#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g9i n HIS 438 N 0.00 1.91 -3.89 0.66 -0.00 -1.26 -5.00 115.22 107.64 3g9i n HIS 438 Ca 0.00 -3.31 -0.27 0.00 -0.00 0.00 0.00 57.72 54.14 3g9i n HIS 438 Cb 0.00 -0.34 -0.17 0.00 -0.00 0.00 0.00 29.99 29.48 3g9i n HIS 438 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.34 177.75 3g9i s MET 439 N -3.11 1.43 0.11 -0.41 1.75 -1.26 -1.42 119.30 116.40 3g9i s MET 439 Ca 0.39 -0.27 -0.35 0.00 -1.25 0.00 0.00 55.69 54.21 3g9i s MET 439 Cb 0.39 -1.62 -0.14 0.00 2.84 0.00 0.00 34.83 36.30 3g9i s MET 439 CO -0.07 -0.30 1.56 0.00 -0.65 0.00 0.00 175.02 175.55 3g9i n LEU 441 N 3.53 0.57 -0.10 0.00 4.77 -0.23 -0.58 117.00 124.97 3g9i n LEU 441 Ca 0.18 0.61 -0.24 0.00 -0.03 0.00 0.00 56.01 56.53 3g9i n LEU 441 Cb 0.26 -0.49 -0.12 0.00 -2.33 0.00 0.00 43.42 40.75 3g9i n LEU 441 CO 0.64 -0.38 -0.95 0.52 -1.33 0.00 0.00 177.39 175.90 3g9i n VAL 442 N -2.09 1.57 -0.00 4.08 0.31 -1.26 -4.75 118.33 116.19 3g9i n VAL 442 Ca 0.04 -0.30 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 3g9i n VAL 442 Cb 0.28 -1.87 0.00 0.00 -0.91 0.00 0.00 33.84 31.34 3g9i n VAL 442 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3g9i n SER 444 N -0.01 -5.04 -3.74 0.00 7.64 0.26 -3.10 113.62 109.63 3g9i n SER 444 Ca 0.00 0.04 -0.30 0.00 1.01 0.00 0.00 58.87 59.62 3g9i n SER 444 Cb 0.00 -2.69 0.24 0.00 -1.01 0.00 0.00 64.21 60.76 3g9i n SER 444 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3g9i s ASP 445 N -2.10 0.80 0.08 6.43 2.15 -1.26 -4.53 116.67 118.25 3g9i s ASP 445 Ca 0.00 0.58 -0.30 0.00 0.43 0.00 0.00 52.55 53.26 3g9i s ASP 445 Cb 0.00 -0.79 -0.05 0.00 -0.30 0.00 0.00 42.92 41.78 3g9i s ASP 445 CO 0.00 -4.19 1.07 -0.70 -0.17 0.00 0.00 175.17 171.18 3g9i s GLU 446 N -5.45 4.55 0.19 4.34 2.12 -1.26 -0.23 118.70 122.97 3g9i s GLU 446 Ca 0.71 1.60 -0.17 0.00 0.36 0.00 0.00 54.97 57.48 3g9i s GLU 446 Cb -0.09 -3.37 -0.08 0.00 0.26 0.00 0.00 34.13 30.86 3g9i s GLU 446 CO 0.56 -0.03 0.64 0.00 -0.54 0.00 0.00 175.26 175.88 3g9i s ALA 447 N 0.54 3.49 -2.41 6.30 0.00 -0.50 -4.48 121.76 124.70 3g9i s ALA 447 Ca 0.52 0.01 0.22 0.00 0.00 0.00 0.00 51.96 52.72 3g9i s ALA 447 Cb -0.26 -2.67 0.09 0.00 0.00 0.00 0.00 23.12 20.28 3g9i s ALA 447 CO 0.30 0.39 1.14 -1.13 0.00 0.00 0.00 175.76 176.46 3g9i n SER 448 N 0.70 2.45 0.00 0.00 3.41 -0.51 -4.79 113.62 114.87 3g9i n SER 448 Ca -0.03 -1.72 0.00 0.00 -0.26 0.00 0.00 58.87 56.85 3g9i n SER 448 Cb 0.52 0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.70 3g9i n SER 448 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g9i n GLY 449 N 1.33 0.33 3.53 5.00 0.00 -1.21 -5.02 105.19 109.14 3g9i n GLY 449 Ca 0.11 