#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kcp s SER 442 N 0.00 -0.38 -0.07 6.43 1.04 -0.46 -0.48 113.70 119.77 3kcp s SER 442 Ca 0.00 -0.23 0.05 0.00 0.48 0.00 0.00 55.95 56.25 3kcp s SER 442 Cb 0.00 0.56 -0.00 0.00 0.10 0.00 0.00 66.02 66.67 3kcp s SER 442 CO 0.00 -0.97 -0.23 -0.51 0.98 0.00 0.00 173.24 172.51 3kcp s ILE 443 N -3.80 1.96 0.02 -1.02 2.07 0.47 -0.12 121.20 120.77 3kcp s ILE 443 Ca 0.04 -0.99 0.05 0.00 -1.41 0.00 0.00 60.65 58.33 3kcp s ILE 443 Cb -0.00 -1.68 -0.02 0.00 0.13 0.00 0.00 42.46 40.89 3kcp s ILE 443 CO -0.10 0.54 -0.14 -1.83 -1.91 0.00 0.00 174.94 171.51 3kcp s GLU 444 N 0.08 1.00 -0.17 3.50 -1.05 0.60 -0.28 118.70 122.38 3kcp s GLU 444 Ca -0.10 -0.64 -0.05 0.00 -0.15 0.00 0.00 54.97 54.03 3kcp s GLU 444 Cb -0.15 -1.00 -0.03 0.00 -0.44 0.00 0.00 34.13 32.51 3kcp s GLU 444 CO 0.06 0.26 -0.01 -1.17 0.95 0.00 0.00 175.26 175.35 3kcp s LEU 445 N -0.78 3.36 -0.01 1.83 2.96 -0.98 -0.09 118.68 124.97 3kcp s LEU 445 Ca 0.03 -0.11 -0.03 0.00 -0.22 0.00 0.00 54.13 53.81 3kcp s LEU 445 Cb -0.07 -1.83 0.00 0.00 0.50 0.00 0.00 46.19 44.79 3kcp s LEU 445 CO 0.00 0.14 0.06 -1.59 -1.32 0.00 0.00 176.35 173.65 3kcp s LYS 446 N 0.52 0.19 -0.05 1.98 -2.85 -0.58 -3.22 119.74 115.73 3kcp s LYS 446 Ca -0.01 -0.12 -0.04 0.00 -1.00 0.00 0.00 55.97 54.79 3kcp s LYS 446 Cb -0.14 0.08 -0.04 0.00 -2.06 0.00 0.00 37.83 35.67 3kcp s LYS 446 CO 0.02 -0.03 0.16 -0.06 0.10 0.00 0.00 175.35 175.54 3kcp s PHE 447 N -0.48 3.56 0.14 1.78 0.08 -1.26 -0.44 117.98 121.35 3kcp s PHE 447 Ca -0.05 0.42 -0.03 0.00 0.12 0.00 0.00 56.93 57.38 3kcp s PHE 447 Cb -0.04 -1.87 -0.08 0.00 -0.57 0.00 0.00 43.02 40.47 3kcp s PHE 447 CO 0.00 0.68 1.32 0.38 -0.10 0.00 0.00 175.22 177.50 3kcp h ASP 448 N 4.30 0.48 -4.09 1.36 2.03 -1.77 -3.44 116.42 115.29 3kcp h ASP 448 Ca -0.51 -0.39 -0.40 0.00 -0.73 0.00 0.00 57.03 55.00 3kcp h ASP 448 Cb 1.20 -0.15 -0.28 0.00 -0.83 0.00 0.00 39.33 39.27 3kcp h ASP 448 CO 0.64 1.19 -0.78 -0.13 -1.03 0.00 0.00 179.24 179.13 3kcp s ARG 449 N -3.26 0.76 0.00 4.15 0.52 -1.26 -5.03 118.95 114.83 3kcp s ARG 449 Ca -0.05 -0.38 0.12 0.00 -0.52 0.00 0.00 55.73 54.90 3kcp s ARG 449 Cb 0.09 -0.73 0.20 0.00 0.52 0.00 0.00 34.95 35.03 3kcp s ARG 449 CO 0.86 0.20 1.05 0.27 0.02 0.00 0.00 175.30 177.70 3kcp n ASN 450 N 2.72 2.45 -4.13 0.23 0.23 -1.26 -4.77 115.26 110.73 3kcp n ASN 450 Ca -0.14 -1.71 -0.16 0.00 -0.53 0.00 0.00 54.58 52.03 3kcp n ASN 450 Cb 0.57 -0.10 -0.12 0.00 -2.08 0.00 0.00 39.78 38.04 3kcp n ASN 450 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 3kcp s LYS 451 N -1.03 0.70 -0.07 -3.83 -0.14 -1.26 -4.14 119.74 109.98 3kcp s LYS 451 Ca 0.19 -0.89 -0.32 0.00 -1.36 0.00 0.00 55.97 53.60 3kcp s LYS 451 Cb 0.12 -0.60 0.14 0.00 -1.68 0.00 0.00 37.83 35.80 3kcp s LYS 451 CO 0.17 0.13 1.38 0.20 -0.76 0.00 0.00 175.35 176.46 3kcp s GLY 452 N -1.71 -0.46 0.28 -3.33 0.00 -1.26 -5.04 107.32 95.80 3kcp s GLY 452 Ca -0.05 0.84 0.00 0.00 0.00 0.00 0.00 44.72 45.51 3kcp s GLY 452 CO 0.01 0.35 0.47 -0.54 0.00 0.00 0.00 173.10 173.40 3kcp s GLU 453 N -2.17 3.50 0.00 2.90 0.41 -1.26 -4.88 118.70 117.21 3kcp s GLU 453 Ca 0.15 -0.38 -0.37 0.00 -0.41 0.00 0.00 54.97 53.96 3kcp s GLU 453 Cb 0.07 -2.75 -0.16 0.00 -1.78 0.00 0.00 34.13 29.51 3kcp s GLU 453 CO -0.06 0.27 1.48 0.28 -0.49 0.00 0.00 175.26 176.74 3kcp n VAL 454 N -1.34 0.09 0.00 2.63 0.31 -1.26 -0.92 118.33 117.84 3kcp n VAL 454 Ca -0.05 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 3kcp n VAL 454 Cb 0.55 -1.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.47 3kcp n VAL 454 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3kcp n GLY 455 N 3.06 1.80 3.80 2.92 0.00 -0.16 -4.97 105.19 111.65 3kcp n GLY 455 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 3kcp n GLY 455 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3kcp s ASP 456 N -1.50 4.95 -0.20 1.61 1.01 -0.10 -4.72 116.67 117.72 3kcp s ASP 456 Ca 0.00 1.63 0.01 0.00 0.71 0.00 0.00 52.55 54.90 3kcp s ASP 456 Cb 0.00 -2.43 0.03 0.00 1.01 0.00 0.00 42.92 41.53 3kcp s ASP 456 CO 0.00 -1.72 -0.17 -0.63 0.21 0.00 0.00 175.17 172.86 3kcp s ILE 457 N -3.02 2.16 -0.05 0.77 1.01 -1.26 -0.54 121.20 120.27 3kcp s ILE 457 Ca 0.59 -1.06 -0.20 0.00 0.00 0.00 0.00 60.65 59.99 3kcp s ILE 457 Cb -0.15 -1.98 -0.05 0.00 0.01 0.00 0.00 42.46 40.29 3kcp s ILE 457 CO 0.55 0.42 0.56 -0.76 0.00 0.00 0.00 174.94 175.71 3kcp s LEU 458 N 1.26 4.36 -0.41 2.97 1.43 -0.66 -4.86 118.68 122.77 3kcp s LEU 458 Ca 0.02 1.04 -0.16 0.00 -1.03 0.00 0.00 54.13 54.00 3kcp s LEU 458 Cb -0.14 -2.85 0.02 0.00 0.03 0.00 0.00 46.19 43.24 3kcp s LEU 458 CO -0.11 0.05 0.34 -0.63 0.23 0.00 0.00 176.35 176.23 3kcp s ILE 459 N 0.17 5.21 -0.27 -0.59 1.01 -1.26 -0.55 121.20 124.92 3kcp s ILE 459 Ca 0.30 -0.52 -0.19 0.00 0.00 0.00 0.00 60.65 60.24 3kcp s ILE 459 Cb -0.17 -3.94 -0.02 0.00 0.01 0.00 0.00 42.46 38.34 3kcp s ILE 459 CO 0.15 -0.32 0.56 -0.83 0.00 0.00 0.00 174.94 174.50 3kcp s GLY 460 N 1.72 1.82 -0.25 6.18 0.00 0.21 -1.94 107.32 115.07 3kcp s GLY 460 Ca 0.07 -0.59 -0.09 0.00 0.00 0.00 0.00 44.72 44.11 3kcp s GLY 460 CO 0.11 1.33 0.11 -1.59 0.00 0.00 0.00 173.10 173.06 3kcp s THR 461 N 2.41 4.76 -0.19 0.90 2.01 0.42 0.21 115.64 126.15 3kcp s THR 461 Ca 0.23 -0.02 -0.18 0.00 0.31 0.00 0.00 61.69 62.02 3kcp s THR 461 Cb -0.15 -3.22 -0.03 0.00 0.01 0.00 0.00 72.50 69.10 3kcp s THR 461 CO 0.10 0.33 0.50 -0.69 -0.69 0.00 0.00 174.62 174.17 3kcp s VAL 462 N 1.41 5.13 0.01 3.82 1.01 0.12 -1.52 120.40 130.38 3kcp