#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r4r s PRO 439 N 0.00 4.17 -0.19 5.56 0.02 -1.26 -3.77 135.00 139.53 1r4r s PRO 439 Ca 0.00 2.41 -0.09 0.00 0.02 0.00 0.00 61.00 63.34 1r4r s PRO 439 Cb 0.00 -3.83 0.03 0.00 0.02 0.00 0.00 34.50 30.72 1r4r s PRO 439 CO 0.00 -0.83 0.18 0.00 -0.33 0.00 0.00 177.00 176.02 1r4r n LEU 441 N 1.33 1.42 0.00 0.00 4.77 -0.74 -1.61 117.00 122.17 1r4r n LEU 441 Ca -0.30 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 54.97 1r4r n LEU 441 Cb 0.47 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1r4r n LEU 441 CO 0.37 0.29 -0.27 0.52 -1.33 0.00 0.00 177.39 176.97 1r4r n VAL 442 N 0.19 0.00 -0.01 4.08 0.31 -1.26 -4.92 118.33 116.71 1r4r n VAL 442 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1r4r n VAL 442 Cb 0.29 -1.01 0.00 0.00 -0.91 0.00 0.00 33.84 32.21 1r4r n VAL 442 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1r4r n SER 444 N -0.07 -5.88 -4.71 0.00 7.64 -0.64 -3.19 113.62 106.77 1r4r n SER 444 Ca 0.00 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.62 1r4r n SER 444 Cb 0.03 -3.42 0.10 0.00 -1.01 0.00 0.00 64.21 59.92 1r4r n SER 444 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1r4r s ASP 445 N -2.00 4.39 -0.16 6.43 2.15 -1.21 -4.82 116.67 121.44 1r4r s ASP 445 Ca 0.00 0.22 -0.29 0.00 0.43 0.00 0.00 52.55 52.91 1r4r s ASP 445 Cb 0.00 -0.69 -0.05 0.00 -0.30 0.00 0.00 42.92 41.88 1r4r s ASP 445 CO 0.00 -1.87 1.88 -1.61 -0.17 0.00 0.00 175.17 173.40 1r4r s GLU 446 N -5.33 3.68 0.34 4.34 0.41 -1.26 -3.69 118.70 117.18 1r4r s GLU 446 Ca 0.64 1.99 -0.26 0.00 -0.41 0.00 0.00 54.97 56.94 1r4r s GLU 446 Cb -0.08 -4.17 -0.10 0.00 -1.78 0.00 0.00 34.13 28.01 1r4r s GLU 446 CO 0.46 -1.46 0.97 0.00 -0.49 0.00 0.00 175.26 174.75 1r4r s ALA 447 N 5.94 3.19 -0.19 5.21 0.00 -1.26 -4.32 121.76 130.33 1r4r s ALA 447 Ca 0.84 0.58 0.20 0.00 0.00 0.00 0.00 51.96 53.57 1r4r s ALA 447 Cb -0.31 -3.21 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 1r4r s ALA 447 CO 0.34 0.08 1.02 0.66 0.00 0.00 0.00 175.76 177.86 1r4r h SER 448 N 3.06 0.00 -2.92 0.00 4.64 -1.05 -3.46 113.55 113.82 1r4r h SER 448 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1r4r h SER 448 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1r4r h SER 448 CO 0.64 0.28 0.00 0.61 -0.87 0.00 0.00 176.83 177.50 1r4r n GLY 449 N 1.27 4.08 3.73 -0.77 0.00 -1.20 -5.04 105.19 107.25 1r4r n GLY 449 Ca -0.04 -1.33 -0.67 0.00 0.00 0.00 0.00 46.02 43.98 1r4r n GLY 449 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r4r s HIS 451 N 2.77 1.72 -0.14 0.00 3.76 -0.09 -4.76 115.29 118.54 1r4r s HIS 451 Ca 1.04 -0.42 0.00 0.00 -0.15 0.00 0.00 55.06 55.53 1r4r s HIS 451 Cb -1.48 -1.13 0.00 0.00 1.11 0.00 0.00 32.58 31.08 1r4r s HIS 451 CO 0.80 -0.10 0.00 0.66 -0.85 0.00 0.00 174.74 175.25 1r4r n TYR 452 N 2.88 -1.42 0.00 1.40 4.02 -1.26 -0.24 117.16 122.54 1r4r n TYR 452 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.73 1r4r n TYR 452 Cb 0.53 -1.19 0.00 0.00 -0.02 0.00 0.00 39.34 38.66 1r4r n TYR 452 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1r4r n GLY 453 N -0.28 2.16 3.08 2.72 0.00 -1.26 -0.05 105.19 111.56 1r4r n GLY 453 Ca -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.85 1r4r n GLY 453 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r4r s VAL 454 N -2.09 0.68 0.05 1.61 1.01 0.67 -4.75 120.40 117.58 1r4r s VAL 454 Ca 0.00 -0.99 -0.32 0.00 0.00 0.00 0.00 61.98 60.67 1r4r s VAL 454 Cb 0.00 -0.70 -0.11 0.00 0.00 0.00 0.00 36.38 35.58 1r4r s VAL 454 CO 0.00 -0.24 1.88 -0.11 0.00 0.00 0.00 175.10 176.63 1r4r n LEU 455 N 1.68 3.88 -3.89 3.92 7.94 -1.26 -0.91 117.00 128.36 1r4r n LEU 455 Ca -0.21 0.96 -0.09 0.00 -1.11 0.00 0.00 56.01 55.56 1r4r n LEU 455 Cb 0.55 -1.49 -0.06 0.00 0.53 0.00 0.00 43.42 42.95 1r4r n LEU 455 CO 0.22 0.10 0.05 0.42 -1.11 0.00 0.00 177.39 177.06 1r4r s THR 456 N 3.53 0.06 0.80 1.96 -4.23 -1.24 -1.79 115.64 114.74 1r4r s THR 456 Ca 0.87 -1.21 -0.14 0.00 -1.18 0.00 0.00 61.69 60.03 1r4r s THR 456 Cb -0.53 -1.72 0.19 0.00 1.34 0.00 0.00 72.50 71.78 1r4r s THR 456 CO 0.42 -0.28 1.02 0.00 -0.54 0.00 0.00 174.62 175.24 1r4r h GLY 458 N -1.52 0.58 0.09 0.00 0.00 -1.94 -3.15 103.07 97.13 1r4r h GLY 458 Ca -0.34 -0.62 0.00 0.00 0.00 0.00 0.00 47.33 46.38 1r4r h GLY 458 CO 0.24 0.56 -0.22 1.76 0.00 0.00 0.00 176.54 178.87 1r4r h SER 459 N 0.21 -0.66 -1.47 0.19 0.02 -1.95 -2.10 113.55 107.80 1r4r h SER 459 Ca 0.03 0.07 0.46 0.00 -0.84 0.00 0.00 61.79 61.51 1r4r h SER 459 Cb 0.81 0.24 -0.11 0.00 0.14 0.00 0.00 62.40 63.47 1r4r h SER 459 CO 0.06 -0.25 0.99 0.00 -1.14 0.00 0.00 176.83 176.49 1r4r n LYS 461 N -4.48 0.00 -0.19 0.00 4.81 -0.80 -1.92 118.16 115.59 1r4r n LYS 461 Ca 0.38 0.50 -0.02 0.00 -0.87 0.00 0.00 58.31 58.30 1r4r n LYS 461 Cb 1.56 -1.43 0.05 0.00 0.02 0.00 0.00 35.03 35.23 1r4r n LYS 461 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1r4r h VAL 462 N 0.00 0.41 -0.55 3.15 2.07 -0.89 -0.17 116.25 120.26 1r4r h VAL 462 Ca 0.00 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.63 1r4r h VAL 462 Cb 0.00 0.41 -0.11 0.00 -1.52 0.00 0.00 31.29 30.07 1r4r h VAL 462 CO 0.00 0.00 -0.19 0.15 0.02 0.00 0.00 177.57 177.55 1r4r h PHE 463 N -0.02 -0.45 0.00 1.57 3.04 -1.38 0.39 116.94 120.09 1r4r h PHE 463 Ca 0.27 0.05 -0.01 0.00 3.98 0.00 0.00 57.97 62.26 1r4r h PHE 463 Cb 0.43 0.28 -0.00 0.00 2.56 0.00 0.00 35.95 39.22 1r4r h PHE 463 CO -0.48 -0.28 -0.07 0.35 -2.02 0.00 0.00 178.31 175.81 1r4r h PHE 464 N -0.06 0.00 0.01 0.41 3.57 -0.36 0.25 116.94 120.76 1r4r h PHE 464 Ca 0.26 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 1r4r h PHE 464 Cb 0.46 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.20 