#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w01 n GLY 436 N 0.00 3.07 0.00 -5.12 0.00 -1.26 -4.86 105.19 97.02 2w01 n GLY 436 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2w01 n GLY 436 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w01 n GLY 437 N -0.95 3.14 2.97 -0.02 0.00 -1.26 -5.00 105.19 104.07 2w01 n GLY 437 Ca 0.00 -0.73 -0.18 0.00 0.00 0.00 0.00 46.02 45.11 2w01 n GLY 437 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2w01 s ASP 438 N 0.00 0.94 -0.22 1.61 3.68 -0.34 -4.99 116.67 117.34 2w01 s ASP 438 Ca 0.00 -0.14 -0.13 0.00 2.13 0.00 0.00 52.55 54.41 2w01 s ASP 438 Cb 0.00 -0.21 -0.05 0.00 -1.45 0.00 0.00 42.92 41.22 2w01 s ASP 438 CO 0.00 0.06 0.27 -0.60 0.13 0.00 0.00 175.17 175.03 2w01 s ARG 439 N 0.12 4.14 0.05 4.34 3.52 -1.26 -0.46 118.95 129.39 2w01 s ARG 439 Ca -0.01 -0.04 -0.27 0.00 -0.13 0.00 0.00 55.73 55.28 2w01 s ARG 439 Cb -0.06 -3.52 0.07 0.00 -1.56 0.00 0.00 34.95 29.87 2w01 s ARG 439 CO -0.00 0.05 0.64 -0.98 -0.81 0.00 0.00 175.30 174.19 2w01 s ARG 440 N 1.08 1.16 0.05 5.12 1.70 0.20 -4.91 118.95 123.35 2w01 s ARG 440 Ca 0.13 -0.09 -0.30 0.00 -0.47 0.00 0.00 55.73 54.99 2w01 s ARG 440 Cb -0.14 0.54 -0.08 0.00 -0.57 0.00 0.00 34.95 34.70 2w01 s ARG 440 CO 0.06 -0.44 1.74 -1.25 -1.08 0.00 0.00 175.30 174.32 2w01 s PRO 441 N -2.42 4.18 0.26 3.89 0.04 -1.26 -0.08 135.00 139.61 2w01 s PRO 441 Ca -0.05 2.39 0.02 0.00 0.04 0.00 0.00 61.00 63.40 2w01 s PRO 441 Cb -0.00 -3.77 -0.04 0.00 0.04 0.00 0.00 34.50 30.72 2w01 s PRO 441 CO -0.01 -0.81 0.17 0.96 0.04 0.00 0.00 177.00 177.35 2w01 s ILE 442 N 3.25 0.14 -0.18 0.56 -4.36 -0.41 -4.90 121.20 115.30 2w01 s ILE 442 Ca 0.77 -2.00 -0.03 0.00 -0.26 0.00 0.00 60.65 59.14 2w01 s ILE 442 Cb -0.40 -2.51 -0.01 0.00 1.25 0.00 0.00 42.46 40.78 2w01 s ILE 442 CO 0.34 0.00 -0.07 -0.89 0.24 0.00 0.00 174.94 174.56 2w01 s THR 443 N -3.81 3.38 -0.13 8.37 2.01 -0.49 -0.63 115.64 124.36 2w01 s THR 443 Ca 0.38 -0.52 -0.02 0.00 0.31 0.00 0.00 61.69 61.85 2w01 s THR 443 Cb 0.05 -2.49 -0.02 0.00 0.01 0.00 0.00 72.50 70.05 2w01 s THR 443 CO 0.17 0.47 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.87 2w01 s ILE 444 N 0.89 3.62 -0.03 1.82 1.01 0.22 -1.60 121.20 127.13 2w01 s ILE 444 Ca -0.01 -0.47 0.07 0.00 0.00 0.00 0.00 60.65 60.23 2w01 s ILE 444 Cb -0.15 -2.54 -0.01 0.00 0.01 0.00 0.00 42.46 39.77 2w01 s ILE 444 CO 0.01 0.53 -0.23 -0.22 0.00 0.00 0.00 174.94 175.03 2w01 s LEU 445 N 0.05 2.03 -0.01 2.97 0.20 -0.60 -1.06 118.68 122.26 2w01 s LEU 445 Ca -0.02 -0.43 0.00 0.00 0.69 0.00 0.00 54.13 54.37 2w01 s LEU 445 Cb -0.14 -1.21 0.01 0.00 -0.43 0.00 0.00 46.19 44.42 2w01 s LEU 445 CO 0.03 0.26 -0.00 0.28 -0.29 0.00 0.00 176.35 176.63 2w01 s THR 446 N -0.38 0.07 0.20 3.68 -1.32 -0.48 0.14 115.64 117.56 2w01 s THR 446 Ca 0.04 0.03 0.09 0.00 -1.21 0.00 0.00 61.69 60.64 2w01 s THR 446 Cb -0.10 -0.10 -0.05 0.00 -1.51 0.00 0.00 72.50 70.74 2w01 s THR 446 CO 0.01 0.05 -0.18 -0.94 -2.21 0.00 0.00 174.62 171.35 2w01 s SER 447 N 0.34 2.94 0.10 8.08 1.04 -0.89 -1.53 113.70 123.78 2w01 s SER 447 Ca -0.03 -0.94 -0.17 0.00 0.48 0.00 0.00 55.95 55.29 2w01 s SER 447 Cb -0.05 -0.19 0.04 0.00 0.10 0.00 0.00 66.02 65.91 2w01 s SER 447 CO -0.01 -0.04 0.41 -0.62 0.98 0.00 0.00 173.24 173.97 2w01 s ASP 448 N -3.03 -0.26 -0.95 7.02 -1.08 -0.06 -2.60 116.67 115.71 2w01 s ASP 448 Ca 0.21 -0.21 -0.01 0.00 -0.52 0.00 0.00 52.55 52.02 2w01 s ASP 448 Cb -0.04 0.46 0.33 0.00 -1.46 0.00 0.00 42.92 42.21 2w01 s ASP 448 CO 0.09 -0.80 1.81 0.18 0.52 0.00 0.00 175.17 176.96 2w01 n LEU 449 N -0.01 7.18 -0.11 -1.34 4.77 -1.17 -0.64 117.00 125.67 2w01 n LEU 449 Ca -0.17 -5.28 0.00 0.00 -0.03 0.00 0.00 56.01 50.53 2w01 n LEU 449 Cb 0.63 -1.10 0.00 0.00 -2.33 0.00 0.00 43.42 40.62 2w01 n LEU 449 CO 0.18 2.01 0.00 0.54 -1.33 0.00 0.00 177.39 178.79 2w01 n ARG 450 N -0.19 0.00 -1.60 3.23 5.12 -1.08 -0.61 116.66 121.53 2w01 n ARG 450 Ca 0.47 0.00 -0.14 0.00 -1.93 0.00 0.00 57.85 56.26 2w01 n ARG 450 Cb 0.27 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.52 2w01 n ARG 450 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2w01 n GLY 451 N 0.18 1.04 0.06 -0.13 0.00 -1.26 -4.68 105.19 100.41 2w01 n GLY 451 Ca 0.00 -0.37 -0.08 0.00 0.00 0.00 0.00 46.02 45.57 2w01 n GLY 451 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2w01 h PHE 452 N 0.00 0.03 -0.82 1.61 3.57 -1.22 -3.20 116.94 116.91 2w01 h PHE 452 Ca -0.29 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.26 2w01 h PHE 452 Cb 0.97 -0.00 -0.10 0.00 2.79 0.00 0.00 35.95 39.61 2w01 h PHE 452 CO 0.38 1.02 -0.49 2.41 -2.23 0.00 0.00 178.31 179.40 2w01 n THR 453 N -3.34 -0.56 0.00 4.41 -1.04 -1.26 -0.71 114.28 111.77 2w01 n THR 453 Ca -0.02 2.18 0.00 0.00 -2.04 0.00 0.00 64.05 64.18 2w01 n THR 453 Cb 0.95 -2.72 0.00 0.00 -1.82 0.00 0.00 70.33 66.75 2w01 n THR 453 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2w01 n SER 454 N -4.88 0.00 0.21 8.00 7.64 -1.24 -3.39 113.62 119.95 2w01 n SER 454 Ca 0.02 0.72 0.13 0.00 1.01 0.00 0.00 58.87 60.75 2w01 n SER 454 Cb 0.21 -0.22 0.69 0.00 -1.01 0.00 0.00 64.21 63.88 2w01 n SER 454 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2w01 h THR 455 N 0.00 0.00 0.00 0.44 1.35 -1.56 -1.84 112.91 111.30 2w01 h THR 455 Ca 0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.83 2w01 h THR 455 Cb 0.00 0.56 -0.00 0.00 -1.73 0.00 0.00 68.15 66.98 2w01 h THR 455 CO 0.00 0.00 -0.15 0.77 -0.25 0.00 0.00 175.52 175.89 2w01 h SER 456 N 0.00 0.00 -0.36 5.36 4.64 -0.93 -2.84 113.55 119.42 2w01 h SER 456 Ca 0.00 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.42 2w01 h SER 456 Cb 0.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 2w01 h SER 456 CO 0.00 0.15 0.31 -0.33 -0.87 0.00 0.00 176.83 176.09 2w01 h GLU 457 N 0.00 0.00 -0.00 4.77 4.39 -1.45 -1.50 114.58 120.79 2w01 h GLU 457 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2w01 h GLU 457 Cb 0.54 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 2w01 h GLU 457 CO 0.02 0.00 -0.00 0.41 -1.16 0.00 0.00 179.01 178.28 2w01 n GLY 458 N -1.53 -1.40 3.89 -3.84 0.00 -1.07 -4.94 105.19 96.31 2w01 n GLY 458 Ca 0.06 -0.12 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 2w01 n GLY 458 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w01 s LEU 459 N -2.79 4.22 0.40 0.99 1.43 -0.57 -5.08 118.68 117.27 2w01 s LEU 459 Ca 0.21 0.17 -0.25 0.00 -1.03 0.00 0.00 54.13 53.22 2w01 s LEU 459 Cb 0.20 -2.82 -0.08 0.00 0.03 0.00 0.00 46.19 43.51 2w01 s LEU 459 CO 0.50 0.13 1.16 0.54 0.23 0.00 0.00 176.35 178.91 2w01 s ASN 460 N -2.73 6.55 0.51 2.29 2.20 -1.26 -4.84 114.94 117.66 2w01 s ASN 460 Ca 0.34 2.33 0.26 0.00 -0.94 0.00 0.00 52.86 54.85 2w01 s ASN 460 Cb -0.12 -2.61 1.36 0.00 -2.00 0.00 0.00 41.25 37.88 2w01 s ASN 460 CO 0.27 -0.66 1.92 -0.65 -2.94 