s VAL 462 Ca 0.06 0.92 0.03 0.00 0.00 0.00 0.00 61.98 62.99 3kcp s VAL 462 Cb -0.15 -3.82 -0.01 0.00 0.00 0.00 0.00 36.38 32.40 3kcp s VAL 462 CO 0.05 0.20 -0.10 -0.60 0.00 0.00 0.00 175.10 174.66 3kcp s ARG 463 N 1.51 0.72 0.01 2.72 3.52 0.87 -0.60 118.95 127.70 3kcp s ARG 463 Ca 0.23 -0.47 0.03 0.00 -0.13 0.00 0.00 55.73 55.39 3kcp s ARG 463 Cb -0.15 -0.68 -0.03 0.00 -1.56 0.00 0.00 34.95 32.52 3kcp s ARG 463 CO 0.09 0.18 -0.06 0.96 -0.81 0.00 0.00 175.30 175.66 3kcp s ILE 464 N -0.52 3.69 -0.10 4.11 -4.36 -0.17 -0.29 121.20 123.56 3kcp s ILE 464 Ca 0.01 -0.77 0.00 0.00 -0.26 0.00 0.00 60.65 59.63 3kcp s ILE 464 Cb -0.05 -2.61 0.02 0.00 1.25 0.00 0.00 42.46 41.07 3kcp s ILE 464 CO 0.00 0.39 -0.09 0.20 0.24 0.00 0.00 174.94 175.68 3kcp s ASN 465 N -1.45 2.11 -1.29 4.36 0.01 0.83 -1.61 114.94 117.89 3kcp s ASN 465 Ca 0.17 -0.31 -0.03 0.00 -0.71 0.00 0.00 52.86 51.99 3kcp s ASN 465 Cb -0.11 -0.85 -0.00 0.00 0.41 0.00 0.00 41.25 40.69 3kcp s ASN 465 CO 0.08 -0.08 0.68 0.59 -1.51 0.00 0.00 177.10 176.85 3kcp n ASN 466 N 4.69 -1.74 -4.34 -1.22 3.02 -0.60 -1.35 115.26 113.72 3kcp n ASN 466 Ca -0.15 -0.86 -0.44 0.00 -0.03 0.00 0.00 54.58 53.10 3kcp n ASN 466 Cb 0.50 -3.89 -0.08 0.00 -0.61 0.00 0.00 39.78 35.71 3kcp n ASN 466 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3kcp s ILE 467 N -3.68 5.00 0.16 2.41 -1.09 0.07 -4.46 121.20 119.62 3kcp s ILE 467 Ca 0.07 -1.25 -0.32 0.00 -2.23 0.00 0.00 60.65 56.93 3kcp s ILE 467 Cb -0.02 -4.06 -0.12 0.00 -1.58 0.00 0.00 42.46 36.68 3kcp s ILE 467 CO 0.82 -0.63 1.73 1.17 -1.23 0.00 0.00 174.94 176.80 3kcp n LYS 468 N 5.15 2.62 -2.19 2.79 4.81 -1.26 -3.19 118.16 126.90 3kcp n LYS 468 Ca -0.12 0.95 -0.19 0.00 -0.87 0.00 0.00 58.31 58.08 3kcp n LYS 468 Cb 0.43 -2.79 -0.02 0.00 0.02 0.00 0.00 35.03 32.66 3kcp n LYS 468 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3kcp n ASN 469 N 4.41 -5.37 -4.73 3.14 3.02 -1.26 -4.79 115.26 109.68 3kcp n ASN 469 Ca 0.17 0.08 -0.42 0.00 -0.03 0.00 0.00 54.58 54.38 3kcp n ASN 469 Cb 0.34 -4.44 -0.02 0.00 -0.61 0.00 0.00 39.78 35.04 3kcp n ASN 469 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3kcp s PHE 470 N -2.88 2.83 0.00 3.10 5.36 -1.19 -0.25 117.98 124.95 3kcp s PHE 470 Ca 0.00 0.50 0.00 0.00 -0.96 0.00 0.00 56.93 56.47 3kcp s PHE 470 Cb 0.00 -4.13 0.00 0.00 -0.34 0.00 0.00 43.02 38.55 3kcp s PHE 470 CO 0.00 -4.09 0.01 0.00 -1.46 0.00 0.00 175.22 169.68 3kcp n ALA 471 N 3.29 0.17 -3.60 11.12 0.00 0.75 -4.45 120.51 127.79 3kcp n ALA 471 Ca 0.13 -0.01 0.01 0.00 0.00 0.00 0.00 53.44 53.57 3kcp n ALA 471 Cb 0.36 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.80 3kcp n ALA 471 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3kcp s GLY 472 N -0.06 -0.34 0.19 0.00 0.00 -1.07 -1.62 107.32 104.42 3kcp s GLY 472 Ca 0.00 1.49 -0.17 0.00 0.00 0.00 0.00 44.72 46.04 3kcp s GLY 472 CO 0.00 0.43 0.52 -0.11 0.00 0.00 0.00 173.10 173.94 3kcp s PHE 473 N -2.01 -0.12 -0.03 1.90 -0.12 0.05 -0.86 117.98 116.78 3kcp s PHE 473 Ca 0.13 -0.22 -0.03 0.00 -0.05 0.00 0.00 56.93 56.77 3kcp s PHE 473 Cb 0.03 0.39 0.01 0.00 -0.63 0.00 0.00 43.02 42.82 3kcp s PHE 473 CO -0.04 -0.91 0.09 -1.14 -0.05 0.00 0.00 175.22 173.17 3kcp s GLN 474 N -3.87 0.10 0.06 1.99 0.74 0.36 -1.54 119.66 117.49 3kcp s GLN 474 Ca 0.09 0.14 0.02 0.00 0.05 0.00 0.00 55.36 55.66 3kcp s GLN 474 Cb -0.01 0.02 -0.03 0.00 1.10 0.00 0.00 33.01 34.10 3kcp s GLN 474 CO -0.03 -0.03 -0.07 0.14 -0.55 0.00 0.00 175.29 174.75 3kcp s VAL 475 N 0.16 0.52 -0.11 1.34 -7.23 -0.48 -0.57 120.40 114.02 3kcp s VAL 475 Ca -0.01 -1.34 0.02 0.00 -1.81 0.00 0.00 61.98 58.85 3kcp s VAL 475 Cb -0.02 -0.92 0.01 0.00 0.56 0.00 0.00 36.38 36.02 3kcp s VAL 475 CO -0.00 -0.56 -0.18 0.21 -0.31 0.00 0.00 175.10 174.25 3kcp s ASN 476 N -2.04 2.66 -0.04 4.85 3.84 0.88 -2.21 114.94 122.87 3kcp s ASN 476 Ca -0.04 -0.48 0.03 0.00 0.21 0.00 0.00 52.86 52.58 3kcp s ASN 476 Cb -0.05 -1.21 0.00 0.00 -0.55 0.00 0.00 41.25 39.45 3kcp s ASN 476 CO -0.02 0.06 -0.14 -0.63 -2.79 0.00 0.00 177.10 173.58 3kcp s ILE 477 N 0.81 1.18 0.11 -5.21 1.01 0.14 -1.77 121.20 117.46 3kcp s ILE 477 Ca -0.09 -0.56 0.09 0.00 0.00 0.00 0.00 60.65 60.09 3kcp s ILE 477 Cb -0.16 -1.03 -0.04 0.00 0.01 0.00 0.00 42.46 41.25 3kcp s ILE 477 CO 0.01 0.35 -0.24 0.68 0.00 0.00 0.00 174.94 175.74 3kcp s VAL 478 N 0.22 1.98 0.27 2.92 -7.23 0.34 -0.10 120.40 118.79 3kcp s VAL 478 Ca -0.06 -1.62 -0.10 0.00 -1.81 0.00 0.00 61.98 58.39 3kcp s VAL 478 Cb -0.12 -1.77 -0.00 0.00 0.56 0.00 0.00 36.38 35.05 3kcp s VAL 478 CO 0.02 0.04 0.46 -0.72 -0.31 0.00 0.00 175.10 174.60 3kcp s TYR 479 N -1.08 0.53 -0.38 2.82 -0.85 -0.36 -1.66 117.35 116.37 3kcp s TYR 479 Ca 0.10 -0.88 -0.15 0.00 -0.52 0.00 0.00 57.07 55.62 3kcp s TYR 479 Cb -0.10 0.11 0.01 0.00 0.38 0.00 0.00 41.96 42.36 3kcp s TYR 479 CO 0.05 -1.02 0.35 0.34 -1.52 0.00 0.00 175.55 173.75 3kcp s ASP 480 N -3.07 6.14 0.00 -0.18 -1.08 -1.26 -4.35 116.67 112.87 3kcp s ASP 480 Ca 0.25 -0.58 0.20 0.00 -0.52 0.00 0.00 52.55 51.90 3kcp s ASP 480 Cb -0.00 -2.18 0.97 0.00 -1.46 0.00 0.00 42.92 40.24 3kcp s ASP 480 CO 0.11 -0.42 1.62 -0.81 0.52 0.00 0.00 175.17 176.19 3kcp n PRO 481 N 5.34 0.24 0.07 4.34 -0.04 -1.26 -1.13 135.00 142.55 3kcp n PRO 481 Ca -0.10 0.11 -0.00 0.00 -0.04 0.00 0.00 63.50 63.47 3kcp n PRO 481 Cb 0.48 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.39 3kcp n PRO 481 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3kcp h LYS 482 N 0.00 0.00 0.03 0.54 1.79 -1.93 -3.38 116.57 113.62 