NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2212 8.3144 121.7898 55.7754 33.3727 174.9508 2 E 3.9288 8.5262 125.0650 54.1476 30.2548 175.9827 3 T 4.1710 8.7368 118.4736 61.4442 72.0601 174.9159 4 A 4.0003 8.5358 123.4023 55.1805 18.5529 180.0327 5 A 3.9881 7.9961 118.9134 55.2860 18.5625 179.5751 6 A 4.0303 8.0712 119.4299 55.1190 18.3650 179.8258 7 K 4.0877 8.4470 118.5217 59.4604 32.1762 178.9023 8 F 4.0523 8.4038 121.1277 61.3116 39.3676 177.0361 9 E 4.0136 8.3282 117.8869 59.3907 29.0494 179.3087 10 R 3.8839 7.9190 117.7827 59.4750 30.2310 178.1617 11 Q 4.0061 7.9927 116.7634 57.7211 29.1117 176.1636 12 H 4.6766 7.9839 114.1392 54.0925 31.2825 173.2430 13 M 4.7535 7.8455 118.7965 53.5188 33.5138 176.6664 14 D 4.7470 8.9837 122.9144 53.1439 40.9657 175.7029 15 S 4.2987 8.3372 118.9592 61.4660 64.1294 175.5714 16 S 4.7670 7.8625 116.6600 55.8601 60.7595 173.5871 17 T 4.5301 6.9438 124.4899 63.4830 71.1105 173.5634 18 S 4.2702 8.3113 119.7483 60.3057 63.8534 173.5315 19 A 4.0300 7.0160 120.5538 50.8470 21.4424 175.1260 20 A 3.4936 8.1055 123.1243 51.9403 20.4525 175.6720 21 S 4.2539 8.6881 120.3482 58.7739 61.4167 177.2697 22 S 4.1773 9.3803 121.8098 59.4632 63.3409 175.8857 23 S 4.4112 8.6222 115.3244 59.5763 63.3379 174.0287 24 N 4.6956 7.9090 119.3625 54.1634 39.7457 175.4638 25 Y 4.1111 8.0853 119.1688 62.0210 38.6027 177.6888 26 C 4.1963 8.4243 116.9746 59.8789 38.3266 175.8105 27 N 4.4720 8.1714 117.9829 56.3712 38.0924 177.5752 28 Q 3.9049 7.8073 118.7792 59.1551 29.0625 178.1322 29 M 3.5856 7.6177 119.8191 58.6703 31.8408 178.6011 30 M 3.9864 8.0484 118.9544 58.3259 32.0178 178.9255 31 K 3.9153 7.6774 118.8946 59.6676 32.3162 178.9366 32 S 4.1120 8.4590 111.9809 60.5105 62.1552 175.2635 33 R 4.4659 7.5937 118.7138 55.1764 30.2709 175.5677 34 N 4.2658 8.0043 114.4618 54.6851 36.5043 174.9099 35 L 4.5091 8.0849 116.6103 55.1204 42.0410 177.8240 36 T 5.4672 7.5600 106.1736 59.9455 69.7825 174.5360 37 K 4.0856 8.4471 123.7494 59.8641 32.0093 177.1156 38 D 4.7068 8.0091 114.0379 53.3762 43.2918 176.0899 39 R 3.8963 7.0459 113.3423 54.8505 31.7688 174.5924 40 C 4.7292 8.5651 117.3096 55.8508 40.3828 173.7707 41 K 4.1626 8.4851 127.4726 55.6805 32.3213 174.6460 42 P 4.7594 0.0000 0.0000 64.8870 32.2560 176.4433 43 V 5.0273 7.5734 117.9923 60.8363 34.6927 174.2758 44 N 4.6706 8.8697 124.1737 52.7451 42.7980 172.8658 45 T 4.7576 7.8511 121.8033 61.6322 71.5190 172.8808 46 F 4.8275 8.9404 124.8733 55.6244 42.0522 174.5838 47 V 4.5685 9.1081 123.4134 60.9393 33.4573 175.7745 48 H 5.4649 8.5058 127.2138 54.3824 26.6107 172.8054 49 E 4.8337 7.7112 117.1936 53.4361 34.3583 176.8119 50 S 4.4690 8.2470 115.9931 57.5843 65.1178 174.8057 51 L 3.9947 8.6128 124.6592 58.4847 41.8002 179.2728 52 A 4.0172 7.9895 120.1442 55.2748 18.1465 179.2188 53 D 4.2971 7.8085 115.9976 57.5222 41.2014 178.8892 54 V 3.7766 7.8817 118.8269 66.1103 31.6871 178.1550 55 Q 3.9318 8.6029 118.0376 58.6878 28.5296 178.4511 56 A 4.0426 7.9203 121.5992 54.6029 18.2436 179.6589 57 V 3.4816 7.5933 117.0664 65.9278 31.3123 176.8590 58 C 3.8150 7.7016 114.2922 57.7827 39.8582 174.0017 59 S 4.6316 7.5671 114.8602 57.8652 63.8639 174.8086 60 Q 4.1378 7.3604 120.5125 56.0384 28.3609 177.1647 61 K 4.1991 7.8295 128.7391 57.4056 33.0415 175.7173 62 N 4.5341 8.8077 127.4722 53.4503 39.8101 174.2988 63 V 4.5942 8.3656 118.2767 59.4388 36.7975 174.6513 64 A 4.4832 8.3640 124.2410 51.8534 19.6088 178.1594 65 C 4.6103 8.7203 118.3562 55.5439 41.5368 175.0025 66 K 3.7516 8.7879 123.5066 59.8244 31.6252 177.5806 67 N 4.4941 7.9899 112.7630 53.4134 37.6203 175.3877 68 G 3.9809 8.4816 108.5175 45.6293 0.0000 174.3206 69 Q 4.2033 8.8175 119.1062 56.4012 29.1840 176.4490 70 T 4.5839 8.2858 108.3179 61.6322 69.1548 173.8444 71 N 4.9795 7.9050 118.1381 54.0214 38.4087 174.7108 72 C 5.3032 7.3856 115.3885 56.7188 43.2541 172.8784 73 Y 5.1108 8.9624 118.5290 56.4471 41.7759 173.9112 74 Q 5.0940 9.2301 125.1840 53.9583 31.6114 174.8519 75 S 4.4127 8.8364 122.0279 58.6858 63.1397 174.1497 76 Y 4.5152 9.5161 122.3033 61.0272 37.8407 176.7785 77 S 4.9364 7.8853 113.8454 57.2501 65.0250 174.1307 78 T 4.2618 8.1940 111.2694 61.6336 70.1999 173.8678 79 M 