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 3g9i n GLY 449 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g9i s HIS 451 N 2.44 2.78 -1.50 0.00 3.76 0.97 -4.65 115.29 119.09 3g9i s HIS 451 Ca 0.18 -1.23 -0.06 0.00 -0.15 0.00 0.00 55.06 53.80 3g9i s HIS 451 Cb -0.15 -1.91 0.02 0.00 1.11 0.00 0.00 32.58 31.64 3g9i s HIS 451 CO 0.15 -0.59 0.63 0.66 -0.85 0.00 0.00 174.74 174.74 3g9i n TYR 452 N 4.29 -2.00 0.00 1.40 4.01 -1.26 -2.03 117.16 121.56 3g9i n TYR 452 Ca -0.20 0.55 0.00 0.00 -0.16 0.00 0.00 57.90 58.09 3g9i n TYR 452 Cb 0.51 -4.26 0.00 0.00 -0.31 0.00 0.00 39.34 35.28 3g9i n TYR 452 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3g9i n GLY 453 N -1.50 0.16 3.02 2.72 0.00 -1.26 -0.83 105.19 107.50 3g9i n GLY 453 Ca -0.09 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.77 3g9i n GLY 453 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g9i s VAL 454 N -2.00 0.59 -0.25 1.61 1.01 -0.86 -4.91 120.40 115.58 3g9i s VAL 454 Ca 0.00 -0.57 -0.29 0.00 0.00 0.00 0.00 61.98 61.12 3g9i s VAL 454 Cb 0.00 -0.54 -0.02 0.00 0.00 0.00 0.00 36.38 35.81 3g9i s VAL 454 CO 0.00 -0.01 1.69 -0.22 0.00 0.00 0.00 175.10 176.55 3g9i s LEU 455 N -0.65 3.76 0.19 3.92 0.20 -1.26 -0.02 118.68 124.83 3g9i s LEU 455 Ca -0.01 1.52 -0.03 0.00 0.69 0.00 0.00 54.13 56.30 3g9i s LEU 455 Cb -0.05 -3.53 -0.03 0.00 -0.43 0.00 0.00 46.19 42.15 3g9i s LEU 455 CO 0.00 -1.41 0.17 0.42 -0.29 0.00 0.00 176.35 175.24 3g9i s THR 456 N 5.77 0.03 0.76 3.68 -4.23 -0.62 -1.06 115.64 119.97 3g9i s THR 456 Ca 0.75 -1.86 -0.08 0.00 -1.18 0.00 0.00 61.69 59.32 3g9i s THR 456 Cb -0.24 -2.32 0.09 0.00 1.34 0.00 0.00 72.50 71.37 3g9i s THR 456 CO 0.31 -0.12 1.08 0.00 -0.54 0.00 0.00 174.62 175.36 3g9i h GLY 458 N -0.82 0.84 1.34 0.00 0.00 -1.95 -1.65 103.07 100.84 3g9i h GLY 458 Ca -0.44 -0.60 -0.16 0.00 0.00 0.00 0.00 47.33 46.13 3g9i h GLY 458 CO 0.55 0.56 -0.46 1.48 0.00 0.00 0.00 176.54 178.67 3g9i h SER 459 N 0.72 0.77 0.00 0.19 4.64 -1.96 -2.17 113.55 115.73 3g9i h SER 459 Ca 0.13 -0.37 -0.19 0.00 -0.47 0.00 0.00 61.79 60.89 3g9i h SER 459 Cb 0.53 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3g9i h SER 459 CO 0.03 1.11 -0.66 0.00 -0.87 0.00 0.00 176.83 176.44 3g9i h LYS 461 N 0.45 -0.35 0.00 0.00 3.64 -1.12 -1.46 116.57 117.73 3g9i h LYS 461 Ca -0.02 0.02 -0.19 0.00 -1.27 0.00 0.00 60.65 59.20 3g9i h LYS 461 Cb 1.24 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.12 3g9i h LYS 461 CO 0.13 -0.23 -0.87 -0.24 -2.27 0.00 0.00 179.45 175.96 3g9i h VAL 462 N -0.37 1.59 -0.82 2.00 3.04 -1.37 -2.60 116.25 117.73 3g9i h VAL 462 Ca 0.10 -2.89 0.02 0.00 -1.01 0.00 0.00 66.70 62.92 3g9i h VAL 462 Cb 