#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i5h s SER 451 N 0.00 4.75 1.17 1.61 1.04 -1.26 -5.00 113.70 116.01 1i5h s SER 451 Ca 0.00 2.61 -0.18 0.00 0.48 0.00 0.00 55.95 58.85 1i5h s SER 451 Cb 0.00 -2.62 0.27 0.00 0.10 0.00 0.00 66.02 63.77 1i5h s SER 451 CO 0.00 -1.90 1.12 -2.16 0.98 0.00 0.00 173.24 171.28 1i5h s PRO 452 N -3.32 -0.95 0.32 4.02 0.04 -1.26 -4.96 135.00 128.89 1i5h s PRO 452 Ca 0.81 -0.03 0.17 0.00 0.04 0.00 0.00 61.00 61.99 1i5h s PRO 452 Cb -0.37 -1.63 0.21 0.00 0.04 0.00 0.00 34.50 32.75 1i5h s PRO 452 CO 0.39 -3.54 1.52 -0.39 0.04 0.00 0.00 177.00 175.02 1i5h h VAL 453 N -2.46 0.70 -1.24 -0.36 -1.51 -2.07 -3.46 116.25 105.85 1i5h h VAL 453 Ca -0.46 -1.91 0.16 0.00 -1.23 0.00 0.00 66.70 63.27 1i5h h VAL 453 Cb 1.29 2.28 -0.31 0.00 -2.13 0.00 0.00 31.29 32.43 1i5h h VAL 453 CO 0.37 0.39 0.65 -0.62 -1.23 0.00 0.00 177.57 177.13 1i5h s ASP 454 N -6.39 -0.22 0.26 4.19 -1.08 -1.26 -5.08 116.67 107.09 1i5h s ASP 454 Ca 0.04 0.36 0.00 0.00 -0.52 0.00 0.00 52.55 52.43 1i5h s ASP 454 Cb 0.07 0.88 0.00 0.00 -1.46 0.00 0.00 42.92 42.41 1i5h s ASP 454 CO 0.72 -0.06 0.00 -1.54 0.52 0.00 0.00 175.17 174.81 1i5h n SER 455 N 2.87 -2.34 0.00 -0.34 3.41 -1.26 -5.09 113.62 110.86 1i5h n SER 455 Ca -0.16 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.07 1i5h n SER 455 Cb 0.57 2.36 0.00 0.00 -0.26 0.00 0.00 64.21 66.88 1i5h n SER 455 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1i5h n ASN 456 N -3.10 0.00 -2.92 4.04 4.05 -1.26 -4.91 115.26 111.16 1i5h n ASN 456 Ca 0.00 0.00 -0.01 0.00 0.45 0.00 0.00 54.58 55.02 1i5h n ASN 456 Cb 0.00 0.25 -0.00 0.00 1.23 0.00 0.00 39.78 41.25 1i5h n ASN 456 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 1i5h n ASP 457 N -1.96 -6.66 -0.01 1.20 9.92 -1.26 -4.97 116.55 112.81 1i5h n ASP 457 Ca 0.00 0.99 -0.00 0.00 -0.53 0.00 0.00 54.79 55.24 1i5h n ASP 457 Cb 0.00 -3.54 -0.04 0.00 -0.64 0.00 0.00 41.12 36.91 1i5h n ASP 457 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1i5h n LEU 458 N 1.21 0.00 0.00 0.64 4.77 -1.26 -5.13 117.00 117.23 1i5h n LEU 458 Ca -0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1i5h n LEU 458 Cb 0.26 0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1i5h n LEU 458 CO 0.23 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 1i5h n GLY 459 N 2.51 -0.15 3.35 -0.72 0.00 -1.26 -4.60 105.19 104.32 1i5h n GLY 459 Ca -0.05 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 1i5h n GLY 459 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1i5h n PRO 460 N 0.84 0.66 -1.21 1.61 -0.04 -1.26 -4.77 135.00 130.84 1i5h n PRO 460 Ca 0.00 -1.44 0.15 0.00 -0.04 0.00 0.00 63.50 