#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qb3 n ALA 407 N 0.00 -2.08 0.00 1.57 0.00 -1.26 -4.77 120.51 113.97 1qb3 n ALA 407 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1qb3 n ALA 407 Cb 0.00 -3.69 0.00 0.00 0.00 0.00 0.00 19.45 15.76 1qb3 n ALA 407 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1qb3 n PHE 408 N -2.51 0.00 -3.81 0.00 7.35 -1.26 -4.92 117.46 112.31 1qb3 n PHE 408 Ca -0.04 0.00 -0.36 0.00 -0.76 0.00 0.00 57.45 56.29 1qb3 n PHE 408 Cb 0.57 0.00 -0.13 0.00 0.35 0.00 0.00 39.48 40.27 1qb3 n PHE 408 CO 0.00 0.00 0.00 -1.14 -0.76 0.00 0.00 176.76 174.86 1qb3 s GLN 409 N 0.00 2.34 0.00 -4.13 0.74 -1.26 -4.99 119.66 112.36 1qb3 s GLN 409 Ca 0.00 -1.44 0.00 0.00 0.05 0.00 0.00 55.36 53.97 1qb3 s GLN 409 Cb 0.00 -3.40 0.00 0.00 1.10 0.00 0.00 33.01 30.71 1qb3 s GLN 409 CO 0.00 -0.79 0.00 0.41 -0.55 0.00 0.00 175.29 174.36 1qb3 n GLY 410 N 4.67 0.74 3.23 2.59 0.00 -1.26 -4.23 105.19 110.93 1qb3 n GLY 410 Ca -0.09 -1.95 -0.42 0.00 0.00 0.00 0.00 46.02 43.56 1qb3 n GLY 410 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1qb3 s ARG 411 N -1.26 3.36 0.44 1.61 3.52 -1.26 -5.06 118.95 120.30 1qb3 s ARG 411 Ca 0.00 -2.71 -0.23 0.00 -0.13 0.00 0.00 55.73 52.66 1qb3 s ARG 411 Cb 0.00 -4.19 -0.11 0.00 -1.56 0.00 0.00 34.95 29.10 1qb3 s ARG 411 CO 0.00 -1.25 0.84 1.17 -0.81 0.00 0.00 175.30 175.25 1qb3 n LYS 412 N 3.41 1.02 -2.80 5.12 4.81 -1.26 -4.93 118.16 123.53 1qb3 n LYS 412 Ca 0.15 0.37 -0.33 0.00 -0.87 0.00 0.00 58.31 57.63 1qb3 n LYS 412 Cb 0.42 -1.86 -0.07 0.00 0.02 0.00 0.00 35.03 33.54 1qb3 n LYS 412 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1qb3 s LEU 413 N 0.11 3.93 0.66 3.14 1.43 -1.26 -5.04 118.68 121.65 1qb3 s LEU 413 Ca 0.65 1.70 -0.11 0.00 -1.03 0.00 0.00 54.13 55.33 1qb3 s LEU 413 Cb -0.56 -4.54 -0.01 0.00 0.03 0.00 0.00 46.19 41.11 1qb3 s LEU 413 CO 0.56 -0.39 1.05 0.42 0.23 0.00 0.00 176.35 178.22 1qb3 s THR 414 N -2.18 4.23 0.38 5.49 -4.23 -1.26 -4.71 115.64 113.36 1qb3 s THR 414 Ca 0.62 0.76 0.16 0.00 -1.18 0.00 0.00 61.69 62.05 1qb3 s THR 414 Cb -0.09 -3.54 0.37 0.00 1.34 0.00 0.00 72.50 70.57 1qb3 s THR 414 CO 0.14 -0.91 1.77 0.44 -0.54 0.00 0.00 174.62 175.52 1qb3 h ASP 415 N -0.46 0.50 0.06 3.99 3.32 -1.99 0.35 116.42 122.19 1qb3 h ASP 415 Ca -0.44 0.09 -0.00 0.00 0.02 0.00 0.00 57.03 56.69 1qb3 h ASP 415 Cb 1.20 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1qb3 h ASP 415 CO 0.58 0.11 -0.03 1.56 -1.72 0.00 0.00 179.24 179.74 1qb3 h GLN 416 N 0.45 -0.08 -0.54 3.56 4.20 -1.98 -1.77 115.11 118.94 1qb3 h GLN 416 Ca 0.59 0.01 0.11 0.00 0.06 0.00 0.00 58.65 59.41 1qb3 h GLN 416 Cb 1.40 0.02 -0.11 0.00 0.30 0.00 0.00 27.48 29.10 1qb3 h GLN 416 CO -0.32 0.47 -0.17 0.93 -0.67 0.00 0.00 178.83 179.07 1qb3 h GLU 417 N -0.70 -0.04 0.31 1.46 5.08 -1.27 -0.99 114.58 118.44 1qb3 h GLU 417 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1qb3 h GLU 417 Cb 0.58 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 1qb3 h GLU 417 CO 0.01 -0.03 -0.39 -0.09 -1.00 0.00 0.00 179.01 177.52 1qb3 h ARG 418 N -0.04 -0.72 0.00 2.33 9.65 -0.44 -1.96 114.38 123.20 1qb3 h ARG 418 Ca 0.26 0.05 0.00 0.00 -1.10 0.00 0.00 59.98 59.19 1qb3 h ARG 418 Cb 0.43 0.16 0.00 0.00 -1.39 0.00 0.00 29.97 29.18 1qb3 h ARG 418 CO -0.58 -0.48 0.02 0.00 2.80 0.00 0.00 179.97 181.73 1qb3 h ALA 419 N -0.32 1.02 0.07 2.80 0.00 -0.36 -1.62 119.26 120.84 1qb3 h ALA 419 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.57 1qb3 h ALA 419 Cb 0.70 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1qb3 h ALA 419 CO -0.11 -0.02 -1.77 0.54 0.00 0.00 0.00 179.25 177.89 1qb3 n ARG 420 N -2.66 0.67 -0.30 0.00 5.12 -0.48 -4.27 116.66 114.74 1qb3 n ARG 