0.51 2.58 -0.05 0.00 -2.01 0.00 0.00 31.29 32.32 3g9i h VAL 462 CO -0.33 0.83 0.53 0.15 -1.01 0.00 0.00 177.57 177.75 3g9i h PHE 463 N 0.02 1.01 -0.15 3.17 3.04 -1.15 -1.29 116.94 121.58 3g9i h PHE 463 Ca -0.02 0.03 -0.05 0.00 3.98 0.00 0.00 57.97 61.91 3g9i h PHE 463 Cb 1.53 -0.34 -0.00 0.00 2.56 0.00 0.00 35.95 39.70 3g9i h PHE 463 CO 0.01 0.60 -0.09 0.35 -2.02 0.00 0.00 178.31 177.15 3g9i h PHE 464 N 1.06 0.39 -0.34 0.41 3.57 -1.04 -0.23 116.94 120.75 3g9i h PHE 464 Ca 0.32 -0.10 0.04 0.00 3.53 0.00 0.00 57.97 61.76 3g9i h PHE 464 Cb -0.04 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.58 3g9i h PHE 464 CO -0.02 0.68 0.12 -0.22 -2.23 0.00 0.00 178.31 176.64 3g9i h LYS 465 N -0.01 0.27 -0.83 1.11 1.63 -1.40 -1.78 116.57 115.56 3g9i h LYS 465 Ca 0.03 -0.02 0.02 0.00 -0.85 0.00 0.00 60.65 59.83 3g9i h LYS 465 Cb 0.58 -0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 32.11 3g9i h LYS 465 CO 0.03 0.18 0.54 0.00 -3.45 0.00 0.00 179.45 176.75 3g9i h ARG 466 N 0.27 1.06 -0.47 1.90 3.08 -1.10 -1.22 114.38 117.90 3g9i h ARG 466 Ca 0.15 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.12 3g9i h ARG 466 Cb 0.12 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 3g9i h ARG 466 CO -0.15 0.70 0.20 0.00 -1.07 0.00 0.00 179.97 179.64 3g9i h ALA 467 N 1.32 0.61 -0.12 0.04 0.00 -0.59 0.28 119.26 120.81 3g9i h ALA 467 Ca 0.31 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 3g9i h ALA 467 Cb -0.08 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.53 3g9i h ALA 467 CO -0.08 0.20 -0.40 0.28 0.00 0.00 0.00 179.25 179.24 3g9i h VAL 468 N 0.61 1.37 -0.03 0.00 2.07 -1.22 -1.16 116.25 117.90 3g9i h VAL 468 Ca 0.16 -1.72 -0.23 0.00 0.82 0.00 0.00 66.70 65.73 3g9i h VAL 468 Cb 0.17 2.14 0.01 0.00 -1.52 0.00 0.00 31.29 32.09 3g9i h VAL 468 CO -0.01 0.51 -0.90 -0.33 0.02 0.00 0.00 177.57 176.85 3g9i h GLU 469 N 0.07 0.50 0.00 1.57 5.08 -1.16 -1.68 114.58 118.96 3g9i h GLU 469 Ca -0.02 -0.50 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 3g9i h GLU 469 Cb 1.03 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3g9i h GLU 469 CO 0.09 1.14 0.00 0.41 -1.00 0.00 0.00 179.01 179.64 3g9i n GLY 470 N 0.88 -1.44 2.43 -3.84 0.00 0.08 -4.90 105.19 98.39 3g9i n GLY 470 Ca -0.07 -0.09 -0.04 0.00 0.00 0.00 0.00 46.02 45.82 3g9i n GLY 470 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g9i n GLN 471 N -1.52 -2.69 -1.12 1.61 10.64 -0.45 -4.89 117.38 118.96 3g9i n GLN 471 Ca 0.07 0.18 -0.31 0.00 -1.83 0.00 0.00 57.00 55.11 3g9i n GLN 471 Cb 0.32 -4.69 0.12 0.00 -0.86 0.00 0.00 30.24 25.13 3g9i n GLN 471 CO 0.00 0.00 0.00 -3.38 -1.83 0.00 0.00 177.06 171.85 3g9i s HIS 472 N -2.14 2.31 -0.32 