#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k2m s PRO 474 N 0.00 0.43 -0.08 1.61 0.04 -1.26 -5.02 135.00 130.72 2k2m s PRO 474 Ca 0.00 0.64 0.12 0.00 0.04 0.00 0.00 61.00 61.80 2k2m s PRO 474 Cb 0.00 -1.73 0.18 0.00 0.04 0.00 0.00 34.50 32.99 2k2m s PRO 474 CO 0.00 -2.76 1.07 1.28 0.04 0.00 0.00 177.00 176.63 2k2m n LEU 475 N -4.21 1.91 0.00 -3.56 4.77 -1.26 -5.09 117.00 109.55 2k2m n LEU 475 Ca 0.05 -2.49 0.00 0.00 -0.03 0.00 0.00 56.01 53.55 2k2m n LEU 475 Cb 0.56 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 2k2m n LEU 475 CO 0.57 0.58 0.00 0.61 -1.33 0.00 0.00 177.39 177.82 2k2m n GLY 476 N -1.01 0.28 2.74 -0.72 0.00 -1.26 -4.96 105.19 100.26 2k2m n GLY 476 Ca 0.10 -1.14 -0.18 0.00 0.00 0.00 0.00 46.02 44.79 2k2m n GLY 476 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2k2m n SER 477 N 0.00 3.58 0.00 1.61 7.64 -1.26 -4.84 113.62 120.35 2k2m n SER 477 Ca 0.00 -2.27 0.00 0.00 1.01 0.00 0.00 58.87 57.61 2k2m n SER 477 Cb 0.00 -0.95 0.00 0.00 -1.01 0.00 0.00 64.21 62.25 2k2m n SER 477 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2k2m n GLY 478 N 3.88 -0.48 3.55 0.23 0.00 -1.26 -4.78 105.19 106.33 2k2m n GLY 478 Ca 0.34 -1.81 -0.35 0.00 0.00 0.00 0.00 46.02 44.20 2k2m n GLY 478 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k2m s ALA 479 N -1.05 2.17 0.46 4.61 0.00 -1.26 -4.43 121.76 122.27 2k2m s ALA 479 Ca 0.00 -1.27 -0.23 0.00 0.00 0.00 0.00 51.96 50.47 2k2m s ALA 479 Cb 0.00 -4.41 -0.10 0.00 0.00 0.00 0.00 23.12 18.61 2k2m s ALA 479 CO 0.00 -4.06 0.92 1.47 0.00 0.00 0.00 175.76 174.09 2k2m n LEU 480 N 12.08 2.39 -2.97 0.00 -0.00 -1.26 -4.99 117.00 122.24 2k2m n LEU 480 Ca 0.26 0.97 -0.16 0.00 -0.00 0.00 0.00 56.01 57.07 2k2m n LEU 480 Cb 0.50 -1.32 -0.01 0.00 -0.00 0.00 0.00 43.42 42.59 2k2m n LEU 480 CO 0.67 -1.78 -0.05 1.17 -0.00 0.00 0.00 177.39 177.40 2k2m n LYS 481 N 0.00 0.77 -1.84 1.47 3.00 -1.26 -5.14 118.16 115.16 2k2m n LYS 481 Ca 0.10 -2.51 -0.37 0.00 -0.00 0.00 0.00 58.31 55.54 2k2m n LYS 481 Cb 0.41 -1.34 0.05 0.00 0.00 0.00 0.00 35.03 34.15 2k2m n LYS 481 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 2k2m s TRP 482 N -0.35 2.20 -0.07 5.64 0.52 -1.26 -4.02 118.94 121.60 2k2m s TRP 482 Ca 0.33 1.49 0.03 0.00 0.02 0.00 0.00 56.10 57.97 2k2m s TRP 482 Cb 0.21 -3.63 -0.02 0.00 -1.15 0.00 0.00 33.47 28.88 2k2m s TRP 482 CO -0.17 -2.68 -0.14 0.14 0.02 0.00 0.00 176.95 174.12 2k2m s VAL 483 N -1.46 3.03 -0.48 4.03 -7.23 0.31 -2.25 120.40 116.35 2k2m s VAL 483 Ca 0.80 -0.72 -0.18 0.00 -1.81 0.00 0.00 61.98 60.08 2k2m s VAL 