#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 4.33 -0.07 1.61 0.04 -1.26 -5.03 135.00 134.62 2k2m s PRO 474 Ca 0.00 2.16 -0.24 0.00 0.04 0.00 0.00 61.00 62.96 2k2m s PRO 474 Cb 0.00 -3.17 0.05 0.00 0.04 0.00 0.00 34.50 31.42 2k2m s PRO 474 CO 0.00 -0.35 0.54 -1.17 0.04 0.00 0.00 177.00 176.06 2k2m s LEU 475 N 0.02 -0.07 -0.14 -3.56 2.96 -1.26 -5.19 118.68 111.44 2k2m s LEU 475 Ca 0.59 0.59 -0.33 0.00 -0.22 0.00 0.00 54.13 54.76 2k2m s LEU 475 Cb -0.39 2.01 0.13 0.00 0.50 0.00 0.00 46.19 48.44 2k2m s LEU 475 CO 0.38 -0.48 1.13 -0.83 -1.32 0.00 0.00 176.35 175.23 2k2m s GLY 476 N -0.95 -0.34 0.00 7.98 0.00 -1.26 -5.08 107.32 107.68 2k2m s GLY 476 Ca -0.10 1.44 0.00 0.00 0.00 0.00 0.00 44.72 46.06 2k2m s GLY 476 CO 0.06 0.48 0.00 1.44 0.00 0.00 0.00 173.10 175.08 2k2m n SER 477 N -0.13 1.34 -0.58 1.64 7.64 -1.26 -5.16 113.62 117.11 2k2m n SER 477 Ca -0.02 -0.11 0.07 0.00 1.01 0.00 0.00 58.87 59.82 2k2m n SER 477 Cb 0.59 0.49 -0.03 0.00 -1.01 0.00 0.00 64.21 64.25 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 0.90 -2.44 2.77 0.23 0.00 -1.26 -4.93 105.19 100.45 2k2m n GLY 478 Ca 0.00 -1.32 -0.02 0.00 0.00 0.00 0.00 46.02 44.67 2k2m n GLY 478 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k2m n ALA 479 N -2.87 2.70 -2.74 4.61 0.00 -1.26 -5.11 120.51 115.84 2k2m n ALA 479 Ca -0.02 -2.31 -0.34 0.00 0.00 0.00 0.00 53.44 50.77 2k2m n ALA 479 Cb 0.27 -0.88 -0.08 0.00 0.00 0.00 0.00 19.45 18.76 2k2m n ALA 479 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k2m s LEU 480 N -3.74 3.75 -0.07 0.00 1.43 -1.26 -5.12 118.68 113.66 2k2m s LEU 480 Ca 0.23 0.13 0.01 0.00 -1.03 0.00 0.00 54.13 53.46 2k2m s LEU 480 Cb 0.38 -2.07 0.02 0.00 0.03 0.00 0.00 46.19 44.55 2k2m s LEU 480 CO -0.05 0.31 -0.07 -0.75 0.23 0.00 0.00 176.35 176.02 2k2m s LYS 481 N -1.41 1.27 0.11 1.70 2.47 -1.26 -5.14 119.74 117.48 2k2m s LYS 481 Ca 0.19 -0.22 0.08 0.00 -1.56 0.00 0.00 55.97 54.45 2k2m s LYS 481 Cb -0.12 -1.23 -0.04 0.00 -1.46 0.00 0.00 37.83 34.99 2k2m s LYS 481 CO 0.09 -0.12 -0.19 -1.58 0.16 0.00 0.00 175.35 173.71 2k2m s TRP 482 N 1.16 1.68 -0.22 4.03 0.52 -1.26 -2.63 118.94 122.21 2k2m s TRP 482 Ca -0.06 -0.44 -0.02 0.00 0.02 0.00 0.00 56.10 55.59 2k2m