==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 22-FEB-13 3ZON . COMPND 2 MOLECULE: NON-RECEPTOR TYROSINE-PROTEIN KINASE TYK2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.M.ELKINS,J.WANG,T.KROJER,P.SAVITSKY,R.CHALK,N.DAGA,E.SALAH . 261 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12631.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 175 67.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 15.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 17 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 27.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 1 2 0 2 0 0 0 0 2 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 0 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 577 A S 0 0 154 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 141.6 36.6 32.1 20.9 2 578 A Q - 0 0 179 2,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.848 360.0-112.0-163.2 118.2 34.6 34.6 18.8 3 579 A L - 0 0 62 -2,-0.3 2,-0.4 1,-0.1 54,-0.1 -0.082 25.8-154.9 -54.8 155.2 31.6 33.5 16.7 4 580 A S + 0 0 65 53,-0.1 2,-0.3 2,-0.0 59,-0.2 -0.947 34.3 124.2-138.2 118.4 31.8 33.7 13.0 5 581 A F - 0 0 54 -2,-0.4 2,-0.3 57,-0.1 70,-0.1 -0.952 58.7 -95.2-164.0 154.9 28.8 34.1 10.8 6 582 A H - 0 0 109 -2,-0.3 70,-2.3 67,-0.1 2,-0.6 -0.581 32.5-134.1 -79.3 133.1 27.5 36.5 8.1 7 583 A R E -a 76 0A 199 -2,-0.3 2,-0.5 68,-0.2 70,-0.2 -0.807 19.6-156.0 -89.2 122.2 25.2 39.3 9.2 8 584 A V E -a 77 0A 9 68,-3.0 70,-0.6 -2,-0.6 2,-0.2 -0.865 10.8-133.0-102.6 128.0 22.2 39.6 6.9 9 585 A D > - 0 0 88 -2,-0.5 3,-1.9 68,-0.1 4,-0.3 -0.571 18.3-123.5 -77.0 144.0 20.4 42.9 6.7 10 586 A Q G > S+ 0 0 101 68,-0.4 3,-1.0 1,-0.3 -1,-0.1 0.773 110.4 63.5 -62.5 -25.6 16.6 42.8 6.8 11 587 A K G 3 S+ 0 0 63 1,-0.2 -1,-0.3 3,-0.0 22,-0.0 0.743 95.5 60.5 -63.2 -27.0 16.4 44.6 3.5 12 588 A E G < S+ 0 0 50 -3,-1.9 21,-3.5 20,-0.1 2,-0.3 0.527 99.3 66.5 -84.6 -7.5 18.2 41.7 1.8 13 589 A I E < -B 32 0A 13 -3,-1.0 2,-0.4 -4,-0.3 19,-0.2 -0.889 57.7-161.9-117.8 150.1 15.4 39.1 2.7 14 590 A T E -B 31 0A 52 17,-1.9 17,-1.8 -2,-0.3 2,-0.6 -0.993 18.7-140.7-123.6 131.6 11.8 38.6 1.8 15 591 A Q E +B 30 0A 67 -2,-0.4 15,-0.2 15,-0.2 3,-0.1 -0.854 28.2 168.2 -99.6 119.1 9.6 36.4 4.0 16 592 A L E - 0 0 72 13,-3.0 14,-0.1 -2,-0.6 -1,-0.1 0.247 43.7 -7.6-102.9-133.7 7.2 34.1 2.2 17 593 A S E - 0 0 79 11,-0.1 12,-2.7 1,-0.1 -1,-0.2 -0.241 65.4-108.3 -79.3 152.8 5.1 31.1 3.4 18 594 A H E -B 28 0A 92 10,-0.2 10,-0.3 1,-0.1 -1,-0.1 -0.514 29.8-176.3 -72.3 133.8 5.1 