483 Cb -0.35 -2.21 0.06 0.00 0.56 0.00 0.00 36.38 34.44 2k2m s VAL 483 CO 0.38 0.57 0.52 -0.22 -0.31 0.00 0.00 175.10 176.04 2k2m s LEU 484 N -0.41 5.18 0.10 1.32 2.96 0.18 -2.13 118.68 125.88 2k2m s LEU 484 Ca 0.05 -1.03 -0.36 0.00 -0.22 0.00 0.00 54.13 52.57 2k2m s LEU 484 Cb -0.12 -2.35 -0.16 0.00 0.50 0.00 0.00 46.19 44.06 2k2m s LEU 484 CO 0.02 -0.77 1.41 0.00 -1.32 0.00 0.00 176.35 175.69 2k2m n ASN 486 N 2.84 0.62 -3.81 0.00 3.02 -0.72 -4.42 115.26 112.79 2k2m n ASN 486 Ca 0.18 -0.71 -0.13 0.00 -0.03 0.00 0.00 54.58 53.89 2k2m n ASN 486 Cb 0.22 1.03 -0.14 0.00 -0.61 0.00 0.00 39.78 40.27 2k2m n ASN 486 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2k2m s TYR 487 N -2.06 -0.05 0.55 3.10 1.51 -1.24 -4.89 117.35 114.28 2k2m s TYR 487 Ca 0.04 0.19 -0.20 0.00 -1.01 0.00 0.00 57.07 56.09 2k2m s TYR 487 Cb 0.08 -0.08 -0.05 0.00 -0.11 0.00 0.00 41.96 41.80 2k2m s TYR 487 CO 0.45 -0.07 1.19 -0.51 -1.11 0.00 0.00 175.55 175.49 2k2m s ASP 488 N 0.54 5.52 -0.21 2.29 1.11 -1.26 -4.51 116.67 120.15 2k2m s ASP 488 Ca -0.04 2.34 -0.09 0.00 0.18 0.00 0.00 52.55 54.94 2k2m s ASP 488 Cb -0.06 -2.60 0.09 0.00 1.07 0.00 0.00 42.92 41.42 2k2m s ASP 488 CO -0.02 -1.37 0.47 0.12 1.18 0.00 0.00 175.17 175.55 2k2m s PHE 489 N -1.61 -0.84 -0.17 4.23 5.36 -0.71 -4.98 117.98 119.25 2k2m s PHE 489 Ca 0.73 1.62 -0.09 0.00 -0.96 0.00 0.00 56.93 58.24 2k2m s PHE 489 Cb -0.29 0.39 -0.05 0.00 -0.34 0.00 0.00 43.02 42.73 2k2m s PHE 489 CO 0.33 -0.47 0.12 -1.14 -1.46 0.00 0.00 175.22 172.59 2k2m s GLN 490 N 2.26 3.90 0.00 10.12 0.74 -1.26 -0.78 119.66 134.65 2k2m s GLN 490 Ca -0.05 -0.21 0.00 0.00 0.05 0.00 0.00 55.36 55.15 2k2m s GLN 490 Cb -0.11 -3.31 0.00 0.00 1.10 0.00 0.00 33.01 30.70 2k2m s GLN 490 CO -0.14 0.45 0.00 0.00 -0.55 0.00 0.00 175.29 175.05 2k2m n ALA 491 N 3.02 2.56 -3.30 1.58 0.00 -1.26 -4.92 120.51 118.19 2k2m n ALA 491 Ca -0.17 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.05 2k2m n ALA 491 Cb 0.53 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.97 2k2m n ALA 491 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2k2m n ARG 492 N -1.84 -3.11 -4.72 0.00 1.74 -1.19 -4.90 116.66 102.64 2k2m n ARG 492 Ca 0.00 0.43 -0.32 0.00 -0.77 0.00 0.00 57.85 57.19 2k2m n ARG 492 Cb 0.00 -5.11 -0.07 0.00 -1.02 0.00 0.00 32.46 26.26 2k2m n ARG 492 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2k2m s ASN 493 N -2.65 3.88 -0.34 0.55 0.01 -1.11 -5.00 114.94 110.27 2k2m s ASN 493 Ca 0.37 -1.70 -0.34 0.00 -0.71 0.00 0.00 52.86 50.47 2k2m s ASN 493 Cb -0.20 0.64 -0.11 0.00 0.41 