s TRP 482 Cb -0.14 -0.91 0.07 0.00 -1.15 0.00 0.00 33.47 31.34 2k2m s TRP 482 CO -0.01 0.20 0.05 0.14 0.02 0.00 0.00 176.95 177.34 2k2m s VAL 483 N -1.37 0.61 0.19 4.03 -7.23 -0.28 -4.13 120.40 112.21 2k2m s VAL 483 Ca 0.07 -0.76 -0.31 0.00 -1.81 0.00 0.00 61.98 59.17 2k2m s VAL 483 Cb -0.09 -1.18 -0.10 0.00 0.56 0.00 0.00 36.38 35.57 2k2m s VAL 483 CO 0.04 -0.32 1.52 -0.22 -0.31 0.00 0.00 175.10 175.81 2k2m s LEU 484 N 1.80 4.37 0.69 1.32 2.96 -0.71 -3.47 118.68 125.65 2k2m s LEU 484 Ca 0.01 2.61 -0.15 0.00 -0.22 0.00 0.00 54.13 56.38 2k2m s LEU 484 Cb -0.17 -3.60 0.02 0.00 0.50 0.00 0.00 46.19 42.93 2k2m s LEU 484 CO -0.13 -0.78 1.16 0.00 -1.32 0.00 0.00 176.35 175.29 2k2m n ASN 486 N -2.49 2.31 -3.78 0.00 5.15 0.13 -4.58 115.26 112.01 2k2m n ASN 486 Ca 0.12 -0.26 -0.12 0.00 -0.60 0.00 0.00 54.58 53.72 2k2m n ASN 486 Cb 0.51 1.14 -0.08 0.00 -0.53 0.00 0.00 39.78 40.82 2k2m n ASN 486 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 2k2m s TYR 487 N -2.00 -0.11 0.47 1.20 2.02 -1.25 -4.79 117.35 112.89 2k2m s TYR 487 Ca -0.00 0.07 -0.23 0.00 -0.37 0.00 0.00 57.07 56.54 2k2m s TYR 487 Cb 0.04 0.07 -0.07 0.00 -0.40 0.00 0.00 41.96 41.60 2k2m s TYR 487 CO 0.22 -0.43 1.22 0.34 -1.57 0.00 0.00 175.55 175.33 2k2m s ASP 488 N -1.67 5.97 -0.24 2.29 -1.08 -1.26 -3.94 116.67 116.74 2k2m s ASP 488 Ca -0.10 2.44 -0.03 0.00 -0.52 0.00 0.00 52.55 54.35 2k2m s ASP 488 Cb -0.03 -2.61 0.12 0.00 -1.46 0.00 0.00 42.92 38.94 2k2m s ASP 488 CO 0.01 -1.06 0.34 0.12 0.52 0.00 0.00 175.17 175.09 2k2m s PHE 489 N -1.46 -0.69 -0.18 -5.34 5.36 -0.60 -4.97 117.98 110.10 2k2m s PHE 489 Ca 0.65 0.64 -0.27 0.00 -0.96 0.00 0.00 56.93 56.99 2k2m s PHE 489 Cb -0.32 -0.09 -0.01 0.00 -0.34 0.00 0.00 43.02 42.26 2k2m s PHE 489 CO 0.39 -0.71 0.93 -1.14 -1.46 0.00 0.00 175.22 173.24 2k2m s GLN 490 N 2.49 4.30 -0.14 10.12 0.74 -1.26 -1.55 119.66 134.36 2k2m s GLN 490 Ca 0.11 1.20 -0.05 0.00 0.05 0.00 0.00 55.36 56.67 2k2m s GLN 490 Cb -0.15 -3.60 0.07 0.00 1.10 0.00 0.00 33.01 30.43 2k2m s GLN 490 CO -0.16 -0.44 0.26 0.00 -0.55 0.00 0.00 175.29 174.40 2k2m s ALA 491 N 2.52 -0.53 0.00 1.58 0.00 -1.26 -4.90 121.76 119.17 2k2m s ALA 491 Ca 0.42 0.85 0.00 0.00 0.00 0.00 0.00 51.96 