24 -0.19 -0.14 0.00 0.34 0.00 0.00 59.36 59.61 2nrt h GLU 502 Cb 0.06 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.55 2nrt h GLU 502 CO -0.04 0.84 -0.46 0.66 -1.16 0.00 0.00 179.01 178.85 2nrt h SER 503 N 0.90 0.53 -0.15 1.42 4.64 -1.03 -2.35 113.55 117.51 2nrt h SER 503 Ca 0.21 -0.25 -0.00 0.00 -0.47 0.00 0.00 61.79 61.27 2nrt h SER 503 Cb 0.25 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 2nrt h SER 503 CO -0.01 0.91 0.08 0.25 -0.87 0.00 0.00 176.83 177.20 2nrt h LEU 504 N 0.40 0.18 -0.42 5.97 6.46 -0.95 -2.68 115.31 124.27 2nrt h LEU 504 Ca 0.03 -0.07 0.04 0.00 -0.12 0.00 0.00 57.88 57.76 2nrt h LEU 504 Cb 0.95 -0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 40.80 2nrt h LEU 504 CO 0.08 0.20 0.18 -0.09 -0.62 0.00 0.00 178.44 178.20 2nrt h ARG 505 N 0.15 0.36 -0.71 1.25 2.43 -0.95 -0.72 114.38 116.18 2nrt h ARG 505 Ca 0.05 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.25 2nrt h ARG 505 Cb 0.06 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.48 2nrt h ARG 505 CO -0.01 0.24 0.42 1.03 -1.51 0.00 0.00 179.97 180.14 2nrt h SER 506 N 0.37 0.66 -0.27 -3.80 0.87 -1.38 -0.61 113.55 109.40 2nrt h SER 506 Ca 0.19 0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.67 2nrt h SER 506 Cb 0.14 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 2nrt h SER 506 CO -0.16 0.44 -0.20 0.58 -0.53 0.00 0.00 176.83 176.96 2nrt h VAL 507 N 0.80 1.31 0.00 2.23 2.07 -1.14 -3.06 116.25 118.46 2nrt h VAL 507 Ca 0.30 -1.33 -0.02 0.00 0.82 0.00 0.00 66.70 66.47 2nrt h VAL 507 Cb 0.12 1.58 -0.00 0.00 -1.52 0.00 0.00 31.29 31.46 2nrt h VAL 507 CO -0.15 0.42 -0.11 -0.07 0.02 0.00 0.00 177.57 177.68 2nrt h LEU 508 N 0.33 0.00 -0.32 2.57 3.38 -0.80 -2.22 115.31 118.25 2nrt h LEU 508 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2nrt h LEU 508 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 2nrt h LEU 508 CO 0.05 0.11 0.00 0.47 0.09 0.00 0.00 178.44 179.16 2nrt n ASP 509 N -4.10 0.27 -0.47 -0.43 8.00 -0.27 -1.27 116.55 118.29 2nrt n ASP 509 Ca -0.02 0.57 0.13 0.00 0.71 0.00 0.00 54.79 56.18 2nrt n ASP 509 Cb 0.19 -0.63 0.44 0.00 -0.02 0.00 0.00 41.12 41.10 2nrt n ASP 509 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2nrt n ASN 510 N -1.81 1.53 -4.65 -2.24 4.13 -0.83 -4.87 115.26 106.52 2nrt n ASN 510 Ca 0.03 -1.40 -0.43 0.00 1.68 0.00 0.00 54.58 54.46 2nrt n ASN 510 Cb 0.18 0.05 -0.02 0.00 -1.54 0.00 0.00 39.78 38.44 2nrt n ASN 510 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2nrt s VAL 511 N -2.13 4.59 0.25 2.41 1.01 -0.39 -5.00 120.40 