0.00 0.00 41.25 42.00 2k2m s ASN 493 CO 0.45 -0.93 2.21 -1.20 -1.51 0.00 0.00 177.10 176.12 2k2m n SER 494 N -1.34 2.25 -0.73 -1.22 7.64 -1.26 -1.06 113.62 117.91 2k2m n SER 494 Ca -0.18 0.36 -0.09 0.00 1.01 0.00 0.00 58.87 59.96 2k2m n SER 494 Cb 0.66 -1.30 -0.04 0.00 -1.01 0.00 0.00 64.21 62.52 2k2m n SER 494 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2k2m n SER 495 N 10.26 -5.49 -4.37 6.43 3.41 -1.26 -5.02 113.62 117.59 2k2m n SER 495 Ca 0.40 0.24 -0.31 0.00 -0.26 0.00 0.00 58.87 58.94 2k2m n SER 495 Cb 0.26 -3.82 -0.15 0.00 -0.26 0.00 0.00 64.21 60.25 2k2m n SER 495 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2k2m s GLU 496 N -2.70 2.08 -0.03 4.33 2.02 -0.22 -1.33 118.70 122.84 2k2m s GLU 496 Ca 0.00 -0.95 0.02 0.00 0.02 0.00 0.00 54.97 54.05 2k2m s GLU 496 Cb 0.00 -2.10 0.01 0.00 0.10 0.00 0.00 34.13 32.14 2k2m s GLU 496 CO 0.00 0.55 -0.06 -1.17 0.02 0.00 0.00 175.26 174.60 2k2m s LEU 497 N -0.96 1.66 0.64 1.80 2.96 -1.25 -2.75 118.68 120.78 2k2m s LEU 497 Ca 0.12 -0.14 -0.17 0.00 -0.22 0.00 0.00 54.13 53.71 2k2m s LEU 497 Cb -0.10 -0.43 -0.01 0.00 0.50 0.00 0.00 46.19 46.15 2k2m s LEU 497 CO 0.01 0.02 1.22 -0.94 -1.32 0.00 0.00 176.35 175.34 2k2m s SER 498 N 0.40 4.84 0.11 3.68 1.04 -1.26 -4.57 113.70 117.93 2k2m s SER 498 Ca -0.05 2.39 -0.05 0.00 0.48 0.00 0.00 55.95 58.72 2k2m s SER 498 Cb -0.09 -2.60 -0.02 0.00 0.10 0.00 0.00 66.02 63.41 2k2m s SER 498 CO 0.00 -1.83 0.12 0.68 0.98 0.00 0.00 173.24 173.19 2k2m s VAL 499 N -1.71 0.13 0.14 5.02 -7.23 0.04 -4.96 120.40 111.83 2k2m s VAL 499 Ca 0.77 -1.57 0.05 0.00 -1.81 0.00 0.00 61.98 59.42 2k2m s VAL 499 Cb -0.31 -1.68 -0.04 0.00 0.56 0.00 0.00 36.38 34.91 2k2m s VAL 499 CO 0.38 -0.61 -0.11 -0.54 -0.31 0.00 0.00 175.10 173.91 2k2m s LYS 500 N -3.95 1.03 0.11 4.82 -0.14 -1.26 -1.74 119.74 118.62 2k2m s LYS 500 Ca 0.13 -1.37 0.09 0.00 -1.36 0.00 0.00 55.97 53.46 2k2m s LYS 500 Cb 0.06 -0.67 0.46 0.00 -1.68 0.00 0.00 37.83 35.99 2k2m s LYS 500 CO -0.05 0.10 1.27 0.94 -0.76 0.00 0.00 175.35 176.85 2k2m n GLN 501 N 0.05 0.05 -0.39 1.68 7.27 -1.26 -1.90 117.38 122.88 2k2m n GLN 501 Ca -0.12 0.52 0.07 0.00 0.07 0.00 0.00 57.00 57.55 2k2m n GLN 501 Cb 0.59 -1.66 0.13 0.00 2.41 0.00 0.00 30.24 31.72 2k2m n GLN 501 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 2k2m n ARG 502 N -1.77 1.11 -3.83 3.69 1.74 -1.26 -4.63 116.66 111.70 2k2m n ARG 502 Ca -0.00 -2.55 -0.36 0.00 -0.77 0.00 0.00 57.85 54.17 2k2m n ARG 502 Cb 0.03 -1.29 -0.13 0.00 -1.02 0.00 0.00 32.46 30.05 2k2m n ARG 502 