3kcp h LYS 482 Ca 0.00 0.00 -0.38 0.00 -2.18 0.00 0.00 60.65 58.09 3kcp h LYS 482 Cb 0.21 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.80 3kcp h LYS 482 CO 0.00 0.44 -2.36 0.28 -1.08 0.00 0.00 179.45 176.73 3kcp n VAL 483 N -3.05 1.56 -4.39 0.50 0.31 -0.68 -4.45 118.33 108.13 3kcp n VAL 483 Ca -0.05 -0.59 -0.20 0.00 -0.01 0.00 0.00 64.34 63.49 3kcp n VAL 483 Cb 0.82 -1.50 -0.14 0.00 -0.91 0.00 0.00 33.84 32.12 3kcp n VAL 483 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3kcp s LEU 484 N -6.66 2.13 -0.15 7.52 1.43 -0.29 0.16 118.68 122.83 3kcp s LEU 484 Ca -0.32 -0.39 0.02 0.00 -1.03 0.00 0.00 54.13 52.41 3kcp s LEU 484 Cb 0.08 -0.58 0.01 0.00 0.03 0.00 0.00 46.19 45.73 3kcp s LEU 484 CO 0.64 0.05 -0.21 -0.32 0.23 0.00 0.00 176.35 176.74 3kcp s MET 485 N -0.90 2.99 0.05 1.70 -2.45 -0.44 -4.13 119.30 116.11 3kcp s MET 485 Ca 0.02 -0.84 -0.31 0.00 -1.25 0.00 0.00 55.69 53.31 3kcp s MET 485 Cb -0.07 -2.47 -0.07 0.00 1.25 0.00 0.00 34.83 33.47 3kcp s MET 485 CO 0.01 -0.08 1.46 0.00 1.05 0.00 0.00 175.02 177.45 3kcp s ALA 486 N 0.98 3.61 0.09 4.11 0.00 -1.26 0.08 121.76 129.38 3kcp s ALA 486 Ca -0.03 1.03 -0.01 0.00 0.00 0.00 0.00 51.96 52.96 3kcp s ALA 486 Cb -0.15 -3.60 -0.04 0.00 0.00 0.00 0.00 23.12 19.33 3kcp s ALA 486 CO -0.06 -0.87 0.01 0.14 0.00 0.00 0.00 175.76 174.99 3kcp s VAL 487 N 2.05 0.21 0.17 0.00 -7.23 0.91 -1.06 120.40 115.46 3kcp s VAL 487 Ca 0.66 -1.87 -0.32 0.00 -1.81 0.00 0.00 61.98 58.64 3kcp s VAL 487 Cb -0.35 -1.80 -0.12 0.00 0.56 0.00 0.00 36.38 34.67 3kcp s VAL 487 CO 0.29 -0.72 1.75 -0.67 -0.31 0.00 0.00 175.10 175.44 3kcp n ASP 488 N -0.01 3.93 0.32 4.85 2.03 0.18 -1.27 116.55 126.59 3kcp n ASP 488 Ca -0.10 1.04 0.20 0.00 0.52 0.00 0.00 54.79 56.46 3kcp n ASP 488 Cb 0.62 -1.55 1.09 0.00 -0.72 0.00 0.00 41.12 40.56 3kcp n ASP 488 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3kcp h PRO 489 N 7.29 0.00 0.00 -0.67 0.13 -1.88 -0.22 132.00 136.64 3kcp h PRO 489 Ca -0.44 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.39 3kcp h PRO 489 Cb 1.21 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.29 3kcp h PRO 489 CO 0.95 0.01 -2.11 0.39 -0.23 0.00 0.00 178.00 177.01 3kcp n GLU 490 N -3.26 0.98 -0.01 0.86 1.02 -1.26 -4.70 120.64 114.27 3kcp n GLU 490 Ca -0.03 0.05 0.10 0.00 -0.02 0.00 0.00 57.16 57.26 3kcp n GLU 490 Cb 0.10 -1.40 -0.14 0.00 -0.02 0.00 0.00 31.44 29.98 3kcp n GLU 490 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3kcp n THR 491 N -2.83 0.00 -1.06 2.62 -2.24 -1.22 -4.99 114.28 104.55 3kcp n THR 491 Ca -0.30 -0.39 -0.02 0.00 -2.27 0.00 0.00 64.05 61.07 3kcp n THR 491 Cb 0.95 0.19 -0.01 0.00 -2.10 0.00 0.00 70.33 69.36 3kcp n THR 491 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kcp n GLY 492 N 1.41 0.50 3.73 3.38 0.00 -0.10 -4.96 105.19 109.15 3kcp n GLY 492 Ca -0.03 -0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 3kcp n GLY 492 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3kcp s LYS 493 N -1.22 4.54 0.36 1.61 2.20 -1.26 -4.58 119.74 121.40 3kcp s LYS 493 Ca 0.00 1.71 -0.26 0.00 -0.36 0.00 0.00 55.97 57.06 3kcp s LYS 493 Cb 0.00 -3.31 -0.09 0.00 -1.51 0.00 0.00 37.83 32.92 3kcp s LYS 493 CO 0.00 -0.03 1.07 -1.83 -0.36 0.00 0.00 175.35 174.19 3kcp s GLU 494 N 0.16 4.31 0.35 4.03 -1.05 -1.26 0.49 118.70 125.72 3kcp s GLU 494 Ca 0.52 1.61 -0.27 0.00 -0.15 0.00 0.00 54.97 56.68 3kcp s GLU 494 Cb -0.29 -2.75 -0.09 0.00 -0.44 0.00 0.00 34.13 30.56 3kcp s GLU 494 CO 0.33 -0.03 1.14 -0.06 0.95 0.00 0.00 175.26 177.58 3kcp s PHE 495 N -1.49 3.29 0.31 4.83 0.40 -0.22 -4.86 117.98 120.24 3kcp s PHE 495 Ca 0.54 1.61 0.02 0.00 -0.60 0.00 0.00 56.93 58.49 3kcp s PHE 495 Cb -0.25 -3.35 0.02 0.00 0.51 0.00 0.00 43.02 39.95 3kcp s PHE 495 CO 0.32 -0.98 0.13 0.25 0.70 0.00 0.00 175.22 175.64 3kcp n THR 496 N 0.57 0.00 -0.20 0.64 -2.24 -1.26 -4.86 114.28 106.94 3kcp n THR 496 Ca 0.02 -1.34 0.29 0.00 -2.27 0.00 0.00 64.05 60.75 3kcp n THR 496 Cb 0.46 0.01 0.72 0.00 -2.10 0.00 0.00 70.33 69.41 3kcp n THR 496 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3kcp h SER 497 N 0.54 0.02 -0.12 3.42 4.64 -1.97 -2.54 113.55 117.54 3kcp h SER 497 Ca -0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 3kcp h SER 497 Cb 0.75 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 3kcp h SER 497 CO 0.36 0.01 0.00 -1.54 -0.87 0.00 0.00 176.83 174.79 3kcp n SER 498 N -4.27 2.56 -4.64 4.97 3.41 -1.26 -0.63 113.62 113.75 3kcp n SER 498 Ca 0.19 -1.74 -0.43 0.00 -0.26 0.00 0.00 58.87 56.63 3kcp n SER 498 Cb 0.98 -0.07 -0.02 0.00 -0.26 0.00 0.00 64.21 64.83 3kcp n SER 498 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3kcp s THR 499 N -1.27 4.11 -0.15 6.66 2.01 -0.96 -4.57 115.64 121.47 3kcp s THR 499 Ca 0.22 1.29 -0.19 0.00 0.31 0.00 0.00 61.69 63.33 3kcp s THR 499 Cb 0.14 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.61 3kcp s THR 499 CO 0.21 -0.31 0.52 0.12 -0.69 0.00 0.00 174.62 174.47 3kcp s PHE 500 N 4.15 3.45 0.30 4.92 5.36 -1.26 -4.83 117.98 130.07 3kcp s PHE 500 Ca 0.58 0.88 -0.29 0.00 -0.96 0.00 0.00 56.93 57.14 3kcp s PHE 500 Cb -0.20 -2.64 -0.11 0.00 -0.34 0.00 0.00 43.02 39.73 3kcp s PHE 500 CO 0.21 0.03 1.49 -2.14 -1.46 0.00 0.00 175.22 173.35 3kcp s PRO 501 N 1.13 4.19 0.99 10.12 0.02 -1.26 -5.00 135.00 145.18 3kcp s PRO 501 Ca 0.26 2.45 -0.16 0.00 0.02 0.00 0.00 61.00 63.57 3kcp s PRO 501 Cb -0.15 -3.04 0.21 0.00 0.02 0.00 0.00 34.50 31.53 3kcp s PRO 501 CO 0.11 -0.49 1.31 -1.25 -0.33 0.00 0.00 177.00 176.34 3kcp s PRO 502 N -0.98 0.42 0.00 5.54 0.04 -1.25 -4.67 135.00 134.10 3kcp s PRO 502 Ca 0.58 -0.39 0.00 0.00 0.04 0.00 0.00 61.00 61.23 3kcp s PRO 502 Cb -0.45 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.27 3kcp s PRO 502 CO 0.51 -2.56 0.00 0.41 0.04 0.00 0.00 177.00 175.39 3kcp n GLY 503 N -3.50 0.69 3.77 0.56 0.00 -1.26 -0.13 105.19 105.32 3kcp n GLY 503 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 3kcp n GLY 503 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3kcp s ARG 504 N -0.88 3.04 0.00 1.61 1.70 -1.26 -4.69 118.95 118.47 3kcp s ARG 504 Ca 0.00 1.59 0.02 0.00 -0.47 0.00 0.00 55.73 56.87 3kcp s ARG 504 Cb 0.00 -1.96 0.05 0.00 -0.57 0.00 0.00 34.95 32.47 3kcp s ARG 504 CO 0.00 -1.10 0.95 0.25 -1.08 0.00 0.00 175.30 174.33 3kcp n THR 505 N -1.78 0.81 -4.34 4.99 -2.24 0.32 -4.96 114.28 107.07 3kcp n THR 505 Ca 0.12 -0.90 -0.18 0.00 -2.27 0.00 0.00 64.05 60.82 3kcp n THR 505 Cb 0.51 0.61 -0.10 0.00 -2.10 0.00 0.00 70.33 69.24 3kcp n THR 505 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3kcp s VAL 506 N -0.84 1.29 -1.35 2.28 -7.23 -1.22 -4.80 120.40 108.53 3kcp s VAL 506 Ca 0.04 -2.08 -0.00 0.00 -1.81 0.00 0.00 61.98 58.13 3kcp s VAL 506 Cb 0.02 -2.26 0.00 0.00 0.56 0.00 0.00 36.38 34.71 3kcp s VAL 506 CO 0.03 -0.42 0.60 0.18 -0.31 0.00 0.00 175.10 175.18 3kcp n LEU 507 N -0.42 -2.76 -0.36 1.32 4.77 -1.26 -4.90 117.00 113.39 3kcp n LEU 507 Ca -0.06 -0.89 0.04 0.00 -0.03 0.00 0.00 56.01 55.06 3kcp n LEU 507 Cb 0.63 -2.49 0.07 0.00 -2.33 0.00 0.00 43.42 39.29 3kcp n LEU 507 CO 0.37 0.42 0.47 0.29 -1.33 0.00 0.00 177.39 177.60 3kcp n LYS 508 N -4.33 1.39 -2.95 3.23 5.02 -1.26 -4.79 118.16 114.47 3kcp n LYS 508 Ca -0.30 -1.38 -0.43 0.00 -2.02 0.00 0.00 58.31 54.18 3kcp n LYS 508 Cb 0.68 -1.16 -0.05 0.00 -0.02 0.00 0.00 35.03 34.48 3kcp n LYS 508 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3kcp s ASN 509 N -0.80 6.28 0.66 4.39 3.84 -1.26 -4.92 114.94 123.12 3kcp s ASN 509 Ca 0.12 -0.65 0.35 0.00 0.21 0.00 0.00 52.86 52.89 3kcp s ASN 509 Cb 0.07 -2.38 1.91 0.00 -0.55 0.00 0.00 41.25 40.30 3kcp s ASN 509 CO 0.10 -1.15 2.10 0.78 -2.79 0.00 0.00 177.10 176.13 3kcp h ASN 510 N 9.25 0.00 -0.79 -4.21 2.35 -1.98 -1.64 115.58 118.55 3kcp h ASN 510 Ca -0.27 0.00 0.17 0.00 -0.55 0.00 0.00 56.30 55.65 3kcp h ASN 510 Cb 1.08 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.40 3kcp h ASN 510 CO 1.06 0.00 0.53 0.00 -1.65 0.00 0.00 177.43 177.38 3kcp h ALA 511 N 1.61 2.22 -0.52 -0.83 0.00 -2.01 -1.81 119.26 117.91 3kcp h ALA 511 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3kcp h ALA 511 Cb 0.43 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3kcp h ALA 511 CO -0.00 -0.45 0.00 0.66 0.00 0.00 0.00 179.25 179.46 3kcp n TYR 512 N -4.47 0.69 -3.20 0.00 4.01 -0.62 -4.88 117.16 108.69 3kcp n TYR 512 Ca 0.16 -0.34 -0.06 0.00 -0.16 0.00 0.00 57.90 57.49 3kcp n TYR 512 Cb 0.62 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.66 3kcp n TYR 512 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3kcp n GLY 513 N 1.49 -1.23 3.76 2.72 0.00 -0.68 -1.19 105.19 110.06 3kcp n GLY 513 Ca 0.20 0.50 -0.41 0.00 0.00 0.00 0.00 46.02 46.31 3kcp n GLY 513 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3kcp s PRO 514 N -3.51 4.28 -0.10 1.61 0.04 -1.26 -1.05 135.00 135.01 3kcp s PRO 514 Ca 0.06 2.30 0.03 0.00 0.04 0.00 0.00 61.00 63.43 3kcp s PRO 514 Cb -0.01 -3.08 0.01 0.00 0.04 0.00 0.00 34.50 31.46 3kcp s PRO 514 CO 0.77 -0.34 -0.19 0.42 0.04 0.00 0.00 177.00 177.70 3kcp s ILE 515 N -0.57 1.72 0.02 0.56 1.01 0.42 -4.91 121.20 119.45 3kcp s ILE 515 Ca 0.54 -0.81 0.08 0.00 0.00 0.00 0.00 60.65 60.47 3kcp s ILE 515 Cb -0.42 -1.52 -0.03 0.00 0.01 0.00 0.00 42.46 40.51 3kcp s ILE 515 CO 0.49 0.48 -0.23 0.00 0.00 0.00 0.00 174.94 175.69 3kcp s GLN 516 N 0.60 1.98 -0.01 2.79 -2.07 -1.26 -1.57 119.66 120.13 3kcp s GLN 516 Ca -0.14 -1.01 0.01 0.00 -1.82 0.00 0.00 55.36 52.40 3kcp s GLN 516 Cb -0.17 -2.08 0.01 0.00 -1.09 0.00 0.00 33.01 29.68 3kcp s GLN 516 CO 0.04 0.54 -0.03 0.42 -1.32 0.00 0.00 175.29 174.94 3kcp s ILE 517 N -0.79 0.29 -0.00 3.63 1.01 0.91 -4.99 121.20 121.26 3kcp s ILE 517 Ca 0.12 -0.11 0.04 0.00 0.00 0.00 0.00 60.65 60.71 3kcp s ILE 517 Cb -0.10 -0.29 -0.01 0.00 0.01 0.00 0.00 42.46 42.07 3kcp s ILE 517 CO 0.02 0.11 -0.14 0.00 0.00 0.00 0.00 174.94 174.93 3kcp s ALA 518 N 0.22 1.18 -0.42 9.38 0.00 -1.26 -1.47 121.76 129.40 3kcp s ALA 518 Ca -0.02 -0.66 0.08 0.00 0.00 0.00 0.00 51.96 51.37 3kcp s ALA 518 Cb -0.05 -0.28 0.27 0.00 0.00 0.00 0.00 23.12 23.07 3kcp s ALA 518 CO -0.00 0.28 0.71 -3.47 0.00 0.00 0.00 175.76 173.27 3kcp n ASP 519 N 2.56 -0.68 -4.88 0.00 2.03 0.71 -4.53 116.55 111.77 3kcp n ASP 519 Ca -0.15 -3.00 -0.30 0.00 0.52 0.00 0.00 54.79 51.86 3kcp n ASP 519 Cb 0.55 0.21 0.00 0.00 -0.72 0.00 0.00 41.12 41.16 3kcp n ASP 519 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 3kcp s ASN 520 N -1.56 6.27 -0.53 1.67 0.02 0.20 -3.79 114.94 117.21 3kcp s ASN 520 Ca 0.34 1.25 0.05 0.00 -1.02 0.00 0.00 52.86 53.48 3kcp s ASN 520 Cb 0.23 -2.39 0.19 0.00 0.02 0.00 0.00 41.25 39.30 3kcp s ASN 520 CO -0.13 -0.74 0.46 -0.67 0.02 0.00 0.00 177.10 176.03 3kcp n ASP 521 N -2.48 1.23 -0.09 -1.22 -0.08 0.37 -4.36 116.55 109.91 3kcp n ASP 521 Ca 0.04 -2.81 0.04 0.00 -1.51 0.00 0.00 54.79 50.55 3kcp n ASP 521 Cb 0.54 -0.65 0.37 0.00 2.34 0.00 0.00 41.12 43.73 3kcp n ASP 521 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3kcp h PRO 522 N 5.21 0.67 -0.62 -0.67 0.11 -1.88 -0.66 132.00 134.16 