1r4r h PHE 464 CO -0.50 0.07 -0.04 -0.22 -2.23 0.00 0.00 178.31 175.39 1r4r h LYS 465 N 0.00 0.02 -0.38 1.11 3.64 0.38 -3.16 116.57 118.17 1r4r h LYS 465 Ca -0.00 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.26 1r4r h LYS 465 Cb 0.57 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 1r4r h LYS 465 CO 0.01 0.96 -0.14 0.00 -2.27 0.00 0.00 179.45 178.01 1r4r h ARG 466 N -0.91 0.70 0.44 1.90 3.08 -0.27 -2.43 114.38 116.88 1r4r h ARG 466 Ca -0.01 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 59.79 1r4r h ARG 466 Cb 0.98 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.96 1r4r h ARG 466 CO 0.01 0.81 -0.28 0.00 -1.07 0.00 0.00 179.97 179.44 1r4r h ALA 467 N 1.21 -0.68 0.51 0.04 0.00 -0.63 -2.24 119.26 117.48 1r4r h ALA 467 Ca 0.10 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1r4r h ALA 467 Cb 0.60 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1r4r h ALA 467 CO 0.04 -0.90 -0.29 0.28 0.00 0.00 0.00 179.25 178.38 1r4r h VAL 468 N -0.68 0.40 -0.07 0.00 2.07 -1.50 -2.50 116.25 113.97 1r4r h VAL 468 Ca -0.05 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 1r4r h VAL 468 Cb 0.57 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1r4r h VAL 468 CO 0.04 0.00 0.02 -0.62 0.02 0.00 0.00 177.57 177.04 1r4r n GLU 469 N -5.43 1.25 -4.62 1.57 -0.58 -0.92 -4.86 120.64 107.05 1r4r n GLU 469 Ca -0.12 -0.27 -0.24 0.00 -0.42 0.00 0.00 57.16 56.11 1r4r n GLU 469 Cb 0.33 -1.39 -0.16 0.00 -0.57 0.00 0.00 31.44 29.65 1r4r n GLU 469 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1r4r s GLY 470 N 0.27 0.75 0.02 0.62 0.00 -0.84 -5.01 107.32 103.13 1r4r s GLY 470 Ca 0.05 -0.51 -0.30 0.00 0.00 0.00 0.00 44.72 43.96 1r4r s GLY 470 CO 0.01 -0.18 1.79 1.62 0.00 0.00 0.00 173.10 176.34 1r4r s GLN 471 N 0.18 4.16 0.34 2.90 0.74 -1.26 -4.92 119.66 121.80 1r4r s GLN 471 Ca -0.05 2.42 -0.06 0.00 0.05 0.00 0.00 55.36 57.72 1r4r s GLN 471 Cb -0.11 -3.95 0.01 0.00 1.10 0.00 0.00 33.01 30.07 1r4r s GLN 471 CO 0.02 -0.87 0.54 -1.01 -0.55 0.00 0.00 175.29 173.42 1r4r s HIS 472 N 3.83 0.79 -0.49 1.67 3.76 -1.26 -5.08 115.29 118.50 1r4r s HIS 472 Ca 0.80 -1.12 0.06 0.00 -0.15 0.00 0.00 55.06 54.65 1r4r s HIS 472 Cb -0.39 0.13 0.24 0.00 1.11 0.00 0.00 32.58 33.67 1r4r s HIS 472 CO 0.35 -1.20 0.90 -1.71 -0.85 0.00 0.00 174.74 172.23 1r4r n ASN 473 N -1.27 -2.87 -4.63 1.40 2.85 -1.26 -5.11 115.26 104.36 1r4r n ASN 473 Ca -0.01 -3.32 -0.43 0.00 -0.11 0.00 0.00 54.58 50.70 1r4r n ASN 473 Cb 0.61 1.83 -0.02 0.00 1.24 0.00 0.00 39.78 43.44 1r4r n ASN 473 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 1r4r s TYR 474 N 0.67 2.88 -0.10 1.20 2.02 -1.26 -5.02 117.35 117.74 1r4r s TYR 474 Ca 0.32 0.98 0.02 0.00 -0.37 0.00 0.00 57.07 58.02 1r4r s TYR 474 Cb 0.23 -3.88 0.01 0.00 -0.40 0.00 0.00 41.96 37.92 1r4r