#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bzq s GLU 402 N 0.00 4.61 0.59 1.97 2.12 -1.26 -5.05 118.70 121.69 1bzq s GLU 402 Ca 0.00 1.32 -0.08 0.00 0.36 0.00 0.00 54.97 56.57 1bzq s GLU 402 Cb 0.00 -3.39 -0.01 0.00 0.26 0.00 0.00 34.13 30.99 1bzq s GLU 402 CO 0.00 0.18 0.94 0.95 -0.54 0.00 0.00 175.26 176.79 1bzq s THR 403 N 0.18 4.12 0.15 -1.70 -4.23 -1.26 -4.88 115.64 108.02 1bzq s THR 403 Ca 0.45 0.31 -0.21 0.00 -1.18 0.00 0.00 61.69 61.06 1bzq s THR 403 Cb -0.22 -3.63 0.02 0.00 1.34 0.00 0.00 72.50 70.01 1bzq s THR 403 CO 0.27 -0.72 1.66 0.00 -0.54 0.00 0.00 174.62 175.30 1bzq h ALA 404 N -0.20 0.02 -0.14 3.99 0.00 -1.96 0.18 119.26 121.14 1bzq h ALA 404 Ca -0.45 0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.59 1bzq h ALA 404 Cb 1.23 0.34 -0.06 0.00 0.00 0.00 0.00 17.79 19.30 1bzq h ALA 404 CO 0.62 -0.57 -0.29 0.00 0.00 0.00 0.00 179.25 179.01 1bzq h ALA 405 N 1.02 -0.31 -0.53 0.00 0.00 -1.88 -1.28 119.26 116.29 1bzq h ALA 405 Ca 0.13 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.13 1bzq h ALA 405 Cb 0.34 0.56 -0.05 0.00 0.00 0.00 0.00 17.79 18.63 1bzq h ALA 405 CO -0.32 -0.76 0.24 0.00 0.00 0.00 0.00 179.25 178.41 1bzq h ALA 406 N 0.52 0.67 -0.77 0.00 0.00 -1.66 -1.12 119.26 116.90 1bzq h ALA 406 Ca 0.10 0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.11 1bzq h ALA 406 Cb 0.51 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 1bzq h ALA 406 CO -0.34 -0.13 0.46 -0.22 0.00 0.00 0.00 179.25 179.02 1bzq h LYS 407 N 0.46 0.82 -0.01 0.00 3.64 -0.11 0.24 116.57 121.62 1bzq h LYS 407 Ca 0.24 -0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.60 1bzq h LYS 407 Cb 0.20 -0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 31.79 1bzq h LYS 407 CO -0.20 0.54 -0.21 0.35 -2.27 0.00 0.00 179.45 177.66 1bzq h PHE 408 N 0.84 -0.56 0.17 1.91 3.57 -0.08 -0.02 116.94 122.77 1bzq h PHE 408 Ca 0.34 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.87 1bzq h PHE 408 Cb 0.17 0.25 -0.04 0.00 2.79 0.00 0.00 35.95 39.12 1bzq h PHE 408 CO -0.05 -0.30 -0.51 0.93 -2.23 0.00 0.00 178.31 176.15 1bzq h GLU 409 N -0.33 -0.75 -0.19 1.11 5.08 -0.56 -0.24 114.58 118.70 1bzq h GLU 409 Ca 0.06 0.05 0.05 0.00 -1.00 0.00 0.00 59.36 58.52 1bzq h GLU 409 Cb 0.42 0.17 -0.06 0.00 0.50 0.00 0.00 28.75 29.78 1bzq h GLU 409 CO -0.20 -0.50 -0.17 -0.09 -1.00 0.00 0.00 179.01 177.05 1bzq h ARG 410 N -0.78 -0.18 -0.07 2.33 2.43 -0.75 0.44 114.38 117.80 1bzq h ARG 410 Ca -0.01 0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.06 1bzq h ARG 410 Cb 0.77 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.35 1bzq h ARG 410 CO -0.25 -0.12 -0.48 1.96 -1.51 0.00 0.00 179.97 179.57 1bzq h GLN 411 N -0.19 0.17 0.00 0.20 4.20 -0.88 -3.40 115.11 115.22 1bzq h GLN 411 Ca 0.12 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1bzq h GLN 411 Cb 0.36 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1bzq h GLN 411 CO -0.30 0.62 0.00 0.72 -0.67 0.00 0.00 178.83 179.20 1bzq n HIS 412 N -3.97 0.00 -3.54 2.96 8.25 -0.11 -4.69 115.22 114.12 1bzq n HIS 412 Ca -0.02 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.05 1bzq n HIS 412 Cb 0.52 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.52 1bzq n HIS 412 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1bzq s MET 413 N -0.27 3.82 -0.47 -0.41 -1.94 0.15 0.73 119.30 120.92 1bzq s MET 413 Ca 0.00 -0.36 0.06 0.00 -1.71 0.00 0.00 55.69 53.68 1bzq s MET 413 Cb 0.00 -3.70 0.21 0.00 2.01 0.00 0.00 34.83 33.35 1bzq s MET 413 CO 0.00 -0.28 0.48 -3.47 -0.01 0.00 0.00 175.02 171.74 1bzq n ASP 414 N 5.12 0.71 0.23 3.03 -0.08 -0.54 -4.82 116.55 120.21 1bzq n ASP 414 Ca -0.13 -2.73 0.06 0.00 -1.51 0.00 0.00 54.79 50.49 1bzq n ASP 414 Cb 0.51 -0.62 0.53 0.00 2.34 0.00 0.00 41.12 43.87 1bzq n ASP 414 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1bzq h SER 415 N 4.77 0.00 0.00 1.67 0.02 -1.71 -3.29 113.55 115.01 1bzq h SER 415 Ca 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1bzq h SER 415 Cb 0.85 