#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nqo s THR 381 N 0.00 0.06 0.01 12.58 -1.32 -0.70 -4.67 115.64 121.59 2nqo s THR 381 Ca 0.00 -0.50 0.04 0.00 -1.21 0.00 0.00 61.69 60.02 2nqo s THR 381 Cb 0.00 -0.68 -0.01 0.00 -1.51 0.00 0.00 72.50 70.30 2nqo s THR 381 CO 0.00 -0.27 -0.12 -2.28 -2.21 0.00 0.00 174.62 169.73 2nqo s HIS 382 N -1.53 1.11 0.04 9.09 2.46 -1.26 -1.57 115.29 123.62 2nqo s HIS 382 Ca -0.12 -0.26 0.02 0.00 0.47 0.00 0.00 55.06 55.18 2nqo s HIS 382 Cb -0.04 -0.69 -0.02 0.00 -0.13 0.00 0.00 32.58 31.69 2nqo s HIS 382 CO 0.03 -0.00 -0.08 1.52 -2.47 0.00 0.00 174.74 173.74 2nqo s TYR 383 N -0.48 0.71 0.01 3.88 1.13 0.98 -4.63 117.35 118.96 2nqo s TYR 383 Ca 0.03 -0.43 0.07 0.00 -1.41 0.00 0.00 57.07 55.34 2nqo s TYR 383 Cb -0.06 -0.43 -0.02 0.00 -1.10 0.00 0.00 41.96 40.35 2nqo s TYR 383 CO 0.00 -0.05 -0.21 -1.12 -2.51 0.00 0.00 175.55 171.65 2nqo s SER 384 N -1.36 2.53 -0.01 -0.18 0.01 -1.26 -0.81 113.70 112.62 2nqo s SER 384 Ca -0.07 -0.46 -0.02 0.00 1.31 0.00 0.00 55.95 56.71 2nqo s SER 384 Cb -0.09 -0.25 0.00 0.00 0.21 0.00 0.00 66.02 65.90 2nqo s SER 384 CO 0.01 0.22 0.04 -0.69 0.41 0.00 0.00 173.24 173.22 2nqo s VAL 385 N -0.65 0.02 -0.12 3.43 1.01 0.13 -4.99 120.40 119.23 2nqo s VAL 385 Ca 0.08 -0.17 -0.06 0.00 0.00 0.00 0.00 61.98 61.83 2nqo s VAL 385 Cb -0.09 -0.12 0.05 0.00 0.00 0.00 0.00 36.38 36.22 2nqo s VAL 385 CO 0.01 -0.09 0.29 0.00 0.00 0.00 0.00 175.10 175.30 2nqo s ALA 386 N -0.27 -0.69 0.55 5.51 0.00 -1.26 -0.37 121.76 125.23 2nqo s ALA 386 Ca -0.03 1.13 0.05 0.00 0.00 0.00 0.00 51.96 53.12 2nqo s ALA 386 Cb -0.02 -0.71 0.04 0.00 0.00 0.00 0.00 23.12 22.44 2nqo s ALA 386 CO 0.00 -0.21 0.43 0.16 0.00 0.00 0.00 175.76 176.13 2nqo s ASP 387 N 1.27 4.64 0.53 0.00 1.47 -0.74 -5.02 116.67 118.82 2nqo s ASP 387 Ca -0.09 -1.25 0.31 0.00 1.18 0.00 0.00 52.55 52.70 2nqo s ASP 387 Cb -0.10 0.47 1.39 0.00 -0.34 0.00 0.00 42.92 44.34 2nqo s ASP 387 CO -0.09 -1.14 2.00 0.08 0.68 0.00 0.00 175.17 176.70 2nqo h ARG 388 N 0.70 0.00 -0.00 2.11 0.11 -2.02 -3.01 114.38 112.28 2nqo h ARG 388 Ca -0.36 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.72 2nqo h ARG 388 Cb 1.30 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.38 2nqo h ARG 388 CO 0.56 0.08 -0.11 0.91 0.10 0.00 0.00 179.97 181.51 2nqo n TRP 389 N -3.27 0.00 0.00 4.08 8.01 -1.26 -4.92 117.44 120.09 2nqo n TRP 389 Ca -0.00 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.19 2nqo n TRP 389 Cb 0.30 -0.38 0.00 0.00 -2.01 0.00 0.00 31.31 29.22 2nqo n TRP 389 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2nqo n GLY 390 N 1.44 0.63 3.80 6.99 0.00 -1.14 -5.09 105.19 111.83 2nqo n GLY 390 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 2nqo n GLY 390 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2nqo s ASN 391 N -2.14 7.17 -0.05 1.61 0.01 -1.26 -4.81 114.94 115.46 2nqo s ASN 391 Ca 0.00 1.76 -0.03 0.00 -0.71 0.00 0.00 52.86 53.88 2nqo s ASN 391 Cb 0.00 -2.56 0.03 0.00 0.41 0.00 0.00 41.25 39.13 2nqo s ASN 391 CO 0.00 -0.18 0.12 0.00 -1.51 0.00 0.00 177.10 175.53 2nqo s ALA 392 N -1.84 -0.23 -0.08 0.60 0.00 -1.26 -1.78 121.76 117.17 2nqo s ALA 392 Ca 0.55 0.51 0.01 0.00 0.00 0.00 0.00 51.96 53.02 2nqo s ALA 392 Cb -0.15 -0.33 0.02 0.00 0.00 0.00 0.00 23.12 22.66 2nqo s ALA 392 CO 0.19 -0.11 -0.09 0.08 0.00 0.00 0.00 175.76 175.83 2nqo s VAL 393 N 0.77 0.96 -0.26 0.00 1.01 0.51 -5.00 120.40 118.39 2nqo s VAL 393 Ca -0.06 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.59 2nqo s VAL 393 Cb -0.08 -0.93 0.05 0.00 0.00 0.00 0.00 36.38 35.42 2nqo s VAL 393 CO -0.04 0.33 -0.08 -0.55 0.00 0.00 0.00 175.10 174.77 2nqo s SER 394 N 1.07 4.45 -0.12 3.32 0.15 -1.26 -0.69 113.70 120.61 2nqo s SER 394 Ca -0.07 -1.21 0.03 0.00 0.70 0.00 0.00 55.95 55.39 2nqo s SER 394 Cb -0.14 -1.61 0.01 0.00 -1.71 0.00 0.00 66.02 62.56 2nqo s SER 394 CO -0.01 -0.18 -0.21 -0.69 1.20 0.00 0.00 173.24 173.35 2nqo s VAL 395 N 1.20 1.92 -0.15 4.45 1.01 0.01 -4.76 120.40 124.07 2nqo s VAL 395 Ca -0.05 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.03 2nqo s VAL 395 Cb -0.19 -1.69 0.02 0.00 0.00 0.00 0.00 36.38 34.52 2nqo s VAL 395 CO -0.04 0.52 -0.17 -0.89 0.00 0.00 0.00 175.10 174.52 2nqo s THR 396 N 0.69 1.76 0.18 3.92 2.01 -1.26 -0.01 115.64 122.93 2nqo s THR 396 Ca -0.11 -0.76 -0.00 0.00 0.31 0.00 0.00 61.69 61.13 2nqo s THR 396 Cb -0.16 -1.61 -0.04 0.00 0.01 0.00 0.00 72.50 70.69 2nqo s THR 396 CO 0.02 0.49 0.07 -0.72 -0.69 0.00 0.00 174.62 173.79 2nqo s TYR 397 N 1.33 1.13 0.11 4.92 1.13 -0.61 -5.00 117.35 120.37 2nqo s TYR 397 Ca 0.03 -1.23 -0.25 0.00 -1.41 0.00 0.00 57.07 54.21 2nqo s TYR 397 Cb -0.13 -0.62 0.08 0.00 -1.10 0.00 0.00 41.96 40.19 2nqo s TYR 397 CO -0.10 -0.46 1.11 -0.08 -2.51 0.00 0.00 175.55 173.51 2nqo s THR 398 N -3.95 0.00 -0.07 -3.49 -1.32 -1.26 -1.73 115.64 103.82 2nqo s THR 398 Ca 0.31 -0.46 0.10 0.00 -1.21 0.00 0.00 61.69 60.43 2nqo s THR 398 Cb 0.07 -2.62 0.16 0.00 -1.51 0.00 0.00 72.50 68.60 2nqo s THR 398 CO 0.07 0.00 1.05 2.30 -2.21 0.00 0.00 174.62 175.83 2nqo n ILE 399 N -0.67 1.29 0.00 5.08 -5.35 -1.26 -5.00 119.36 113.44 2nqo n ILE 399 Ca -0.03 -1.49 0.00 0.00 -0.27 0.00 0.00 62.75 60.96 2nqo n ILE 399 Cb 0.60 0.13 0.00 0.00 -1.74 0.00 0.00 39.64 38.63 2nqo n ILE 399 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 2nqo n ASN 400 N -0.91 0.00 -4.58 7.28 5.15 -1.26 -2.33 115.26 118.62 2nqo n ASN 400 Ca 0.09 0.00 -0.29 0.00 -0.60 0.00 0.00 54.58 53.77 2nqo n ASN 400 Cb 0.53 0.00 0.15 0.00 -0.53 0.00 0.00 39.78 39.93 2nqo n ASN 400 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2nqo s ALA 401 N -1.00 1.89 -0.00 5.20 0.00 -1.26 -3.38 121.76 123.21 2nqo s ALA 401 Ca 0.00 -0.72 -0.30 0.00 0.00 0.00 0.00 51.96 50.94 2nqo s ALA 401 Cb 0.00 -2.96 -0.08 0.00 0.00 0.00 0.00 23.12 20.09 2nqo s ALA 401 CO 0.00 -2.35 1.94 -1.12 0.00 0.00 0.00 175.76 174.23 2nqo s SER 402 N -4.27 6.39 -1.15 0.00 0.01 -1.26 -0.38 113.70 113.03 2nqo s SER 402 Ca 0.66 2.52 0.00 0.00 1.31 0.00 0.00 55.95 60.44 2nqo s SER 402 Cb -0.11 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.59 2nqo s SER 402 CO 0.53 -1.12 0.00 -1.22 0.41 0.00 0.00 173.24 171.84 2nqo n TYR 403 N 7.87 -0.12 0.00 2.43 4.01 -1.26 -4.80 117.16 125.29 2nqo n TYR 403 Ca 0.20 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.94 2nqo n TYR 