420 Ca -0.02 0.38 -0.04 0.00 -1.93 0.00 0.00 57.85 56.24 1qb3 n ARG 420 Cb 0.07 -1.70 0.08 0.00 -1.16 0.00 0.00 32.46 29.75 1qb3 n ARG 420 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1qb3 h VAL 421 N -0.40 1.22 0.00 1.55 2.07 -0.94 -1.29 116.25 118.46 1qb3 h VAL 421 Ca -0.42 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 66.69 1qb3 h VAL 421 Cb 1.73 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1qb3 h VAL 421 CO -0.06 0.21 0.20 0.18 0.02 0.00 0.00 177.57 178.12 1qb3 n LEU 422 N -4.49 0.05 -0.23 2.57 4.77 -0.65 -1.05 117.00 117.96 1qb3 n LEU 422 Ca 0.08 0.34 -0.06 0.00 -0.03 0.00 0.00 56.01 56.35 1qb3 n LEU 422 Cb 0.02 -0.34 0.04 0.00 -2.33 0.00 0.00 43.42 40.82 1qb3 n LEU 422 CO 0.37 -0.36 1.10 -0.08 -1.33 0.00 0.00 177.39 177.09 1qb3 h GLU 423 N 0.00 0.88 0.00 3.23 4.81 -1.43 -3.00 114.58 119.07 1qb3 h GLU 423 Ca 0.00 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1qb3 h GLU 423 Cb 0.41 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.61 1qb3 h GLU 423 CO 0.00 0.64 -0.18 1.19 -0.73 0.00 0.00 179.01 179.93 1qb3 n PHE 424 N -4.58 0.08 -0.25 0.92 3.72 -0.21 -4.55 117.46 112.59 1qb3 n PHE 424 Ca 0.05 0.02 -0.07 0.00 -0.05 0.00 0.00 57.45 57.41 1qb3 n PHE 424 Cb 0.06 -0.46 -0.06 0.00 -0.94 0.00 0.00 39.48 38.09 1qb3 n PHE 424 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65 1qb3 n GLN 425 N -1.57 -0.26 0.00 -1.08 7.27 -1.13 -0.41 117.38 120.19 1qb3 n GLN 425 Ca 0.06 1.21 0.00 0.00 0.07 0.00 0.00 57.00 58.34 1qb3 n GLN 425 Cb 0.35 -1.78 0.00 0.00 2.41 0.00 0.00 30.24 31.21 1qb3 n GLN 425 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1qb3 n ASP 426 N -4.39 0.00 0.00 1.69 8.00 -1.26 -1.51 116.55 119.08 1qb3 n ASP 426 Ca 0.01 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.51 1qb3 n ASP 426 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.26 1qb3 n ASP 426 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1qb3 n SER 427 N -0.85 1.21 -4.73 -2.24 7.64 0.45 -5.01 113.62 110.09 1qb3 n SER 427 Ca 0.00 -1.51 -0.41 0.00 1.01 0.00 0.00 58.87 57.95 1qb3 n SER 427 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 1qb3 n SER 427 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1qb3 s ILE 428 N -0.51 3.93 -0.06 0.44 1.01 -0.57 -4.38 121.20 121.06 1qb3 s ILE 428 Ca 0.00 1.60 0.03 0.00 0.00 0.00 0.00 60.65 62.28 1qb3 s ILE 428 Cb 0.00 -4.02 -0.02 0.00 0.01 0.00 0.00 42.46 38.42 1qb3 s ILE 428 CO 0.00 0.24 -0.14 -2.28 0.00 0.00 0.00 174.94 172.76 1qb3 s HIS 429 N 0.03 2.72 -0.18 3.97 5.65 -0.67 -4.97 115.29 121.84 1qb3 s HIS 429 Ca 0.51 -0.24 -0.03 0.00 0.25 0.00 0.00 55.06 55.56 1qb3 s HIS 429 Cb -0.29 -1.67 -0.01 0.00 -1.18 0.00 0.00 32.58 29.43 1qb3 s HIS 429 CO 0.34 0.12 -0.07 0.71 -0.65 0.00 0.00 174.74 175.19 1qb3 s TYR 430 N -0.55 2.92 0.95 3.88 1.51 -1.26 -0.05 117.35 124.75 1qb3 s TYR 430 Ca 0.08 -0.77 -0.12 0.00 -1.01 0.00 0.00 57.07 55.24 1qb3 s TYR 430 Cb -0.12 -2.00 0.16 0.00 -0.11 0.00 0.00 41.96 39.89 1qb3 s TYR 430 CO 0.01 -0.38 1.12 -1.54 -1.11 0.00 0.00 175.55 173.66 1qb3 s SER 431 N 0.98 3.14 0.60 2.29 1.04 -0.04 -5.01 113.70 116.70 1qb3 s SER 431 Ca -0.01 1.05 -0.11 0.00 0.48 0.00 0.00 55.95 57.36 1qb3 s SER 431 Cb -0.15 -1.66 -0.04 0.00 0.10 0.00 0.00 66.02 64.27 1qb3 s SER 431 CO -0.00 -2.79 1.01 -2.84 0.98 0.00 0.00 173.24 169.60 1qb3 s PRO 432 N -5.15 3.63 0.60 4.02 0.02 -1.26 -4.67 135.00 132.19 1qb3 s PRO 432 Ca 0.64 0.73 -0.11 0.00 0.02 0.00 0.00 61.00 62.28 1qb3 s PRO 432 Cb -0.16 -2.10 -0.04 0.00 0.02 0.00 0.00 34.50 32.21 1qb3 s PRO 432 CO 0.55 -0.52 1.01 1.03 -0.33 0.00 0.00 177.00 178.74 1qb3 s ARG 433 N -5.06 3.62 0.15 5.54 0.52 -1.26 -4.63 118.95 117.83 1qb3 s ARG 433 Ca 0.55 0.73 -0.15 