#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 2.69 0.00 3.03 0.00 -1.26 -5.09 105.19 104.56 2w01 n GLY 436 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.55 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 0.00 1.96 3.09 -0.02 0.00 -1.26 -4.22 105.19 104.75 2w01 n GLY 437 Ca 0.00 -0.63 -0.17 0.00 0.00 0.00 0.00 46.02 45.22 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 2.00 1.26 -0.19 1.61 3.68 -0.66 -4.98 116.67 119.39 2w01 s ASP 438 Ca 0.00 -0.42 -0.13 0.00 2.13 0.00 0.00 52.55 54.13 2w01 s ASP 438 Cb 0.00 -0.06 -0.05 0.00 -1.45 0.00 0.00 42.92 41.36 2w01 s ASP 438 CO 0.00 -0.03 0.24 -0.60 0.13 0.00 0.00 175.17 174.91 2w01 s ARG 439 N -1.10 4.19 0.16 4.34 3.52 -1.26 -0.83 118.95 127.97 2w01 s ARG 439 Ca -0.02 -0.04 -0.23 0.00 -0.13 0.00 0.00 55.73 55.32 2w01 s ARG 439 Cb -0.07 -3.46 0.07 0.00 -1.56 0.00 0.00 34.95 29.92 2w01 s ARG 439 CO 0.01 0.17 0.61 -0.98 -0.81 0.00 0.00 175.30 174.30 2w01 s ARG 440 N 0.69 1.27 -0.01 5.12 1.70 -0.04 -4.95 118.95 122.74 2w01 s ARG 440 Ca 0.13 -0.47 -0.30 0.00 -0.47 0.00 0.00 55.73 54.62 2w01 s ARG 440 Cb -0.13 0.58 -0.03 0.00 -0.57 0.00 0.00 34.95 34.80 2w01 s ARG 440 CO 0.03 -0.56 1.03 -2.14 -1.08 0.00 0.00 175.30 172.58 2w01 s PRO 441 N -3.73 4.51 0.04 3.89 0.02 -1.26 -0.57 135.00 137.89 2w01 s PRO 441 Ca 0.01 1.48 -0.06 0.00 0.02 0.00 0.00 61.00 62.45 2w01 s PRO 441 Cb -0.01 -3.46 -0.01 0.00 0.02 0.00 0.00 34.50 31.03 2w01 s PRO 441 CO -0.13 -0.15 0.10 0.96 -0.33 0.00 0.00 177.00 177.45 2w01 s ILE 442 N 1.26 0.13 -0.23 2.83 -4.36 0.51 -4.91 121.20 116.44 2w01 s ILE 442 Ca 0.52 -1.10 -0.14 0.00 -0.26 0.00 0.00 60.65 59.67 2w01 s ILE 442 Cb -0.22 -0.91 -0.04 0.00 1.25 0.00 0.00 42.46 42.54 2w01 s ILE 442 CO 0.26 -0.61 0.34 -0.89 0.24 0.00 0.00 174.94 174.29 2w01 s THR 443 N -2.65 5.22 -0.09 8.37 2.01 -0.28 -1.04 115.64 127.19 2w01 s THR 443 Ca -0.05 0.56 0.01 0.00 0.31 0.00 0.00 61.69 62.53 2w01 s THR 443 Cb -0.01 -3.67 -0.02 0.00 0.01 0.00 0.00 72.50 68.80 2w01 s THR 443 CO -0.05 0.24 -0.12 0.27 -0.69 0.00 0.00 174.62 174.27 2w01 s ILE 444 N 1.52 3.25 -0.06 1.82 -4.36 0.29 -0.38 121.20 123.27 2w01 s ILE 444 Ca 0.15 -0.63 0.04 0.00 -0.26 0.00 0.00 60.65 59.96 2w01 s ILE 444 Cb -0.15 -2.32 -0.02 0.00 1.25 0.00 0.00 42.46 41.22 2w01 s ILE 444 CO 0.08 0.56 -0.18 -0.22 0.24 0.00 0.00 174.94 175.42 2w01 s LEU 445 N -0.33 2.47 0.01 0.37 0.20 -0.09 -1.82 118.68 119.49 2w01 s LEU 445 Ca 0.04 -0.33 0.03 0.00 0.69 0.00 0.00 54.13 54.55 2w01 s LEU 445 Cb -0.13 -1.49 -0.01 0.00 -0.43 0.00 0.00 46.19 44.13 2w01 s LEU 445 CO 0.02 0.28 -0.10 0.28 -0.29 0.00 0.00 176.35 176.55 2w01 s THR 446 N -0.38 0.78 0.30 3.68 -1.32 -0.05 -0.82 115.64 117.83 2w01 s THR 446 Ca 0.03 -0.57 0.06 0.00 -1.21 0.00 0.00 61.69 60.01 2w01 s THR 446 Cb -0.12 -0.68 -0.06 0.00 -1.51 0.00 0.00 72.50 70.12 2w01 s THR 446 CO 0.02 0.12 -0.04 -0.94 -2.21 0.00 0.00 174.62 171.57 2w01 s SER 447 N -0.51 2.82 -0.18 8.08 1.04 -0.94 -1.25 113.70 122.76 2w01 s SER 447 Ca 0.02 -1.23 -0.19 0.00 0.48 0.00 0.00 55.95 55.03 2w01 s SER 447 Cb -0.05 -0.18 0.05 0.00 0.10 0.00 0.00 66.02 65.94 2w01 s SER 447 CO 0.00 -0.38 0.52 -0.62 0.98 0.00 0.00 173.24 173.74 2w01 s ASP 448 N -3.47 -0.54 -0.72 7.02 -1.08 -0.77 -3.15 116.67 113.97 2w01 s ASP 448 Ca 0.31 1.00 -0.17 0.00 -0.52 0.00 0.00 52.55 53.17 2w01 s ASP 448 Cb 0.05 1.02 0.14 0.00 -1.46 0.00 0.00 42.92 42.66 2w01 s ASP 448 CO 0.13 -0.22 0.79 -0.76 0.52 0.00 0.00 175.17 175.64 2w01 s LEU 449 N 0.13 5.73 0.05 -1.34 1.43 -0.87 -1.83 118.68 121.99 2w01 s LEU 449 Ca -0.01 -1.91 -0.36 0.00 -1.03 0.00 0.00 54.13 50.83 2w01 s LEU 449 Cb -0.04 -2.29 -0.15 0.00 0.03 0.00 0.00 46.19 43.75 2w01 s LEU 449 CO 0.01 -0.95 1.57 0.54 0.23 0.00 0.00 176.35 177.76 2w01 n ARG 450 N 5.69 1.73 -0.44 1.70 5.12 -0.96 -2.22 116.66 127.28 2w01 n ARG 450 Ca 0.03 0.63 0.00 0.00 -1.93 0.00 0.00 57.85 56.58 2w01 n ARG 450 Cb 0.45 -2.36 0.00 0.00 -1.16 0.00 0.00 32.46 29.39 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 3.38 1.64 0.25 -0.13 0.00 -1.26 -4.52 105.19 104.54 2w01 n GLY 451 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 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 1.02 -0.39 1.61 3.57 -1.82 -0.78 116.94 120.15 2w01 h PHE 452 Ca 0.00 -0.30 0.08 0.00 3.53 0.00 0.00 57.97 61.28 2w01 h PHE 452 Cb 0.00 -0.22 -0.08 0.00 2.79 0.00 0.00 35.95 38.44 2w01 h PHE 452 CO 0.00 1.09 -0.17 1.15 -2.23 0.00 0.00 178.31 178.15 2w01 h THR 453 N 0.65 0.47 0.45 4.41 2.02 -1.91 0.35 112.91 119.35 2w01 h THR 453 Ca 0.06 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.22 2w01 h THR 453 Cb 0.91 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.79 2w01 h THR 453 CO 0.08 0.00 -0.22 -1.28 0.37 0.00 0.00 175.52 174.48 2w01 h SER 454 N -0.09 -0.51 -0.79 4.18 0.87 -1.94 -2.91 113.55 112.36 2w01 h SER 454 Ca 0.19 -0.01 0.07 0.00 -1.23 0.00 0.00 61.79 60.81 2w01 h SER 454 Cb 0.39 0.13 -0.05 0.00 -0.44 0.00 0.00 62.40 62.43 2w01 h SER 454 CO -0.46 -0.33 0.52 0.00 -0.53 0.00 0.00 176.83 176.03 2w01 h THR 455 N -0.66 1.03 0.00 2.23 1.03 -0.83 -2.73 112.91 112.97 2w01 h THR 455 Ca -0.06 -0.29 -0.00 0.00 -0.01 0.00 0.00 66.41 66.05 2w01 h THR 455 Cb 0.49 0.12 -0.00 0.00 -1.07 0.00 0.00 68.15 67.69 2w01 h THR 455 CO 0.10 0.15 -0.01 0.77 -0.01 0.00 0.00 175.52 176.52 2w01 h SER 456 N 0.83 0.00 0.68 0.00 4.64 -0.10 -2.12 113.55 117.49 2w01 h SER 456 Ca 0.34 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.64 2w01 h SER 456 Cb 0.26 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.35 2w01 h SER 456 CO -0.12 0.01 -0.08 -0.08 -0.87 0.00 0.00 176.83 175.69 2w01 h GLU 457 N 0.00 0.00 0.00 4.77 4.57 -1.40 -2.23 114.58 120.29 2w01 h GLU 457 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2w01 h GLU 457 Cb 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 2w01 h GLU 457 CO 0.00 0.08 -0.58 0.41 -1.18 0.00 0.00 179.01 177.74 2w01 n GLY 458 N -0.29 -1.21 3.92 1.92 0.00 -0.80 -5.00 105.19 103.73 2w01 n GLY 458 Ca -0.01 -0.39 -0.27 0.00 0.00 0.00 0.00 46.02 45.36 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 -3.01 3.41 0.46 0.99 1.43 -0.84 -5.06 118.68 116.06 2w01 s LEU 459 Ca 0.10 0.76 -0.20 0.00 -1.03 0.00 0.00 54.13 53.76 2w01 s LEU 459 Cb 0.17 -3.64 -0.10 0.00 0.03 0.00 0.00 46.19 42.66 2w01 s LEU 459 CO 0.73 -0.85 0.99 0.20 0.23 0.00 0.00 176.35 177.65 2w01 s ASN 460 N -4.22 6.63 0.52 2.29 0.02 -1.26 -4.90 114.94 114.02 2w01 s ASN 460 Ca 0.51 1.79 0.28 0.00 -1.02 0.00 0.00 52.86 54.43 2w01 s ASN 460 Cb -0.10 -2.55 1.44 0.00 0.02 0.00 0.00 41.25 40.05 2w01 s ASN 460 CO 