0.00 0.00 177.10 175.04 2w01 h PRO 461 N 2.65 0.09 -0.21 3.55 0.11 -1.98 0.22 132.00 136.43 2w01 h PRO 461 Ca -0.49 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.47 2w01 h PRO 461 Cb 1.23 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2w01 h PRO 461 CO 0.63 0.06 -0.49 0.93 -0.21 0.00 0.00 178.00 178.91 2w01 h GLU 462 N 0.09 0.58 -0.35 1.05 5.08 -1.99 -2.61 114.58 116.43 2w01 h GLU 462 Ca 0.38 -0.34 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 2w01 h GLU 462 Cb 1.35 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.62 2w01 h GLU 462 CO -0.04 0.94 0.01 0.93 -1.00 0.00 0.00 179.01 179.85 2w01 h GLU 463 N 0.46 0.61 0.25 2.33 5.08 -0.94 -1.50 114.58 120.86 2w01 h GLU 463 Ca 0.02 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2w01 h GLU 463 Cb 1.02 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.20 2w01 h GLU 463 CO 0.09 0.72 -0.23 0.28 -1.00 0.00 0.00 179.01 178.87 2w01 h VAL 464 N 0.43 0.50 -0.57 3.13 2.07 -1.47 -1.32 116.25 119.01 2w01 h VAL 464 Ca 0.10 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.65 2w01 h VAL 464 Cb 0.44 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 2w01 h VAL 464 CO 0.02 0.00 0.38 0.58 0.02 0.00 0.00 177.57 178.56 2w01 h VAL 465 N -0.51 1.08 -0.02 2.57 2.07 -1.47 -2.26 116.25 117.70 2w01 h VAL 465 Ca -0.01 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.22 2w01 h VAL 465 Cb 0.47 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 2w01 h VAL 465 CO -0.04 0.12 -0.24 0.50 0.02 0.00 0.00 177.57 177.92 2w01 h LYS 466 N 0.67 0.20 -0.97 1.57 1.63 -1.03 -1.44 116.57 117.20 2w01 h LYS 466 Ca 0.23 -0.19 0.04 0.00 -0.85 0.00 0.00 60.65 59.87 2w01 h LYS 466 Cb 0.07 0.05 -0.06 0.00 -0.60 0.00 0.00 32.23 31.69 2w01 h LYS 466 CO -0.06 0.88 0.64 0.28 -3.45 0.00 0.00 179.45 177.74 2w01 h VAL 467 N -0.41 1.17 -0.26 2.00 2.07 -1.18 -1.32 116.25 118.32 2w01 h VAL 467 Ca -0.02 -0.42 -0.16 0.00 0.82 0.00 0.00 66.70 66.91 2w01 h VAL 467 Cb 0.95 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 2w01 h VAL 467 CO 0.05 0.22 -0.48 -0.07 0.02 0.00 0.00 177.57 177.32 2w01 h LEU 468 N 1.23 0.77 -0.32 2.57 4.07 -1.38 -1.60 115.31 120.65 2w01 h LEU 468 Ca 0.39 -0.38 -0.18 0.00 0.08 0.00 0.00 57.88 57.78 2w01 h LEU 468 Cb -0.00 -0.22 -0.00 0.00 1.08 0.00 0.00 40.66 41.52 2w01 h LEU 468 CO -0.12 1.12 -0.50 0.78 -1.08 0.00 0.00 178.44 178.64 2w01 h ASN 469 N 0.56 1.00 -0.07 -0.43 -0.26 -1.01 0.46 115.58 115.83 2w01 h ASN 469 Ca 0.03 -0.51 0.02 0.00 -0.56 0.00 0.00 56.30 55.28 2w01 h ASN 469 Cb 1.04 -0.28 -0.02 0.00 -1.06 0.00 0.00 38.32 37.99 2w01 h ASN 469 CO 0.10 1.32 -0.06 0.40 -1.06 0.00 0.00 177.43 178.13 2w01 h ILE 470 N 0.71 0.82 0.16 2.81 2.04 -1.19 0.58 117.51 123.44 2w01 h ILE 470 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.89 2w01 h ILE 470 Cb 1.11 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 2w01 h ILE 470 CO 0.12 0.00 -0.15 0.22 0.00 0.00 0.00 178.15 178.33 2w01 h TYR 471 N -0.07 -0.40 -0.58 1.37 3.20 -1.25 -2.24 116.97 116.99 2w01 h TYR 471 Ca 0.05 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 2w01 h TYR 471 Cb 0.15 0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.55 2w01 h TYR 471 CO -0.17 -0.24 0.31 0.74 -1.64 0.00 0.00 178.16 177.17 2w01 h PHE 472 N -0.34 0.81 0.10 -3.82 0.04 -0.83 0.66 116.94 113.56 2w01 h PHE 472 Ca 0.00 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.75 2w01 h PHE 472 Cb 0.32 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.21 2w01 h PHE 472 CO -0.13 0.59 -0.09 0.78 -0.60 0.00 0.00 178.31 178.86 2w01 h GLY 473 N 0.79 -0.20 0.98 -1.45 0.00 -0.91 -0.93 103.07 101.35 2w01 h GLY 473 Ca 0.20 0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.64 2w01 h GLY 473 CO -0.03 -0.10 0.21 1.70 0.00 0.00 0.00 176.54 178.32 2w01 h LYS 474 N -0.21 0.46 -0.88 4.80 1.63 -1.26 -2.67 116.57 118.43 2w01 h LYS 474 Ca 0.00 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.76 2w01 h LYS 474 Cb 0.20 -0.10 -0.04 0.00 -0.60 0.00 0.00 32.23 31.69 2w01 h LYS 474 CO -0.02 0.34 0.54 0.52 -3.45 0.00 0.00 179.45 177.37 2w01 h MET 475 N 0.44 1.19 -0.53 1.90 2.86 -0.82 -2.92 114.93 117.05 2w01 h MET 475 Ca 0.12 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2w01 h MET 475 Cb -0.00 -0.25 -0.03 0.00 0.06 0.00 0.00 31.60 31.38 2w01 h MET 475 CO -0.02 0.83 0.28 0.00 1.06 0.00 0.00 176.91 179.06 2w01 h ALA 476 N 1.29 1.50 0.02 6.32 0.00 -1.04 -0.62 119.26 126.72 2w01 h ALA 476 Ca 0.32 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.14 2w01 h ALA 476 Cb -0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2w01 h ALA 476 CO -0.06 0.42 -0.06 -0.44 0.00 0.00 0.00 179.25 179.11 2w01 h ASP 477 N 0.74 -0.16 -0.32 0.00 3.45 -1.34 -2.44 116.42 116.35 2w01 h ASP 477 Ca 0.19 0.02 -0.13 0.00 0.43 0.00 0.00 57.03 57.54 2w01 h ASP 477 Cb 0.03 0.07 -0.01 0.00 -0.56 0.00 0.00 39.33 38.86 2w01 h ASP 477 CO -0.03 -0.09 -0.27 -0.37 -1.57 0.00 0.00 179.24 176.91 2w01 h VAL 478 N -0.11 1.27 -0.38 -1.35 -1.51 -1.21 -2.27 116.25 110.69 2w01 h VAL 478 Ca 0.02 -1.41 0.01 0.00 -1.23 0.00 0.00 66.70 64.09 2w01 h VAL 478 Cb 0.13 1.26 -0.02 0.00 -2.13 0.00 0.00 31.29 30.52 2w01 h VAL 478 CO -0.05 0.47 0.23 0.40 -1.23 0.00 0.00 177.57 177.39 2w01 h ILE 479 N 0.71 1.05 -0.45 7.19 2.04 -1.17 -1.86 117.51 125.01 2w01 h ILE 479 Ca 0.09 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 2w01 h ILE 479 Cb 0.81 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 2w01 h ILE 479 CO 0.07 0.08 0.16 0.74 0.00 0.00 0.00 178.15 179.20 2w01 h THR 480 N 0.46 1.21 -0.44 -0.27 2.02 -1.42 -0.02 112.91 114.45 2w01 h THR 480 Ca 0.15 -0.69 0.03 0.00 0.77 0.00 0.00 66.41 66.67 2w01 h THR 480 Cb -0.01 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 2w01 h THR 480 CO -0.06 0.25 0.29 -0.74 0.37 0.00 0.00 175.52 175.63 2w01 h HIS 481 N 0.58 0.47 -0.54 3.16 -0.00 -1.23 -1.47 115.15 116.12 2w01 h HIS 481 Ca 0.15 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.53 2w01 h HIS 481 Cb 0.23 -0.16 0.00 0.00 -0.00 0.00 0.00 27.41 27.49 2w01 h HIS 481 CO 0.01 0.28 0.00 0.72 -0.00 0.00 0.00 177.93 178.94 2w01 n HIS 482 N -4.48 0.77 -2.43 5.26 8.25 -0.72 -4.95 115.22 116.92 2w01 n HIS 482 Ca 0.05 -0.37 -0.15 0.00 -0.26 0.00 0.00 57.72 56.99 2w01 n HIS 482 Cb 0.14 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.23 2w01 n HIS 482 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2w01 n GLY 483 N 1.31 -0.19 3.89 -1.41 0.00 -0.56 -4.86 105.19 103.37 2w01 n GLY 483 Ca 0.18 -0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 2w01 n GLY 483 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2w01 s GLY 484 N -2.50 1.86 -0.37 -0.02 0.00 -0.12 -4.84 107.32 101.34 2w01 s GLY 484 Ca 0.07 -0.32 -0.13 0.00 0.00 0.00 0.00 44.72 44.33 2w01 s GLY 484 CO 0.08 -0.16 0.24 -1.59 0.00 0.00 