s TYR 474 CO -0.24 -1.29 -0.17 -1.17 -1.57 0.00 0.00 175.55 171.10 1r4r s LEU 475 N 4.10 1.83 0.53 -1.29 2.96 -1.26 -4.67 118.68 120.89 1r4r s LEU 475 Ca 0.51 -0.45 -0.18 0.00 -0.22 0.00 0.00 54.13 53.79 1r4r s LEU 475 Cb -0.14 -1.15 -0.06 0.00 0.50 0.00 0.00 46.19 45.34 1r4r s LEU 475 CO 0.21 0.06 1.04 0.00 -1.32 0.00 0.00 176.35 176.33 1r4r n ALA 477 N -1.50 3.25 -2.45 0.00 0.00 -1.26 -4.97 120.51 113.59 1r4r n ALA 477 Ca 0.09 -2.70 0.00 0.00 0.00 0.00 0.00 53.44 50.82 1r4r n ALA 477 Cb 0.53 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.36 1r4r n ALA 477 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r4r n GLY 478 N -0.96 3.95 1.39 0.00 0.00 -1.26 -5.07 105.19 103.24 1r4r n GLY 478 Ca 0.23 -0.47 0.02 0.00 0.00 0.00 0.00 46.02 45.80 1r4r n GLY 478 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r4r n ARG 479 N 0.00 1.10 -3.68 1.61 1.74 -1.26 -4.98 116.66 111.20 1r4r n ARG 479 Ca 0.00 -2.84 -0.23 0.00 -0.77 0.00 0.00 57.85 54.01 1r4r n ARG 479 Cb 0.00 -0.97 0.05 0.00 -1.02 0.00 0.00 32.46 30.52 1r4r n ARG 479 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1r4r n ASN 480 N -0.31 -3.07 -1.14 0.55 5.03 -1.26 -4.89 115.26 110.17 1r4r n ASN 480 Ca 0.14 -0.72 -0.01 0.00 0.87 0.00 0.00 54.58 54.86 1r4r n ASN 480 Cb 0.93 -4.41 -0.02 0.00 -1.02 0.00 0.00 39.78 35.26 1r4r n ASN 480 CO 0.00 0.00 0.00 -0.90 -1.83 0.00 0.00 177.26 174.53 1r4r n ASP 481 N -3.01 0.01 -4.73 6.41 5.75 -1.26 -5.09 116.55 114.63 1r4r n ASP 481 Ca -0.17 -1.93 -0.37 0.00 -0.01 0.00 0.00 54.79 52.32 1r4r n ASP 481 Cb 0.62 -0.02 0.06 0.00 -1.03 0.00 0.00 41.12 40.76 1r4r n ASP 481 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1r4r s ILE 483 N -1.41 4.39 -0.14 0.00 -1.09 -1.26 -5.02 121.20 116.67 1r4r s ILE 483 Ca 0.82 1.57 -0.03 0.00 -2.23 0.00 0.00 60.65 60.78 1r4r s ILE 483 Cb -0.37 -3.98 0.05 0.00 -1.58 0.00 0.00 42.46 36.58 1r4r s ILE 483 CO 0.39 0.26 0.04 -0.63 -1.23 0.00 0.00 174.94 173.77 1r4r s ILE 484 N -1.47 0.34 0.00 2.92 1.01 -1.26 -4.74 121.20 118.00 1r4r s ILE 484 Ca 0.44 -0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.85 1r4r s ILE 484 Cb -0.19 -0.76 0.00 0.00 0.01 0.00 0.00 42.46 41.52 1r4r s ILE 484 CO 0.23 -0.06 0.00 0.47 0.00 0.00 0.00 174.94 175.58 1r4r n ASP 485 N 5.13 1.15 0.25 3.58 9.92 -1.25 -4.44 116.55 130.89 1r4r n ASP 485 Ca -0.08 -0.19 -0.16 0.00 -0.53 0.00 0.00 54.79 53.83 1r4r n ASP 485 Cb 0.48 0.00 -0.08 0.00 -0.64 0.00 0.00 41.12 40.88 1r4r n ASP 485 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 1r4r h LYS 486 N 0.00 -0.57 0.01 -1.24 3.64 -1.87 -2.62 116.57 113.92 1r4r h LYS 486 Ca 0.00 0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 1r4r h LYS 486 Cb 0.00 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1r4r h LYS 486 CO 0.00 -0.38 -0.15 0.97 -2.27 0.00 0.00 179.45 177.62 1r4r h