#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i5h n SER 451 N 0.00 -5.93 -4.60 1.61 7.64 -1.26 -4.89 113.62 106.20 1i5h n SER 451 Ca 0.00 -0.15 -0.43 0.00 1.01 0.00 0.00 58.87 59.30 1i5h n SER 451 Cb 0.00 -4.01 -0.03 0.00 -1.01 0.00 0.00 64.21 59.17 1i5h n SER 451 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1i5h s PRO 452 N -3.22 3.20 0.11 1.43 0.04 -1.26 -4.93 135.00 130.36 1i5h s PRO 452 Ca 0.07 1.75 -0.25 0.00 0.04 0.00 0.00 61.00 62.61 1i5h s PRO 452 Cb -0.01 -4.30 0.07 0.00 0.04 0.00 0.00 34.50 30.30 1i5h s PRO 452 CO 0.53 -2.03 0.64 0.14 0.04 0.00 0.00 177.00 176.33 1i5h s VAL 453 N 7.77 0.00 -0.41 -0.36 -7.23 -1.26 -5.04 120.40 113.87 1i5h s VAL 453 Ca 0.91 0.00 -0.02 0.00 -1.81 0.00 0.00 61.98 61.06 1i5h s VAL 453 Cb -0.28 -1.00 0.20 0.00 0.56 0.00 0.00 36.38 35.86 1i5h s VAL 453 CO 0.34 0.00 2.23 -0.90 -0.31 0.00 0.00 175.10 176.46 1i5h n ASP 454 N -0.14 6.64 0.03 4.85 5.75 -1.26 -4.50 116.55 127.91 1i5h n ASP 454 Ca -0.17 -3.20 -0.10 0.00 -0.01 0.00 0.00 54.79 51.31 1i5h n ASP 454 Cb 0.63 -1.10 -0.08 0.00 -1.03 0.00 0.00 41.12 39.55 1i5h n ASP 454 CO 0.00 0.00 0.00 -1.28 -0.11 0.00 0.00 177.20 175.81 1i5h h SER 455 N 1.98 -0.14 -1.65 -1.12 0.87 -1.96 -3.41 113.55 108.12 1i5h h SER 455 Ca 0.36 -0.42 -0.45 0.00 -1.23 0.00 0.00 61.79 60.05 1i5h h SER 455 Cb 0.83 0.04 -0.35 0.00 -0.44 0.00 0.00 62.40 62.47 1i5h h SER 455 CO 0.90 0.47 -1.05 -0.46 -0.53 0.00 0.00 176.83 176.16 1i5h n ASN 456 N -4.87 0.12 -3.94 6.23 0.23 -1.26 -4.95 115.26 106.82 1i5h n ASN 456 Ca -0.07 -3.05 -0.18 0.00 -0.53 0.00 0.00 54.58 50.74 1i5h n ASN 456 Cb 0.27 -0.18 -0.15 0.00 -2.08 0.00 0.00 39.78 37.64 1i5h n ASN 456 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 1i5h s ASP 457 N -2.00 0.85 0.00 0.53 1.11 -1.26 -5.03 116.67 110.87 1i5h s ASP 457 Ca 0.36 -0.12 0.00 0.00 0.18 0.00 0.00 52.55 52.97 1i5h s ASP 457 Cb 0.30 -0.27 0.00 0.00 1.07 0.00 0.00 42.92 44.02 1i5h s ASP 457 CO -0.09 0.01 0.00 0.18 1.18 0.00 0.00 175.17 176.45 1i5h n LEU 458 N 3.50 2.41 0.00 1.23 4.77 -1.26 -5.01 117.00 122.64 1i5h n LEU 458 Ca -0.20 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.78 1i5h n LEU 458 Cb 0.54 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.63 1i5h n LEU 458 CO 0.24 0.40 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 1i5h n GLY 459 N 3.35 0.97 2.28 -0.72 0.00 -1.26 -4.70 105.19 105.12 1i5h n GLY 459 Ca 0.00 -0.85 -0.24 0.00 0.00 0.00 0.00 46.02 44.93 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 0.00 2.54 -1.34 1.61 -0.04 -1.26 -4.91 135.00 131.60 1i5h n PRO 460 Ca 0.00 -1.49 0.16 