403 Cb 0.42 -2.24 0.00 0.00 -0.31 0.00 0.00 39.34 37.21 2nqo n TYR 403 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2nqo n GLY 404 N -1.45 3.11 0.00 2.72 0.00 0.49 -0.69 105.19 109.37 2nqo n GLY 404 Ca -0.12 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.00 2nqo n GLY 404 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2nqo n SER 405 N 3.24 0.00 0.00 1.61 3.41 0.03 -4.59 113.62 117.32 2nqo n SER 405 Ca 0.00 -0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 2nqo n SER 405 Cb 0.00 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 2nqo n SER 405 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nqo n ALA 406 N -1.25 0.00 -2.77 7.33 0.00 0.13 -4.97 120.51 118.98 2nqo n ALA 406 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.21 2nqo n ALA 406 Cb 0.17 -0.42 -0.09 0.00 0.00 0.00 0.00 19.45 19.11 2nqo n ALA 406 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2nqo s ALA 407 N -2.70 3.35 0.30 0.00 0.00 -1.26 -4.97 121.76 116.48 2nqo s ALA 407 Ca 0.00 -0.77 0.09 0.00 0.00 0.00 0.00 51.96 51.27 2nqo s ALA 407 Cb 0.00 -1.64 -0.04 0.00 0.00 0.00 0.00 23.12 21.44 2nqo s ALA 407 CO 0.00 0.46 0.10 -1.12 0.00 0.00 0.00 175.76 175.20 2nqo s SER 408 N -0.50 4.72 -0.46 0.00 0.01 -1.26 0.49 113.70 116.70 2nqo s SER 408 Ca 0.09 -0.67 -0.20 0.00 1.31 0.00 0.00 55.95 56.48 2nqo s SER 408 Cb -0.12 -0.84 0.03 0.00 0.21 0.00 0.00 66.02 65.31 2nqo s SER 408 CO 0.02 -0.17 0.65 -0.63 0.41 0.00 0.00 173.24 173.52 2nqo s ILE 409 N -2.36 4.83 0.14 1.44 -1.09 -0.89 -4.90 121.20 118.36 2nqo s ILE 409 Ca 0.35 -0.08 -0.34 0.00 -2.23 0.00 0.00 60.65 58.35 2nqo s ILE 409 Cb -0.04 -4.25 -0.14 0.00 -1.58 0.00 0.00 42.46 36.45 2nqo s ILE 409 CO 0.22 -0.68 1.58 -0.67 -1.23 0.00 0.00 174.94 174.16 2nqo n ASP 410 N 6.28 3.02 0.00 3.58 2.03 -1.26 -1.19 116.55 129.01 2nqo n ASP 410 Ca -0.03 1.08 0.00 0.00 0.52 0.00 0.00 54.79 56.36 2nqo n ASP 410 Cb 0.47 -1.41 0.00 0.00 -0.72 0.00 0.00 41.12 39.46 2nqo n ASP 410 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2nqo n GLY 411 N 3.42 3.25 0.05 0.27 0.00 -1.26 -4.80 105.19 106.11 2nqo n GLY 411 Ca 0.17 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.19 2nqo n GLY 411 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nqo n ALA 412 N -1.09 2.11 -1.04 4.61 0.00 -0.33 -5.03 120.51 119.73 2nqo n ALA 412 Ca 0.00 -0.87 -0.02 0.00 0.00 0.00 0.00 53.44 52.55 2nqo n ALA 412 Cb 0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 19.45 19.04 2nqo n ALA 412 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nqo n GLY 413 N 1.62 0.51 3.37 0.00 0.00 -1.03 -5.02 105.19 104.63 2nqo n GLY 413 Ca -0.18 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.26 2nqo n GLY 413 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2nqo s PHE 414 N -1.92 2.26 0.33 1.61 -0.71 -1.26 -4.97 117.98 113.33 2nqo s PHE 414 Ca 0.00 -0.39 -0.27 0.00 -1.04 0.00 0.00 56.93 55.23 2nqo s PHE 414 Cb 0.00 -1.27 -0.09 0.00 -1.21 0.00 0.00 43.02 40.45 2nqo s PHE 414 CO 0.00 0.26 1.05 -0.51 -1.34 0.00 0.00 175.22 174.68 2nqo s LEU 415 N -1.78 4.36 0.12 -1.99 1.43 -1.26 -2.09 118.68 117.48 2nqo s LEU 415 Ca 0.13 2.10 -0.17 0.00 -1.03 0.00 0.00 54.13 55.16 2nqo s LEU 415 Cb -0.10 -3.91 -0.07 0.00 0.03 0.00 0.00 46.19 42.15 2nqo s LEU 415 CO 0.05 -0.27 0.57 -0.76 0.23 0.00 0.00 176.35 176.17 2nqo s LEU 416 N -2.00 4.41 0.78 1.79 1.43 0.18 -4.94 118.68 120.33 2nqo s LEU 416 Ca 0.51 1.18 -0.12 0.00 -1.03 0.00 0.00 54.13 54.67 2nqo s LEU 416 Cb -0.26 -3.15 0.06 0.00 0.03 0.00 0.00 46.19 42.87 2nqo s LEU 416 CO 0.33 0.16 1.10 0.54 0.23 0.00 0.00 176.35 178.71 2nqo s ASN 417 N -1.47 4.69 -0.36 2.29 2.20 -1.26 -0.79 114.94 120.24 2nqo s ASN 417 Ca 0.35 1.22 0.11 0.00 -0.94 0.00 0.00 52.86 53.61 2nqo s ASN 417 Cb -0.17 -1.96 0.45 0.00 -2.00 0.00 0.00 41.25 37.57 2nqo s ASN 417 CO 0.19 -1.83 1.07 -0.46 -2.94 0.00 0.00 177.10 173.13 2nqo n ASN 418 N -3.33 3.34 0.28 3.54 6.94 -0.98 -4.10 115.26 120.95 2nqo n ASN 418 Ca 0.07 -3.21 0.18 0.00 -0.02 0.00 0.00 54.58 51.60 2nqo n ASN 418 Cb 0.57 -0.47 0.84 0.00 -2.36 0.00 0.00 39.78 38.36 2nqo n ASN 418 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 2nqo h GLU 419 N 2.66 0.00 -0.07 -3.83 4.57 -1.94 -2.94 114.58 113.02 2nqo h GLU 419 Ca 0.13 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.33 2nqo h GLU 419 Cb 1.13 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.72 2nqo h GLU 419 CO 0.65 0.00 0.06 0.52 -1.18 0.00 0.00 179.01 179.06 2nqo h MET 420 N 0.00 0.00 0.00 1.92 2.86 -1.97 -0.53 114.93 117.21 2nqo h MET 420 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2nqo h MET 420 Cb 0.31 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.97 2nqo h MET 420 CO 0.00 0.00 0.00 -3.47 1.06 0.00 0.00 176.91 174.50 2nqo n ASP 421 N -4.17 0.00 -0.06 1.22 2.03 -1.11 -0.78 116.55 113.68 2nqo n ASP 421 Ca -0.01 0.40 0.14 0.00 0.52 0.00 0.00 54.79 55.83 2nqo n ASP 421 Cb 0.17 -0.44 0.55 0.00 -0.72 0.00 0.00 41.12 40.68 2nqo n ASP 421 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2nqo n ASP 422 N -1.44 0.33 -4.88 1.67 9.92 -0.21 -4.69 116.55 117.25 2nqo n ASP 422 Ca 0.03 -0.21 -0.30 0.00 -0.53 0.00 0.00 54.79 53.78 2nqo n ASP 422 Cb 0.11 -0.13 -0.01 0.00 -0.64 0.00 0.00 41.12 40.45 2nqo n ASP 422 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 2nqo s PHE 423 N -2.71 3.54 -0.49 1.24 0.08 0.04 -3.97 117.98 115.70 2nqo s PHE 423 Ca 0.22 1.06 -0.24 0.00 0.12 0.00 0.00 56.93 58.09 2nqo s PHE 423 Cb 0.19 -2.49 0.03 0.00 -0.57 0.00 0.00 43.02 40.19 2nqo s PHE 423 CO 0.53 -0.33 0.88 0.45 -0.10 0.00 0.00 175.22 176.66 2nqo s SER 424 N -3.72 6.40 0.00 1.36 0.15 0.73 -4.85 113.70 113.76 2nqo s SER 424 Ca 0.51 -0.16 0.29 0.00 0.70 0.00 0.00 55.95 57.29 2nqo s SER 424 Cb -0.10 -2.42 1.23 0.00 -1.71 0.00 0.00 66.02 63.02 2nqo s SER 424 CO 0.41 -1.08 1.86 2.30 1.20 0.00 0.00 173.24 177.94 2nqo n ILE 425 N 6.23 0.00 -3.54 6.45 -5.35 -1.26 -4.15 119.36 117.74 2nqo n ILE 425 Ca 0.03 -0.07 0.00 0.00 -0.27 0.00 0.00 62.75 62.45 2nqo n ILE 425 Cb 0.48 -0.08 -0.06 0.00 -1.74 0.00 0.00 39.64 38.25 2nqo n ILE 425 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 2nqo s LYS 426 N -2.44 0.23 0.11 6.28 2.20 -1.26 -5.05 119.74 119.81 2nqo s LYS 426 Ca 0.30 0.45 -0.35 0.00 -0.36 0.00 0.00 55.97 56.01 2nqo s LYS 426 Cb 0.20 0.14 -0.18 0.00 -1.51 0.00 0.00 37.83 36.48 2nqo