0.00 -0.52 0.00 0.00 55.73 56.34 1qb3 s ARG 433 Cb -0.11 -2.10 0.02 0.00 0.52 0.00 0.00 34.95 33.28 1qb3 s ARG 433 CO 0.51 -0.53 0.41 1.52 0.02 0.00 0.00 175.30 177.24 1qb3 s TYR 434 N -3.12 -0.06 0.35 -0.53 -0.85 0.66 -4.95 117.35 108.85 1qb3 s TYR 434 Ca 0.55 -0.28 -0.09 0.00 -0.52 0.00 0.00 57.07 56.73 1qb3 s TYR 434 Cb -0.11 0.24 0.02 0.00 0.38 0.00 0.00 41.96 42.49 1qb3 s TYR 434 CO 0.52 -0.77 0.60 -1.54 -1.52 0.00 0.00 175.55 172.84 1qb3 s SER 435 N -2.86 0.46 0.00 -0.18 1.04 -1.26 0.21 113.70 111.12 1qb3 s SER 435 Ca 0.07 -1.29 0.00 0.00 0.48 0.00 0.00 55.95 55.22 1qb3 s SER 435 Cb 0.01 0.73 0.00 0.00 0.10 0.00 0.00 66.02 66.86 1qb3 s SER 435 CO -0.07 -1.43 0.00 -0.90 0.98 0.00 0.00 173.24 171.82 1qb3 n ASP 436 N -1.29 0.11 -1.96 7.02 5.75 -0.78 -4.99 116.55 120.41 1qb3 n ASP 436 Ca -0.03 -0.70 -0.07 0.00 -0.01 0.00 0.00 54.79 53.98 1qb3 n ASP 436 Cb 0.61 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.60 1qb3 n ASP 436 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1qb3 n ASP 437 N -2.03 4.18 0.00 -1.12 9.92 -1.26 -3.63 116.55 122.61 1qb3 n ASP 437 Ca 0.00 -2.23 0.00 0.00 -0.53 0.00 0.00 54.79 52.03 1qb3 n ASP 437 Cb 0.00 -1.06 0.00 0.00 -0.64 0.00 0.00 41.12 39.42 1qb3 n ASP 437 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1qb3 n ASN 438 N 2.32 0.00 -4.25 -2.24 2.85 -1.26 -5.17 115.26 107.51 1qb3 n ASN 438 Ca 0.25 0.00 -0.14 0.00 -0.11 0.00 0.00 54.58 54.58 1qb3 n ASN 438 Cb 0.64 0.00 -0.10 0.00 1.24 0.00 0.00 39.78 41.55 1qb3 n ASN 438 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 1qb3 s TYR 439 N 0.00 1.29 -0.07 1.20 2.02 -1.24 -5.15 117.35 115.41 1qb3 s TYR 439 Ca 0.00 -1.24 0.05 0.00 -0.37 0.00 0.00 57.07 55.50 1qb3 s TYR 439 Cb 0.00 -0.71 -0.00 0.00 -0.40 0.00 0.00 41.96 40.85 1qb3 s TYR 439 CO 0.00 -0.46 -0.22 -2.00 -1.57 0.00 0.00 175.55 171.30 1qb3 s GLU 440 N -4.07 2.47 0.14 -0.62 2.12 -1.26 -1.87 118.70 115.60 1qb3 s GLU 440 Ca 0.35 -0.80 0.07 0.00 0.36 0.00 0.00 54.97 54.96 1qb3 s GLU 440 Cb 0.07 -2.01 -0.04 0.00 0.26 0.00 0.00 34.13 32.41 1qb3 s GLU 440 CO 0.11 0.26 -0.16 0.71 -0.54 0.00 0.00 175.26 175.64 1qb3 s TYR 441 N 0.09 1.59 0.05 5.30 2.02 0.57 -4.94 117.35 122.03 1qb3 s TYR 441 Ca -0.09 -0.51 -0.28 0.00 -0.37 0.00 0.00 57.07 55.82 1qb3 s TYR 441 Cb -0.15 -0.82 0.09 0.00 -0.40 0.00 0.00 41.96 40.69 1qb3 s TYR 441 CO 0.05 0.22 1.11 -0.98 -1.57 0.00 0.00 175.55 174.38 1qb3 s ARG 442 N -2.63 0.78 0.01 -0.62 1.04 -1.26 -0.25 118.95 116.02 1qb3 s ARG 442 Ca 0.11 -0.42 -0.02 0.00 -1.04 0.00 0.00 55.73 54.36 1qb3 s ARG 442 Cb -0.06 0.27 -0.01 0.00 -2.04 0.00 0.00 34.95 33.11 1qb3 s ARG 442 CO 0.04 -0.35 0.01 -3.38 -0.04 0.00 0.00 175.30 171.58 1qb3 s HIS 443 N -2.85 0.20 -0.19 5.89 -3.43 -1.26 -5.00 115.29 108.63 1qb3 s HIS 443 Ca 0.13 -0.41 -0.05 0.00 -0.80 0.00 0.00 55.06 53.92 1qb3 s HIS 443 Cb 0.01 -0.15 -0.02 0.00 -1.43 0.00 0.00 32.58 30.99 1qb3 s HIS 443 CO -0.01 -0.21 -0.01 0.08 -2.00 0.00 0.00 174.74 172.59 1qb3 s VAL 444 N -1.39 3.93 -0.37 -5.38 1.01 -1.26 -0.86 120.40 116.08 1qb3 s VAL 444 Ca -0.15 -0.32 -0.12 0.00 0.00 0.00 0.00 61.98 61.39 1qb3 s VAL 444 Cb -0.09 -2.77 0.02 0.00 0.00 0.00 0.00 36.38 33.54 1qb3 s VAL 444 CO -0.00 0.44 0.22 -0.32 0.00 0.00 0.00 175.10 175.43 1qb3 s MET 445 N 0.93 2.97 0.21 2.72 1.75 0.92 -4.95 119.30 123.85 1qb3 s MET 445 Ca 0.01 -0.99 -0.18 0.00 -1.25 0.00 0.00 55.69 53.28 1qb3 s MET 445 Cb -0.14 -3.76 -0.08 0.00 2.84 0.00 0.00 34.83 33.69 1qb3 s MET 445 CO 0.02 -0.65 0.69 -0.51 -0.65 0.00 0.00 175.02 173.91 1qb3 s LEU 446 N 1.60 4.32 -0.02 4.11 1.43 -1.26 -1.67 118.68 127.20 1qb3 s LEU 446 Ca 0.03 1.34 -0.30 0.00 -1.03 0.00 0.00 54.13 54.17 1qb3 s LEU 446 Cb -0.19 -3.55 -0.06 