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.39 1bzq h SER 415 CO 0.50 0.20 0.00 -1.54 -1.14 0.00 0.00 176.83 174.86 1bzq n SER 416 N -4.13 1.00 -3.52 3.07 3.41 -1.26 -4.70 113.62 107.50 1bzq n SER 416 Ca -0.02 -0.93 -0.10 0.00 -0.26 0.00 0.00 58.87 57.56 1bzq n SER 416 Cb 0.27 -0.23 -0.03 0.00 -0.26 0.00 0.00 64.21 63.96 1bzq n SER 416 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1bzq s THR 417 N -0.11 0.00 -0.81 6.66 -1.32 -1.24 -5.04 115.64 113.79 1bzq s THR 417 Ca 0.00 0.00 0.21 0.00 -1.21 0.00 0.00 61.69 60.69 1bzq s THR 417 Cb 0.00 -1.00 -0.24 0.00 -1.51 0.00 0.00 72.50 69.75 1bzq s THR 417 CO 0.00 0.00 0.80 -1.54 -2.21 0.00 0.00 174.62 171.67 1bzq n SER 418 N 0.08 0.83 -3.64 8.08 3.41 -1.26 -4.66 113.62 116.45 1bzq n SER 418 Ca -0.10 -0.81 -0.03 0.00 -0.26 0.00 0.00 58.87 57.67 1bzq n SER 418 Cb 0.61 1.17 -0.05 0.00 -0.26 0.00 0.00 64.21 65.68 1bzq n SER 418 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bzq s ALA 419 N -3.04 -2.12 -0.37 7.33 0.00 -1.26 -4.88 121.76 117.42 1bzq s ALA 419 Ca 0.05 1.85 -0.38 0.00 0.00 0.00 0.00 51.96 53.48 1bzq s ALA 419 Cb 0.15 -1.50 -0.14 0.00 0.00 0.00 0.00 23.12 21.63 1bzq s ALA 419 CO 0.85 -0.23 2.09 0.00 0.00 0.00 0.00 175.76 178.48 1bzq n ALA 420 N 0.67 0.65 -1.00 0.00 0.00 -1.26 -4.86 120.51 114.70 1bzq n ALA 420 Ca -0.02 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1bzq n ALA 420 Cb 0.59 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.66 1bzq n ALA 420 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1bzq n SER 421 N 8.47 0.00 -3.10 0.00 7.64 -1.26 -4.85 113.62 120.52 1bzq n SER 421 Ca 0.42 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.67 1bzq n SER 421 Cb 0.15 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 1bzq n SER 421 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1bzq n SER 422 N -0.48 0.00 -0.53 6.43 3.41 -1.26 -4.98 113.62 116.21 1bzq n SER 422 Ca 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.67 1bzq n SER 422 Cb 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.02 1bzq n SER 422 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1bzq n SER 423 N 0.00 2.16 -1.16 4.04 2.88 -1.26 -4.25 113.62 116.03 1bzq n SER 423 Ca 0.00 -1.58 -0.05 0.00 -1.33 0.00 0.00 58.87 55.92 1bzq n SER 423 Cb 0.00 -0.03 0.19 0.00 -0.75 0.00 0.00 64.21 63.62 1bzq n SER 423 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1bzq n ASN 424 N 0.71 2.54 -0.03 -3.46 5.15 -1.26 -4.40 115.26 114.51 1bzq n ASN 424 Ca 0.08 -3.82 -0.15 0.00 -0.60 0.00 0.00 54.58 50.10 1bzq n ASN 424 Cb 0.33 -0.62 -0.10 0.00 -0.53 0.00 0.00 39.78 38.86 1bzq n ASN 424 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1bzq h TYR 425 N 1.07 0.38 -0.58 1.20 3.20 -1.95 -2.91 116.97 117.37 1bzq h TYR 425 Ca 0.21 -0.17 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 1bzq h TYR 425 Cb 1.55 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 39.74 1bzq h TYR 425 CO 1.02 0.91 0.29 0.00 -1.64 0.00 0.00 178.16 178.73 1bzq h ASN 427 N 0.78 -0.21 0.02 0.00 2.35 -1.81 0.73 115.58 117.45 1bzq h ASN 427 Ca 0.20 0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 56.01 1bzq h ASN 427 Cb 0.10 0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.59 1bzq h ASN 427 CO -0.03 -0.08 -0.01 1.56 -1.65 0.00 0.00 177.43 177.22 1bzq h GLN 428 N -0.03 -0.03 0.05 0.81 4.20 -1.29 -3.02 115.11 115.80 1bzq h GLN 428 Ca 0.09 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 1bzq h GLN 428 Cb 0.16 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1bzq h GLN 428 CO -0.19 0.32 -0.02 1.98 -0.67 0.00 0.00 178.83 180.25 1bzq h MET 429 N -0.39 -0.06 -0.58 1.46 4.05 -0.46 0.16 114.93 119.11 1bzq h MET 429 Ca -0.00 0.00 0.11 0.00 -0.28 0.00 0.00 59.70 59.53 1bzq h MET 429 Cb 0.37 0.01 -0.09 0.00 -0.80 0.00 0.00 31.60 31.09 1bzq h MET 429 CO 0.01 0.24 0.10 0.52 0.23 0.00 0.00 176.91 178.00 1bzq h MET 430 N -0.37 0.22 -0.41 0.39 2.86 0.37 -0.99 114.93 117.00 1bzq h MET 430 Ca -0.01 -0.01 -0.15 0.00 -2.06 0.00 0.00 59.70 57.47 