2.61 -3.43 -1.12 -4.99 115.29 108.20 3g9i s HIS 472 Ca 0.00 1.55 -0.03 0.00 -0.80 0.00 0.00 55.06 55.78 3g9i s HIS 472 Cb 0.00 -3.13 0.06 0.00 -1.43 0.00 0.00 32.58 28.08 3g9i s HIS 472 CO 0.00 -2.16 0.05 -0.80 -2.00 0.00 0.00 174.74 169.84 3g9i s ASN 473 N -3.23 5.04 0.32 7.38 0.01 -1.26 -4.96 114.94 118.24 3g9i s ASN 473 Ca 0.63 -1.35 -0.01 0.00 -0.71 0.00 0.00 52.86 51.41 3g9i s ASN 473 Cb -0.19 -1.77 -0.04 0.00 0.41 0.00 0.00 41.25 39.67 3g9i s ASN 473 CO 0.57 -0.32 0.54 -0.31 -1.51 0.00 0.00 177.10 176.08 3g9i s TYR 474 N 1.27 3.50 -0.05 2.20 2.02 -1.26 -5.10 117.35 119.93 3g9i s TYR 474 Ca -0.02 0.46 0.02 0.00 -0.37 0.00 0.00 57.07 57.15 3g9i s TYR 474 Cb -0.20 -1.97 0.01 0.00 -0.40 0.00 0.00 41.96 39.40 3g9i s TYR 474 CO -0.01 0.14 -0.09 -1.17 -1.57 0.00 0.00 175.55 172.86 3g9i s LEU 475 N -4.01 1.56 0.33 -1.29 2.96 -1.26 -4.81 118.68 112.16 3g9i s LEU 475 Ca 0.41 -0.21 -0.27 0.00 -0.22 0.00 0.00 54.13 53.84 3g9i s LEU 475 Cb -0.10 -0.63 -0.09 0.00 0.50 0.00 0.00 46.19 45.87 3g9i s LEU 475 CO 0.34 0.01 1.08 0.00 -1.32 0.00 0.00 176.35 176.46 3g9i n ALA 477 N 0.69 2.46 -2.00 0.00 0.00 -1.26 -4.88 120.51 115.52 3g9i n ALA 477 Ca 0.01 -0.70 0.00 0.00 0.00 0.00 0.00 53.44 52.75 3g9i n ALA 477 Cb 0.47 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 19.09 3g9i n ALA 477 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g9i n GLY 478 N 1.35 0.50 0.75 0.00 0.00 -1.26 -5.04 105.19 101.49 3g9i n GLY 478 Ca 0.15 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.17 3g9i n GLY 478 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g9i n ARG 479 N 0.00 0.00 -2.18 1.61 1.74 -1.26 -4.98 116.66 111.59 3g9i n ARG 479 Ca 0.00 -1.21 -0.20 0.00 -0.77 0.00 0.00 57.85 55.67 3g9i n ARG 479 Cb 0.00 -0.35 -0.03 0.00 -1.02 0.00 0.00 32.46 31.06 3g9i n ARG 479 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3g9i n ASN 480 N 0.12 -5.58 -2.61 0.55 3.02 -1.26 -4.87 115.26 104.63 3g9i n ASN 480 Ca 0.01 0.10 -0.00 0.00 -0.03 0.00 0.00 54.58 54.66 3g9i n ASN 480 Cb 0.80 -4.66 0.06 0.00 -0.61 0.00 0.00 39.78 35.37 3g9i n ASN 480 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 3g9i n ASP 481 N -1.62 0.73 -4.75 6.41 3.85 -1.26 -5.01 116.55 114.89 3g9i n ASP 481 Ca -0.23 -2.06 -0.36 0.00 -0.71 0.00 0.00 54.79 51.43 3g9i n ASP 481 Cb 0.67 -0.17 0.04 0.00 -1.35 0.00 0.00 41.12 40.32 3g9i n ASP 481 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3g9i s ILE 483 N -1.52 4.35 -0.34 0.00 1.01 -1.26 -4.99 121.20 118.46 3g9i s ILE 483 Ca 0.78 1.67 -0.02 0.00 0.00 0.00 0.00 60.65 63.07 3g9i s ILE 483 Cb -0.33 -4.07 0.07 0.00 0.01 0.00 0.00 42.46 38.14 3g9i s ILE 483 CO 0.36 -0.00 0.08 -0.63 