0.00 0.03 0.00 0.00 46.19 42.43 1qb3 s LEU 446 CO 0.07 0.03 1.48 -2.16 0.23 0.00 0.00 176.35 176.01 1qb3 s PRO 447 N -2.03 4.24 0.26 1.29 0.04 -1.26 -4.89 135.00 132.65 1qb3 s PRO 447 Ca 0.43 2.05 -0.04 0.00 0.04 0.00 0.00 61.00 63.47 1qb3 s PRO 447 Cb -0.16 -3.69 0.50 0.00 0.04 0.00 0.00 34.50 31.19 1qb3 s PRO 447 CO 0.20 -0.67 1.40 1.63 0.04 0.00 0.00 177.00 179.60 1qb3 n LYS 448 N 5.92 -0.08 -0.33 4.56 5.02 -1.26 -0.13 118.16 131.86 1qb3 n LYS 448 Ca 0.15 1.38 0.10 0.00 -2.02 0.00 0.00 58.31 57.91 1qb3 n LYS 448 Cb 0.43 -2.10 0.21 0.00 -0.02 0.00 0.00 35.03 33.55 1qb3 n LYS 448 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1qb3 n ALA 449 N -3.53 0.35 -0.05 7.82 0.00 -1.26 0.17 120.51 124.02 1qb3 n ALA 449 Ca 0.16 1.01 0.18 0.00 0.00 0.00 0.00 53.44 54.80 1qb3 n ALA 449 Cb 0.52 -0.68 0.63 0.00 0.00 0.00 0.00 19.45 19.93 1qb3 n ALA 449 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1qb3 h MET 450 N 0.00 0.13 -0.79 0.00 1.85 -0.90 -0.37 114.93 114.85 1qb3 h MET 450 Ca 0.51 -0.01 0.05 0.00 -0.61 0.00 0.00 59.70 59.65 1qb3 h MET 450 Cb 0.93 -0.03 -0.06 0.00 0.43 0.00 0.00 31.60 32.88 1qb3 h MET 450 CO -0.92 0.09 0.48 -0.07 -0.40 0.00 0.00 176.91 176.09 1qb3 h LEU 451 N 0.13 0.76 -2.55 3.39 3.38 0.16 -2.00 115.31 118.58 1qb3 h LEU 451 Ca 0.28 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.27 1qb3 h LEU 451 Cb 0.94 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1qb3 h LEU 451 CO -0.04 0.49 -0.02 0.11 0.09 0.00 0.00 178.44 179.08 1qb3 h LYS 452 N 0.89 0.00 -0.39 1.13 1.57 -1.06 -2.09 116.57 116.62 1qb3 h LYS 452 Ca 0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.12 1qb3 h LYS 452 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1qb3 h LYS 452 CO -0.16 0.02 0.00 1.33 -0.57 0.00 0.00 179.45 180.07 1qb3 n VAL 453 N -3.37 2.34 -3.67 0.50 0.24 -0.76 -4.94 118.33 108.66 1qb3 n VAL 453 Ca -0.02 -1.63 -0.36 0.00 -2.04 0.00 0.00 64.34 60.28 1qb3 n VAL 453 Cb 0.12 -0.19 -0.08 0.00 -1.47 0.00 0.00 33.84 32.22 1qb3 n VAL 453 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1qb3 s ILE 454 N -2.64 5.38 0.60 1.34 1.01 -0.79 -4.60 121.20 121.51 1qb3 s ILE 454 Ca 0.46 0.32 -0.18 0.00 0.00 0.00 0.00 60.65 61.25 1qb3 s ILE 454 Cb 0.35 -3.52 -0.11 0.00 0.01 0.00 0.00 42.46 39.19 1qb3 s ILE 454 CO 0.13 0.44 0.13 -2.65 0.00 0.00 0.00 174.94 172.98 1qb3 n PRO 455 N 3.41 0.21 0.20 2.79 -0.02 -1.26 -4.87 135.00 135.46 1qb3 n PRO 455 Ca -0.15 0.09 0.13 0.00 -2.02 0.00 0.00 63.50 61.55 1qb3 n PRO 455 Cb 0.52 -1.36 0.32 0.00 -0.02 0.00 0.00 33.50 32.96 1qb3 n PRO 455 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1qb3 h SER 456 N -0.08 0.00 0.33 2.55 4.64 -1.96 -2.92 113.55 116.11 1qb3 h SER 456 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1qb3 h SER 456 Cb 1.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.49 1qb3 h SER 456 CO 0.42 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.48 1qb3 n ASP 457 N -2.90 0.00 -0.94 4.97 5.75 -1.26 -1.90 116.55 120.27 1qb3 n ASP 457 Ca 0.04 -0.30 0.08 0.00 -0.01 0.00 0.00 54.79 54.60 1qb3 n ASP 457 Cb 0.46 -0.20 0.23 0.00 -1.03 0.00 0.00 41.12 40.58 1qb3 n ASP 457 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1qb3 n TYR 458 N -1.20 0.67 -4.41 2.11 4.02 -1.10 -4.91 117.16 112.34 1qb3 n TYR 458 Ca 0.14 -0.34 -0.27 0.00 -0.01 0.00 0.00 57.90 57.43 1qb3 n TYR 458 Cb 0.17 0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 39.37 1qb3 n TYR 458 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1qb3 s PHE 459 N -1.33 2.28 -0.61 -0.72 0.08 -0.80 -2.27 117.98 114.62 1qb3 s PHE 459 Ca 0.34 -0.37 -0.19 0.00 0.12 0.00 0.00 56.93 56.83 1qb3 s PHE 459 Cb 0.18 -1.15 0.10 0.00 -0.57 0.00 0.00 43.02 41.58 