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2k2m s ASP 503 N -2.68 5.09 0.06 0.55 2.15 -0.80 -5.07 116.67 115.98 2k2m s ASP 503 Ca 0.30 -1.40 -0.26 0.00 0.43 0.00 0.00 52.55 51.62 2k2m s ASP 503 Cb 0.28 -1.78 -0.06 0.00 -0.30 0.00 0.00 42.92 41.06 2k2m s ASP 503 CO -0.02 -0.34 0.79 0.54 -0.17 0.00 0.00 175.17 175.97 2k2m s VAL 504 N 1.27 4.69 0.03 1.11 0.11 -1.26 -3.77 120.40 122.58 2k2m s VAL 504 Ca -0.01 1.68 0.01 0.00 -2.93 0.00 0.00 61.98 60.73 2k2m s VAL 504 Cb -0.20 -4.14 -0.02 0.00 -1.53 0.00 0.00 36.38 30.48 2k2m s VAL 504 CO -0.01 0.37 -0.05 -0.76 -3.33 0.00 0.00 175.10 171.32 2k2m s LEU 505 N -0.10 2.26 -0.21 2.54 1.43 -0.90 -4.70 118.68 119.00 2k2m s LEU 505 Ca 0.39 -0.55 -0.06 0.00 -1.03 0.00 0.00 54.13 52.88 2k2m s LEU 505 Cb -0.21 0.02 -0.03 0.00 0.03 0.00 0.00 46.19 46.00 2k2m s LEU 505 CO 0.24 -0.29 0.03 -0.70 0.23 0.00 0.00 176.35 175.86 2k2m s GLU 506 N -1.66 3.69 0.17 1.70 2.56 -1.12 -0.53 118.70 123.50 2k2m s GLU 506 Ca -0.13 -0.48 -0.30 0.00 0.00 0.00 0.00 54.97 54.06 2k2m s GLU 506 Cb -0.09 -3.17 -0.08 0.00 2.00 0.00 0.00 34.13 32.79 2k2m s GLU 506 CO -0.01 0.01 1.31 0.08 -0.56 0.00 0.00 175.26 176.09 2k2m s VAL 507 N 1.04 3.33 -0.04 3.70 1.01 -1.26 -1.35 120.40 126.84 2k2m s VAL 507 Ca 0.03 1.05 0.02 0.00 0.00 0.00 0.00 61.98 63.07 2k2m s VAL 507 Cb -0.14 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 2k2m s VAL 507 CO 0.02 0.13 -0.01 0.18 0.00 0.00 0.00 175.10 175.42 2k2m n LEU 508 N 3.05 1.42 -3.71 3.92 4.77 -0.06 -4.87 117.00 121.51 2k2m n LEU 508 Ca 0.07 -0.01 -0.13 0.00 -0.03 0.00 0.00 56.01 55.91 2k2m n LEU 508 Cb 0.43 -0.03 -0.10 0.00 -2.33 0.00 0.00 43.42 41.40 2k2m n LEU 508 CO 0.58 0.32 0.13 -0.62 -1.33 0.00 0.00 177.39 176.47 2k2m s ASP 509 N -3.91 -0.49 -0.01 -1.43 -1.08 -1.16 -5.00 116.67 103.59 2k2m s ASP 509 Ca -0.04 0.93 0.02 0.00 -0.52 0.00 0.00 52.55 52.95 2k2m s ASP 509 Cb 0.01 0.93 0.03 0.00 -1.46 0.00 0.00 42.92 42.43 2k2m s ASP 509 CO 0.13 -0.16 0.80 -0.90 0.52 0.00 0.00 175.17 175.55 2k2m n ASP 510 N 3.00 0.61 0.16 -0.34 5.68 -1.26 -1.32 116.55 123.08 2k2m n ASP 510 Ca -0.14 -1.69 0.14 0.00 -0.50 0.00 0.00 54.79 52.60 2k2m n ASP 510 Cb 0.57 -0.10 0.70 0.00 -1.14 0.00 0.00 41.12 41.15 2k2m n ASP 510 CO 0.00 0.00 0.00 -1.28 -1.33 0.00 0.00 177.20 174.59 2k2m h SER 511 N 0.00 0.00 -4.10 -1.12 0.87 -1.97 -3.45 113.55 103.78 2k2m h SER 511 Ca 0.00 0.00 -0.45 0.00 -1.23 0.00 0.00 61.79 60.11 2k2m h SER 511 Cb 1.02 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 62.85 2k2m h SER 511 CO 0.00 0.00 -0.56 -0.13 -0.53 0.00 0.00 176.83 175.61 2k2m