5.0265 9.2634 122.0719 53.3506 36.9480 174.7192 80 S 4.7781 9.4852 117.4639 58.4081 63.4726 173.1041 81 I 5.2068 9.1507 120.4692 59.5707 41.7674 174.2389 82 T 5.0531 8.9322 119.2054 62.0709 72.0876 172.7460 83 D 5.0722 9.2341 127.2549 53.2975 43.1584 174.9094 84 C 5.2939 9.4485 121.3005 55.3573 39.7494 172.7796 85 R 5.3500 8.6036 124.5707 53.9658 32.8713 174.5386 86 E 4.6867 9.6833 128.0860 55.9207 30.8177 176.7572 87 T 4.2759 8.3433 116.3914 60.8659 69.9629 175.6699 88 G 3.5632 8.6039 111.1630 48.1183 0.0000 174.6239 89 S 4.6265 7.2803 113.0684 57.7690 63.2175 173.9421 90 S 4.2846 7.5051 116.1002 58.4348 62.7913 173.7536 91 K 4.6107 8.4536 125.4094 54.6731 36.2222 175.2308 92 Y 4.4196 8.7427 124.5452 57.6674 39.1586 174.4868 93 P 3.9414 0.0000 0.0000 62.7980 32.1649 176.7296 94 N 4.6449 7.9051 119.9279 52.3769 36.9480 173.0841 95 C 4.5445 7.9583 117.1556 56.3931 36.2931 173.1723 96 A 5.0590 8.6048 125.2186 50.4046 21.9500 174.6249 97 Y 5.1557 8.8726 117.4315 56.2014 42.6622 174.6537 98 K 4.5229 9.3593 124.7229 55.5706 34.0549 175.2206 99 T 4.8427 8.5789 124.2710 62.9135 70.0167 174.4541 100 T 4.5152 8.7317 122.4712 61.6979 71.9005 173.1279 101 Q 4.6911 8.7646 127.8867 56.1432 30.1628 174.5825 102 A 4.5861 8.9613 125.4542 51.3339 23.5933 175.0476 103 N 5.4358 8.7485 116.2881 51.7390 40.8048 174.1059 104 K 4.7601 8.7111 122.3331 54.8456 37.7575 175.4731 105 H 5.0422 9.1896 118.7605 55.6983 30.0402 175.0258 106 I 4.8631 8.7332 115.2518 59.2248 40.9435 174.3273 107 I 4.8992 8.2900 124.1924 59.7188 40.1009 175.1309 108 V 4.7578 8.7820 119.5602 59.3643 36.2228 174.3025 109 A 5.0383 8.7966 125.0098 50.9217 20.7209 175.6267 110 C 5.0964 8.7001 119.7924 55.3395 41.2599 173.0732 111 E 4.6350 8.7185 120.5494 56.6934 33.5917 175.9051 112 G 3.8660 9.3673 111.4366 44.6608 0.0000 171.4376 113 N 4.9786 8.2091 116.2458 50.6800 40.6128 172.4205 114 P 4.3232 0.0000 0.0000 62.7619 31.9580 175.9799 115 Y 5.0126 8.3107 121.6798 57.1957 38.4946 174.5035 116 V 4.4308 7.9012 118.6889 58.2230 36.7780 173.3414 117 P 4.4198 0.0000 0.0000 62.9400 31.1337 177.0304 118 V 4.4803 8.6590 115.4859 61.0760 33.8487 175.2137 119 H 5.0128 7.8256 120.3834 54.7712 33.5302 171.6364 120 F 4.6277 8.7682 128.2236 57.3650 39.3765 174.6237 121 D 4.5200 8.4918 127.0883 56.1455 41.6684 175.7924 122 A 4.6223 6.5860 117.2798 51.5158 22.4374 174.4819 123 S 5.1843 8.8847 113.2692 56.7097 66.0699 174.7421 124 V 4.1520 9.0173 114.5451 61.6980 32.4289 175.4624 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 K 8.31 4.22 0.00 1.74 1.79 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.53 3.93 0.00 2.06 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 3 T 8.74 4.17 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 4 A 8.54 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 A 8.00 3.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 A 8.07 4.03 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.45 4.09 0.00 1.96 2.03 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.44 7.81 8 F 8.40 4.05 0.00 3.29 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.33 4.01 0.00 2.31 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.72 0.00 10 R 7.92 3.88 0.00 1.81 2.07 0.00 3.35 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 11 Q 7.99 4.01 0.00 1.47 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.46 0.00 0.00 0.00 0.00 0.00 2.23 2.50 0.00 12 H 7.98 4.68 0.00 1.90 2.71 0.00 5.60 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.85 4.75 0.00 1.98 2.18 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.65 0.00 14 D 8.98 4.75 0.00 2.74 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.34 4.30 0.00 3.96 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 7.86 4.77 0.00 3.87 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 6.94 4.53 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 18 S 8.31 4.27 0.00 3.93 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 A 7.02 4.03 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.11 3.49 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.69 4.25 0.00 3.87 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 9.38 4.18 0.00 4.10 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.62 