1qb3 s PHE 459 CO 0.24 0.46 0.74 1.21 -0.10 0.00 0.00 175.22 177.76 1qb3 s ASN 460 N -2.54 6.19 0.54 1.36 3.84 0.16 -4.56 114.94 119.93 1qb3 s ASN 460 Ca 0.19 -1.40 0.30 0.00 0.21 0.00 0.00 52.86 52.15 1qb3 s ASN 460 Cb -0.08 -2.32 1.46 0.00 -0.55 0.00 0.00 41.25 39.76 1qb3 s ASN 460 CO 0.09 -1.15 1.93 0.77 -2.79 0.00 0.00 177.10 175.94 1qb3 h SER 461 N 9.22 0.00 1.49 -4.21 4.64 -1.90 0.18 113.55 122.96 1qb3 h SER 461 Ca -0.29 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.02 1qb3 h SER 461 Cb 1.08 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1qb3 h SER 461 CO 1.11 0.00 -0.07 -0.33 -0.87 0.00 0.00 176.83 176.67 1qb3 h GLU 462 N 0.00 0.00 0.00 4.77 3.07 -1.96 -3.38 114.58 117.08 1qb3 h GLU 462 Ca 0.36 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 1qb3 h GLU 462 Cb 1.47 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.38 1qb3 h GLU 462 CO -0.00 0.07 -0.90 0.28 -1.40 0.00 0.00 179.01 177.05 1qb3 n VAL 463 N -3.14 0.00 -0.25 3.13 0.31 -0.64 -5.03 118.33 112.71 1qb3 n VAL 463 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1qb3 n VAL 463 Cb 0.46 -0.72 0.00 0.00 -0.91 0.00 0.00 33.84 32.66 1qb3 n VAL 463 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1qb3 n GLY 464 N 2.97 0.72 4.01 2.92 0.00 0.54 -5.06 105.19 111.29 1qb3 n GLY 464 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1qb3 n GLY 464 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qb3 s THR 465 N -2.31 2.11 0.19 2.61 -4.23 -1.25 -4.88 115.64 107.87 1qb3 s THR 465 Ca 0.00 -1.08 -0.28 0.00 -1.18 0.00 0.00 61.69 59.15 1qb3 s THR 465 Cb 0.00 -2.18 -0.08 0.00 1.34 0.00 0.00 72.50 71.58 1qb3 s THR 465 CO 0.00 0.00 0.87 -0.76 -0.54 0.00 0.00 174.62 174.19 1qb3 s LEU 466 N -4.59 4.61 1.05 4.79 1.43 -1.26 -0.66 118.68 124.04 1qb3 s LEU 466 Ca 0.57 1.80 -0.15 0.00 -1.03 0.00 0.00 54.13 55.32 1qb3 s LEU 466 Cb -0.05 -3.48 0.21 0.00 0.03 0.00 0.00 46.19 42.91 1qb3 s LEU 466 CO 0.36 0.15 1.12 0.00 0.23 0.00 0.00 176.35 178.21 1qb3 s ARG 467 N -1.00 -0.01 0.36 1.70 1.70 -0.96 -4.66 118.95 116.09 1qb3 s ARG 467 Ca 0.40 0.21 -0.28 0.00 -0.47 0.00 0.00 55.73 55.58 1qb3 s ARG 467 Cb -0.24 -1.71 -0.11 0.00 -0.57 0.00 0.00 34.95 32.31 1qb3 s ARG 467 CO 0.29 -2.96 1.44 0.42 -1.08 0.00 0.00 175.30 173.41 1qb3 s ILE 468 N -3.10 2.25 -0.09 4.99 -1.09 -1.26 -4.93 121.20 117.97 1qb3 s ILE 468 Ca 0.67 0.25 0.02 0.00 -2.23 0.00 0.00 60.65 59.36 1qb3 s ILE 468 Cb -0.14 -3.16 -0.02 0.00 -1.58 0.00 0.00 42.46 37.56 1qb3 s ILE 468 CO 0.56 0.06 -0.13 -0.76 -1.23 0.00 0.00 174.94 173.44 1qb3 s LEU 469 N -1.94 2.78 0.88 2.97 1.43 -1.26 -5.10 118.68 118.44 1qb3 s LEU 469 Ca 0.52 -0.23 -0.12 0.00 -1.03 0.00 0.00 54.13 53.27 1qb3 s LEU 469 Cb -0.45 -1.60 0.12 0.00 0.03 0.00 0.00 46.19 44.30 1qb3 s LEU 469 CO 0.60 0.26 1.10 0.42 0.23 0.00 0.00 176.35 178.96 1qb3 s THR 470 N -0.24 2.63 0.13 5.49 -4.23 -1.26 -4.59 115.64 113.57 1qb3 s THR 470 Ca 0.01 0.20 -0.16 0.00 -1.18 0.00 0.00 61.69 60.57 1qb3 s THR 470 Cb -0.13 -2.79 -0.01 0.00 1.34 0.00 0.00 72.50 70.91 1qb3 s THR 470 CO 0.03 -0.27 1.67 -0.08 -0.54 0.00 0.00 174.62 175.43 1qb3 h GLU 471 N -1.46 0.61 -0.77 3.99 4.81 -1.92 -1.72 114.58 118.12 1qb3 h GLU 471 Ca -0.50 -0.12 0.13 0.00 -0.13 0.00 0.00 59.36 58.75 1qb3 h GLU 471 Cb 1.29 -0.09 -0.09 0.00 0.63 0.00 0.00 28.75 30.49 1qb3 h GLU 471 CO 0.57 0.59 0.35 -0.44 -0.73 0.00 0.00 179.01 179.36 1qb3 h ASP 472 N 0.51 0.40 0.68 1.04 3.32 -1.93 0.12 116.42 120.56 1qb3 h ASP 472 Ca 0.13 0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.24 1qb3 h ASP 472 Cb 0.22 0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.81 1qb3 h ASP 472 CO -0.01 0.18 -0.36 -0.33 -1.72 0.00 0.00 179.24 177.00 1qb3 h GLU 473 