#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqe s SER 423 N 0.00 1.12 -0.27 1.61 0.01 -1.26 -5.13 113.70 109.79 2cqe s SER 423 Ca 0.00 0.09 -0.27 0.00 1.31 0.00 0.00 55.95 57.08 2cqe s SER 423 Cb 0.00 0.08 0.17 0.00 0.21 0.00 0.00 66.02 66.48 2cqe s SER 423 CO 0.00 -0.27 1.27 -0.55 0.41 0.00 0.00 173.24 174.10 2cqe s SER 424 N 2.24 -0.18 -0.30 2.44 0.15 -1.26 -5.08 113.70 111.71 2cqe s SER 424 Ca 0.04 0.28 0.12 0.00 0.70 0.00 0.00 55.95 57.09 2cqe s SER 424 Cb -0.13 0.27 0.36 0.00 -1.71 0.00 0.00 66.02 64.81 2cqe s SER 424 CO -0.06 -0.10 1.49 0.61 1.20 0.00 0.00 173.24 176.38 2cqe n GLY 425 N 1.27 1.88 2.33 9.45 0.00 -1.26 -4.97 105.19 113.90 2cqe n GLY 425 Ca -0.08 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.45 2cqe n GLY 425 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2cqe n SER 426 N -1.38 7.31 -4.68 1.61 7.64 -1.26 -4.98 113.62 117.88 2cqe n SER 426 Ca -0.19 -3.79 -0.43 0.00 1.01 0.00 0.00 58.87 55.48 2cqe n SER 426 Cb 0.86 -0.90 -0.02 0.00 -1.01 0.00 0.00 64.21 63.14 2cqe n SER 426 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2cqe s SER 427 N -2.04 7.20 0.00 6.43 0.01 -1.26 -4.84 113.70 119.20 2cqe s SER 427 Ca 0.62 1.48 0.00 0.00 1.31 0.00 0.00 55.95 59.36 2cqe s SER 427 Cb 0.49 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 64.17 2cqe s SER 427 CO -0.03 -0.52 0.00 0.61 0.41 0.00 0.00 173.24 173.71 2cqe n GLY 428 N 3.17 -0.56 3.53 3.44 0.00 -1.26 -4.95 105.19 108.56 2cqe n GLY 428 Ca 0.10 -1.59 -0.43 0.00 0.00 0.00 0.00 46.02 44.10 2cqe n GLY 428 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2cqe n GLU 429 N -0.17 0.95 -4.28 1.61 4.07 -1.26 -5.00 120.64 116.57 2cqe n GLU 429 Ca 0.00 0.34 -0.18 0.00 -0.06 0.00 0.00 57.16 57.26 2cqe n GLU 429 Cb 0.00 -1.71 -0.11 0.00 -0.06 0.00 0.00 31.44 29.56 2cqe n GLU 429 CO 0.00 0.00 0.00 -0.48 -0.06 0.00 0.00 177.13 176.59 2cqe s LEU 430 N 0.84 2.46 0.00 4.31 -0.00 -1.26 -5.12 118.68 119.90 2cqe s LEU 430 Ca 0.62 -0.89 0.00 0.00 -0.00 0.00 0.00 54.13 53.86 2cqe s LEU 430 Cb -0.64 -0.59 0.00 0.00 -0.00 0.00 0.00 46.19 44.96 2cqe s LEU 430 CO 0.58 -0.16 0.00 -0.81 -0.00 0.00 0.00 176.35 175.96 2cqe n PRO 431 N 0.20 0.00 -1.72 1.48 -0.04 -1.26 -4.76 135.00 128.90 2cqe n PRO 431 Ca -0.13 0.00 -0.61 0.00 -0.04 0.00 0.00 63.50 62.72 2cqe n PRO 431 Cb 0.58 -0.23 -0.08 0.00 -0.04 0.00 0.00 33.50 33.73 2cqe n PRO 431 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2cqe n LYS 432 N 0.00 0.76 0.05 0.54 4.76 -1.26 -4.84 118.16 118.17 2cqe n LYS 432 Ca 0.00 0.28 -0.12 0.00 -2.87 0.00 0.00 58.31 55.60 2cqe n LYS 432 Cb 0.00 -1.90 -0.13 0.00 -1.84 0.00 0.00 35.03 31.16 2cqe n LYS 432 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 2cqe h LYS 433 N 6.44 0.12 -4.51 1.97 1.79 -1.29 -3.48 116.57 117.61 2cqe h LYS 433 Ca -0.46 -0.20 -0.40 0.00 -2.18 0.00 0.00 60.65 57.42 2cqe h LYS 433 Cb 1.34 0.07 0.07 0.00 -1.58 0.00 0.00 32.23 32.13 2cqe h LYS 433 CO 0.96 0.97 -0.60 -2.13 -1.08 0.00 0.00 179.45 177.57 2cqe n ARG 434 N -3.35 -5.14 -4.54 3.15 3.00 -1.25 -4.99 116.66 103.54 2cqe n ARG 434 Ca -0.10 0.88 -0.26 0.00 -0.00 0.00 0.00 57.85 58.37 2cqe n ARG 434 Cb 1.01 -5.71 -0.09 0.00 0.00 0.00 0.00 32.46 27.67 2cqe n ARG 434 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 2cqe s GLU 435 N -5.74 1.91 -0.13 -0.14 2.02 -1.26 -4.85 118.70 110.51 2cqe s GLU 435 Ca 0.33 -2.16 -0.29 0.00 0.02 0.00 0.00 54.97 52.87 2cqe s GLU 435 Cb -0.14 -0.81 -0.02 0.00 0.10 0.00 0.00 34.13 33.26 2cqe s GLU 435 CO 0.41 -0.40 1.24 -1.17 0.02 0.00 0.00 175.26 175.36 2cqe s LEU 436 N -3.62 4.21 0.23 1.80 2.96 -1.26 -0.19 118.68 122.81 2cqe s LEU 436 Ca 0.24 1.73 -0.32 0.00 -0.22 0.00 0.00 54.13 55.56 2cqe s LEU 436 Cb 0.04 -3.55 -0.12 0.00 0.50 0.00 0.00 46.19 43.06 2cqe s LEU 436 CO 0.13 -0.70 1.69 0.00 -1.32 0.00 0.00 176.35 176.16 2cqe n LYS 438 N 3.48 0.64 -0.01 0.00 4.01 -1.26 -3.18 118.16 121.84 2cqe n LYS 438 Ca 0.14 0.00 -0.01 0.00 -0.51 0.00 0.00 58.31 57.93 2cqe n LYS 438 Cb 0.35 -1.40 -0.01 0.00 -0.51 0.00 0.00 35.03 33.47 2cqe n LYS 438 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 2cqe n PHE 439 N -0.90 0.00 0.05 2.13 3.72 -1.26 -4.66 117.46 116.53 2cqe n PHE 439 Ca 0.12 0.00 0.20 0.00 -0.05 0.00 0.00 57.45 57.72 2cqe n PHE 439 Cb 0.06 -0.05 0.72 0.00 -0.94 0.00 0.00 39.48 39.27 2cqe n PHE 439 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 2cqe h TYR 440 N -0.00 0.00 -1.34 1.38 3.20 -1.77 -1.22 116.97 117.22 2cqe h TYR 440 Ca -0.03 0.00 0.39 0.00 3.14 0.00 0.00 58.73 62.23 2cqe h TYR 440 Cb 1.04 0.00 -0.08 0.00 1.54 0.00 0.00 36.73 39.24 2cqe h TYR 440 CO 0.00 0.00 0.93 0.82 -1.64 0.00 0.00 178.16 178.27 2cqe h ILE 441 N 0.00 0.30 0.00 1.81 2.04 -1.82 0.88 117.51 120.72 2cqe h ILE 441 Ca 0.22 -0.03 -0.32 0.00 1.00 0.00 0.00 64.86 65.73 2cqe h ILE 441 Cb 0.98 0.20 -0.06 0.00 -0.74 0.00 0.00 36.82 37.19 2cqe h ILE 441 CO -0.00 0.02 -2.22 0.35 0.00 0.00 0.00 178.15 176.30 2cqe n THR 442 N -4.32 1.19 0.00 -0.27 -2.24 -0.48 -5.01 114.28 103.15 2cqe n THR 442 Ca 0.31 -0.75 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 2cqe n THR 442 Cb 1.36 -0.50 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 2cqe n THR 442 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cqe n GLY 443 N 1.88 1.25 3.31 3.38 0.00 0.30 -5.07 105.19 110.26 2cqe n GLY 443 Ca -0.28 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.27 2cqe n GLY 443 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2cqe s PHE 444 N -2.01 3.36 -0.23 1.61 2.19 -1.24 -4.92 117.98 116.74 2cqe s PHE 444 Ca 0.00 -1.43 -0.01 0.00 0.33 0.00 0.00 56.93 55.81 2cqe s PHE 444 Cb 0.00 -3.81 0.07 0.00 -1.31 0.00 0.00 43.02 37.97 2cqe s PHE 444 CO 0.00 -1.02 0.02 0.00 1.83 0.00 0.00 175.22 176.06 2cqe n ALA 446 N 4.91 -0.24 -2.13 0.00 0.00 -1.26 -3.82 120.51 117.96 2cqe n ALA 446 Ca -0.08 0.32 -0.41 0.00 0.00 0.00 0.00 53.44 53.27 2cqe n ALA 446 Cb 0.45 0.25 -0.03 0.00 0.00 0.00 0.00 19.45 20.13 2cqe n ALA 446 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2cqe s ARG 447 N -3.95 3.07 0.00 0.00 0.52 -1.26 -4.89 118.95 112.44 2cqe s ARG 447 Ca -0.04 0.84 0.00 0.00 -0.52 0.00 0.00 55.73 56.01 2cqe s ARG 447 Cb 0.04 -4.24 0.00 0.00 