3kcp h PRO 522 Ca 0.20 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 66.33 3kcp h PRO 522 Cb 0.83 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 31.75 3kcp h PRO 522 CO 0.55 0.44 0.41 0.93 -0.21 0.00 0.00 178.00 180.12 3kcp h GLU 523 N 0.69 0.58 -0.67 1.05 3.07 -1.94 -0.74 114.58 116.62 3kcp h GLU 523 Ca 0.22 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.05 3kcp h GLU 523 Cb 0.03 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 27.81 3kcp h GLU 523 CO -0.06 0.39 0.00 1.63 -1.40 0.00 0.00 179.01 179.57 3kcp n LYS 524 N -4.48 3.00 -3.40 2.33 5.02 -0.37 -4.83 118.16 115.44 3kcp n LYS 524 Ca 0.09 -2.55 -0.20 0.00 -2.02 0.00 0.00 58.31 53.63 3kcp n LYS 524 Cb 0.24 -1.67 0.07 0.00 -0.02 0.00 0.00 35.03 33.65 3kcp n LYS 524 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kcp n GLY 525 N 1.38 -0.30 3.12 0.72 0.00 -0.29 -4.86 105.19 104.95 3kcp n GLY 525 Ca 0.23 0.10 -0.28 0.00 0.00 0.00 0.00 46.02 46.07 3kcp n GLY 525 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kcp s ILE 526 N -3.27 1.60 -0.12 -0.61 1.01 -0.54 -1.23 121.20 118.03 3kcp s ILE 526 Ca 0.44 -0.74 -0.01 0.00 0.00 0.00 0.00 60.65 60.33 3kcp s ILE 526 Cb -0.19 -1.42 -0.02 0.00 0.01 0.00 0.00 42.46 40.84 3kcp s ILE 526 CO 0.61 0.46 -0.08 -0.76 0.00 0.00 0.00 174.94 175.18 3kcp s LEU 527 N 0.56 3.06 -0.08 2.97 1.43 0.86 -0.48 118.68 127.00 3kcp s LEU 527 Ca -0.16 -0.16 -0.03 0.00 -1.03 0.00 0.00 54.13 52.76 3kcp s LEU 527 Cb -0.17 -1.70 0.04 0.00 0.03 0.00 0.00 46.19 44.39 3kcp s LEU 527 CO 0.05 0.23 0.08 0.21 0.23 0.00 0.00 176.35 177.15 3kcp s ASN 528 N 0.01 1.43 0.12 2.29 3.84 -1.25 0.24 114.94 121.62 3kcp s ASN 528 Ca -0.01 -0.09 -0.09 0.00 0.21 0.00 0.00 52.86 52.88 3kcp s ASN 528 Cb -0.14 -0.12 -0.00 0.00 -0.55 0.00 0.00 41.25 40.44 3kcp s ASN 528 CO 0.03 -0.28 0.24 0.72 -2.79 0.00 0.00 177.10 175.02 3kcp s PHE 529 N 2.18 0.23 -0.15 0.43 -0.12 -0.94 -0.20 117.98 119.41 3kcp s PHE 529 Ca 0.04 -0.63 -0.26 0.00 -0.05 0.00 0.00 56.93 56.03 3kcp s PHE 529 Cb -0.13 -0.04 0.06 0.00 -0.63 0.00 0.00 43.02 42.28 3kcp s PHE 529 CO -0.05 -0.63 0.64 0.00 -0.05 0.00 0.00 175.22 175.14 3kcp s ALA 530 N -3.90 -1.63 -0.14 1.99 0.00 -0.54 -1.38 121.76 116.15 3kcp s ALA 530 Ca 0.10 1.52 -0.15 0.00 0.00 0.00 0.00 51.96 53.43 3kcp s ALA 530 Cb 0.04 -0.54 0.04 0.00 0.00 0.00 0.00 23.12 22.66 3kcp s ALA 530 CO -0.06 -0.33 0.41 -1.17 0.00 0.00 0.00 175.76 174.60 3kcp s LEU 531 N -0.42 0.43 0.07 0.00 0.20 -0.59 -0.06 118.68 118.30 3kcp s LEU 531 Ca -0.06 0.78 -0.21 0.00 0.69 0.00 0.00 54.13 55.33 3kcp s LEU 531 Cb -0.03 1.43 0.05 0.00 -0.43 0.00 0.00 46.19 47.21 3kcp s LEU 531 CO 0.05 -0.17 0.50 0.00 -0.29 0.00 0.00 176.35 176.44 3kcp s ALA 532 N 0.10 -1.27 0.32 5.97 0.00 -0.61 -0.77 121.76 125.49 3kcp s ALA 532 Ca -0.01 0.48 -0.28 0.00 0.00 0.00 0.00 51.96 52.15 3kcp s ALA 532 Cb -0.03 0.47 -0.09 0.00 0.00 0.00 0.00 23.12 23.46 3kcp s ALA 532 CO 0.01 -0.54 1.08 0.71 0.00 0.00 0.00 175.76 177.02 3kcp s TYR 533 N -2.74 3.48 -0.04 0.00 2.02 -0.64 -0.44 117.35 118.99 3kcp s TYR 533 Ca -0.04 1.68 -0.03 0.00 -0.37 0.00 0.00 57.07 58.32 3kcp s TYR 533 Cb -0.00 -3.24 -0.27 0.00 -0.40 0.00 0.00 41.96 38.05 3kcp s TYR 533 CO -0.04 -0.57 0.70 0.66 -1.57 0.00 0.00 175.55 174.72 3kcp h SER 534 N 3.39 0.37 -1.62 2.29 4.64 0.00 -3.40 113.55 119.23 3kcp h SER 534 Ca -0.47 -0.61 -0.77 0.00 -0.47 0.00 0.00 61.79 59.47 3kcp h SER 534 Cb 1.21 -0.12 -0.17 0.00 -0.31 0.00 0.00 62.40 63.01 3kcp h SER 534 CO 0.65 1.53 1.87 -1.22 -0.87 0.00 0.00 176.83 178.79 3kcp n TYR 535 N -3.42 2.69 0.17 4.77 4.01 -0.33 -4.71 117.16 120.34 3kcp n TYR 535 Ca -0.21 -2.74 0.02 0.00 -0.16 0.00 0.00 57.90 54.81 3kcp n TYR 535 Cb 1.05 -1.74 0.32 0.00 -0.31 0.00 0.00 39.34 38.66 3kcp n TYR 535 CO 0.00 0.00 0.00 -0.84 -0.46 0.00 0.00 176.86 175.56 3kcp h ILE 536 N 3.21 1.30 -0.55 -0.72 3.07 -1.83 -2.26 117.51 119.73 3kcp h ILE 536 Ca 0.47 -1.47 -0.09 0.00 1.55 0.00 0.00 64.86 65.33 3kcp h ILE 536 Cb 0.50 1.79 -0.02 0.00 -0.27 0.00 0.00 36.82 38.82 3kcp h ILE 536 CO 1.50 0.42 -0.00 0.00 -1.05 0.00 0.00 178.15 179.02 3kcp h ALA 537 N 1.57 0.74 -0.78 0.16 0.00 -1.84 0.13 119.26 119.25 3kcp h ALA 537 Ca -0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 3kcp h ALA 537 Cb 0.76 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 3kcp h ALA 537 CO 0.06 0.57 0.36 0.78 0.00 0.00 0.00 179.25 181.02 3kcp h GLY 538 N 0.86 1.21 1.00 0.00 0.00 -1.90 -2.14 103.07 102.09 3kcp h GLY 538 Ca 0.16 -0.61 -0.05 0.00 0.00 0.00 0.00 47.33 46.83 3kcp h GLY 538 CO 0.03 0.58 0.18 -1.82 0.00 0.00 0.00 176.54 175.51 3kcp h TYR 539 N 1.10 0.92 -0.37 5.60 3.20 -1.06 -2.80 116.97 123.57 3kcp h TYR 539 Ca 0.27 -0.09 -0.00 0.00 3.14 0.00 0.00 58.73 62.04 3kcp h TYR 539 Cb 0.14 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.12 3kcp h TYR 539 CO 0.01 0.77 0.21 -0.22 -1.64 0.00 0.00 178.16 177.30 3kcp h LYS 540 N 0.80 0.51 -0.93 1.82 3.64 -0.71 -2.69 116.57 119.03 3kcp h LYS 540 Ca 0.18 -0.05 0.10 0.00 -1.27 0.00 0.00 60.65 59.61 3kcp h LYS 540 Cb 0.28 -0.10 -0.07 0.00 -0.41 0.00 0.00 32.23 31.93 3kcp h LYS 540 CO -0.01 0.40 0.59 1.49 -2.27 0.00 0.00 179.45 179.66 3kcp h GLU 541 N 0.48 0.90 -0.52 1.90 4.57 -1.34 -0.18 114.58 120.39 3kcp h GLU 541 Ca 0.13 -0.05 0.06 0.00 -1.18 0.00 0.00 59.36 58.31 3kcp h GLU 541 Cb 0.03 -0.20 -0.03 0.00 -0.16 0.00 0.00 28.75 28.39 3kcp h GLU 541 CO -0.02 0.60 0.35 1.15 -1.18 0.00 0.00 179.01 179.90 3kcp h THR 542 N 0.93 0.99 0.00 0.32 2.02 -1.20 -3.47 112.91 112.50 3kcp h