#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 0.29 -0.30 1.61 0.01 -1.26 -5.13 113.70 108.92 2cqe s SER 423 Ca 0.00 -0.18 -0.07 0.00 1.31 0.00 0.00 55.95 57.01 2cqe s SER 423 Cb 0.00 0.01 0.18 0.00 0.21 0.00 0.00 66.02 66.42 2cqe s SER 423 CO 0.00 -0.06 0.82 -0.55 0.41 0.00 0.00 173.24 173.86 2cqe s SER 424 N -0.48 -0.93 0.00 2.44 0.15 -1.26 -5.05 113.70 108.58 2cqe s SER 424 Ca -0.04 0.59 0.00 0.00 0.70 0.00 0.00 55.95 57.20 2cqe s SER 424 Cb -0.03 1.78 0.00 0.00 -1.71 0.00 0.00 66.02 66.06 2cqe s SER 424 CO -0.00 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.87 2cqe n GLY 425 N 5.45 -0.22 3.76 9.45 0.00 -1.26 -5.15 105.19 117.22 2cqe n GLY 425 Ca -0.04 0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 2cqe n GLY 425 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cqe s SER 426 N 0.00 7.28 0.18 1.61 1.04 -1.26 -4.97 113.70 117.57 2cqe s SER 426 Ca 0.00 1.52 -0.13 0.00 0.48 0.00 0.00 55.95 57.82 2cqe s SER 426 Cb 0.00 -2.47 0.12 0.00 0.10 0.00 0.00 66.02 63.77 2cqe s SER 426 CO 0.00 0.12 1.80 0.77 0.98 0.00 0.00 173.24 176.90 2cqe h SER 427 N 5.02 0.42 0.00 7.02 4.64 -2.08 -3.47 113.55 125.10 2cqe h SER 427 Ca -0.46 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2cqe h SER 427 Cb 1.21 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 2cqe h SER 427 CO 0.68 0.29 0.00 0.61 -0.87 0.00 0.00 176.83 177.55 2cqe n GLY 428 N -1.25 -0.82 2.87 -0.77 0.00 -1.26 -5.11 105.19 98.86 2cqe n GLY 428 Ca 0.04 -1.10 -0.30 0.00 0.00 0.00 0.00 46.02 44.65 2cqe n GLY 428 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cqe s GLU 429 N -2.00 1.27 0.33 1.61 2.02 -1.26 -5.11 118.70 115.56 2cqe s GLU 429 Ca 0.00 -1.74 -0.09 0.00 0.02 0.00 0.00 54.97 53.17 2cqe s GLU 429 Cb 0.00 -2.69 -0.06 0.00 0.10 0.00 0.00 34.13 31.48 2cqe s GLU 429 CO 0.00 -1.01 0.66 -0.51 0.02 0.00 0.00 175.26 174.42 2cqe s LEU 430 N 0.89 3.97 -1.12 1.80 2.01 -1.26 -4.98 118.68 120.00 2cqe s LEU 430 Ca 0.12 0.96 -0.23 0.00 0.01 0.00 0.00 54.13 54.99 2cqe s LEU 430 Cb -0.20 -3.79 -0.08 0.00 0.01 0.00 0.00 46.19 42.13 2cqe s LEU 430 CO -0.11 -0.27 1.94 -2.16 1.01 0.00 0.00 176.35 176.76 2cqe s PRO 431 N -3.56 2.51 0.13 1.29 0.04 -1.26 -4.87 135.00 129.28 2cqe s PRO 431 Ca 0.48 -0.97 -0.06 0.00 0.04 0.00 0.00 61.00 60.49 2cqe s PRO 431 Cb -0.11 -5.20 -0.02 0.00 0.04 0.00 0.00 34.50 29.21 2cqe s PRO 431 CO 0.29 -3.85 0.18 0.15 0.04 0.00 0.00 177.00 173.81 2cqe s LYS 432 N 6.59 0.99 -0.07 4.56 -0.14 -1.26 -5.02 119.74 125.39 2cqe s LYS 432 Ca 0.69 -1.20 -0.02 0.00 -1.36 0.00 0.00 55.97 54.08 2cqe s LYS 432 Cb -0.02 0.32 -0.26 0.00 -1.68 0.00 0.00 37.83 36.19 2cqe s LYS 432 CO 0.10 -0.32 0.57 0.87 -0.76 0.00 0.00 175.35 175.81 2cqe h LYS 433 N 2.72 0.21 -5.59 1.68 1.79 -1.75 -3.49 116.57 112.14 2cqe h LYS 433 Ca -0.33 -0.36 -0.37 0.00 -2.18 0.00 0.00 60.65 57.40 2cqe h LYS 433 Cb 1.21 0.13 0.14 0.00 -1.58 0.00 0.00 32.23 32.13 2cqe h LYS 433 CO 0.54 1.03 -0.65 -2.13 -1.08 0.00 0.00 179.45 177.16 2cqe n ARG 434 N -3.38 -7.48 -4.19 3.15 3.00 -1.26 -5.01 116.66 101.49 2cqe n ARG 434 Ca -0.24 0.79 -0.12 0.00 -0.00 0.00 0.00 57.85 58.28 2cqe n ARG 434 Cb 1.05 -5.72 -0.10 0.00 0.00 0.00 0.00 32.46 27.69 2cqe n ARG 434 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 2cqe s GLU 435 N -6.16 0.92 -0.15 -0.14 2.56 -1.26 -4.85 118.70 109.62 2cqe s GLU 435 Ca 0.51 -1.39 -0.29 0.00 0.00 0.00 0.00 54.97 53.80 2cqe s GLU 435 Cb -0.22 -0.27 -0.06 0.00 2.00 0.00 0.00 34.13 35.58 2cqe s GLU 435 CO 0.69 -0.03 2.12 -1.17 -0.56 0.00 0.00 175.26 176.31 2cqe s LEU 436 N -3.08 3.73 -0.22 2.70 2.96 -1.26 -1.53 118.68 121.97 2cqe s LEU 436 Ca 0.15 2.07 -0.35 0.00 -0.22 0.00 0.00 54.13 55.78 2cqe s LEU 436 Cb 0.05 -3.52 -0.11 0.00 0.50 0.00 0.00 46.19 43.11 2cqe s LEU 436 CO -0.02 -1.69 2.01 0.00 -1.32 0.00 0.00 176.35 175.33 2cqe n LYS 438 N 7.25 0.05 -0.13 0.00 5.02 -1.26 -1.82 118.16 127.28 2cqe n LYS 438 Ca 0.30 0.49 -0.27 0.00 -2.02 0.00 0.00 58.31 56.82 2cqe n LYS 438 Cb 0.27 -1.79 -0.10 0.00 -0.02 0.00 0.00 35.03 33.39 2cqe n LYS 438 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2cqe n PHE 439 N -1.74 0.00 -0.33 2.13 3.01 -1.26 -4.48 117.46 114.79 2cqe n PHE 439 Ca -0.01 0.00 0.21 0.00 1.01 0.00 0.00 57.45 58.67 2cqe n PHE 439 Cb 0.13 -0.95 0.43 0.00 -0.01 0.00 0.00 39.48 39.09 2cqe n PHE 439 CO 0.00 0.00 0.00 -0.92 1.01 0.00 0.00 176.76 176.85 2cqe h TYR 440 N -0.80 0.85 -1.81 1.38 3.20 -1.61 0.26 116.97 118.43 2cqe h TYR 440 Ca -0.66 0.04 0.55 0.00 3.14 0.00 0.00 58.73 61.80 2cqe h TYR 440 Cb 1.63 -0.21 -0.10 0.00 1.54 0.00 0.00 36.73 39.59 2cqe h TYR 440 CO -0.07 -0.15 1.27 -0.89 -1.64 0.00 0.00 178.16 176.69 2cqe n ILE 441 N -5.06 -0.08 -0.11 1.81 5.41 -1.08 0.06 119.36 120.32 2cqe n ILE 441 Ca 0.29 1.59 -0.14 0.00 1.00 0.00 0.00 62.75 65.50 2cqe n ILE 441 Cb 0.90 -2.64 -0.12 0.00 -0.71 0.00 0.00 39.64 37.07 2cqe n ILE 441 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2cqe n THR 442 N -4.17 1.30 0.00 1.39 -2.24 0.86 -5.02 114.28 106.40 2cqe n THR 442 Ca 0.44 -0.60 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 2cqe n THR 442 Cb 1.90 -1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 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 2.22 1.44 3.37 3.38 0.00 0.11 -5.06 105.19 110.65 2cqe n GLY 443 Ca -0.37 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.00 3.65 -0.23 1.61 5.36 -1.25 -4.91 117.98 120.22 2cqe s PHE 444 Ca 0.00 -1.93 0.00 0.00 -0.96 0.00 0.00 56.93 54.04 2cqe s PHE 444 Cb 0.00 -3.96 0.06 0.00 -0.34 0.00 0.00 43.02 38.78 2cqe s PHE 444 CO 0.00 -1.13 -0.05 0.00 -1.46 0.00 0.00 175.22 172.58 2cqe n ALA 446 N 4.71 0.00 -2.24 0.00 0.00 -1.26 -3.74 120.51 117.97 2cqe n ALA 446 Ca -0.12 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.92 2cqe n ALA 446 Cb 0.45 0.44 -0.03 0.00 0.00 0.00 0.00 19.45 20.31 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 -2.59 3.00 0.00 0.00 0.52 -1.26 -4.88 118.95 113.74 2cqe s ARG 447 Ca 0.00 0.47 0.00 0.00 -0.52 0.00 0.00 55.73 55.68 2cqe s ARG 447 Cb 0.00 -4.25 0.00 0.00 0.52 0.00 0.00 34.95 31.22 