N 0.53 -0.92 0.00 3.56 5.08 -1.59 0.93 114.58 122.17 1qb3 h GLU 473 Ca 0.42 0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.83 1qb3 h GLU 473 Cb 0.58 0.21 -0.00 0.00 0.50 0.00 0.00 28.75 30.04 1qb3 h GLU 473 CO -0.36 -0.61 -0.02 0.11 -1.00 0.00 0.00 179.01 177.13 1qb3 h TRP 474 N -0.95 0.00 -0.12 4.33 5.08 -0.89 0.56 115.95 123.97 1qb3 h TRP 474 Ca -0.09 0.00 -0.18 0.00 1.08 0.00 0.00 58.89 59.70 1qb3 h TRP 474 Cb 0.74 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.90 1qb3 h TRP 474 CO 0.02 0.02 -0.68 0.00 -1.28 0.00 0.00 178.44 176.52 1qb3 h ARG 475 N 0.00 0.48 -0.97 0.12 2.47 -0.53 -2.89 114.38 113.06 1qb3 h ARG 475 Ca -0.00 -0.37 0.06 0.00 -1.26 0.00 0.00 59.98 58.41 1qb3 h ARG 475 Cb 0.10 0.07 -0.06 0.00 -1.65 0.00 0.00 29.97 28.43 1qb3 h ARG 475 CO 0.00 0.99 0.62 0.78 0.56 0.00 0.00 179.97 182.93 1qb3 h GLY 476 N 1.15 1.46 1.29 0.04 0.00 0.27 -0.88 103.07 106.40 1qb3 h GLY 476 Ca -0.02 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1qb3 h GLY 476 CO 0.12 0.34 0.00 1.04 0.00 0.00 0.00 176.54 178.04 1qb3 n LEU 477 N -4.52 0.00 0.00 3.11 4.77 -0.90 -4.82 117.00 114.64 1qb3 n LEU 477 Ca 0.14 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 1qb3 n LEU 477 Cb 0.17 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1qb3 n LEU 477 CO 0.32 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 1qb3 n GLY 478 N -0.06 0.72 3.72 -0.72 0.00 -0.33 -4.66 105.19 103.86 1qb3 n GLY 478 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1qb3 n GLY 478 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qb3 s ILE 479 N -2.66 4.05 -0.03 -0.61 1.01 -1.10 -4.87 121.20 116.99 1qb3 s ILE 479 Ca 0.00 1.54 -0.00 0.00 0.00 0.00 0.00 60.65 62.19 1qb3 s ILE 479 Cb 0.00 -3.99 0.03 0.00 0.01 0.00 0.00 42.46 38.51 1qb3 s ILE 479 CO 0.00 0.16 0.01 0.42 0.00 0.00 0.00 174.94 175.53 1qb3 s THR 480 N 0.73 0.09 0.23 2.92 -4.23 -1.26 -4.17 115.64 109.96 1qb3 s THR 480 Ca 0.56 0.16 -0.15 0.00 -1.18 0.00 0.00 61.69 61.08 1qb3 s THR 480 Cb -0.29 -0.22 0.01 0.00 1.34 0.00 0.00 72.50 73.33 1qb3 s THR 480 CO 0.31 0.14 0.51 0.00 -0.54 0.00 0.00 174.62 175.04 1qb3 s GLN 481 N 1.22 1.52 1.39 3.99 -2.07 -1.26 -5.12 119.66 119.32 1qb3 s GLN 481 Ca -0.07 -1.12 -0.21 0.00 -1.82 0.00 0.00 55.36 52.14 1qb3 s GLN 481 Cb -0.13 0.50 0.35 0.00 -1.09 0.00 0.00 33.01 32.64 1qb3 s GLN 481 CO -0.02 -0.64 0.86 -1.13 -1.32 0.00 0.00 175.29 173.03 1qb3 n SER 482 N -0.37 -3.59 -4.77 12.60 3.41 -1.26 -4.98 113.62 114.66 1qb3 n SER 482 Ca -0.04 -0.69 -0.31 0.00 -0.26 0.00 0.00 58.87 57.57 1qb3 n SER 482 Cb 0.62 -1.05 0.09 0.00 -0.26 0.00 0.00 64.21 63.61 1qb3 n SER 482 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1qb3 s LEU 483 N -7.22 2.99 -0.23 1.04 1.43 -1.26 -4.13 118.68 111.30 1qb3 s LEU 483 Ca 0.66 1.77 0.00 0.00 -1.03 0.00 0.00 54.13 55.53 1qb3 s LEU 483 Cb -0.15 -4.48 0.00 0.00 0.03 0.00 0.00 46.19 41.59 1qb3 s LEU 483 CO 0.58 -2.00 0.00 0.61 0.23 0.00 0.00 176.35 175.76 1qb3 n GLY 484 N -1.31 0.49 3.72 -3.19 0.00 -1.26 -4.99 105.19 98.65 1qb3 n GLY 484 Ca 0.09 -0.17 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 1qb3 n GLY 484 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1qb3 s TRP 485 N -1.78 3.66 -0.15 1.61 0.52 -1.26 -5.05 118.94 116.49 1qb3 s TRP 485 Ca 0.00 1.51 -0.03 0.00 0.02 0.00 0.00 56.10 57.60 1qb3 s TRP 485 Cb 0.00 -2.95 -0.03 0.00 -1.15 0.00 0.00 33.47 29.34 1qb3 s TRP 485 CO 0.00 0.10 -0.04 -1.21 0.02 0.00 0.00 176.95 175.82 1qb3 s GLU 486 N 0.63 3.59 -0.22 4.98 2.02 -1.26 -4.93 118.70 123.51 1qb3 s GLU 486 Ca 0.44 -0.52 -0.23 0.00 0.02 0.00 0.00 54.97 54.67 1qb3 s GLU 486 Cb -0.20 -2.88 -0.01 0.00 0.10 0.00 0.00 34.13 31.14 1qb3 s GLU 486 CO 0.24 0.28 0.76 -1.58 0.02 0.00 0.00 175.26 174.98 1qb3 s HIS 487 N 0.25 3.34 0.17 1.61 5.65 -1.26 -5.05 115.29 120.00 1qb3 s HIS 487 Ca -0.03 1.07 0.10 0.00 0.25 0.00 0.00 55.06 56.45 1qb3 s HIS 487 Cb -0.14 -2.96 -0.04 0.00 -1.18 0.00 0.00 32.58 28.26 1qb3 s HIS 487 CO 0.03 -0.31 -0.21 1.52 -0.65 0.00 0.00 174.74 175.13 1qb3 s TYR 488 N 2.44 2.02 0.01 3.88 1.13 -1.26 -4.68 117.35 120.90 1qb3 s TYR 488 Ca 0.33 -0.42 -0.22 0.00 -1.41 0.00 0.00 57.07 55.35 1qb3 s TYR 488 Cb -0.16 -1.01 -0.17 0.00 -1.10 0.00 0.00 41.96 39.53 1qb3 s TYR 488 CO 0.09 0.40 1.27 0.93 -2.51 0.00 0.00 175.55 175.73 1qb3 h GLU 489 N 3.27 0.28 -3.88 -3.49 5.08 -1.96 -3.48 114.58 110.39 1qb3 h GLU 489 Ca -0.44 -0.17 -0.10 0.00 -1.00 0.00 0.00 59.36 57.65 1qb3 h GLU 489 Cb 1.21 0.02 -0.13 0.00 0.50 0.00 0.00 28.75 30.35 1qb3 h GLU 489 CO 0.49 0.75 -0.34 0.00 -1.00 0.00 0.00 179.01 178.92 1qb3 n HIS 491 N -0.18 2.67 -1.24 0.00 -0.00 -1.26 -5.09 115.22 110.11 1qb3 n HIS 491 Ca -0.09 -4.05 -0.40 0.00 0.46 0.00 0.00 57.72 53.64 1qb3 n HIS 491 Cb 0.63 -0.49 -0.01 0.00 -0.12 0.00 0.00 29.99 30.00 1qb3 n HIS 491 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1qb3 n ALA 492 N 1.31 -2.87 -1.95 1.57 0.00 -1.26 -4.95 120.51 112.37 1qb3 n ALA 492 Ca 0.26 0.17 -0.29 0.00 0.00 0.00 0.00 53.44 53.58 1qb3 n ALA 492 Cb 0.42 -1.41 0.20 0.00 0.00 0.00 0.00 19.45 18.66 1qb3 n ALA 492 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1qb3 s PRO 493 N -0.94 0.50 0.54 0.00 0.04 -1.26 -5.03 135.00 128.85 1qb3 s PRO 493 Ca 0.56 -0.63 -0.20 0.00 0.04 0.00 0.00 61.00 60.77 1qb3 s PRO 493 Cb -0.65 -1.89 -0.05 0.00 0.04 0.00 0.00 34.50 31.94 1qb3 s PRO 493 CO 0.58 -2.46 1.22 -1.21 0.04 0.00 0.00 177.00 175.16 1qb3 s GLU 494 N -5.86 3.25 0.54 4.56 2.02 -1.26 -4.91 118.70 117.04 1qb3 s GLU 494 Ca 0.76 1.87 0.40 0.00 0.02 0.00 0.00 54.97 58.01 1qb3 s GLU 494 Cb -0.02 -2.12 1.58 0.00 0.10 0.00 0.00 34.13 33.67 1qb3 s GLU 494 CO 0.53 -0.99 1.73 -1.00 0.02 0.00 0.00 175.26 175.54 1qb3 h PRO 495 N 1.33 0.02 -0.00 0.39 0.13 -2.05 -0.63 132.00 131.19 1qb3 h PRO 495 Ca -0.50 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1qb3 h PRO 495 Cb 1.28 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1qb3 h PRO 495 CO 0.57 0.01 -0.03 -2.39 -0.23 0.00 0.00 178.00 175.94 1qb3 n HIS 496 N -4.15 0.00 -3.61 1.56 1.44 -1.26 -4.60 115.22 104.60 1qb3 n HIS 496 Ca 0.31 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.62 1qb3 n HIS 496 Cb 1.46 -0.36 -0.11 0.00 0.12 0.00 0.00 29.99 31.11 1qb3 n HIS 496 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1qb3 s ILE 497 N -2.74 4.39 -0.02 0.61 1.01 -0.25 -5.08 121.20 119.12 1qb3 s ILE 497 Ca 0.22 -1.06 -0.11 0.00 0.00 0.00 0.00 60.65 59.71 1qb3 s ILE 497 Cb 0.20 -3.53 -0.05 0.00 0.01 0.00 0.00 42.46 39.09 1qb3 s ILE 497 CO 0.50 -0.31 0.32 -0.76 0.00 0.00 0.00 174.94 174.69 1qb3 s LEU 498 N 1.50 4.43 -0.13 2.97 1.02 -1.26 -4.72 118.68 122.48 1qb3 s LEU 498 Ca 0.02 0.78 -0.07 0.00 0.02 0.00 0.00 54.13 54.88 1qb3 s LEU 498 Cb -0.20 -2.51 -0.04 0.00 0.02 0.00 0.00 46.19 43.46 1qb3 s LEU 498 CO 0.05 0.32 0.11 -0.76 0.02 0.00 0.00 176.35 176.09 1qb3 s LEU 499 N -1.23 4.18 0.07 1.79 1.43 -1.26 -5.12 118.68 118.54 1qb3 s LEU 499 Ca 0.23 0.35 0.03 0.00 -1.03 0.00 0.00 54.13 53.71 1qb3 s LEU 499 Cb -0.15 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 44.02 1qb3 s LEU 499 CO 0.12 0.35 -0.10 -0.36 0.23 0.00 0.00 176.35 176.59 1qb3 s PHE 500 N -0.67 0.91 0.03 0.29 0.08 -1.26 -5.16 117.98 112.20 1qb3 s PHE 500 Ca 0.13 -0.55 -0.13 0.00 0.12 0.00 0.00 56.93 56.49 1qb3 s PHE 500 Cb -0.12 -0.52 0.02 0.00 -0.57 0.00 0.00 43.02 41.83 1qb3 s PHE 500 CO 0.02 -0.03 0.29 -1.59 -0.10 0.00 0.00 175.22 173.81 1qb3 s