0.00 -0.04 0.00 0.00 63.50 62.13 1i5h n PRO 460 Cb 0.00 -2.37 -0.06 0.00 -0.04 0.00 0.00 33.50 31.03 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 3.31 -0.77 -4.56 1.53 4.77 -1.26 -4.89 117.00 115.14 1i5h n LEU 461 Ca 0.54 1.76 -0.30 0.00 -0.03 0.00 0.00 56.01 57.98 1i5h n LEU 461 Cb 0.43 -4.32 0.25 0.00 -2.33 0.00 0.00 43.42 37.45 1i5h n LEU 461 CO 0.54 -2.66 0.60 -2.84 -1.33 0.00 0.00 177.39 171.69 1i5h s PRO 462 N -3.24 -1.58 0.15 3.23 0.02 -1.26 -4.93 135.00 127.39 1i5h s PRO 462 Ca 0.00 -0.12 -0.30 0.00 0.02 0.00 0.00 61.00 60.60 1i5h s PRO 462 Cb 0.00 -1.56 -0.08 0.00 0.02 0.00 0.00 34.50 32.88 1i5h s PRO 462 CO 0.00 -3.94 1.26 -1.25 -0.33 0.00 0.00 177.00 172.74 1i5h s PRO 463 N -5.43 4.43 0.00 5.54 0.04 -1.26 -2.78 135.00 135.53 1i5h s PRO 463 Ca 0.71 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.68 1i5h s PRO 463 Cb -0.09 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.20 1i5h s PRO 463 CO 0.56 -0.22 0.00 0.41 0.04 0.00 0.00 177.00 177.79 1i5h n GLY 464 N 2.63 2.16 3.95 0.56 0.00 -1.26 -4.88 105.19 108.35 1i5h n GLY 464 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.10 3.10 -0.09 1.61 0.52 -1.12 0.14 118.94 120.00 1i5h s TRP 465 Ca 0.00 0.22 -0.14 0.00 0.02 0.00 0.00 56.10 56.19 1i5h s TRP 465 Cb 0.00 -2.54 0.03 0.00 -1.15 0.00 0.00 33.47 29.81 1i5h s TRP 465 CO 0.00 -0.62 0.36 -2.00 0.02 0.00 0.00 176.95 174.71 1i5h s GLU 466 N -4.70 0.54 -0.56 4.98 -6.30 0.11 -4.87 118.70 107.90 1i5h s GLU 466 Ca 0.52 0.26 -0.19 0.00 -2.50 0.00 0.00 54.97 53.06 1i5h s GLU 466 Cb -0.10 0.25 0.08 0.00 0.00 0.00 0.00 34.13 34.36 1i5h s GLU 466 CO 0.39 -0.11 0.69 -1.83 0.02 0.00 0.00 175.26 174.42 1i5h s GLU 467 N -0.39 3.09 -0.04 4.30 -1.05 -1.26 -1.88 118.70 121.46 1i5h s GLU 467 Ca -0.05 -1.09 -0.01 0.00 -0.15 0.00 0.00 54.97 53.67 1i5h s GLU 467 Cb -0.03 -4.19 -0.04 0.00 -0.44 0.00 0.00 34.13 29.43 1i5h s GLU 467 CO 0.02 -1.42 0.04 1.03 0.95 0.00 0.00 175.26 175.88 1i5h s ARG 468 N 2.76 3.00 -0.13 -4.83 1.81 -0.93 -4.95 118.95 115.67 1i5h s ARG 468 Ca 0.14 -0.46 -0.24 0.00 -1.72 0.00 0.00 55.73 53.45 1i5h s ARG 468 Cb -0.21 -2.81 -0.02 0.00 -0.45 0.00 0.00 34.95 31.45 1i5h s ARG 468 CO 0.09 0.67 0.77 0.95 -0.68 0.00 0.00 175.30 177.10 1i5h s THR 469 N -1.04 4.95 0.62 0.02 -4.23 -1.26 -0.48 115.64 114.22 1i5h s THR 469 Ca 0.18 1.54 -0.12 0.00 -1.18 0.00 0.00 61.69 62.10 1i5h s THR 469 Cb -0.12 -4.09 -0.03 0.00 1.34 0.00 0.00 72.50 69.60 1i5h s THR 469 CO 0.08 0.12 1.03 -2.28 -0.54 0.00 0.00 174.62 173.03 1i5h s HIS 470 N 1.62 3.38 0.64 3.99 2.46 -0.17 -4.90 115.29 122.31 1i5h s HIS 470 