ILE 487 N -0.59 1.66 0.00 2.00 2.10 -1.96 -3.33 117.51 117.38 1r4r h ILE 487 Ca -0.06 -2.12 0.00 0.00 1.08 0.00 0.00 64.86 63.76 1r4r h ILE 487 Cb 0.46 3.07 0.00 0.00 -1.09 0.00 0.00 36.82 39.25 1r4r h ILE 487 CO 0.09 0.56 0.00 -1.14 -1.08 0.00 0.00 178.15 176.58 1r4r n ARG 488 N -4.56 0.18 -0.07 2.19 0.63 -1.25 -3.70 116.66 110.07 1r4r n ARG 488 Ca -0.10 0.17 -0.14 0.00 -0.92 0.00 0.00 57.85 56.86 1r4r n ARG 488 Cb 0.49 -1.50 -0.06 0.00 0.45 0.00 0.00 32.46 31.85 1r4r n ARG 488 CO 0.00 0.00 0.00 0.07 -2.51 0.00 0.00 177.63 175.19 1r4r h ARG 489 N 0.00 0.63 -0.61 -0.14 0.11 -1.58 -3.18 114.38 109.62 1r4r h ARG 489 Ca 0.00 -0.39 0.12 0.00 0.10 0.00 0.00 59.98 59.82 1r4r h ARG 489 Cb 0.12 0.04 -0.03 0.00 1.11 0.00 0.00 29.97 31.21 1r4r h ARG 489 CO 0.00 1.00 0.41 0.87 0.10 0.00 0.00 179.97 182.36 1r4r h LYS 490 N 0.33 0.28 0.00 0.08 1.57 -1.81 -3.31 116.57 113.71 1r4r h LYS 490 Ca 0.02 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1r4r h LYS 490 Cb 0.96 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.20 1r4r h LYS 490 CO 0.08 0.18 0.00 0.09 -0.57 0.00 0.00 179.45 179.24 1r4r n ASN 491 N -4.45 0.00 -4.47 0.86 4.13 -1.20 -4.51 115.26 105.62 1r4r n ASN 491 Ca 0.11 0.06 -0.43 0.00 1.68 0.00 0.00 54.58 55.99 1r4r n ASN 491 Cb 0.47 0.00 -0.06 0.00 -1.54 0.00 0.00 39.78 38.65 1r4r n ASN 491 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1r4r h PRO 493 N 9.04 0.64 -0.36 0.00 0.11 -1.81 -2.32 132.00 137.30 1r4r h PRO 493 Ca -0.27 -0.44 0.05 0.00 0.11 0.00 0.00 66.00 65.45 1r4r h PRO 493 Cb 1.09 0.06 -0.04 0.00 0.11 0.00 0.00 31.00 32.22 1r4r h PRO 493 CO 0.98 1.05 0.10 0.00 -0.21 0.00 0.00 178.00 179.93 1r4r h ALA 494 N 0.85 0.41 0.00 -0.75 0.00 -1.86 0.46 119.26 118.37 1r4r h ALA 494 Ca -0.00 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1r4r h ALA 494 Cb 1.18 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1r4r h ALA 494 CO 0.12 -0.30 -0.00 0.00 0.00 0.00 0.00 179.25 179.07 1r4r h ARG 496 N -0.62 0.25 -0.53 0.00 1.12 -1.23 0.72 114.38 114.09 1r4r h ARG 496 Ca -0.00 -0.01 -0.12 0.00 -1.11 0.00 0.00 59.98 58.73 1r4r h ARG 496 Cb 0.62 -0.06 -0.02 0.00 -0.01 0.00 0.00 29.97 30.51 1r4r h ARG 496 CO 0.00 0.16 -0.14 -0.92 -3.11 0.00 0.00 179.97 175.96 1r4r h TYR 497 N 0.26 1.16 0.00 2.20 3.20 -0.97 0.11 116.97 122.94 1r4r h TYR 497 Ca 0.36 -0.25 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 1r4r h TYR 497 Cb 0.58 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 38.57 1r4r h TYR 497 CO -0.26 1.09 -0.01 -0.09 -1.64 0.00 0.00 178.16 177.24 1r4r h ARG 498 N 0.90 0.00 0.14 1.82 2.43 0.75 0.18 114.38 120.61 1r4r h ARG 498 Ca 0.13 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 58.99 1r4r h ARG 498 Cb 0.72 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 1r4r h ARG 498 CO 0.06 0.01 -1.50 0.87 -1.51 