0.00 173.10 171.68 2w01 s THR 485 N -2.35 5.01 -0.62 0.90 2.01 0.50 -4.51 115.64 116.59 2w01 s THR 485 Ca 0.49 -0.56 -0.27 0.00 0.31 0.00 0.00 61.69 61.66 2w01 s THR 485 Cb -0.10 -3.70 -0.01 0.00 0.01 0.00 0.00 72.50 68.69 2w01 s THR 485 CO 0.33 -0.16 1.78 -0.63 -0.69 0.00 0.00 174.62 175.24 2w01 s ILE 486 N 1.65 3.42 0.00 1.82 1.01 -1.26 -0.02 121.20 127.81 2w01 s ILE 486 Ca 0.04 0.25 -0.20 0.00 0.00 0.00 0.00 60.65 60.75 2w01 s ILE 486 Cb -0.18 -4.06 -0.25 0.00 0.01 0.00 0.00 42.46 37.97 2w01 s ILE 486 CO 0.09 -1.01 1.07 -0.78 0.00 0.00 0.00 174.94 174.30 2w01 h ASP 487 N 14.19 0.56 -5.00 3.58 -0.00 -1.21 -3.48 116.42 125.06 2w01 h ASP 487 Ca -0.26 -0.80 -0.05 0.00 -0.00 0.00 0.00 57.03 55.92 2w01 h ASP 487 Cb 1.15 -0.17 -0.17 0.00 -0.00 0.00 0.00 39.33 40.13 2w01 h ASP 487 CO 1.22 1.29 0.18 -1.83 -0.00 0.00 0.00 179.24 180.10 2w01 s GLU 488 N -3.06 1.11 -0.25 0.28 -1.05 -1.10 -4.96 118.70 109.67 2w01 s GLU 488 Ca -0.13 0.04 -0.10 0.00 -0.15 0.00 0.00 54.97 54.63 2w01 s GLU 488 Cb 0.03 0.52 -0.04 0.00 -0.44 0.00 0.00 34.13 34.20 2w01 s GLU 488 CO 0.84 -0.39 0.14 -0.06 0.95 0.00 0.00 175.26 176.74 2w01 s PHE 489 N -1.92 3.20 -0.44 4.83 0.08 -1.26 -0.27 117.98 122.20 2w01 s PHE 489 Ca -0.08 -0.02 0.02 0.00 0.12 0.00 0.00 56.93 56.98 2w01 s PHE 489 Cb -0.00 -2.29 0.15 0.00 -0.57 0.00 0.00 43.02 40.30 2w01 s PHE 489 CO 0.03 -0.15 0.29 -1.64 -0.10 0.00 0.00 175.22 173.65 2w01 s MET 490 N 1.46 1.14 3.32 0.44 -1.94 0.12 -4.96 119.30 118.88 2w01 s MET 490 Ca 0.06 -2.02 0.00 0.00 -1.71 0.00 0.00 55.69 52.03 2w01 s MET 490 Cb -0.15 -1.98 0.00 0.00 2.01 0.00 0.00 34.83 34.71 2w01 s MET 490 CO 0.07 -1.24 0.00 0.41 -0.01 0.00 0.00 175.02 174.24 2w01 n GLY 491 N 3.32 0.91 1.74 -0.03 0.00 -1.26 -1.51 105.19 108.35 2w01 n GLY 491 Ca 0.16 0.41 -0.13 0.00 0.00 0.00 0.00 46.02 46.46 2w01 n GLY 491 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2w01 n ASP 492 N 6.43 3.61 -4.31 1.61 5.68 -1.26 -5.04 116.55 123.26 2w01 n ASP 492 Ca 0.00 -3.52 -0.17 0.00 -0.50 0.00 0.00 54.79 50.60 2w01 n ASP 492 Cb 0.00 -0.40 -0.10 0.00 -1.14 0.00 0.00 41.12 39.48 2w01 n ASP 492 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 2w01 s GLY 493 N -3.47 1.43 -0.00 6.12 0.00 -0.57 -3.07 107.32 107.77 2w01 s GLY 493 Ca 0.44 -1.70 0.01 0.00 0.00 0.00 0.00 44.72 43.48 2w01 s GLY 493 CO -0.00 -1.66 -0.03 -0.42 0.00 0.00 0.00 173.10 170.98 2w01 s ILE 494 N -3.36 0.27 -0.13 0.90 1.01 -1.07 -0.71 121.20 118.12 2w01 s ILE 494 Ca 0.25 -0.16 0.03 0.00 0.00 0.00 0.00 60.65 60.77 2w01 s ILE 494 Cb 0.04 -0.24 0.01 0.00 0.01 0.00 0.00 42.46 42.29 2w01 s ILE 494 CO 0.07 0.07 -0.22 -0.22 0.00 0.00 0.00 174.94 174.63 2w01 s LEU 495 N -0.10 2.10 0.01 2.97 0.20 0.63 -2.10 118.68 122.39 2w01 s LEU 495 Ca 0.01 -0.59 0.05 0.00 0.69 0.00 0.00 54.13 54.29 2w01 s LEU 495 Cb -0.01 -1.43 -0.02 0.00 -0.43 0.00 0.00 46.19 44.30 2w01 s LEU 495 CO -0.00 0.10 -0.15 0.54 -0.29 0.00 0.00 176.35 176.55 2w01 s VAL 496 N 0.70 1.16 -0.08 1.68 0.11 0.12 -0.60 120.40 123.49 2w01 s VAL 496 Ca -0.10 -0.79 0.02 0.00 -2.93 0.00 0.00 61.98 58.18 2w01 s VAL 496 Cb -0.16 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.67 2w01 s VAL 496 CO 0.01 0.20 -0.15 -0.76 -3.33 0.00 0.00 175.10 171.06 2w01 s LEU 497 N -0.69 2.65 -0.23 2.54 1.43 0.97 -1.56 118.68 123.78 2w01 s LEU 497 Ca 0.04 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 52.87 2w01 s LEU 497 Cb -0.07 -1.56 0.04 0.00 0.03 0.00 0.00 46.19 44.64 2w01 s LEU 497 CO 0.00 0.26 -0.14 -0.36 0.23 0.00 0.00 176.35 176.34 2w01 s PHE 498 N -0.20 3.09 0.00 0.29 0.08 -0.63 -0.37 117.98 120.24 2w01 s PHE 498 Ca -0.00 -2.05 0.00 0.00 0.12 0.00 0.00 56.93 55.00 2w01 s PHE 498 Cb -0.13 -1.93 0.00 0.00 -0.57 0.00 0.00 43.02 40.38 2w01 s PHE 498 CO 0.03 -0.85 0.00 0.41 -0.10 0.00 0.00 175.22 174.71 2w01 n GLY 499 N 4.51 0.99 3.14 4.36 0.00 -1.21 -1.39 105.19 115.59 2w01 n GLY 499 Ca -0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 2w01 n GLY 499 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w01 s ALA 500 N -1.73 -0.77 -0.01 4.61 0.00 -1.26 -3.79 121.76 118.80 2w01 s ALA 500 Ca 0.00 1.22 0.29 0.00 0.00 0.00 0.00 51.96 53.47 2w01 s ALA 500 Cb 0.00 -0.82 1.03 0.00 0.00 0.00 0.00 23.12 23.34 2w01 s ALA 500 CO 0.00 -0.29 1.86 -1.35 0.00 0.00 0.00 175.76 175.98 2w01 h PRO 501 N 7.32 0.00 -6.61 0.00 0.11 -1.99 -3.42 132.00 127.41 2w01 h PRO 501 Ca -0.36 0.00 -0.69 0.00 0.11 0.00 0.00 66.00 65.06 2w01 h PRO 501 Cb 1.16 0.00 -0.26 0.00 0.11 0.00 0.00 31.00 32.01 2w01 h PRO 501 CO 0.31 0.06 -0.85 -0.08 -0.21 0.00 0.00 178.00 177.23 2w01 s THR 502 N -3.55 2.40 0.40 -1.15 -1.32 -1.26 -5.15 115.64 106.01 2w01 s THR 502 Ca 0.02 -1.18 0.06 0.00 -1.21 0.00 0.00 61.69 59.39 2w01 s THR 502 Cb 0.08 -1.93 -0.07 0.00 -1.51 0.00 0.00 72.50 69.07 2w01 s THR 502 CO 0.59 0.45 0.02 -0.94 -2.21 0.00 0.00 174.62 172.53 2w01 s SER 503 N -1.05 3.65 0.27 8.08 1.04 -1.25 -3.33 113.70 121.11 2w01 s SER 503 Ca 0.12 -1.39 -0.10 0.00 0.48 0.00 0.00 55.95 55.06 2w01 s SER 503 Cb -0.10 -0.30 -0.00 0.00 0.10 0.00 0.00 66.02 65.71 2w01 s SER 503 CO 0.02 -0.50 0.47 -1.10 0.98 0.00 0.00 173.24 173.11 2w01 s GLN 504 N -3.75 1.62 0.19 4.02 -0.21 -1.26 -5.01 119.66 115.26 2w01 s GLN 504 Ca 0.34 -1.37 -0.02 0.00 0.02 0.00 0.00 55.36 54.33 2w01 s GLN 504 Cb 0.09 0.46 0.11 0.00 1.00 0.00 0.00 33.01 34.67 2w01 s GLN 504 CO 0.17 -0.67 1.49 1.96 -2.12 0.00 0.00 175.29 176.12 2w01 h GLN 505 N 2.24 0.49 -0.85 2.91 4.20 -2.02 -3.25 115.11 118.84 2w01 h GLN 505 Ca -0.27 -0.33 -0.13 0.00 0.06 0.00 0.00 58.65 57.98 2w01 h GLN 505 Cb 1.25 0.05 -0.08 0.00 0.30 0.00 0.00 27.48 29.00 2w01 h GLN 505 CO 0.37 0.95 0.16 -0.40 -0.67 0.00 0.00 178.83 179.24 2w01 n ASP 506 N -3.92 3.73 -0.11 1.46 5.68 -1.26 -4.64 116.55 117.49 2w01 n ASP 506 Ca -0.03 -2.73 -0.05 0.00 -0.50 0.00 0.00 54.79 51.47 2w01 n ASP 506 Cb 0.63 -0.65 0.01 0.00 -1.14 0.00 0.00 41.12 39.97 2w01 n ASP 506 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2w01 h ASP 507 N 1.71 -0.32 -0.37 -1.12 3.32 -1.92 0.11 116.42 117.83 2w01 h ASP 507 Ca 0.16 0.11 -0.05 0.00 0.02 0.00 0.00 57.03 57.26 2w01 h ASP 507 Cb 1.70 0.22 -0.01 0.00 0.22 0.00 0.00 39.33 41.46 2w01 h ASP 507 CO 0.45 -0.11 0.02 0.00 -1.72 0.00 0.00 179.24 177.88 2w01 h ALA 508 N 1.37 0.49 -0.32 3.45 0.00 -1.87 -1.38 119.26 121.01 2w01 h ALA 508 Ca 0.18 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.91 2w01 h ALA 508 Cb 0.28 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 2w01 h ALA 508 CO -0.38 0.24 -0.02 1.25 0.00 0.00 0.00 179.25 180.35 2w01 h LEU 509 N 0.46 -0.17 -1.46 0.00 5.85 -1.72 -2.02 115.31 116.24 2w01 h LEU 509 Ca 0.11 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.91 2w01 h LEU 509 Cb 0.44 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 2w01 h LEU 509 CO 