29.4 6.8 19 595 A L E - 0 0 84 8,-3.6 2,-0.3 1,-0.5 9,-0.2 0.645 50.6 -79.9-104.3 -19.9 6.6 25.9 6.6 20 596 A G E -B 27 0A 27 7,-1.0 7,-2.7 2,-0.0 -1,-0.5 -0.948 52.5 -67.6 142.7-168.8 6.2 24.7 10.1 21 597 A Q E -B 26 0A 148 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.947 31.9-171.8-128.0 139.4 7.8 25.0 13.5 22 598 A G E > -B 25 0A 40 3,-0.9 3,-1.5 -2,-0.4 2,-0.6 -0.452 59.0 -47.1-111.3-165.8 11.2 23.9 15.0 23 599 A T T 3 S- 0 0 43 1,-0.3 139,-0.5 -2,-0.2 3,-0.1 -0.541 127.9 -19.2 -72.0 112.1 12.4 24.1 18.6 24 600 A R T 3 S+ 0 0 71 -2,-0.6 21,-3.6 1,-0.2 2,-0.3 0.676 124.6 105.0 59.9 21.3 11.5 27.6 19.7 25 601 A T E < -BC 22 44A 11 -3,-1.5 -3,-0.9 19,-0.2 2,-0.4 -0.917 61.0-148.6-127.7 156.4 11.2 28.6 16.0 26 602 A N E -BC 21 43A 33 17,-2.4 17,-3.4 -2,-0.3 2,-0.4 -0.992 27.2-150.2-112.4 138.7 8.8 29.4 13.2 27 603 A V E +BC 20 42A 22 -7,-2.7 -8,-3.6 -2,-0.4 -7,-1.0 -0.889 17.7 176.5-117.1 129.2 10.2 28.5 9.8 28 604 A Y E -BC 18 41A 48 13,-2.8 13,-3.1 -2,-0.4 -10,-0.2 -0.937 33.1-113.2-129.0 152.6 9.4 30.2 6.5 29 605 A E E + C 0 40A 25 -12,-2.7 -13,-3.0 -2,-0.3 2,-0.3 -0.609 51.0 163.6 -71.6 147.1 10.3 30.1 2.9 30 606 A G E -BC 15 39A 0 9,-2.7 9,-1.7 -15,-0.2 2,-0.4 -0.844 35.9-116.9-148.4-175.6 12.2 33.2 1.9 31 607 A R E -BC 14 38A 64 -17,-1.8 -17,-1.9 -2,-0.3 2,-0.5 -0.996 17.2-155.8-131.2 139.9 14.4 34.9 -0.6 32 608 A L E -BC 13 37A 22 5,-2.8 5,-3.0 -2,-0.4 2,-0.2 -0.969 11.6-168.8-115.5 120.3 17.9 36.2 -0.1 33 609 A R 0 0 83 -21,-3.5 -21,-0.0 -2,-0.5 -2,-0.0 -0.659 360.0 360.0 -98.3 159.4 19.3 39.1 -2.2 34 610 A V 0 0 170 -2,-0.2 -1,-0.0 0, 0.0 -2,-0.0 -0.598 360.0 360.0 -71.5 360.0 22.9 40.3 -2.5 35 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 36 636 A E 0 0 150 0, 0.0 2,-0.4 0, 0.0 -3,-0.2 0.000 360.0 360.0 360.0 117.7 18.3 36.1 -5.5 37 637 A L E -C 32 0A 91 -5,-3.0 -5,-2.8 51,-0.0 2,-0.5 -0.817 360.0-126.1-100.3 138.2 18.6 32.8 -3.5 38 638 A R E +C 31 0A 107 -2,-0.4 51,-1.1 -7,-0.2 2,-0.2 -0.730 49.4 163.0 -72.3 126.1 15.7 30.6 -2.5 39 639 A V E -CD 30 88A 0 -9,-1.7 -9,-2.7 -2,-0.5 2,-0.4 -0.813 39.0-116.2-140.8 172.9 16.2 30.2 1.3 40 640 A V E -CD 29 87A 15 47,-3.3 47,-3.0 -2,-0.2 2,-0.5 -0.957 21.4-149.9-115.2 140.1 14.6 29.2 4.6 41 641 A L E -CD 28 86A 0 -13,-3.1 -13,-2.8 -2,-0.4 2,-0.7 -0.958 4.6-164.3-112.0 120.3 14.1 31.7 7.5 42 642 A K E -CD 27 85A 26 43,-2.5 43,-2.1 -2,-0.5 2,-0.7 -0.884 9.9-161.5-104.8 100.0 14.1 30.3 11.1 43 643 A V E -CD 26 84A 6 -17,-3.4 -17,-2.4 -2,-0.7 2,-0.3 -0.789 14.4-136.7 -90.6 