4.41 0.00 4.04 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 N 7.91 4.70 0.00 2.77 2.86 0.00 0.00 6.75 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 8.09 4.11 0.00 3.16 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 C 8.42 4.20 0.00 3.17 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.17 4.47 0.00 2.96 2.92 0.00 0.00 7.01 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 Q 7.81 3.90 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.87 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 29 M 7.62 3.59 0.00 0.85 1.33 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.22 0.00 30 M 8.05 3.99 0.00 1.77 2.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.36 0.00 31 K 7.68 3.92 0.00 1.85 2.02 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.44 7.81 32 S 8.46 4.11 0.00 3.77 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.59 4.47 0.00 1.86 2.03 0.00 3.64 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.91 0.00 34 N 8.00 4.27 0.00 2.87 2.93 0.00 0.00 6.83 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 8.08 4.51 0.00 1.82 1.63 0.81 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.56 5.47 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 37 K 8.45 4.09 0.00 1.94 1.92 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.47 1.45 7.81 38 D 8.01 4.71 0.00 2.48 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.05 3.90 0.00 1.81 1.70 0.00 2.87 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.56 0.00 40 C 8.57 4.73 0.00 3.11 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.49 4.16 0.00 1.82 1.77 0.00 1.77 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.56 1.38 7.81 42 P 0.00 4.76 0.00 2.19 2.32 0.00 3.88 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.83 0.00 43 V 7.57 5.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.97 0.00 0.00 44 N 8.87 4.67 0.00 2.62 2.20 0.00 0.00 6.82 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 7.85 4.76 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 46 F 8.94 4.83 0.00 2.98 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 9.11 4.57 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.10 0.00 0.00 48 H 8.51 5.46 0.00 3.05 3.53 0.00 5.61 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.71 4.83 0.00 1.95 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 50 S 8.25 4.47 0.00 4.07 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 8.61 3.99 0.00 1.83 1.75 1.02 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.99 4.02 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 7.81 4.30 0.00 2.89 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.88 3.78 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.09 0.00 0.00 55 Q 8.60 3.93 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.33 2.65 0.00 56 A 7.92 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.59 3.48 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.98 0.00 0.00 58 C 7.70 3.81 0.00 2.90 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 7.57 4.63 0.00 3.87 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Q 7.36 4.14 0.00 1.85 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.96 0.00 0.00 0.00 0.00 0.00 1.48 2.08 0.00 61 K 7.83 4.20 0.00 2.07 1.89 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.44 7.81 62 N 8.81 4.53 0.00 2.83 2.69 0.00 0.00 7.00 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 8.37 4.59 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.86 0.00 0.00 64 A 8.36 4.48 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 C 8.72 4.61 0.00 3.14 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 K 8.79 3.75 0.00 1.91 1.87 0.00 1.82 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.41 7.81 67 N 7.99 4.49 0.00 2.84 2.88 0.00 0.00 6.29 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.48 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 8.82 4.20 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.27 0.00 70 T 8.29 4.58 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 71 N 7.91 4.98 0.00 3.06 3.14 0.00 0.00 6.03 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 C 7.39 5.30 0.00 3.04 