2cqe s ARG 447 CO 0.00 -2.30 0.00 0.00 0.02 0.00 0.00 175.30 173.02 2cqe n ALA 448 N 10.92 0.00 1.04 2.13 0.00 -1.25 -2.84 120.51 130.52 2cqe n ALA 448 Ca 0.15 -0.01 0.12 0.00 0.00 0.00 0.00 53.44 53.70 2cqe n ALA 448 Cb 0.50 0.00 0.58 0.00 0.00 0.00 0.00 19.45 20.53 2cqe n ALA 448 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2cqe n GLU 449 N -1.71 0.22 -0.67 0.00 0.28 -1.26 -2.93 120.64 114.57 2cqe n GLU 449 Ca 0.00 0.07 0.04 0.00 -0.16 0.00 0.00 57.16 57.10 2cqe n GLU 449 Cb 0.00 -1.50 0.20 0.00 1.43 0.00 0.00 31.44 31.57 2cqe n GLU 449 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 2cqe n ASN 450 N -1.37 1.90 -4.62 -1.84 0.23 -1.26 -5.02 115.26 103.29 2cqe n ASN 450 Ca 0.09 -3.89 -0.43 0.00 -0.53 0.00 0.00 54.58 49.83 2cqe n ASN 450 Cb 0.23 -0.54 -0.02 0.00 -2.08 0.00 0.00 39.78 37.36 2cqe n ASN 450 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2cqe n PRO 452 N 7.65 0.49 -3.35 0.00 -0.04 -1.26 -4.73 135.00 133.76 2cqe n PRO 452 Ca 0.16 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.45 2cqe n PRO 452 Cb 0.47 -1.14 -0.03 0.00 -0.04 0.00 0.00 33.50 32.75 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 -0.64 0.38 -3.89 0.54 4.02 -1.26 -2.07 117.16 114.24 2cqe n TYR 453 Ca 0.03 -1.35 -0.36 0.00 -0.01 0.00 0.00 57.90 56.22 2cqe n TYR 453 Cb 0.02 -0.19 -0.08 0.00 -0.02 0.00 0.00 39.34 39.07 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 -3.03 3.75 0.00 -0.72 -1.94 -0.58 -4.85 119.30 111.93 2cqe s MET 454 Ca 0.03 -0.22 0.00 0.00 -1.71 0.00 0.00 55.69 53.79 2cqe s MET 454 Cb -0.00 -3.24 0.00 0.00 2.01 0.00 0.00 34.83 33.60 2cqe s MET 454 CO 0.02 0.52 0.00 0.72 -0.01 0.00 0.00 175.02 176.27 2cqe n HIS 455 N 2.79 0.00 0.00 -0.03 8.25 -1.26 -3.25 115.22 121.72 2cqe n HIS 455 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 2cqe n HIS 455 Cb 0.53 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.64 2cqe n HIS 455 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cqe n GLY 456 N 3.30 -0.65 0.16 -1.41 0.00 -1.26 -3.98 105.19 101.35 2cqe n GLY 456 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2cqe n GLY 456 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2cqe n ASP 457 N -1.90 0.07 -4.64 1.61 8.00 -1.26 -3.50 116.55 114.92 2cqe n ASP 457 Ca 0.00 0.80 -0.54 0.00 0.71 0.00 0.00 54.79 55.76 2cqe n ASP 457 Cb 0.00 -0.35 -0.06 0.00 -0.02 0.00 0.00 41.12 40.69 2cqe n ASP 457 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2cqe n PHE 458 N -4.28 1.74 -2.19 1.24 7.35 -1.26 -4.76 117.46 115.31 2cqe n PHE 458 Ca 0.15 0.59 -0.42 0.00 -0.76 0.00 0.00 57.45 57.01 2cqe n PHE 458 Cb 0.51 -2.39 -0.03 0.00 0.35 0.00 0.00 39.48 37.92 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 1.78 4.29 0.56 -7.13 0.04 -1.26 -3.32 135.00 129.97 2cqe s PRO 459 Ca 0.90 2.03 -0.19 0.00 0.04 0.00 0.00 61.00 63.79 2cqe s PRO 459 Cb -1.00 -3.46 -0.08 0.00 0.04 0.00 0.00 34.50 30.00 2cqe s PRO 459 CO 0.55 -0.53 0.61 0.00 0.04 0.00 0.00 177.00 177.66 2cqe h LYS 461 N 0.36 0.00 -0.59 0.00 3.64 -1.93 -3.34 