0.44 -0.58 2.05 1.55 0.02 0.00 0.00 177.10 180.59 2w01 h PRO 461 N 1.67 0.00 -0.24 -0.60 0.13 -1.97 -2.35 132.00 128.64 2w01 h PRO 461 Ca -0.49 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.52 2w01 h PRO 461 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2w01 h PRO 461 CO 0.60 0.12 -0.35 0.93 -0.23 0.00 0.00 178.00 179.06 2w01 h GLU 462 N 0.00 0.52 -0.19 0.86 3.07 -2.00 -2.89 114.58 113.95 2w01 h GLU 462 Ca -0.00 -0.24 -0.10 0.00 -0.50 0.00 0.00 59.36 58.52 2w01 h GLU 462 Cb 0.38 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.28 2w01 h GLU 462 CO 0.02 0.80 -0.27 0.93 -1.40 0.00 0.00 179.01 179.09 2w01 h GLU 463 N 0.44 0.52 -0.51 2.33 5.08 -1.82 -2.20 114.58 118.42 2w01 h GLU 463 Ca 0.05 -0.30 0.05 0.00 -1.00 0.00 0.00 59.36 58.15 2w01 h GLU 463 Cb 0.83 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 30.06 2w01 h GLU 463 CO 0.07 0.90 0.25 0.28 -1.00 0.00 0.00 179.01 179.51 2w01 h VAL 464 N 0.18 0.95 -0.37 3.13 2.07 -1.39 -1.12 116.25 119.70 2w01 h VAL 464 Ca 0.02 -0.17 -0.12 0.00 0.82 0.00 0.00 66.70 67.25 2w01 h VAL 464 Cb 0.84 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 2w01 h VAL 464 CO 0.06 0.09 -0.23 0.58 0.02 0.00 0.00 177.57 178.09 2w01 h VAL 465 N 0.49 1.28 -0.03 2.57 2.07 -1.56 -2.02 116.25 119.06 2w01 h VAL 465 Ca 0.23 -1.38 -0.00 0.00 0.82 0.00 0.00 66.70 66.37 2w01 h VAL 465 Cb 0.15 1.36 -0.00 0.00 -1.52 0.00 0.00 31.29 31.27 2w01 h VAL 465 CO -0.16 0.46 0.01 0.50 0.02 0.00 0.00 177.57 178.40 2w01 h LYS 466 N 0.61 0.04 -0.69 1.57 1.63 -1.21 -1.38 116.57 117.16 2w01 h LYS 466 Ca 0.08 -0.01 0.10 0.00 -0.85 0.00 0.00 60.65 59.97 2w01 h LYS 466 Cb 0.80 -0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 32.35 2w01 h LYS 466 CO 0.06 0.16 0.32 0.28 -3.45 0.00 0.00 179.45 176.82 2w01 h VAL 467 N -0.08 0.82 -0.75 2.00 2.07 -1.17 -0.52 116.25 118.61 2w01 h VAL 467 Ca 0.01 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.33 2w01 h VAL 467 Cb 0.13 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 2w01 h VAL 467 CO -0.00 0.10 0.40 -0.07 0.02 0.00 0.00 177.57 178.01 2w01 h LEU 468 N 0.54 0.96 -0.62 2.57 4.07 -1.08 -1.99 115.31 119.76 2w01 h LEU 468 Ca 0.34 -0.11 -0.14 0.00 0.08 0.00 0.00 57.88 58.06 2w01 h LEU 468 Cb 0.39 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.88 2w01 h LEU 468 CO -0.29 0.79 -0.38 0.78 -1.08 0.00 0.00 178.44 178.27 2w01 h ASN 469 N 1.05 0.70 -0.41 -0.43 2.35 -0.82 0.22 115.58 118.24 2w01 h ASN 469 Ca 0.26 -0.31 -0.03 0.00 -0.55 0.00 0.00 56.30 55.68 2w01 h ASN 469 Cb 0.06 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 2w01 h ASN 469 CO -0.04 1.00 0.15 0.40 -1.65 0.00 0.00 177.43 177.30 2w01 h ILE 470 N 0.55 1.20 -0.09 2.81 2.04 -0.98 -0.42 117.51 122.62 2w01 h ILE 470 Ca 0.05 -0.63 -0.02 0.00 1.00 0.00 0.00 64.86 65.25 2w01 h ILE 470 Cb 0.90 0.86 -0.00 0.00 -0.74 0.00 0.00 36.82 37.84 2w01 h ILE 470 CO 0.08 0.23 -0.03 0.22 0.00 0.00 0.00 178.15 178.64 2w01 h TYR 471 N 0.51 0.20 -0.47 1.37 3.20 -0.96 -2.97 116.97 117.85 2w01 h TYR 471 Ca 0.13 -0.05 -0.07 0.00 3.14 0.00 0.00 58.73 61.89 2w01 h TYR 471 Cb 0.21 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 2w01 h TYR 471 CO 0.00 0.53 0.01 0.74 -1.64 0.00 0.00 178.16 177.79 2w01 h PHE 472 N -0.18 0.83 -0.42 -3.82 0.04 -0.63 -1.32 116.94 111.43 2w01 h PHE 472 Ca 0.02 -0.11 0.05 0.00 2.80 0.00 0.00 57.97 60.73 2w01 h PHE 472 Cb 0.47 -0.23 -0.05 0.00 2.20 0.00 0.00 35.95 38.34 2w01 h PHE 472 CO 0.06 0.76 0.14 0.78 -0.60 0.00 0.00 178.31 179.46 2w01 h GLY 473 N 0.97 0.54 0.65 -1.45 0.00 -1.04 -1.03 103.07 101.70 2w01 h GLY 473 Ca 0.14 -0.08 -0.15 0.00 0.00 0.00 0.00 47.33 47.25 2w01 h GLY 473 CO 0.02 0.02 -0.61 1.70 0.00 0.00 0.00 176.54 177.67 2w01 h LYS 474 N 0.31 0.30 -0.63 4.80 1.63 -1.48 -2.96 116.57 118.54 2w01 h LYS 474 Ca 0.19 -0.41 0.08 0.00 -0.85 0.00 0.00 60.65 59.67 2w01 h LYS 474 Cb 0.18 0.14 -0.04 0.00 -0.60 0.00 0.00 32.23 31.91 2w01 h LYS 474 CO -0.20 1.13 0.42 0.52 -3.45 0.00 0.00 179.45 177.87 2w01 h MET 475 N -0.33 0.50 -0.38 1.90 2.86 -1.21 -1.72 114.93 116.55 2w01 h MET 475 Ca -0.09 -0.03 -0.15 0.00 -2.06 0.00 0.00 59.70 57.37 2w01 h MET 475 Cb 1.40 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.94 2w01 h MET 475 CO 0.12 0.33 -0.34 0.00 1.06 0.00 0.00 176.91 178.08 2w01 h ALA 476 N 1.67 0.56 -0.54 6.32 0.00 -1.18 -0.52 119.26 125.57 2w01 h ALA 476 Ca 0.28 -0.44 0.11 0.00 0.00 0.00 0.00 54.91 54.87 2w01 h ALA 476 Cb 0.43 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 18.01 2w01 h ALA 476 CO -0.09 0.63 -0.08 -0.44 0.00 0.00 0.00 179.25 179.27 2w01 h ASP 477 N 0.72 -0.40 -0.12 0.00 3.32 -1.27 0.23 116.42 118.90 2w01 h ASP 477 Ca 0.07 0.15 -0.05 0.00 0.02 0.00 0.00 57.03 57.22 2w01 h ASP 477 Cb 0.93 0.29 -0.00 0.00 0.22 0.00 0.00 39.33 40.77 2w01 h ASP 477 CO 0.09 -0.14 -0.11 0.58 -1.72 0.00 0.00 179.24 177.93 2w01 h VAL 478 N 0.04 1.35 -0.10 -1.35 2.07 -1.02 -1.88 116.25 115.36 2w01 h VAL 478 Ca 0.27 -1.25 0.02 0.00 0.82 0.00 0.00 66.70 66.56 2w01 h VAL 478 Cb 0.41 1.91 -0.02 0.00 -1.52 0.00 0.00 31.29 32.07 2w01 h VAL 478 CO -0.52 0.36 -0.02 0.40 0.02 0.00 0.00 177.57 177.81 2w01 h ILE 479 N -0.11 0.90 -0.76 4.57 2.04 -1.08 -2.39 117.51 120.68 2w01 h ILE 479 Ca 0.02 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.84 2w01 h ILE 479 Cb 0.62 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 2w01 h ILE 479 CO 0.03 0.00 0.32 0.74 0.00 0.00 0.00 178.15 179.24 2w01 h THR 480 N -0.00 1.25 -0.09 -0.27 2.02 -0.52 -0.89 112.91 114.41 2w01 h THR 480 Ca 0.05 -0.75 0.00 0.00 0.77 0.00 0.00 66.41 66.48 2w01 h THR 480 Cb 0.07 0.32 -0.00 0.00 -1.74 0.00 0.00 68.15 66.80 2w01 h THR 480 CO -0.10 0.31 0.06 -0.74 0.37 0.00 0.00 175.52 175.42 2w01 h HIS 481 N 1.09 0.10 -0.59 3.16 -0.00 -1.15 -2.57 115.15 115.18 2w01 h HIS 481 Ca 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.63 2w01 h HIS 481 Cb 0.17 -0.03 0.00 0.00 -0.00 0.00 0.00 27.41 27.55 2w01 h HIS 481 CO 0.02 0.06 0.00 0.72 -0.00 0.00 0.00 177.93 178.73 2w01 n HIS 482 N -4.52 0.95 -1.15 5.26 -0.00 -0.39 -4.95 115.22 110.41 2w01 n HIS 482 Ca -0.02 -0.44 -0.05 0.00 -0.00 0.00 0.00 57.72 57.22 2w01 n HIS 482 Cb 0.10 -0.07 -0.02 0.00 -0.00 0.00 0.00 29.99 30.00 2w01 n HIS 482 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2w01 n GLY 483 N 1.33 0.70 3.79 -1.41 0.00 -0.97 -4.91 105.19 103.72 2w01 n GLY 483 Ca 0.21 -0.22 -0.35 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 -2.40 2.58 -0.27 -0.02 0.00 -0.91 -4.90 107.32 101.39 2w01 s GLY 484 Ca 0.00 0.71 -0.10 0.00 0.00 0.00 0.00 44.72 45.33 