116.6 12.6 33.0 13.3 44 644 A L E -C 25 0A 7 39,-3.1 39,-0.5 -2,-0.7 -19,-0.2 -0.582 21.8-117.2 -73.8 131.3 13.5 32.4 16.9 45 645 A D - 0 0 62 -21,-3.6 2,-0.2 -2,-0.3 38,-0.1 -0.237 41.7 -85.0 -59.6 154.2 10.6 32.9 19.4 46 646 A P S S+ 0 0 126 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.509 78.8 142.4 -57.3 130.8 10.9 35.6 22.0 47 647 A S - 0 0 50 -2,-0.2 5,-0.1 -3,-0.1 -3,-0.0 -0.988 50.0 -50.1-169.0 167.4 12.9 33.8 24.7 48 648 A H >> - 0 0 139 -2,-0.3 4,-1.5 1,-0.1 3,-0.7 -0.039 55.3-112.1 -50.2 152.1 15.5 33.7 27.4 49 649 A H H 3> S+ 0 0 119 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.825 114.3 60.3 -60.8 -33.4 18.9 35.1 26.5 50 650 A D H 3> S+ 0 0 97 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.836 102.4 53.0 -66.2 -33.2 20.6 31.6 26.7 51 651 A I H <> S+ 0 0 5 -3,-0.7 4,-2.2 2,-0.2 -1,-0.2 0.927 109.9 49.1 -62.9 -46.8 18.3 30.3 23.9 52 652 A A H X S+ 0 0 15 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.924 111.7 47.7 -59.2 -44.5 19.4 33.3 21.8 53 653 A L H X S+ 0 0 88 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.909 110.5 52.3 -65.0 -39.0 23.1 32.6 22.5 54 654 A A H X S+ 0 0 16 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.867 107.5 53.0 -62.6 -39.4 22.6 28.9 21.7 55 655 A F H X S+ 0 0 1 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.918 110.6 46.2 -60.6 -48.4 21.0 29.9 18.3 56 656 A Y H X S+ 0 0 47 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.840 107.8 57.4 -64.1 -35.9 23.9 32.1 17.5 57 657 A E H X S+ 0 0 107 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.871 107.8 47.8 -65.0 -36.9 26.3 29.3 18.5 58 658 A T H X S+ 0 0 10 -4,-1.7 4,-2.7 2,-0.2 5,-0.2 0.931 110.2 51.1 -68.5 -44.3 24.6 26.9 16.0 59 659 A A H X S+ 0 0 0 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.915 112.6 47.4 -58.7 -41.8 24.8 29.6 13.2 60 660 A S H < S+ 0 0 7 -4,-2.3 4,-0.4 2,-0.2 -2,-0.2 0.925 112.1 48.7 -65.7 -49.9 28.5 30.0 13.9 61 661 A L H >< S+ 0 0 39 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.912 116.1 42.7 -49.5 -52.0 29.3 26.3 14.0 62 662 A M H >< S+ 0 0 8 -4,-2.7 3,-0.7 1,-0.3 11,-0.3 0.647 105.5 63.3 -79.0 -15.8 27.4 25.7 10.7 63 663 A S T 3< S+ 0 0 41 -4,-1.2 -1,-0.3 -59,-0.2 -2,-0.2 0.566 104.1 50.5 -80.3 -8.9 28.9 28.7 9.0 64 664 A Q T < S+ 0 0 108 -3,-1.0 2,-0.3 -4,-0.4 -1,-0.2 0.145 97.8 72.6-120.6 22.1 32.3 27.2 9.3 65 665 A V < - 0 0 17 -3,-0.7 2,-0.4 2,-0.0 60,-0.0 -0.977 56.0-164.0-134.9 145.9 31.8 23.7 7.9 66 666 A S + 0 0 102 -2,-0.3 2,-0.3 6,-0.1 