116.57 114.71 2cqe h LYS 461 Ca -0.46 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 58.99 2cqe h LYS 461 Cb 1.39 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 33.12 2cqe h LYS 461 CO 0.48 0.00 -0.55 -0.07 -2.27 0.00 0.00 179.45 177.04 2cqe h LEU 462 N -0.21 -1.90 -1.02 5.20 3.38 -1.93 0.81 115.31 119.64 2cqe h LEU 462 Ca 0.00 0.26 0.30 0.00 0.09 0.00 0.00 57.88 58.53 2cqe h LEU 462 Cb 0.00 0.80 -0.04 0.00 0.09 0.00 0.00 40.66 41.51 2cqe h LEU 462 CO 0.00 -0.33 1.19 0.00 0.09 0.00 0.00 178.44 179.39 2cqe n TYR 463 N -5.23 0.00 -0.12 1.13 9.36 -1.00 -0.45 117.16 120.86 2cqe n TYR 463 Ca -0.02 0.00 -0.23 0.00 3.32 0.00 0.00 57.90 60.98 2cqe n TYR 463 Cb 0.30 -0.26 -0.08 0.00 -0.63 0.00 0.00 39.34 38.68 2cqe n TYR 463 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 2cqe n HIS 464 N -3.19 0.10 -0.21 2.98 8.25 0.24 -1.64 115.22 121.75 2cqe n HIS 464 Ca 0.23 0.04 0.15 0.00 -0.26 0.00 0.00 57.72 57.88 2cqe n HIS 464 Cb 1.49 -0.85 0.28 0.00 1.12 0.00 0.00 29.99 32.03 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 -4.34 -0.26 0.00 1.59 -2.24 0.10 -2.82 114.28 106.31 2cqe n THR 465 Ca -0.40 1.33 0.00 0.00 -2.27 0.00 0.00 64.05 62.71 2cqe n THR 465 Cb 0.75 -2.05 0.00 0.00 -2.10 0.00 0.00 70.33 66.92 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 -4.62 0.00 0.00 4.28 -2.24 -0.98 -5.07 114.28 105.65 2cqe n THR 466 Ca 0.19 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.97 2cqe n THR 466 Cb 0.65 -0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 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 2.48 4.69 3.93 3.38 0.00 -0.65 -5.08 105.19 113.94 2cqe n GLY 467 Ca 0.00 -0.80 -0.21 0.00 0.00 0.00 0.00 46.02 45.01 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 5.10 -0.12 1.61 -0.87 -1.21 -4.50 114.94 114.96 2cqe s ASN 468 Ca 0.00 -0.78 -0.00 0.00 -1.57 0.00 0.00 52.86 50.50 2cqe s ASN 468 Cb 0.00 -0.30 0.03 0.00 -0.02 0.00 0.00 41.25 40.96 2cqe s ASN 468 CO 0.00 -0.85 -0.07 0.00 -2.57 0.00 0.00 177.10 173.61 2cqe h ILE 470 N 6.21 0.60 0.04 0.00 6.09 -2.00 -2.43 117.51 126.02 2cqe h ILE 470 Ca -0.29 -0.01 0.01 0.00 -1.37 0.00 0.00 64.86 63.21 2cqe h ILE 470 Cb 1.13 0.58 -0.03 0.00 0.47 0.00 0.00 36.82 38.96 2cqe h ILE 470 CO 0.40 0.00 -0.36 0.78 -3.07 0.00 0.00 178.15 175.91 2cqe h ASN 471 N 0.02 -1.09 -0.80 2.19 4.21 -1.99 -3.49 115.58 114.63 2cqe h ASN 471 Ca 0.39 0.12 0.00 0.00 1.21 0.00 0.00 56.30 58.02 2cqe h ASN 471 Cb 1.52 0.41 0.00 0.00 -1.12 0.00 0.00 38.32 39.13 2cqe h ASN 471 CO -0.01 -0.36 0.00 0.61 -1.29 0.00 0.00 177.43 176.38 2cqe n GLY 472 N -1.32 0.68 0.24 2.83 0.00 -0.92 -4.89 105.19 101.81 2cqe n GLY 472 Ca -0.05 -1.76 -0.10 0.00 0.00 0.00 0.00 46.02 44.11 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 0.77 -2.57 1.61 3.32 -1.94 -3.30 116.42 114.30 2cqe h ASP 473 Ca 0.00 -0.36 -0.81 0.00 0.02 0.00 0.00 57.03 55.88 2cqe h ASP 473 Cb 0.00 -0.22 -0.27 0.00 0.22 0.00 0.00 39.33 39.06 2cqe h ASP 473 CO 0.00 1.10 0.93 0.47 -1.72 0.00 0.00 179.24 180.01 2cqe n ASP 474 N -4.02 