2w01 s GLY 484 CO 0.00 1.05 0.16 -1.59 0.00 0.00 0.00 173.10 172.72 2w01 s THR 485 N -1.87 5.06 -0.38 0.90 2.01 -0.80 -4.55 115.64 116.02 2w01 s THR 485 Ca 0.69 0.09 -0.29 0.00 0.31 0.00 0.00 61.69 62.49 2w01 s THR 485 Cb -0.20 -3.40 0.02 0.00 0.01 0.00 0.00 72.50 68.93 2w01 s THR 485 CO 0.23 0.27 1.11 -0.63 -0.69 0.00 0.00 174.62 174.92 2w01 s ILE 486 N 1.72 4.38 -0.13 1.82 1.01 -1.26 -1.78 121.20 126.95 2w01 s ILE 486 Ca 0.07 1.53 -0.16 0.00 0.00 0.00 0.00 60.65 62.09 2w01 s ILE 486 Cb -0.16 -4.48 -0.13 0.00 0.01 0.00 0.00 42.46 37.70 2w01 s ILE 486 CO 0.09 -0.68 0.33 -0.78 0.00 0.00 0.00 174.94 173.91 2w01 h ASP 487 N 8.56 0.00 -5.11 3.58 3.58 -0.85 -3.49 116.42 122.69 2w01 h ASP 487 Ca -0.22 -0.48 -0.12 0.00 0.42 0.00 0.00 57.03 56.63 2w01 h ASP 487 Cb 1.06 0.00 -0.17 0.00 1.72 0.00 0.00 39.33 41.94 2w01 h ASP 487 CO 1.07 0.85 -0.54 -1.83 -2.88 0.00 0.00 179.24 175.91 2w01 s GLU 488 N -1.99 0.60 -0.11 0.28 -1.05 -1.16 -4.96 118.70 110.32 2w01 s GLU 488 Ca -0.13 -0.83 0.00 0.00 -0.15 0.00 0.00 54.97 53.87 2w01 s GLU 488 Cb -0.00 0.23 -0.02 0.00 -0.44 0.00 0.00 34.13 33.90 2w01 s GLU 488 CO 0.38 -0.15 -0.11 -0.06 0.95 0.00 0.00 175.26 176.27 2w01 s PHE 489 N -2.85 2.83 0.30 4.83 0.08 -1.26 -1.72 117.98 120.19 2w01 s PHE 489 Ca -0.03 -0.38 0.11 0.00 0.12 0.00 0.00 56.93 56.75 2w01 s PHE 489 Cb 0.00 -1.79 -0.05 0.00 -0.57 0.00 0.00 43.02 40.61 2w01 s PHE 489 CO -0.06 -0.01 -0.16 -1.64 -0.10 0.00 0.00 175.22 173.25 2w01 s MET 490 N -0.07 1.70 0.49 0.44 -1.94 0.81 -4.94 119.30 115.78 2w01 s MET 490 Ca -0.01 -1.81 0.03 0.00 -1.71 0.00 0.00 55.69 52.18 2w01 s MET 490 Cb -0.14 -1.69 0.17 0.00 2.01 0.00 0.00 34.83 35.18 2w01 s MET 490 CO 0.03 0.25 0.98 0.78 -0.01 0.00 0.00 175.02 177.06 2w01 h GLY 491 N 2.21 0.00 -4.05 -0.03 0.00 -2.03 -0.25 103.07 98.93 2w01 h GLY 491 Ca -0.41 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 46.75 2w01 h GLY 491 CO 0.64 0.00 -0.49 2.09 0.00 0.00 0.00 176.54 178.78 2w01 n ASP 492 N -2.17 -0.60 -3.43 0.19 5.75 -1.26 -5.01 116.55 110.02 2w01 n ASP 492 Ca -0.00 -2.11 -0.12 0.00 -0.01 0.00 0.00 54.79 52.55 2w01 n ASP 492 Cb 0.79 0.29 -0.02 0.00 -1.03 0.00 0.00 41.12 41.16 2w01 n ASP 492 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2w01 s GLY 493 N -1.62 -0.61 -0.01 6.12 0.00 -0.11 -2.04 107.32 109.05 2w01 s GLY 493 Ca 0.12 0.52 0.01 0.00 0.00 0.00 0.00 44.72 45.37 2w01 s GLY 493 CO -0.08 0.19 -0.04 -0.42 0.00 0.00 0.00 173.10 172.75 2w01 s ILE 494 N -3.61 0.34 -0.23 0.90 1.01 -1.19 -0.14 121.20 118.29 2w01 s ILE 494 Ca 0.00 -0.13 -0.05 0.00 0.00 0.00 0.00 60.65 60.47 2w01 s ILE 494 Cb -0.01 -0.32 -0.02 0.00 0.01 0.00 0.00 42.46 42.12 2w01 s ILE 494 CO -0.12 0.12 0.00 -0.22 0.00 0.00 0.00 174.94 174.73 2w01 s LEU 495 N 0.22 3.13 0.14 2.97 2.96 -0.70 -2.20 118.68 125.20 2w01 s LEU 495 Ca -0.02 -0.30 0.11 0.00 -0.22 0.00 0.00 54.13 53.70 2w01 s LEU 495 Cb -0.05 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.78 2w01 s LEU 495 CO -0.00 -0.02 -0.26 -0.69 -1.32 0.00 0.00 176.35 174.06 2w01 s VAL 496 N 1.48 2.30 -0.02 1.68 1.01 0.00 -0.08 120.40 126.77 2w01 s VAL 496 Ca 0.05 -1.80 0.06 0.00 0.00 0.00 0.00 61.98 60.29 2w01 s VAL 496 Cb -0.15 -2.04 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 2w01 s VAL 496 CO -0.00 0.05 -0.19 -0.76 0.00 0.00 0.00 175.10 174.20 2w01 s LEU 497 N -2.18 2.02 -0.25 3.92 1.43 -0.73 -0.91 118.68 121.97 2w01 s LEU 497 Ca 0.15 -0.35 0.01 0.00 -1.03 0.00 0.00 54.13 52.92 2w01 s LEU 497 Cb -0.10 -0.99 0.07 0.00 0.03 0.00 0.00 46.19 45.20 2w01 s LEU 497 CO 0.07 0.22 -0.05 -0.36 0.23 0.00 0.00 176.35 176.46 2w01 s PHE 498 N -0.35 2.66 0.00 0.29 0.08 0.48 -1.91 117.98 119.23 2w01 s PHE 498 Ca 0.05 -1.98 0.00 0.00 0.12 0.00 0.00 56.93 55.12 2w01 s PHE 498 Cb -0.08 -1.77 0.00 0.00 -0.57 0.00 0.00 43.02 40.60 2w01 s PHE 498 CO -0.00 -0.82 0.00 0.41 -0.10 0.00 0.00 175.22 174.71 2w01 n GLY 499 N 4.60 1.58 3.12 4.36 0.00 -1.21 -1.13 105.19 116.51 2w01 n GLY 499 Ca -0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.02 1.15 -1.80 4.61 0.00 -1.26 -3.65 121.76 118.80 2w01 s ALA 500 Ca 0.00 -0.73 0.29 0.00 0.00 0.00 0.00 51.96 51.52 2w01 s ALA 500 Cb 0.00 -0.22 1.64 0.00 0.00 0.00 0.00 23.12 24.53 2w01 s ALA 500 CO 0.00 0.24 2.05 -0.35 0.00 0.00 0.00 175.76 177.70 2w01 n PRO 501 N 2.24 0.73 -5.01 0.00 -0.04 -1.26 -4.67 135.00 127.00 2w01 n PRO 501 Ca -0.16 0.01 -0.32 0.00 -0.04 0.00 0.00 63.50 62.98 2w01 n PRO 501 Cb 0.55 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.36 2w01 n PRO 501 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2w01 s THR 502 N -2.20 2.60 0.34 0.52 2.01 -1.26 -5.14 115.64 112.50 2w01 s THR 502 Ca 0.38 -0.85 0.08 0.00 0.31 0.00 0.00 61.69 61.62 2w01 s THR 502 Cb 0.20 -2.03 -0.04 0.00 0.01 0.00 0.00 72.50 70.64 2w01 s THR 502 CO 0.37 0.55 0.13 -0.44 -0.69 0.00 0.00 174.62 174.54 2w01 s SER 503 N 0.06 4.64 0.00 3.53 0.01 -1.24 -3.30 113.70 117.41 2w01 s SER 503 Ca -0.08 -0.79 -0.28 0.00 1.31 0.00 0.00 55.95 56.11 2w01 s SER 503 Cb -0.15 -0.72 0.10 0.00 0.21 0.00 0.00 66.02 65.46 2w01 s SER 503 CO 0.05 -0.29 0.85 -1.58 0.41 0.00 0.00 173.24 172.69 2w01 s GLN 504 N -3.83 0.87 0.47 12.44 0.74 -1.26 -4.98 119.66 124.10 2w01 s GLN 504 Ca 0.37 -0.28 0.15 0.00 0.05 0.00 0.00 55.36 55.65 2w01 s GLN 504 Cb -0.02 0.40 1.10 0.00 1.10 0.00 0.00 33.01 35.59 2w01 s GLN 504 CO 0.22 -0.37 2.05 -0.56 -0.55 0.00 0.00 175.29 176.08 2w01 h GLN 505 N 2.06 0.00 -0.76 1.67 -0.00 -2.02 -2.31 115.11 113.75 2w01 h GLN 505 Ca -0.23 -0.00 -0.51 0.00 -0.00 0.00 0.00 58.65 57.91 2w01 h GLN 505 Cb 1.24 -0.00 -0.30 0.00 -0.00 0.00 0.00 27.48 28.43 2w01 h GLN 505 CO 0.32 0.12 0.07 -0.25 -0.00 0.00 0.00 178.83 179.08 2w01 n ASP 506 N -4.40 5.22 -0.33 0.06 8.00 -1.26 -4.43 116.55 119.41 2w01 n ASP 506 Ca -0.03 -3.77 0.24 0.00 0.71 0.00 0.00 54.79 51.95 2w01 n ASP 506 Cb 0.19 -0.68 0.48 0.00 -0.02 0.00 0.00 41.12 41.09 2w01 n ASP 506 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2w01 h ASP 507 N 1.74 0.49 -0.17 -2.24 5.19 -1.78 -2.73 116.42 116.93 2w01 h ASP 507 Ca 0.44 0.20 -0.05 0.00 -0.62 0.00 0.00 57.03 57.00 2w01 h ASP 507 Cb 1.42 0.15 -0.00 0.00 0.18 0.00 0.00 39.33 41.07 2w01 h ASP 507 CO 1.00 -0.16 -0.09 0.00 -3.12 0.00 0.00 179.24 176.87 2w01 h ALA 508 N 1.86 0.23 -0.60 3.45 0.00 -1.85 0.28 119.26 122.63 2w01 h ALA 508 Ca 0.74 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 55.34 2w01 h ALA 508 Cb 1.70 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.41 2w01 h ALA 508 CO -0.62 0.06 0.28 1.25 0.00 0.00 0.00 179.25 180.22 2w01 h LEU 