0.02 -0.05 0.34 0.03 -0.34 0.00 0.00 178.44 178.44 2w01 h ARG 510 N 0.07 0.70 -0.23 1.25 3.08 -0.68 0.18 114.38 118.74 2w01 h ARG 510 Ca 0.15 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 60.09 2w01 h ARG 510 Cb 0.21 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 2w01 h ARG 510 CO -0.27 0.47 -0.11 0.00 -1.07 0.00 0.00 179.97 178.99 2w01 h ALA 511 N 1.66 0.33 -0.30 0.04 0.00 -0.79 0.66 119.26 120.86 2w01 h ALA 511 Ca 0.19 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2w01 h ALA 511 Cb -0.07 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2w01 h ALA 511 CO -0.04 0.18 0.12 0.28 0.00 0.00 0.00 179.25 179.78 2w01 h VAL 512 N 0.20 1.18 -0.75 0.00 2.07 -1.14 0.25 116.25 118.08 2w01 h VAL 512 Ca 0.05 -0.56 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 2w01 h VAL 512 Cb 0.61 0.99 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 2w01 h VAL 512 CO 0.03 0.19 0.40 0.00 0.02 0.00 0.00 177.57 178.22 2w01 h ALA 513 N 0.96 1.30 -0.17 1.67 0.00 -0.87 -1.63 119.26 120.52 2w01 h ALA 513 Ca 0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2w01 h ALA 513 Cb 0.19 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2w01 h ALA 513 CO -0.01 0.56 0.09 0.00 0.00 0.00 0.00 179.25 179.89 2w01 h GLY 515 N 0.16 -0.39 0.66 0.00 0.00 -0.14 0.27 103.07 103.62 2w01 h GLY 515 Ca 0.06 0.45 0.04 0.00 0.00 0.00 0.00 47.33 47.88 2w01 h GLY 515 CO -0.01 -0.21 0.05 -2.08 0.00 0.00 0.00 176.54 174.29 2w01 h VAL 516 N -0.31 0.86 -0.21 4.60 2.07 -1.31 -2.07 116.25 119.88 2w01 h VAL 516 Ca 0.14 -0.05 -0.09 0.00 0.82 0.00 0.00 66.70 67.52 2w01 h VAL 516 Cb 0.56 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 2w01 h VAL 516 CO -0.51 0.03 -0.28 -0.08 0.02 0.00 0.00 177.57 176.76 2w01 h GLU 517 N 0.15 0.40 -0.21 1.57 4.81 -1.18 -1.89 114.58 118.23 2w01 h GLU 517 Ca 0.13 -0.15 0.05 0.00 -0.13 0.00 0.00 59.36 59.26 2w01 h GLU 517 Cb 0.14 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 2w01 h GLU 517 CO -0.18 0.64 -0.11 0.52 -0.73 0.00 0.00 179.01 179.15 2w01 h MET 518 N 0.35 -0.09 -0.90 1.92 2.86 -0.10 0.76 114.93 119.73 2w01 h MET 518 Ca 0.05 0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.74 2w01 h MET 518 Cb 0.67 0.02 -0.06 0.00 0.06 0.00 0.00 31.60 32.29 2w01 h MET 518 CO 0.05 -0.06 0.58 1.96 1.06 0.00 0.00 176.91 180.50 2w01 h GLN 519 N -0.09 1.05 -0.20 1.72 1.08 -1.19 -2.29 115.11 115.19 2w01 h GLN 519 Ca 0.11 -0.06 -0.18 0.00 -1.45 0.00 0.00 58.65 57.07 2w01 h GLN 519 Cb 0.26 -0.24 -0.00 0.00 -0.05 0.00 0.00 27.48 27.45 2w01 h GLN 519 CO -0.27 0.70 -0.59 -0.07 -0.95 0.00 0.00 178.83 177.65 2w01 h LEU 520 N 1.08 0.74 -2.35 1.46 4.07 -0.90 -2.75 115.31 116.66 2w01 h LEU 520 Ca 0.37 -0.41 0.00 0.00 0.08 0.00 0.00 57.88 57.92 2w01 h LEU 520 Cb 0.08 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 41.61 2w01 h LEU 520 CO -0.14 1.16 0.00 0.00 -1.08 0.00 0.00 178.44 178.38 2w01 h ALA 521 N 0.85 1.00 0.00 1.53 0.00 -0.56 -2.74 119.26 119.34 2w01 h ALA 521 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2w01 h ALA 521 Cb 1.16 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 2w01 h ALA 521 CO 0.12 0.00 -0.58 1.25 0.00 0.00 0.00 179.25 180.03 2w01 h LEU 522 N 0.00 0.00 -1.11 0.00 7.12 -1.10 -2.71 115.31 117.52 2w01 h LEU 522 Ca 0.00 0.00 0.07 0.00 0.13 0.00 0.00 57.88 58.08 2w01 h LEU 522 Cb 0.11 0.00 -0.06 0.00 -0.53 0.00 0.00 40.66 40.18 2w01 h LEU 522 CO 0.00 0.58 0.61 0.03 -0.13 0.00 0.00 178.44 179.53 2w01 h ARG 523 N 0.00 1.04 -0.00 1.25 3.08 -1.58 0.26 114.38 118.42 2w01 h ARG 523 Ca -0.01 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 2w01 h ARG 523 Cb 1.05 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 30.86 2w01 h ARG 523 CO 0.08 0.69 -0.00 1.49 -1.07 0.00 0.00 179.97 181.15 2w01 h GLU 524 N 1.07 0.01 -0.11 0.04 4.81 -1.68 -1.33 114.58 117.38 2w01 h GLU 524 Ca 0.40 -0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.59 2w01 h GLU 524 Cb 0.20 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 2w01 h GLU 524 CO -0.16 0.32 -0.10 -0.39 -0.73 0.00 0.00 179.01 177.95 2w01 h VAL 525 N -0.31 1.14 -0.11 0.32 -1.51 -1.08 -2.32 116.25 112.39 2w01 h VAL 525 Ca 0.00 -0.61 -0.18 0.00 -1.23 0.00 0.00 66.70 64.68 2w01 h VAL 525 Cb 0.32 1.17 -0.00 0.00 -2.13 0.00 0.00 31.29 30.65 2w01 h VAL 525 CO 0.00 0.19 -0.69 0.78 -1.23 0.00 0.00 177.57 176.62 2w01 h ASN 526 N 0.16 0.53 -0.40 4.19 2.35 -0.24 0.61 115.58 122.78 2w01 h ASN 526 Ca 0.03 -0.33 0.05 0.00 -0.55 0.00 0.00 56.30 55.50 2w01 h ASN 526 Cb 0.29 -0.16 -0.05 0.00 0.05 0.00 0.00 38.32 38.46 2w01 h ASN 526 CO 0.02 1.07 0.12 1.56 -1.65 0.00 0.00 177.43 178.55 2w01 h GLN 527 N 0.32 0.27 -0.06 0.81 1.08 -0.73 0.45 115.11 117.25 2w01 h GLN 527 Ca -0.02 -0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.15 2w01 h GLN 527 Cb 1.26 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 28.62 2w01 h GLN 527 CO 0.12 0.18 0.01 1.96 -0.95 0.00 0.00 178.83 180.15 2w01 h GLN 528 N 0.27 0.10 -0.88 1.46 4.20 -1.25 -1.90 115.11 117.12 2w01 h GLN 528 Ca 0.18 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.87 2w01 h GLN 528 Cb 0.18 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.91 2w01 h GLN 528 CO -0.20 0.34 0.57 0.28 -0.67 0.00 0.00 178.83 179.15 2w01 h VAL 529 N -0.15 1.23 -0.62 -0.54 2.07 -0.81 -1.77 116.25 115.66 2w01 h VAL 529 Ca 0.02 -0.43 -0.09 0.00 0.82 0.00 0.00 66.70 67.01 2w01 h VAL 529 Cb 0.28 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 2w01 h VAL 529 CO 0.00 0.22 0.02 0.74 0.02 0.00 0.00 177.57 178.57 2w01 h THR 530 N 1.20 1.27 -0.02 2.57 2.02 -0.81 -2.13 112.91 117.00 2w01 h THR 530 Ca 0.32 -1.14 0.00 0.00 0.77 0.00 0.00 66.41 66.36 2w01 h THR 530 Cb -0.12 0.77 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 2w01 h THR 530 CO -0.07 0.42 0.00 0.61 0.37 0.00 0.00 175.52 176.85 2w01 n GLY 531 N -0.45 -0.52 0.28 2.16 0.00 -0.72 -2.13 105.19 103.81 2w01 n GLY 531 Ca 0.03 -0.30 0.15 0.00 0.00 0.00 0.00 46.02 45.90 2w01 n GLY 531 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2w01 n LEU 532 N -0.43 0.90 0.00 0.99 4.77 -0.69 -4.90 117.00 117.63 2w01 n LEU 532 Ca 0.20 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 2w01 n LEU 532 Cb 0.21 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2w01 n LEU 532 CO 0.16 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 2w01 n GLY 533 N 1.13 0.78 3.84 -0.72 0.00 -0.91 -5.07 105.19 104.25 2w01 n GLY 533 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 2w01 n GLY 533 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w01 s LEU 534 N 0.00 3.54 0.49 0.99 2.01 -1.00 -5.02 118.68 119.69 2w01 s LEU 534 Ca 0.00 -0.55 -0.12 0.00 0.01 0.00 0.00 54.13 53.47 2w01 s LEU 534 Cb 0.00 -2.15 -0.06 0.00 0.01 0.00 0.00 46.19 43.99 2w01 s LEU 534 CO 0.00 -0.38 0.89 -1.10 1.01 0.00 0.00 