1bzq h MET 430 Cb 0.34 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 1bzq h MET 430 CO 0.01 0.14 -0.34 -0.22 1.06 0.00 0.00 176.91 177.56 1bzq h LYS 431 N 0.22 0.96 0.00 1.72 1.63 -1.52 -1.81 116.57 117.77 1bzq h LYS 431 Ca 0.30 -0.48 0.00 0.00 -0.85 0.00 0.00 60.65 59.62 1bzq h LYS 431 Cb 0.45 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.09 1bzq h LYS 431 CO -0.41 1.14 0.00 -1.13 -3.45 0.00 0.00 179.45 175.60 1bzq n SER 432 N -4.08 0.00 -0.91 4.20 3.41 0.04 -2.86 113.62 113.42 1bzq n SER 432 Ca -0.02 0.47 0.07 0.00 -0.26 0.00 0.00 58.87 59.14 1bzq n SER 432 Cb 0.52 -0.49 0.23 0.00 -0.26 0.00 0.00 64.21 64.21 1bzq n SER 432 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1bzq n ARG 433 N -1.49 3.02 -3.12 4.33 1.74 -0.49 -4.97 116.66 115.68 1bzq n ARG 433 Ca 0.06 -2.42 -0.18 0.00 -0.77 0.00 0.00 57.85 54.55 1bzq n ARG 433 Cb 0.29 -1.53 0.05 0.00 -1.02 0.00 0.00 32.46 30.25 1bzq n ARG 433 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1bzq n ASN 434 N 0.48 -5.25 -1.28 0.55 3.02 -1.14 -4.83 115.26 106.82 1bzq n ASN 434 Ca 0.17 -0.33 0.11 0.00 -0.03 0.00 0.00 54.58 54.51 1bzq n ASN 434 Cb 0.62 -3.97 0.30 0.00 -0.61 0.00 0.00 39.78 36.13 1bzq n ASN 434 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1bzq n LEU 435 N -3.61 3.72 -0.02 3.41 4.77 -0.68 -3.78 117.00 120.82 1bzq n LEU 435 Ca -0.04 -1.83 0.00 0.00 -0.03 0.00 0.00 56.01 54.12 1bzq n LEU 435 Cb 0.57 -0.44 0.01 0.00 -2.33 0.00 0.00 43.42 41.22 1bzq n LEU 435 CO 0.44 0.91 0.40 0.35 -1.33 0.00 0.00 177.39 178.16 1bzq n THR 436 N 1.55 0.62 0.09 -5.08 -2.24 -1.24 -2.32 114.28 105.66 1bzq n THR 436 Ca 0.23 -0.63 -0.04 0.00 -2.27 0.00 0.00 64.05 61.34 1bzq n THR 436 Cb 0.59 0.66 -0.02 0.00 -2.10 0.00 0.00 70.33 69.47 1bzq n THR 436 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1bzq h LYS 437 N 0.00 -0.23 0.00 -0.78 3.64 -1.91 -3.33 116.57 113.96 1bzq h LYS 437 Ca 0.00 0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1bzq h LYS 437 Cb 0.75 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1bzq h LYS 437 CO 0.00 -0.16 -0.58 -0.44 -2.27 0.00 0.00 179.45 176.00 1bzq h ASP 438 N -0.25 0.00 -5.55 4.20 3.32 -1.91 -3.48 116.42 112.74 1bzq h ASP 438 Ca -0.02 0.00 0.28 0.00 0.02 0.00 0.00 57.03 57.30 1bzq h ASP 438 Cb 0.19 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.62 1bzq h ASP 438 CO 0.04 0.08 0.73 0.00 -1.72 0.00 0.00 179.24 178.37 1bzq s ARG 439 N -3.24 0.61 -0.57 3.56 1.04 -1.25 -5.09 118.95 114.02 1bzq s ARG 439 Ca 0.03 -0.33 -0.28 0.00 -1.04 0.00 0.00 55.73 54.10 1bzq s ARG 439 Cb 0.07 0.21 0.02 0.00 -2.04 0.00 0.00 34.95 33.22 1bzq s ARG 439 CO 0.74 -0.28 1.30 0.00 -0.04 0.00 0.00 175.30 177.01 1bzq s LYS 441 N 5.20 4.16 0.14 0.00 2.20 -0.98 -4.90 119.74 125.56 1bzq s LYS 441 Ca 0.47 2.48 -0.23 0.00 -0.36 0.00 0.00 55.97 58.33 1bzq s LYS 441 Cb -0.09 -3.88 0.01 0.00 -1.51 0.00 0.00 37.83 32.36 1bzq s LYS 441 CO 0.25 -0.86 1.63 -1.35 -0.36 0.00 0.00 175.35 174.66 1bzq h PRO 442 N 9.47 -0.27 -4.26 4.03 0.11 -1.93 -3.44 132.00 135.70 1bzq h PRO 442 Ca -0.45 0.02 -0.27 0.00 0.11 0.00 0.00 66.00 65.41 1bzq h PRO 442 Cb 1.21 0.06 -0.24 0.00 0.11 0.00 0.00 31.00 32.14 1bzq h PRO 442 CO 0.94 -0.18 -0.73 0.14 -0.21 0.00 0.00 178.00 177.96 1bzq s VAL 443 N -6.07 0.35 0.02 3.15 -7.23 -1.26 -1.64 120.40 107.72 1bzq s VAL 443 Ca -0.15 -0.62 -0.13 0.00 -1.81 0.00 0.00 61.98 59.27 1bzq s VAL 443 Cb 0.11 -0.38 0.02 0.00 0.56 0.00 0.00 36.38 36.69 1bzq s VAL 443 CO 0.67 -0.19 0.28 0.21 -0.31 0.00 0.00 175.10 175.77 1bzq s ASN 444 N -0.86 -0.11 -0.06 4.85 2.47 -0.56 -5.00 114.94 115.66 1bzq s ASN 444 Ca -0.06 -0.13 0.02 0.00 0.42 0.00 0.00 52.86 53.11 1bzq s ASN 444 Cb -0.06 0.33 0.01 0.00 -1.45 0.00 0.00 41.25 40.08 1bzq s ASN 444 CO -0.00 -0.54 -0.11 -0.89 -3.72 0.00 0.00 177.10 171.84 1bzq s THR 445 N -2.12 1.01 0.00 -5.21 2.01 -1.26 -0.11 115.64 109.97 1bzq s THR 445 Ca -0.08 -0.41 -0.01 0.00 0.31 0.00 0.00 61.69 61.50 1bzq s THR 445 Cb -0.03 -0.94 -0.04 0.00 0.01 0.00 0.00 72.50 