LYS 501 N -2.04 0.76 -0.01 0.44 -2.85 -1.26 -5.15 119.74 109.62 1qb3 s LYS 501 Ca -0.03 -0.45 -0.01 0.00 -1.00 0.00 0.00 55.97 54.48 1qb3 s LYS 501 Cb -0.07 0.33 0.00 0.00 -2.06 0.00 0.00 37.83 36.03 1qb3 s LYS 501 CO 0.00 -0.23 0.03 -0.98 0.10 0.00 0.00 175.35 174.28 1qb3 s ARG 502 N -2.25 0.05 0.16 1.78 1.70 -1.26 -5.12 118.95 114.02 1qb3 s ARG 502 Ca -0.07 0.03 -0.32 0.00 -0.47 0.00 0.00 55.73 54.90 1qb3 s ARG 502 Cb -0.02 0.02 -0.10 0.00 -0.57 0.00 0.00 34.95 34.28 1qb3 s ARG 502 CO -0.02 -0.01 1.59 -1.25 -1.08 0.00 0.00 175.30 174.54 1qb3 s PRO 503 N -0.03 4.20 0.66 3.89 0.04 -1.26 -4.87 135.00 137.62 1qb3 s PRO 503 Ca -0.01 2.39 0.18 0.00 0.04 0.00 0.00 61.00 63.60 1qb3 s PRO 503 Cb -0.01 -3.17 0.94 0.00 0.04 0.00 0.00 34.50 32.30 1qb3 s PRO 503 CO 0.00 -0.63 1.52 -0.07 0.04 0.00 0.00 177.00 177.86 1qb3 h LEU 504 N 6.90 0.00 -4.08 -3.56 3.38 -2.07 -0.22 115.31 115.65 1qb3 h LEU 504 Ca -0.43 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 56.92 1qb3 h LEU 504 Cb 1.20 0.00 -0.37 0.00 0.09 0.00 0.00 40.66 41.58 1qb3 h LEU 504 CO 0.92 0.00 -0.09 -0.46 0.09 0.00 0.00 178.44 178.90 1qb3 n ASN 505 N -2.81 6.02 0.24 -0.43 6.94 -1.26 -4.71 115.26 119.25 1qb3 n ASN 505 Ca 0.01 -3.77 0.11 0.00 -0.02 0.00 0.00 54.58 50.91 1qb3 n ASN 505 Cb 0.71 -0.63 0.61 0.00 -2.36 0.00 0.00 39.78 38.10 1qb3 n ASN 505 CO 0.00 0.00 0.00 0.10 -1.03 0.00 0.00 177.26 176.33 1qb3 h TYR 506 N 2.27 0.00 -0.17 -2.53 -0.00 -1.40 -2.80 116.97 112.34 1qb3 h TYR 506 Ca 0.45 0.00 0.05 0.00 -0.00 0.00 0.00 58.73 59.24 1qb3 h TYR 506 Cb 1.06 0.00 -0.06 0.00 -0.00 0.00 0.00 36.73 37.73 1qb3 h TYR 506 CO 1.06 0.18 -0.27 0.93 -0.00 0.00 0.00 178.16 180.06 1qb3 h GLU 507 N 0.00 -0.31 0.16 0.10 4.39 -1.85 -2.86 114.58 114.21 1qb3 h GLU 507 Ca -0.00 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.71 1qb3 h GLU 507 Cb 0.51 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 1qb3 h GLU 507 CO 0.02 -0.21 -0.08 0.00 -1.16 0.00 0.00 179.01 177.59 1qb3 h ALA 508 N 0.61 -1.04 -1.48 3.43 0.00 -1.89 -1.08 119.26 117.81 1qb3 h ALA 508 Ca 0.11 -0.05 0.47 0.00 0.00 0.00 0.00 54.91 55.44 1qb3 h ALA 508 Cb 0.49 0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.26 1qb3 h ALA 508 CO -0.35 -1.02 1.01 0.39 0.00 0.00 0.00 179.25 179.28 1qb3 n GLU 509 N -2.60 -0.02 0.13 0.00 1.02 -1.18 0.30 120.64 118.29 1qb3 n GLU 509 Ca -0.03 1.07 0.05 0.00 -0.02 0.00 0.00 57.16 58.23 1qb3 n GLU 509 Cb 0.09 -2.25 0.03 0.00 -0.02 0.00 0.00 31.44 29.29 1qb3 n GLU 509 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1qb3 h LEU 510 N 0.00 0.00 0.00 -4.62 5.85 -1.36 -2.92 115.31 112.26 1qb3 h LEU 510 Ca 0.82 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 59.49 1qb3 h LEU 510 Cb 2.93 0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.97 1qb3 h LEU 510 CO -0.25 0.36 -0.22 -0.09 -0.34 0.00 0.00 178.44 177.91 1qb3 h ARG 511 N 0.00 0.15 -0.93 1.25 2.43 0.59 -3.09 114.38 114.77 1qb3 h ARG 511 Ca -0.03 -0.16 0.24 0.00 -0.81 0.00 0.00 59.98 59.22 1qb3 h ARG 511 Cb 1.30 0.04 -0.13 0.00 -0.42 0.00 0.00 29.97 30.77 1qb3 h ARG 511 CO 0.04 0.91 0.45 0.00 -1.51 0.00 0.00 179.97 179.86 1qb3 h ALA 512 N 0.24 1.58 -0.31 2.80 0.00 -0.86 -1.52 119.26 121.19 1qb3 h ALA 512 Ca -0.03 0.16 -0.63 0.00 0.00 0.00 0.00 54.91 54.41 1qb3 h ALA 512 Cb 0.98 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.84 1qb3 h ALA 512 CO 0.04 -0.36 2.50 0.00 0.00 0.00 0.00 179.25 181.43 1qb3 n ALA 513 N -2.44 7.04 0.00 0.00 0.00 -1.11 -5.12 120.51 118.88 1qb3 n ALA 513 Ca 0.24 -3.53 0.00 0.00 0.00 0.00 0.00 53.44 50.15 1qb3 n ALA 513 Cb 0.72 -2.90 0.00 0.00 0.00 0.00 0.00 19.45 17.27 1qb3 n ALA 513 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13