509 N 0.03 0.78 -0.39 0.00 5.85 -1.82 -2.48 115.31 117.28 2w01 h LEU 509 Ca 0.04 -0.08 -0.18 0.00 0.84 0.00 0.00 57.88 58.49 2w01 h LEU 509 Cb 0.58 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.41 2w01 h LEU 509 CO 0.03 0.67 -0.57 -0.09 -0.34 0.00 0.00 178.44 178.14 2w01 h ARG 510 N 0.86 0.72 -0.32 1.25 2.43 -1.13 0.45 114.38 118.63 2w01 h ARG 510 Ca 0.21 -0.47 0.05 0.00 -0.81 0.00 0.00 59.98 58.96 2w01 h ARG 510 Cb 0.11 0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.67 2w01 h ARG 510 CO -0.03 1.09 0.04 0.00 -1.51 0.00 0.00 179.97 179.56 2w01 h ALA 511 N 0.81 0.32 -0.38 2.80 0.00 -0.38 0.15 119.26 122.58 2w01 h ALA 511 Ca 0.01 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2w01 h ALA 511 Cb 1.15 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 2w01 h ALA 511 CO 0.12 -0.37 0.12 0.28 0.00 0.00 0.00 179.25 179.40 2w01 h VAL 512 N 0.14 1.21 -0.48 0.00 2.07 -1.14 -1.51 116.25 116.54 2w01 h VAL 512 Ca 0.15 -0.68 0.08 0.00 0.82 0.00 0.00 66.70 67.07 2w01 h VAL 512 Cb 0.18 0.95 -0.06 0.00 -1.52 0.00 0.00 31.29 30.84 2w01 h VAL 512 CO -0.22 0.24 0.12 0.00 0.02 0.00 0.00 177.57 177.73 2w01 h ALA 513 N 0.97 0.56 -0.47 1.67 0.00 -0.80 -1.48 119.26 119.70 2w01 h ALA 513 Ca 0.12 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.16 2w01 h ALA 513 Cb 0.25 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 2w01 h ALA 513 CO -0.00 -0.28 0.22 0.00 0.00 0.00 0.00 179.25 179.19 2w01 h GLY 515 N 0.44 0.62 0.85 0.00 0.00 -0.66 0.36 103.07 104.69 2w01 h GLY 515 Ca 0.21 0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.56 2w01 h GLY 515 CO -0.16 -0.13 0.04 -2.08 0.00 0.00 0.00 176.54 174.21 2w01 h VAL 516 N 0.17 1.17 -0.56 4.60 2.07 -0.59 -1.60 116.25 121.51 2w01 h VAL 516 Ca 0.28 -0.50 0.02 0.00 0.82 0.00 0.00 66.70 67.32 2w01 h VAL 516 Cb 0.42 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 2w01 h VAL 516 CO -0.41 0.15 0.37 -0.33 0.02 0.00 0.00 177.57 177.37 2w01 h GLU 517 N 0.02 0.69 -0.28 1.57 5.08 -0.96 -1.96 114.58 118.75 2w01 h GLU 517 Ca 0.04 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2w01 h GLU 517 Cb 0.20 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2w01 h GLU 517 CO -0.00 0.46 0.16 0.52 -1.00 0.00 0.00 179.01 179.15 2w01 h MET 518 N 0.71 0.38 -0.81 2.33 2.86 0.52 0.89 114.93 121.81 2w01 h MET 518 Ca 0.21 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.82 2w01 h MET 518 Cb -0.01 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.53 2w01 h MET 518 CO -0.05 0.31 0.54 1.96 1.06 0.00 0.00 176.91 180.73 2w01 h GLN 519 N 0.35 1.07 -0.36 1.72 1.08 -1.02 -1.82 115.11 116.13 2w01 h GLN 519 Ca 0.10 -0.06 -0.10 0.00 -1.45 0.00 0.00 58.65 57.14 2w01 h GLN 519 Cb 0.03 -0.24 -0.01 0.00 -0.05 0.00 0.00 27.48 27.21 2w01 h GLN 519 CO -0.02 0.71 -0.15 -0.07 -0.95 0.00 0.00 178.83 178.35 2w01 h LEU 520 N 1.10 0.77 -2.53 1.46 3.38 -1.02 -2.65 115.31 115.81 2w01 h LEU 520 Ca 0.30 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2w01 h LEU 520 Cb -0.13 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.41 2w01 h LEU 520 CO -0.06 0.99 0.00 0.00 0.09 0.00 0.00 178.44 179.46 2w01 h ALA 521 N 0.80 1.47 0.00 1.53 0.00 -0.63 -2.29 119.26 120.13 2w01 h ALA 521 Ca 0.08 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2w01 h ALA 521 Cb 0.69 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 2w01 h ALA 521 CO 0.05 -0.01 -0.10 1.25 0.00 0.00 0.00 179.25 180.44 2w01 h LEU 522 N 0.00 0.00 -1.44 0.00 5.85 -0.95 -1.59 115.31 117.19 2w01 h LEU 522 Ca 0.00 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 2w01 h LEU 522 Cb 0.01 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 2w01 h LEU 522 CO -0.00 0.10 0.25 0.03 -0.34 0.00 0.00 178.44 178.48 2w01 h ARG 523 N 0.00 0.63 -0.13 1.25 3.08 -1.53 -0.28 114.38 117.41 2w01 h ARG 523 Ca -0.00 -0.06 -0.20 0.00 0.07 0.00 0.00 59.98 59.79 2w01 h ARG 523 Cb 0.20 -0.13 0.01 0.00 0.08 0.00 0.00 29.97 30.12 2w01 h ARG 523 CO 0.01 0.47 -0.70 0.93 -1.07 0.00 0.00 179.97 179.62 2w01 h GLU 524 N 0.64 0.69 -0.79 0.04 5.08 -1.46 -2.75 114.58 116.04 2w01 h GLU 524 Ca 0.17 -0.58 -0.01 0.00 -1.00 0.00 0.00 59.36 57.94 2w01 h GLU 524 Cb 0.02 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 2w01 h GLU 524 CO -0.03 1.19 0.45 -0.39 -1.00 0.00 0.00 179.01 179.24 2w01 h VAL 525 N 0.38 1.23 -0.45 3.13 -1.51 -1.32 -2.40 116.25 115.30 2w01 h VAL 525 Ca -0.05 -0.53 -0.08 0.00 -1.23 0.00 0.00 66.70 64.81 2w01 h VAL 525 Cb 1.34 0.13 -0.02 0.00 -2.13 0.00 0.00 31.29 30.61 2w01 h VAL 525 CO 0.14 0.25 -0.03 0.78 -1.23 0.00 0.00 177.57 177.48 2w01 h ASN 526 N 1.10 0.73 -0.64 4.19 -0.26 -1.06 0.11 115.58 119.75 2w01 h ASN 526 Ca 0.28 -0.18 0.11 0.00 -0.56 0.00 0.00 56.30 55.95 2w01 h ASN 526 Cb -0.01 -0.19 -0.08 0.00 -1.06 0.00 0.00 38.32 36.98 2w01 h ASN 526 CO -0.05 0.82 0.24 -0.61 -1.06 0.00 0.00 177.43 176.76 2w01 h GLN 527 N 0.70 0.40 -0.18 0.81 4.15 -1.12 0.29 115.11 120.16 2w01 h GLN 527 Ca 0.13 -0.02 -0.08 0.00 0.77 0.00 0.00 58.65 59.45 2w01 h GLN 527 Cb 0.47 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.07 2w01 h GLN 527 CO 0.02 0.26 -0.21 1.96 -1.93 0.00 0.00 178.83 178.94 2w01 h GLN 528 N 0.41 0.47 -0.22 1.69 4.20 -1.42 0.24 115.11 120.48 2w01 h GLN 528 Ca 0.33 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 2w01 h GLN 528 Cb 0.44 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 2w01 h GLN 528 CO -0.34 0.84 0.12 0.28 -0.67 0.00 0.00 178.83 179.06 2w01 h VAL 529 N 0.12 1.12 0.00 -0.54 2.07 -0.16 -2.41 116.25 116.45 2w01 h VAL 529 Ca 0.03 -0.32 -0.08 0.00 0.82 0.00 0.00 66.70 67.15 2w01 h VAL 529 Cb 0.76 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 2w01 h VAL 529 CO 0.05 0.11 -0.39 0.74 0.02 0.00 0.00 177.57 178.10 2w01 h THR 530 N 0.24 0.80 0.00 2.57 2.02 -0.49 -1.92 112.91 116.12 2w01 h THR 530 Ca 0.08 -1.72 0.00 0.00 0.77 0.00 0.00 66.41 65.54 2w01 h THR 530 Cb 0.08 2.