s ARG 512 N -4.95 1.67 0.27 2.24 0.52 -1.26 -5.07 118.95 112.37 2k2m s ARG 512 Ca -0.05 -1.97 0.00 0.00 -0.52 0.00 0.00 55.73 53.20 2k2m s ARG 512 Cb 0.18 -0.35 0.58 0.00 0.52 0.00 0.00 34.95 35.87 2k2m s ARG 512 CO 0.66 -0.41 1.75 -0.22 0.02 0.00 0.00 175.30 177.11 2k2m h LYS 513 N 2.11 0.57 -6.17 3.54 3.64 -1.96 -3.32 116.57 114.97 2k2m h LYS 513 Ca -0.35 -0.03 -0.58 0.00 -1.27 0.00 0.00 60.65 58.41 2k2m h LYS 513 Cb 1.25 -0.13 -0.09 0.00 -0.41 0.00 0.00 32.23 32.85 2k2m h LYS 513 CO 0.56 0.38 1.35 -1.58 -2.27 0.00 0.00 179.45 177.89 2k2m s TRP 514 N -5.95 2.46 0.39 1.91 0.52 -1.26 -1.07 118.94 115.94 2k2m s TRP 514 Ca -0.12 -0.59 -0.26 0.00 0.02 0.00 0.00 56.10 55.15 2k2m s TRP 514 Cb 0.22 -4.67 -0.09 0.00 -1.15 0.00 0.00 33.47 27.79 2k2m s TRP 514 CO 0.78 -1.98 1.22 -1.58 0.02 0.00 0.00 176.95 175.41 2k2m s TRP 515 N 5.19 3.01 -0.21 -1.98 0.52 -0.43 -4.76 118.94 120.29 2k2m s TRP 515 Ca 0.42 1.51 -0.11 0.00 0.02 0.00 0.00 56.10 57.94 2k2m s TRP 515 Cb -0.03 -3.50 -0.05 0.00 -1.15 0.00 0.00 33.47 28.75 2k2m s TRP 515 CO -0.02 -1.57 0.17 0.21 0.02 0.00 0.00 176.95 175.76 2k2m s LYS 516 N -2.19 4.15 0.07 4.98 2.20 -0.44 -2.24 119.74 126.27 2k2m s LYS 516 Ca 0.56 -0.20 0.03 0.00 -0.36 0.00 0.00 55.97 56.00 2k2m s LYS 516 Cb -0.34 -3.47 -0.03 0.00 -1.51 0.00 0.00 37.83 32.48 2k2m s LYS 516 CO 0.43 0.19 -0.10 0.14 -0.36 0.00 0.00 175.35 175.65 2k2m s VAL 517 N 0.68 0.83 -0.29 4.02 -7.23 -1.07 -0.88 120.40 116.45 2k2m s VAL 517 Ca 0.09 -1.41 -0.09 0.00 -1.81 0.00 0.00 61.98 58.76 2k2m s VAL 517 Cb -0.12 -1.08 -0.01 0.00 0.56 0.00 0.00 36.38 35.72 2k2m s VAL 517 CO 0.01 -0.46 0.12 -0.60 -0.31 0.00 0.00 175.10 173.87 2k2m s ARG 518 N -2.26 3.42 0.72 4.82 3.52 -0.46 -2.96 118.95 125.75 2k2m s ARG 518 Ca -0.01 -0.65 -0.11 0.00 -0.13 0.00 0.00 55.73 54.84 2k2m s ARG 518 Cb -0.06 -3.48 0.02 0.00 -1.56 0.00 0.00 34.95 29.87 2k2m s ARG 518 CO 0.00 -0.35 1.07 0.16 -0.81 0.00 0.00 175.30 175.38 2k2m s ASP 519 N 1.61 5.10 0.10 -2.12 1.47 -1.22 -2.79 116.67 118.82 2k2m s ASP 519 Ca 0.05 1.64 0.19 0.00 1.18 0.00 0.00 52.55 55.61 2k2m s ASP 519 Cb -0.16 -2.47 0.79 0.00 -0.34 0.00 0.00 42.92 40.74 2k2m s ASP 519 CO 0.05 -1.62 1.59 -0.81 0.68 0.00 0.00 175.17 175.06 2k2m n PRO 520 N -3.25 0.08 0.22 2.11 -0.04 -1.26 -2.28 135.00 130.59 2k2m n PRO 520 Ca 0.08 0.30 0.14 0.00 -0.04 0.00 0.00 63.50 63.98 2k2m n PRO 520 Cb 0.54 -1.65 0.42 0.00 -0.04 0.00 0.00 33.50 32.77 2k2m n PRO 520 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k2m h ALA 521 N 2.43 1.00 0.00 0.55 0.00 -2.00 -3.47 119.26 