6.89 -4.82 6.45 9.92 -1.26 -5.02 116.55 124.69 2cqe n ASP 474 Ca -0.02 -3.55 -0.33 0.00 -0.53 0.00 0.00 54.79 50.36 2cqe n ASP 474 Cb 0.55 -1.22 -0.04 0.00 -0.64 0.00 0.00 41.12 39.77 2cqe n ASP 474 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2cqe h MET 476 N 1.36 0.00 -6.11 0.00 -0.00 -1.95 -3.44 114.93 104.80 2cqe h MET 476 Ca -0.48 0.00 -0.53 0.00 -0.00 0.00 0.00 59.70 58.69 2cqe h MET 476 Cb 1.20 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 32.76 2cqe h MET 476 CO 0.60 0.00 -0.48 -0.06 -0.00 0.00 0.00 176.91 176.97 2cqe s PHE 477 N -3.65 3.39 0.31 -0.10 0.08 -1.26 -4.84 117.98 111.91 2cqe s PHE 477 Ca 0.01 0.06 -0.27 0.00 0.12 0.00 0.00 56.93 56.85 2cqe s PHE 477 Cb 0.09 -1.61 -0.09 0.00 -0.57 0.00 0.00 43.02 40.84 2cqe s PHE 477 CO 0.52 0.51 0.98 -1.12 -0.10 0.00 0.00 175.22 176.00 2cqe s SER 478 N -3.36 7.33 -0.33 1.36 0.01 -1.21 -4.78 113.70 112.73 2cqe s SER 478 Ca 0.34 1.95 0.07 0.00 1.31 0.00 0.00 55.95 59.61 2cqe s SER 478 Cb -0.10 -2.59 0.47 0.00 0.21 0.00 0.00 66.02 64.00 2cqe s SER 478 CO 0.27 -0.07 1.39 1.41 0.41 0.00 0.00 173.24 176.65 2cqe n HIS 479 N 0.79 1.84 -1.46 2.43 8.25 -1.26 -0.77 115.22 125.04 2cqe n HIS 479 Ca 0.01 -2.01 -0.31 0.00 -0.26 0.00 0.00 57.72 55.15 2cqe n HIS 479 Cb 0.49 -0.52 0.07 0.00 1.12 0.00 0.00 29.99 31.15 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 -2.98 4.86 -0.18 0.41 1.01 -1.26 -4.96 116.67 113.57 2cqe s ASP 480 Ca 0.49 1.61 -0.29 0.00 0.71 0.00 0.00 52.55 55.07 2cqe s ASP 480 Cb 0.42 -2.40 -0.03 0.00 1.01 0.00 0.00 42.92 41.91 2cqe s ASP 480 CO 0.00 -1.78 1.58 -2.16 0.21 0.00 0.00 175.17 173.03 2cqe s PRO 481 N -5.02 3.92 0.39 8.23 0.04 -1.26 -4.94 135.00 136.36 2cqe s PRO 481 Ca 0.60 1.77 -0.22 0.00 0.04 0.00 0.00 61.00 63.19 2cqe s PRO 481 Cb -0.15 -4.00 -0.15 0.00 0.04 0.00 0.00 34.50 30.24 2cqe s PRO 481 CO 0.55 -1.14 0.15 1.28 0.04 0.00 0.00 177.00 177.88 2cqe n LEU 482 N 7.98 -2.54 -4.34 -3.56 4.77 -1.26 -4.98 117.00 113.07 2cqe n LEU 482 Ca 0.18 0.84 -0.21 0.00 -0.03 0.00 0.00 56.01 56.79 2cqe n LEU 482 Cb 0.45 -0.91 -0.11 0.00 -2.33 0.00 0.00 43.42 40.52 2cqe n LEU 482 CO 0.63 -4.02 -0.47 0.42 -1.33 0.00 0.00 177.39 172.62 2cqe s THR 483 N -1.62 1.81 0.49 -5.08 -4.23 -1.26 -4.91 115.64 100.85 2cqe s THR 483 Ca 0.60 -1.98 0.40 0.00 -1.18 0.00 0.00 61.69 59.52 2cqe s THR 483 Cb -0.65 -1.89 0.60 0.00 1.34 0.00 0.00 72.50 71.90 2cqe s THR 483 CO 0.62 -0.37 1.58 -0.08 -0.54 0.00 0.00 174.62 175.83 2cqe h GLU 484 N 3.09 0.01 0.00 3.99 4.57 -1.99 0.35 114.58 124.61 2cqe h GLU 484 Ca -0.41 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.77 2cqe h GLU 484 Cb 1.21 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 2cqe h GLU 484 CO 0.53 0.01 0.00 0.39 -1.18 0.00 0.00 179.01 178.76 2cqe n GLU 485 N -4.41 0.00 -0.34 1.92 -0.58 -1.26 -3.92 120.64 112.06 2cqe n GLU 485 Ca 0.42 0.23 0.06 0.00 -0.42 0.00 0.00 57.16 57.45 2cqe n GLU 485 Cb 1.74 -0.73 0.15 0.00 -0.57 0.00 0.00 31.44 32.03 2cqe n GLU 485 CO 0.00 0.00 0.00 1.79 -0.48 0.00 0.00 177.13 