71.51 1bzq s THR 445 CO -0.01 0.33 0.13 -0.36 -0.69 0.00 0.00 174.62 174.02 1bzq s PHE 446 N 0.69 3.41 -0.17 4.92 0.40 -0.92 -4.36 117.98 121.96 1bzq s PHE 446 Ca -0.14 0.27 -0.03 0.00 -0.60 0.00 0.00 56.93 56.43 1bzq s PHE 446 Cb -0.15 -1.77 -0.02 0.00 0.51 0.00 0.00 43.02 41.58 1bzq s PHE 446 CO 0.03 0.60 -0.04 0.08 0.70 0.00 0.00 175.22 176.58 1bzq s VAL 447 N -1.28 3.75 -0.82 -0.44 1.01 0.22 -1.65 120.40 121.19 1bzq s VAL 447 Ca 0.26 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 61.82 1bzq s VAL 447 Cb -0.12 -2.65 0.35 0.00 0.00 0.00 0.00 36.38 33.96 1bzq s VAL 447 CO 0.17 0.48 1.93 1.41 0.00 0.00 0.00 175.10 179.10 1bzq n HIS 448 N 3.76 3.01 -4.53 5.22 8.25 0.32 -1.46 115.22 129.80 1bzq n HIS 448 Ca -0.17 -2.41 -0.25 0.00 -0.26 0.00 0.00 57.72 54.62 1bzq n HIS 448 Cb 0.52 -1.09 -0.10 0.00 1.12 0.00 0.00 29.99 30.45 1bzq n HIS 448 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1bzq s GLU 449 N -4.04 1.83 0.70 -0.41 0.41 -1.26 -4.62 118.70 111.31 1bzq s GLU 449 Ca 0.51 -2.07 -0.11 0.00 -0.41 0.00 0.00 54.97 52.90 1bzq s GLU 449 Cb 0.42 -1.01 0.01 0.00 -1.78 0.00 0.00 34.13 31.78 1bzq s GLU 449 CO -0.38 -0.25 1.06 -1.54 -0.49 0.00 0.00 175.26 173.66 1bzq s SER 450 N -3.60 5.26 0.09 -0.19 1.04 -1.26 -4.06 113.70 110.98 1bzq s SER 450 Ca 0.30 1.65 -0.31 0.00 0.48 0.00 0.00 55.95 58.07 1bzq s SER 450 Cb 0.07 -2.50 -0.14 0.00 0.10 0.00 0.00 66.02 63.54 1bzq s SER 450 CO 0.14 -1.53 1.63 0.25 0.98 0.00 0.00 173.24 174.71 1bzq h LEU 451 N -0.75 -0.82 -0.85 2.42 5.85 -1.98 -2.74 115.31 116.44 1bzq h LEU 451 Ca -0.44 0.06 0.21 0.00 0.84 0.00 0.00 57.88 58.56 1bzq h LEU 451 Cb 1.21 0.26 -0.13 0.00 0.37 0.00 0.00 40.66 42.38 1bzq h LEU 451 CO 0.56 -0.47 0.26 0.00 -0.34 0.00 0.00 178.44 178.46 1bzq h ALA 452 N -0.21 1.24 -0.02 1.25 0.00 -1.98 0.16 119.26 119.69 1bzq h ALA 452 Ca -0.04 0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 1bzq h ALA 452 Cb 0.61 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1bzq h ALA 452 CO -0.01 -0.40 -0.41 -0.44 0.00 0.00 0.00 179.25 177.99 1bzq h ASP 453 N 0.28 0.05 0.75 0.00 5.19 -1.88 -2.02 116.42 118.78 1bzq h ASP 453 Ca 0.52 -0.02 -0.25 0.00 -0.62 0.00 0.00 57.03 56.66 1bzq h ASP 453 Cb 0.99 -0.01 -0.01 0.00 0.18 0.00 0.00 39.33 40.48 1bzq h ASP 453 CO -0.58 0.46 -1.18 0.58 -3.12 0.00 0.00 179.24 175.40 1bzq h VAL 454 N 0.04 1.55 0.00 -1.35 2.07 -0.52 -3.16 116.25 114.89 1bzq h VAL 454 Ca 0.00 -3.17 -0.05 0.00 0.82 0.00 0.00 66.70 64.30 1bzq h VAL 454 Cb 0.75 2.90 -0.01 0.00 -1.52 0.00 0.00 31.29 33.41 1bzq h VAL 454 CO 0.06 0.92 -0.24 1.56 0.02 0.00 0.00 177.57 179.88 1bzq h GLN 455 N 0.05 0.00 0.00 1.57 4.20 -0.76 -2.21 115.11 117.96 1bzq h GLN 455 Ca -0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.61 1bzq h GLN 455 Cb 1.91 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.69 1bzq h GLN 455 CO 0.18 0.24 0.00 0.00 -0.67 0.00 0.00 178.83 178.57 1bzq h ALA 456 N 1.76 1.00 0.00 3.87 0.00 -1.33 -3.03 119.26 121.53 1bzq h ALA 456 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1bzq h ALA 456 Cb 0.65 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1bzq h ALA 456 CO 0.03 0.00 -0.04 0.28 0.00 0.00 0.00 179.25 179.52 1bzq h VAL 457 N 0.00 0.53 0.00 0.00 2.07 -1.43 -0.95 116.25 116.47 1bzq h VAL 457 Ca 0.00 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.35 1bzq h VAL 457 Cb 0.66 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.54 1bzq h VAL 457 CO 0.00 0.04 0.00 0.00 0.02 0.00 0.00 177.57 177.63 1bzq n SER 459 N -2.02 3.29 0.00 0.00 7.64 -0.36 -4.98 113.62 117.20 1bzq n SER 459 Ca 0.00 -1.99 0.00 0.00 1.01 0.00 0.00 58.87 57.89 1bzq n SER 459 Cb 0.09 -0.32 0.00 0.00 -1.01 0.00 0.00 64.21 62.97 1bzq n SER 459 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bzq n GLN 460 N 0.95 2.58 -2.35 1.43 6.02 -0.46 -5.01 117.38 120.56 1bzq n GLN 460 Ca 0.16 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.73 1bzq n GLN 460 Cb 0.50 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.74 1bzq n