s LYS 426 CO 0.47 -0.06 0.99 -2.30 -0.36 0.00 0.00 175.35 174.09 2nqo n PRO 427 N 3.93 0.46 -0.45 4.03 -0.02 -1.26 -0.91 135.00 140.78 2nqo n PRO 427 Ca -0.15 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 2nqo n PRO 427 Cb 0.56 -1.56 0.00 0.00 -0.02 0.00 0.00 33.50 32.48 2nqo n PRO 427 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2nqo n GLY 428 N 1.85 0.85 3.63 -1.23 0.00 -1.06 -4.96 105.19 104.27 2nqo n GLY 428 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 2nqo n GLY 428 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2nqo s ASN 429 N -2.67 6.88 0.16 1.61 3.84 -0.08 -4.89 114.94 119.78 2nqo s ASN 429 Ca 0.00 0.98 -0.30 0.00 0.21 0.00 0.00 52.86 53.75 2nqo s ASN 429 Cb 0.00 -2.51 -0.08 0.00 -0.55 0.00 0.00 41.25 38.12 2nqo s ASN 429 CO 0.00 -0.78 1.20 -2.16 -2.79 0.00 0.00 177.10 172.56 2nqo s PRO 430 N 3.41 4.48 0.00 0.43 0.04 -1.26 -4.58 135.00 137.53 2nqo s PRO 430 Ca 0.42 1.85 0.00 0.00 0.04 0.00 0.00 61.00 63.31 2nqo s PRO 430 Cb -0.13 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.15 2nqo s PRO 430 CO 0.13 -0.12 0.00 0.27 0.04 0.00 0.00 177.00 177.33 2nqo n ASN 431 N 2.81 0.00 0.32 6.66 6.94 -0.68 -4.77 115.26 126.54 2nqo n ASN 431 Ca 0.05 -0.44 0.14 0.00 -0.02 0.00 0.00 54.58 54.31 2nqo n ASN 431 Cb 0.45 0.00 0.73 0.00 -2.36 0.00 0.00 39.78 38.60 2nqo n ASN 431 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 2nqo h LEU 432 N 0.00 0.00 -2.88 -4.53 3.38 -1.91 -1.23 115.31 108.14 2nqo h LEU 432 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2nqo h LEU 432 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2nqo h LEU 432 CO 0.00 0.00 0.00 -1.22 0.09 0.00 0.00 178.44 177.31 2nqo n TYR 433 N -2.80 0.15 -0.93 1.13 4.01 -1.26 -4.98 117.16 112.49 2nqo n TYR 433 Ca -0.02 -0.48 0.00 0.00 -0.16 0.00 0.00 57.90 57.25 2nqo n TYR 433 Cb 0.41 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.40 2nqo n TYR 433 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2nqo n GLY 434 N -0.14 0.54 3.78 2.72 0.00 -0.46 -4.73 105.19 106.90 2nqo n GLY 434 Ca 0.04 -0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 2nqo n GLY 434 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2nqo s LEU 435 N 0.00 4.56 0.33 0.99 1.43 -1.26 -4.64 118.68 120.09 2nqo s LEU 435 Ca 0.00 1.66 0.10 0.00 -1.03 0.00 0.00 54.13 54.86 2nqo s LEU 435 Cb 0.00 -3.39 -0.06 0.00 0.03 0.00 0.00 46.19 42.77 2nqo s LEU 435 CO 0.00 0.17 -0.09 0.68 0.23 0.00 0.00 176.35 177.34 2nqo s VAL 436 N -1.21 2.37 0.27 -1.59 -7.23 -1.26 -1.68 120.40 110.06 2nqo s VAL 436 Ca 0.38 -2.19 -0.20 0.00 -1.81 0.00 0.00 61.98 58.15 2nqo s VAL 436 Cb -0.23 -2.62 0.02 0.00 0.56 0.00 0.00 36.38 34.11 2nqo s VAL 436 CO 0.26 -0.24 0.69 -0.83 -0.31 0.00 0.00 175.10 174.67 2nqo s GLY 437 N -3.61 -0.04 0.00 2.32 0.00 -1.26 -5.00 107.32 99.73 2nqo s GLY 437 Ca 0.32 -0.34 0.00 0.00 0.00 0.00 0.00 44.72 44.70 2nqo s GLY 437 CO 0.17 -0.14 0.00 0.61 0.00 0.00 0.00 173.10 173.74 2nqo n GLY 438 N -0.45 1.60 0.12 0.20 0.00 -1.26 -2.55 105.19 102.85 2nqo n GLY 438 Ca -0.04 -0.04 -0.17 0.00 0.00 0.00 0.00 46.02 45.76 2nqo n GLY 438 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2nqo n ASP 439 N 0.00 1.69 -0.32 1.61 8.00 -1.26 -3.88 116.55 122.39 2nqo n ASP 439 Ca 0.00 0.27 0.17 0.00 0.71 0.00 0.00 54.79 55.94 2nqo n ASP 439 Cb 0.00 -0.57 0.42 0.00 -0.02 0.00 0.00 41.12 40.94 2nqo n ASP 439 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2nqo h ALA 440 N 0.38 1.94 -0.55 2.24 0.00 -2.02 -2.32 119.26 118.94 2nqo h ALA 440 Ca -0.38 0.07 -0.38 0.00 0.00 0.00 0.00 54.91 54.21 2nqo h ALA 440 Cb 2.03 -0.03 -0.26 0.00 0.00 0.00 0.00 17.79 19.53 2nqo h ALA 440 CO 0.08 -0.31 -0.39 -1.71 0.00 0.00 0.00 179.25 176.92 2nqo n ASN 441 N -4.69 4.09 -4.91 0.00 5.15 -1.26 -5.02 115.26 108.62 2nqo n ASN 441 Ca 0.23 -3.80 -0.28 0.00 -0.60 0.00 0.00 54.58 50.14 2nqo n ASN 441 Cb 0.70 -0.52 0.05 0.00 -0.53 0.00 0.00 39.78 39.47 2nqo n ASN 441 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2nqo s ALA 442 N -3.48 3.10 0.06 5.20 0.00 -0.87 -0.20 121.76 125.56 2nqo s ALA 442 Ca 0.49 -0.62 -0.29 0.00 0.00 0.00 0.00 51.96 51.54 2nqo s ALA 442 Cb 0.41 -2.76 -0.05 0.00 0.00 0.00 0.00 23.12 20.72 2nqo s ALA 442 CO 0.00 -1.06 0.92 0.42 0.00 0.00 0.00 175.76 176.04 2nqo s ILE 443 N -3.20 4.67 -0.01 0.00 1.01 -1.26 -4.83 121.20 117.58 2nqo s ILE 443 Ca 0.57 1.97 -0.09 0.00 0.00 0.00 0.00 60.65 63.10 2nqo s ILE 443 Cb -0.11 -4.27 0.01 0.00 0.01 0.00 0.00 42.46 38.10 2nqo s ILE 443 CO 0.47 0.28 0.18 -1.61 0.00 0.00 0.00 174.94 174.26 2nqo s GLU 444 N 0.31 0.49 0.23 2.79 2.02 -1.26 -5.10 118.70 118.18 2nqo s GLU 444 Ca 0.46 -0.28 -0.32 0.00 0.02 0.00 0.00 54.97 54.86 2nqo s GLU 444 Cb -0.22 0.21 -0.13 0.00 0.10 0.00 0.00 34.13 34.09 2nqo s GLU 444 CO 0.28 -0.12 1.56 0.00 0.02 0.00 0.00 175.26 177.00 2nqo n ALA 445 N 1.61 1.89 -0.83 5.21 0.00 -1.26 -1.86 120.51 125.27 2nqo n ALA 445 Ca -0.21 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2nqo n ALA 445 Cb 0.56 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.62 2nqo n ALA 445 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2nqo n ASN 446 N 2.82 -2.39 -4.79 0.00 3.02 -1.26 -4.99 115.26 107.67 2nqo n ASN 446 Ca 0.13 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.32 2nqo n ASN 446 Cb 0.33 -2.04 -0.07 0.00 -0.61 0.00 0.00 39.78 37.39 2nqo n ASN 446 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2nqo s LYS 447 N -0.97 4.48 -0.18 3.52 2.20 -0.78 -5.04 119.74 122.98 2nqo s LYS 447 Ca 0.00 1.26 -0.14 0.00 -0.36 0.00 0.00 55.97 56.73 2nqo s LYS 447 Cb 0.00 -2.64 -0.04 0.00 -1.51 0.00 0.00 37.83 33.63 2nqo s LYS 447 CO 0.00 0.20 0.32 1.03 -0.36 0.00 0.00 175.35 176.54 2nqo s ARG 448 N -2.34 4.23 0.41 4.03 0.52 -1.26 -4.88 118.95 119.66 2nqo s ARG 448 Ca 0.53 0.11 -0.26 0.00 -0.52 0.00 0.00 55.73 55.59 2nqo s ARG 448 Cb -0.16 -3.47 -0.08 0.00 0.52 0.00 0.00 34.95 31.76 2nqo s ARG 448 CO 0.21 0.14 1.29 -1.25 0.02 0.00 0.00 175.30 175.71 2nqo s PRO 449 N 0.75 3.92 0.38 3.54 0.04 -1.26 -4.96 135.00 137.42 2nqo s PRO 449 Ca 0.17 2.11 -0.27 0.00 0.04 0.00 0.00 61.00 63.05 2nqo s PRO 449 Cb -0.14 -2.71 -0.11 0.00 0.04 0.00 0.00 34.50 31.59 2nqo s PRO 449 CO 0.05 -0.51 1.32 -0.11 0.04 0.00 0.00 177.00 177.79 2nqo n LEU 450 N 0.03 4.03 -4.34 -3.56 7.94 -1.25 -4.95 117.00 114.89 2nqo n LEU 450 Ca 0.04 1.17 -0.18 0.00 -1.11 0.00 0.00 56.01 55.93 2nqo n LEU 450 Cb 0.44 -1.52 -0.10 0.00 0.53 0.00 0.00 43.42 42.77 2nqo n LEU 450 CO 0.55 -0.42 -0.40 -0.55 -1.11 0.00 0.00 177.39 175.46 2nqo s SER 451 N -0.37 2.35 0.00 1.96 0.15 -1.26 -4.75 113.70 111.77 2nqo s SER 451 Ca 0.57 -1.09 0.11 0.00 0.70 0.00 0.00 55.95 56.24 2nqo s SER 451 Cb -0.52 -0.10 -0.01 0.00 -1.71 0.00 0.00 66.02 63.68 2nqo s SER 451 CO 0.61 -0.30 0.64 -1.20 1.20 0.00 0.00 173.24 174.19 2nqo n SER 452 N -0.40 1.20 -4.65 5.45 7.64 -1.26 -5.02 113.62 116.57 2nqo n SER 452 Ca -0.07 -1.10 -0.46 0.00 1.01 0.00 0.00 58.87 58.24 2nqo n SER 452 Cb 0.62 0.51 -0.04 0.00 -1.01 0.00 0.00 64.21 64.29 2nqo n SER 452 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2nqo n MET 453 N -0.32 1.90 -2.82 1.43 2.81 -1.26 -4.18 117.12 114.69 2nqo n MET 453 Ca 0.04 0.68 -0.24 0.00 -1.81 0.00 0.00 57.70 56.38 2nqo n MET 453 Cb 0.22 -2.37 -0.02 0.00 -0.71 0.00 0.00 33.22 30.34 2nqo n MET 453 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 2nqo n SER 454 N 2.71 3.61 -4.69 7.83 7.64 -1.26 -5.03 113.62 124.42 2nqo n SER 454 Ca 0.15 -3.48 -0.44 0.00 1.01 0.00 0.00 58.87 56.11 2nqo n SER 454 Cb 0.28 -0.54 -0.04 0.00 -1.01 0.00 0.00 64.21 62.91 2nqo n SER 454 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2nqo n PRO 455 N -0.20 2.56 -4.05 1.43 -0.04 -1.26 -4.61 135.00 128.82 2nqo n PRO 455 Ca 0.30 0.93 -0.11 0.00 -0.04 0.00 0.00 63.50 64.58 2nqo n PRO 455 Cb 0.56 -2.76 -0.11 0.00 -0.04 0.00 0.00 33.50 31.15 2nqo n PRO 455 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2nqo s THR 456 N 1.78 0.39 -0.07 0.52 2.01 0.10 -5.01 115.64 115.36 2nqo s THR 456 Ca 0.80 -1.23 0.00 0.00 0.31 0.00 0.00 61.69 61.56 2nqo s THR 456 Cb -0.56 -0.76 0.02 0.00 0.01 0.00 0.00 72.50 71.21 2nqo s THR 456 CO 0.37 -0.56 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.07 2nqo s ILE 457 N -2.03 0.60 -0.15 1.82 1.01 -1.26 -0.36 121.20 120.82 2nqo s ILE 457 Ca -0.07 -0.09 -0.06 0.00 0.00 0.00 0.00 60.65 60.44 2nqo s ILE 457 Cb -0.06 -0.66 -0.04 0.00 0.01 0.00 0.00 42.46 41.72 2nqo s ILE 457 CO -0.02 0.27 0.04 -0.69 0.00 0.00 0.00 174.94 174.54 2nqo s VAL 458 N 1.38 4.62 0.24 2.92 1.01 0.13 -4.97 120.40 125.73 2nqo s VAL 458 Ca -0.03 -0.10 0.10 0.00 0.00 0.00 0.00 61.98 61.94 2nqo s VAL 458 Cb -0.13 -3.04 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 2nqo s VAL 458 CO -0.03 0.51 -0.06 -0.76 0.00 0.00 0.00 175.10 174.76 2nqo s LEU 459 N 0.01 3.03 -0.16 3.92 1.43 -1.26 -1.31 118.68 124.33 2nqo s LEU 459 Ca 0.05 -0.69 -0.04 0.00 -1.03 0.00 0.00 54.13 52.42 2nqo s LEU 459 Cb -0.12 -1.60 0.07 0.00 0.03 0.00 0.00 46.19 44.57 2nqo s LEU 459 CO 0.01 0.04 0.17 -0.75 0.23 0.00 0.00 176.35 176.05 2nqo s LYS 460 N -3.39 0.11 -1.18 1.70 2.47 -0.43 -4.80 119.74 114.22 2nqo s LYS 460 Ca 0.29 0.24 -0.06 0.00 -1.56 0.00 0.00 55.97 54.89 2nqo s LYS 460 Cb -0.07 -1.08 0.01 0.00 -1.46 0.00 0.00 37.83 35.23 2nqo s LYS 460 CO 0.18 -0.56 0.75 0.09 0.16 0.00 0.00 175.35 175.97 2nqo n ASN 461 N 5.31 -5.46 -1.23 1.43 5.03 -1.26 -1.94 115.26 117.15 2nqo n ASN 461 Ca -0.06 -0.34 -0.16 0.00 0.87 0.00 0.00 54.58 54.89 2nqo n ASN 461 Cb 0.49 -4.17 -0.07 0.00 -1.02 0.00 0.00 39.78 35.01 2nqo n ASN 461 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2nqo n ASN 462 N -1.97 -5.50 -4.54 6.41 5.03 -1.26 -4.98 115.26 108.46 2nqo n ASN 462 Ca -0.04 0.40 -0.29 0.00 0.87 0.00 0.00 54.58 55.52 2nqo n ASN 462 Cb 0.57 -4.40 -0.10 0.00 -1.02 0.00 0.00 39.78 34.82 2nqo n ASN 462 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2nqo s LYS 463 N -3.34 1.96 0.17 3.52 1.02 -0.82 -5.08 119.74 117.17 2nqo s LYS 463 Ca 0.00 -1.17 -0.32 0.00 0.02 0.00 0.00 55.97 54.50 2nqo s LYS 463 Cb 0.00 -2.18 -0.12 0.00 -0.52 0.00 0.00 37.83 35.01 2nqo s LYS 463 CO 0.00 0.47 1.75 0.28 -0.92 0.00 0.00 175.35 176.93 2nqo n VAL 464 N 0.54 0.13 -0.01 3.17 0.31 -1.26 -1.31 118.33 119.90 2nqo n VAL 464 Ca -0.13 -0.02 -0.01 0.00 -0.01 0.00 0.00 64.34 64.16 2nqo n VAL 464 Cb 0.53 -1.97 -0.00 0.00 -0.91 0.00 0.00 33.84 31.49 2nqo n VAL 464 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 2nqo n PHE 465 N 4.50 0.00 -3.88 3.52 7.35 -0.43 -4.39 117.46 124.13 2nqo n PHE 465 Ca 0.17 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.74 2nqo n PHE 465 Cb 0.35 -0.04 -0.13 0.00 0.35 0.00 0.00 39.48 40.01 2nqo n PHE 465 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 2nqo s LEU 466 N -5.91 1.92 -0.20 -2.13 1.43 -0.57 -1.34 118.68 111.88 2nqo s LEU 466 Ca -0.01 -0.02 -0.00 0.00 -1.03 0.00 0.00 54.13 53.06 2nqo s LEU 466 Cb 0.01 0.12 0.05 0.00 0.03 0.00 0.00 46.19 46.40 2nqo s LEU 466 CO 0.02 -0.06 -0.05 -0.69 0.23 0.00 0.00 176.35 175.80 2nqo s VAL 467 N -0.23 1.27 0.03 -1.59 1.01 -0.44 0.19 120.40 120.64 2nqo s VAL 467 Ca -0.03 -0.88 -0.04 0.00 0.00 0.00 0.00 61.98 61.04 2nqo s VAL 467 Cb -0.02 -1.49 -0.02 0.00 0.00 0.00 0.00 36.38 34.85 2nqo s VAL 467 CO -0.00 0.02 0.06 0.54 0.00 0.00 0.00 175.10 175.72 2nqo s VAL 468 N 1.54 0.13 0.03 2.92 0.11 0.51 -1.50 120.40 124.14 2nqo s VAL 468 Ca -0.02 -1.10 -0.28 0.00 -2.93 0.00 0.00 61.98 57.65 2nqo s VAL 468 Cb -0.17 -0.80 0.10 0.00 -1.53 0.00 0.00 36.38 33.99 2nqo s VAL 468 CO -0.07 -0.61 1.22 -0.83 -3.33 0.00 0.00 175.10 171.48 2nqo s GLY 469 N -2.02 -0.23 -0.14 6.54 0.00 -1.26 0.03 107.32 110.23 2nqo s GLY 469 Ca -0.07 0.29 -0.33 0.00 0.00 0.00 0.00 44.72 44.62 2nqo s GLY 469 CO -0.04 2.14 1.12 -0.45 0.00 0.00 0.00 173.10 175.86 2nqo s SER 470 N -3.29 -0.21 0.70 1.64 0.15 -1.26 -3.71 113.70 107.71 2nqo s SER 470 Ca 0.20 0.04 0.02 0.00 0.70 0.00 0.00 55.95 56.90 2nqo s SER 470 Cb 0.02 0.21 0.13 0.00 -1.71 0.00 0.00 66.02 64.67 2nqo s SER 470 CO -0.01 -0.33 0.96 -2.16 1.20 0.00 0.00 173.24 172.90 2nqo s PRO 471 N -2.41 1.76 0.00 5.44 0.04 -1.26 -4.65 135.00 133.92 2nqo s PRO 471 Ca 0.07 -1.30 0.00 0.00 0.04 0.00 0.00 61.00 59.81 2nqo s PRO 471 Cb -0.01 -2.40 0.00 0.00 0.04 0.00 0.00 34.50 32.13 2nqo s PRO 471 CO -0.05 -1.36 0.00 0.41 0.04 0.00 0.00 177.00 176.03 2nqo n GLY 472 N -2.72 1.35 7.00 0.56 0.00 -1.26 -4.29 105.19 105.83 2nqo n GLY 472 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2nqo n GLY 472 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nqo n GLY 473 N 0.00 2.90 0.26 -0.02 0.00 -1.26 -0.89 105.19 106.18 2nqo n GLY 473 Ca 0.00 0.04 0.07 0.00 0.00 0.00 0.00 46.02 46.13 2nqo