121.14 2nrt s VAL 511 Ca 0.33 1.89 -0.30 0.00 0.00 0.00 0.00 61.98 63.91 2nrt s VAL 511 Cb 0.20 -4.32 -0.09 0.00 0.00 0.00 0.00 36.38 32.17 2nrt s VAL 511 CO 0.38 -0.28 1.23 -2.16 0.00 0.00 0.00 175.10 174.27 2nrt s PRO 512 N 3.38 4.47 -0.66 2.72 0.04 -1.26 -3.81 135.00 139.88 2nrt s PRO 512 Ca 0.45 1.99 0.00 0.00 0.04 0.00 0.00 61.00 63.49 2nrt s PRO 512 Cb -0.15 -3.17 0.00 0.00 0.04 0.00 0.00 34.50 31.22 2nrt s PRO 512 CO 0.10 -0.08 0.00 0.41 0.04 0.00 0.00 177.00 177.47 2nrt n GLY 513 N 1.60 0.38 3.40 0.56 0.00 -1.26 -5.01 105.19 104.85 2nrt n GLY 513 Ca 0.02 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 45.07 2nrt n GLY 513 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2nrt s ILE 514 N -2.32 3.40 0.90 -0.61 2.07 -1.25 -5.02 121.20 118.37 2nrt s ILE 514 Ca 0.00 -0.52 -0.13 0.00 -1.41 0.00 0.00 60.65 58.59 2nrt s ILE 514 Cb 0.00 -2.48 0.17 0.00 0.13 0.00 0.00 42.46 40.28 2nrt s ILE 514 CO 0.00 0.49 1.25 -0.83 -1.91 0.00 0.00 174.94 173.94 2nrt s GLY 515 N 0.62 1.75 0.25 1.50 0.00 -1.26 -4.88 107.32 105.30 2nrt s GLY 515 Ca -0.05 -1.18 -0.02 0.00 0.00 0.00 0.00 44.72 43.47 2nrt s GLY 515 CO 0.03 -0.49 1.71 -0.56 0.00 0.00 0.00 173.10 173.79 2nrt h PRO 516 N -1.39 0.74 -0.30 2.90 0.13 -1.99 -2.12 132.00 129.96 2nrt h PRO 516 Ca -0.44 -0.24 -0.02 0.00 -0.87 0.00 0.00 66.00 64.43 2nrt h PRO 516 Cb 1.25 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2nrt h PRO 516 CO 0.43 0.83 0.11 0.82 -0.23 0.00 0.00 178.00 179.96 2nrt h ILE 517 N 0.67 1.19 -0.63 -3.56 2.04 -1.99 -0.51 117.51 114.71 2nrt h ILE 517 Ca 0.11 -0.58 -0.07 0.00 1.00 0.00 0.00 64.86 65.33 2nrt h ILE 517 Cb 0.58 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 2nrt h ILE 517 CO 0.04 0.20 0.12 0.03 0.00 0.00 0.00 178.15 178.54 2nrt h ARG 518 N 0.34 1.01 -0.83 2.37 3.08 -1.94 -1.50 114.38 116.91 2nrt h ARG 518 Ca 0.10 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 2nrt h ARG 518 Cb 0.20 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.08 2nrt h ARG 518 CO -0.01 0.92 0.45 0.87 -1.07 0.00 0.00 179.97 181.13 2nrt h LYS 519 N 0.96 1.16 -0.17 0.04 1.57 -1.16 -1.80 116.57 117.17 2nrt h LYS 519 Ca 0.20 -0.14 -0.14 0.00 -1.87 0.00 0.00 60.65 58.70 2nrt h LYS 519 Cb 0.39 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 2nrt h LYS 519 CO 0.01 0.86 -0.50 0.87 -0.57 0.00 0.00 179.45 180.11 2nrt h LYS 520 N 1.17 0.47 -0.49 3.15 1.57 -0.85 -1.42 116.57 120.17 2nrt h LYS 520 Ca 0.29 -0.27 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 2nrt h LYS 520 Cb 0.04 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 