0.00 0.00 0.00 174.94 174.74 3g9i s ILE 484 N 2.19 3.14 0.33 2.92 -1.09 -1.26 -4.60 121.20 122.82 3g9i s ILE 484 Ca 0.54 -1.60 0.07 0.00 -2.23 0.00 0.00 60.65 57.43 3g9i s ILE 484 Cb -0.23 -2.93 -0.03 0.00 -1.58 0.00 0.00 42.46 37.69 3g9i s ILE 484 CO 0.21 -0.31 0.28 1.51 -1.23 0.00 0.00 174.94 175.39 3g9i s ASP 485 N 1.44 1.63 0.32 3.58 1.47 -1.26 -4.37 116.67 119.47 3g9i s ASP 485 Ca -0.00 -1.75 0.10 0.00 1.18 0.00 0.00 52.55 52.08 3g9i s ASP 485 Cb -0.21 0.55 0.93 0.00 -0.34 0.00 0.00 42.92 43.85 3g9i s ASP 485 CO -0.02 -1.06 1.71 0.50 0.68 0.00 0.00 175.17 176.98 3g9i h LYS 486 N 2.15 0.49 0.08 2.11 3.64 -1.88 0.93 116.57 124.09 3g9i h LYS 486 Ca -0.25 -0.03 -0.37 0.00 -1.27 0.00 0.00 60.65 58.73 3g9i h LYS 486 Cb 1.23 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.91 3g9i h LYS 486 CO 0.37 0.32 -2.09 1.51 -2.27 0.00 0.00 179.45 177.29 3g9i n ILE 487 N -4.94 1.68 0.61 2.00 3.06 -1.26 -4.37 119.36 116.15 3g9i n ILE 487 Ca 0.28 -0.58 0.10 0.00 -2.50 0.00 0.00 62.75 60.05 3g9i n ILE 487 Cb 0.80 -1.68 0.43 0.00 0.54 0.00 0.00 39.64 39.73 3g9i n ILE 487 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 3g9i n ARG 488 N -3.52 0.07 0.28 9.51 1.74 -0.67 -3.04 116.66 121.04 3g9i n ARG 488 Ca -0.36 0.22 0.15 0.00 -0.77 0.00 0.00 57.85 57.09 3g9i n ARG 488 Cb 1.00 -1.61 0.85 0.00 -1.02 0.00 0.00 32.46 31.68 3g9i n ARG 488 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 3g9i h ARG 489 N 0.00 0.00 0.00 5.56 0.11 -1.05 -0.61 114.38 118.39 3g9i h ARG 489 Ca 0.00 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.05 3g9i h ARG 489 Cb 0.39 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.46 3g9i h ARG 489 CO 0.00 0.06 -0.12 0.87 0.10 0.00 0.00 179.97 180.88 3g9i h LYS 490 N 0.00 0.00 0.10 0.08 1.57 -1.81 -3.32 116.57 113.19 3g9i h LYS 490 Ca -0.00 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.49 3g9i h LYS 490 Cb 0.22 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.55 3g9i h LYS 490 CO 0.01 0.12 -1.20 -0.91 -0.57 0.00 0.00 179.45 176.90 3g9i h ASN 491 N 0.00 0.88 -3.63 0.86 4.21 -1.33 -3.42 115.58 113.15 3g9i h ASN 491 Ca -0.00 -0.81 -0.62 0.00 1.21 0.00 0.00 56.30 56.08 3g9i h ASN 491 Cb 0.62 -0.27 -0.40 0.00 -1.12 0.00 0.00 38.32 37.15 3g9i h ASN 491 CO 0.02 1.59 -0.72 0.00 -1.29 0.00 0.00 177.43 177.03 3g9i h PRO 493 N 6.66 0.28 0.03 0.00 0.11 -1.82 0.92 132.00 138.19 3g9i h PRO 493 Ca -0.02 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 3g9i h PRO 493 Cb 0.92 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.97 3g9i h PRO 493 CO 0.52 0.19 -0.02 0.00 -0.21 0.00 0.00 178.00 178.48 3g9i h ALA 494 N 1.83 -0.05 -0.02 -0.75 0.00 -1.87 0.99 119.26 119.40 