n GLY 473 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2nqo h SER 474 N 0.00 0.05 0.56 1.61 4.64 -1.95 -2.53 113.55 115.93 2nqo h SER 474 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2nqo h SER 474 Cb 0.00 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 2nqo h SER 474 CO 0.00 0.09 0.00 0.54 -0.87 0.00 0.00 176.83 176.59 2nqo n ARG 475 N -4.48 0.04 -0.04 4.77 3.00 -0.06 -3.76 116.66 116.12 2nqo n ARG 475 Ca -0.02 0.19 -0.08 0.00 -0.01 0.00 0.00 57.85 57.93 2nqo n ARG 475 Cb 0.13 -1.50 -0.02 0.00 0.00 0.00 0.00 32.46 31.07 2nqo n ARG 475 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 2nqo h ILE 476 N 0.00 0.71 -0.36 0.55 2.04 -1.44 -0.45 117.51 118.56 2nqo h ILE 476 Ca 0.00 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 2nqo h ILE 476 Cb 0.28 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 37.02 2nqo h ILE 476 CO 0.00 0.00 0.08 0.40 0.00 0.00 0.00 178.15 178.63 2nqo h ILE 477 N -0.05 0.84 -0.17 -0.67 2.04 -1.72 -1.35 117.51 116.43 2nqo h ILE 477 Ca 0.11 -0.07 -0.13 0.00 1.00 0.00 0.00 64.86 65.77 2nqo h ILE 477 Cb 0.22 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2nqo h ILE 477 CO -0.25 0.04 -0.46 0.71 0.00 0.00 0.00 178.15 178.19 2nqo h THR 478 N 0.21 1.32 0.11 -0.27 1.35 -1.74 -2.15 112.91 111.74 2nqo h THR 478 Ca 0.17 -1.65 -0.01 0.00 -0.55 0.00 0.00 66.41 64.37 2nqo h THR 478 Cb 0.18 1.69 0.00 0.00 -1.73 0.00 0.00 68.15 68.29 2nqo h THR 478 CO -0.21 0.51 -0.05 0.74 -0.25 0.00 0.00 175.52 176.25 2nqo h THR 479 N 0.34 1.03 -0.55 6.82 2.02 -0.69 -1.85 112.91 120.04 2nqo h THR 479 Ca 0.02 -0.53 0.01 0.00 0.77 0.00 0.00 66.41 66.68 2nqo h THR 479 Cb 0.94 1.36 -0.03 0.00 -1.74 0.00 0.00 68.15 68.68 2nqo h THR 479 CO 0.08 0.13 0.36 0.58 0.37 0.00 0.00 175.52 177.04 2nqo h VAL 480 N -0.39 1.13 -0.78 3.16 2.07 -1.27 -2.46 116.25 117.70 2nqo h VAL 480 Ca -0.01 -0.25 0.06 0.00 0.82 0.00 0.00 66.70 67.32 2nqo h VAL 480 Cb 0.32 0.34 -0.06 0.00 -1.52 0.00 0.00 31.29 30.37 2nqo h VAL 480 CO 0.02 0.13 0.47 0.25 0.02 0.00 0.00 177.57 178.47 2nqo h LEU 481 N 0.73 0.73 -0.49 2.57 6.46 -1.36 -2.25 115.31 121.70 2nqo h LEU 481 Ca 0.20 0.02 -0.14 0.00 -0.12 0.00 0.00 57.88 57.84 2nqo h LEU 481 Cb -0.07 -0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 39.72 2nqo h LEU 481 CO -0.05 0.47 -0.28 1.56 -0.62 0.00 0.00 178.44 179.51 2nqo h GLN 482 N 0.86 0.94 -0.70 1.25 4.20 -0.97 -1.21 115.11 119.48 2nqo h GLN 482 Ca 0.35 -0.44 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 2nqo h GLN 482 Cb 0.18 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.91 2nqo h GLN 482 CO -0.18 1.10 0.35 0.28 -0.67 0.00 0.00 178.83 179.71 2nqo h VAL 483 N 0.80 1.23 -0.19 -0.54 2.07 -1.14 0.23 116.25 118.70 2nqo h VAL 483 Ca 0.09 -0.63 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 2nqo h VAL 483 Cb 0.86 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2nqo h VAL 483 CO 0.08 0.26 0.03 0.40 0.02 0.00 0.00 177.57 178.36 2nqo h ILE 484 N 0.97 1.23 -0.82 4.57 2.04 -1.31 -2.60 117.51 121.59 2nqo h ILE 484 Ca 0.24 -0.76 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 2nqo h ILE 484 Cb 0.10 1.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.50 2nqo h ILE 484 CO -0.03 0.23 0.45 -1.28 0.00 0.00 0.00 178.15 177.51 2nqo h SER 485 N 0.11 1.03 -0.92 1.72 0.87 -1.00 -1.26 113.55 114.10 2nqo h SER 485 Ca 0.06 -0.09 0.03 0.00 -1.23 0.00 0.00 61.79 60.56 2nqo h SER 485 Cb 0.33 -0.26 -0.05 0.00 -0.44 0.00 0.00 62.40 61.97 2nqo h SER 485 CO 0.00 0.83 0.60 0.78 -0.53 0.00 0.00 176.83 178.52 2nqo h ASN 486 N 1.15 1.01 0.04 6.23 2.35 -0.35 0.49 115.58 126.50 2nqo h ASN 486 Ca 0.29 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 56.02 2nqo h ASN 486 Cb 0.03 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.17 2nqo h ASN 486 CO -0.05 0.70 -0.02 0.58 -1.65 0.00 0.00 177.43 177.00 2nqo h VAL 487 N 1.18 1.37 -0.05 2.81 2.07 -1.05 -2.17 116.25 120.40 2nqo h VAL 487 Ca 0.36 -1.55 -0.18 0.00 0.82 0.00 0.00 66.70 66.15 2nqo h VAL 487 Cb -0.03 2.36 0.01 0.00 -1.52 0.00 0.00 31.29 32.11 2nqo h VAL 487 CO -0.10 0.38 -0.66 0.40 0.02 0.00 0.00 177.57 177.61 2nqo h ILE 488 N -0.76 1.36 0.16 4.57 2.04 -1.13 -2.22 117.51 121.53 2nqo h ILE 488 Ca -0.01 -2.00 -0.27 0.00 1.00 0.00 0.00 64.86 63.58 2nqo h ILE 488 Cb 0.66 2.35 0.01 0.00 -0.74 0.00 0.00 36.82 39.10 2nqo h ILE 488 CO 0.01 0.60 -1.31 0.44 0.00 0.00 0.00 178.15 177.89 2nqo h ASP 489 N 0.13 0.53 -0.36 1.72 3.32 -0.20 -3.38 116.42 118.17 2nqo h ASP 489 Ca -0.07 -0.91 0.00 0.00 0.02 0.00 0.00 57.03 56.08 2nqo h ASP 489 Cb 1.33 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.70 2nqo h ASP 489 CO 0.13 1.60 0.00 -1.22 -1.72 0.00 0.00 179.24 178.03 2nqo n TYR 490 N -3.89 0.47 -3.97 4.55 4.01 -1.08 -5.00 117.16 112.25 2nqo n TYR 490 Ca -0.20 -0.34 -0.29 0.00 -0.16 0.00 0.00 57.90 56.91 2nqo n TYR 490 Cb 0.94 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.96 2nqo n TYR 490 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2nqo n ASN 491 N 0.99 -2.83 -4.86 7.72 4.13 -0.84 -4.95 115.26 114.63 2nqo n ASN 491 Ca 0.15 -0.90 -0.32 0.00 1.68 0.00 0.00 54.58 55.19 2nqo n ASN 491 Cb 0.48 -3.44 -0.05 0.00 -1.54 0.00 0.00 39.78 35.23 2nqo n ASN 491 CO 0.00 0.00 0.00 -0.04 0.28 0.00 0.00 177.26 177.50 2nqo s MET 492 N -6.58 3.91 0.81 3.52 -1.94 -0.84 -4.99 119.30 113.18 2nqo s MET 492 Ca 0.43 0.53 -0.12 0.00 -1.71 0.00 0.00 55.69 54.82 2nqo s MET 492 Cb -0.22 -2.47 0.08 0.00 2.01 0.00 0.00 34.83 34.22 2nqo s MET 492 CO 0.87 0.15 1.13 0.54 -0.01 0.00 0.00 175.02 177.70 2nqo s ASN 493 N -2.48 4.49 0.45 3.03 2.20 -1.26 -4.40 114.94 116.96 2nqo s ASN 493 Ca 0.52 1.01 0.16 0.00 -0.94 0.00 0.00 52.86 53.61 2nqo s ASN 493 Cb -0.10 -1.64 1.10 0.00 -2.00 0.00 0.00 41.25 38.60 2nqo s ASN 493 CO 0.21 -1.94 1.99 -0.29 -2.94 0.00 0.00 177.10 174.13 2nqo h ILE 494 N -1.07 0.88 -0.13 0.54 6.09 -1.95 0.39 117.51 122.25 2nqo h ILE 494 Ca -0.47 -0.11 -0.03 0.00 -1.37 0.00 0.00 64.86 62.88 2nqo h ILE 494 Cb 1.30 0.52 -0.00 0.00 0.47 0.00 0.00 36.82 39.11 2nqo h ILE 494 CO 0.63 0.06 -0.03 -1.28 -3.07 0.00 0.00 178.15 174.46 2nqo h SER 495 N 0.33 0.26 -0.50 2.19 0.87 -1.91 -1.83 113.55 112.95 2nqo h SER 495 Ca 0.26 -0.37 -0.04 0.00 -1.23 0.00 0.00 61.79 60.41 2nqo h SER 495 Cb 0.58 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.45 2nqo h SER 495 CO -0.06 0.57 0.14 -0.33 -0.53 0.00 0.00 176.83 176.62 2nqo h GLU 496 N -0.05 0.79 -0.97 2.24 5.08 -1.76 -1.10 114.58 118.81 2nqo h GLU 496 Ca 0.03 -0.18 0.07 0.00 -1.00 0.00 0.00 59.36 58.29 2nqo h GLU 496 Cb 0.45 -0.11 -0.07 0.00 0.50 0.00 0.00 28.75 29.53 2nqo h GLU 496 CO 0.01 0.75 0.62 0.00 -1.00 0.00 0.00 179.01 179.39 2nqo h ALA 497 N 1.01 1.35 0.02 3.43 0.00 -0.89 -0.67 119.26 123.51 2nqo h ALA 497 Ca 0.16 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.83 2nqo h ALA 497 Cb 0.30 -0.28 0.02 0.00 0.00 0.00 0.00 17.79 17.83 2nqo h ALA 497 CO -0.00 0.39 -0.89 0.28 0.00 0.00 0.00 179.25 179.02 2nqo h VAL 498 N 1.11 1.34 -0.17 0.00 2.07 -1.10 -3.32 116.25 116.18 2nqo h VAL 498 Ca 0.42 -2.22 -0.09 0.00 0.82 0.00 0.00 66.70 65.64 2nqo h VAL 498 Cb 0.19 2.53 -0.01 0.00 -1.52 0.00 0.00 31.29 32.48 2nqo h VAL 498 CO -0.18 0.67 -0.27 0.28 0.02 0.00 0.00 177.57 178.08 2nqo h SER 499 N 0.16 0.33 -2.00 0.57 0.02 -0.91 -3.46 113.55 108.25 2nqo h SER 499 Ca -0.12 -0.11 -0.64 0.00 -0.84 0.00 0.00 61.79 60.09 2nqo h SER 499 Cb 1.57 -0.09 0.09 0.00 0.14 0.00 0.00 62.40 64.12 2nqo h SER 499 CO 0.17 0.60 0.13 0.00 -1.14 0.00 0.00 176.83 176.60 2nqo n ALA 500 N -2.48 -0.87 -1.67 3.77 0.00 -0.29 -4.90 120.51 114.07 2nqo n ALA 500 Ca -0.01 0.44 -0.38 0.00 0.00 0.00 0.00 53.44 53.49 2nqo n ALA 500 Cb 0.39 -1.98 0.05 0.00 0.00 0.00 0.00 19.45 17.92 2nqo n ALA 500 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2nqo n PRO 501 N 1.32 1.19 -4.35 0.00 -0.02 -1.26 -5.01 135.00 126.85 2nqo n PRO 501 Ca 0.14 0.45 -0.27 0.00 -2.02 0.00 0.00 63.50 61.79 2nqo n PRO 501 Cb 0.27 -2.32 -0.13 0.00 -0.02 0.00 0.00 33.50 31.30 2nqo n PRO 501 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2nqo s ARG 502 N -2.82 1.31 0.44 -0.52 0.52 -1.26 -5.07 118.95 111.55 2nqo s ARG 502 Ca 0.75 -1.30 0.05 0.00 -0.52 0.00 0.00 55.73 54.71 2nqo s ARG 502 Cb -0.42 -1.70 -0.06 0.00 0.52 0.00 0.00 34.95 33.28 2nqo s ARG 502 CO 0.47 0.40 0.01 -0.59 0.02 0.00 0.00 175.30 175.61 2nqo s PHE 503 N -1.17 2.27 -0.24 -0.53 -0.12 -1.26 -3.62 117.98 113.31 2nqo s PHE 503 Ca 0.12 -0.79 -0.23 0.00 -0.05 0.00 0.00 56.93 55.98 2nqo s PHE 503 Cb -0.10 -1.69 0.06 0.00 -0.63 0.00 0.00 43.02 40.66 2nqo s PHE 503 CO 0.06 0.35 0.66 -1.58 -0.05 0.00 0.00 175.22 174.65 2nqo s HIS 504 N -2.80 -0.72 -0.05 3.49 2.46 0.42 -4.83 115.29 113.26 2nqo s HIS 504 Ca 0.25 1.75 -0.02 0.00 0.47 0.00 0.00 55.06 57.51 2nqo s HIS 504 Cb 0.07 0.25 0.04 0.00 -0.13 0.00 0.00 32.58 32.80 2nqo s HIS 504 CO 0.13 -0.35 0.09 1.41 -2.47 0.00 0.00 174.74 173.55 2nqo s MET 505 N 0.31 -0.03 -0.18 2.88 0.00 -1.26 -0.96 119.30 120.06 2nqo s MET 505 Ca -0.00 0.40 0.14 0.00 0.00 0.00 0.00 55.69 56.22 2nqo s MET 505 Cb -0.04 -0.38 0.43 0.00 0.00 0.00 0.00 34.83 34.83 2nqo s MET 505 CO 0.01 -0.29 1.20 0.00 0.00 0.00 0.00 175.02 175.95 2nqo n GLN 506 N 5.06 1.55 0.00 4.11 10.64 -1.26 -5.02 117.38 132.45 2nqo n GLN 506 Ca -0.09 -3.18 0.00 0.00 -1.83 0.00 0.00 57.00 51.90 2nqo n GLN 506 Cb 0.50 -1.41 0.00 0.00 -0.86 0.00 0.00 30.24 28.48 2nqo n GLN 506 CO 0.00 0.00 0.00 1.87 -1.83 0.00 0.00 177.06 177.10 2nqo n TRP 507 N -0.76 0.00 -4.02 2.61 -0.00 -1.26 -4.58 117.44 109.43 2nqo n TRP 507 Ca 0.19 0.00 -0.28 0.00 -0.00 0.00 0.00 57.50 57.41 2nqo n TRP 507 Cb 0.81 0.00 -0.17 0.00 -0.00 0.00 0.00 31.31 31.95 2nqo n TRP 507 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 177.69 177.18 2nqo s LEU 508 N 0.00 1.40 0.78 5.87 1.43 -1.26 -2.67 118.68 124.23 2nqo s LEU 508 Ca 0.00 -0.37 -0.12 0.00 -1.03 0.00 0.00 54.13 52.62 2nqo s LEU 508 Cb 0.00 -0.96 0.07 0.00 0.03 0.00 0.00 46.19 45.32 2nqo s LEU 508 CO 0.00 -0.08 1.12 -2.16 0.23 0.00 0.00 176.35 175.46 2nqo s PRO 509 N 1.53 2.05 -1.40 1.29 0.04 -1.26 -4.72 135.00 132.52 2nqo s PRO 509 Ca 0.03 1.37 -0.13 0.00 0.04 0.00 0.00 61.00 62.30 2nqo s PRO 509 Cb -0.13 -1.86 0.07 0.00 0.04 0.00 0.00 34.50 32.62 2nqo s PRO 509 CO -0.08 -1.83 2.08 -3.47 0.04 0.00 0.00 177.00 173.75 2nqo n ASP 510 N -3.40 4.27 -4.09 6.66 -0.08 -1.09 -4.54 116.55 114.29 2nqo n ASP 510 Ca 0.10 -2.91 -0.08 0.00 -1.51 0.00 0.00 54.79 50.39 2nqo n ASP 510 Cb 0.52 -1.63 -0.10 0.00 2.34 0.00 0.00 41.12 42.25 2nqo n ASP 510 CO 0.00 0.00 0.00 -1.83 0.12 0.00 0.00 177.20 175.49 2nqo s GLU 511 N 2.70 0.60 -0.43 -0.67 -1.05 -1.26 -4.54 118.70 114.05 2nqo s GLU 511 Ca 0.46 -1.12 -0.07 0.00 -0.15 0.00 0.00 54.97 54.09 2nqo s GLU 511 Cb 0.12 0.09 0.10 0.00 -0.44 0.00 0.00 34.13 34.00 2nqo s GLU 511 CO -0.05 -0.07 0.27 -1.17 0.95 0.00 0.00 175.26 175.18 2nqo s LEU 512 N -2.64 5.32 0.00 1.83 2.96 -0.31 -4.53 118.68 121.31 2nqo s LEU 512 Ca 0.03 -1.77 -0.30 0.00 -0.22 0.00 0.00 54.13 51.88 2nqo s LEU 512 Cb 0.04 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.75 2nqo s LEU 512 CO -0.07 -0.58 0.97 -0.60 -1.32 0.00 0.00 176.35 174.75 2nqo s ARG 513 N 1.33 4.56 0.34 1.98 3.52 -0.13 -1.54 118.95 129.00 2nqo s ARG 513 Ca 0.05 1.41 0.03 0.00 -0.13 0.00 0.00 55.73 57.09 2nqo s ARG 513 Cb -0.24 -3.46 -0.05 0.00 -1.56 0.00 0.00 34.95 29.65 2nqo s ARG 513 CO -0.01 -0.03 0.10 0.96 -0.81 0.00 0.00 175.30 175.51 2nqo s ILE 514 N 0.96 0.80 0.21 4.11 -4.36 -0.10 -0.44 121.20 122.37 2nqo s ILE 514 Ca 0.51 -2.00 0.07 0.00 -0.26 0.00 0.00 60.65 58.97 2nqo s ILE 514 Cb -0.21 -2.59 -0.04 0.00 1.25 0.00 0.00 42.46 40.87 2nqo s ILE 514 CO 0.28 0.00 0.12 -1.61 0.24 0.00 0.00 174.94 173.96 2nqo s GLU 515 N -3.85 2.75 0.22 0.37 2.02 -1.24 -1.49 118.70 117.48 2nqo s GLU 515 Ca 0.32 -1.05 -0.32 0.00 0.02 0.00 0.00 54.97 53.95 2nqo s GLU 515 Cb 0.06 -2.50 -0.13 0.00 0.10 0.00 0.00 34.13 31.66 2nqo s GLU 515 CO 0.15 0.43 1.58 1.17 0.02 0.00 0.00 175.26 178.62 2nqo n LYS 516 N -0.68 2.42 -0.91 1.61 4.81 -1.26 -0.84 118.16 123.31 2nqo n LYS 516 Ca -0.08 0.87 0.00 0.00 -0.87 0.00 0.00 58.31 58.23 2nqo n LYS 516 Cb 0.56 -2.64 0.00 0.00 0.02 0.00 0.00 35.03 32.98 2nqo n LYS 516 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2nqo n PHE 517 N 2.93 0.00 0.37 5.64 3.72 -1.26 -4.86 117.46 124.00 2nqo n PHE 517 Ca 0.14 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.66 2nqo n PHE 517 Cb 0.33 -1.40 0.21 0.00 -0.94 0.00 0.00 39.48 37.68 2nqo n PHE 517 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2nqo h GLY 518 N 0.00 0.00 -6.76 1.37 0.00 -1.40 -3.45 103.07 92.83 2nqo h GLY 518 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.06 2nqo h GLY 