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.58 2w01 h THR 530 CO -0.01 0.38 0.00 1.23 0.37 0.00 0.00 175.52 177.49 2w01 h GLY 531 N 2.66 0.00 -2.04 2.16 0.00 -0.52 0.06 103.07 105.38 2w01 h GLY 531 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2w01 h GLY 531 CO 0.05 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.63 2w01 n LEU 532 N -2.35 3.14 -0.12 3.11 4.32 -0.75 -4.94 117.00 119.41 2w01 n LEU 532 Ca 0.00 -1.26 0.00 0.00 -0.02 0.00 0.00 56.01 54.73 2w01 n LEU 532 Cb 0.16 -0.16 0.00 0.00 -1.62 0.00 0.00 43.42 41.79 2w01 n LEU 532 CO 0.17 0.63 0.00 0.61 -1.22 0.00 0.00 177.39 177.58 2w01 n GLY 533 N 1.43 0.55 3.30 -0.72 0.00 0.01 -5.04 105.19 104.71 2w01 n GLY 533 Ca 0.18 -0.82 -0.24 0.00 0.00 0.00 0.00 46.02 45.14 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 -0.24 2.32 0.39 0.99 2.01 -1.04 -5.01 118.68 118.10 2w01 s LEU 534 Ca 0.00 -0.71 -0.27 0.00 0.01 0.00 0.00 54.13 53.15 2w01 s LEU 534 Cb 0.00 -0.90 -0.10 0.00 0.01 0.00 0.00 46.19 45.19 2w01 s LEU 534 CO 0.00 0.06 1.46 -1.10 1.01 0.00 0.00 176.35 177.77 2w01 s GLN 535 N -2.02 4.03 0.51 1.70 -0.21 -1.26 -3.51 119.66 118.90 2w01 s GLN 535 Ca 0.08 2.51 -0.23 0.00 0.02 0.00 0.00 55.36 57.74 2w01 s GLN 535 Cb -0.10 -2.90 -0.06 0.00 1.00 0.00 0.00 33.01 30.95 2w01 s GLN 535 CO 0.05 -0.57 1.36 -1.25 -2.12 0.00 0.00 175.29 172.75 2w01 s PRO 536 N -2.15 3.38 0.40 2.91 0.04 -1.26 -4.76 135.00 133.55 2w01 s PRO 536 Ca 0.54 2.24 -0.23 0.00 0.04 0.00 0.00 61.00 63.58 2w01 s PRO 536 Cb -0.45 -2.40 -0.10 0.00 0.04 0.00 0.00 34.50 31.59 2w01 s PRO 536 CO 0.61 -1.00 1.00 -0.51 0.04 0.00 0.00 177.00 177.13 2w01 s LEU 537 N -3.22 4.10 0.15 -3.56 1.43 -1.26 -5.09 118.68 111.23 2w01 s LEU 537 Ca 0.67 1.90 0.10 0.00 -1.03 0.00 0.00 54.13 55.77 2w01 s LEU 537 Cb -0.40 -4.27 -0.04 0.00 0.03 0.00 0.00 46.19 41.50 2w01 s LEU 537 CO 0.49 -0.40 -0.18 -1.61 0.23 0.00 0.00 176.35 174.88 2w01 s GLU 538 N -2.64 1.77 -0.01 1.70 2.02 -1.26 -5.01 118.70 115.26 2w01 s GLU 538 Ca 0.58 -1.28 0.02 0.00 0.02 0.00 0.00 54.97 54.31 2w01 s GLU 538 Cb -0.17 -2.06 0.00 0.00 0.10 0.00 0.00 34.13 32.00 2w01 s GLU 538 CO 0.22 0.45 -0.05 1.41 0.02 0.00 0.00 175.26 177.32 2w01 s MET 539 N -2.40 0.48 0.22 1.61 -2.45 -1.26 -2.28 119.30 113.22 2w01 s MET 539 Ca 0.20 -0.16 0.09 0.00 -1.25 0.00 0.00 55.69 54.56 2w01 s MET 539 Cb -0.10 -0.48 -0.04 0.00 1.25 0.00 0.00 34.83 35.46 2w01 s MET 539 CO 0.11 0.07 -0.03 0.20 1.05 0.00 0.00 175.02 176.42 2w01 s GLY 540 N 0.09 1.70 -0.05 2.11 0.00 -0.76 -0.62 107.32 109.79 2w01 s GLY 540 Ca -0.01 -1.53 -0.04 0.00 0.00 0.00 0.00 44.72 43.15 2w01 s GLY 540 CO -0.00 -1.56 0.13 -0.42 0.00 0.00 0.00 173.10 171.24 2w01 s ILE 541 N -1.98 -0.01 0.04 0.90 1.01 -0.90 -1.84 121.20 118.41 2w01 s ILE 541 Ca 0.28 0.05 0.09 0.00 0.00 0.00 0.00 60.65 61.07 2w01 s ILE 541 Cb -0.08 -0.19 -0.03 0.00 0.01 0.00 0.00 42.46 42.17 2w01 s ILE 541 CO 0.18 0.02 -0.26 -0.83 0.00 0.00 0.00 174.94 174.05 2w01 s GLY 542 N 0.37 1.39 -0.02 6.18 0.00 -0.38 -0.95 107.32 113.91 2w01 s GLY 542 Ca -0.03 -1.26 0.02 0.00 0.00 0.00 0.00 44.72 43.46 2w01 s GLY 542 CO -0.01 -1.13 -0.06 -0.42 0.00 0.00 0.00 173.10 171.47 2w01 s ILE 543 N -0.79 0.51 0.00 0.90 1.01 -0.58 -0.87 121.20 121.39 2w01 s ILE 543 Ca 0.12 -0.23 -0.04 0.00 0.00 0.00 0.00 60.65 60.50 2w01 s ILE 543 Cb -0.10 -0.46 -0.01 0.00 0.01 0.00 0.00 42.46 41.90 2w01 s ILE 543 CO 0.02 0.17 0.07 0.21 0.00 0.00 0.00 174.94 175.40 2w01 s ASN 544 N 0.15 0.09 -0.15 3.58 3.04 -0.76 -1.73 114.94 119.16 2w01 s ASN 544 Ca -0.02 -0.25 0.02 0.00 0.04 0.00 0.00 52.86 52.65 2w01 s ASN 544 Cb -0.06 0.16 0.01 0.00 -1.54 0.00 0.00 41.25 39.82 2w01 s ASN 544 CO -0.00 -0.29 -0.20 -0.89 -3.04 0.00 0.00 177.10 172.68 2w01 s THR 545 N -1.17 2.17 0.07 -5.21 2.01 -1.26 -0.54 115.64 111.70 2w01 s THR 545 Ca -0.13 -0.94 -0.26 0.00 0.31 0.00 0.00 61.69 60.68 2w01 s THR 545 Cb -0.07 -1.88 0.09 0.00 0.01 0.00 0.00 72.50 70.64 2w01 s THR 545 CO 0.00 0.54 1.18 -0.83 -0.69 0.00 0.00 174.62 174.83 2w01 s GLY 546 N 0.91 -0.04 0.03 4.40 0.00 -0.20 -4.68 107.32 107.74 2w01 s GLY 546 Ca -0.05 -0.09 -0.30 0.00 0.00 0.00 0.00 44.72 44.28 2w01 s GLY 546 CO -0.04 4.04 1.02 -0.54 0.00 0.00 0.00 173.10 177.58 2w01 s GLU 547 N -2.11 4.56 0.22 2.90 2.02 -1.26 -0.36 118.70 124.68 2w01 s GLU 547 Ca 0.26 1.49 0.01 0.00 0.02 0.00 0.00 54.97 56.75 2w01 s GLU 547 Cb -0.01 -3.42 -0.05 0.00 0.10 0.00 0.00 34.13 30.75 2w01 s GLU 547 CO 0.02 -0.04 0.06 0.14 0.02 0.00 0.00 175.26 175.46 2w01 s VAL 548 N 0.81 0.58 -0.06 2.63 -7.23 0.27 -4.65 120.40 112.75 2w01 s VAL 548 Ca 0.52 -1.99 -0.15 0.00 -1.81 0.00 0.00 61.98 58.54 2w01 s VAL 548 Cb -0.23 -2.42 -0.05 0.00 0.56 0.00 0.00 36.38 34.24 2w01 s VAL 548 CO 0.29 -0.19 0.41 -0.69 -0.31 0.00 0.00 175.10 174.60 2w01 s VAL 549 N -3.73 5.12 0.02 1.32 1.01 -0.33 -0.86 120.40 122.96 2w01 s VAL 549 Ca 0.32 0.82 0.06 0.00 0.00 0.00 0.00 61.98 63.18 2w01 s VAL 549 Cb 0.07 -3.73 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 2w01 s VAL 549 CO 0.10 0.48 -0.17 0.68 0.00 0.00 0.00 175.10 176.19 2w01 s VAL 550 N -0.36 1.35 -0.07 2.92 -7.23 -0.01 -0.67 120.40 116.32 2w01 s VAL 550 Ca 0.23 -0.96 -0.31 0.00 -1.81 0.00 0.00 61.98 59.13 2w01 s VAL 550 Cb -0.16 -1.17 0.12 0.00 0.56 0.00 0.00 36.38 35.73 2w01 s VAL 550 CO 0.11 0.20 1.38 -0.83 -0.31 0.00 0.00 175.10 175.64 2w01 s GLY 551 N -0.88 -0.34 -0.09 2.32 0.00 -0.42 -1.65 107.32 106.27 2w01 s GLY 551 Ca 0.05 0.51 -0.23 0.00 0.00 0.00 0.00 44.72 45.05 2w01 s GLY 551 CO 0.01 3.38 0.70 -1.31 0.00 0.00 0.00 173.10 175.88 2w01 s ASN 552 N -3.46 6.95 -0.09 1.64 -0.87 -1.26 -1.25 114.94 116.60 2w01 s ASN 552 Ca 0.23 1.15 -0.11 0.00 -1.57 0.00 0.00 52.86 52.56 2w01 s ASN 552 Cb 0.04 -2.41 0.03 0.00 -0.02 0.00 0.00 41.25 38.88 2w01 s ASN 552 CO -0.04 -0.16 0.29 -0.63 -2.57 0.00 0.00 177.10 173.99 2w01 s ILE 553 N 1.04 0.02 -0.08 0.60 1.01 -0.87 -4.86 121.20 118.06 2w01 s ILE 553 Ca 0.36 -0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.89 2w01 s ILE 553 Cb -0.17 -0.46 0.00 0.00 0.01 0.00 0.00 42.46 41.84 2w01 s ILE 553 CO 0.17 -0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.65 2w01 n GLY 554 N 2.54 0.14 3.30 6.18 0.00 -1.26 -2.36 105.19 113.72 2w01 n GLY 554 Ca -0.15 -1.93 -0.29 0.00 0.00 0.00 0.00 46.02 43.65 2w01 n GLY 554 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2w01 n SER 555 N 0.00 -3.30 0.21 1.61 2.88 -1.26 -4.93 113.62 108.83 2w01 n SER 555 Ca 0.00 -0.60 0.12 0.00 -1.33 0.00 0.00 58.87 57.06 2w01 n SER 555 Cb 0.00 -1.08 0.20 0.00 -0.75 0.00 0.00 64.21 62.58 2w01 n SER 555 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2w01 h GLU 556 N -3.27 0.00 0.00 -1.46 4.22 -2.02 -3.42 114.58 108.63 2w01 h GLU 556 Ca -0.48 0.00 0.00 0.00 0.08 0.00 0.00 59.36 58.96 2w01 h GLU 556 Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 2w01 h GLU 556 CO 0.34 0.00 0.00 1.17 -2.18 0.00 0.00 179.01 178.34 2w01 n LYS 557 N -3.03 0.00 -2.70 1.92 3.00 -1.26 -4.89 118.16 111.20 2w01 n LYS 557 Ca 0.04 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.92 2w01 n LYS 557 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.55 2w01 n LYS 557 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 2w01 n ARG 558 N 0.00 3.39 -3.36 1.64 0.63 -1.26 -4.98 116.66 112.71 2w01 n ARG 558 Ca 0.00 -3.65 -0.38 0.00 -0.92 0.00 0.00 57.85 52.90 2w01 n ARG 558 Cb 0.00 -3.07 -0.06 0.00 0.45 0.00 0.00 32.46 29.78 2w01 n ARG 558 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 2w01 s THR 559 N 1.64 5.10 0.47 5.15 -4.23 -1.26 -4.63 115.64 117.88 2w01 s THR 559 Ca 0.43 0.94 0.08 0.00 -1.18 0.00 0.00 61.69 61.97 2w01 s THR 559 Cb 0.02 -3.79 0.03 0.00 1.34 0.00 0.00 72.50 70.10 2w01 s THR 559 CO 0.01 0.42 0.63 -1.59 -0.54 0.00 0.00 174.62 173.54 2w01 s LYS 560 N 0.01 2.65 -0.30 3.99 0.00 -1.00 -4.82 119.74 120.28 2w01 s LYS 560 Ca 0.25 -1.39 -0.25 0.00 0.00 0.00 0.00 55.97 54.59 2w01 s LYS 560 Cb -0.16 -2.70 0.00 0.00 0.00 0.00 0.00 37.83 34.97 2w01 s LYS 560 CO 0.12 -0.46 0.86 -0.47 0.00 0.00 0.00 175.35 175.40 2w01 s TYR 561 N -2.46 3.21 0.24 1.78 5.04 -1.26 -2.05 117.35 121.86 2w01 s TYR 561 Ca 0.57 0.96 0.11 0.00 -2.44 0.00 0.00 57.07 56.27 2w01 s TYR 561 Cb -0.08 -3.29 -0.05 0.00 0.35 0.00 0.00 41.96 38.90 2w01 s TYR 561 CO 0.35 -0.58 -0.13 0.20 -1.34 0.00 0.00 175.55 174.05 2w01 s GLY 562 N 1.56 1.76 -0.04 8.97 0.00 -0.38 -4.95 107.32 114.25 2w01 s GLY 562 Ca 0.36 -1.70 0.02 0.00 0.00 0.00 0.00 44.72 43.40 2w01 s GLY 562 CO 0.12 -1.76 -0.08 0.54 0.00 0.00 0.00 173.10 171.92 2w01 s VAL 563 N -2.18 0.79 -0.01 1.40 0.11 -1.26 -1.30 120.40 117.95 2w01 s VAL 563 Ca 0.28 -0.32 0.04 0.00 -2.93 0.00 0.00 61.98 59.06 2w01 s VAL 563 Cb -0.07 -0.73 -0.01 0.00 -1.53 0.00 0.00 36.38 34.04 2w01 s VAL 563 CO 0.16 0.26 -0.15 -0.69 -3.33 0.00 0.00 175.10 171.35 2w01 s VAL 564 N 0.48 1.14 0.00 2.04 1.01 0.15 -5.00 120.40 120.22 2w01 s VAL 564 Ca -0.08 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.27 2w01 s VAL 564 Cb -0.12 -0.96 0.00 0.00 0.00 0.00 0.00 36.38 35.31 2w01 s VAL 564 CO 0.01 0.31 0.00 0.61 0.00 0.00 0.00 175.10 176.04 2w01 n GLY 565 N 2.70 3.43 0.44 4.51 0.00 -1.26 -1.18 105.19 113.82 2w01 n GLY 565 Ca -0.14 -1.31 0.25 0.00 0.00 0.00 0.00 46.02 44.81 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 2.48 0.00 4.61 0.00 -2.00 -0.94 119.26 123.42 2w01 h ALA 566 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2w01 h ALA 566 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2w01 h ALA 566 CO 0.00 -0.81 0.00 0.37 0.00 0.00 0.00 179.25 178.81 2w01 h GLN 567 N 0.26 0.00 0.12 0.00 5.75 -1.92 0.87 115.11 120.19 2w01 h GLN 567 Ca 0.51 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 59.01 2w01 h GLN 567 Cb 1.55 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.10 2w01 h GLN 567 CO -0.15 0.00 -0.06 0.28 -2.65 0.00 0.00 178.83 176.25 2w01 h VAL 568 N 0.00 1.05 -0.92 2.39 2.07 -1.51 -3.09 116.25 116.24 2w01 h VAL 568 Ca 0.00 -1.18 0.11 0.00 0.82 0.00 0.00 66.70 66.45 2w01 h VAL 568 Cb 0.72 1.73 -0.07 0.00 -1.52 0.00 0.00 31.29 32.15 2w01 h VAL 568 CO 0.00 0.26 0.59 0.78 0.02 0.00 0.00 177.57 179.22 2w01 h ASN 569 N -0.76 0.82 -0.66 0.57 2.35 -1.50 -2.24 115.58 114.16 2w01 h ASN 569 Ca -0.02 0.03 0.03 0.00 -0.55 0.00 0.00 56.30 55.79 2w01 h ASN 569 Cb 0.55 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 38.74 2w01 h ASN 569 CO 0.03 0.46 0.41 0.25 -1.65 0.00 0.00 177.43 176.93 2w01 h LEU 570 N 0.89 0.67 -1.22 1.61 6.46 -0.88 -1.55 115.31 121.28 2w01 h LEU 570 Ca 0.44 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 58.17 2w01 h LEU 570 Cb 0.46 -0.14 -0.03 0.00 -0.73 0.00 0.00 40.66 40.23 2w01 h LEU 570 CO -0.20 0.46 0.24 0.00 -0.62 0.00 0.00 178.44 178.32 2w01 h THR 571 N 0.80 1.19 -0.64 1.05 1.03 -1.32 0.13 112.91 115.16 2w01 h THR 571 Ca 0.27 -0.57 -0.07 0.00 -0.01 0.00 0.00 66.41 66.03 2w01 h THR 571 Cb 0.03 0.51 -0.03 0.00 -1.07 0.00 0.00 68.15 67.59 2w01 h THR 571 CO -0.11 0.23 0.13 1.88 -0.01 0.00 0.00 175.52 177.64 2w01 h TYR 572 N 0.78 1.10 0.42 0.00 -1.99 -1.40 -2.18 116.97 113.69 2w01 h TYR 572 Ca 0.19 -0.14 -0.01 0.00 2.00 0.00 0.00 58.73 60.77 2w01 h TYR 572 Cb 0.12 -0.30 -0.01 0.00 2.00 0.00 0.00 36.73 38.53 2w01 h TYR 572 CO 0.01 0.92 -0.31 0.00 -0.00 0.00 0.00 178.16 178.79 2w01 h ARG 573 N 0.95 -0.69 -0.76 4.88 -0.00 -0.63 -2.22 114.38 115.92 2w01 h ARG 573 Ca 0.20 0.05 0.17 0.00 -0.50 0.00 0.00 59.98 59.89 2w01 h ARG 573 Cb 0.40 0.16 -0.13 0.00 0.00 0.00 0.00 29.97 30.39 2w01 h ARG 573 CO 0.01 -0.46 -0.03 0.82 0.00 0.00 0.00 179.97 180.31 2w01 h ILE 574 N -0.71 0.32 0.00 2.04 2.04 -0.72 -0.79 117.51 119.69 2w01 h ILE 574 Ca -0.04 -0.03 -0.08 0.00 1.00 0.00 0.00 64.86 65.71 2w01 h ILE 574 Cb 0.61 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 2w01 h ILE 574 CO 0.01 0.01 -0.38 -0.08 0.00 0.00 0.00 178.15 177.72 2w01 h GLU 575 N 0.08 0.00 0.00 2.37 4.22 -1.37 -3.09 114.58 116.78 2w01 h GLU 575 Ca 0.41 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.85 2w01 h GLU 575 Cb 0.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.96 2w01 h GLU 575 CO -0.69 0.38 0.00 0.66 -2.18 0.00 0.00 179.01 177.18 2w01 h SER 576 N 0.00 0.00 0.45 1.04 4.64 -0.49 -1.45 113.55 117.75 2w01 h SER 576 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2w01 h SER 576 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 2w01 h SER 576 CO 0.05 0.00 -0.13 -1.22 -0.87 0.00 0.00 176.83 174.66 2w01 n TYR 577 N -3.00 0.00 -2.48 4.77 4.01 -1.17 -4.90 117.16 114.39 2w01 n TYR 577 Ca -0.02 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.40 2w01 n TYR 577 Cb 0.14 -0.23 -0.04 0.00 -0.31 0.00 0.00 39.34 38.91 2w01 n TYR 577 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2w01 s THR 578 N -2.58 4.33 0.39 -0.72 -1.32 -0.55 -5.08 115.64 110.11 2w01 s THR 578 Ca 0.26 1.23 0.08 0.00 -1.21 0.00 0.00 61.69 62.05 2w01 s THR 578 Cb 0.20 -3.62 -0.07 0.00 -1.51 0.00 0.00 72.50 67.50 2w01 s THR 578 CO 0.50 -0.53 0.01 0.42 -2.21 0.00 0.00 174.62 172.81 2w01 s THR 579 N -2.43 2.15 0.10 5.08 -4.23 -1.26 -4.98 115.64 110.07 2w01 s THR 579 Ca 0.61 -2.01 -0.27 0.00 -1.18 0.00 0.00 61.69 58.85 2w01 s THR 579 Cb -0.11 -2.90 -0.15 0.00 1.34 0.00 0.00 72.50 70.68 2w01 s THR 579 CO 0.26 -0.06 0.59 0.61 -0.54 0.00 0.00 174.62 175.48 2w01 n GLY 580 N -0.96 -1.00 3.10 3.99 0.00 -1.26 -2.25 105.19 106.81 2w01 n GLY 580 Ca -0.04 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.38 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 1.49 0.98 3.55 -0.02 0.00 0.21 -4.87 105.19 106.54 2w01 n GLY 581 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 2w01 n GLY 581 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2w01 s GLN 582 N -0.09 2.84 -0.22 1.61 0.74 -0.95 -5.04 119.66 118.54 2w01 s GLN 582 Ca 0.00 -0.57 -0.03 0.00 0.05 0.00 0.00 55.36 54.82 2w01 s GLN 