176.35 176.77 2w01 s GLN 535 N -3.99 3.78 0.76 1.70 -1.52 -1.26 -3.80 119.66 115.33 2w01 s GLN 535 Ca 0.41 0.65 -0.13 0.00 -1.95 0.00 0.00 55.36 54.34 2w01 s GLN 535 Cb -0.05 -2.25 0.05 0.00 -0.22 0.00 0.00 33.01 30.54 2w01 s GLN 535 CO 0.26 -0.22 1.16 -1.25 -0.25 0.00 0.00 175.29 174.99 2w01 s PRO 536 N -4.24 2.06 0.10 2.91 0.04 -1.26 -4.73 135.00 129.88 2w01 s PRO 536 Ca 0.54 1.57 -0.11 0.00 0.04 0.00 0.00 61.00 63.04 2w01 s PRO 536 Cb -0.10 -1.84 -0.06 0.00 0.04 0.00 0.00 34.50 32.53 2w01 s PRO 536 CO 0.37 -1.85 0.44 -0.51 0.04 0.00 0.00 177.00 175.48 2w01 s LEU 537 N -5.48 4.33 0.02 -3.56 1.43 -1.26 -5.10 118.68 109.06 2w01 s LEU 537 Ca 0.70 0.85 0.07 0.00 -1.03 0.00 0.00 54.13 54.72 2w01 s LEU 537 Cb -0.25 -3.09 -0.03 0.00 0.03 0.00 0.00 46.19 42.85 2w01 s LEU 537 CO 0.48 0.14 -0.19 -1.83 0.23 0.00 0.00 176.35 175.18 2w01 s GLU 538 N -2.00 2.12 -0.02 1.70 -1.05 -1.26 -4.98 118.70 113.21 2w01 s GLU 538 Ca 0.35 -0.94 0.03 0.00 -0.15 0.00 0.00 54.97 54.26 2w01 s GLU 538 Cb -0.14 -2.19 -0.00 0.00 -0.44 0.00 0.00 34.13 31.36 2w01 s GLU 538 CO 0.19 0.55 -0.10 1.41 0.95 0.00 0.00 175.26 178.26 2w01 s MET 539 N -1.23 1.00 0.06 -4.83 -2.45 -1.26 -2.65 119.30 107.93 2w01 s MET 539 Ca 0.13 -0.36 0.06 0.00 -1.25 0.00 0.00 55.69 54.27 2w01 s MET 539 Cb -0.10 -0.94 -0.04 0.00 1.25 0.00 0.00 34.83 35.00 2w01 s MET 539 CO 0.04 0.17 -0.11 0.20 1.05 0.00 0.00 175.02 176.37 2w01 s GLY 540 N 0.00 1.72 -0.03 2.11 0.00 0.19 -1.72 107.32 109.59 2w01 s GLY 540 Ca -0.00 -1.16 0.02 0.00 0.00 0.00 0.00 44.72 43.57 2w01 s GLY 540 CO 0.00 -1.08 -0.06 -0.42 0.00 0.00 0.00 173.10 171.54 2w01 s ILE 541 N -1.07 0.58 0.00 0.90 1.01 -0.65 -0.88 121.20 121.09 2w01 s ILE 541 Ca 0.18 -0.20 0.08 0.00 0.00 0.00 0.00 60.65 60.71 2w01 s ILE 541 Cb -0.11 -0.56 -0.02 0.00 0.01 0.00 0.00 42.46 41.78 2w01 s ILE 541 CO 0.09 0.21 -0.24 -0.83 0.00 0.00 0.00 174.94 174.18 2w01 s GLY 542 N 0.56 1.37 -0.03 6.18 0.00 -0.58 -0.92 107.32 113.90 2w01 s GLY 542 Ca -0.08 -1.15 0.02 0.00 0.00 0.00 0.00 44.72 43.51 2w01 s GLY 542 CO 0.00 -0.99 -0.06 -0.42 0.00 0.00 0.00 173.10 171.64 2w01 s ILE 543 N -0.71 0.55 0.01 0.90 1.01 -0.25 -1.38 121.20 121.33 2w01 s ILE 543 Ca 0.11 -0.20 0.00 0.00 0.00 0.00 0.00 60.65 60.57 2w01 s ILE 543 Cb -0.10 -0.53 -0.01 0.00 0.01 0.00 0.00 42.46 41.83 2w01 s ILE 543 CO 0.01 0.20 -0.03 0.21 0.00 0.00 0.00 174.94 175.33 2w01 s ASN 544 N 0.46 0.25 -0.09 3.58 3.04 -0.23 -1.79 114.94 120.17 2w01 s ASN 544 Ca -0.06 -0.30 0.04 0.00 0.04 0.00 0.00 52.86 52.58 2w01 s ASN 544 Cb -0.10 0.04 -0.01 0.00 -1.54 0.00 0.00 41.25 39.65 2w01 s ASN 544 CO 0.00 -0.16 -0.22 -0.89 -3.04 0.00 0.00 177.10 172.80 2w01 s THR 545 N -0.83 2.28 0.00 -5.21 2.01 -1.26 0.72 115.64 113.35 2w01 s THR 545 Ca -0.08 -0.96 0.00 0.00 0.31 0.00 0.00 61.69 60.96 2w01 s THR 545 Cb -0.06 -1.87 0.00 0.00 0.01 0.00 0.00 72.50 70.58 2w01 s THR 545 CO -0.00 0.56 0.00 0.61 -0.69 0.00 0.00 174.62 175.10 2w01 n GLY 546 N 3.24 -0.52 3.69 4.40 0.00 0.20 -4.60 105.19 111.60 2w01 n GLY 546 Ca -0.18 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 2w01 n GLY 546 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2w01 s GLU 547 N -2.00 4.28 0.12 1.61 2.12 -1.26 -1.29 118.70 122.29 2w01 s GLU 547 Ca 0.00 1.92 0.02 0.00 0.36 0.00 0.00 54.97 57.27 2w01 s GLU 547 Cb 0.00 -3.60 -0.04 0.00 0.26 0.00 0.00 34.13 30.75 2w01 s GLU 547 CO 0.00 -0.58 -0.05 0.14 -0.54 0.00 0.00 175.26 174.24 2w01 s VAL 548 N 2.50 0.68 -0.12 3.70 -7.23 0.89 -4.60 120.40 116.21 2w01 s VAL 548 Ca 0.63 -1.95 -0.24 0.00 -1.81 0.00 0.00 61.98 58.61 2w01 s VAL 548 Cb -0.30 -1.80 -0.03 0.00 0.56 0.00 0.00 36.38 34.81 2w01 s VAL 548 CO 0.25 -0.77 0.73 -0.69 -0.31 0.00 0.00 175.10 174.32 2w01 s VAL 549 N -3.64 4.99 0.09 1.32 1.01 -0.64 -0.63 120.40 122.91 2w01 s VAL 549 Ca 0.15 1.46 0.09 0.00 0.00 0.00 0.00 61.98 63.68 2w01 s VAL 549 Cb 0.05 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 2w01 s VAL 549 CO -0.02 0.15 -0.23 0.68 0.00 0.00 0.00 175.10 175.68 2w01 s VAL 550 N 1.44 2.48 0.00 2.92 -7.23 0.39 -1.06 120.40 119.34 2w01 s VAL 550 Ca 0.36 -1.52 0.00 0.00 -1.81 0.00 0.00 61.98 59.02 2w01 s VAL 550 Cb -0.17 -2.08 0.00 0.00 0.56 0.00 0.00 36.38 34.69 2w01 s VAL 550 CO 0.15 0.19 0.00 0.61 -0.31 0.00 0.00 175.10 175.74 2w01 n GLY 551 N 1.17 1.63 3.57 2.32 0.00 -0.86 -1.20 105.19 111.81 2w01 n GLY 551 Ca -0.17 -0.98 -0.40 0.00 0.00 0.00 0.00 46.02 44.48 2w01 n GLY 551 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2w01 s ASN 552 N 0.00 5.24 -0.14 1.61 -0.87 -1.26 -0.00 114.94 119.52 2w01 s ASN 552 Ca 0.00 0.94 -0.07 0.00 -1.57 0.00 0.00 52.86 52.17 2w01 s ASN 552 Cb 0.00 -2.52 -0.04 0.00 -0.02 0.00 0.00 41.25 38.67 2w01 s ASN 552 CO 0.00 -2.29 0.10 -0.63 -2.57 0.00 0.00 177.10 171.72 2w01 s ILE 553 N 9.21 5.16 -5.00 0.60 -1.09 0.41 -4.67 121.20 125.82 2w01 s ILE 553 Ca 0.82 0.09 0.00 0.00 -2.23 0.00 0.00 60.65 59.32 2w01 s ILE 553 Cb -0.18 -3.27 0.00 0.00 -1.58 0.00 0.00 42.46 37.43 2w01 s ILE 553 CO 0.27 0.56 0.00 0.61 -1.23 0.00 0.00 174.94 175.15 2w01 n GLY 554 N 2.51 0.07 0.00 6.18 0.00 -1.26 0.28 105.19 112.97 2w01 n GLY 554 Ca -0.19 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.56 2w01 n GLY 554 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2w01 n SER 555 N 0.00 0.70 0.00 1.61 3.41 -0.98 -4.92 113.62 113.44 2w01 n SER 555 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2w01 n SER 555 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2w01 n SER 555 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2w01 n GLU 556 N 0.00 0.00 0.00 4.33 4.71 -1.26 -4.14 120.64 124.29 2w01 n GLU 556 Ca 0.00 0.48 0.00 0.00 -0.01 0.00 0.00 57.16 57.63 2w01 n GLU 556 Cb 0.00 -1.28 0.00 0.00 -1.01 0.00 0.00 31.44 29.15 2w01 n GLU 556 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2w01 n LYS 557 N -1.95 0.77 -2.69 3.49 4.01 -1.26 -4.29 118.16 116.24 2w01 n LYS 557 Ca 0.00 0.00 -0.05 0.00 -0.51 0.00 0.00 58.31 57.75 2w01 n LYS 557 Cb 0.00 -1.12 0.06 0.00 -0.51 0.00 0.00 35.03 33.45 2w01 n LYS 557 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 2w01 n ARG 558 N -0.30 0.30 -3.10 1.97 0.63 -1.26 -5.15 116.66 109.75 2w01 n ARG 558 Ca 0.00 -1.06 -0.34 0.00 -0.92 0.00 0.00 57.85 55.53 2w01 n ARG 558 Cb 0.06 -0.54 -0.06 0.00 0.45 0.00 0.00 32.46 32.37 2w01 n ARG 558 CO 0.00 0.00 0.00 -0.08 -2.51 0.00 0.00 177.63 175.04 2w01 s THR 559 N 0.48 4.61 -0.04 5.15 -1.32 -1.26 -2.31 115.64 120.95 2w01 s THR 559 Ca 0.27 1.11 0.01 0.00 -1.21 0.00 0.00 61.69 61.87 2w01 s THR 559 Cb 0.18 -3.69 0.02 0.00 -1.51 0.00 0.00 72.50 67.49 2w01 s THR 559 CO -0.12 -0.07 -0.06 -0.75 -2.21 0.00 0.00 174.62 171.41 2w01 s LYS 560 N -2.67 0.89 -0.33 7.08 2.47 0.80 -4.94 119.74 123.05 2w01 s LYS 560 Ca 0.51 -0.17 -0.29 0.00 -1.56 0.00 0.00 55.97 54.46 2w01 s