62.18 1i5h n PRO 460 Cb 0.00 -2.80 -0.06 0.00 -0.04 0.00 0.00 33.50 30.60 1i5h n PRO 460 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1i5h n LEU 461 N 9.26 -0.73 -4.61 1.53 4.77 -1.26 -4.91 117.00 121.04 1i5h n LEU 461 Ca 0.48 1.68 -0.30 0.00 -0.03 0.00 0.00 56.01 57.84 1i5h n LEU 461 Cb 0.42 -3.89 0.24 0.00 -2.33 0.00 0.00 43.42 37.86 1i5h n LEU 461 CO 1.08 -2.51 0.64 -2.84 -1.33 0.00 0.00 177.39 172.43 1i5h s PRO 462 N -3.07 -1.22 -0.06 3.23 0.02 -1.26 -4.94 135.00 127.70 1i5h s PRO 462 Ca 0.00 -0.14 -0.30 0.00 0.02 0.00 0.00 61.00 60.58 1i5h s PRO 462 Cb 0.00 -1.60 -0.04 0.00 0.02 0.00 0.00 34.50 32.88 1i5h s PRO 462 CO 0.00 -3.70 1.38 -1.25 -0.33 0.00 0.00 177.00 173.10 1i5h s PRO 463 N -5.48 4.26 0.00 5.54 0.04 -1.26 -3.07 135.00 135.04 1i5h s PRO 463 Ca 0.72 1.89 0.00 0.00 0.04 0.00 0.00 61.00 63.64 1i5h s PRO 463 Cb -0.09 -3.69 0.00 0.00 0.04 0.00 0.00 34.50 30.76 1i5h s PRO 463 CO 0.56 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 177.37 1i5h n GLY 464 N 3.68 0.88 3.18 0.56 0.00 -1.26 -4.90 105.19 107.33 1i5h n GLY 464 Ca 0.14 -0.66 -0.11 0.00 0.00 0.00 0.00 46.02 45.39 1i5h n GLY 464 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1i5h s TRP 465 N -2.73 0.94 -0.04 1.61 0.52 -1.17 0.90 118.94 118.96 1i5h s TRP 465 Ca 0.00 -1.09 -0.17 0.00 0.02 0.00 0.00 56.10 54.86 1i5h s TRP 465 Cb 0.00 -0.55 0.03 0.00 -1.15 0.00 0.00 33.47 31.80 1i5h s TRP 465 CO 0.00 -0.34 0.38 -1.21 0.02 0.00 0.00 176.95 175.80 1i5h s GLU 466 N -3.95 0.68 -0.54 4.98 8.01 0.58 -4.87 118.70 123.59 1i5h s GLU 466 Ca 0.20 0.01 -0.18 0.00 0.01 0.00 0.00 54.97 55.01 1i5h s GLU 466 Cb 0.07 0.31 0.09 0.00 -4.31 0.00 0.00 34.13 30.28 1i5h s GLU 466 CO 0.00 -0.18 0.63 -1.83 0.01 0.00 0.00 175.26 173.89 1i5h s GLU 467 N -1.02 3.06 0.02 1.61 -1.05 -1.26 -2.07 118.70 117.99 1i5h s GLU 467 Ca -0.11 -1.19 -0.01 0.00 -0.15 0.00 0.00 54.97 53.51 1i5h s GLU 467 Cb -0.04 -4.19 -0.04 0.00 -0.44 0.00 0.00 34.13 29.42 1i5h s GLU 467 CO 0.04 -1.35 0.19 1.03 0.95 0.00 0.00 175.26 176.12 1i5h s ARG 468 N 2.47 3.41 -0.21 -4.83 1.81 -0.98 -4.96 118.95 115.66 1i5h s ARG 468 Ca 0.11 -0.38 -0.17 0.00 -1.72 0.00 0.00 55.73 53.57 1i5h s ARG 468 Cb -0.23 -3.05 -0.04 0.00 -0.45 0.00 0.00 34.95 31.18 1i5h s ARG 468 CO 0.08 0.65 0.43 0.95 -0.68 0.00 0.00 175.30 176.73 1i5h s THR 469 N -1.39 5.17 0.61 0.02 -4.23 -1.26 -0.97 115.64 113.59 1i5h s THR 469 Ca 0.30 0.77 -0.12 0.00 -1.18 0.00 0.00 61.69 61.46 1i5h s THR 469 Cb -0.13 -3.76 -0.04 0.00 1.34 0.00 0.00 72.50 69.91 1i5h s THR 469 CO 0.22 0.22 1.03 -2.28 -0.54 0.00 0.00 174.62 173.27 1i5h s HIS 470 N 1.51 3.45 0.64 3.99 2.46 -0.79 -4.92 115.29 121.63 1i5h