582 Cb 0.00 -2.60 0.00 0.00 1.10 0.00 0.00 33.01 31.51 2w01 s GLN 582 CO 0.00 0.60 -0.07 0.42 -0.55 0.00 0.00 175.29 175.69 2w01 s ILE 583 N -0.64 3.09 -0.14 -2.34 1.01 -1.26 -2.13 121.20 118.78 2w01 s ILE 583 Ca 0.10 -0.64 -0.05 0.00 0.00 0.00 0.00 60.65 60.06 2w01 s ILE 583 Cb -0.11 -2.41 -0.03 0.00 0.01 0.00 0.00 42.46 39.91 2w01 s ILE 583 CO 0.02 0.41 0.02 -0.36 0.00 0.00 0.00 174.94 175.02 2w01 s PHE 584 N 1.43 3.17 0.05 3.97 2.99 -0.12 -1.37 117.98 128.10 2w01 s PHE 584 Ca 0.05 0.02 0.07 0.00 0.00 0.00 0.00 56.93 57.08 2w01 s PHE 584 Cb -0.14 -1.95 -0.03 0.00 0.00 0.00 0.00 43.02 40.90 2w01 s PHE 584 CO -0.05 0.22 -0.21 0.96 -0.00 0.00 0.00 175.22 176.14 2w01 s ILE 585 N -0.09 1.70 0.87 0.64 -4.36 -0.47 -1.52 121.20 117.96 2w01 s ILE 585 Ca 0.05 -1.24 -0.11 0.00 -0.26 0.00 0.00 60.65 59.09 2w01 s ILE 585 Cb -0.13 -1.48 0.11 0.00 1.25 0.00 0.00 42.46 42.22 2w01 s ILE 585 CO 0.02 0.19 1.09 -0.94 0.24 0.00 0.00 174.94 175.54 2w01 s SER 586 N -1.24 3.66 0.37 4.36 1.04 -0.71 -0.04 113.70 121.15 2w01 s SER 586 Ca 0.08 1.61 0.20 0.00 0.48 0.00 0.00 55.95 58.31 2w01 s SER 586 Cb -0.09 -2.28 0.47 0.00 0.10 0.00 0.00 66.02 64.22 2w01 s SER 586 CO 0.02 -2.54 1.63 0.28 0.98 0.00 0.00 173.24 173.61 2w01 h SER 587 N -1.48 0.00 -0.10 7.02 0.02 -1.93 -1.64 113.55 115.45 2w01 h SER 587 Ca -0.48 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.36 2w01 h SER 587 Cb 1.27 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.80 2w01 h SER 587 CO 0.53 0.31 -0.31 0.71 -1.14 0.00 0.00 176.83 176.93 2w01 h THR 588 N 0.00 1.28 -0.14 -2.27 1.35 -1.91 0.14 112.91 111.37 2w01 h THR 588 Ca -0.00 -1.41 -0.03 0.00 -0.55 0.00 0.00 66.41 64.42 2w01 h THR 588 Cb 1.06 1.41 -0.00 0.00 -1.73 0.00 0.00 68.15 68.88 2w01 h THR 588 CO 0.04 0.45 -0.03 0.74 -0.25 0.00 0.00 175.52 176.47 2w01 h THR 589 N 0.49 1.29 -0.51 6.82 2.02 -1.77 -0.63 112.91 120.62 2w01 h THR 589 Ca 0.06 -0.98 -0.01 0.00 0.77 0.00 0.00 66.41 66.25 2w01 h THR 589 Cb 0.78 1.66 -0.03 0.00 -1.74 0.00 0.00 68.15 68.83 2w01 h THR 589 CO 0.06 0.29 0.28 0.25 0.37 0.00 0.00 175.52 176.77 2w01 h LEU 590 N -0.04 0.62 -0.05 2.58 5.85 -1.23 0.02 115.31 123.06 2w01 h LEU 590 Ca 0.03 -0.04 -0.26 0.00 0.84 0.00 0.00 57.88 58.46 2w01 h LEU 590 Cb 0.46 -0.16 0.02 0.00 0.37 0.00 0.00 40.66 41.35 2w01 h LEU 590 CO 0.01 0.50 -1.03 -0.33 -0.34 0.00 0.00 178.44 177.25 2w01 h GLU 591 N 0.71 0.59 -0.34 1.25 4.39 -0.60 0.58 114.58 121.15 2w01 h GLU 591 Ca 0.18 -0.65 -0.04 0.00 0.34 0.00 0.00 59.36 59.19 2w01 h GLU 591 Cb 0.02 0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 2w01 h GLU 591 CO -0.03 1.26 0.05 0.00 -1.16 0.00 0.00 179.01 179.12 2w01 h ALA 592 N 0.51 0.45 -0.10 3.43 0.00 -0.99 -3.29 119.26 119.27 2w01 h ALA 592 Ca -0.12 -0.21 -0.19 0.00 0.00 0.00 0.00 54.91 54.40 2w01 h ALA 592 Cb 1.68 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.34 2w01 h ALA 592 CO 0.19 0.16 -0.72 0.00 0.00 0.00 0.00 179.25 178.88 2w01 h ALA 593 N 0.89 0.56 0.00 0.00 0.00 -0.98 -3.45 119.26 116.28 2w01 h ALA 593 Ca 0.10 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2w01 h ALA 593 Cb 0.37 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2w01 h ALA 593 CO 0.01 0.74 0.00 0.41 0.00 0.00 0.00 179.25 180.41 2w01 n GLY 594 N 0.56 -1.81 0.32 0.00 0.00 0.19 -4.49 105.19 99.95 2w01 n GLY 594 Ca -0.05 -1.51 0.15 0.00 0.00 0.00 0.00 46.02 44.61 2w01 n GLY 594 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2w01 h ASP 595 N 0.00 0.00 0.82 1.61 3.32 -1.94 -2.27 116.42 117.97 2w01 h ASP 595 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2w01 h ASP 595 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2w01 h ASP 595 CO 0.00 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 178.06 2w01 n ARG 596 N -4.14 0.19 -2.49 3.56 1.74 -1.26 -4.41 116.66 109.85 2w01 n ARG 596 Ca 0.02 0.37 -0.43 0.00 -0.77 0.00 0.00 57.85 57.04 2w01 n ARG 596 Cb 0.30 -1.83 -0.02 0.00 -1.02 0.00 0.00 32.46 29.89 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 -3.26 4.35 -0.09 1.55 1.01 -0.86 -1.02 120.40 122.09 2w01 s VAL 597 Ca 0.06 1.60 -0.12 0.00 0.00 0.00 0.00 61.98 63.51 2w01 s VAL 597 Cb 0.10 -4.13 -0.05 0.00 0.00 0.00 0.00 36.38 32.30 2w01 s VAL 597 CO 0.41 -0.25 0.30 -1.00 0.00 0.00 0.00 175.10 174.56 2w01 s HIS 598 N 3.65 3.61 -0.03 5.22 3.76 0.26 -5.01 115.29 126.75 2w01 s HIS 598 Ca 0.52 0.74 0.05 0.00 -0.15 0.00 0.00 55.06 56.22 2w01 s HIS 598 Cb -0.18 -2.21 -0.01 0.00 1.11 0.00 0.00 32.58 31.28 2w01 s HIS 598 CO 0.15 0.54 -0.19 0.08 -0.85 0.00 0.00 174.74 174.46 2w01 s VAL 599 N -0.55 1.55 -0.86 -0.90 1.01 -1.26 -1.61 120.40 117.77 2w01 s VAL 599 Ca 0.19 -0.80 0.24 0.00 0.00 0.00 0.00 61.98 61.60 2w01 s VAL 599 Cb -0.14 -1.31 0.22 0.00 0.00 0.00 0.00 36.38 35.15 2w01 s VAL 599 CO 0.08 0.44 1.74 0.59 0.00 0.00 0.00 175.10 177.94 2w01 n ASN 600 N 2.90 0.27 0.00 3.32 4.13 0.33 -4.78 115.26 121.43 2w01 n ASN 600 Ca -0.17 0.54 0.00 0.00 1.68 0.00 0.00 54.58 56.63 2w01 n ASN 600 Cb 0.53 -0.61 0.00 0.00 -1.54 0.00 0.00 39.78 38.16 2w01 n ASN 600 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2w01 n GLY 601 N 0.80 0.98 3.44 7.41 0.00 -1.25 -4.98 105.19 111.59 2w01 n GLY 601 Ca 0.05 -1.71 -0.22 0.00 0.00 0.00 0.00 46.02 44.14 2w01 n GLY 601 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2w01 s ASN 602 N 0.00 3.15 -0.24 1.61 2.47 -1.26 -1.27 114.94 119.39 2w01 s ASN 602 Ca 0.00 -1.09 -0.24 0.00 0.42 0.00 0.00 52.86 51.95 2w01 s ASN 602 Cb 0.00 -0.23 0.07 0.00 -1.45 0.00 0.00 41.25 39.63 2w01 s ASN 602 CO 0.00 -0.14 0.67 -0.60 -3.72 0.00 0.00 177.10 173.31 2w01 s ARG 603 N -3.61 0.80 -0.22 0.43 3.52 -0.46 -4.94 118.95 114.46 2w01 s ARG 603 Ca 0.28 0.90 -0.04 0.00 -0.13 0.00 0.00 55.73 56.73 2w01 s ARG 603 Cb -0.01 0.39 -0.01 0.00 -1.56 0.00 0.00 34.95 33.76 2w01 s ARG 603 CO 0.12 -0.11 -0.03 -0.08 -0.81 0.00 0.00 175.30 174.40 2w01 s THR 604 N 0.27 3.48 0.15 4.11 -1.32 -1.26 0.08 115.64 121.14 2w01 s THR 604 Ca -0.01 -0.46 0.10 0.00 -1.21 0.00 0.00 61.69 60.11 2w01 s THR 604 Cb -0.04 -2.59 -0.04 0.00 -1.51 0.00 0.00 72.50 68.32 2w01 s THR 604 CO 0.01 0.41 -0.19 0.68 -2.21 0.00 0.00 174.62 173.33 2w01 s VAL 605 N 1.48 2.75 -0.59 5.08 -7.23 -0.19 -4.97 120.40 116.73 2w01 s VAL 605 Ca 0.06 -1.67 0.02 0.00 -1.81 0.00 0.00 61.98 58.58 2w01 s VAL 605 Cb -0.14 -2.29 0.15 0.00 0.56 0.00 0.00 36.38 34.65 2w01 s VAL 605 CO -0.02 0.01 0.37 -1.58 -0.31 0.00 0.00 175.10 173.57 2w01 s GLN 606 N -2.38 2.26 0.49 4.82 2.00 -1.26 -0.73 119.66 124.86 2w01 s GLN 606 Ca 0.19 -2.76 -0.20 0.00 -2.00 0.00 0.00 55.36 50.59 