53.23 2k2m s ALA 491 Cb -0.16 -1.07 0.00 0.00 0.00 0.00 0.00 23.12 21.89 2k2m s ALA 491 CO 0.11 -0.72 0.73 0.54 0.00 0.00 0.00 175.76 176.42 2k2m n ARG 492 N 5.35 0.00 -0.00 0.00 5.12 -1.26 -1.47 116.66 124.39 2k2m n ARG 492 Ca -0.06 -0.57 -0.10 0.00 -1.93 0.00 0.00 57.85 55.20 2k2m n ARG 492 Cb 0.50 -0.31 -0.04 0.00 -1.16 0.00 0.00 32.46 31.45 2k2m n ARG 492 CO 0.00 0.00 0.00 -0.91 -1.93 0.00 0.00 177.63 174.79 2k2m h ASN 493 N 0.00 -0.17 0.00 0.55 4.21 -1.96 -3.46 115.58 114.76 2k2m h ASN 493 Ca 0.00 0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.55 2k2m h ASN 493 Cb 1.21 0.10 0.00 0.00 -1.12 0.00 0.00 38.32 38.51 2k2m h ASN 493 CO 0.00 -0.07 0.00 -0.24 -1.29 0.00 0.00 177.43 175.83 2k2m n SER 494 N -5.18 0.00 -0.51 5.81 2.88 -1.26 -4.97 113.62 110.38 2k2m n SER 494 Ca -0.04 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.55 2k2m n SER 494 Cb 0.11 0.22 0.08 0.00 -0.75 0.00 0.00 64.21 63.86 2k2m n SER 494 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2k2m n SER 495 N -2.07 1.15 -4.83 -3.46 7.64 -1.26 -5.06 113.62 105.73 2k2m n SER 495 Ca 0.00 -2.60 -0.22 0.00 1.01 0.00 0.00 58.87 57.06 2k2m n SER 495 Cb 0.00 -0.33 -0.04 0.00 -1.01 0.00 0.00 64.21 62.83 2k2m n SER 495 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2k2m s GLU 496 N -1.37 2.77 -0.07 1.43 2.02 -1.26 -2.95 118.70 119.27 2k2m s GLU 496 Ca 0.20 -1.21 -0.05 0.00 0.02 0.00 0.00 54.97 53.93 2k2m s GLU 496 Cb 0.20 -2.48 0.03 0.00 0.10 0.00 0.00 34.13 31.97 2k2m s GLU 496 CO -0.02 0.23 0.18 -1.17 0.02 0.00 0.00 175.26 174.50 2k2m s LEU 497 N -3.91 0.97 0.65 1.80 2.96 -1.16 -4.30 118.68 115.69 2k2m s LEU 497 Ca 0.37 0.38 -0.18 0.00 -0.22 0.00 0.00 54.13 54.48 2k2m s LEU 497 Cb -0.06 0.57 -0.01 0.00 0.50 0.00 0.00 46.19 47.18 2k2m s LEU 497 CO 0.25 -0.11 1.25 -0.94 -1.32 0.00 0.00 176.35 175.49 2k2m s SER 498 N 0.63 4.70 0.06 3.68 1.04 -0.54 -4.48 113.70 118.78 2k2m s SER 498 Ca -0.04 2.49 -0.05 0.00 0.48 0.00 0.00 55.95 58.83 2k2m s SER 498 Cb -0.06 -2.61 -0.02 0.00 0.10 0.00 0.00 66.02 63.44 2k2m s SER 498 CO -0.03 -1.93 0.09 0.68 0.98 0.00 0.00 173.24 173.03 2k2m s VAL 499 N -1.58 0.16 0.27 5.02 -7.23 -0.60 -4.92 120.40 111.52 2k2m s VAL 499 Ca 0.79 -1.33 0.09 