THR 542 Ca 0.43 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.45 3kcp h THR 542 Cb 0.41 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 3kcp h THR 542 CO -0.19 0.09 0.00 0.61 0.37 0.00 0.00 175.52 176.39 3kcp n GLY 543 N -1.50 0.65 3.19 2.16 0.00 -0.08 -4.99 105.19 104.62 3kcp n GLY 543 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 3kcp n GLY 543 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kcp s VAL 544 N -2.76 3.60 0.11 1.61 1.01 -1.26 -5.09 120.40 117.62 3kcp s VAL 544 Ca 0.00 -1.67 -0.26 0.00 0.00 0.00 0.00 61.98 60.05 3kcp s VAL 544 Cb 0.00 -3.29 -0.07 0.00 0.00 0.00 0.00 36.38 33.03 3kcp s VAL 544 CO 0.00 -0.51 0.81 0.00 0.00 0.00 0.00 175.10 175.40 3kcp s ALA 545 N 1.27 3.38 -0.85 5.51 0.00 -1.26 -5.01 121.76 124.80 3kcp s ALA 545 Ca 0.04 0.38 -0.21 0.00 0.00 0.00 0.00 51.96 52.16 3kcp s ALA 545 Cb -0.22 -3.04 0.09 0.00 0.00 0.00 0.00 23.12 19.95 3kcp s ALA 545 CO -0.01 0.14 1.15 -1.21 0.00 0.00 0.00 175.76 175.83 3kcp s GLU 546 N -0.51 3.41 0.01 0.00 2.02 -1.26 -4.86 118.70 117.51 3kcp s GLU 546 Ca 0.39 -1.24 0.22 0.00 0.02 0.00 0.00 54.97 54.36 3kcp s GLU 546 Cb -0.22 -4.73 -0.08 0.00 0.10 0.00 0.00 34.13 29.20 3kcp s GLU 546 CO 0.26 -1.90 0.93 0.39 0.02 0.00 0.00 175.26 174.96 3kcp n GLU 547 N 7.56 0.20 -4.02 1.61 1.02 -1.26 -4.54 120.64 121.21 3kcp n GLU 547 Ca 0.15 -0.03 -0.13 0.00 -0.02 0.00 0.00 57.16 57.13 3kcp n GLU 547 Cb 0.48 -1.53 -0.13 0.00 -0.02 0.00 0.00 31.44 30.23 3kcp n GLU 547 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3kcp s SER 548 N -3.54 0.37 0.00 1.62 0.01 -1.26 -0.75 113.70 110.15 3kcp s SER 548 Ca 0.04 -0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.14 3kcp s SER 548 Cb 0.15 -0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.37 3kcp s SER 548 CO 0.84 -0.04 0.00 0.61 0.41 0.00 0.00 173.24 175.06 3kcp n GLY 549 N 2.65 -2.25 3.77 3.44 0.00 -0.63 -4.93 105.19 107.23 3kcp n GLY 549 Ca -0.15 -1.23 -0.38 0.00 0.00 0.00 0.00 46.02 44.26 3kcp n GLY 549 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kcp s ILE 550 N -2.22 5.01 -0.04 -0.61 1.01 -1.26 -0.99 121.20 122.08 3kcp s ILE 550 Ca 0.00 1.06 0.12 0.00 0.00 0.00 0.00 60.65 61.83 3kcp s ILE 550 Cb 0.00 -3.85 -0.18 0.00 0.01 0.00 0.00 42.46 38.44 3kcp s ILE 550 CO 0.00 0.43 0.21 2.30 0.00 0.00 0.00 174.94 177.89 3kcp n ILE 551 N 2.75 0.21 -3.58 2.92 -5.35 0.23 -0.52 119.36 116.02 3kcp n ILE 551 Ca -0.09 -0.34 -0.16 0.00 -0.27 0.00 0.00 62.75 61.89 3kcp n ILE 551 Cb 0.51 -0.03 -0.07 0.00 -1.74 0.00 0.00 39.64 38.32 3kcp n ILE 551 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3kcp s ALA 552 N -2.71 -1.63 -0.09 -1.28 0.00 -1.14 -4.26 121.76 110.64 3kcp s ALA 552 Ca -0.05 1.36 0.04 0.00 0.00 0.00 0.00 51.96 53.31 3kcp s ALA 552 Cb 0.07 -0.28 0.00 0.00 0.00 0.00 0.00 23.12 22.91 3kcp s ALA 552 CO 0.51 -0.34 -0.23 0.15 0.00 0.00 0.00 175.76 175.85 3kcp s LYS 553 N -0.80 2.89 -0.07 0.00 1.02 0.81 -0.70 119.74 122.89 3kcp s LYS 553 Ca -0.08 -0.83 0.01 0.00 0.02 0.00 0.00 55.97 55.09 3kcp s LYS 553 Cb -0.02 -2.20 0.02 0.00 -0.52 0.00 0.00 37.83 35.11 3kcp s LYS 553 CO 0.07 0.17 -0.09 0.42 -0.92 0.00 0.00 175.35 175.00 3kcp s ILE 554 N 0.36 0.94 0.12 2.17 1.01 0.13 -3.94 121.20 121.99 3kcp s ILE 554 Ca -0.18 -0.33 -0.18 0.00 0.00 0.00 0.00 60.65 59.96 3kcp s ILE 554 Cb -0.18 -0.91 -0.07 0.00 0.01 0.00 0.00 42.46 41.32 3kcp s ILE 554 CO 0.08 0.32 0.58 -0.83 0.00 0.00 0.00 174.94 175.09 3kcp s GLY 555 N 1.00 2.59 -0.23 6.18 0.00 -0.39 0.68 107.32 117.13 3kcp s GLY 555 Ca -0.09 -0.01 0.02 0.00 0.00 0.00 0.00 44.72 44.64 3kcp s GLY 555 CO -0.00 0.36 -0.10 -1.36 0.00 0.00 0.00 173.10 172.00 3kcp s PHE 556 N -1.28 2.81 0.03 1.90 0.08 0.29 -0.06 117.98 121.74 3kcp s PHE 556 Ca 0.34 -1.96 -0.30 0.00 0.12 0.00 0.00 56.93 55.12 3kcp s PHE 556 Cb -0.18 -1.77 -0.04 0.00 -0.57 0.00 0.00 43.02 40.47 3kcp s PHE 556 CO 0.19 -0.82 1.00 0.21 -0.10 0.00 0.00 175.22 175.71 3kcp s LYS 557 N 1.26 4.57 -0.09 0.44 2.20 0.11 -1.66 119.74 126.58 3kcp s LYS 557 Ca -0.06 1.46 -0.30 0.00 -0.36 0.00 0.00 55.97 56.72 3kcp s LYS 557 Cb -0.18 -3.43 -0.03 0.00 -1.51 0.00 0.00 37.83 32.68 3kcp s LYS 557 CO -0.07 -0.02 1.22 0.42 -0.36 0.00 0.00 175.35 176.54 3kcp s ILE 558 N 0.83 4.26 -0.09 5.43 1.01 0.30 -1.33 121.20 131.61 3kcp s ILE 558 Ca 0.52 1.57 0.19 0.00 0.00 0.00 0.00 60.65 62.92 3kcp s ILE 558 Cb -0.22 -4.01 -0.28 0.00 0.01 0.00 0.00 42.46 37.96 3kcp s ILE 558 CO 0.29 -0.04 0.30 0.18 0.00 0.00 0.00 174.94 175.66 3kcp n LEU 559 N 5.60 0.00 -3.70 2.97 4.77 0.12 -0.99 117.00 125.77 3kcp n LEU 559 Ca 0.12 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.97 3kcp n LEU 559 Cb 0.46 0.17 -0.09 0.00 -2.33 0.00 0.00 43.42 41.62 3kcp n LEU 559 CO 0.55 0.17 0.17 -1.10 -1.33 0.00 0.00 177.39 175.85 3kcp s GLN 560 N -3.03 0.55 -1.46 3.23 -0.21 -1.20 -4.95 119.66 112.60 3kcp s GLN 560 Ca -0.08 0.75 -0.12 0.00 0.02 0.00 0.00 55.36 55.93 3kcp s GLN 560 Cb 0.10 0.21 0.04 0.00 1.00 0.00 0.00 33.01 34.36 3kcp s GLN 560 CO 0.80 -0.09 2.33 1.63 -2.12 0.00 0.00 175.29 177.84 3kcp n LYS 561 N 3.19 3.24 -4.85 2.91 5.02 -1.26 -4.89 118.16 121.52 3kcp n LYS 561 Ca -0.16 -2.71 -0.31 0.00 -2.02 0.00 0.00 58.31 53.11 3kcp n LYS 561 Cb 0.56 -3.10 -0.14 0.00 -0.02 0.00 0.00 35.03 32.34 3kcp n LYS 561 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3kcp s LYS 562 N 2.31 2.12 0.29 1.97 2.20 -1.26 -5.10 119.74 122.27 3kcp s LYS 562 Ca 0.51 -0.94 -0.30 0.00 -0.36 0.00 0.00 55.97 54.88 3kcp s LYS 562 Cb 0.14 -2.17 -0.12 0.00 -1.51 0.00 