GLN 460 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1bzq s LYS 461 N 4.86 4.08 -0.16 -1.09 2.20 -0.92 -4.83 119.74 123.88 1bzq s LYS 461 Ca 0.00 1.59 -0.29 0.00 -0.36 0.00 0.00 55.97 56.90 1bzq s LYS 461 Cb 0.00 -3.85 -0.01 0.00 -1.51 0.00 0.00 37.83 32.46 1bzq s LYS 461 CO 0.00 -0.92 1.19 1.21 -0.36 0.00 0.00 175.35 176.47 1bzq s ASN 462 N 2.62 7.01 0.15 1.43 3.04 -1.26 0.66 114.94 128.60 1bzq s ASN 462 Ca 0.59 1.62 0.02 0.00 0.04 0.00 0.00 52.86 55.14 1bzq s ASN 462 Cb -0.22 -2.54 -0.04 0.00 -1.54 0.00 0.00 41.25 36.91 1bzq s ASN 462 CO 0.20 -0.70 -0.03 0.68 -3.04 0.00 0.00 177.10 174.21 1bzq s VAL 463 N 3.16 0.77 0.28 -5.21 -7.23 0.75 -4.92 120.40 108.00 1bzq s VAL 463 Ca 0.52 -1.98 -0.29 0.00 -1.81 0.00 0.00 61.98 58.42 1bzq s VAL 463 Cb -0.20 -1.97 -0.09 0.00 0.56 0.00 0.00 36.38 34.68 1bzq s VAL 463 CO 0.14 -0.62 1.02 0.00 -0.31 0.00 0.00 175.10 175.32 1bzq s ALA 464 N -3.59 3.34 1.02 1.32 0.00 -1.26 -2.79 121.76 119.79 1bzq s ALA 464 Ca 0.20 0.73 -0.16 0.00 0.00 0.00 0.00 51.96 52.73 1bzq s ALA 464 Cb 0.05 -3.26 0.21 0.00 0.00 0.00 0.00 23.12 20.12 1bzq s ALA 464 CO 0.01 0.02 1.21 0.00 0.00 0.00 0.00 175.76 177.00 1bzq h LYS 466 N -1.87 0.95 0.00 0.00 1.57 -1.93 -2.92 116.57 112.38 1bzq h LYS 466 Ca -0.46 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 57.97 1bzq h LYS 466 Cb 1.28 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1bzq h LYS 466 CO 0.44 1.01 0.00 0.27 -0.57 0.00 0.00 179.45 180.60 1bzq n ASN 467 N -4.15 0.00 0.00 0.86 0.23 -1.26 -4.88 115.26 106.06 1bzq n ASN 467 Ca 0.01 -1.04 0.00 0.00 -0.53 0.00 0.00 54.58 53.02 1bzq n ASN 467 Cb 0.40 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.10 1bzq n ASN 467 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1bzq n GLY 468 N 0.89 2.42 3.66 4.83 0.00 -1.10 -5.08 105.19 110.81 1bzq n GLY 468 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 1bzq n GLY 468 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1bzq n GLN 469 N -0.47 0.61 -0.27 1.61 6.02 -1.26 -4.65 117.38 118.97 1bzq n GLN 469 Ca 0.00 0.27 0.07 0.00 -0.01 0.00 0.00 57.00 57.32 1bzq n GLN 469 Cb 0.00 -2.36 0.18 0.00 1.02 0.00 0.00 30.24 29.08 1bzq n GLN 469 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1bzq n THR 470 N -2.52 1.59 -1.02 5.09 -2.24 -1.26 -0.03 114.28 113.89 1bzq n THR 470 Ca 0.14 -1.44 -0.24 0.00 -2.27 0.00 0.00 64.05 60.23 1bzq n THR 470 Cb 0.49 0.14 0.12 0.00 -2.10 0.00 0.00 70.33 68.98 1bzq n THR 470 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1bzq n ASN 471 N -0.11 5.20 -4.87 3.42 2.04 -1.26 -4.64 115.26 115.04 1bzq n ASN 471 Ca 0.15 -3.46 -0.34 0.00 -0.44 0.00 0.00 54.58 50.49 1bzq n ASN 471 Cb 0.62 -0.88 -0.06 0.00 -2.53 0.00 0.00 39.78 36.93 1bzq n ASN 471 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1bzq s TYR 473 N -1.20 1.74 -0.12 0.00 2.02 0.20 -0.18 117.35 119.81 1bzq s TYR 473 Ca 0.22 -0.80 -0.13 0.00 -0.37 0.00 0.00 57.07 55.99 1bzq s TYR 473 Cb -0.12 -1.30 -0.05 0.00 -0.40 0.00 0.00 41.96 40.09 1bzq s TYR 473 CO 0.13 -0.45 0.29 -1.14 -1.57 0.00 0.00 175.55 172.81 1bzq s GLN 474 N 1.11 4.04 0.27 -0.62 0.74 0.21 -1.13 119.66 124.28 1bzq s GLN 474 Ca -0.05 0.11 -0.29 0.00 0.05 0.00 0.00 55.36 55.18 1bzq s GLN 474 Cb -0.14 -3.34 -0.09 0.00 1.10 0.00 0.00 33.01 30.53 1bzq s GLN 474 CO -0.02 0.43 1.14 -1.54 -0.55 0.00 0.00 175.29 174.74 1bzq s SER 475 N -0.11 7.18 0.05 6.67 1.04 -0.59 -2.16 113.70 125.78 1bzq s SER 475 Ca 0.17 2.31 -0.33 0.00 0.48 0.00 0.00 55.95 58.59 1bzq s SER 475 Cb -0.13 -2.63 -0.18 0.00 0.10 0.00 0.00 66.02 63.18 1bzq s SER 475 CO 0.06 -0.23 1.50 1.88 0.98 0.00 0.00 173.24 177.42 1bzq h TYR 476 N 4.01 -1.12 -3.96 5.02 0.05 -1.95 -3.44 116.97 115.60 1bzq h TYR 476 Ca -0.47 -0.02 -0.44 0.00 0.05 0.00 0.00 58.73 57.85 1bzq h TYR 476 Cb 1.21 0.38 0.16 0.00 1.01 0.00 0.00 36.73 39.49 1bzq h TYR 476 CO 0.59 -0.68 0.36 -1.12 -1.05 0.00 0.00 178.16 176.26 1bzq s SER 477 N -3.76 2.74 0.14 3.88 0.01 -1.26 -5.02 113.70 110.42 1bzq s SER 477 Ca -0.17 0.40 