Ca 0.37 1.39 0.34 0.00 0.47 0.00 0.00 55.06 57.63 1i5h s HIS 470 Cb -0.17 -2.81 1.85 0.00 -0.13 0.00 0.00 32.58 31.32 1i5h s HIS 470 CO 0.15 -0.83 2.10 1.15 -2.47 0.00 0.00 174.74 174.83 1i5h h THR 471 N -0.12 0.16 0.00 0.89 2.02 -1.97 0.35 112.91 114.24 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 1.20 0.81 0.00 0.00 -1.74 0.00 0.00 68.15 68.42 1i5h h THR 471 CO 0.60 0.00 -0.55 0.47 0.37 0.00 0.00 175.52 176.41 1i5h n ASP 472 N -3.26 0.58 0.00 4.18 9.92 -1.26 -4.94 116.55 121.76 1i5h n ASP 472 Ca -0.01 -0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.25 1i5h n ASP 472 Cb 0.29 0.17 0.00 0.00 -0.64 0.00 0.00 41.12 40.94 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 1.41 2.62 3.67 0.44 0.00 0.12 -5.07 105.19 108.38 1i5h n GLY 473 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 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 4.31 -0.43 1.61 3.00 -1.26 -4.57 118.95 121.07 1i5h s ARG 474 Ca 0.00 1.48 -0.29 0.00 0.00 0.00 0.00 55.73 56.92 1i5h s ARG 474 Cb 0.00 -3.63 0.02 0.00 0.00 0.00 0.00 34.95 31.34 1i5h s ARG 474 CO 0.00 -0.54 1.18 0.54 0.00 0.00 0.00 175.30 176.48 1i5h s VAL 475 N 2.82 4.21 0.69 3.52 0.11 -1.26 -1.00 120.40 129.49 1i5h s VAL 475 Ca 0.49 1.27 -0.00 0.00 -2.93 0.00 0.00 61.98 60.81 1i5h s VAL 475 Cb -0.19 -4.50 0.11 0.00 -1.53 0.00 0.00 36.38 30.28 1i5h s VAL 475 CO 0.13 -0.86 0.96 0.72 -3.33 0.00 0.00 175.10 172.72 1i5h s PHE 476 N 4.46 1.77 0.05 1.54 -0.12 0.37 -4.85 117.98 121.19 1i5h s PHE 476 Ca 0.50 -0.25 0.03 0.00 -0.05 0.00 0.00 56.93 57.16 1i5h s PHE 476 Cb -0.09 -2.93 -0.04 0.00 -0.63 0.00 0.00 43.02 39.32 1i5h s PHE 476 CO 0.29 -1.58 0.04 -0.06 -0.05 0.00 0.00 175.22 173.86 1i5h s PHE 477 N -3.08 3.13 -0.10 3.49 0.40 -1.09 -2.19 117.98 118.55 1i5h s PHE 477 Ca 0.65 0.07 -0.04 0.00 -0.60 0.00 0.00 56.93 57.01 1i5h s PHE 477 Cb -0.06 -1.63 0.05 0.00 0.51 0.00 0.00 43.02 41.89 1i5h s PHE 477 CO 0.43 0.50 0.21 -1.50 0.70 0.00 0.00 175.22 175.57 1i5h s ILE 478 N -1.27 -0.12 0.17 0.64 2.07 -0.79 -1.45 121.20 120.46 1i5h s ILE 478 Ca 0.25 0.20 -0.06 0.00 -1.41 0.00 0.00 60.65 59.63 1i5h s ILE 478 Cb -0.12 -0.34 -0.06 0.00 0.13 0.00 0.00 42.46 42.07 1i5h s ILE 478 CO 0.17 0.08 0.42 0.54 -1.91 0.00 0.00 174.94 174.25 1i5h s ASN 479 N 1.51 6.51 -0.13 4.50 4.22 -1.11 0.08 114.94 130.52 1i5h s ASN 479 Ca -0.07 0.66 0.15 0.00 -2.14 0.00 0.00 52.86 51.46 1i5h s ASN 479 Cb -0.11 -2.12 0.50 0.00 1.28 0.00 0.00 41.25 40.80 1i5h s ASN 479 CO -0.08 0.01 1.41 1.41 -2.04 0.00 0.00 177.10 177.81 1i5h n HIS 480 N -0.06 0.92 -0.05 1.54 8.25 0.37 -3.35 115.22 122.85 1i5h