0.00 0.00 179.97 177.90 1r4r h LYS 499 N 0.00 0.30 -1.95 0.20 1.57 0.19 -2.29 116.57 114.59 1r4r h LYS 499 Ca -0.00 -0.52 -0.08 0.00 -1.87 0.00 0.00 60.65 58.18 1r4r h LYS 499 Cb 0.06 0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 1r4r h LYS 499 CO 0.00 1.19 -0.01 0.00 -0.57 0.00 0.00 179.45 180.06 1r4r n LEU 501 N 1.53 0.00 -0.04 0.00 -0.00 -1.09 -4.78 117.00 112.61 1r4r n LEU 501 Ca 0.12 0.00 -0.14 0.00 -0.00 0.00 0.00 56.01 55.99 1r4r n LEU 501 Cb 0.58 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.98 1r4r n LEU 501 CO 0.07 0.00 0.39 -0.61 -0.00 0.00 0.00 177.39 177.24 1r4r h GLN 502 N 0.00 0.76 -2.66 1.96 -0.00 -1.22 -3.34 115.11 110.60 1r4r h GLN 502 Ca 0.00 -0.52 -0.80 0.00 -0.00 0.00 0.00 58.65 57.33 1r4r h GLN 502 Cb 0.00 0.08 -0.24 0.00 0.00 0.00 0.00 27.48 27.32 1r4r h GLN 502 CO 0.00 1.15 1.24 0.00 0.00 0.00 0.00 178.83 181.21 1r4r n ALA 503 N -2.56 5.79 -0.62 3.38 0.00 -1.05 -4.95 120.51 120.50 1r4r n ALA 503 Ca -0.05 -4.58 0.00 0.00 0.00 0.00 0.00 53.44 48.81 1r4r n ALA 503 Cb 0.66 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.71 1r4r n ALA 503 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r4r n GLY 504 N 0.95 1.03 0.37 0.00 0.00 -1.26 -4.76 105.19 101.53 1r4r n GLY 504 Ca 0.41 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.89 1r4r n GLY 504 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1r4r n MET 505 N 0.00 0.00 -4.26 1.61 0.00 -1.26 -4.73 117.12 108.48 1r4r n MET 505 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 57.70 57.44 1r4r n MET 505 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 33.22 33.14 1r4r n MET 505 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 1r4r s ASN 506 N 0.00 4.50 -0.08 6.12 3.84 0.93 -4.62 114.94 125.64 1r4r s ASN 506 Ca 0.00 -0.52 0.20 0.00 0.21 0.00 0.00 52.86 52.75 1r4r s ASN 506 Cb 0.00 -0.85 -0.29 0.00 -0.55 0.00 0.00 41.25 39.55 1r4r s ASN 506 CO 0.00 0.08 0.36 -0.11 -2.79 0.00 0.00 177.10 174.63 1r4r n LEU 507 N -0.19 0.05 -0.85 3.21 7.94 -1.26 -4.61 117.00 121.29 1r4r n LEU 507 Ca -0.10 0.02 0.00 0.00 -1.11 0.00 0.00 56.01 54.83 1r4r n LEU 507 Cb 0.56 0.19 0.00 0.00 0.53 0.00 0.00 43.42 44.70 1r4r n LEU 507 CO 0.37 0.19 -0.18 -0.62 -1.11 0.00 0.00 177.39 176.04 1r4r n GLU 508 N -2.47 -2.05 -1.46 1.96 -0.58 -1.26 -4.95 120.64 109.82 1r4r n GLU 508 Ca -0.15 1.58 -0.48 0.00 -0.42 0.00 0.00 57.16 57.69 1r4r n GLU 508 Cb 0.80 -1.61 -0.03 0.00 -0.57 0.00 0.00 31.44 30.03 1r4r n GLU 508 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1r4r n ALA 509 N 0.18 -2.18 -0.22 0.62 0.00 -1.26 -5.29 120.51 112.36 1r4r n ALA 509 Ca 0.00 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1r4r n ALA 509 Cb 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 19.45 17.71 1r4r n ALA 509 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04