2nrt h LYS 520 CO -0.05 0.86 0.24 0.87 -0.57 0.00 0.00 179.45 180.80 2nrt h LYS 521 N 0.37 0.68 -0.16 3.15 1.57 -0.85 0.53 116.57 121.87 2nrt h LYS 521 Ca 0.02 -0.08 -0.11 0.00 -1.87 0.00 0.00 60.65 58.61 2nrt h LYS 521 Cb 1.01 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.19 2nrt h LYS 521 CO 0.09 0.53 -0.32 -0.07 -0.57 0.00 0.00 179.45 179.11 2nrt h LEU 522 N 0.69 0.56 -0.43 2.94 3.38 -0.90 -1.63 115.31 119.91 2nrt h LEU 522 Ca 0.17 -0.56 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 2nrt h LEU 522 Cb 0.07 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2nrt h LEU 522 CO -0.02 1.01 0.24 0.40 0.09 0.00 0.00 178.44 180.16 2nrt h ILE 523 N 0.13 1.15 -0.42 1.22 2.04 -0.99 0.15 117.51 120.79 2nrt h ILE 523 Ca 0.00 -0.38 -0.10 0.00 1.00 0.00 0.00 64.86 65.38 2nrt h ILE 523 Cb 0.92 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 2nrt h ILE 523 CO 0.07 0.16 -0.16 -0.33 0.00 0.00 0.00 178.15 177.89 2nrt h GLU 524 N 0.56 0.78 -0.01 2.37 4.39 -0.85 0.53 114.58 122.35 2nrt h GLU 524 Ca 0.15 -0.28 -0.01 0.00 0.34 0.00 0.00 59.36 59.56 2nrt h GLU 524 Cb 0.04 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 2nrt h GLU 524 CO -0.03 0.89 -0.04 1.25 -1.16 0.00 0.00 179.01 179.92 2nrt h HIS 525 N 0.69 0.06 0.01 4.33 2.76 -1.14 -3.38 115.15 118.47 2nrt h HIS 525 Ca 0.11 -0.03 -0.32 0.00 -2.20 0.00 0.00 60.37 57.94 2nrt h HIS 525 Cb 0.65 -0.01 -0.05 0.00 1.55 0.00 0.00 27.41 29.54 2nrt h HIS 525 CO 0.03 0.66 -1.92 1.19 -1.30 0.00 0.00 177.93 176.60 2nrt n PHE 526 N -4.74 0.73 0.00 5.26 3.01 0.03 -4.99 117.46 116.76 2nrt n PHE 526 Ca -0.09 0.26 0.00 0.00 1.01 0.00 0.00 57.45 58.63 2nrt n PHE 526 Cb 0.33 -1.13 0.00 0.00 -0.01 0.00 0.00 39.48 38.67 2nrt n PHE 526 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2nrt n GLY 527 N 1.64 0.89 3.36 1.37 0.00 0.18 -4.62 105.19 108.01 2nrt n GLY 527 Ca -0.22 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.70 2nrt n GLY 527 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nrt s SER 528 N 0.00 -0.01 0.19 1.61 1.04 -1.26 -3.26 113.70 112.01 2nrt s SER 528 Ca 0.00 -0.78 -0.12 0.00 0.48 0.00 0.00 55.95 55.53 2nrt s SER 528 Cb 0.00 0.45 0.10 0.00 0.10 0.00 0.00 66.02 66.68 2nrt s SER 528 CO 0.00 -0.91 1.85 -0.07 0.98 0.00 0.00 173.24 175.09 2nrt h LEU 529 N 2.50 0.73 -0.96 2.42 3.38 -1.89 -1.94 115.31 119.54 2nrt h LEU 529 Ca -0.31 -0.03 0.07 0.00 0.09 0.00 0.00 57.88 57.70 2nrt h LEU 529 Cb 1.23 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.73 2nrt h LEU 529 CO 0.47 0.54 0.61 -0.08 0.09 