178.44 2cqe h THR 486 N 0.00 0.06 -0.99 2.62 1.35 -1.84 0.35 112.91 114.46 2cqe h THR 486 Ca 0.00 -0.00 0.26 0.00 -0.55 0.00 0.00 66.41 66.12 2cqe h THR 486 Cb 0.00 0.06 -0.18 0.00 -1.73 0.00 0.00 68.15 66.29 2cqe h THR 486 CO 0.00 0.00 -0.00 -0.09 -0.25 0.00 0.00 175.52 175.18 2cqe h ARG 487 N 0.00 0.01 -0.36 4.72 1.12 -0.50 0.63 114.38 120.01 2cqe h ARG 487 Ca 0.47 -0.00 -0.01 0.00 -1.11 0.00 0.00 59.98 59.33 2cqe h ARG 487 Cb 0.76 -0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 30.70 2cqe h ARG 487 CO -0.96 0.01 0.18 0.93 -3.11 0.00 0.00 179.97 177.02 2cqe h GLU 488 N 0.01 0.50 -0.35 0.20 5.08 -0.43 -3.17 114.58 116.43 2cqe h GLU 488 Ca 0.58 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.92 2cqe h GLU 488 Cb 1.17 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 30.26 2cqe h GLU 488 CO -0.93 0.44 -0.44 -0.07 -1.00 0.00 0.00 179.01 177.01 2cqe h LEU 489 N 0.44 -1.47 -0.71 1.33 3.38 0.38 -2.13 115.31 116.53 2cqe h LEU 489 Ca 0.12 0.20 0.07 0.00 0.09 0.00 0.00 57.88 58.36 2cqe h LEU 489 Cb 0.09 0.61 -0.09 0.00 0.09 0.00 0.00 40.66 41.35 2cqe h LEU 489 CO -0.02 -0.30 -0.50 -0.07 0.09 0.00 0.00 178.44 177.63 2cqe h LEU 490 N -0.29 -1.80 -0.99 1.67 3.38 -1.45 0.28 115.31 116.11 2cqe h LEU 490 Ca 0.06 0.26 0.25 0.00 0.09 0.00 0.00 57.88 58.54 2cqe h LEU 490 Cb 0.45 0.78 -0.19 0.00 0.09 0.00 0.00 40.66 41.80 2cqe h LEU 490 CO -0.48 -0.25 -0.06 0.47 0.09 0.00 0.00 178.44 178.21 2cqe n ASP 491 N -4.98 -0.19 -0.10 -0.43 9.92 -0.84 0.67 116.55 120.60 2cqe n ASP 491 Ca 0.00 1.69 -0.12 0.00 -0.53 0.00 0.00 54.79 55.83 2cqe n ASP 491 Cb 0.25 -0.58 -0.04 0.00 -0.64 0.00 0.00 41.12 40.11 2cqe n ASP 491 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 2cqe h LYS 492 N 0.00 0.65 0.69 -1.24 1.63 -0.13 -2.15 116.57 116.02 2cqe h LYS 492 Ca 0.56 -0.29 -0.03 0.00 -0.85 0.00 0.00 60.65 60.05 2cqe h LYS 492 Cb 1.08 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.69 2cqe h LYS 492 CO -0.96 0.88 -0.49 1.98 -3.45 0.00 0.00 179.45 177.41 2cqe h MET 493 N 0.41 -1.08 -0.87 1.90 4.05 0.30 -2.19 114.93 117.46 2cqe h MET 493 Ca 0.07 0.07 0.14 0.00 -0.28 0.00 0.00 59.70 59.70 2cqe h MET 493 Cb 0.68 0.25 -0.07 0.00 -0.80 0.00 0.00 31.60 31.66 2cqe h MET 493 CO 0.05 -0.72 0.56 -0.07 0.23 0.00 0.00 176.91 176.96 2cqe h LEU 494 N -1.12 0.64 -0.86 3.39 -0.00 -0.81 -0.74 115.31 115.81 2cqe h LEU 494 Ca -0.09 0.04 0.06 0.00 -0.00 0.00 0.00 57.88 57.89 2cqe h LEU 494 Cb 0.92 -0.09 -0.06 0.00 -0.00 0.00 0.00 40.66 41.43 2cqe h LEU 494 CO 0.05 0.33 0.53 0.00 -0.00 0.00 0.00 178.44 179.35 2cqe h ALA 495 N 1.60 1.18 -0.67 1.53 0.00 -0.94 0.82 119.26 122.78 2cqe h ALA 495 Ca 0.43 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.47 2cqe h ALA 495 Cb 0.68 -0.23 -0.10 0.00 0.00 0.00 0.00 17.79 18.15 2cqe h ALA 495 CO -0.19 0.27 0.17 0.22 0.00 0.00 0.00 179.25 179.72 2cqe h ASP 496 N 0.96 0.05 0.09 0.00 3.58 -0.52 0.22 116.42 120.80 2cqe h ASP 496 Ca 0.38 0.12 -0.00 0.00 0.42 0.00 0.00 57.03 57.94 2cqe h ASP 496 Cb 0.18 