0.00 -1.81 0.00 0.00 61.98 59.73 2k2m s VAL 499 Cb -0.33 -1.23 -0.05 0.00 0.56 0.00 0.00 36.38 35.32 2k2m s VAL 499 CO 0.39 -0.73 -0.14 -0.54 -0.31 0.00 0.00 175.10 173.76 2k2m s LYS 500 N -3.42 1.59 0.46 4.82 -0.14 -1.26 -1.56 119.74 120.23 2k2m s LYS 500 Ca 0.02 -1.76 0.31 0.00 -1.36 0.00 0.00 55.97 53.18 2k2m s LYS 500 Cb 0.04 -1.48 1.67 0.00 -1.68 0.00 0.00 37.83 36.38 2k2m s LYS 500 CO -0.08 0.20 1.95 0.37 -0.76 0.00 0.00 175.35 177.03 2k2m h GLN 501 N 2.30 0.00 -0.11 1.68 4.15 -1.86 -1.77 115.11 119.49 2k2m h GLN 501 Ca -0.40 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.02 2k2m h GLN 501 Cb 1.24 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.93 2k2m h GLN 501 CO 0.64 0.00 0.00 0.54 -1.93 0.00 0.00 178.83 178.08 2k2m n ARG 502 N -2.60 2.88 -2.74 1.69 3.00 -1.26 -4.38 116.66 113.25 2k2m n ARG 502 Ca -0.02 -1.76 -0.40 0.00 -0.01 0.00 0.00 57.85 55.67 2k2m n ARG 502 Cb 0.06 -1.13 -0.06 0.00 0.00 0.00 0.00 32.46 31.33 2k2m n ARG 502 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2k2m s ASP 503 N -1.11 7.59 -0.19 0.55 2.15 -0.67 -4.97 116.67 120.02 2k2m s ASP 503 Ca 0.10 1.95 0.01 0.00 0.43 0.00 0.00 52.55 55.04 2k2m s ASP 503 Cb 0.06 -2.61 0.03 0.00 -0.30 0.00 0.00 42.92 40.10 2k2m s ASP 503 CO 0.05 0.12 -0.18 -0.69 -0.17 0.00 0.00 175.17 174.30 2k2m s VAL 504 N -1.24 2.04 0.11 1.11 1.01 -1.26 -2.47 120.40 119.70 2k2m s VAL 504 Ca 0.42 -1.04 0.03 0.00 0.00 0.00 0.00 61.98 61.40 2k2m s VAL 504 Cb -0.25 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 2k2m s VAL 504 CO 0.31 0.44 -0.09 -0.76 0.00 0.00 0.00 175.10 175.00 2k2m s LEU 505 N 1.27 2.46 0.55 3.92 1.02 -1.23 -4.69 118.68 122.00 2k2m s LEU 505 Ca 0.03 -0.91 -0.04 0.00 0.02 0.00 0.00 54.13 53.22 2k2m s LEU 505 Cb -0.14 -0.23 0.01 0.00 0.02 0.00 0.00 46.19 45.85 2k2m s LEU 505 CO -0.11 -0.35 0.84 -1.61 0.02 0.00 0.00 176.35 175.14 2k2m s GLU 506 N -3.32 2.93 -0.12 1.70 2.02 -1.15 -1.12 118.70 119.64 2k2m s GLU 506 Ca 0.10 -0.17 -0.02 0.00 0.02 0.00 0.00 54.97 54.90 2k2m s GLU 506 Cb 0.01 -2.35 -0.03 0.00 0.10 0.00 0.00 34.13 31.86 2k2m s GLU 506 CO -0.01 -0.60 -0.04 0.54 0.02 0.00 0.00 175.26 175.17 2k2m s VAL 507 N -2.87 3.92 0.00 2.63 0.11 -1.08 -3.02 120.40 120.09 