0.52 0.00 0.00 34.95 31.27 2cqe s ARG 447 CO 0.23 -2.20 0.00 0.00 0.02 0.00 0.00 175.30 173.36 2cqe n ALA 448 N 10.97 0.00 1.66 2.13 0.00 -1.25 -3.56 120.51 130.46 2cqe n ALA 448 Ca 0.19 -0.01 0.15 0.00 0.00 0.00 0.00 53.44 53.77 2cqe n ALA 448 Cb 0.49 0.00 0.79 0.00 0.00 0.00 0.00 19.45 20.73 2cqe n ALA 448 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2cqe n GLU 449 N -0.99 0.80 -0.53 0.00 2.13 -1.26 -3.21 120.64 117.58 2cqe n GLU 449 Ca 0.00 -0.12 0.04 0.00 0.66 0.00 0.00 57.16 57.74 2cqe n GLU 449 Cb 0.00 -1.50 0.21 0.00 0.27 0.00 0.00 31.44 30.42 2cqe n GLU 449 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2cqe n ASN 450 N -1.00 2.88 -4.63 4.31 4.13 -1.26 -4.99 115.26 114.70 2cqe n ASN 450 Ca 0.19 -3.40 -0.43 0.00 1.68 0.00 0.00 54.58 52.61 2cqe n ASN 450 Cb 0.20 -0.56 -0.02 0.00 -1.54 0.00 0.00 39.78 37.86 2cqe n ASN 450 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2cqe n PRO 452 N 7.14 0.49 -2.92 0.00 -0.04 -1.26 -4.74 135.00 133.67 2cqe n PRO 452 Ca 0.12 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.44 2cqe n PRO 452 Cb 0.48 -1.37 -0.02 0.00 -0.04 0.00 0.00 33.50 32.55 2cqe n PRO 452 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2cqe n TYR 453 N -0.87 -0.18 -3.92 0.54 4.02 -1.26 -0.85 117.16 114.64 2cqe n TYR 453 Ca 0.09 -1.10 -0.31 0.00 -0.01 0.00 0.00 57.90 56.57 2cqe n TYR 453 Cb 0.04 -0.17 -0.04 0.00 -0.02 0.00 0.00 39.34 39.15 2cqe n TYR 453 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 176.86 174.21 2cqe s MET 454 N -2.91 3.44 0.00 -0.72 -1.94 0.73 -4.85 119.30 113.04 2cqe s MET 454 Ca 0.06 -0.45 0.00 0.00 -1.71 0.00 0.00 55.69 53.59 2cqe s MET 454 Cb -0.00 -3.04 0.00 0.00 2.01 0.00 0.00 34.83 33.80 2cqe s MET 454 CO 0.04 0.61 0.00 0.72 -0.01 0.00 0.00 175.02 176.38 2cqe n HIS 455 N 0.26 0.00 -0.05 -0.03 8.25 -1.26 -3.25 115.22 119.13 2cqe n HIS 455 Ca -0.05 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.40 2cqe n HIS 455 Cb 0.51 0.04 -0.00 0.00 1.12 0.00 0.00 29.99 31.66 2cqe n HIS 455 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2cqe h GLY 456 N 0.00 0.00 -0.97 -1.41 0.00 -1.97 -3.35 103.07 95.38 2cqe h GLY 456 Ca 0.00 0.00 0.33 0.00 0.00 0.00 0.00 47.33 47.66 2cqe h GLY 456 CO 0.00 0.00 0.26 1.22 0.00 0.00 0.00 176.54 178.02 2cqe n ASP 457 N -4.74 0.10 -4.61 0.19 9.92 -1.26 -2.39 116.55 113.76 2cqe n ASP 457 Ca -0.01 1.62 -0.55 0.00 -0.53 0.00 0.00 54.79 55.33 2cqe n ASP 457 Cb 0.03 -0.69 -0.07 0.00 -0.64 0.00 0.00 41.12 39.76 2cqe n ASP 457 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 2cqe n PHE 458 N -5.32 1.50 -2.26 1.24 7.35 -1.26 -4.59 117.46 114.13 2cqe n PHE 458 Ca 0.29 0.70 -0.40 0.00 -0.76 0.00 0.00 57.45 57.28 2cqe n PHE 458 Cb 0.98 -2.32 -0.03 0.00 0.35 0.00 0.00 39.48 38.47 2cqe n PHE 458 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 2cqe s PRO 459 N 1.10 4.44 0.53 -7.13 0.04 -1.26 -2.21 135.00 130.51 2cqe s PRO 459 Ca 0.89 2.04 -0.22 0.00 0.04 0.00 0.00 61.00 63.75 2cqe s PRO 459 Cb -1.05 -3.09 -0.05 0.00 0.04 0.00 0.00 34.50 30.36 2cqe s PRO 459 CO 0.53 -0.05 1.34 0.00 0.04 0.00 0.00 