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 Y 8.96 5.11 0.00 2.74 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 9.23 5.09 0.00 2.03 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.00 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 75 S 8.84 4.41 0.00 3.91 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 9.52 4.52 0.00 2.99 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 7.89 4.94 0.00 3.80 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.19 4.26 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 79 M 9.26 5.03 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 80 S 9.49 4.78 0.00 3.91 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 9.15 5.21 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.20 1.02 0.00 0.00 82 T 8.93 5.05 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 83 D 9.23 5.07 0.00 2.60 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 C 9.45 5.29 0.00 2.80 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 R 8.60 5.35 0.00 1.96 1.81 0.00 3.13 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 86 E 9.68 4.69 0.00 2.23 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.47 0.00 87 T 8.34 4.28 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 88 G 8.60 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 7.28 4.63 0.00 4.16 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 S 7.51 4.28 0.00 3.63 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.45 4.61 0.00 1.83 1.64 0.00 1.76 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 1.43 7.81 92 Y 8.74 4.42 0.00 2.98 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 3.94 0.00 1.80 0.89 0.00 3.61 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.58 0.00 94 N 7.91 4.64 0.00 2.82 2.76 0.00 0.00 7.01 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 C 7.96 4.54 0.00 3.08 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.60 5.06 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.87 5.16 0.00 3.01 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 9.36 4.52 0.00 1.89 1.73 0.00 1.54 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.50 7.81 99 T 8.58 4.84 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 100 T 8.73 4.52 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 101 Q 8.76 4.69 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 102 A 8.96 4.59 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.75 5.44 0.00 2.58 2.75 0.00 0.00 6.69 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 8.71 4.76 0.00 1.74 1.83 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.44 7.81 105 H 9.19 5.04 0.00 3.10 3.35 0.00 5.57 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.73 4.86 1.80 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.29 1.13 0.00 0.00 107 I 8.29 4.90 1.76 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.70 0.79 0.00 0.00 108 V 8.78 4.76 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.83 0.00 0.00 109 A 8.80 5.04 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 C 8.70 5.10 0.00 2.25 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.72 4.63 0.00 1.95 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 112 G 9.37 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.21 4.98 0.00 2.66 2.71 0.00 0.00 6.89 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 P 0.00 4.32 0.00 2.23 2.05 0.00 3.83 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.31 5.01 0.00 2.92 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 7.90 4.43 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.87 0.00 0.00 117 P 0.00 4.42 0.00 0.49 1.23 0.00 3.32 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 118 V 8.66 4.48 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.93 0.00 0.00 119 H 7.83 5.01 0.00 3.26 3.10 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.77 4.63 0.00 2.81 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.49 4.52 0.00 2.61 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 A 6.59 4.62 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 S 8.88 5.18 0.00 3.97 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 9.02 4.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.98 0.00 0.00