2k2m s VAL 507 Ca 0.53 -0.37 0.00 0.00 -2.93 0.00 0.00 61.98 59.21 2k2m s VAL 507 Cb -0.10 -2.68 0.00 0.00 -1.53 0.00 0.00 36.38 32.07 2k2m s VAL 507 CO 0.43 0.54 0.00 0.18 -3.33 0.00 0.00 175.10 172.92 2k2m n LEU 508 N 2.95 0.00 -3.86 2.54 4.77 -0.16 -4.90 117.00 118.34 2k2m n LEU 508 Ca -0.18 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.68 2k2m n LEU 508 Cb 0.53 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.48 2k2m n LEU 508 CO 0.31 0.00 -0.32 -0.62 -1.33 0.00 0.00 177.39 175.42 2k2m s ASP 509 N -2.59 -0.04 0.00 -1.43 2.15 -1.16 -4.95 116.67 108.65 2k2m s ASP 509 Ca 0.00 0.07 0.00 0.00 0.43 0.00 0.00 52.55 53.05 2k2m s ASP 509 Cb 0.00 0.07 0.00 0.00 -0.30 0.00 0.00 42.92 42.69 2k2m s ASP 509 CO 0.00 -0.01 0.42 -0.90 -0.17 0.00 0.00 175.17 174.51 2k2m n ASP 510 N 3.06 0.21 0.23 -0.34 5.68 -1.26 -2.84 116.55 121.29 2k2m n ASP 510 Ca -0.12 -1.09 0.06 0.00 -0.50 0.00 0.00 54.79 53.14 2k2m n ASP 510 Cb 0.60 0.00 0.52 0.00 -1.14 0.00 0.00 41.12 41.10 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 -4.21 -1.12 0.87 -1.96 -3.45 113.55 103.68 2k2m h SER 511 Ca 0.00 0.00 -0.37 0.00 -1.23 0.00 0.00 61.79 60.19 2k2m h SER 511 Cb 0.80 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 62.62 2k2m h SER 511 CO 0.00 0.19 -0.63 -0.13 -0.53 0.00 0.00 176.83 175.73 2k2m s ARG 512 N -4.55 1.40 0.44 2.24 0.52 -1.26 -5.06 118.95 112.68 2k2m s ARG 512 Ca -0.04 -1.75 0.19 0.00 -0.52 0.00 0.00 55.73 53.61 2k2m s ARG 512 Cb 0.15 -0.41 1.13 0.00 0.52 0.00 0.00 34.95 36.34 2k2m s ARG 512 CO 0.68 -0.23 1.88 1.57 0.02 0.00 0.00 175.30 179.22 2k2m h LYS 513 N 2.39 0.34 -5.95 3.54 2.10 -1.96 -3.33 116.57 113.70 2k2m h LYS 513 Ca -0.38 -0.02 -0.61 0.00 -2.00 0.00 0.00 60.65 57.64 2k2m h LYS 513 Cb 1.24 -0.08 -0.11 0.00 -0.90 0.00 0.00 32.23 32.38 2k2m h LYS 513 CO 0.63 0.22 1.35 -1.58 -2.00 0.00 0.00 179.45 178.07 2k2m s TRP 514 N -5.36 2.60 -0.04 0.07 0.52 -1.26 -0.85 118.94 114.62 2k2m s TRP 514 Ca -0.08 -0.86 -0.30 0.00 0.02 0.00 0.00 56.10 54.89 2k2m s TRP 514 Cb 0.22 -4.62 -0.05 0.00 -1.15 0.00 0.00 33.47 27.87 2k2m s TRP 514 CO 0.78 -1.88 1.42 -1.58 0.02 0.00 0.00 176.95 175.71 2k2m s TRP 515 N 4.67 2.67 0.06 -1.98 0.52 -0.27 -4.75 118.94 119.88 