0.03 0.00 1.31 0.00 0.00 55.95 57.52 1bzq s SER 477 Cb 0.02 -0.53 -0.04 0.00 0.21 0.00 0.00 66.02 65.68 1bzq s SER 477 CO 0.52 -2.98 0.23 0.42 0.41 0.00 0.00 173.24 171.85 1bzq s THR 478 N -3.66 5.12 0.22 1.44 -4.23 -1.26 -4.53 115.64 108.74 1bzq s THR 478 Ca 0.72 -0.73 0.06 0.00 -1.18 0.00 0.00 61.69 60.56 1bzq s THR 478 Cb -0.06 -3.61 -0.05 0.00 1.34 0.00 0.00 72.50 70.12 1bzq s THR 478 CO 0.53 -0.06 -0.08 -0.04 -0.54 0.00 0.00 174.62 174.44 1bzq s MET 479 N -3.08 1.35 -0.64 3.99 -1.94 0.19 -4.86 119.30 114.32 1bzq s MET 479 Ca 0.34 -1.64 -0.28 0.00 -1.71 0.00 0.00 55.69 52.40 1bzq s MET 479 Cb -0.11 -0.95 0.02 0.00 2.01 0.00 0.00 34.83 35.80 1bzq s MET 479 CO 0.27 0.07 1.30 0.45 -0.01 0.00 0.00 175.02 177.10 1bzq s SER 480 N -3.33 6.22 0.24 3.03 0.15 -1.26 -1.91 113.70 116.84 1bzq s SER 480 Ca 0.25 -0.08 0.11 0.00 0.70 0.00 0.00 55.95 56.93 1bzq s SER 480 Cb 0.02 -2.55 -0.05 0.00 -1.71 0.00 0.00 66.02 61.73 1bzq s SER 480 CO 0.08 -1.71 -0.14 0.27 1.20 0.00 0.00 173.24 172.93 1bzq s ILE 481 N 5.66 2.82 -0.21 6.45 -4.36 0.19 0.12 121.20 131.87 1bzq s ILE 481 Ca 0.42 -2.07 0.01 0.00 -0.26 0.00 0.00 60.65 58.75 1bzq s ILE 481 Cb -0.08 -2.44 0.05 0.00 1.25 0.00 0.00 42.46 41.23 1bzq s ILE 481 CO 0.21 -0.28 -0.09 -0.89 0.24 0.00 0.00 174.94 174.13 1bzq s THR 482 N -2.13 1.61 -0.11 8.37 2.01 -0.66 -1.10 115.64 123.62 1bzq s THR 482 Ca 0.27 -1.05 -0.23 0.00 0.31 0.00 0.00 61.69 60.99 1bzq s THR 482 Cb -0.07 -1.73 -0.03 0.00 0.01 0.00 0.00 72.50 70.68 1bzq s THR 482 CO 0.15 0.10 0.68 -1.81 -0.69 0.00 0.00 174.62 173.06 1bzq s ASP 483 N 1.40 6.89 -0.27 3.53 1.11 0.35 -2.16 116.67 127.53 1bzq s ASP 483 Ca -0.02 1.08 -0.05 0.00 0.18 0.00 0.00 52.55 53.74 1bzq s ASP 483 Cb -0.17 -2.39 0.01 0.00 1.07 0.00 0.00 42.92 41.44 1bzq s ASP 483 CO -0.08 -0.17 0.02 0.00 1.18 0.00 0.00 175.17 176.12 1bzq s ARG 485 N 1.44 2.41 0.11 0.00 3.52 -0.96 -1.50 118.95 123.96 1bzq s ARG 485 Ca 0.02 -0.77 -0.30 0.00 -0.13 0.00 0.00 55.73 54.55 1bzq s ARG 485 Cb -0.17 -2.35 -0.06 0.00 -1.56 0.00 0.00 34.95 30.81 1bzq s ARG 485 CO -0.00 0.60 1.13 -2.00 -0.81 0.00 0.00 175.30 174.22 1bzq s GLU 486 N -1.00 4.52 0.00 5.12 2.12 -0.65 -0.06 118.70 128.75 1bzq s GLU 486 Ca 0.13 1.72 0.00 0.00 0.36 0.00 0.00 54.97 57.18 1bzq s GLU 486 Cb -0.11 -3.32 0.00 0.00 0.26 0.00 0.00 34.13 30.96 1bzq s GLU 486 CO 0.03 -0.08 0.00 0.25 -0.54 0.00 0.00 175.26 174.92 1bzq n THR 487 N 3.17 0.00 -0.08 -1.70 -2.24 -0.73 -4.87 114.28 107.83 1bzq n THR 487 Ca 0.06 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.72 1bzq n THR 487 Cb 0.47 -0.88 -0.15 0.00 -2.10 0.00 0.00 70.33 67.67 1bzq n THR 487 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bzq n GLY 488 N 2.20 -0.85 0.26 3.38 0.00 -1.26 -4.17 105.19 104.75 1bzq n GLY 488 Ca 0.00 -0.23 0.03 0.00 0.00 0.00 0.00 46.02 45.81 1bzq n GLY 488 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1bzq h SER 489 N 0.01 0.28 -3.63 1.61 0.87 -1.93 -3.44 113.55 107.31 1bzq h SER 489 Ca -0.48 -0.05 -0.56 0.00 -1.23 0.00 0.00 61.79 59.48 1bzq h SER 489 Cb 2.11 -0.07 0.12 0.00 -0.44 0.00 0.00 62.40 64.12 1bzq h SER 489 CO 0.03 0.38 0.57 -0.24 -0.53 0.00 0.00 176.83 177.03 1bzq n SER 490 N -4.32 2.90 -3.61 6.23 2.88 -1.26 -4.93 113.62 111.51 1bzq n SER 490 Ca -0.00 1.15 -0.02 0.00 -1.33 0.00 0.00 58.87 58.66 1bzq n SER 490 Cb 0.22 -1.53 -0.05 0.00 -0.75 0.00 0.00 64.21 62.10 1bzq n SER 490 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1bzq s LYS 491 N -2.17 0.56 0.22 -1.46 2.20 -0.47 -4.90 119.74 113.72 1bzq s LYS 491 Ca 0.59 1.26 -0.32 0.00 -0.36 0.00 0.00 55.97 57.14 1bzq s LYS 491 Cb -0.50 0.59 -0.14 0.00 -1.51 0.00 0.00 37.83 36.27 1bzq s LYS 491 CO 0.60 -0.17 1.41 0.98 -0.36 0.00 0.00 175.35 177.81 1bzq n TYR 492 N 5.00 2.08 0.06 4.03 9.36 -1.26 0.74 117.16 137.17 1bzq n TYR 492 Ca -0.14 0.44 0.08 0.00 3.32 0.00 0.00 57.90 61.59 1bzq n TYR 492 Cb 0.52 -2.45 0.26 0.00 -0.63 0.00 0.00 39.34 37.04 1bzq n TYR 492 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1bzq