5,-0.1 -0.993 19.2 148.5-129.5 140.9 31.3 22.5 4.3 67 667 A H > - 0 0 48 3,-0.4 3,-1.9 -2,-0.4 54,-0.1 -0.922 52.7-118.9-165.8 147.8 30.1 19.2 3.0 68 668 A T T 3 S+ 0 0 86 -2,-0.3 -1,-0.1 1,-0.3 49,-0.0 0.834 118.7 39.2 -46.3 -40.9 28.2 17.7 0.1 69 669 A H T 3 S+ 0 0 17 48,-0.1 88,-3.1 87,-0.1 2,-0.5 -0.002 95.6 90.7-110.4 25.3 25.6 16.5 2.6 70 670 A L B < S-f 157 0B 6 -3,-1.9 -3,-0.4 86,-0.2 88,-0.2 -0.993 76.5-124.1-115.7 129.4 25.4 19.5 5.0 71 671 A A - 0 0 9 86,-2.2 -2,-0.1 -2,-0.5 -3,-0.0 -0.384 33.1-105.7 -68.3 143.4 22.8 22.2 4.2 72 672 A F - 0 0 115 -2,-0.1 16,-2.2 17,-0.0 2,-0.5 -0.297 18.9-151.4 -69.3 152.0 24.2 25.8 3.9 73 673 A V E - E 0 87A 19 -11,-0.3 14,-0.3 14,-0.2 -67,-0.1 -0.998 9.4-173.4-119.3 120.9 23.8 28.5 6.5 74 674 A H E - 0 0 40 12,-2.8 2,-0.3 -2,-0.5 13,-0.2 0.755 50.5 -86.5 -86.0 -30.0 23.8 31.9 4.8 75 675 A G E - E 0 86A 0 11,-1.5 11,-2.9 -70,-0.1 2,-0.4 -0.996 42.0 -67.1 158.8-162.3 23.7 34.0 8.0 76 676 A V E -aE 7 85A 3 -70,-2.3 -68,-3.0 -2,-0.3 2,-0.5 -0.999 32.4-163.6-131.8 131.6 21.7 35.6 10.7 77 677 A C E -aE 8 84A 0 7,-2.9 7,-2.5 -2,-0.4 2,-0.6 -0.975 7.6-153.0-113.0 127.5 19.4 38.5 10.2 78 678 A V E - E 0 83A 75 -70,-0.6 2,-0.6 -2,-0.5 -68,-0.4 -0.905 10.4-174.4 -98.1 125.0 18.1 40.6 13.2 79 679 A R E > - E 0 82A 61 3,-2.7 3,-2.2 -2,-0.6 -2,-0.0 -0.839 60.8 -69.8-119.1 87.9 14.8 42.1 12.5 80 680 A G T 3 S- 0 0 55 -2,-0.6 -1,-0.2 1,-0.3 0, 0.0 -0.401 119.7 -7.0 58.5-132.1 14.2 44.3 15.5 81 681 A P T 3 S+ 0 0 132 0, 0.0 2,-0.4 0, 0.0 -1,-0.3 0.549 120.1 92.6 -69.2 -4.7 13.5 41.9 18.4 82 682 A E E < - E 0 79A 72 -3,-2.2 -3,-2.7 -36,-0.1 2,-0.5 -0.763 60.9-154.3 -97.7 132.1 13.5 38.8 16.1 83 683 A N E - E 0 78A 33 -39,-0.5 -39,-3.1 -2,-0.4 2,-0.5 -0.919 16.2-170.3-101.8 128.6 16.6 36.7 15.4 84 684 A I E -DE 43 77A 0 -7,-2.5 -7,-2.9 -2,-0.5 2,-0.4 -0.965 15.1-151.1-124.9 115.4 16.4 34.9 12.1 85 685 A M E -DE 42 76A 0 -43,-2.1 -43,-2.5 -2,-0.5 2,-0.6 -0.716 16.4-147.3 -79.2 130.8 18.7 32.2 10.8 86 686 A V E +DE 41 75A 0 -11,-2.9 -12,-2.8 -2,-0.4 -11,-1.5 -0.907 29.5 167.1-105.4 119.1 18.9 32.2 7.0 87 687 A T E -DE 40 73A 7 -47,-3.0 -47,-3.3 -2,-0.6 -14,-0.2 -0.767 38.1 -71.7-132.8 167.5 19.5 28.7 5.6 88 688 A E E -D 39 0A 27 -16,-2.2 2,-0.8 -2,-0.2 -49,-0.2 -0.391 35.8-136.0 -61.2 126.8 19.4 26.6 2.4 89 689 A Y - 0 0 49 -51,-1.1 2,-0.5 -2,-0.2 -51,-0.1 -0.801 20.5-160.9 -78.3 115.7 16.1 25.8 0.9 90 690 A V > - 0 0 6 -2,-0.8 3,-1.7 1,-0.1 52,-0.2 -0.926 20.6-125.1-102.4 125.9 16.4 22.1 -0.0 91 691 A E T 3 S+ 0 0 