n HIS 480 Ca -0.02 -0.76 -0.21 0.00 -0.26 0.00 0.00 57.72 56.47 1i5h n HIS 480 Cb 0.52 -0.25 -0.13 0.00 1.12 0.00 0.00 29.99 31.25 1i5h n HIS 480 CO 0.00 0.00 0.00 -0.91 0.64 0.00 0.00 176.34 176.07 1i5h h ASN 481 N 2.12 0.18 0.00 0.41 2.35 -1.94 -3.41 115.58 115.30 1i5h h ASN 481 Ca 0.00 -0.72 -0.06 0.00 -0.55 0.00 0.00 56.30 54.97 1i5h h ASN 481 Cb 1.29 -0.06 -0.12 0.00 0.05 0.00 0.00 38.32 39.48 1i5h h ASN 481 CO 0.18 1.56 -0.57 2.30 -1.65 0.00 0.00 177.43 179.25 1i5h n ILE 482 N -4.13 0.95 -3.56 2.81 -5.35 -1.26 -5.04 119.36 103.78 1i5h n ILE 482 Ca -0.28 -1.60 -0.29 0.00 -0.27 0.00 0.00 62.75 60.30 1i5h n ILE 482 Cb 0.79 0.32 0.02 0.00 -1.74 0.00 0.00 39.64 39.03 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 -0.42 -1.78 -3.51 6.28 4.76 -1.24 -4.99 118.16 117.25 1i5h n LYS 483 Ca 0.10 1.21 -0.09 0.00 -2.87 0.00 0.00 58.31 56.66 1i5h n LYS 483 Cb 0.82 -2.58 -0.09 0.00 -1.84 0.00 0.00 35.03 31.34 1i5h n LYS 483 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1i5h s LYS 484 N -3.49 0.32 0.50 1.97 2.20 -1.21 -5.03 119.74 115.00 1i5h s LYS 484 Ca 0.20 0.79 0.04 0.00 -0.36 0.00 0.00 55.97 56.64 1i5h s LYS 484 Cb -0.02 -0.06 0.02 0.00 -1.51 0.00 0.00 37.83 36.26 1i5h s LYS 484 CO 0.87 -0.44 0.69 -0.08 -0.36 0.00 0.00 175.35 176.04 1i5h s THR 485 N 2.57 2.83 -0.07 3.43 -1.32 -1.26 -2.77 115.64 119.05 1i5h s THR 485 Ca 0.05 -0.80 -0.28 0.00 -1.21 0.00 0.00 61.69 59.45 1i5h s THR 485 Cb -0.14 -3.01 0.06 0.00 -1.51 0.00 0.00 72.50 67.91 1i5h s THR 485 CO -0.14 -0.01 0.63 0.00 -2.21 0.00 0.00 174.62 172.90 1i5h s GLN 486 N -4.59 0.98 0.07 7.08 -2.07 -0.53 -4.99 119.66 115.61 1i5h s GLN 486 Ca 0.56 0.29 -0.16 0.00 -1.82 0.00 0.00 55.36 54.23 1i5h s GLN 486 Cb -0.10 0.46 -0.15 0.00 -1.09 0.00 0.00 33.01 32.12 1i5h s GLN 486 CO 0.36 -0.28 1.29 -1.49 -1.32 0.00 0.00 175.29 173.84 1i5h h TRP 487 N 3.37 0.80 -3.15 9.60 -0.00 -1.98 -2.89 115.95 121.70 1i5h h TRP 487 Ca -0.28 -0.32 -0.41 0.00 -0.00 0.00 0.00 58.89 57.88 1i5h h TRP 487 Cb 1.15 -0.13 0.21 0.00 -0.00 0.00 0.00 29.16 30.39 1i5h h TRP 487 CO 0.40 1.10 -0.05 -1.21 -0.00 0.00 0.00 178.44 178.68 1i5h s GLU 488 N -3.85 -1.93 -0.33 0.49 8.01 -1.26 -4.66 118.70 115.18 1i5h s GLU 488 Ca -0.12 0.47 -0.09 0.00 0.01 0.00 0.00 54.97 55.24 1i5h s GLU 488 Cb 0.07 -1.47 0.01 0.00 -4.31 0.00 0.00 34.13 28.43 1i5h s GLU 488 CO 0.84 -4.30 0.15 -0.51 0.01 0.00 0.00 175.26 171.44 1i5h s ASP 489 N -2.84 5.47 0.17 -0.19 1.11 -1.26 -4.51 116.67 114.62 1i5h s ASP 489 Ca 0.69 -0.76 0.02 0.00 0.18 0.00 0.00 52.55 52.67 1i5h s ASP 489 Cb -0.19 -1.96 0.02 0.00 1.07 0.00 0.00 