2w01 s GLN 606 Cb -0.10 -3.46 -0.08 0.00 0.80 0.00 0.00 33.01 30.17 2w01 s GLN 606 CO 0.11 -1.16 1.04 -1.25 -0.50 0.00 0.00 175.29 173.53 2w01 s PRO 607 N -0.50 3.78 0.90 1.67 0.04 -1.26 -5.02 135.00 134.60 2w01 s PRO 607 Ca 0.19 1.37 -0.11 0.00 0.04 0.00 0.00 61.00 62.49 2w01 s PRO 607 Cb -0.20 -2.09 0.13 0.00 0.04 0.00 0.00 34.50 32.38 2w01 s PRO 607 CO -0.04 -0.45 1.11 0.15 0.04 0.00 0.00 177.00 177.81 2w01 s LYS 608 N -3.25 1.21 0.00 4.56 3.01 -1.26 -3.64 119.74 120.38 2w01 s LYS 608 Ca 0.67 1.28 0.00 0.00 -1.01 0.00 0.00 55.97 56.91 2w01 s LYS 608 Cb -0.17 -1.77 0.00 0.00 -1.01 0.00 0.00 37.83 34.89 2w01 s LYS 608 CO 0.20 -2.41 0.00 0.41 0.51 0.00 0.00 175.35 174.07 2w01 n GLY 609 N -0.32 1.65 3.68 -3.33 0.00 -1.26 -4.90 105.19 100.71 2w01 n GLY 609 Ca 0.10 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 2w01 n GLY 609 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w01 s VAL 610 N 0.00 4.28 0.01 1.61 0.11 -1.24 -4.97 120.40 120.20 2w01 s VAL 610 Ca 0.00 1.59 -0.25 0.00 -2.93 0.00 0.00 61.98 60.39 2w01 s VAL 610 Cb 0.00 -4.02 -0.18 0.00 -1.53 0.00 0.00 36.38 30.65 2w01 s VAL 610 CO 0.00 -0.05 1.30 0.11 -3.33 0.00 0.00 175.10 173.13 2w01 h LYS 611 N 7.69 -0.20 -6.99 1.54 1.57 -1.90 -3.42 116.57 114.85 2w01 h LYS 611 Ca -0.31 0.01 -0.45 0.00 -1.87 0.00 0.00 60.65 58.03 2w01 h LYS 611 Cb 1.14 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 2w01 h LYS 611 CO 0.91 0.15 0.33 -0.51 -0.57 0.00 0.00 179.45 179.76 2w01 s ASP 612 N -5.33 7.05 0.23 0.86 1.11 -1.26 -5.01 116.67 114.33 2w01 s ASP 612 Ca -0.15 1.72 -0.30 0.00 0.18 0.00 0.00 52.55 54.01 2w01 s ASP 612 Cb 0.02 -2.55 -0.09 0.00 1.07 0.00 0.00 42.92 41.38 2w01 s ASP 612 CO 0.60 -0.27 1.05 -2.16 1.18 0.00 0.00 175.17 175.58 2w01 s PRO 613 N -2.83 4.68 -0.11 8.23 0.04 -1.26 -4.78 135.00 138.97 2w01 s PRO 613 Ca 0.58 1.68 -0.13 0.00 0.04 0.00 0.00 61.00 63.17 2w01 s PRO 613 Cb -0.12 -3.25 -0.05 0.00 0.04 0.00 0.00 34.50 31.13 2w01 s PRO 613 CO 0.16 0.25 0.31 0.14 0.04 0.00 0.00 177.00 177.90 2w01 s VAL 614 N -0.83 5.26 -0.11 -0.36 -7.23 0.09 -4.90 120.40 112.32 2w01 s VAL 614 Ca 0.45 0.59 -0.27 0.00 -1.81 0.00 0.00 61.98 60.95 2w01 s VAL 614 Cb -0.29 -3.63 -0.02 0.00 0.56 0.00 0.00 36.38 33.00 2w01 s VAL 614 CO 0.36 0.47 0.87 -0.69 -0.31 0.00 0.00 175.10 175.81 2w01 s VAL 615 N -0.17 4.89 0.05 1.32 1.01 -1.26 -1.02 120.40 125.22 2w01 s VAL 615 Ca 0.19 1.76 0.08 0.00 0.00 0.00 0.00 61.98 64.01 2w01 s VAL 615 Cb -0.14 -4.19 -0.03 0.00 0.00 0.00 0.00 36.38 32.02 2w01 s VAL 615 CO 0.07 0.08 -0.21 0.27 0.00 0.00 0.00 175.10 175.31 2w01 s ILE 616 N 1.68 2.58 -0.10 2.22 -4.36 0.11 -3.47 121.20 119.86 2w01 s ILE 616 Ca 0.43 -1.30 0.01 0.00 -0.26 0.00 0.00 60.65 59.53 2w01 s ILE 616 Cb -0.18 -2.07 -0.02 0.00 1.25 0.00 0.00 42.46 41.44 2w01 s ILE 616 CO 0.17 0.32 -0.12 0.26 0.24 0.00 0.00 174.94 175.81 2w01 s TRP 617 N -0.91 2.81 -0.45 1.37 0.52 0.94 -1.36 118.94 121.86 2w01 s TRP 617 Ca 0.14 -0.35 -0.25 0.00 0.02 0.00 0.00 56.10 55.66 2w01 s TRP 617 Cb -0.10 -1.76 0.03 0.00 -1.15 0.00 0.00 33.47 30.48 2w01 s TRP 617 CO 0.05 0.02 0.88 0.34 0.02 0.00 0.00 176.95 178.26 2w01 s ASP 618 N -0.18 6.49 -0.16 2.95 3.68 -0.40 -1.37 116.67 127.67 2w01 s ASP 618 Ca 0.01 0.10 -0.27 0.00 2.13 0.00 0.00 52.55 54.52 2w01 s ASP 618 Cb -0.13 -2.43 -0.01 0.00 -1.45 0.00 0.00 42.92 38.89 2w01 s ASP 618 CO 0.03 -0.99 0.89 -0.69 0.13 0.00 0.00 175.17 174.54 2w01 s VAL 619 N 3.59 4.84 -0.05 1.11 1.01 -0.47 0.12 120.40 130.56 2w01 s VAL 619 Ca 0.35 1.76 0.13 0.00 0.00 0.00 0.00 61.98 64.22 2w01 s VAL 619 Cb -0.11 -4.19 -0.23 0.00 0.00 0.00 0.00 36.38 31.85 2w01 s VAL 619 CO 0.25 0.01 0.66 0.00 0.00 0.00 0.00 175.10 176.01 2w01 n ALA 620 N 5.26 1.51 0.00 5.51 0.00 -0.63 -4.57 120.51 127.59 2w01 n ALA 620 Ca 0.06 -0.77 0.00 0.00 0.00 0.00 0.00 53.44 52.73 2w01 n ALA 620 Cb 0.49 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 19.09 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 1.55 -1.60 3.05 0.00 0.00 -1.18 -0.85 105.19 106.16 2w01 n GLY 621 Ca -0.17 -1.13 -0.12 0.00 0.00 0.00 0.00 46.02 44.60 2w01 n GLY 621 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2w01 s VAL 622 N -2.75 0.46 0.00 1.61 -7.23 0.35 -0.57 120.40 112.27 2w01 s VAL 622 Ca 0.00 -1.09 0.00 0.00 -1.81 0.00 0.00 61.98 59.08 2w01 s VAL 622 Cb 0.00 -0.59 0.00 0.00 0.56 0.00 0.00 36.38 36.35 2w01 s VAL 622 CO 0.00 -0.43 0.00 0.61 -0.31 0.00 0.00 175.10 174.97 2w01 n GLY 623 N 1.42 1.74 3.62 2.32 0.00 -0.19 -1.84 105.19 112.27 2w01 n GLY 623 Ca -0.23 -1.91 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 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 1.51 0.00 1.61 -0.58 -1.26 -1.31 120.64 120.62 2w01 n GLU 624 Ca 0.00 0.54 0.15 0.00 -0.42 0.00 0.00 57.16 57.43 2w01 n GLU 624 Cb 0.00 -2.06 0.77 0.00 -0.57 0.00 0.00 31.44 29.58 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 0.34 0.52 -0.01 3.49 -0.04 -1.26 -4.88 135.00 133.17 2w01 n PRO 625 Ca 0.08 -0.02 -0.17 0.00 -0.04 0.00 0.00 63.50 63.35 2w01 n PRO 625 Cb 0.37 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.23 2w01 n PRO 625 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2w01 h TYR 626 N 0.05 0.67 -6.18 0.54 -1.99 -1.49 -3.48 116.97 105.09 2w01 h TYR 626 Ca 0.00 -0.34 -0.42 0.00 2.00 0.00 0.00 58.73 59.97 2w01 h TYR 626 Cb 0.26 -0.09 0.08 0.00 2.00 0.00 0.00 36.73 38.98 2w01 h TYR 626 CO 0.00 1.14 -0.92 0.09 -0.00 0.00 0.00 178.16 178.47 2w01 n ASN 627 N -4.20 -4.44 -4.17 3.88 3.02 -1.00 -4.98 115.26 103.38 2w01 n ASN 627 Ca -0.09 -0.97 -0.30 0.00 -0.03 0.00 0.00 54.58 53.18 2w01 n ASN 627 Cb 0.66 -3.55 -0.17 0.00 -0.61 0.00 0.00 39.78 36.11 2w01 n ASN 627 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2w01 s LEU 628 N -6.47 1.97 0.04 3.41 1.02 -0.77 -4.99 118.68 112.90 2w01 s LEU 628 Ca 0.37 -0.49 0.03 0.00 0.02 0.00 0.00 54.13 54.07 2w01 s LEU 628 Cb -0.13 -1.25 -0.02 0.00 0.02 0.00 0.00 46.19 44.81 2w01 s LEU 628 CO 0.85 0.13 -0.10 -0.55 0.02 0.00 0.00 176.35 176.69 2w01 s SER 629 N 0.43 1.20 -0.02 2.29 0.15 -1.26 -0.50 113.70 115.99 2w01 s SER 629 Ca -0.18 -0.50 0.18 0.00 0.70 0.00 0.00 55.95 56.16 2w01 s SER 629 Cb -0.17 -0.03 -0.20 0.00 -1.71 0.00 0.00 66.02 63.91 2w01 s SER 629 CO 0.08 -0.09 0.57 -0.11 1.20 0.00 0.00 173.24 174.89 2w01 n LEU 630 N 1.67 0.47 0.00 3.45 7.94 -0.03 -4.99 117.00 125.51 2w01 n LEU 630 Ca -0.20 0.20 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2w01 n LEU 630 Cb 0.55 0.16 0.00 0.00 0.53 0.00 0.00 43.42 44.66 2w01 n LEU 630 CO 0.22 0.19 0.00 0.00 -1.11 0.00 0.00 177.39 176.69