0.00 0.00 178.44 180.07 2nrt h GLU 530 N 0.85 1.06 -0.04 1.13 4.81 -1.97 -0.93 114.58 119.49 2nrt h GLU 530 Ca 0.23 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.39 2nrt h GLU 530 Cb -0.08 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.06 2nrt h GLU 530 CO -0.05 0.70 -0.01 -0.97 -0.73 0.00 0.00 179.01 177.95 2nrt h ASN 531 N 1.09 0.07 1.15 1.04 -1.24 -1.77 -2.66 115.58 113.26 2nrt h ASN 531 Ca 0.43 -0.36 -0.02 0.00 0.71 0.00 0.00 56.30 57.05 2nrt h ASN 531 Cb 0.22 -0.02 -0.00 0.00 0.73 0.00 0.00 38.32 39.25 2nrt h ASN 531 CO -0.19 0.41 -0.11 -0.29 -1.29 0.00 0.00 177.43 175.97 2nrt h ILE 532 N -0.28 0.25 0.00 2.57 2.10 -1.28 -2.33 117.51 118.54 2nrt h ILE 532 Ca 0.01 -0.89 0.00 0.00 1.08 0.00 0.00 64.86 65.06 2nrt h ILE 532 Cb 0.38 1.72 0.00 0.00 -1.09 0.00 0.00 36.82 37.83 2nrt h ILE 532 CO 0.00 0.11 0.00 0.03 -1.08 0.00 0.00 178.15 177.21 2nrt h ARG 533 N 0.00 0.00 -0.01 2.19 3.08 -1.05 -2.91 114.38 115.68 2nrt h ARG 533 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2nrt h ARG 533 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.76 2nrt h ARG 533 CO 0.01 0.00 -0.06 -1.13 -1.07 0.00 0.00 179.97 177.72 2nrt n SER 534 N -2.55 1.49 -4.85 7.04 3.41 -0.88 -4.95 113.62 112.33 2nrt n SER 534 Ca 0.04 -1.39 -0.34 0.00 -0.26 0.00 0.00 58.87 56.91 2nrt n SER 534 Cb 0.41 0.04 -0.06 0.00 -0.26 0.00 0.00 64.21 64.34 2nrt n SER 534 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nrt s ALA 535 N -2.12 3.53 0.65 7.33 0.00 -1.10 -5.09 121.76 124.96 2nrt s ALA 535 Ca 0.34 -0.12 -0.14 0.00 0.00 0.00 0.00 51.96 52.05 2nrt s ALA 535 Cb 0.20 -2.56 -0.01 0.00 0.00 0.00 0.00 23.12 20.76 2nrt s ALA 535 CO 0.38 0.44 1.07 -1.54 0.00 0.00 0.00 175.76 176.11 2nrt s SER 536 N -1.93 5.47 0.19 0.00 1.04 -1.26 -4.90 113.70 112.31 2nrt s SER 536 Ca 0.42 1.77 -0.18 0.00 0.48 0.00 0.00 55.95 58.44 2nrt s SER 536 Cb -0.14 -2.52 0.14 0.00 0.10 0.00 0.00 66.02 63.60 2nrt s SER 536 CO 0.20 -1.38 1.61 0.25 0.98 0.00 0.00 173.24 174.90 2nrt h LEU 537 N -0.12 -0.85 -0.91 2.42 5.85 -1.98 -1.28 115.31 118.45 2nrt h LEU 537 Ca -0.46 0.19 0.07 0.00 0.84 0.00 0.00 57.88 58.53 2nrt h LEU 537 Cb 1.22 0.45 -0.07 0.00 0.37 0.00 0.00 40.66 42.64 2nrt h LEU 537 CO 0.56 -0.26 0.57 -0.33 -0.34 0.00 0.00 178.44 178.64 2nrt h GLU 538 N -0.12 0.99 -0.15 1.25 5.08 -1.98 0.11 114.58 119.75 2nrt h GLU 538 Ca 0.24 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 2nrt h GLU 538 Cb 0.50 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 2nrt h GLU 538 CO -0.60 0.66 0.03 0.93 -1.00 0.00 0.00 179.01 