177.00 178.86 2cqe h LYS 461 N 1.53 0.00 -0.58 0.00 3.64 -1.94 -3.34 116.57 115.88 2cqe h LYS 461 Ca -0.51 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 58.96 2cqe h LYS 461 Cb 1.29 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 33.01 2cqe h LYS 461 CO 0.58 0.00 -0.45 -0.07 -2.27 0.00 0.00 179.45 177.24 2cqe h LEU 462 N -0.13 -1.54 -1.46 5.20 3.38 -1.94 0.65 115.31 119.48 2cqe h LEU 462 Ca 0.00 0.25 0.42 0.00 0.09 0.00 0.00 57.88 58.64 2cqe h LEU 462 Cb 0.00 0.69 -0.06 0.00 0.09 0.00 0.00 40.66 41.39 2cqe h LEU 462 CO 0.00 -0.34 1.32 0.22 0.09 0.00 0.00 178.44 179.73 2cqe h TYR 463 N -0.23 0.00 0.00 1.13 3.20 -1.75 0.42 116.97 119.74 2cqe h TYR 463 Ca 0.17 0.00 -0.32 0.00 3.14 0.00 0.00 58.73 61.72 2cqe h TYR 463 Cb 0.56 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 38.78 2cqe h TYR 463 CO -0.72 0.00 -1.99 0.72 -1.64 0.00 0.00 178.16 174.52 2cqe n HIS 464 N -3.55 0.14 -0.35 -3.82 8.25 0.19 -1.29 115.22 114.80 2cqe n HIS 464 Ca 0.33 0.06 0.29 0.00 -0.26 0.00 0.00 57.72 58.14 2cqe n HIS 464 Cb 1.76 -0.89 0.49 0.00 1.12 0.00 0.00 29.99 32.48 2cqe n HIS 464 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2cqe n THR 465 N -4.33 -0.17 0.00 1.59 -2.24 0.74 -2.84 114.28 107.03 2cqe n THR 465 Ca -0.41 1.28 0.00 0.00 -2.27 0.00 0.00 64.05 62.65 2cqe n THR 465 Cb 0.76 -2.10 0.00 0.00 -2.10 0.00 0.00 70.33 66.89 2cqe n THR 465 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2cqe n THR 466 N -4.08 0.00 0.00 4.28 -2.24 -0.92 -5.07 114.28 106.25 2cqe n THR 466 Ca 0.29 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.07 2cqe n THR 466 Cb 1.14 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 2cqe n THR 466 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cqe n GLY 467 N 2.18 4.46 3.69 3.38 0.00 -0.41 -5.08 105.19 113.41 2cqe n GLY 467 Ca 0.00 -0.71 -0.28 0.00 0.00 0.00 0.00 46.02 45.02 2cqe n GLY 467 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2cqe s ASN 468 N -0.00 4.99 -0.07 1.61 -0.87 -1.19 -4.55 114.94 114.86 2cqe s ASN 468 Ca 0.00 -0.25 -0.02 0.00 -1.57 0.00 0.00 52.86 51.02 2cqe s ASN 468 Cb 0.00 -1.16 -0.04 0.00 -0.02 0.00 0.00 41.25 40.03 2cqe s ASN 468 CO 0.00 0.13 0.04 0.00 -2.57 0.00 0.00 177.10 174.70 2cqe h ILE 470 N 3.89 1.43 0.02 0.00 6.09 -2.00 -3.33 117.51 123.61 2cqe h ILE 470 Ca -0.51 -2.16 0.00 0.00 -1.37 0.00 0.00 64.86 60.83 2cqe h ILE 470 Cb 1.20 2.13 -0.01 0.00 0.47 0.00 0.00 36.82 40.61 2cqe h ILE 470 CO 0.57 0.63 -0.09 0.78 -3.07 0.00 0.00 178.15 176.96 2cqe h ASN 471 N 0.11 -0.28 0.00 2.19 4.21 -1.99 -3.49 115.58 116.33 2cqe h ASN 471 Ca -0.01 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.53 2cqe h ASN 471 Cb 1.18 0.10 0.00 0.00 -1.12 0.00 0.00 38.32 38.49 2cqe h ASN 471 CO 0.10 -0.10 0.00 0.61 -1.29 0.00 0.00 177.43 176.75 2cqe n GLY 472 N -1.08 0.60 0.13 2.83 0.00 -1.25 -4.87 105.19 101.54 2cqe n GLY 472 Ca -0.01 -1.63 -0.01 0.00 0.00 0.00 0.00 46.02 44.37 2cqe n GLY 472 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2cqe h ASP 473 N 0.00 0.00 -2.04 1.61 3.32 -1.95 -3.27 116.42 114.09 2cqe h ASP 473 Ca 0.00 