518 CO 0.00 0.00 -0.61 -0.29 0.00 0.00 0.00 176.54 175.64 2nqo s MET 519 N -3.20 0.06 0.64 4.80 -2.45 -1.26 -4.84 119.30 113.05 2nqo s MET 519 Ca 0.07 0.57 -0.14 0.00 -1.25 0.00 0.00 55.69 54.93 2nqo s MET 519 Cb 0.09 -0.22 -0.01 0.00 1.25 0.00 0.00 34.83 35.93 2nqo s MET 519 CO 0.68 -0.28 1.07 -1.25 1.05 0.00 0.00 175.02 176.29 2nqo s PRO 520 N 2.15 3.05 0.26 4.11 0.04 -1.26 -4.80 135.00 138.55 2nqo s PRO 520 Ca 0.01 1.22 -0.08 0.00 0.04 0.00 0.00 61.00 62.19 2nqo s PRO 520 Cb -0.12 -1.99 0.45 0.00 0.04 0.00 0.00 34.50 32.87 2nqo s PRO 520 CO -0.06 -1.03 1.59 0.00 0.04 0.00 0.00 177.00 177.54 2nqo h ALA 521 N 0.06 0.70 -0.84 8.56 0.00 -2.01 -0.97 119.26 124.76 2nqo h ALA 521 Ca -0.46 0.32 0.11 0.00 0.00 0.00 0.00 54.91 54.88 2nqo h ALA 521 Cb 1.23 0.60 -0.08 0.00 0.00 0.00 0.00 17.79 19.54 2nqo h ALA 521 CO 0.56 -0.43 0.47 -0.44 0.00 0.00 0.00 179.25 179.41 2nqo h ASP 522 N 0.02 0.64 -0.06 0.00 5.19 -1.99 0.12 116.42 120.33 2nqo h ASP 522 Ca 0.44 0.06 -0.04 0.00 -0.62 0.00 0.00 57.03 56.88 2nqo h ASP 522 Cb 0.74 -0.05 -0.00 0.00 0.18 0.00 0.00 39.33 40.20 2nqo h ASP 522 CO -0.85 0.34 -0.11 0.58 -3.12 0.00 0.00 179.24 176.07 2nqo h VAL 523 N 0.75 1.41 -0.77 -1.35 2.07 -1.57 -2.72 116.25 114.06 2nqo h VAL 523 Ca 0.43 -1.39 0.02 0.00 0.82 0.00 0.00 66.70 66.58 2nqo h VAL 523 Cb 0.47 2.17 -0.04 0.00 -1.52 0.00 0.00 31.29 32.37 2nqo h VAL 523 CO -0.29 0.38 0.50 0.11 0.02 0.00 0.00 177.57 178.30 2nqo h LYS 524 N -0.29 0.97 -0.42 1.57 1.57 -1.00 -1.28 116.57 117.69 2nqo h LYS 524 Ca 0.00 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.74 2nqo h LYS 524 Cb 0.68 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.74 2nqo h LYS 524 CO 0.03 0.64 0.26 -0.44 -0.57 0.00 0.00 179.45 179.36 2nqo h ASP 525 N 1.00 0.42 -0.03 0.86 3.32 -0.80 0.13 116.42 121.33 2nqo h ASP 525 Ca 0.30 -0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.25 2nqo h ASP 525 Cb -0.05 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 2nqo h ASP 525 CO -0.09 0.31 -0.27 0.78 -1.72 0.00 0.00 179.24 178.25 2nqo h ASN 526 N 0.52 0.47 -0.10 6.45 2.35 -1.13 -1.43 115.58 122.71 2nqo h ASN 526 Ca 0.16 -0.16 -0.20 0.00 -0.55 0.00 0.00 56.30 55.55 2nqo h ASN 526 Cb -0.01 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.23 2nqo h ASN 526 CO -0.06 0.73 -0.66 -0.07 -1.65 0.00 0.00 177.43 175.71 2nqo h LEU 527 N 0.41 0.84 -1.09 1.61 3.38 -0.88 -2.58 115.31 117.00 2nqo h LEU 527 Ca 0.06 -0.50 -0.06 0.00 0.09 0.00 0.00 57.88 57.47 2nqo h LEU 527 Cb 0.68 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2nqo h LEU 527 CO 0.05 1.28 0.02 0.74 0.09 0.00 0.00 178.44 180.61 2nqo h THR 528 N 0.53 1.22 -0.02 0.22 2.02 -0.56 -1.77 112.91 114.54 2nqo h THR 528 Ca -0.02 -0.87 -0.08 0.00 0.77 0.00 0.00 66.41 66.21 2nqo h THR 528 Cb 1.26 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 68.55 2nqo h THR 528 CO 0.13 0.31 -0.38 0.50 0.37 0.00 0.00 175.52 176.45 2nqo h LYS 529 N 0.63 0.04 0.00 6.66 3.64 -1.13 -2.40 116.57 124.00 2nqo h LYS 529 Ca 0.13 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.42 2nqo h LYS 529 Cb 0.37 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 2nqo h LYS 529 CO 0.01 0.42 -0.34 0.52 -2.27 0.00 0.00 179.45 177.79 2nqo h MET 530 N 0.04 0.00 0.00 1.90 2.86 -0.93 -3.47 114.93 115.33 2nqo h MET 530 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2nqo h MET 530 Cb 0.68 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.34 2nqo h MET 530 CO 0.05 0.34 0.00 0.41 1.06 0.00 0.00 176.91 178.77 2nqo n GLY 531 N 0.09 0.30 3.78 8.32 0.00 -0.90 -5.11 105.19 111.66 2nqo n GLY 531 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2nqo n GLY 531 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2nqo s TYR 532 N -1.25 3.38 -0.60 1.61 2.02 -0.95 -5.01 117.35 116.55 2nqo s TYR 532 Ca 0.00 1.67 -0.09 0.00 -0.37 0.00 0.00 57.07 58.28 2nqo s TYR 532 Cb 0.00 -3.08 0.16 0.00 -0.40 0.00 0.00 41.96 38.63 2nqo s TYR 532 CO 0.00 -0.42 0.48 -1.14 -1.57 0.00 0.00 175.55 172.90 2nqo s GLN 533 N -2.37 2.80 0.06 -0.62 2.00 -1.26 -4.34 119.66 115.93 2nqo s GLN 533 Ca 0.56 -2.13 -0.30 0.00 -2.00 0.00 0.00 55.36 51.48 2nqo s GLN 533 Cb -0.21 -4.02 -0.05 0.00 0.80 0.00 0.00 33.01 29.53 2nqo s GLN 533 CO 0.27 -1.22 1.11 0.42 -0.50 0.00 0.00 175.29 175.37 2nqo s ILE 534 N 0.71 4.28 -0.03 -2.34 1.01 -1.26 -1.16 121.20 122.41 2nqo s ILE 534 Ca 0.11 1.69 0.01 0.00 0.00 0.00 0.00 60.65 62.46 2nqo s ILE 534 Cb -0.21 -4.08 0.02 0.00 0.01 0.00 0.00 42.46 38.20 2nqo s ILE 534 CO -0.03 0.16 -0.03 0.68 0.00 0.00 0.00 174.94 175.72 2nqo s VAL 535 N 0.80 0.39 -0.19 2.92 -7.23 -0.59 -4.93 120.40 111.58 2nqo s VAL 535 Ca 0.55 -0.06 -0.19 0.00 -1.81 0.00 0.00 61.98 60.47 2nqo s VAL 535 Cb -0.27 -0.43 -0.03 0.00 0.56 0.00 0.00 36.38 36.21 2nqo s VAL 535 CO 0.30 0.18 0.54 -0.89 -0.31 0.00 0.00 175.10 174.92 2nqo s THR 536 N 0.84 5.10 0.31 5.32 2.01 -1.26 -0.93 115.64 127.03 2nqo s THR 536 Ca -0.10 1.01 0.03 0.00 0.31 0.00 0.00 61.69 62.93 2nqo s THR 536 Cb -0.13 -3.86 -0.05 0.00 0.01 0.00 0.00 72.50 68.47 2nqo s THR 536 CO -0.00 0.18 0.11 -0.54 -0.69 0.00 0.00 174.62 173.68 2nqo s LYS 537 N 1.56 1.61 0.53 4.92 1.02 -0.55 -4.94 119.74 123.88 2nqo s LYS 537 Ca 0.25 -1.91 -0.19 0.00 0.02 0.00 0.00 55.97 54.14 2nqo s LYS 537 Cb -0.15 -0.42 -0.10 0.00 -0.52 0.00 0.00 37.83 36.63 2nqo s LYS 537 CO 0.10 -0.34 0.51 -2.30 -0.92 0.00 0.00 175.35 172.40 2nqo n PRO 538 N -0.62 0.52 -1.60 -1.68 -0.02 -1.26 -4.44 135.00 125.89 2nqo n PRO 538 Ca -0.01 0.20 -0.40 0.00 -2.02 0.00 0.00 63.50 61.27 2nqo n PRO 538 Cb 0.66 -1.64 0.02 0.00 -0.02 0.00 0.00 33.50 32.52 2nqo n PRO 538 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2nqo n VAL 539 N -1.49 2.69 -3.86 -1.45 0.24 -1.26 -4.93 118.33 108.27 2nqo n VAL 539 Ca 0.11 -0.50 -0.36 0.00 -2.04 0.00 0.00 64.34 61.55 2nqo n VAL 539 Cb 0.46 -1.12 -0.11 0.00 -1.47 0.00 0.00 33.84 31.59 2nqo n VAL 539 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 2nqo s MET 540 N -2.18 3.81 0.05 7.34 -1.94 -1.26 -5.04 119.30 120.08 2nqo s MET 540 Ca 0.66 -0.41 0.00 0.00 -1.71 0.00 0.00 55.69 54.23 2nqo s MET 540 Cb -0.52 -3.30 0.00 0.00 2.01 0.00 0.00 34.83 33.02 2nqo s MET 540 CO 0.55 0.00 0.00 0.41 -0.01 0.00 0.00 175.02 175.97 2nqo n GLY 541 N 4.36 -2.83 2.75 -0.03 0.00 -1.26 -4.93 105.19 103.25 2nqo n GLY 541 Ca -0.16 -1.70 -0.04 0.00 0.00 