0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.39 2cqe h ASP 496 CO -0.18 0.01 -0.04 -0.78 -2.88 0.00 0.00 179.24 175.37 2cqe h ASP 497 N 0.29 -0.10 -0.69 2.28 3.58 -1.43 -3.08 116.42 117.27 2cqe h ASP 497 Ca 0.36 -0.34 0.13 0.00 0.42 0.00 0.00 57.03 57.60 2cqe h ASP 497 Cb 0.57 0.03 -0.13 0.00 1.72 0.00 0.00 39.33 41.51 2cqe h ASP 497 CO -0.44 0.52 -0.26 0.00 -2.88 0.00 0.00 179.24 176.19 2cqe h ALA 498 N -0.57 0.25 -0.00 -0.78 0.00 -0.67 -0.75 119.26 116.73 2cqe h ALA 498 Ca -0.01 0.24 0.03 0.00 0.00 0.00 0.00 54.91 55.16 2cqe h ALA 498 Cb 0.43 0.68 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 2cqe h ALA 498 CO 0.02 -0.53 -0.20 1.49 0.00 0.00 0.00 179.25 180.02 2cqe h GLU 499 N -0.07 -0.31 -0.96 0.00 4.57 -0.69 -2.31 114.58 114.81 2cqe h GLU 499 Ca 0.30 0.02 0.25 0.00 -1.18 0.00 0.00 59.36 58.75 2cqe h GLU 499 Cb 0.55 0.07 -0.18 0.00 -0.16 0.00 0.00 28.75 29.03 2cqe h GLU 499 CO -0.74 -0.21 -0.04 0.00 -1.18 0.00 0.00 179.01 176.84 2cqe n ALA 500 N -2.58 0.43 -1.00 2.92 0.00 -0.31 -3.20 120.51 116.77 2cqe n ALA 500 Ca -0.05 1.03 0.00 0.00 0.00 0.00 0.00 53.44 54.42 2cqe n ALA 500 Cb 0.25 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 18.98 2cqe n ALA 500 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cqe n GLY 501 N -1.51 -1.29 3.95 0.00 0.00 -0.88 -4.97 105.19 100.50 2cqe n GLY 501 Ca 0.21 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.56 4.45 0.06 4.61 0.00 -1.17 -5.13 121.76 122.02 2cqe s ALA 502 Ca 0.00 -1.75 0.04 0.00 0.00 0.00 0.00 51.96 50.25 2cqe s ALA 502 Cb 0.00 -1.14 -0.04 0.00 0.00 0.00 0.00 23.12 21.94 2cqe s ALA 502 CO 0.00 -0.52 -0.03 -1.21 0.00 0.00 0.00 175.76 174.00 2cqe s GLU 503 N -4.38 2.52 0.21 0.00 2.02 -1.26 -4.28 118.70 113.53 2cqe s GLU 503 Ca 0.49 -0.80 -0.20 0.00 0.02 0.00 0.00 54.97 54.48 2cqe s GLU 503 Cb -0.04 -2.52 0.03 0.00 0.10 0.00 0.00 34.13 31.70 2cqe s GLU 503 CO 0.30 0.56 0.60 0.16 0.02 0.00 0.00 175.26 176.90 2cqe s ASP 504 N -1.98 -0.32 -0.13 -0.19 -4.77 -1.26 -5.14 116.67 102.89 2cqe s ASP 504 Ca 0.22 -0.43 0.02 0.00 -3.30 0.00 0.00 52.55 49.06 2cqe s ASP 504 Cb -0.11 0.63 0.00 0.00 -1.09 0.00 0.00 42.92 42.34 2cqe s ASP 504 CO 0.14 -1.13 -0.20 -1.61 0.70 0.00 0.00 175.17 173.07 2cqe s GLU 505 N -3.87 3.12 0.25 2.11 0.41 -1.26 -5.13 118.70 114.34 2cqe s GLU 505 Ca 0.09 -0.82 0.08 0.00 -0.41 0.00 0.00 54.97 53.90 2cqe s GLU 505 Cb -0.02 -2.45 -0.04 0.00 -1.78 0.00 0.00 34.13 29.84 2cqe s GLU 505 CO -0.02 0.09 0.13 0.21 -0.49 0.00 0.00 175.26 175.19 2cqe s LYS 506 N 0.58 2.72 -0.20 1.61 2.20 -1.26 -5.14 119.74 120.26 2cqe s LYS 506 Ca -0.12 -1.16 -0.22 0.00 -0.36 0.00 0.00 55.97 54.11 2cqe s LYS 506 Cb -0.16 -2.44 0.06 0.00 -1.51 0.00 0.00 37.83 33.77 2cqe s LYS 506 CO 0.04 0.39 0.61 -2.00 -0.36 0.00 0.00 175.35 174.03 2cqe s GLU 507 N -3.75 0.76 -0.57 4.03 2.12 -1.26 -5.11 118.70 114.91 2cqe s GLU 507 Ca 0.32 0.73 0.04 0.00 0.36 0.00 0.00 54.97 56.42 2cqe s GLU 507 Cb -0.07 0.37 0.16 0.00 0.26 0.00 0.00 34.13 34.84 2cqe s GLU 507 CO 0.23 -0.12 0.40 0.54 -0.54 0.00 0.00 175.26 