3g9i h ALA 494 Ca 0.12 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.77 3g9i h ALA 494 Cb 0.12 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3g9i h ALA 494 CO -0.02 -0.47 -0.84 0.00 0.00 0.00 0.00 179.25 177.92 3g9i h ARG 496 N 0.17 0.17 -0.22 0.00 2.43 -0.74 -0.47 114.38 115.72 3g9i h ARG 496 Ca -0.05 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 3g9i h ARG 496 Cb 1.45 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.95 3g9i h ARG 496 CO 0.13 0.18 0.14 -0.92 -1.51 0.00 0.00 179.97 177.99 3g9i h TYR 497 N 0.11 0.26 -0.22 2.20 3.20 -0.73 -1.48 116.97 120.31 3g9i h TYR 497 Ca 0.04 0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.97 3g9i h TYR 497 Cb 0.06 -0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.19 3g9i h TYR 497 CO -0.05 0.16 -0.13 -0.09 -1.64 0.00 0.00 178.16 176.41 3g9i h ARG 498 N 0.28 -0.11 -0.84 1.82 2.43 -0.91 -1.11 114.38 115.94 3g9i h ARG 498 Ca 0.08 0.01 0.12 0.00 -0.81 0.00 0.00 59.98 59.38 3g9i h ARG 498 Cb -0.02 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.49 3g9i h ARG 498 CO -0.03 -0.08 0.55 0.87 -1.51 0.00 0.00 179.97 179.77 3g9i h LYS 499 N -0.12 0.66 -0.12 0.20 1.57 -0.78 0.70 116.57 118.69 3g9i h LYS 499 Ca 0.12 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3g9i h LYS 499 Cb 0.30 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 3g9i h LYS 499 CO -0.29 0.44 0.06 0.00 -0.57 0.00 0.00 179.45 179.09 3g9i h LEU 501 N 0.08 0.99 -1.02 0.00 3.38 -0.69 -1.24 115.31 116.82 3g9i h LEU 501 Ca 0.04 -0.33 -0.08 0.00 0.09 0.00 0.00 57.88 57.59 3g9i h LEU 501 Cb 0.09 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3g9i h LEU 501 CO -0.01 1.09 -0.18 1.56 0.09 0.00 0.00 178.44 180.99 3g9i h GLN 502 N 0.87 0.50 0.00 1.13 4.20 -0.73 -1.71 115.11 119.36 3g9i h GLN 502 Ca 0.15 -0.16 0.00 0.00 0.06 0.00 0.00 58.65 58.69 3g9i h GLN 502 Cb 0.62 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.35 3g9i h GLN 502 CO 0.04 0.66 0.00 0.00 -0.67 0.00 0.00 178.83 178.86 3g9i n ALA 503 N -2.48 1.74 0.00 3.87 0.00 0.26 -4.87 120.51 119.02 3g9i n ALA 503 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3g9i n ALA 503 Cb 0.36 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.55 3g9i n ALA 503 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g9i n GLY 504 N 0.15 1.08 3.76 0.00 0.00 -0.64 -4.89 105.19 104.65 3g9i n GLY 504 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 3g9i n GLY 504 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3g9i s MET 505 N -0.79 4.24 -0.21 1.61 -1.94 -0.50 -4.77 119.30 116.95 3g9i s MET 505 Ca 0.00 2.38 -0.09 0.00 -1.71 0.00 0.00 55.69 56.26 3g9i s MET 505 Cb 0.00 -3.05 0.08 0.00 