0.00 0.00 46.02 44.12 2nqo n GLY 541 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2nqo s ASP 542 N -1.61 -1.25 -0.03 1.61 2.15 -1.26 -4.58 116.67 111.71 2nqo s ASP 542 Ca 0.00 -1.48 -0.28 0.00 0.43 0.00 0.00 52.55 51.22 2nqo s ASP 542 Cb 0.00 1.63 -0.03 0.00 -0.30 0.00 0.00 42.92 44.22 2nqo s ASP 542 CO 0.00 -0.05 0.91 -0.69 -0.17 0.00 0.00 175.17 175.17 2nqo s VAL 543 N 0.91 4.91 -0.30 1.11 1.01 -1.26 -4.36 120.40 122.42 2nqo s VAL 543 Ca 0.29 1.89 0.03 0.00 0.00 0.00 0.00 61.98 64.19 2nqo s VAL 543 Cb 0.02 -4.24 0.08 0.00 0.00 0.00 0.00 36.38 32.24 2nqo s VAL 543 CO -0.06 0.17 -0.03 0.20 0.00 0.00 0.00 175.10 175.38 2nqo s ASN 544 N 0.97 4.62 0.23 3.32 0.01 -1.24 -1.83 114.94 121.01 2nqo s ASN 544 Ca 0.48 -1.76 0.08 0.00 -0.71 0.00 0.00 52.86 50.94 2nqo s ASN 544 Cb -0.20 -1.59 -0.05 0.00 0.41 0.00 0.00 41.25 39.82 2nqo s ASN 544 CO 0.24 -0.29 -0.13 0.00 -1.51 0.00 0.00 177.10 175.41 2nqo s ALA 545 N 1.01 2.16 -0.00 0.60 0.00 -0.71 -4.24 121.76 120.57 2nqo s ALA 545 Ca 0.01 -1.73 0.03 0.00 0.00 0.00 0.00 51.96 50.27 2nqo s ALA 545 Cb -0.20 -0.05 -0.01 0.00 0.00 0.00 0.00 23.12 22.86 2nqo s ALA 545 CO -0.06 0.06 -0.09 0.42 0.00 0.00 0.00 175.76 176.09 2nqo s ILE 546 N -2.93 0.74 -0.11 0.00 1.01 -0.56 -1.18 121.20 118.17 2nqo s ILE 546 Ca 0.25 -0.48 0.02 0.00 0.00 0.00 0.00 60.65 60.44 2nqo s ILE 546 Cb -0.00 -0.63 0.01 0.00 0.01 0.00 0.00 42.46 41.85 2nqo s ILE 546 CO 0.09 0.15 -0.15 -1.58 0.00 0.00 0.00 174.94 173.44 2nqo s GLN 547 N -0.37 2.21 -0.15 2.79 0.74 0.28 -1.33 119.66 123.84 2nqo s GLN 547 Ca 0.03 -0.56 -0.04 0.00 0.05 0.00 0.00 55.36 54.84 2nqo s GLN 547 Cb -0.04 -1.87 -0.03 0.00 1.10 0.00 0.00 33.01 32.17 2nqo s GLN 547 CO -0.00 -0.05 -0.02 0.08 -0.55 0.00 0.00 175.29 174.75 2nqo s VAL 548 N 0.94 4.03 -0.06 1.34 1.01 -0.45 -0.38 120.40 126.83 2nqo s VAL 548 Ca -0.08 -0.31 0.04 0.00 0.00 0.00 0.00 61.98 61.63 2nqo s VAL 548 Cb -0.15 -2.76 0.00 0.00 0.00 0.00 0.00 36.38 33.47 2nqo s VAL 548 CO -0.01 0.50 -0.17 -0.76 0.00 0.00 0.00 175.10 174.66 2nqo s LEU 549 N 0.20 1.87 0.07 3.92 1.43 -0.46 -4.45 118.68 121.25 2nqo s LEU 549 Ca -0.01 -0.39 -0.31 0.00 -1.03 0.00 0.00 54.13 52.40 2nqo s LEU 549 Cb -0.14 -1.03 -0.08 0.00 0.03 0.00 0.00 46.19 44.97 2nqo s LEU 549 CO 0.02 0.12 1.61 -2.16 0.23 0.00 0.00 176.35 176.17 2nqo s PRO 550 N 0.32 4.21 0.26 1.29 0.04 -1.26 -0.72 135.00 139.14 2nqo s PRO 550 Ca -0.11 2.29 0.06 0.00 0.04 0.00 0.00 61.00 63.28 2nqo s PRO 550 Cb -0.15 -3.54 -0.03 0.00 0.04 0.00 0.00 34.50 30.83 2nqo s PRO 550 CO 0.04 -0.69 0.33 0.15 0.04 0.00 0.00 177.00 176.87 2nqo s LYS 551 N 2.40 3.23 0.26 4.56 1.02 0.29 -4.88 119.74 126.62 2nqo s LYS 551 Ca 0.72 -0.89 -0.03 0.00 0.02 0.00 0.00 55.97 55.79 2nqo s LYS 551 Cb -0.39 -2.78 0.52 0.00 -0.52 0.00 0.00 37.83 34.66 2nqo s LYS 551 CO 0.31 0.36 1.70 1.15 -0.92 0.00 0.00 175.35 177.95 2nqo h THR 552 N 1.22 0.55 0.00 2.17 2.02 -2.00 -3.10 112.91 113.76 2nqo h THR 552 Ca -0.50 -0.12 -0.35 0.00 0.77 0.00 0.00 66.41 66.21 2nqo h THR 552 Cb 1.24 0.16 -0.07 0.00 -1.74 0.00 0.00 68.15 67.74 2nqo h THR 552 CO 0.60 0.06 -2.33 0.29 0.37 0.00 0.00 175.52 174.51 2nqo n LYS 553 N -5.09 0.80 0.00 6.66 4.01 -1.26 -5.07 118.16 118.21 2nqo n LYS 553 Ca 0.16 0.04 0.00 0.00 -0.51 0.00 0.00 58.31 58.00 2nqo n LYS 553 Cb 0.49 -1.49 0.00 0.00 -0.51 0.00 0.00 35.03 33.52 2nqo n LYS 553 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2nqo n GLY 554 N 2.01 4.56 3.07 0.72 0.00 -1.17 -5.18 105.19 109.20 2nqo n GLY 554 Ca -0.35 -0.53 -0.12 0.00 0.00 0.00 0.00 46.02 45.02 2nqo n GLY 554 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2nqo s SER 555 N 1.26 0.82 -0.09 1.61 0.01 -1.26 0.11 113.70 116.16 2nqo s SER 555 Ca 0.00 -0.63 0.02 0.00 1.31 0.00 0.00 55.95 56.65 2nqo s SER 555 Cb 0.00 0.06 -0.02 0.00 0.21 0.00 0.00 66.02 66.27 2nqo s SER 555 CO 0.00 -0.27 -0.14 0.54 0.41 0.00 0.00 173.24 173.78 2nqo s VAL 556 N -1.82 3.04 -0.22 3.43 0.11 0.10 -4.83 120.40 120.22 2nqo s VAL 556 Ca -0.07 -0.70 -0.06 0.00 -2.93 0.00 0.00 61.98 58.23 2nqo s VAL 556 Cb -0.07 -2.23 -0.02 0.00 -1.53 0.00 0.00 36.38 32.53 2nqo s VAL 556 CO -0.01 0.56 0.01 -0.36 -3.33 0.00 0.00 175.10 171.97 2nqo s PHE 557 N -0.22 3.04 -0.11 1.54 0.08 -1.26 -1.36 117.98 119.69 2nqo s PHE 557 Ca 0.01 -0.53 0.01 0.00 0.12 0.00 0.00 56.93 56.54 2nqo s PHE 557 Cb -0.13 -2.13 -0.01 0.00 -0.57 0.00 0.00 43.02 40.17 2nqo s PHE 557 CO 0.03 -0.33 -0.16 0.71 -0.10 0.00 0.00 175.22 175.37 2nqo s TYR 558 N 1.27 2.73 0.28 0.36 2.02 0.49 -4.97 117.35 119.53 2nqo s TYR 558 Ca 0.04 -0.63 0.04 0.00 -0.37 0.00 0.00 57.07 56.15 2nqo s TYR 558 Cb -0.15 -1.77 -0.06 0.00 -0.40 0.00 0.00 41.96 39.58 2nqo s TYR 558 CO 0.01 -0.18 0.01 0.20 -1.57 0.00 0.00 175.55 174.02 2nqo s GLY 559 N 0.14 1.82 -0.25 0.71 0.00 -1.26 0.99 107.32 109.46 2nqo s GLY 559 Ca -0.08 -1.91 -0.18 0.00 0.00 0.00 0.00 44.72 42.55 2nqo s GLY 559 CO 0.05 -1.76 0.64 -0.45 0.00 0.00 0.00 173.10 171.57 2nqo s SER 560 N -3.41 -0.78 0.24 1.64 0.15 -0.33 -4.75 113.70 106.46 2nqo s SER 560 Ca 0.32 1.35 0.06 0.00 0.70 0.00 0.00 55.95 58.38 2nqo s SER 560 Cb 0.06 1.28 -0.03 0.00 -1.71 0.00 0.00 66.02 65.62 2nqo s SER 560 CO 0.12 -0.23 0.28 0.42 1.20 0.00 0.00 173.24 175.03 2nqo s THR 561 N 1.10 4.87 -0.08 6.45 -4.23 -1.26 -1.74 115.64 120.74 2nqo s THR 561 Ca -0.06 -1.17 -0.24 0.00 -1.18 0.00 0.00 61.69 59.03 2nqo s THR 561 Cb -0.05 -3.63 -0.03 0.00 1.34 0.00 0.00 72.50 70.12 2nqo s THR 561 CO -0.11 -0.33 0.74 -0.62 -0.54 0.00 0.00 174.62 173.77 2nqo s ASP 562 N -3.87 7.00 0.00 3.99 -1.08 -0.76 -4.92 116.67 117.03 2nqo s ASP 562 Ca 0.33 1.21 0.15 0.00 -0.52 0.00 0.00 52.55 53.72 2nqo s ASP 562 Cb -0.09 -2.43 0.87 0.00 -1.46 0.00 0.00 42.92 39.82 2nqo s ASP 562 CO 0.27 -0.18 1.30 -0.81 0.52 0.00 0.00 175.17 176.26 2nqo n PRO 563 N 4.10 0.55 0.02 4.34 -0.04 -1.26 -2.48 135.00 140.23 2nqo n PRO 563 Ca 0.00 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.39 2nqo n PRO 563 Cb 0.51 -1.42 -0.13 0.00 -0.04 0.00 0.00 33.50 32.42 2nqo n PRO 563 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2nqo h ARG 564 N 0.00 0.00 0.00 0.54 3.08 -1.91 -3.54 114.38 112.55 2nqo h ARG 564 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2nqo h ARG 564 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2nqo h ARG 564 CO 0.00 0.75 0.00 1.17 -1.07 0.00 0.00 179.97 180.82