2k2m s TRP 515 Ca 0.43 0.73 -0.30 0.00 0.02 0.00 0.00 56.10 56.97 2k2m s TRP 515 Cb -0.02 -3.68 -0.05 0.00 -1.15 0.00 0.00 33.47 28.57 2k2m s TRP 515 CO -0.08 -2.58 1.13 0.21 0.02 0.00 0.00 176.95 175.65 2k2m s LYS 516 N 2.94 4.49 0.21 4.98 2.20 -1.13 -2.36 119.74 131.06 2k2m s LYS 516 Ca 0.64 1.67 0.04 0.00 -0.36 0.00 0.00 55.97 57.96 2k2m s LYS 516 Cb -0.30 -3.37 -0.05 0.00 -1.51 0.00 0.00 37.83 32.61 2k2m s LYS 516 CO 0.25 -0.15 -0.05 0.14 -0.36 0.00 0.00 175.35 175.18 2k2m s VAL 517 N 0.86 1.17 -0.13 4.02 -7.23 -0.57 -0.99 120.40 117.53 2k2m s VAL 517 Ca 0.56 -2.06 -0.00 0.00 -1.81 0.00 0.00 61.98 58.66 2k2m s VAL 517 Cb -0.27 -2.18 0.03 0.00 0.56 0.00 0.00 36.38 34.51 2k2m s VAL 517 CO 0.30 -0.47 -0.07 -0.60 -0.31 0.00 0.00 175.10 173.95 2k2m s ARG 518 N -3.80 1.52 0.72 4.82 3.52 -1.17 -2.22 118.95 122.34 2k2m s ARG 518 Ca 0.25 -0.32 -0.11 0.00 -0.13 0.00 0.00 55.73 55.42 2k2m s ARG 518 Cb 0.04 -1.70 0.02 0.00 -1.56 0.00 0.00 34.95 31.76 2k2m s ARG 518 CO 0.06 -0.31 1.07 0.16 -0.81 0.00 0.00 175.30 175.48 2k2m s ASP 519 N 1.69 5.12 0.07 -2.12 -4.77 -1.24 -2.92 116.67 112.51 2k2m s ASP 519 Ca 0.04 1.60 0.16 0.00 -3.30 0.00 0.00 52.55 51.05 2k2m s ASP 519 Cb -0.13 -2.43 0.68 0.00 -1.09 0.00 0.00 42.92 39.94 2k2m s ASP 519 CO -0.08 -1.61 1.49 -0.81 0.70 0.00 0.00 175.17 174.87 2k2m n PRO 520 N -3.23 0.05 0.09 2.11 -0.04 -1.26 -2.31 135.00 130.41 2k2m n PRO 520 Ca 0.08 0.33 0.13 0.00 -0.04 0.00 0.00 63.50 63.99 2k2m n PRO 520 Cb 0.54 -1.61 0.35 0.00 -0.04 0.00 0.00 33.50 32.74 2k2m n PRO 520 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k2m n ALA 521 N -1.58 2.44 0.00 0.55 0.00 -1.26 -4.96 120.51 115.70 2k2m n ALA 521 Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2k2m n ALA 521 Cb 0.17 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.22 2k2m n ALA 521 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k2m n GLY 522 N 1.32 0.86 2.54 0.00 0.00 -0.98 -5.11 105.19 103.82 2k2m n GLY 522 Ca 0.05 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.77 -0.69 -4.01 1.61 1.13 -1.26 -4.97 117.38 107.42 2k2m n GLN 523 Ca 0.00 -1.43 -0.08 0.00 -1.94 0.00 0.00 57.00 53.55 2k2m n GLN 523 Cb 0.00 -0.83 -0.10 0.00 0.11 0.00 0.00 30.24 