n PRO 493 N 2.24 2.76 -3.16 2.98 -0.04 -1.26 -5.01 135.00 133.51 1bzq n PRO 493 Ca 0.13 -2.07 -0.45 0.00 -0.04 0.00 0.00 63.50 61.06 1bzq n PRO 493 Cb 0.30 -1.62 -0.01 0.00 -0.04 0.00 0.00 33.50 32.12 1bzq n PRO 493 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1bzq s ASN 494 N -0.87 6.89 -0.18 3.54 0.02 0.23 -5.00 114.94 119.57 1bzq s ASN 494 Ca 0.38 -2.74 -0.25 0.00 -1.02 0.00 0.00 52.86 49.22 1bzq s ASN 494 Cb 0.23 -2.29 -0.01 0.00 0.02 0.00 0.00 41.25 39.19 1bzq s ASN 494 CO 0.21 -0.68 0.84 0.00 0.02 0.00 0.00 177.10 177.48 1bzq s ALA 496 N 2.25 2.45 0.10 0.00 0.00 -1.26 -4.92 121.76 120.38 1bzq s ALA 496 Ca 0.38 -0.93 0.06 0.00 0.00 0.00 0.00 51.96 51.47 1bzq s ALA 496 Cb -0.16 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.89 1bzq s ALA 496 CO 0.12 0.30 -0.16 0.71 0.00 0.00 0.00 175.76 176.72 1bzq s TYR 497 N 0.23 1.43 -0.19 0.00 2.02 -1.26 -1.78 117.35 117.81 1bzq s TYR 497 Ca -0.11 -0.48 -0.09 0.00 -0.37 0.00 0.00 57.07 56.02 1bzq s TYR 497 Cb -0.16 -0.78 -0.05 0.00 -0.40 0.00 0.00 41.96 40.58 1bzq s TYR 497 CO 0.06 0.13 0.12 -1.59 -1.57 0.00 0.00 175.55 172.70 1bzq s LYS 498 N -2.09 4.08 -0.24 -0.62 -2.85 0.92 -4.58 119.74 114.36 1bzq s LYS 498 Ca 0.04 -0.23 -0.21 0.00 -1.00 0.00 0.00 55.97 54.57 1bzq s LYS 498 Cb -0.08 -3.36 -0.02 0.00 -2.06 0.00 0.00 37.83 32.30 1bzq s LYS 498 CO 0.03 0.35 0.65 0.99 0.10 0.00 0.00 175.35 177.47 1bzq s THR 499 N 0.21 4.98 -0.33 3.79 2.01 -1.26 -2.27 115.64 122.77 1bzq s THR 499 Ca 0.08 1.19 0.03 0.00 0.31 0.00 0.00 61.69 63.29 1bzq s THR 499 Cb -0.11 -3.95 0.10 0.00 0.01 0.00 0.00 72.50 68.54 1bzq s THR 499 CO -0.01 0.04 0.06 -0.89 -0.69 0.00 0.00 174.62 173.13 1bzq s THR 500 N 2.39 1.85 0.48 -0.82 2.01 -0.04 -5.00 115.64 116.50 1bzq s THR 500 Ca 0.28 -2.04 -0.20 0.00 0.31 0.00 0.00 61.69 60.03 1bzq s THR 500 Cb -0.16 -2.37 -0.09 0.00 0.01 0.00 0.00 72.50 69.90 1bzq s THR 500 CO 0.09 -0.61 1.03 -1.58 -0.69 0.00 0.00 174.62 172.85 1bzq s GLN 501 N 1.12 3.85 0.01 4.92 2.00 -1.26 -0.49 119.66 129.81 1bzq s GLN 501 Ca 0.10 1.34 -0.28 0.00 -2.00 0.00 0.00 55.36 54.52 1bzq s GLN 501 Cb -0.18 -2.10 0.10 0.00 0.80 0.00 0.00 33.01 31.62 1bzq s GLN 501 CO -0.13 -0.39 0.87 0.00 -0.50 0.00 0.00 175.29 175.14 1bzq s ALA 502 N -2.00 -1.80 -0.33 1.58 0.00 -0.26 -4.90 121.76 114.05 1bzq s ALA 502 Ca 0.67 0.93 0.04 0.00 0.00 0.00 0.00 51.96 53.60 1bzq s ALA 502 Cb -0.16 0.46 0.10 0.00 0.00 0.00 0.00 23.12 23.52 1bzq s ALA 502 CO 0.19 -0.71 0.03 -0.80 0.00 0.00 0.00 175.76 174.47 1bzq s ASN 503 N -2.52 4.73 0.28 0.00 -0.87 -1.26 -0.64 114.94 114.66 1bzq s ASN 503 Ca 0.05 -2.07 0.04 0.00 -1.57 0.00 0.00 52.86 49.31 1bzq s ASN 503 Cb -0.01 -1.62 -0.04 0.00 -0.02 0.00 0.00 41.25 39.57 1bzq s ASN 503 CO -0.09 -0.36 0.20 -1.59 -2.57 0.00 0.00 177.10 172.70 1bzq s LYS 504 N 0.93 1.53 0.16 -0.60 0.00 -0.80 -4.77 119.74 116.19 1bzq s LYS 504 Ca 0.09 -1.86 -0.30 0.00 0.00 0.00 0.00 55.97 53.89 1bzq s LYS 504 Cb -0.19 0.22 -0.07 0.00 0.00 0.00 0.00 37.83 37.79 1bzq s LYS 504 CO -0.08 -0.52 0.98 -1.01 0.00 0.00 0.00 175.35 174.72 1bzq s HIS 505 N -3.73 3.82 -0.11 1.78 3.76 0.63 0.56 115.29 122.01 1bzq s HIS 505 Ca 0.39 1.80 -0.04 0.00 -0.15 0.00 0.00 55.06 57.07 1bzq s HIS 505 Cb 0.04 -3.07 -0.03 0.00 1.11 0.00 0.00 32.58 30.63 1bzq s HIS 505 CO 0.20 0.13 0.03 0.96 -0.85 0.00 0.00 174.74 175.21 1bzq s ILE 506 N -0.41 4.53 -0.22 0.60 -5.25 -1.26 -0.19 121.20 118.99 1bzq s ILE 506 Ca 0.46 -0.16 -0.05 0.00 -0.99 0.00 0.00 60.65 59.91 1bzq s ILE 506 Cb -0.25 -2.94 -0.01 0.00 2.95 0.00 0.00 42.46 42.20 1bzq s ILE 506 CO 0.32 0.58 -0.02 -0.63 -1.79 0.00 0.00 174.94 173.40 1bzq s ILE 507 N -0.63 3.58 0.27 8.37 1.01 0.15 -1.55 121.20 132.40 1bzq s ILE 507 Ca 0.11 -0.42 0.12 0.00 0.00 0.00 0.00 60.65 60.45 1bzq s ILE 507 Cb -0.12 -2.64 -0.05 0.00 0.01 0.00 0.00 42.46 39.67 1bzq s ILE 507 CO 0.02 0.41 -0.19 0.68 0.00 0.00 0.00 174.94 175.86 1bzq s VAL 508 N 1.48 2.55 -0.20 2.92 -7.23 -0.28 -1.09 120.40 118.55 1bzq s VAL 508 Ca 0.06 -2.32 -0.07 0.00 -1.81 0.00 0.00 61.98 57.85 1bzq s VAL 508 Cb -0.14 -2.33 -0.03 0.00 0.56 0.00 0.00 36.38 34.44 1bzq s VAL 508 CO -0.02 -0.36 0.04 0.00 -0.31 0.00 0.00 175.10 174.46 1bzq s ALA 509 N -2.38 3.25 0.11 1.32 0.00 0.06 0.59 121.76 124.70 1bzq s ALA 509 Ca 0.29 -0.88 0.08 0.00 0.00 0.00 0.00 51.96 51.45 1bzq s ALA 509 Cb -0.06 -1.89 -0.04 0.00 0.00 0.00 0.00 23.12 21.14 1bzq s ALA 509 CO 0.15 -0.01 -0.12 0.00 0.00 0.00 0.00 175.76 175.78 1bzq s GLU 511 N -2.24 0.66 0.97 0.00 -1.05 -0.60 -4.90 118.70 111.55 1bzq s GLU 511 Ca 0.21 -0.36 0.00 0.00 -0.15 0.00 0.00 54.97 54.67 1bzq s GLU 511 Cb -0.11 0.23 0.00 0.00 -0.44 0.00 0.00 34.13 33.81 1bzq s GLU 511 CO 0.13 -0.30 0.00 0.41 0.95 0.00 0.00 175.26 176.45 1bzq n GLY 512 N -0.47 -2.09 3.12 -3.83 0.00 -1.26 -2.72 105.19 97.93 1bzq n GLY 512 Ca -0.08 -1.42 -0.10 0.00 0.00 0.00 0.00 46.02 44.42 1bzq n GLY 512 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1bzq s ASN 513 N -3.90 0.05 0.58 1.61 2.47 -1.26 -2.83 114.94 111.66 1bzq s ASN 513 Ca 0.00 0.71 -0.20 0.00 0.42 0.00 0.00 52.86 53.79 1bzq s ASN 513 Cb 0.00 1.10 -0.04 0.00 -1.45 0.00 0.00 41.25 40.86 1bzq s ASN 513 CO 0.00 -0.25 1.29 -2.16 -3.72 0.00 0.00 177.10 172.26 1bzq s PRO 514 N 2.54 2.97 -0.83 0.43 0.04 -1.26 -5.05 135.00 133.83 1bzq s PRO 514 Ca 0.02 2.06 -0.25 0.00 0.04 0.00 0.00 61.00 62.86 1bzq s PRO 514 Cb -0.13 -2.07 -0.00 0.00 0.04 0.00 0.00 34.50 32.35 1bzq s PRO 514 CO -0.12 -1.27 1.66 -0.47 0.04 0.00 0.00 177.00 176.84 1bzq s TYR 515 N -1.41 2.06 0.31 0.56 5.04 -1.13 -4.91 117.35 117.87 1bzq s TYR 515 Ca 0.76 0.14 0.10 0.00 -2.44 0.00 0.00 57.07 55.63 1bzq s TYR 515 Cb -0.36 -4.34 -0.06 0.00 0.35 0.00 0.00 41.96 37.54 1bzq s TYR 515 CO 0.41 -1.99 -0.14 0.14 -1.34 0.00 0.00 175.55 172.63 1bzq s VAL 516 N 7.64 2.27 0.22 3.14 -7.23 -1.10 -4.83 120.40 120.51 1bzq s VAL 516 Ca 0.56 -2.28 -0.31 0.00 -1.81 0.00 0.00 61.98 58.14 1bzq s VAL 516 Cb -0.07 -2.47 -0.11 0.00 0.56 0.00 0.00 36.38 34.30 1bzq s VAL 516 CO 0.05 -0.31 1.56 -2.84 -0.31 0.00 0.00 175.10 173.26 1bzq s PRO 517 N -3.58 4.19 0.00 4.82 0.02 -1.26 -1.56 135.00 137.63 1bzq s PRO 517 Ca 0.31 2.44 0.00 0.00 0.02 0.00 0.00 61.00 63.76 1bzq s PRO 517 Cb -0.01 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.42 1bzq s PRO 517 CO 0.15 -0.59 0.00 1.33 -0.33 0.00 0.00 177.00 177.56 1bzq n VAL 518 N 3.12 0.00 -3.73 3.83 0.24 0.61 -4.51 118.33 117.89 1bzq n VAL 518 Ca 0.11 -0.36 -0.13 0.00 -2.04 0.00 0.00 64.34 61.91 1bzq n VAL 518 Cb 0.38 0.91 -0.10 0.00 -1.47 0.00 0.00 33.84 33.56 1bzq n VAL 518 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1bzq s HIS 519 N -1.01 -0.43 -0.38 6.34 5.65 -1.12 -4.55 115.29 119.79 1bzq s HIS 519 Ca 0.00 1.04 -0.21 0.00 0.25 0.00 0.00 55.06 56.14 1bzq s HIS 519 Cb 0.00 0.15 0.01 0.00 -1.18 0.00 0.00 32.58 31.56 1bzq s HIS 519 CO 0.00 -0.24 0.67 0.12 -0.65 0.00 0.00 174.74 174.64 1bzq s PHE 520 N 0.07 3.12 -0.12 3.88 2.19 -1.26 -0.76 117.98 125.10 1bzq s PHE 520 Ca -0.01 0.31 -0.07 0.00 0.33 0.00 0.00 56.93 57.48 1bzq s PHE 520 Cb -0.03 -3.25 -0.02 0.00 -1.31 0.00 0.00 43.02 38.41 1bzq s PHE 520 CO 0.01 -0.71 -0.14 0.22 1.83 0.00 0.00 175.22 176.43 1bzq h ASP 521 N 8.56 0.00 -5.29 6.13 3.58 -1.44 -3.48 116.42 124.48 1bzq h ASP 521 Ca -0.26 0.00 -0.10 0.00 0.42 0.00 0.00 57.03 57.09 1bzq h ASP 521 Cb 1.10 0.00 -0.08 0.00 1.72 0.00 0.00 39.33 42.07 1bzq h ASP 521 CO 0.86 0.62 -0.11 0.00 -2.88 0.00 0.00 179.24 177.73 1bzq s ALA 522 N -2.77 -0.04 -0.03 -0.78 0.00 -0.98 -4.97 121.76 112.20 1bzq s ALA 522 Ca -0.12 -1.02 0.04 0.00 0.00 0.00 0.00 51.96 50.86 1bzq s ALA 522 Cb 0.02 1.06 -0.00 0.00 0.00 0.00 0.00 23.12 24.20 1bzq s ALA 522 CO 0.17 -0.85 -0.14 -1.54 0.00 0.00 0.00 175.76 173.40 1bzq s SER 523 N -3.07 1.78 0.00 0.00 1.04 -1.26 0.34 113.70 112.53 1bzq s SER 523 Ca 0.24 -0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.39 1bzq s SER 523 Cb -0.01 -0.39 0.00 0.00 0.10 0.00 0.00 66.02 65.72 1bzq s SER 523 CO 0.12 0.14 0.07 0.55 0.98 0.00 0.00 173.24 175.10