s HIS 470 Ca 0.20 1.36 0.36 0.00 0.47 0.00 0.00 55.06 57.45 1i5h s HIS 470 Cb -0.15 -2.78 1.99 0.00 -0.13 0.00 0.00 32.58 31.51 1i5h s HIS 470 CO 0.09 -0.76 2.19 1.15 -2.47 0.00 0.00 174.74 174.94 1i5h h THR 471 N -0.12 0.19 0.00 0.89 2.02 -1.98 0.18 112.91 114.09 1i5h h THR 471 Ca -0.45 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1i5h h THR 471 Cb 1.19 0.89 0.00 0.00 -1.74 0.00 0.00 68.15 68.49 1i5h h THR 471 CO 0.61 0.00 -0.57 0.47 0.37 0.00 0.00 175.52 176.40 1i5h n ASP 472 N -3.33 0.67 0.00 4.18 9.92 -1.26 -4.94 116.55 121.79 1i5h n ASP 472 Ca -0.02 0.11 0.00 0.00 -0.53 0.00 0.00 54.79 54.36 1i5h n ASP 472 Cb 0.20 0.11 0.00 0.00 -0.64 0.00 0.00 41.12 40.79 1i5h n ASP 472 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1i5h n GLY 473 N 1.36 2.60 3.65 0.44 0.00 0.62 -5.06 105.19 108.79 1i5h n GLY 473 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 1i5h n GLY 473 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1i5h s ARG 474 N -0.53 4.11 -0.43 1.61 0.52 -1.26 -4.61 118.95 118.36 1i5h s ARG 474 Ca 0.00 1.34 -0.29 0.00 -0.52 0.00 0.00 55.73 56.26 1i5h s ARG 474 Cb 0.00 -3.76 0.02 0.00 0.52 0.00 0.00 34.95 31.73 1i5h s ARG 474 CO 0.00 -0.85 1.20 0.54 0.02 0.00 0.00 175.30 176.20 1i5h s VAL 475 N 3.72 4.18 0.77 3.52 0.11 -1.26 -1.88 120.40 129.56 1i5h s VAL 475 Ca 0.51 1.24 -0.02 0.00 -2.93 0.00 0.00 61.98 60.78 1i5h s VAL 475 Cb -0.17 -4.47 0.16 0.00 -1.53 0.00 0.00 36.38 30.37 1i5h s VAL 475 CO 0.15 -0.85 1.06 0.72 -3.33 0.00 0.00 175.10 172.86 1i5h s PHE 476 N 4.53 1.25 0.11 1.54 -0.71 -0.14 -4.86 117.98 119.71 1i5h s PHE 476 Ca 0.51 -0.33 0.06 0.00 -1.04 0.00 0.00 56.93 56.13 1i5h s PHE 476 Cb -0.10 -3.11 -0.04 0.00 -1.21 0.00 0.00 43.02 38.57 1i5h s PHE 476 CO 0.29 -1.96 -0.01 -0.06 -1.34 0.00 0.00 175.22 172.14 1i5h s PHE 477 N -3.27 2.93 -0.10 3.49 0.40 -1.06 -2.32 117.98 118.06 1i5h s PHE 477 Ca 0.69 -0.07 -0.06 0.00 -0.60 0.00 0.00 56.93 56.90 1i5h s PHE 477 Cb -0.04 -1.49 0.04 0.00 0.51 0.00 0.00 43.02 42.04 1i5h s PHE 477 CO 0.46 0.48 0.23 -1.50 0.70 0.00 0.00 175.22 175.59 1i5h s ILE 478 N -1.40 -0.03 0.34 0.64 2.07 -0.88 -1.68 121.20 120.27 1i5h s ILE 478 Ca 0.26 0.11 0.02 0.00 -1.41 0.00 0.00 60.65 59.63 1i5h s ILE 478 Cb -0.11 -0.35 -0.02 0.00 0.13 0.00 0.00 42.46 42.10 1i5h s ILE 478 CO 0.18 0.05 0.52 0.54 -1.91 0.00 0.00 174.94 174.32 1i5h s ASN 479 N 0.98 6.17 -0.12 4.50 4.22 -0.27 -0.30 114.94 130.11 1i5h s ASN 479 Ca -0.07 0.25 0.17 0.00 -2.14 0.00 0.00 52.86 51.07 1i5h s ASN 479 Cb -0.08 -1.79 0.27 0.00 1.28 0.00 0.00 41.25 40.93 1i5h s ASN 479 CO -0.06 -0.34 1.14 1.41 -2.04 0.00 0.00 177.10 177.21 1i5h n HIS 480 N -1.74 0.00 -0.06 1.54 8.25 0.26 -3.49 115.22 119.97 1i5h n HIS 480 Ca -0.04 -0.93 -0.22 0.00 -0.26 0.00 0.00 57.72 56.27 1i5h n HIS 480 Cb 0.57 -0.14 -0.13 0.00 1.12 0.00 0.00 29.99 31.41 1i5h n HIS 480 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1i5h n ASN 481 N -1.31 1.99 -0.97 0.41 3.02 -1.26 -4.56 115.26 112.59 1i5h n ASN 481 Ca 0.15 0.31 0.05 0.00 -0.03 0.00 0.00 54.58 55.06 1i5h n ASN 481 Cb 0.65 -0.90 0.10 0.00 -0.61 0.00 0.00 39.78 39.01 1i5h n ASN 481 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 1i5h n ILE 482 N -3.98 0.98 -3.31 2.41 -5.35 -1.26 -5.05 119.36 103.79 1i5h n ILE 482 Ca -0.33 -1.86 -0.27 0.00 -0.27 0.00 0.00 62.75 60.02 1i5h n ILE 482 Cb 0.86 0.40 0.03 0.00 -1.74 0.00 0.00 39.64 39.18 1i5h n ILE 482 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1i5h n LYS 483 N -0.30 -1.83 -3.91 6.28 4.01 -1.26 -5.02 118.16 116.13 1i5h n LYS 483 Ca 0.11 1.51 -0.09 0.00 -0.51 0.00 0.00 58.31 59.33 1i5h n LYS 483 Cb 0.90 -2.66 -0.06 0.00 -0.51 0.00 0.00 35.03 32.70 1i5h n LYS 483 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 1i5h s LYS 484 N -2.23 1.36 0.13 1.97 2.20 -1.23 -5.05 119.74 116.89 1i5h s LYS 484 Ca 0.29 -1.12 -0.06 0.00 -0.36 0.00 0.00 55.97 54.72 1i5h s LYS 484 Cb -0.04 0.45 -0.02 0.00 -1.51 0.00 0.00 37.83 36.71 1i5h s LYS 484 CO 0.73 -0.55 0.18 -0.08 -0.36 0.00 0.00 175.35 175.27 1i5h s THR 485 N -3.96 0.11 -0.14 3.43 -1.32 -1.26 -1.11 115.64 111.39 1i5h s THR 485 Ca 0.17 -1.49 -0.26 0.00 -1.21 0.00 0.00 61.69 58.90 1i5h s THR 485 Cb 0.01 -1.74 0.06 0.00 -1.51 0.00 0.00 72.50 69.33 1i5h s THR 485 CO 0.03 -0.48 0.64 0.00 -2.21 0.00 0.00 174.62 172.60 1i5h s GLN 486 N -3.96 0.90 0.15 7.08 -2.07 -0.67 -5.00 119.66 116.10 1i5h s GLN 486 Ca 0.15 0.52 -0.07 0.00 -1.82 0.00 0.00 55.36 54.13 1i5h s GLN 486 Cb 0.05 0.43 -0.01 0.00 -1.09 0.00 0.00 33.01 32.39 1i5h s GLN 486 CO -0.03 -0.21 1.43 -1.49 -1.32 0.00 0.00 175.29 173.67 1i5h h TRP 487 N 3.99 0.89 -3.24 9.60 -0.00 -1.98 -2.79 115.95 122.41 1i5h h TRP 487 Ca -0.28 -0.34 -0.43 0.00 -0.00 0.00 0.00 58.89 57.85 1i5h h TRP 487 Cb 1.15 -0.16 0.21 0.00 -0.00 0.00 0.00 29.16 30.36 1i5h h TRP 487 CO 0.40 1.12 0.00 -2.00 -0.00 0.00 0.00 178.44 177.96 1i5h s GLU 488 N -3.97 -1.15 -0.49 0.49 2.12 -1.26 -4.64 118.70 109.80 1i5h s GLU 488 Ca -0.09 0.70 -0.16 0.00 0.36 0.00 0.00 54.97 55.79 1i5h s GLU 488 Cb 0.10 -1.54 0.09 0.00 0.26 0.00 0.00 34.13 33.04 1i5h s GLU 488 CO 0.87 -3.84 0.43 -0.51 -0.54 0.00 0.00 175.26 171.67 1i5h s ASP 489 N -2.65 6.16 0.24 -1.70 1.11 -1.26 -4.49 116.67 114.09 1i5h s ASP 489 Ca 0.68 -1.42 -0.02 0.00 0.18 0.00 0.00 52.55 51.98 1i5h s ASP 489 Cb -0.23 -2.19 0.28 0.00 