179.03 2nrt h GLU 539 N 1.02 0.25 -0.41 2.33 5.08 -1.76 -0.87 114.58 120.22 2nrt h GLU 539 Ca 0.40 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.69 2nrt h GLU 539 Cb 0.21 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 2nrt h GLU 539 CO -0.18 0.41 0.24 0.82 -1.00 0.00 0.00 179.01 179.29 2nrt h ILE 540 N 0.04 1.14 -0.74 3.13 2.04 -0.97 -2.70 117.51 119.46 2nrt h ILE 540 Ca 0.05 -0.35 0.02 0.00 1.00 0.00 0.00 64.86 65.58 2nrt h ILE 540 Cb 0.28 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 2nrt h ILE 540 CO 0.00 0.15 0.48 0.00 0.00 0.00 0.00 178.15 178.78 2nrt h ALA 541 N 1.10 0.95 -0.86 1.87 0.00 -0.65 -2.39 119.26 119.27 2nrt h ALA 541 Ca 0.15 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2nrt h ALA 541 Cb 0.03 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.50 2nrt h ALA 541 CO -0.03 0.31 0.44 0.00 0.00 0.00 0.00 179.25 179.98 2nrt h ARG 542 N 0.96 1.21 -0.61 0.00 3.08 -0.94 0.28 114.38 118.36 2nrt h ARG 542 Ca 0.28 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 2nrt h ARG 542 Cb -0.06 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 29.73 2nrt h ARG 542 CO -0.08 0.90 0.26 0.28 -1.07 0.00 0.00 179.97 180.26 2nrt h VAL 543 N 1.21 1.21 -0.08 2.04 2.07 -1.12 -3.18 116.25 118.40 2nrt h VAL 543 Ca 0.30 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 67.16 2nrt h VAL 543 Cb 0.07 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 2nrt h VAL 543 CO -0.04 0.26 0.00 2.30 0.02 0.00 0.00 177.57 180.11 2nrt n ILE 544 N -4.32 0.19 -1.41 4.57 -5.35 -1.04 -4.91 119.36 107.09 2nrt n ILE 544 Ca 0.05 -0.59 -0.09 0.00 -0.27 0.00 0.00 62.75 61.85 2nrt n ILE 544 Cb 0.16 1.12 -0.03 0.00 -1.74 0.00 0.00 39.64 39.14 2nrt n ILE 544 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2nrt n GLY 545 N 0.68 0.92 3.27 3.28 0.00 0.93 -5.00 105.19 109.28 2nrt n GLY 545 Ca 0.08 -0.60 -0.04 0.00 0.00 0.00 0.00 46.02 45.46 2nrt n GLY 545 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2nrt s SER 546 N -2.85 -0.64 0.19 1.61 0.15 -0.86 -5.00 113.70 106.29 2nrt s SER 546 Ca 0.00 0.97 -0.01 0.00 0.70 0.00 0.00 55.95 57.61 2nrt s SER 546 Cb 0.00 1.74 0.09 0.00 -1.71 0.00 0.00 66.02 66.13 2nrt s SER 546 CO 0.00 -0.25 1.46 0.74 1.20 0.00 0.00 173.24 176.39 2nrt h THR 547 N 6.09 1.37 -0.07 6.45 2.02 -1.94 -1.03 112.91 125.81 2nrt h THR 547 Ca -0.19 -2.07 0.01 0.00 0.77 0.00 0.00 66.41 64.94 2nrt h THR 547 Cb 1.13 2.05 -0.01 0.00 -1.74 0.00 0.00 68.15 69.57 2nrt h THR 547 CO 0.17 0.62 -0.02 -0.33 0.37 0.00 0.00 175.52 176.34 2nrt h GLU 548 N 0.29 -0.00 -0.50 6.66 