0.00 37.83 34.18 3kcp s LYS 562 CO -0.07 0.55 1.57 0.43 -0.36 0.00 0.00 175.35 177.48 3kcp n SER 563 N 1.87 3.75 -3.54 1.43 7.64 -1.26 -4.87 113.62 118.64 3kcp n SER 563 Ca -0.16 1.15 -0.14 0.00 1.01 0.00 0.00 58.87 60.72 3kcp n SER 563 Cb 0.52 -1.58 -0.05 0.00 -1.01 0.00 0.00 64.21 62.09 3kcp n SER 563 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3kcp s THR 564 N -0.06 0.02 0.00 0.44 -1.32 0.28 -5.01 115.64 109.99 3kcp s THR 564 Ca 0.64 -0.16 0.06 0.00 -1.21 0.00 0.00 61.69 61.02 3kcp s THR 564 Cb -0.51 -0.98 -0.02 0.00 -1.51 0.00 0.00 72.50 69.49 3kcp s THR 564 CO 0.49 -0.09 -0.20 0.00 -2.21 0.00 0.00 174.62 172.62 3kcp s ALA 565 N -2.35 1.64 -0.05 11.08 0.00 -1.26 -0.02 121.76 130.79 3kcp s ALA 565 Ca -0.06 -0.90 0.06 0.00 0.00 0.00 0.00 51.96 51.06 3kcp s ALA 565 Cb -0.01 -0.38 -0.01 0.00 0.00 0.00 0.00 23.12 22.72 3kcp s ALA 565 CO -0.01 0.39 -0.24 0.08 0.00 0.00 0.00 175.76 175.98 3kcp s VAL 566 N -0.57 1.97 -0.03 0.00 1.01 -1.26 -4.25 120.40 117.26 3kcp s VAL 566 Ca 0.07 -1.02 -0.27 0.00 0.00 0.00 0.00 61.98 60.76 3kcp s VAL 566 Cb -0.08 -1.66 0.06 0.00 0.00 0.00 0.00 36.38 34.70 3kcp s VAL 566 CO 0.00 0.55 0.58 -1.59 0.00 0.00 0.00 175.10 174.64 3kcp s LYS 567 N -0.17 0.97 0.20 2.72 -2.85 -0.67 -4.54 119.74 115.40 3kcp s LYS 567 Ca -0.03 0.11 -0.31 0.00 -1.00 0.00 0.00 55.97 54.74 3kcp s LYS 567 Cb -0.13 0.45 -0.10 0.00 -2.06 0.00 0.00 37.83 36.00 3kcp s LYS 567 CO 0.03 -0.30 1.47 -0.06 0.10 0.00 0.00 175.35 176.58 3kcp s PHE 568 N -1.36 3.08 -0.02 1.78 0.08 -1.26 -0.51 117.98 119.77 3kcp s PHE 568 Ca -0.11 0.90 -0.01 0.00 0.12 0.00 0.00 56.93 57.82 3kcp s PHE 568 Cb -0.01 -3.82 0.01 0.00 -0.57 0.00 0.00 43.02 38.63 3kcp s PHE 568 CO 0.07 -2.82 0.05 -1.14 -0.10 0.00 0.00 175.22 171.28 3kcp s GLN 569 N 0.36 0.04 0.71 0.44 0.74 -0.73 -4.79 119.66 116.43 3kcp s GLN 569 Ca 0.63 0.09 -0.16 0.00 0.05 0.00 0.00 55.36 55.97 3kcp s GLN 569 Cb -0.41 -0.02 0.02 0.00 1.10 0.00 0.00 33.01 33.70 3kcp s GLN 569 CO 0.37 -0.03 1.21 -0.25 -0.55 0.00 0.00 175.29 176.03 3kcp n ASP 570 N 3.25 1.47 -3.76 6.67 8.00 -1.26 -4.08 116.55 126.84 3kcp n ASP 570 Ca -0.15 0.73 -0.11 0.00 0.71 0.00 0.00 54.79 55.97 3kcp n ASP 570 Cb 0.58 -1.51 -0.07 0.00 -0.02 0.00 0.00 41.12 40.10 3kcp n ASP 570 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3kcp s THR 571 N -1.68 0.09 0.33 -3.53 -1.32 -1.26 -4.89 115.64 103.38 3kcp s THR 571 Ca 0.78 -0.76 0.04 0.00 -1.21 0.00 0.00 61.69 60.54 3kcp s THR 571 Cb -0.35 -1.04 0.29 0.00 -1.51 0.00 0.00 72.50 69.89 3kcp s THR 571 CO 0.45 -0.42 1.92 0.25 -2.21 0.00 0.00 174.62 174.61 3kcp h LEU 572 N 3.02 0.77 0.00 9.08 5.85 -2.03 -1.32 115.31 130.68 3kcp h LEU 572 Ca -0.32 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.41 3kcp h LEU 572 Cb 1.21 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.08 3kcp h LEU 572 CO 0.48 0.48 0.00 -1.54 -0.34 0.00 0.00 178.44 177.52 3kcp n SER 573 N -4.50 0.00 -3.28 1.25 3.41 -1.26 -3.75 113.62 105.49 3kcp n SER 573 Ca 0.13 -0.57 -0.25 0.00 -0.26 0.00 0.00 58.87 57.92 3kcp n SER 573 Cb 0.25 -0.04 -0.07 0.00 -0.26 0.00 0.00 64.21 64.09 3kcp n SER 573 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3kcp n MET 574 N -1.04 1.90 -2.08 4.33 2.81 -0.50 -5.09 117.12 117.45 3kcp n MET 574 Ca 0.15 -4.13 -0.40 0.00 -1.81 0.00 0.00 57.70 51.50 3kcp n MET 574 Cb 0.09 -1.88 -0.02 0.00 -0.71 0.00 0.00 33.22 30.70 3kcp n MET 574 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 3kcp s PRO 575 N -2.15 4.26 0.00 0.03 0.04 -1.25 -2.34 135.00 133.60 3kcp s PRO 575 Ca 0.39 2.23 0.00 0.00 0.04 0.00 0.00 61.00 63.66 3kcp s PRO 575 Cb 0.18 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.72 3kcp s PRO 575 CO -0.06 -0.27 0.00 0.41 0.04 0.00 0.00 177.00 177.12 3kcp n GLY 576 N 0.74 0.83 3.74 0.56 0.00 -1.26 -5.04 105.19 104.75 3kcp n GLY 576 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 3kcp n GLY 576 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kcp s ALA 577 N -3.35 2.09 -0.47 4.61 0.00 -0.99 -5.00 121.76 118.64 3kcp s ALA 577 Ca 0.00 0.46 -0.14 0.00 0.00 0.00 0.00 51.96 52.28 3kcp s ALA 577 Cb 0.00 -3.35 0.08 0.00 0.00 0.00 0.00 23.12 19.86 3kcp s ALA 577 CO 0.00 -1.94 0.39 0.42 0.00 0.00 0.00 175.76 174.63 3kcp s ILE 578 N -2.65 5.04 -1.63 0.00 1.01 0.23 -4.52 121.20 118.67 3kcp s ILE 578 Ca 0.65 -1.20 -0.08 0.00 0.00 0.00 0.00 60.65 60.02 3kcp s ILE 578 Cb -0.20 -4.06 0.07 0.00 0.01 0.00 0.00 42.46 38.28 3kcp s ILE 578 CO 0.53 -0.61 0.27 -1.20 0.00 0.00 0.00 174.94 173.92 3kcp n SER 579 N 5.15 -0.25 0.00 3.58 7.64 -1.26 -0.96 113.62 127.53 3kcp n SER 579 Ca -0.12 -1.22 0.00 0.00 1.01 0.00 0.00 58.87 58.54 3kcp n SER 579 Cb 0.43 -1.86 0.00 0.00 -1.01 0.00 0.00 64.21 61.77 3kcp n SER 579 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3kcp n GLY 580 N -2.03 0.58 3.25 0.23 0.00 -1.26 -2.78 105.19 103.18 3kcp n GLY 580 Ca -0.18 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.18 3kcp n GLY 580 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kcp s THR 581 N -2.00 1.92 -0.06 2.61 -4.23 -0.13 -0.08 115.64 113.67 3kcp s THR 581 Ca 0.00 -1.