1.07 0.00 0.00 42.92 41.84 1i5h s ASP 489 CO 0.64 -0.71 1.69 1.55 1.18 0.00 0.00 175.17 179.52 1i5h h PRO 490 N 8.80 0.72 0.00 8.23 0.13 -1.93 -2.56 132.00 145.39 1i5h h PRO 490 Ca -0.29 -0.25 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 1i5h h PRO 490 Cb 1.11 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1i5h h PRO 490 CO 0.92 0.84 0.00 2.89 -0.23 0.00 0.00 178.00 182.42 1i5h n ARG 491 N -4.15 0.18 0.07 0.86 1.85 -1.26 -3.04 116.66 111.17 1i5h n ARG 491 Ca 0.01 0.30 -0.16 0.00 -1.00 0.00 0.00 57.85 57.00 1i5h n ARG 491 Cb 0.38 -1.78 -0.14 0.00 -1.05 0.00 0.00 32.46 29.87 1i5h n ARG 491 CO 0.00 0.00 0.00 1.98 -0.01 0.00 0.00 177.63 179.60 1i5h h MET 492 N 0.00 0.23 -6.34 2.89 4.05 -1.88 -3.46 114.93 110.42 1i5h h MET 492 Ca 0.00 -0.39 -0.59 0.00 -0.28 0.00 0.00 59.70 58.44 1i5h h MET 492 Cb 0.49 0.15 0.03 0.00 -0.80 0.00 0.00 31.60 31.46 1i5h h MET 492 CO 0.00 1.10 1.06 0.94 0.23 0.00 0.00 176.91 180.24 1i5h n GLN 493 N -3.44 2.30 0.00 0.39 -0.06 -1.16 -4.64 117.38 110.77 1i5h n GLN 493 Ca -0.14 0.84 0.00 0.00 -2.00 0.00 0.00 57.00 55.70 1i5h n GLN 493 Cb 1.03 -2.69 0.00 0.00 -4.06 0.00 0.00 30.24 24.52 1i5h n GLN 493 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 1i5h n ASN 494 N 6.08 0.00 -1.98 1.69 3.02 -1.26 -5.05 115.26 117.76 1i5h n ASN 494 Ca 0.21 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.66 1i5h n ASN 494 Cb 0.31 0.02 0.04 0.00 -0.61 0.00 0.00 39.78 39.54 1i5h n ASN 494 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1i5h n VAL 495 N -0.99 -1.75 0.00 2.41 0.31 -1.26 -4.86 118.33 112.19 1i5h n VAL 495 Ca 0.00 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 1i5h n VAL 495 Cb 0.00 -2.91 0.00 0.00 -0.91 0.00 0.00 33.84 30.02 1i5h n VAL 495 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1i5h n ALA 496 N -3.33 0.00 -3.37 3.52 0.00 -1.26 -4.80 120.51 111.26 1i5h n ALA 496 Ca -0.03 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.16 1i5h n ALA 496 Cb 0.54 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.03 1i5h n ALA 496 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1i5h n ILE 497 N 0.00 -2.10 -2.76 0.00 2.08 -1.26 -4.94 119.36 110.38 1i5h n ILE 497 Ca 0.00 0.00 -0.41 0.00 0.56 0.00 0.00 62.75 62.90 1i5h n ILE 497 Cb 0.00 -3.25 -0.04 0.00 -0.75 0.00 0.00 39.64 35.60 1i5h n ILE 497 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 1i5h s THR 498 N -3.20 4.57 0.00 1.39 -1.32 -1.26 -5.23 115.64 110.59 1i5h s THR 498 Ca 0.45 2.01 0.00 0.00 -1.21 0.00 0.00 61.69 62.94 1i5h s THR 498 Cb -0.21 -4.29 0.00 0.00 -1.51 0.00 0.00 72.50 66.48 1i5h s THR 498 CO 0.56 0.31 0.00 0.61 -2.21 0.00 0.00 174.62 173.89