0.00 -0.74 0.00 0.02 0.00 0.00 57.03 56.31 2cqe h ASP 473 Cb 0.00 0.00 -0.30 0.00 0.22 0.00 0.00 39.33 39.25 2cqe h ASP 473 CO 0.00 0.66 0.66 0.47 -1.72 0.00 0.00 179.24 179.31 2cqe n ASP 474 N -3.62 6.83 -4.79 6.45 9.92 -1.26 -5.03 116.55 125.06 2cqe n ASP 474 Ca -0.01 -3.76 -0.35 0.00 -0.53 0.00 0.00 54.79 50.14 2cqe n ASP 474 Cb 0.68 -0.97 -0.03 0.00 -0.64 0.00 0.00 41.12 40.16 2cqe n ASP 474 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2cqe n MET 476 N -0.71 0.97 -4.37 0.00 0.00 -1.26 -4.79 117.12 106.96 2cqe n MET 476 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 57.70 57.57 2cqe n MET 476 Cb 0.51 -1.05 -0.10 0.00 0.00 0.00 0.00 33.22 32.57 2cqe n MET 476 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 2cqe s PHE 477 N -1.90 1.88 0.13 3.17 0.08 -1.26 -4.72 117.98 115.35 2cqe s PHE 477 Ca 0.00 -0.48 -0.30 0.00 0.12 0.00 0.00 56.93 56.27 2cqe s PHE 477 Cb 0.00 -0.88 -0.06 0.00 -0.57 0.00 0.00 43.02 41.50 2cqe s PHE 477 CO 0.00 0.42 1.07 -1.12 -0.10 0.00 0.00 175.22 175.49 2cqe s SER 478 N -3.10 7.30 -0.19 1.36 0.01 -0.94 -4.80 113.70 113.34 2cqe s SER 478 Ca 0.21 1.97 0.16 0.00 1.31 0.00 0.00 55.95 59.60 2cqe s SER 478 Cb -0.04 -2.59 0.58 0.00 0.21 0.00 0.00 66.02 64.18 2cqe s SER 478 CO 0.08 -0.23 1.48 1.41 0.41 0.00 0.00 173.24 176.39 2cqe n HIS 479 N 2.87 1.14 -1.25 2.43 8.25 -1.26 -0.39 115.22 127.02 2cqe n HIS 479 Ca 0.04 -0.88 -0.31 0.00 -0.26 0.00 0.00 57.72 56.31 2cqe n HIS 479 Cb 0.47 -0.35 0.10 0.00 1.12 0.00 0.00 29.99 31.33 2cqe n HIS 479 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2cqe s ASP 480 N -1.77 4.30 -0.15 0.41 1.01 -1.26 -4.94 116.67 114.28 2cqe s ASP 480 Ca 0.44 1.94 -0.29 0.00 0.71 0.00 0.00 52.55 55.35 2cqe s ASP 480 Cb 0.36 -2.54 -0.03 0.00 1.01 0.00 0.00 42.92 41.71 2cqe s ASP 480 CO 0.10 -2.17 1.56 -2.16 0.21 0.00 0.00 175.17 172.71 2cqe s PRO 481 N -4.68 4.03 0.20 8.23 0.04 -1.26 -4.93 135.00 136.62 2cqe s PRO 481 Ca 0.64 1.86 -0.27 0.00 0.04 0.00 0.00 61.00 63.27 2cqe s PRO 481 Cb -0.19 -3.96 -0.16 0.00 0.04 0.00 0.00 34.50 30.22 2cqe s PRO 481 CO 0.54 -1.01 0.50 1.28 0.04 0.00 0.00 177.00 178.34 2cqe n LEU 482 N 7.58 -1.23 -4.42 -3.56 4.77 -1.26 -4.97 117.00 113.92 2cqe n LEU 482 Ca 0.17 1.09 -0.26 0.00 -0.03 0.00 0.00 56.01 56.97 2cqe n LEU 482 Cb 0.44 -0.92 -0.12 0.00 -2.33 0.00 0.00 43.42 40.50 2cqe n LEU 482 CO 0.62 -2.90 -0.53 0.42 -1.33 0.00 0.00 177.39 173.67 2cqe s THR 483 N -0.97 2.31 0.57 -5.08 -4.23 -1.26 -4.90 115.64 102.08 2cqe s THR 483 Ca 0.62 -2.04 0.45 0.00 -1.18 0.00 0.00 61.69 59.54 2cqe s THR 483 Cb -0.89 -2.11 0.66 0.00 1.34 0.00 0.00 72.50 71.50 2cqe s THR 483 CO 0.54 -0.15 1.56 1.05 -0.54 0.00 0.00 174.62 177.08 2cqe h GLU 484 N 3.16 0.00 0.00 3.99 4.11 -1.98 0.38 114.58 124.25 2cqe h GLU 484 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 2cqe h GLU 484 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2cqe h GLU 484 CO 0.49 0.00 0.00 -1.91 0.07 0.00 0.00 179.01 177.66 2cqe n GLU 485 N -3.84 0.00 -0.26 1.06 2.13 -1.26 -3.97 120.64 114.50 2cqe n GLU 485 Ca 0.39 0.22 0.05 0.00 0.66 0.00 0.00 57.16 