122 -2,-0.5 52,-0.2 1,-0.3 -1,-0.1 0.660 96.2 34.5 -46.7 -51.7 13.7 21.3 -2.7 92 692 A H T 3 S- 0 0 56 50,-2.5 -1,-0.3 1,-0.2 51,-0.1 0.352 97.5-141.2 -99.1 6.5 11.7 18.4 -1.3 93 693 A G < + 0 0 13 -3,-1.7 49,-2.8 49,-0.2 -1,-0.2 -0.142 51.4 5.4 76.5-164.9 11.8 19.2 2.4 94 694 A P B > -G 141 0B 40 0, 0.0 4,-1.6 0, 0.0 47,-0.2 -0.239 56.7-139.2 -61.0 140.6 12.1 17.0 5.5 95 695 A L H > S+ 0 0 0 45,-3.1 4,-3.0 42,-1.2 5,-0.2 0.863 99.1 56.6 -68.7 -40.7 12.8 13.4 5.0 96 696 A D H > S+ 0 0 10 41,-0.8 4,-2.1 44,-0.3 -1,-0.2 0.924 109.4 46.1 -60.7 -42.0 10.4 12.2 7.8 97 697 A V H > S+ 0 0 60 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.912 114.7 48.7 -65.7 -40.4 7.4 14.0 6.2 98 698 A W H X S+ 0 0 7 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.892 109.6 51.0 -68.7 -41.8 8.3 12.6 2.8 99 699 A L H < S+ 0 0 2 -4,-3.0 -1,-0.2 2,-0.2 -2,-0.2 0.905 108.3 51.6 -65.6 -40.6 8.7 9.0 4.1 100 700 A R H >< S+ 0 0 89 -4,-2.1 3,-0.9 1,-0.2 -1,-0.2 0.927 112.6 46.5 -62.0 -41.9 5.3 9.0 5.8 101 701 A R H 3< S+ 0 0 157 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.887 117.9 41.7 -65.8 -40.1 3.7 10.2 2.6 102 702 A E T >< S+ 0 0 40 -4,-2.4 3,-2.0 -5,-0.1 -1,-0.2 0.204 84.8 154.5 -93.6 15.6 5.6 7.7 0.4 103 703 A R T < + 0 0 90 -3,-0.9 -3,-0.1 1,-0.2 103,-0.0 -0.154 62.8 22.6 -41.1 124.3 5.1 4.9 3.1 104 704 A G T 3 S+ 0 0 67 2,-0.1 -1,-0.2 -5,-0.0 -2,-0.1 0.032 115.2 61.2 103.7 -26.9 5.2 1.5 1.4 105 705 A H < + 0 0 112 -3,-2.0 -2,-0.1 2,-0.1 -3,-0.0 0.025 64.9 106.4-129.7 35.4 7.2 2.2 -1.8 106 706 A V - 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0 0 15 -2,-0.5 3,-0.7 -3,-0.1 -10,-0.1 -0.684 25.1 -96.1 -98.4 158.1 10.0 6.3 14.9 210 814 A P T 3 S+ 0 0 16 0, 0.0 -1,-0.1 0, 0.0 -8,-0.1 -0.374 103.9 28.5 -74.5 155.1 9.7 4.0 17.9 211 815 A L T > S+ 0 0 19 -34,-0.1 3,-0.8 -2,-0.1 8,-0.1 0.699 75.3 130.2 70.0 24.4 8.0 5.1 21.1 212 816 A Q T < S+ 0 0 84 -3,-0.7 -1,-0.0 1,-0.2 -36,-0.0 0.782 71.8 52.7 -76.7 -27.3 5.7 7.6 19.3 213 817 A S T 3 S+ 0 0 105 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 0.313 94.0 102.0 -84.8 7.4 2.6 6.2 21.0 214 818 A R S < S- 0 0 102 -3,-0.8 5,-0.0 1,-0.1 0, 0.0 -0.741 70.5-126.0-100.4 141.3 4.3 6.7 24.5 215 819 A S > - 0 0 43 -2,-0.3 4,-2.0 1,-0.1 3,-0.4 -0.300 35.2-101.0 -73.9 163.7 3.7 9.5 27.0 216 820 A P H > S+ 0 0 79 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.912 124.4 53.7 -51.2 -46.2 6.6 11.6 28.2 217 821 A S H > S+ 0 0 81 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.878 108.8 