117.77 2k2m h ALA 521 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2k2m h ALA 521 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2k2m h ALA 521 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2k2m n GLY 522 N 0.61 1.08 1.42 0.00 0.00 -0.96 -5.12 105.19 102.21 2k2m n GLY 522 Ca 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.97 2k2m n GLY 522 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k2m n GLN 523 N -1.73 0.48 -3.96 1.61 6.02 -1.26 -4.98 117.38 113.56 2k2m n GLN 523 Ca 0.00 -1.03 -0.09 0.00 -0.01 0.00 0.00 57.00 55.87 2k2m n GLN 523 Cb 0.00 -0.20 -0.10 0.00 1.02 0.00 0.00 30.24 30.96 2k2m n GLN 523 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2k2m s GLU 524 N -3.27 0.51 0.10 -1.09 2.02 -1.26 -3.40 118.70 112.31 2k2m s GLU 524 Ca 0.24 -0.75 -0.26 0.00 0.02 0.00 0.00 54.97 54.22 2k2m s GLU 524 Cb -0.01 0.19 0.08 0.00 0.10 0.00 0.00 34.13 34.49 2k2m s GLU 524 CO 0.16 -0.11 1.00 0.20 0.02 0.00 0.00 175.26 176.52 2k2m s GLY 525 N -1.99 -0.29 -0.12 -1.39 0.00 -1.16 -4.82 107.32 97.56 2k2m s GLY 525 Ca -0.07 0.35 -0.07 0.00 0.00 0.00 0.00 44.72 44.93 2k2m s GLY 525 CO -0.04 0.07 0.14 -0.19 0.00 0.00 0.00 173.10 173.09 2k2m s TYR 526 N -3.13 3.60 0.01 1.90 2.02 -0.44 -2.59 117.35 118.72 2k2m s TYR 526 Ca 0.11 0.54 -0.14 0.00 -0.37 0.00 0.00 57.07 57.22 2k2m s TYR 526 Cb -0.00 -1.95 0.02 0.00 -0.40 0.00 0.00 41.96 39.63 2k2m s TYR 526 CO -0.00 0.74 0.29 0.14 -1.57 0.00 0.00 175.55 175.14 2k2m s VAL 527 N -1.03 0.07 0.30 0.71 -7.23 -0.95 -3.96 120.40 108.30 2k2m s VAL 527 Ca 0.15 -0.60 -0.29 0.00 -1.81 0.00 0.00 61.98 59.43 2k2m s VAL 527 Cb -0.12 -0.75 -0.10 0.00 0.56 0.00 0.00 36.38 35.97 2k2m s VAL 527 CO 0.04 -0.33 1.30 -2.16 -0.31 0.00 0.00 175.10 173.64 2k2m s PRO 528 N -1.87 4.38 0.63 4.82 0.04 -1.26 -1.32 135.00 140.43 2k2m s PRO 528 Ca -0.10 2.15 0.41 0.00 0.04 0.00 0.00 61.00 63.50 2k2m s PRO 528 Cb -0.03 -3.11 2.13 0.00 0.04 0.00 0.00 34.50 33.53 2k2m s PRO 528 CO 0.01 -0.18 2.27 0.10 0.04 0.00 0.00 177.00 179.24 2k2m h TYR 529 N 3.92 0.00 0.00 0.56 -0.00 -1.45 -3.12 116.97 116.89 2k2m h TYR 529 Ca -0.48 0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 58.24 2k2m h TYR 529 Cb 1.22 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.95 2k2m h TYR 529 CO 0.58 0.01 -0.07 -0.97 -0.00 0.00 0.00 178.16 177.70 2k2m h ASN 530 N 0.00 0.00 0.00 0.10 -0.73 -1.92 -2.33 115.58 110.70 2k2m h ASN 530 Ca -0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2k2m h ASN 530 Cb 0.13 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.72 2k2m h