58.48 2cqe n GLU 485 Cb 1.85 -0.72 0.15 0.00 0.27 0.00 0.00 31.44 32.99 2cqe n GLU 485 CO 0.00 0.00 0.00 1.79 -0.41 0.00 0.00 177.13 178.51 2cqe h THR 486 N 0.00 0.33 -1.05 6.31 1.35 -1.81 0.17 112.91 118.20 2cqe h THR 486 Ca 0.00 -0.03 0.42 0.00 -0.55 0.00 0.00 66.41 66.25 2cqe h THR 486 Cb 0.00 0.23 -0.17 0.00 -1.73 0.00 0.00 68.15 66.48 2cqe h THR 486 CO 0.00 0.02 0.59 -1.14 -0.25 0.00 0.00 175.52 174.74 2cqe n ARG 487 N -5.36 -0.05 -0.19 4.72 0.00 0.13 0.22 116.66 116.12 2cqe n ARG 487 Ca 0.13 1.34 -0.07 0.00 -0.00 0.00 0.00 57.85 59.25 2cqe n ARG 487 Cb 0.47 -2.44 0.08 0.00 0.00 0.00 0.00 32.46 30.57 2cqe n ARG 487 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2cqe h GLU 488 N 0.00 1.00 0.05 -0.14 4.39 -0.79 -3.21 114.58 115.88 2cqe h GLU 488 Ca 0.84 -0.27 0.01 0.00 0.34 0.00 0.00 59.36 60.28 2cqe h GLU 488 Cb 2.32 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 30.81 2cqe h GLU 488 CO -0.71 0.95 -0.45 -0.07 -1.16 0.00 0.00 179.01 177.57 2cqe h LEU 489 N 0.94 -1.37 -0.89 1.33 3.38 0.26 -2.46 115.31 116.50 2cqe h LEU 489 Ca 0.18 0.15 0.13 0.00 0.09 0.00 0.00 57.88 58.43 2cqe h LEU 489 Cb 0.46 0.51 -0.14 0.00 0.09 0.00 0.00 40.66 41.58 2cqe h LEU 489 CO 0.02 -0.45 -0.43 -0.07 0.09 0.00 0.00 178.44 177.59 2cqe h LEU 490 N -0.60 -1.57 -0.99 1.67 3.38 -1.54 0.47 115.31 116.14 2cqe h LEU 490 Ca 0.00 0.30 0.30 0.00 0.09 0.00 0.00 57.88 58.57 2cqe h LEU 490 Cb 0.62 0.77 -0.18 0.00 0.09 0.00 0.00 40.66 41.96 2cqe h LEU 490 CO -0.27 -0.29 0.11 0.47 0.09 0.00 0.00 178.44 178.55 2cqe n ASP 491 N -5.41 -0.03 0.11 -0.43 8.00 -0.94 0.84 116.55 118.69 2cqe n ASP 491 Ca 0.07 1.67 -0.19 0.00 0.71 0.00 0.00 54.79 57.05 2cqe n ASP 491 Cb 0.36 -0.65 -0.13 0.00 -0.02 0.00 0.00 41.12 40.68 2cqe n ASP 491 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2cqe h LYS 492 N 0.00 0.40 0.25 -1.24 1.63 -0.10 -3.22 116.57 114.29 2cqe h LYS 492 Ca 0.64 -0.62 -0.01 0.00 -0.85 0.00 0.00 60.65 59.81 2cqe h LYS 492 Cb 1.41 0.22 0.00 0.00 -0.60 0.00 0.00 32.23 33.27 2cqe h LYS 492 CO -0.90 1.28 -0.12 1.98 -3.45 0.00 0.00 179.45 178.24 2cqe h MET 493 N 0.14 -0.33 -1.00 1.90 4.05 0.34 -0.59 114.93 119.45 2cqe h MET 493 Ca -0.16 0.02 0.22 0.00 -0.28 0.00 0.00 59.70 59.50 2cqe h MET 493 Cb 1.96 0.07 -0.19 0.00 -0.80 0.00 0.00 31.60 32.65 2cqe h MET 493 CO 0.22 -0.22 -0.17 -0.07 0.23 0.00 0.00 176.91 176.90 2cqe h LEU 494 N -0.43 -0.80 -0.51 3.39 3.38 -0.00 0.74 115.31 121.07 2cqe h LEU 494 Ca -0.03 0.29 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 2cqe h LEU 494 Cb 0.26 0.58 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 2cqe h LEU 494 CO 0.06 -0.34 0.20 0.00 0.09 0.00 0.00 178.44 178.45 2cqe h ALA 495 N 2.00 0.66 -0.28 1.53 0.00 -1.58 -1.16 119.26 120.43 2cqe h ALA 495 Ca 0.51 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.30 2cqe h ALA 495 Cb 0.88 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2cqe h ALA 495 CO -1.00 0.28 0.09 0.22 0.00 0.00 0.00 179.25 178.83 2cqe h ASP 496 N 0.68 0.08 0.08 0.00 3.58 0.20 0.12 116.42 121.17 2cqe h ASP 496 Ca 0.17 