29.43 2k2m n GLN 523 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2k2m s GLU 524 N -4.79 0.56 0.09 -1.09 2.02 -1.26 -3.61 118.70 110.62 2k2m s GLU 524 Ca 0.49 -0.95 -0.26 0.00 0.02 0.00 0.00 54.97 54.27 2k2m s GLU 524 Cb -0.01 0.21 0.08 0.00 0.10 0.00 0.00 34.13 34.50 2k2m s GLU 524 CO 0.34 -0.12 0.80 0.20 0.02 0.00 0.00 175.26 176.50 2k2m s GLY 525 N -2.40 -0.44 0.01 -1.39 0.00 -0.94 -4.74 107.32 97.41 2k2m s GLY 525 Ca -0.01 0.61 -0.17 0.00 0.00 0.00 0.00 44.72 45.15 2k2m s GLY 525 CO -0.07 0.20 0.47 -0.19 0.00 0.00 0.00 173.10 173.51 2k2m s TYR 526 N -3.40 3.72 0.01 1.90 2.02 -1.15 -1.51 117.35 118.94 2k2m s TYR 526 Ca 0.05 1.07 -0.11 0.00 -0.37 0.00 0.00 57.07 57.71 2k2m s TYR 526 Cb -0.01 -2.39 0.01 0.00 -0.40 0.00 0.00 41.96 39.17 2k2m s TYR 526 CO -0.07 0.56 0.24 0.14 -1.57 0.00 0.00 175.55 174.85 2k2m s VAL 527 N -0.85 0.08 0.28 0.71 -7.23 -1.00 -4.03 120.40 108.36 2k2m s VAL 527 Ca 0.26 -0.64 -0.29 0.00 -1.81 0.00 0.00 61.98 59.49 2k2m s VAL 527 Cb -0.17 -0.65 -0.10 0.00 0.56 0.00 0.00 36.38 36.02 2k2m s VAL 527 CO 0.15 -0.35 1.21 -2.16 -0.31 0.00 0.00 175.10 173.64 2k2m s PRO 528 N -1.70 4.49 0.55 4.82 0.04 -1.26 -1.11 135.00 140.82 2k2m s PRO 528 Ca -0.12 2.00 0.36 0.00 0.04 0.00 0.00 61.00 63.28 2k2m s PRO 528 Cb -0.05 -3.15 1.86 0.00 0.04 0.00 0.00 34.50 33.20 2k2m s PRO 528 CO 0.01 -0.03 2.11 0.10 0.04 0.00 0.00 177.00 179.23 2k2m h TYR 529 N 4.02 0.00 -0.60 0.56 -0.00 -1.35 -3.15 116.97 116.45 2k2m h TYR 529 Ca -0.47 0.00 -0.06 0.00 -0.00 0.00 0.00 58.73 58.20 2k2m h TYR 529 Cb 1.22 0.00 -0.03 0.00 -0.00 0.00 0.00 36.73 37.92 2k2m h TYR 529 CO 0.58 0.00 0.12 -0.97 -0.00 0.00 0.00 178.16 177.90 2k2m h ASN 530 N 0.00 0.89 1.46 0.10 -0.73 -1.92 -2.72 115.58 112.66 2k2m h ASN 530 Ca 0.00 -0.18 0.00 0.00 1.87 0.00 0.00 56.30 57.99 2k2m h ASN 530 Cb 0.14 -0.23 0.00 0.00 0.27 0.00 0.00 38.32 38.49 2k2m h ASN 530 CO 0.00 0.88 -0.25 0.16 -0.37 0.00 0.00 177.43 177.85 2k2m h ILE 531 N 0.90 0.00 -4.11 2.57 3.07 -1.94 -3.46 117.51 114.53 2k2m h ILE 531 Ca 0.19 -0.71 -0.49 0.00 1.55 0.00 0.00 64.86 65.40 2k2m h ILE 531 Cb 0.36 1.56 0.03 0.00 -0.27 0.00 0.00 36.82 38.50 2k2m h ILE 531 CO 0.00 0.00 0.33 -0.76 -1.05 0.00 0.00 178.15 176.67 