ASN 530 CO 0.00 0.07 -1.20 2.30 -0.37 0.00 0.00 177.43 178.24 2k2m n ILE 531 N -3.48 0.00 -3.01 2.57 -5.35 -1.18 -4.96 119.36 103.94 2k2m n ILE 531 Ca -0.02 -0.12 -0.29 0.00 -0.27 0.00 0.00 62.75 62.05 2k2m n ILE 531 Cb 0.20 0.77 -0.03 0.00 -1.74 0.00 0.00 39.64 38.85 2k2m n ILE 531 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2k2m s LEU 532 N -3.31 3.89 0.00 7.28 1.43 -0.88 -1.76 118.68 125.34 2k2m s LEU 532 Ca 0.04 0.95 -0.18 0.00 -1.03 0.00 0.00 54.13 53.91 2k2m s LEU 532 Cb 0.15 -3.81 0.03 0.00 0.03 0.00 0.00 46.19 42.59 2k2m s LEU 532 CO 0.85 -0.34 0.40 0.42 0.23 0.00 0.00 176.35 177.90 2k2m s THR 533 N -2.31 0.05 0.88 5.49 -4.23 -1.20 -4.90 115.64 109.43 2k2m s THR 533 Ca 0.48 -0.41 -0.10 0.00 -1.18 0.00 0.00 61.69 60.47 2k2m s THR 533 Cb -0.10 -0.81 0.13 0.00 1.34 0.00 0.00 72.50 73.05 2k2m s THR 533 CO 0.32 -0.23 1.13 -2.16 -0.54 0.00 0.00 174.62 173.15 2k2m s PRO 534 N -1.77 1.29 -0.63 3.99 0.04 -1.26 -0.65 135.00 136.01 2k2m s PRO 534 Ca -0.10 1.44 0.06 0.00 0.04 0.00 0.00 61.00 62.44 2k2m s PRO 534 Cb -0.03 -1.77 0.25 0.00 0.04 0.00 0.00 34.50 32.99 2k2m s PRO 534 CO 0.02 -2.40 0.73 0.98 0.04 0.00 0.00 177.00 176.37 2k2m n TYR 535 N -4.07 3.49 -2.05 0.56 9.36 -0.95 -4.30 117.16 119.20 2k2m n TYR 535 Ca 0.11 -4.14 -0.43 0.00 3.32 0.00 0.00 57.90 56.76 2k2m n TYR 535 Cb 0.52 -0.55 -0.03 0.00 -0.63 0.00 0.00 39.34 38.65 2k2m n TYR 535 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 2k2m s PRO 536 N -2.38 3.82 0.01 2.98 0.04 -1.26 -4.86 135.00 133.34 2k2m s PRO 536 Ca 0.39 1.80 -0.16 0.00 0.04 0.00 0.00 61.00 63.07 2k2m s PRO 536 Cb 0.14 -4.06 0.03 0.00 0.04 0.00 0.00 34.50 30.65 2k2m s PRO 536 CO -0.02 -1.27 0.35 0.00 0.04 0.00 0.00 177.00 176.09 2k2m s ALA 537 N 5.21 -0.85 -1.21 8.56 0.00 -1.26 -4.93 121.76 127.28 2k2m s ALA 537 Ca 0.74 0.31 -0.09 0.00 0.00 0.00 0.00 51.96 52.92 2k2m s ALA 537 Cb -0.27 0.17 0.08 0.00 0.00 0.00 0.00 23.12 23.09 2k2m s ALA 537 CO 0.30 -0.33 0.43 0.00 0.00 0.00 0.00 175.76 176.16 2k2m n ALA 538 N 0.97 -1.06 -3.45 0.00 0.00 -1.26 -4.97 120.51 110.74 2k2m n ALA 538 Ca -0.20 0.04 -0.14 0.00 0.00 0.00 0.00 53.44 53.14 2k2m n ALA 538 Cb 0.57 -2.46 -0.15 0.00 0.00 0.00 0.00 19.45 17.41 2k2m n ALA 538 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k2m s ALA 539 N -2.85 0.02 0.00 0.00 0.00 -1.26 -5.34 121.76 112.32 2k2m s ALA 539 Ca 0.39 0.24 0.00 0.00 0.00 0.00 0.00 51.96 52.58 2k2m s ALA 539 Cb -0.21 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.73 2k2m s ALA 539 CO 0.48 -0.08 0.00 0.43 0.00 0.00 0.00 175.76 176.59