4.39 -1.98 0.79 114.58 124.22 2nrt h GLU 548 Ca -0.02 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.55 2nrt h GLU 548 Cb 1.25 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.89 2nrt h GLU 548 CO 0.12 -0.00 -0.19 0.82 -1.16 0.00 0.00 179.01 178.60 2nrt h ILE 549 N -0.00 1.27 -0.56 3.13 2.04 -1.95 -2.86 117.51 118.57 2nrt h ILE 549 Ca 0.03 -1.35 -0.01 0.00 1.00 0.00 0.00 64.86 64.53 2nrt h ILE 549 Cb 0.06 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 2nrt h ILE 549 CO -0.07 0.47 0.30 0.00 0.00 0.00 0.00 178.15 178.84 2nrt h ALA 550 N 0.90 1.47 -0.95 1.87 0.00 -0.77 -1.21 119.26 120.56 2nrt h ALA 550 Ca 0.12 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2nrt h ALA 550 Cb 0.76 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 2nrt h ALA 550 CO 0.06 0.43 0.57 0.00 0.00 0.00 0.00 179.25 180.32 2nrt h ARG 551 N 0.78 1.29 -0.15 0.00 3.08 -0.63 -1.31 114.38 117.43 2nrt h ARG 551 Ca 0.20 -0.12 -0.17 0.00 0.07 0.00 0.00 59.98 59.96 2nrt h ARG 551 Cb 0.04 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 29.81 2nrt h ARG 551 CO -0.03 0.91 -0.60 0.00 -1.07 0.00 0.00 179.97 179.17 2nrt h ARG 552 N 1.31 0.52 -0.57 0.04 3.08 -1.21 -0.57 114.38 116.99 2nrt h ARG 552 Ca 0.34 -0.35 0.06 0.00 0.07 0.00 0.00 59.98 60.09 2nrt h ARG 552 Cb -0.05 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.00 2nrt h ARG 552 CO -0.06 0.97 0.29 0.28 -1.07 0.00 0.00 179.97 180.37 2nrt h VAL 553 N 0.39 0.93 -0.66 2.04 2.07 -0.88 -1.99 116.25 118.15 2nrt h VAL 553 Ca -0.00 -0.18 -0.06 0.00 0.82 0.00 0.00 66.70 67.27 2nrt h VAL 553 Cb 1.16 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 2nrt h VAL 553 CO 0.11 0.10 0.16 -0.07 0.02 0.00 0.00 177.57 177.89 2nrt h LEU 554 N 0.54 1.00 -0.11 2.57 4.07 -0.79 -0.95 115.31 121.64 2nrt h LEU 554 Ca 0.26 -0.23 0.04 0.00 0.08 0.00 0.00 57.88 58.03 2nrt h LEU 554 Cb 0.19 -0.26 -0.06 0.00 1.08 0.00 0.00 40.66 41.60 2nrt h LEU 554 CO -0.19 0.97 -0.35 0.44 -1.08 0.00 0.00 178.44 178.24 2nrt h ASP 555 N 0.99 -1.07 1.59 -0.43 3.32 -0.87 -2.95 116.42 117.00 2nrt h ASP 555 Ca 0.21 0.15 -0.06 0.00 0.02 0.00 0.00 57.03 57.35 2nrt h ASP 555 Cb 0.36 0.45 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 2nrt h ASP 555 CO 0.00 -0.38 -0.30 0.16 -1.72 0.00 0.00 179.24 177.00 2nrt h ILE 556 N -0.43 0.53 0.00 0.35 -0.00 -1.05 -3.51 117.51 113.39 2nrt h ILE 556 Ca 0.09 -1.67 0.00 0.00 -0.00 0.00 0.00 64.86 63.28 2nrt h ILE 556 Cb 0.57 2.20 0.00 0.00 -0.00 0.00 0.00 36.82 39.59 2nrt h ILE 556 CO -0.35 0.29 0.00 0.18 -0.00 0.00 0.00 178.15 178.27