LYS 560 Cb -0.12 -0.85 -0.01 0.00 -1.46 0.00 0.00 37.83 35.39 2w01 s LYS 560 CO 0.18 -0.02 1.52 -0.47 0.16 0.00 0.00 175.35 176.72 2w01 s TYR 561 N 0.67 2.26 0.32 4.03 5.04 -1.26 0.16 117.35 128.56 2w01 s TYR 561 Ca -0.10 0.67 0.07 0.00 -2.44 0.00 0.00 57.07 55.27 2w01 s TYR 561 Cb -0.13 -4.13 -0.06 0.00 0.35 0.00 0.00 41.96 37.99 2w01 s TYR 561 CO 0.01 -2.35 -0.03 0.20 -1.34 0.00 0.00 175.55 172.04 2w01 s GLY 562 N 4.22 2.03 -0.02 8.97 0.00 1.00 -4.92 107.32 118.60 2w01 s GLY 562 Ca 0.66 -2.02 0.01 0.00 0.00 0.00 0.00 44.72 43.37 2w01 s GLY 562 CO 0.30 -1.90 -0.01 0.14 0.00 0.00 0.00 173.10 171.63 2w01 s VAL 563 N -2.96 0.21 -0.04 1.40 1.01 -1.26 -2.04 120.40 116.73 2w01 s VAL 563 Ca 0.32 -0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.30 2w01 s VAL 563 Cb 0.05 -0.25 0.02 0.00 0.00 0.00 0.00 36.38 36.20 2w01 s VAL 563 CO 0.14 0.11 -0.04 -0.69 0.00 0.00 0.00 175.10 174.63 2w01 s VAL 564 N 0.55 0.45 0.00 2.92 1.01 -0.23 -5.00 120.40 120.11 2w01 s VAL 564 Ca -0.05 -0.10 0.00 0.00 0.00 0.00 0.00 61.98 61.83 2w01 s VAL 564 Cb -0.08 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.82 2w01 s VAL 564 CO -0.01 0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.90 2w01 n GLY 565 N 3.91 3.19 0.34 4.51 0.00 -1.26 -1.61 105.19 114.26 2w01 n GLY 565 Ca -0.24 -1.36 0.31 0.00 0.00 0.00 0.00 46.02 44.72 2w01 n GLY 565 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w01 h ALA 566 N 0.00 2.18 -0.06 4.61 0.00 -2.00 0.07 119.26 124.06 2w01 h ALA 566 Ca 0.00 0.24 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 2w01 h ALA 566 Cb 0.00 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2w01 h ALA 566 CO 0.00 -0.93 -0.35 1.96 0.00 0.00 0.00 179.25 179.94 2w01 h GLN 567 N 0.07 0.12 0.83 0.00 1.08 -1.91 -1.76 115.11 113.53 2w01 h GLN 567 Ca 0.83 -0.05 -0.04 0.00 -1.45 0.00 0.00 58.65 57.94 2w01 h GLN 567 Cb 2.18 -0.01 0.01 0.00 -0.05 0.00 0.00 27.48 29.61 2w01 h GLN 567 CO -0.71 0.46 -0.40 0.28 -0.95 0.00 0.00 178.83 177.52 2w01 h VAL 568 N 0.11 0.00 -1.05 -0.54 2.07 -1.31 -3.08 116.25 112.45 2w01 h VAL 568 Ca 0.01 -0.07 0.30 0.00 0.82 0.00 0.00 66.70 67.76 2w01 h VAL 568 Cb 0.67 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.31 2w01 h VAL 568 CO 0.05 0.00 0.63 0.78 0.02 0.00 0.00 177.57 179.05 2w01 h ASN 569 N -1.18 0.52 0.15 0.57 4.21 -1.56 -1.85 115.58 116.44 2w01 h ASN 569 Ca -0.11 0.15 -0.06 0.00 1.21 0.00 0.00 56.30 57.48 2w01 h ASN 569 Cb 0.85 0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 38.12 2w01 h ASN 569 CO 0.19 -0.02 -0.24 0.25 -1.29 0.00 0.00 177.43 176.32 2w01 h LEU 570 N 0.39 0.15 -0.27 1.61 5.85 -1.31 -2.03 115.31 119.70 2w01 h LEU 570 Ca 0.69 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 59.34 2w01 h LEU 570 Cb 1.61 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.59 2w01 h LEU 570 CO -0.48 0.40 0.04 0.00 -0.34 0.00 0.00 178.44 178.06 2w01 h THR 571 N 0.14 1.23 -0.52 1.05 1.03 -1.24 0.37 112.91 114.97 2w01 h THR 571 Ca 0.02 -0.79 0.09 0.00 -0.01 0.00 0.00 66.41 65.73 2w01 h THR 571 Cb 0.50 1.23 -0.08 0.00 -1.07 0.00 0.00 68.15 68.74 2w01 h THR 571 CO 0.03 0.25 0.08 1.88 -0.01 0.00 0.00 175.52 177.76 2w01 h TYR 572 N 0.27 0.12 -0.70 0.00 0.05 -1.59 -0.84 116.97 114.27 2w01 h TYR 572 Ca 0.08 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.90 2w01 h TYR 572 Cb 0.34 0.03 -0.03 0.00 1.01 0.00 0.00 36.73 38.07 2w01 h TYR 572 CO 0.02 -0.04 0.45 0.00 -1.05 0.00 0.00 178.16 177.54 2w01 h ARG 573 N 0.21 0.93 -0.03 4.88 -0.00 -0.91 -1.56 114.38 117.90 2w01 h ARG 573 Ca 0.26 -0.07 -0.00 0.00 -0.50 0.00 0.00 59.98 59.68 2w01 h ARG 573 Cb 0.38 -0.20 -0.00 0.00 0.00 0.00 0.00 29.97 30.14 2w01 h ARG 573 CO -0.37 0.64 0.01 0.82 0.00 0.00 0.00 179.97 181.07 2w01 h ILE 574 N 0.95 1.07 -0.93 2.04 2.04 -0.55 -2.66 117.51 119.46 2w01 h ILE 574 Ca 0.25 -0.19 0.17 0.00 1.00 0.00 0.00 64.86 66.10 2w01 h ILE 574 Cb -0.08 1.15 -0.10 0.00 -0.74 0.00 0.00 36.82 37.05 2w01 h ILE 574 CO -0.05 0.05 0.52 -0.08 0.00 0.00 0.00 178.15 178.59 2w01 h GLU 575 N -0.04 0.66 -0.77 2.37 4.22 -1.03 -2.64 114.58 117.34 2w01 h GLU 575 Ca 0.01 -0.04 0.22 0.00 0.08 0.00 0.00 59.36 59.63 2w01 h GLU 575 Cb 0.07 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 2w01 h GLU 575 CO -0.00 0.43 0.55 0.66 -2.18 0.00 0.00 179.01 178.48 2w01 h SER 576 N 0.68 0.02 1.09 1.04 4.64 -0.91 -2.45 113.55 117.66 2w01 h SER 576 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 2w01 h SER 576 Cb 0.80 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 2w01 h SER 576 CO -0.39 0.01 0.00 -1.22 -0.87 0.00 0.00 176.83 174.36 2w01 n TYR 577 N -4.32 0.52 -2.77 4.77 4.01 -0.99 -4.87 117.16 113.51 2w01 n TYR 577 Ca 0.16 0.16 -0.36 0.00 -0.16 0.00 0.00 57.90 57.70 2w01 n TYR 577 Cb 0.83 -0.77 -0.06 0.00 -0.31 0.00 0.00 39.34 39.03 2w01 n TYR 577 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2w01 s THR 578 N -3.09 4.22 0.30 -0.72 2.01 -0.92 -5.09 115.64 112.34 2w01 s THR 578 Ca 0.10 1.68 0.03 0.00 0.31 0.00 0.00 61.69 63.81 2w01 s THR 578 Cb 0.14 -3.86 0.03 0.00 0.01 0.00 0.00 72.50 68.82 2w01 s THR 578 CO 0.50 -0.01 0.24 0.35 -0.69 0.00 0.00 174.62 175.01 2w01 n THR 579 N 0.14 0.00 -1.72 -0.82 -2.24 -1.26 -4.96 114.28 103.41 2w01 n THR 579 Ca 0.04 -1.15 -0.42 0.00 -2.27 0.00 0.00 64.05 60.24 2w01 n THR 579 Cb 0.51 -0.30 -0.02 0.00 -2.10 0.00 0.00 70.33 68.42 2w01 n THR 579 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2w01 n GLY 580 N 1.43 1.28 2.21 3.38 0.00 -1.26 -2.23 105.19 109.99 2w01 n GLY 580 Ca -0.00 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.53 2w01 n GLY 580 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w01 n GLY 581 N 2.57 0.93 3.88 -0.02 0.00 -0.70 -4.89 105.19 106.96 2w01 n GLY 581 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 2w01 n GLY 581 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w01 s GLN 582 N -0.26 3.29 -0.22 1.61 -0.21 -0.95 -5.02 119.66 117.89 2w01 s GLN 582 Ca 0.00 -0.48 0.02 0.00 0.02 0.00 0.00 55.36 54.91 2w01 s GLN 582 Cb 0.00 -2.96 0.05 0.00 1.00 0.00 0.00 33.01 31.09 2w01 s GLN 582 CO 0.00 0.61 -0.11 0.42 -2.12 0.00 0.00 175.29 174.09 2w01 s ILE 583 N -1.44 1.85 -0.17 1.08 1.01 -1.26 -1.63 121.20 120.64 2w01 s ILE 583 Ca 0.32 -1.24 -0.08 0.00 0.00 0.00 0.00 60.65 59.65 2w01 s ILE 583 Cb -0.13 -1.93 -0.04 0.00 0.01 0.00 0.00 42.46 40.37 2w01 s ILE 583 CO 0.24 0.11 0.11 -0.36 0.00 0.00 0.00 174.94 175.04 2w01 s PHE 584 N 1.29 3.40 0.01 3.97 0.08 -0.10 -0.72 117.98 125.91 2w01 s PHE 584 Ca -0.04 0.30 0.04 0.00 0.12 0.00 0.00 56.93 57.35 2w01 s PHE 584 Cb -0.17 -2.06 -0.02 0.00 -0.57 0.00 0.00 43.02 40.20 2w01 s PHE 584 CO -0.07 0.37 -0.12 0.96 -0.10 0.00 0.00 175.22 176.25 2w01 s ILE 585 N -0.03 0.97 0.86 0.64 -4.36 -0.37 -1.09 121.20 117.82 2w01 s ILE 585 Ca 0.09 -0.74 -0.12 0.00 -0.26 0.00 0.00 60.65 59.62 2w01 s ILE 585 Cb -0.12 -0.86 0.11 0.00 1.25 0.00 0.00 42.46 42.84 2w01 s ILE 585 CO 0.00 0.11 1.10 -0.94 0.24 0.00 0.00 174.94 175.46 2w01 s SER 586 N -0.72 3.89 0.36 4.36 1.04 -0.74 0.15 113.70 122.05 2w01 s SER 586 Ca 0.02 1.26 0.03 0.00 0.48 0.00 0.00 55.95 57.75 2w01 s SER 586 Cb -0.06 -1.94 0.69 0.00 0.10 0.00 0.00 66.02 64.80 2w01 s SER 586 CO 0.00 -2.35 2.02 0.28 0.98 0.00 0.00 173.24 174.17 2w01 h SER 587 N -1.35 0.68 -0.26 7.02 0.02 -1.92 -2.11 113.55 115.63 2w01 h SER 587 Ca -0.49 -0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 60.34 2w01 h SER 587 Cb 1.29 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.65 2w01 h SER 587 CO 0.59 0.49 -0.18 0.71 -1.14 0.00 0.00 176.83 177.29 2w01 h THR 588 N 0.80 1.26 -0.72 -2.27 1.35 -1.91 -0.91 112.91 110.51 2w01 h THR 588 Ca 0.22 -1.24 -0.05 0.00 -0.55 0.00 0.00 66.41 64.79 2w01 h THR 588 Cb -0.07 1.17 -0.03 0.00 -1.73 0.00 0.00 68.15 67.50 2w01 h THR 588 CO -0.05 0.41 0.27 0.74 -0.25 0.00 0.00 175.52 176.65 2w01 h THR 589 N 0.63 1.25 -0.57 6.82 2.02 -1.73 -1.25 112.91 120.07 2w01 h THR 589 Ca 0.10 -0.82 -0.07 0.00 0.77 0.00 0.00 66.41 66.39 2w01 h THR 589 Cb 0.65 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 2w01 h THR 589 CO 0.05 0.33 0.07 0.25 0.37 0.00 0.00 175.52 176.58 2w01 h LEU 590 N 1.04 0.93 -0.34 2.58 6.46 -1.04 0.33 115.31 125.26 2w01 h LEU 590 Ca 0.24 -0.27 -0.17 0.00 -0.12 0.00 0.00 57.88 57.55 2w01 h LEU 590 Cb 0.24 -0.25 -0.00 0.00 -0.73 0.00 0.00 40.66 39.92 2w01 h LEU 590 CO -0.02 0.97 -0.46 -0.33 -0.62 0.00 0.00 178.44 177.98 2w01 h GLU 591 N 0.85 0.91 -0.54 1.25 5.08 -1.14 -1.02 114.58 119.97 2w01 h GLU 591 Ca 0.17 -0.53 -0.10 0.00 -1.00 0.00 0.00 59.36 57.90 2w01 h GLU 591 Cb 0.45 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 2w01 h GLU 591 CO 0.02 1.17 -0.07 0.00 -1.00 0.00 0.00 179.01 179.13 2w01 h ALA 592 N 0.73 0.86 -0.03 3.43 0.00 -1.12 -3.22 119.26 119.91 2w01 h ALA 592 Ca 0.04 -0.33 -0.21 0.00 0.00 0.00 0.00 54.91 54.41 2w01 h ALA 592 Cb 1.06 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2w01 h ALA 592 CO 0.11 0.65 -0.88 0.00 0.00 0.00 0.00 179.25 179.13 2w01 h ALA 593 N 1.03 0.42 0.00 0.00 0.00 -0.85 -3.43 119.26 116.43 2w01 h ALA 593 Ca 0.15 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2w01 h ALA 593 Cb 0.61 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2w01 h ALA 593 CO 0.04 0.80 0.00 0.41 0.00 0.00 0.00 179.25 180.50 2w01 n GLY 594 N 0.84 0.32 0.00 0.00 0.00 -0.40 -4.57 105.19 101.37 2w01 n GLY 594 Ca -0.06 -1.83 0.01 0.00 0.00 0.00 0.00 46.02 44.14 2w01 n GLY 594 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2w01 n ASP 595 N -0.79 0.00 0.04 1.61 3.85 -1.26 -1.66 116.55 118.34 2w01 n ASP 595 Ca 0.00 0.09 0.09 0.00 -0.71 0.00 0.00 54.79 54.26 2w01 n ASP 595 Cb 0.00 -0.15 0.40 0.00 -1.35 0.00 0.00 41.12 40.02 2w01 n ASP 595 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 2w01 n ARG 596 N -1.15 0.06 -2.84 0.11 1.74 -1.26 -4.50 116.66 108.82 2w01 n ARG 596 Ca 0.02 0.26 -0.42 0.00 -0.77 0.00 0.00 57.85 56.93 2w01 n ARG 596 Cb 0.02 -1.61 -0.04 0.00 -1.02 0.00 0.00 32.46 29.81 2w01 n ARG 596 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2w01 s VAL 597 N -3.08 4.67 -0.05 1.55 1.01 -0.66 0.06 120.40 123.89 2w01 s VAL 597 Ca 0.07 1.27 -0.17 0.00 0.00 0.00 0.00 61.98 63.16 2w01 s VAL 597 Cb 0.11 -4.26 -0.05 0.00 0.00 0.00 0.00 36.38 32.17 2w01 s VAL 597 CO 0.35 -0.40 0.45 -1.00 0.00 0.00 0.00 175.10 174.49 2w01 s HIS 598 N 3.27 3.63 -0.02 5.22 3.76 0.11 -4.99 115.29 126.26 2w01 s HIS 598 Ca 0.37 0.95 0.04 0.00 -0.15 0.00 0.00 55.06 56.26 2w01 s HIS 598 Cb -0.13 -2.42 -0.00 0.00 1.11 0.00 0.00 32.58 31.13 2w01 s HIS 598 CO 0.15 0.41 -0.13 0.08 -0.85 0.00 0.00 174.74 174.41 2w01 s VAL 599 N -0.26 1.04 -0.12 -0.90 1.01 -1.26 -0.84 120.40 119.08 2w01 s VAL 599 Ca 0.25 -0.53 0.15 0.00 0.00 0.00 0.00 61.98 61.85 2w01 s VAL 599 Cb -0.16 -0.89 -0.07 0.00 0.00 0.00 0.00 36.38 35.26 2w01 s VAL 599 CO 0.12 0.31 1.10 0.78 0.00 0.00 0.00 175.10 177.41 2w01 h ASN 600 N 6.10 0.00 -0.24 3.32 -0.26 -0.97 -3.45 115.58 120.08 2w01 h ASN 600 Ca -0.33 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.41 2w01 h ASN 600 Cb 1.17 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.43 2w01 h ASN 600 CO 0.49 0.59 0.00 0.61 -1.06 0.00 0.00 177.43 178.06 2w01 n GLY 601 N 1.33 -1.16 3.30 2.83 0.00 -1.25 -5.01 105.19 105.23 2w01 n GLY 601 Ca -0.04 -1.27 -0.16 0.00 0.00 0.00 0.00 46.02 44.55 2w01 n GLY 601 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w01 s ASN 602 N -4.00 1.21 -0.02 1.61 2.20 -1.26 -1.04 114.94 113.64 2w01 s ASN 602 Ca 0.00 -1.34 -0.02 0.00 -0.94 0.00 0.00 52.86 50.56 2w01 s ASN 602 Cb 0.00 0.15 0.01 0.00 -2.00 0.00 0.00 41.25 39.41 2w01 s ASN 602 CO 0.00 -0.69 0.07 -0.60 -2.94 0.00 0.00 177.10 172.93 2w01 s ARG 603 N -4.00 0.08 -0.22 3.55 3.52 -0.48 -4.95 118.95 116.45 2w01 s ARG 603 Ca 0.35 0.09 -0.06 0.00 -0.13 0.00 0.00 55.73 55.98 2w01 s ARG 603 Cb 0.07 0.04 -0.02 0.00 -1.56 0.00 0.00 34.95 33.48 2w01 s ARG 603 CO 0.11 -0.01 0.01 -0.08 -0.81 0.00 0.00 175.30 174.53 2w01 s THR 604 N 0.04 3.99 0.28 4.11 -1.32 -1.26 -0.81 115.64 120.67 2w01 s THR 604 Ca -0.00 -0.29 0.03 0.00 -1.21 0.00 0.00 61.69 60.21 2w01 s THR 604 Cb -0.01 -2.82 -0.06 0.00 -1.51 0.00 0.00 72.50 68.11 2w01 s THR 604 CO 0.00 0.40 0.06 0.68 -2.21 0.00 0.00 174.62 173.55 2w01 s VAL 605 N 1.22 0.96 -0.42 5.08 -7.23 0.04 -4.94 120.40 115.11 2w01 s VAL 605 Ca 0.04 -2.01 0.07 0.00 -1.81 0.00 0.00 61.98 58.27 2w01 s VAL 605 Cb -0.15 -2.64 0.18 0.00 0.56 0.00 0.00 36.38 34.33 2w01 s VAL 605 CO 0.02 -0.07 0.61 -1.58 -0.31 0.00 0.00 175.10 173.76 2w01 s GLN 606 N -3.93 0.84 0.78 4.82 0.74 -1.26 0.10 119.66 121.76 2w01 s GLN 606 Ca 0.35 -0.51 -0.11 0.00 0.05 0.00 0.00 55.36 55.14 2w01 s GLN 606 Cb 0.08 -0.06 0.06 0.00 1.10 0.00 0.00 33.01 34.19 2w01 s GLN 606 CO 0.13 -1.22 1.08 -1.25 -0.55 0.00 0.00 175.29 173.49 2w01 s PRO 607 N 1.59 2.20 0.11 1.67 0.04 -1.26 -4.83 135.00 134.52 2w01 s PRO 607 Ca 0.19 1.00 -0.36 0.00 0.04 0.00 0.00 61.00 61.87 2w01 s PRO 607 Cb -0.05 -1.90 -0.16 0.00 0.04 0.00 0.00 34.50 32.43 2w01 s PRO 607 CO -0.06 -1.63 1.32 1.63 0.04 0.00 0.00 177.00 178.29 2w01 n LYS 608 N -3.50 1.20 -1.63 4.56 5.02 -1.26 -0.83 118.16 121.73 2w01 n LYS 608 Ca 0.08 0.43 -0.14 0.00 -2.02 0.00 0.00 58.31 56.67 2w01 n LYS 608 Cb 0.54 -2.05 -0.04 0.00 -0.02 0.00 0.00 35.03 33.45 2w01 n LYS 608 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2w01 n GLY 609 N 2.46 0.99 3.75 0.72 0.00 -1.26 -5.02 105.19 106.82 2w01 n GLY 609 Ca 0.18 -0.37 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 2w01 n GLY 609 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w01 s VAL 610 N -2.55 5.31 0.12 1.61 1.01 -0.01 -5.02 120.40 