175.77 2cqe s VAL 508 N 0.06 1.98 0.59 3.70 0.11 -1.26 -5.11 120.40 120.47 2cqe s VAL 508 Ca -0.02 -3.51 -0.18 0.00 -2.93 0.00 0.00 61.98 55.34 2cqe s VAL 508 Cb -0.04 -2.33 -0.04 0.00 -1.53 0.00 0.00 36.38 32.45 2cqe s VAL 508 CO 0.02 -1.03 1.14 -0.70 -3.33 0.00 0.00 175.10 171.20 2cqe s GLU 509 N -0.69 3.11 0.40 1.54 2.56 -1.26 -5.05 118.70 119.32 2cqe s GLU 509 Ca 0.25 1.59 0.05 0.00 0.00 0.00 0.00 54.97 56.86 2cqe s GLU 509 Cb -0.07 -1.97 0.00 0.00 2.00 0.00 0.00 34.13 34.08 2cqe s GLU 509 CO -0.13 -1.04 0.57 -1.83 -0.56 0.00 0.00 175.26 172.26 2cqe s GLU 510 N -3.54 2.96 -0.04 4.30 1.03 -1.26 -5.08 118.70 117.08 2cqe s GLU 510 Ca 0.72 -0.95 -0.04 0.00 0.03 0.00 0.00 54.97 54.73 2cqe s GLU 510 Cb -0.24 -2.72 -0.01 0.00 -0.80 0.00 0.00 34.13 30.36 2cqe s GLU 510 CO 0.32 -0.18 -0.08 1.28 -1.33 0.00 0.00 175.26 175.28 2cqe n LEU 511 N -1.86 0.47 -3.66 1.83 4.32 -1.26 -4.89 117.00 111.95 2cqe n LEU 511 Ca 0.03 0.12 -0.28 0.00 -0.02 0.00 0.00 56.01 55.86 2cqe n LEU 511 Cb 0.58 -0.56 -0.11 0.00 -1.62 0.00 0.00 43.42 41.71 2cqe n LEU 511 CO 0.43 -0.45 -0.17 -1.59 -1.22 0.00 0.00 177.39 174.39 2cqe s LYS 512 N -1.45 1.73 -1.12 3.23 -2.85 -1.26 -5.03 119.74 112.99 2cqe s LYS 512 Ca -0.07 -2.76 -0.11 0.00 -1.00 0.00 0.00 55.97 52.03 2cqe s LYS 512 Cb 0.01 -2.49 0.24 0.00 -2.06 0.00 0.00 37.83 33.53 2cqe s LYS 512 CO 0.10 -1.33 1.19 0.15 0.10 0.00 0.00 175.35 175.56 2cqe s LYS 513 N -0.74 4.12 0.03 1.78 -0.14 -1.26 -4.94 119.74 118.58 2cqe s LYS 513 Ca 0.28 -2.93 -0.29 0.00 -1.36 0.00 0.00 55.97 51.67 2cqe s LYS 513 Cb -0.01 -4.72 0.10 0.00 -1.68 0.00 0.00 37.83 31.53 2cqe s LYS 513 CO -0.18 -1.42 1.18 -1.54 -0.76 0.00 0.00 175.35 172.63 2cqe s SER 514 N 1.91 -0.10 -0.31 2.83 1.04 -1.26 -5.15 113.70 112.66 2cqe s SER 514 Ca 0.34 -0.21 -0.06 0.00 0.48 0.00 0.00 55.95 56.50 2cqe s SER 514 Cb -0.08 0.26 0.19 0.00 0.10 0.00 0.00 66.02 66.49 2cqe s SER 514 CO -0.06 -0.47 0.94 -0.83 0.98 0.00 0.00 173.24 173.80 2cqe s GLY 515 N -2.93 -1.17 1.23 7.32 0.00 -1.26 -5.17 107.32 105.34 2cqe s GLY 515 Ca 0.13 1.56 -0.20 0.00 0.00 0.00 0.00 44.72 46.21 2cqe s GLY 515 CO -0.02 4.06 1.11 2.56 0.00 0.00 0.00 173.10 180.81 2cqe s PRO 516 N 2.58 -1.47 0.33 2.90 0.04 -1.26 -5.10 135.00 133.02 2cqe s PRO 516 Ca 0.21 -0.16 -0.14 0.00 0.04 0.00 0.00 61.00 60.95 2cqe s PRO 516 Cb -0.02 -1.58 0.03 0.00 0.04 0.00 0.00 34.50 32.97 2cqe s PRO 516 CO -0.20 -3.86 0.67 -1.54 0.04 0.00 0.00 177.00 172.11 2cqe s SER 517 N -3.96 0.07 0.20 6.66 1.04 -1.26 -5.19 113.70 111.26 2cqe s SER 517 Ca 0.72 -1.03 -0.23 0.00 0.48 0.00 0.00 55.95 55.89 2cqe s SER 517 Cb -0.08 0.74 0.07 0.00 0.10 0.00 0.00 66.02 66.85 2cqe s SER 517 CO 0.56 -1.44 0.96 -0.94 0.98 0.00 0.00 173.24 173.35 2cqe s SER 518 N -3.05 -0.09 0.00 7.02 1.04 -1.26 -5.38 113.70 111.98 2cqe s SER 518 Ca 0.18 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 56.00 2cqe s SER 518 Cb -0.04 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.63 2cqe s SER 518 CO 0.11 -1.05 0.00 0.61 0.98 0.00 0.00 173.24 173.89