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.65 2cqe h ASP 496 Cb 0.21 0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.29 2cqe h ASP 496 CO -0.01 0.08 -0.04 -0.78 -2.88 0.00 0.00 179.24 175.61 2cqe h ASP 497 N 0.21 -0.09 -0.85 2.28 3.58 -0.79 0.26 116.42 121.03 2cqe h ASP 497 Ca 0.13 0.00 0.18 0.00 0.42 0.00 0.00 57.03 57.76 2cqe h ASP 497 Cb 0.11 0.02 -0.16 0.00 1.72 0.00 0.00 39.33 41.02 2cqe h ASP 497 CO -0.14 -0.05 -0.14 0.00 -2.88 0.00 0.00 179.24 176.03 2cqe h ALA 498 N -1.93 0.68 0.70 -0.78 0.00 -1.26 -1.51 119.26 115.17 2cqe h ALA 498 Ca -0.01 0.31 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 2cqe h ALA 498 Cb 0.08 0.59 0.01 0.00 0.00 0.00 0.00 17.79 18.47 2cqe h ALA 498 CO 0.02 -0.43 -0.34 1.49 0.00 0.00 0.00 179.25 180.00 2cqe h GLU 499 N 0.02 -0.91 -5.71 0.00 4.81 -0.79 -3.38 114.58 108.63 2cqe h GLU 499 Ca 0.43 0.06 -0.61 0.00 -0.13 0.00 0.00 59.36 59.11 2cqe h GLU 499 Cb 0.72 0.21 -0.13 0.00 0.63 0.00 0.00 28.75 30.18 2cqe h GLU 499 CO -0.84 -0.57 0.88 0.00 -0.73 0.00 0.00 179.01 177.75 2cqe s ALA 500 N -5.39 3.00 -0.68 2.92 0.00 0.92 -4.88 121.76 117.67 2cqe s ALA 500 Ca -0.16 -1.96 -0.02 0.00 0.00 0.00 0.00 51.96 49.82 2cqe s ALA 500 Cb 0.02 -4.10 0.44 0.00 0.00 0.00 0.00 23.12 19.48 2cqe s ALA 500 CO 0.52 -3.08 2.02 0.41 0.00 0.00 0.00 175.76 175.63 2cqe n GLY 501 N 5.62 5.86 3.22 0.00 0.00 -1.24 -4.58 105.19 114.08 2cqe n GLY 501 Ca 0.09 -2.33 -0.10 0.00 0.00 0.00 0.00 46.02 43.68 2cqe n GLY 501 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqe s ALA 502 N -3.84 -1.01 -0.20 4.61 0.00 -1.26 -5.13 121.76 114.92 2cqe s ALA 502 Ca 0.64 1.41 -0.05 0.00 0.00 0.00 0.00 51.96 53.96 2cqe s ALA 502 Cb 0.50 -1.12 0.07 0.00 0.00 0.00 0.00 23.12 22.57 2cqe s ALA 502 CO -0.04 -0.56 0.11 -2.00 0.00 0.00 0.00 175.76 173.27 2cqe s GLU 503 N 2.13 0.10 1.01 0.00 -6.30 -1.26 -5.14 118.70 109.25 2cqe s GLU 503 Ca -0.04 -0.19 -0.20 0.00 -2.50 0.00 0.00 54.97 52.04 2cqe s GLU 503 Cb -0.11 -1.62 -0.08 0.00 0.00 0.00 0.00 34.13 32.32 2cqe s GLU 503 CO -0.12 -0.76 -0.66 -0.40 0.02 0.00 0.00 175.26 173.33 2cqe n ASP 504 N 5.27 -3.70 -4.72 -1.70 5.75 -1.26 -5.01 116.55 111.18 2cqe n ASP 504 Ca -0.07 0.09 -0.32 0.00 -0.01 0.00 0.00 54.79 54.49 2cqe n ASP 504 Cb 0.47 -0.80 -0.09 0.00 -1.03 0.00 0.00 41.12 39.68 2cqe n ASP 504 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2cqe s GLU 505 N -2.58 2.13 0.29 0.11 2.02 -1.26 -5.16 118.70 114.25 2cqe s GLU 505 Ca 0.45 -2.32 0.11 0.00 0.02 0.00 0.00 54.97 53.23 2cqe s GLU 505 Cb -0.09 -1.56 -0.05 0.00 0.10 0.00 0.00 34.13 32.54 2cqe s GLU 505 CO 0.72 -0.27 -0.15 0.21 0.02 0.00 0.00 175.26 175.79 2cqe s LYS 506 N -3.83 1.80 0.09 1.61 2.20 -1.26 -5.15 119.74 115.19 2cqe s LYS 506 Ca 0.14 -1.75 0.07 0.00 -0.36 0.00 0.00 55.97 54.07 2cqe s LYS 506 Cb 0.04 -1.82 -0.03 0.00 -1.51 0.00 0.00 37.83 34.51 2cqe s LYS 506 CO 0.07 0.30 -0.18 -2.00 -0.36 0.00 0.00 175.35 173.18 2cqe s GLU 507 N -3.56 0.99 -0.24 4.03 2.12 -1.26 -5.13 118.70 115.66 2cqe s GLU 507 Ca 0.31 -1.07 -0.18 0.00 0.36 0.00 0.00 54.97 54.39 2cqe s GLU 507 Cb -0.04 -1.14 -0.03 0.00 0.26 0.00 