120.87 2w01 s VAL 610 Ca 0.00 0.52 -0.20 0.00 0.00 0.00 0.00 61.98 62.30 2w01 s VAL 610 Cb 0.00 -3.61 -0.07 0.00 0.00 0.00 0.00 36.38 32.70 2w01 s VAL 610 CO 0.00 0.42 1.76 0.07 0.00 0.00 0.00 175.10 177.35 2w01 h LYS 611 N 6.43 0.20 -4.89 2.72 5.09 -1.95 -3.45 116.57 120.71 2w01 h LYS 611 Ca -0.43 -0.01 -0.29 0.00 0.09 0.00 0.00 60.65 60.02 2w01 h LYS 611 Cb 1.17 -0.04 -0.15 0.00 0.10 0.00 0.00 32.23 33.30 2w01 h LYS 611 CO 0.74 0.13 -0.71 -0.51 -2.09 0.00 0.00 179.45 177.01 2w01 s ASP 612 N -5.33 1.49 0.46 7.07 1.11 -1.26 -5.14 116.67 115.07 2w01 s ASP 612 Ca -0.13 -0.98 -0.25 0.00 0.18 0.00 0.00 52.55 51.37 2w01 s ASP 612 Cb 0.09 0.03 -0.08 0.00 1.07 0.00 0.00 42.92 44.03 2w01 s ASP 612 CO 0.69 -0.37 1.37 -2.65 1.18 0.00 0.00 175.17 175.38 2w01 n PRO 613 N -0.03 2.06 -4.44 8.23 -0.02 -1.26 -4.84 135.00 134.70 2w01 n PRO 613 Ca -0.12 0.74 -0.34 0.00 -2.02 0.00 0.00 63.50 61.75 2w01 n PRO 613 Cb 0.60 -2.54 -0.11 0.00 -0.02 0.00 0.00 33.50 31.43 2w01 n PRO 613 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2w01 s VAL 614 N -1.21 4.06 -0.04 -1.45 -7.23 0.29 -4.90 120.40 109.92 2w01 s VAL 614 Ca 0.63 -0.33 -0.23 0.00 -1.81 0.00 0.00 61.98 60.24 2w01 s VAL 614 Cb -0.46 -2.72 -0.04 0.00 0.56 0.00 0.00 36.38 33.72 2w01 s VAL 614 CO 0.56 0.57 0.67 0.68 -0.31 0.00 0.00 175.10 177.27 2w01 s VAL 615 N -0.51 4.98 0.19 1.32 -7.23 -1.26 -0.78 120.40 117.10 2w01 s VAL 615 Ca 0.08 1.39 0.10 0.00 -1.81 0.00 0.00 61.98 61.74 2w01 s VAL 615 Cb -0.12 -4.01 -0.04 0.00 0.56 0.00 0.00 36.38 32.77 2w01 s VAL 615 CO 0.02 0.31 -0.14 0.27 -0.31 0.00 0.00 175.10 175.25 2w01 s ILE 616 N 0.42 2.91 -0.10 -0.62 -4.36 0.01 -3.21 121.20 116.26 2w01 s ILE 616 Ca 0.35 -1.79 0.03 0.00 -0.26 0.00 0.00 60.65 58.97 2w01 s ILE 616 Cb -0.18 -2.43 -0.01 0.00 1.25 0.00 0.00 42.46 41.09 2w01 s ILE 616 CO 0.18 -0.12 -0.19 0.26 0.24 0.00 0.00 174.94 175.31 2w01 s TRP 617 N -1.72 2.66 -0.57 1.37 0.52 0.41 -1.38 118.94 120.23 2w01 s TRP 617 Ca 0.24 -0.76 -0.27 0.00 0.02 0.00 0.00 56.10 55.33 2w01 s TRP 617 Cb -0.08 -1.74 0.03 0.00 -1.15 0.00 0.00 33.47 30.52 2w01 s TRP 617 CO 0.14 -0.25 1.13 0.34 0.02 0.00 0.00 176.95 178.32 2w01 s ASP 618 N 0.18 6.42 0.05 2.95 3.68 -0.21 -1.23 116.67 128.52 2w01 s ASP 618 Ca -0.11 0.00 -0.31 0.00 2.13 0.00 0.00 52.55 54.27 2w01 s ASP 618 Cb -0.16 -2.52 -0.05 0.00 -1.45 0.00 0.00 42.92 38.73 2w01 s ASP 618 CO 0.06 -1.42 1.19 -0.69 0.13 0.00 0.00 175.17 174.44 2w01 s VAL 619 N 4.71 4.09 -0.15 1.11 1.01 0.10 -0.31 120.40 130.96 2w01 s VAL 619 Ca 0.40 1.50 -0.09 0.00 0.00 0.00 0.00 61.98 63.78 2w01 s VAL 619 Cb -0.09 -3.96 -0.24 0.00 0.00 0.00 0.00 36.38 32.09 2w01 s VAL 619 CO 0.24 0.11 0.29 0.00 0.00 0.00 0.00 175.10 175.74 2w01 n ALA 620 N 4.00 0.90 0.00 5.51 0.00 -0.02 -4.60 120.51 126.30 2w01 n ALA 620 Ca 0.09 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.92 2w01 n ALA 620 Cb 0.47 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.31 2w01 n ALA 620 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w01 n GLY 621 N 1.89 -1.38 3.16 0.00 0.00 -1.10 -1.50 105.19 106.27 2w01 n GLY 621 Ca -0.33 -0.99 -0.25 0.00 0.00 0.00 0.00 46.02 44.44 2w01 n GLY 621 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w01 s VAL 622 N -2.42 1.42 0.00 1.61 1.01 0.48 0.06 120.40 122.56 2w01 s VAL 622 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.23 2w01 s VAL 622 Cb 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 36.38 35.19 2w01 s VAL 622 CO 0.00 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.11 2w01 n GLY 623 N 2.77 0.26 3.59 4.51 0.00 0.11 -1.61 105.19 114.83 2w01 n GLY 623 Ca -0.16 -1.75 -0.46 0.00 0.00 0.00 0.00 46.02 43.66 2w01 n GLY 623 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2w01 n GLU 624 N 0.00 1.35 -0.51 1.61 -0.58 -1.26 -1.21 120.64 120.04 2w01 n GLU 624 Ca 0.00 0.48 0.06 0.00 -0.42 0.00 0.00 57.16 57.28 2w01 n GLU 624 Cb 0.00 -1.90 0.26 0.00 -0.57 0.00 0.00 31.44 29.24 2w01 n GLU 624 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 2w01 n PRO 625 N 1.05 3.25 -0.07 3.49 -0.04 -1.26 -4.86 135.00 136.55 2w01 n PRO 625 Ca 0.11 -2.08 -0.22 0.00 -0.04 0.00 0.00 63.50 61.27 2w01 n PRO 625 Cb 0.30 -1.84 -0.12 0.00 -0.04 0.00 0.00 33.50 31.80 2w01 n PRO 625 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2w01 n TYR 626 N 0.61 0.93 -4.00 0.54 4.02 -0.35 -5.00 117.16 113.91 2w01 n TYR 626 Ca 0.19 0.29 -0.37 0.00 -0.01 0.00 0.00 57.90 58.00 2w01 n TYR 626 Cb 0.76 -1.11 -0.00 0.00 -0.02 0.00 0.00 39.34 38.97 2w01 n TYR 626 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2w01 n ASN 627 N -3.95 -2.87 -4.47 7.72 5.03 -0.96 -4.98 115.26 110.79 2w01 n ASN 627 Ca -0.36 -1.18 -0.34 0.00 0.87 0.00 0.00 54.58 53.57 2w01 n ASN 627 Cb 0.87 -2.30 -0.12 0.00 -1.02 0.00 0.00 39.78 37.21 2w01 n ASN 627 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2w01 s LEU 628 N -7.13 3.20 -0.01 3.41 1.43 -0.63 -4.98 118.68 113.96 2w01 s LEU 628 Ca 0.32 -0.17 0.03 0.00 -1.03 0.00 0.00 54.13 53.28 2w01 s LEU 628 Cb -0.15 -1.78 -0.00 0.00 0.03 0.00 0.00 46.19 44.28 2w01 s LEU 628 CO 0.94 0.13 -0.10 -0.55 0.23 0.00 0.00 176.35 177.00 2w01 s SER 629 N 0.57 1.19 0.10 2.29 0.15 -1.26 -0.39 113.70 116.36 2w01 s SER 629 Ca -0.03 -0.18 -0.16 0.00 0.70 0.00 0.00 55.95 56.28 2w01 s SER 629 Cb -0.14 -0.20 -0.06 0.00 -1.71 0.00 0.00 66.02 63.90 2w01 s SER 629 CO 0.03 0.10 1.50 -0.07 1.20 0.00 0.00 173.24 176.00 2w01 h LEU 630 N 6.07 0.62 -9.15 3.45 3.38 -1.61 -3.43 115.31 114.64 2w01 h LEU 630 Ca -0.32 -0.37 -0.68 0.00 0.09 0.00 0.00 57.88 56.60 2w01 h LEU 630 Cb 1.17 -0.17 -0.18 0.00 0.09 0.00 0.00 40.66 41.57 2w01 h LEU 630 CO 0.49 0.85 -0.71 0.00 0.09 0.00 0.00 178.44 179.16 2w01 s ALA 631 N -4.76 2.98 0.14 1.53 0.00 -1.26 -5.08 121.76 115.31 2w01 s ALA 631 Ca -0.13 -0.99 -0.30 0.00 0.00 0.00 0.00 51.96 50.54 2w01 s ALA 631 Cb 0.09 -1.14 -0.07 0.00 0.00 0.00 0.00 23.12 21.99 2w01 s ALA 631 CO 0.79 0.60 1.19 0.14 0.00 0.00 0.00 175.76 178.48 2w01 s VAL 632 N -0.93 3.74 -0.25 0.00 -7.23 -1.26 -4.98 120.40 109.49 2w01 s VAL 632 Ca 0.15 1.39 -0.29 0.00 -1.81 0.00 0.00 61.98 61.43 2w01 s VAL 632 Cb -0.11 -3.89 -0.03 0.00 0.56 0.00 0.00 36.38 32.91 2w01 s VAL 632 CO 0.05 0.19 1.87 -1.61 -0.31 0.00 0.00 175.10 175.29 2w01 s GLU 633 N 0.19 3.45 -0.12 4.82 2.02 -1.26 -4.94 118.70 122.86 2w01 s GLU 633 Ca 0.55 1.72 -0.27 0.00 0.02 0.00 0.00 54.97 56.98 2w01 s GLU 633 Cb -0.31 -4.20 -0.02 0.00 0.10 0.00 0.00 34.13 29.70 2w01 s GLU 633 CO 0.34 -1.72 0.91 -1.21 0.02 0.00 0.00 175.26 173.60 2w01 s GLU 634 N 5.51 4.39 0.00 1.61 2.02 -1.26 -5.25 118.70 125.71 2w01 s GLU 634 Ca 0.84 1.20 0.27 0.00 0.02 0.00 0.00 54.97 57.30 2w01 s GLU 634 Cb -0.27 -3.54 0.88 0.00 0.10 0.00 0.00 34.13 31.30 2w01 s GLU 634 CO 0.34 -0.27 1.65 1.04 0.02 0.00 0.00 175.26 178.04