42.92 41.85 1i5h s ASP 489 CO 0.61 -0.26 1.40 1.55 1.18 0.00 0.00 175.17 179.65 1i5h h PRO 490 N 8.33 0.24 0.00 8.23 0.13 -1.94 -2.86 132.00 144.13 1i5h h PRO 490 Ca -0.29 -0.24 -0.02 0.00 -0.87 0.00 0.00 66.00 64.57 1i5h h PRO 490 Cb 1.12 0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 1i5h h PRO 490 CO 0.63 0.95 -0.11 0.07 -0.23 0.00 0.00 178.00 179.30 1i5h h ARG 491 N 0.14 0.00 0.13 0.86 0.11 -1.99 -3.15 114.38 110.48 1i5h h ARG 491 Ca -0.04 0.00 -0.32 0.00 0.10 0.00 0.00 59.98 59.72 1i5h h ARG 491 Cb 1.45 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.52 1i5h h ARG 491 CO 0.13 0.11 -1.58 1.98 0.10 0.00 0.00 179.97 180.71 1i5h h MET 492 N 0.00 0.28 -4.90 0.08 4.05 -1.95 -3.40 114.93 109.08 1i5h h MET 492 Ca -0.00 -0.48 -0.62 0.00 -0.28 0.00 0.00 59.70 58.33 1i5h h MET 492 Cb 0.76 0.18 -0.03 0.00 -0.80 0.00 0.00 31.60 31.71 1i5h h MET 492 CO 0.01 1.15 2.30 1.04 0.23 0.00 0.00 176.91 181.65 1i5h n GLN 493 N -3.48 2.41 -3.64 0.39 1.13 -1.09 -4.81 117.38 108.30 1i5h n GLN 493 Ca -0.18 -2.59 -0.09 0.00 -1.94 0.00 0.00 57.00 52.19 1i5h n GLN 493 Cb 1.05 -3.35 -0.07 0.00 0.11 0.00 0.00 30.24 27.99 1i5h n GLN 493 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1i5h s ASN 494 N 4.51 -0.68 -0.10 1.08 4.22 -1.26 -4.98 114.94 117.72 1i5h s ASN 494 Ca 0.55 1.21 0.04 0.00 -2.14 0.00 0.00 52.86 52.53 1i5h s ASN 494 Cb 0.09 1.25 0.13 0.00 1.28 0.00 0.00 41.25 44.00 1i5h s ASN 494 CO 0.05 -0.20 1.16 0.55 -2.04 0.00 0.00 177.10 176.62 1i5h n VAL 495 N 3.15 0.01 -3.57 3.54 3.14 -1.26 -4.94 118.33 118.40 1i5h n VAL 495 Ca -0.16 -0.32 -0.10 0.00 -2.96 0.00 0.00 64.34 60.80 1i5h n VAL 495 Cb 0.57 0.66 -0.05 0.00 -1.06 0.00 0.00 33.84 33.96 1i5h n VAL 495 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1i5h s ALA 496 N 0.02 -1.92 0.37 1.55 0.00 -1.26 -5.16 121.76 115.36 1i5h s ALA 496 Ca 0.03 1.50 -0.12 0.00 0.00 0.00 0.00 51.96 53.37 1i5h s ALA 496 Cb 0.14 -0.52 0.05 0.00 0.00 0.00 0.00 23.12 22.79 1i5h s ALA 496 CO -0.04 -0.38 0.71 0.44 0.00 0.00 0.00 175.76 176.49 1i5h n ILE 497 N 0.55 0.00 -4.63 0.00 -6.64 -1.26 -5.17 119.36 102.21 1i5h n ILE 497 Ca -0.10 -1.06 -0.25 0.00 -1.77 0.00 0.00 62.75 59.58 1i5h n ILE 497 Cb 0.58 0.96 -0.16 0.00 -1.44 0.00 0.00 39.64 39.58 1i5h n ILE 497 CO 0.00 0.00 0.00 0.28 -1.77 0.00 0.00 176.55 175.06 1i5h s THR 498 N -2.24 1.18 0.00 7.28 -1.32 -1.26 -5.34 115.64 113.93 1i5h s THR 498 Ca 0.17 -0.52 0.00 0.00 -1.21 0.00 0.00 61.69 60.13 1i5h s THR 498 Cb -0.04 -1.06 0.00 0.00 -1.51 0.00 0.00 72.50 69.88 1i5h s THR 498 CO 0.13 0.36 0.00 0.61 -2.21 0.00 0.00 174.62 173.51