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.52 3kcp s THR 581 Cb 0.00 -1.62 0.02 0.00 1.34 0.00 0.00 72.50 72.24 3kcp s THR 581 CO 0.00 0.54 -0.07 -1.10 -0.54 0.00 0.00 174.62 173.45 3kcp s GLN 582 N -0.20 1.13 0.04 3.99 -0.21 0.26 -0.60 119.66 124.08 3kcp s GLN 582 Ca -0.01 -0.19 0.09 0.00 0.02 0.00 0.00 55.36 55.26 3kcp s GLN 582 Cb -0.13 -1.09 -0.03 0.00 1.00 0.00 0.00 33.01 32.77 3kcp s GLN 582 CO 0.03 -0.08 -0.24 -0.51 -2.12 0.00 0.00 175.29 172.36 3kcp s LEU 583 N 1.00 2.30 0.03 2.90 1.43 -1.26 -0.49 118.68 124.59 3kcp s LEU 583 Ca -0.09 -0.55 0.05 0.00 -1.03 0.00 0.00 54.13 52.51 3kcp s LEU 583 Cb -0.14 -1.35 -0.02 0.00 0.03 0.00 0.00 46.19 44.71 3kcp s LEU 583 CO -0.00 0.26 -0.14 -0.36 0.23 0.00 0.00 176.35 176.34 3kcp s PHE 584 N -0.84 1.23 0.63 0.29 0.08 -0.04 -0.15 117.98 119.18 3kcp s PHE 584 Ca 0.13 -0.33 0.03 0.00 0.12 0.00 0.00 56.93 56.88 3kcp s PHE 584 Cb -0.10 -0.74 0.09 0.00 -0.57 0.00 0.00 43.02 41.70 3kcp s PHE 584 CO 0.03 0.03 0.87 0.16 -0.10 0.00 0.00 175.22 176.20 3kcp s ASP 585 N -0.99 4.82 0.00 1.36 1.47 -0.25 -0.18 116.67 122.90 3kcp s ASP 585 Ca 0.02 -0.44 0.17 0.00 1.18 0.00 0.00 52.55 53.48 3kcp s ASP 585 Cb -0.07 -0.13 1.01 0.00 -0.34 0.00 0.00 42.92 43.39 3kcp s ASP 585 CO 0.01 -1.51 1.56 -2.67 0.68 0.00 0.00 175.17 173.24 3kcp n TRP 586 N -2.51 0.00 1.14 2.11 2.14 0.65 -0.51 117.44 120.47 3kcp n TRP 586 Ca 0.13 0.00 0.12 0.00 2.07 0.00 0.00 57.50 59.83 3kcp n TRP 586 Cb 0.61 0.00 0.20 0.00 -0.81 0.00 0.00 31.31 31.30 3kcp n TRP 586 CO 0.00 0.00 0.00 -0.25 2.07 0.00 0.00 177.69 179.51 3kcp n ASP 587 N -0.80 2.08 0.00 -0.67 8.00 -1.26 -4.39 116.55 119.51 3kcp n ASP 587 Ca 0.13 -1.57 0.00 0.00 0.71 0.00 0.00 54.79 54.06 3kcp n ASP 587 Cb 0.06 0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 3kcp n ASP 587 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3kcp n GLY 588 N 1.34 0.50 3.90 0.44 0.00 0.33 -5.04 105.19 106.65 3kcp n GLY 588 Ca 0.13 -0.20 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 3kcp n GLY 588 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kcp s GLU 589 N -0.40 3.58 0.30 1.61 0.41 -1.26 -4.85 118.70 118.10 3kcp s GLU 589 Ca 0.00 -0.15 -0.30 0.00 -0.41 0.00 0.00 54.97 54.11 3kcp s GLU 589 Cb 0.00 -2.90 -0.11 0.00 -1.78 0.00 0.00 34.13 29.34 3kcp s GLU 589 CO 0.00 0.51 1.54 0.08 -0.49 0.00 0.00 175.26 176.90 3kcp s VAL 590 N -1.61 2.18 -0.00 2.63 1.01 -1.26 -1.09 120.40 122.26 3kcp s VAL 590 Ca 0.39 0.16 -0.16 0.00 0.00 0.00 0.00 61.98 62.37 3kcp s VAL 590 Cb -0.12 -3.10 -0.06 0.00 0.00 0.00 0.00 36.38 33.10 3kcp s VAL 590 CO 0.25 0.03 0.43 -0.63 0.00 0.00 0.00 175.10 175.18 3kcp s ILE 591 N -0.22 5.01 0.47 2.22 1.01 0.79 -4.83 121.20 125.64 3kcp s ILE 591 Ca 0.60 0.89 0.02 0.00 0.00 0.00 0.00 60.65 62.17 3kcp s ILE 591 Cb -0.46 -3.74 -0.02 0.00 0.01 0.00 0.00 42.46 38.25 3kcp s ILE 591 CO 0.50 0.55 0.06 0.42 0.00 0.00 0.00 174.94 176.46 3kcp s THR 592 N -0.91 0.93 -0.01 2.92 -4.23 -1.26 -4.55 115.64 108.54 3kcp s THR 592 Ca 0.24 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.75 3kcp s THR 592 Cb -0.17 -2.24 0.00 0.00 1.34 0.00 0.00 72.50 71.43 3kcp s THR 592 CO 0.14 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.83 3kcp n GLY 593 N -1.12 0.40 3.78 3.99 0.00 -1.26 -5.04 105.19 105.94 3kcp n GLY 593 Ca -0.14 -0.97 -0.23 0.00 0.00 0.00 0.00 46.02 44.69 3kcp n GLY 593 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3kcp s TYR 594 N -2.00 3.02 0.18 1.61 -0.85 -1.26 -4.83 117.35 113.22 3kcp s TYR 594 Ca 0.00 -0.12 -0.17 0.00 -0.52 0.00 0.00 57.07 56.26 3kcp s TYR 594 Cb 0.00 -1.37 -0.07 0.00 0.38 0.00 0.00 41.96 40.89 3kcp s TYR 594 CO 0.00 0.54 0.63 -2.00 -1.52 0.00 0.00 175.55 173.20 3kcp s GLU 595 N -3.66 4.10 -0.35 -3.49 2.12 0.37 -4.92 118.70 112.88 3kcp s GLU 595 Ca 0.32 0.66 -0.10 0.00 0.36 0.00 0.00 54.97 56.21 3kcp s GLU 595 Cb -0.08 -2.91 0.01 0.00 0.26 0.00 0.00 34.13 31.41 3kcp s GLU 595 CO 0.23 0.44 0.18 0.08 -0.54 0.00 0.00 175.26 175.66 3kcp s VAL 596 N -1.49 4.55 -0.52 3.70 1.01 -1.26 -0.40 120.40 125.99 3kcp s VAL 596 Ca 0.40 -0.70 -0.18 0.00 0.00 0.00 0.00 61.98 61.50 3kcp s VAL 596 Cb -0.16 -3.45 0.08 0.00 0.00 0.00 0.00 36.38 32.85 3kcp s VAL 596 CO 0.20 -0.11 0.58 -0.63 0.00 0.00 0.00 175.10 175.14 3kcp s ILE 597 N 1.57 4.97 0.34 2.22 1.01 0.61 -4.98 121.20 126.94 3kcp s ILE 597 Ca 0.03 -0.79 -0.25 0.00 0.00 0.00 0.00 60.65 59.63 3kcp s ILE 597 Cb -0.18 -4.30 -0.10 0.00 0.01 0.00 0.00 42.46 37.88 3kcp s ILE 597 CO 0.06 -0.83 0.95 -1.10 0.00 0.00 0.00 174.94 174.03 3kcp s GLN 598 N 2.35 4.51 0.59 2.79 -1.52 -1.26 -2.31 119.66 124.80 3kcp s GLN 598 Ca 0.11 1.32 -0.18 0.00 -1.95 0.00 0.00 55.36 54.66 3kcp s GLN 598 Cb -0.22 -2.71 -0.04 0.00 -0.22 0.00 0.00 33.01 29.83 3kcp s GLN 598 CO 0.09 0.21 1.13 -1.25 -0.25 0.00 0.00 175.29 175.22 3kcp s PRO 599 N -2.22 3.15 0.87 2.91 0.04 -1.20 -4.92 135.00 133.62 3kcp s PRO 599 Ca 0.52 1.55 -0.11 0.00 0.04 0.00 0.00 61.00 63.00 3kcp s PRO 599 Cb -0.18 -1.98 0.11 0.00 0.04 0.00 0.00 34.50 32.49 3kcp s PRO 599 CO 0.23 -1.00 1.10 -0.51 0.04 0.00 0.00 177.00 176.85 3kcp s ASP 600 N -2.04 3.59 0.40 6.66 1.01 -1.26 -4.87 116.67 120.16 3kcp s ASP 600 Ca 0.71 1.78 -0.25 0.00 0.71 0.00 0.00 52.55 55.50 3kcp s ASP 600 Cb -0.23 -2.41 -0.11 0.00 1.01 0.00 0.00 42.92 41.18 3kcp s ASP 600 CO 0.32 -2.61 1.08 0.52 0.21 0.00 0.00 175.17 174.70 3kcp n VAL 601 N -3.89 2.37 -3.00 -1.27 0.31 -1.26 -4.84 118.33 106.75 3kcp n VAL 601 Ca 0.09 -0.50 -0.44 0.00 -0.01 0.00 0.00 64.34 63.48 3kcp n VAL 601 Cb 0.54 -1.25 -0.04 0.00 -0.91 0.00 0.00 33.84 32.17 3kcp n VAL 601 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3kcp s LEU 602 N -0.68 5.02 0.00 7.52 1.43 0.97 -4.98 118.68 127.96 3kcp s LEU 602 Ca 0.62 -1.39 0.25 0.00 -1.03 0.00 0.00 54.13 52.57 3kcp s LEU 602 Cb -0.57 -2.35 0.32 0.00 0.03 0.00 0.00 46.19 43.62 3kcp s LEU 602 CO 0.58 -1.21 1.33 -1.54 0.23 0.00 0.00 176.35 175.74