2.01 0.00 0.00 34.83 33.87 3g9i s MET 505 CO 0.00 -0.40 0.47 1.21 -0.01 0.00 0.00 175.02 176.29 3g9i s ASN 506 N -0.03 -0.52 0.53 3.03 3.04 -0.01 -4.68 114.94 116.29 3g9i s ASN 506 Ca 0.55 1.08 0.20 0.00 0.04 0.00 0.00 52.86 54.72 3g9i s ASN 506 Cb -0.43 1.23 1.38 0.00 -1.54 0.00 0.00 41.25 41.89 3g9i s ASN 506 CO 0.52 -0.22 2.15 -0.07 -3.04 0.00 0.00 177.10 176.45 3g9i h LEU 507 N 7.62 0.00 -5.02 3.21 4.07 -1.95 -1.96 115.31 121.29 3g9i h LEU 507 Ca -0.26 0.00 -0.71 0.00 0.08 0.00 0.00 57.88 56.99 3g9i h LEU 507 Cb 1.15 0.00 -0.32 0.00 1.08 0.00 0.00 40.66 42.57 3g9i h LEU 507 CO 0.19 0.03 0.47 -0.62 -1.08 0.00 0.00 178.44 177.43 3g9i n GLU 508 N -4.30 3.26 0.10 1.13 1.02 -1.26 -4.60 120.64 115.99 3g9i n GLU 508 Ca -0.03 -3.99 -0.19 0.00 -0.02 0.00 0.00 57.16 52.93 3g9i n GLU 508 Cb 0.11 -2.28 -0.12 0.00 -0.02 0.00 0.00 31.44 29.12 3g9i n GLU 508 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3g9i h ALA 509 N 3.01 0.06 -0.10 0.62 0.00 -1.64 -3.12 119.26 118.09 3g9i h ALA 509 Ca 0.47 -0.82 -0.05 0.00 0.00 0.00 0.00 54.91 54.51 3g9i h ALA 509 Cb 0.33 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 3g9i h ALA 509 CO 1.21 0.81 -0.12 -0.09 0.00 0.00 0.00 179.25 181.06 3g9i h ARG 510 N 0.17 0.26 0.00 0.00 2.43 -1.84 -2.95 114.38 112.45 3g9i h ARG 510 Ca -0.17 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 58.86 3g9i h ARG 510 Cb 1.93 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 31.49 3g9i h ARG 510 CO 0.22 0.70 -0.00 0.87 -1.51 0.00 0.00 179.97 180.25 3g9i h LYS 511 N -0.16 0.00 -2.67 0.20 1.57 -1.90 -2.37 116.57 111.25 3g9i h LYS 511 Ca 0.01 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.22 3g9i h LYS 511 Cb 0.66 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.94 3g9i h LYS 511 CO 0.03 0.00 2.53 2.41 -0.57 0.00 0.00 179.45 183.85 3g9i n THR 512 N -3.20 4.17 -1.03 -0.16 -1.04 -1.11 -3.73 114.28 108.17 3g9i n THR 512 Ca -0.03 -2.71 0.06 0.00 -2.04 0.00 0.00 64.05 59.33 3g9i n THR 512 Cb 0.08 -2.33 0.29 0.00 -1.82 0.00 0.00 70.33 66.55 3g9i n THR 512 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 3g9i n LYS 513 N 2.86 3.26 -1.51 -2.82 5.02 -0.89 -5.00 118.16 119.07 3g9i n LYS 513 Ca 0.67 -2.96 -0.51 0.00 -2.02 0.00 0.00 58.31 53.49 3g9i n LYS 513 Cb 0.39 -1.96 -0.07 0.00 -0.02 0.00 0.00 35.03 33.38 3g9i n LYS 513 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3g9i n LYS 514 N -0.33 1.27 0.00 1.97 4.76 -1.24 -5.22 118.16 119.36 3g9i n LYS 514 Ca 0.26 0.38 0.00 0.00 -2.87 0.00 0.00 58.31 56.08 3g9i n LYS 514 Cb 1.01 -2.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.72 3g9i n LYS 514 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39