2k2m s LEU 532 N -5.10 3.54 0.10 0.16 1.43 -1.03 -0.69 118.68 117.09 2k2m s LEU 532 Ca 0.07 1.40 -0.08 0.00 -1.03 0.00 0.00 54.13 54.49 2k2m s LEU 532 Cb 0.10 -4.37 -0.01 0.00 0.03 0.00 0.00 46.19 41.95 2k2m s LEU 532 CO 0.67 -0.64 0.19 0.42 0.23 0.00 0.00 176.35 177.22 2k2m s THR 533 N -2.76 0.13 0.94 5.49 -4.23 0.07 -4.82 115.64 110.46 2k2m s THR 533 Ca 0.55 -1.28 -0.11 0.00 -1.18 0.00 0.00 61.69 59.68 2k2m s THR 533 Cb -0.10 -1.47 0.16 0.00 1.34 0.00 0.00 72.50 72.42 2k2m s THR 533 CO 0.39 -0.59 1.10 -2.16 -0.54 0.00 0.00 174.62 172.82 2k2m s PRO 534 N -3.89 0.85 -0.72 3.99 0.04 -1.26 -1.73 135.00 132.28 2k2m s PRO 534 Ca 0.08 1.17 0.05 0.00 0.04 0.00 0.00 61.00 62.33 2k2m s PRO 534 Cb 0.05 -1.74 0.19 0.00 0.04 0.00 0.00 34.50 33.04 2k2m s PRO 534 CO -0.08 -2.62 0.57 0.98 0.04 0.00 0.00 177.00 175.88 2k2m n TYR 535 N -4.19 3.41 -0.85 0.56 9.36 -1.26 -4.34 117.16 119.85 2k2m n TYR 535 Ca 0.08 -4.27 -0.14 0.00 3.32 0.00 0.00 57.90 56.89 2k2m n TYR 535 Cb 0.53 -0.67 -0.11 0.00 -0.63 0.00 0.00 39.34 38.47 2k2m n TYR 535 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2k2m n PRO 536 N 1.80 1.90 -1.75 2.98 -0.04 -1.26 -4.95 135.00 133.68 2k2m n PRO 536 Ca 0.22 -1.04 -0.41 0.00 -0.04 0.00 0.00 63.50 62.23 2k2m n PRO 536 Cb 0.36 -2.07 0.00 0.00 -0.04 0.00 0.00 33.50 31.76 2k2m n PRO 536 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k2m n ALA 537 N 2.90 1.98 -2.66 0.55 0.00 -1.26 -4.94 120.51 117.08 2k2m n ALA 537 Ca 0.41 0.33 -0.43 0.00 0.00 0.00 0.00 53.44 53.75 2k2m n ALA 537 Cb 0.60 -2.36 -0.01 0.00 0.00 0.00 0.00 19.45 17.68 2k2m n ALA 537 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k2m s ALA 538 N -1.13 3.22 0.21 0.00 0.00 -1.26 -5.01 121.76 117.79 2k2m s ALA 538 Ca 0.55 -2.76 -0.31 0.00 0.00 0.00 0.00 51.96 49.45 2k2m s ALA 538 Cb -0.50 -4.48 -0.11 0.00 0.00 0.00 0.00 23.12 18.03 2k2m s ALA 538 CO 0.62 -3.30 1.59 0.00 0.00 0.00 0.00 175.76 174.67 2k2m s ALA 539 N 3.97 3.79 0.00 0.00 0.00 -1.26 -5.36 121.76 122.89 2k2m s ALA 539 Ca 0.48 1.44 0.00 0.00 0.00 0.00 0.00 51.96 53.88 2k2m s ALA 539 Cb 0.01 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.50 2k2m s ALA 539 CO -0.00 -0.84 0.00 0.43 0.00 0.00 0.00 175.76 175.35