49.4 -56.3 -40.9 6.7 9.6 31.5 218 822 A E H > S+ 0 0 90 -3,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.831 108.6 51.3 -69.6 -35.9 7.0 6.4 29.5 219 823 A K H X S+ 0 0 27 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.917 112.2 47.4 -67.3 -44.5 9.8 7.6 27.3 220 824 A E H X S+ 0 0 49 -4,-2.4 4,-2.9 -5,-0.2 3,-0.2 0.950 112.0 49.8 -56.1 -51.7 11.7 8.6 30.4 221 825 A H H X S+ 0 0 115 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.885 105.4 57.8 -58.6 -40.7 11.0 5.3 32.0 222 826 A F H <>S+ 0 0 13 -4,-2.4 5,-2.4 1,-0.2 -1,-0.2 0.913 111.6 42.1 -54.6 -46.3 12.2 3.5 28.9 223 827 A Y H ><5S+ 0 0 10 -4,-1.7 3,-2.1 -3,-0.2 -2,-0.2 0.936 111.5 54.2 -67.8 -46.6 15.6 5.2 29.2 224 828 A Q H 3<5S+ 0 0 129 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.925 113.3 42.2 -55.2 -46.7 15.7 4.7 33.0 225 829 A R T 3<5S- 0 0 51 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.325 109.9-129.1 -78.8 8.5 15.2 0.9 32.6 226 830 A Q T < 5 - 0 0 117 -3,-2.1 -3,-0.2 -5,-0.1 19,-0.1 0.800 37.4-174.0 36.8 47.5 17.7 1.0 29.6 227 831 A H < - 0 0 86 -5,-2.4 2,-0.3 -6,-0.2 -1,-0.1 -0.280 23.7-113.2 -64.1 149.9 15.3 -0.8 27.4 228 832 A R - 0 0 139 1,-0.1 -1,-0.1 16,-0.0 3,-0.1 -0.670 25.8-124.6 -90.4 138.5 16.5 -1.8 24.0 229 833 A L - 0 0 23 -2,-0.3 -1,-0.1 14,-0.3 14,-0.0 -0.395 40.6 -82.4 -80.6 157.8 15.0 -0.3 20.9 230 834 A P - 0 0 61 0, 0.0 -1,-0.2 0, 0.0 -29,-0.0 -0.049 41.5-110.8 -62.5 166.1 13.5 -2.4 18.1 231 835 A E 0 0 152 1,-0.1 5,-0.1 -3,-0.1 6,-0.0 -0.706 360.0 360.0 -92.3 136.9 15.5 -4.1 15.4 232 836 A P 0 0 53 0, 0.0 -1,-0.1 0, 0.0 4,-0.0 0.566 360.0 360.0 -74.2 360.0 15.2 -3.0 11.8 233 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 234 840 A Q 0 0 120 0, 0.0 4,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 73.5 20.2 -6.4 8.7 235 841 A L > + 0 0 13 2,-0.1 4,-2.9 1,-0.1 5,-0.2 0.135 360.0 105.1 -82.4 5.5 21.2 -2.9 9.5 236 842 A A H > S+ 0 0 13 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.867 71.2 47.1 -59.7 -46.6 20.4 -4.5 12.9 237 843 A T H > S+ 0 0 100 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.935 115.7 46.7 -58.6 -50.4 24.0 -5.0 14.1 238 844 A L H > S+ 0 0 7 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.913 113.9 46.5 -56.8 -49.9 24.8 -1.4 13.1 239 845 A T H X S+ 0 0 2 -4,-2.9 4,-2.9 1,-0.2 -1,-0.2 0.907 112.7 49.4 -66.8 -41.7 21.7 0.1 14.7 240 846 A S H < S+ 0 0 53 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.887 110.5 52.1 -62.4 -40.1 22.1 -1.9 17.9 241 847 A Q H >< S+ 0 0 66 -4,-2.4 3,-0.8 -5,-0.2 -2,-0.2 0.945 113.5 42.9 -59.9 -50.4 25.8 -0.8 18.1 242 848 A C H 3< S+ 0 0 0 -4,-2.6 2,-0.8 1,-0.3 -2,-0.2 0.906 110.4 57.8 -59.6 -43.8 24.8 2.8 17.7 243 849 A L T 3< S+ 0 0 6 -4,-2.9 2,-0.5 -5,-0.2 -14,-0.3 -0.190 75.1 128.5 -88.3 45.5 21.9 2.4 20.1 244 850 A T < - 0 0 22 -2,-0.8 6,-0.1 -3,-0.8 5,-0.1 -0.857 58.6-140.5 -95.3 129.4 24.2 1.2 23.0 245 851 A Y S S+ 0 0 21 -2,-0.5 -63,-0.2 -19,-0.1 -1,-0.1 0.917 86.2 78.6 -61.7 -42.0 23.5 3.2 26.1 246 852 A E S > S- 0 0 84 1,-0.2 3,-1.7 -3,-0.1 4,-0.4 -0.539 75.1-151.8 -69.0 113.7 27.3 3.4 27.1 247 853 A P G > S+ 0 0 37 0, 0.0 3,-1.9 0, 0.0 -1,-0.2 0.897 89.2 61.8 -58.0 -40.1 28.7 6.1 24.8 248 854 A T G 3 S+ 0 0 116 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.1 0.465 99.3 57.6 -67.7 -2.1 32.2 4.6 24.7 249 855 A Q G < S+ 0 0 137 -3,-1.7 -1,-0.3 -5,-0.1 -4,-0.1 0.462 79.1 104.2-106.0 -4.5 30.9 1.4 23.0 250 856 A R S < S- 0 0 16 -3,-1.9 -8,-0.2 -4,-0.4 -56,-0.1 -0.595 77.6-114.6 -78.0 136.7 29.3 3.1 20.0 251 857 A P - 0 0 20 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.297 30.1 -99.2 -76.3 157.3 31.4 2.6 16.9 252 858 A S > - 0 0 43 1,-0.1 4,-3.5 4,-0.0 5,-0.1 -0.274 27.5-115.8 -66.9 159.5 33.2 5.4 15.0 253 859 A F H > S+ 0 0 3 2,-0.2 4,-3.6 1,-0.2 5,-0.3 0.851 118.0 61.7 -66.8 -29.1 31.7 6.9 11.9 254 860 A R H > S+ 0 0 86 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.956 111.6 37.8 -55.7 -51.9 34.7 5.6 10.0 255 861 A T H > S+ 0 0 56 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.958 116.6 51.4 -62.6 -52.8 33.6 2.1 11.0 256 862 A I H X S+ 0 0 0 -4,-3.5 4,-2.0 1,-0.2 -2,-0.2 0.943 115.0 43.3 -51.9 -48.4 29.9 2.9 10.6 257 863 A L H X S+ 0 0 41 -4,-3.6 4,-2.1 1,-0.2 -1,-0.2 0.900 110.5 53.6 -66.7 -43.9 30.6 4.2 7.1 258 864 A R H X S+ 0 0 159 -4,-2.6 4,-1.9 -5,-0.3 -1,-0.2 0.887 111.4 49.0 -56.3 -37.5 33.0 1.4 6.1 259 865 A D H < S+ 0 0 61 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.886 108.3 50.4 -70.7 -41.0 30.2 -1.0 7.1 260 866 A L H >X S+ 0 0 0 -4,-2.0 4,-1.3 -5,-0.2 3,-0.8 0.846 110.5 52.6 -66.5 -32.3 27.4 0.7 5.1 261 867 A T H >< S+ 0 0 78 -4,-2.1 3,-0.6 1,-0.2 -2,-0.2 0.947 107.1 49.0 -63.7 -53.2 29.7 0.7 2.0 262 868 A R T 3< S+ 0 0 127 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.167 109.4 56.4 -79.2 18.1 30.4 -3.0 2.2 263 869 A L T <4 0 0 91 -3,-0.8 -1,-0.2 -5,-0.1 -2,-0.2 0.589 360.0 360.0-110.2 -31.6 26.6 -3.6 2.5 264 870 A Q << 0 0 111 -4,-1.3 -3,-0.1 -3,-0.6 -4,-0.0 0.004 360.0 360.0-149.5 360.0 25.7 -1.7 -0.7