0.00 34.13 33.18 2cqe s GLU 507 CO 0.16 0.26 0.51 0.54 -0.54 0.00 0.00 175.26 176.19 2cqe s VAL 508 N -1.21 5.09 0.03 3.70 0.11 -1.26 -5.06 120.40 121.80 2cqe s VAL 508 Ca 0.03 0.89 -0.15 0.00 -2.93 0.00 0.00 61.98 59.81 2cqe s VAL 508 Cb -0.10 -3.82 -0.06 0.00 -1.53 0.00 0.00 36.38 30.87 2cqe s VAL 508 CO 0.03 0.13 0.44 -1.83 -3.33 0.00 0.00 175.10 170.54 2cqe s GLU 509 N 2.04 3.95 0.74 1.54 4.04 -1.26 -5.04 118.70 124.70 2cqe s GLU 509 Ca 0.22 0.45 -0.17 0.00 0.04 0.00 0.00 54.97 55.51 2cqe s GLU 509 Cb -0.15 -3.19 -0.09 0.00 0.02 0.00 0.00 34.13 30.72 2cqe s GLU 509 CO 0.09 0.66 0.07 -0.85 -1.84 0.00 0.00 175.26 173.40 2cqe n GLU 510 N 1.68 0.12 -1.37 -4.83 0.28 -1.26 -4.82 120.64 110.45 2cqe n GLU 510 Ca -0.13 0.06 -0.25 0.00 -0.16 0.00 0.00 57.16 56.69 2cqe n GLU 510 Cb 0.52 -1.44 -0.04 0.00 1.43 0.00 0.00 31.44 31.91 2cqe n GLU 510 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2cqe n LEU 511 N 1.17 6.47 -3.86 -1.84 4.77 -1.26 -4.80 117.00 117.66 2cqe n LEU 511 Ca 0.07 -3.92 -0.33 0.00 -0.03 0.00 0.00 56.01 51.80 2cqe n LEU 511 Cb 0.51 -1.20 -0.06 0.00 -2.33 0.00 0.00 43.42 40.34 2cqe n LEU 511 CO 0.52 1.63 -0.12 2.29 -1.33 0.00 0.00 177.39 180.38 2cqe n LYS 512 N 0.77 -0.80 -1.68 3.23 0.00 -1.26 -4.67 118.16 113.75 2cqe n LYS 512 Ca 0.46 0.11 -0.58 0.00 -0.00 0.00 0.00 58.31 58.29 2cqe n LYS 512 Cb 0.56 -3.69 -0.07 0.00 -0.00 0.00 0.00 35.03 31.83 2cqe n LYS 512 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2cqe n LYS 513 N -3.27 0.86 -3.79 -1.58 3.00 -1.26 -4.91 118.16 107.22 2cqe n LYS 513 Ca 0.09 0.31 -0.04 0.00 -0.00 0.00 0.00 58.31 58.68 2cqe n LYS 513 Cb 0.35 -1.94 -0.01 0.00 0.00 0.00 0.00 35.03 33.43 2cqe n LYS 513 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2cqe s SER 514 N 2.53 -0.16 0.00 3.14 1.04 -1.26 -5.14 113.70 113.85 2cqe s SER 514 Ca 0.96 -0.51 0.00 0.00 0.48 0.00 0.00 55.95 56.88 2cqe s SER 514 Cb -1.14 0.55 0.00 0.00 0.10 0.00 0.00 66.02 65.53 2cqe s SER 514 CO 0.64 -1.02 0.00 0.61 0.98 0.00 0.00 173.24 174.45 2cqe n GLY 515 N -0.50 0.62 2.33 7.32 0.00 -1.26 -5.17 105.19 108.53 2cqe n GLY 515 Ca -0.05 0.15 -0.20 0.00 0.00 0.00 0.00 46.02 45.92 2cqe n GLY 515 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cqe n PRO 516 N 0.00 -2.45 -3.68 1.61 -0.04 -1.26 -5.08 135.00 124.10 2cqe n PRO 516 Ca 0.00 -1.16 -0.21 0.00 -0.04 0.00 0.00 63.50 62.08 2cqe n PRO 516 Cb 0.00 -1.09 -0.04 0.00 -0.04 0.00 0.00 33.50 32.33 2cqe n PRO 516 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2cqe s SER 517 N -3.47 5.07 0.14 3.54 0.01 -1.26 -5.15 113.70 112.59 2cqe s SER 517 Ca 0.47 -0.69 0.02 0.00 1.31 0.00 0.00 55.95 57.06 2cqe s SER 517 Cb -0.05 -0.69 -0.04 0.00 0.21 0.00 0.00 66.02 65.45 2cqe s SER 517 CO 0.36 -0.55 -0.03 -0.55 0.41 0.00 0.00 173.24 172.88 2cqe s SER 518 N -4.07 1.21 0.00 2.44 0.15 -1.26 -5.37 113.70 106.81 2cqe s SER 518 Ca 0.45 -1.09 0.00 0.00 0.70 0.00 0.00 55.95 56.01 2cqe s SER 518 Cb -0.04 0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.38 2cqe s SER 518 CO 0.27 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 174.81