NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.5535 8.1749 117.3755 63.7476 70.1246 172.8983 2 T 4.6963 9.3847 121.0652 60.3859 72.5751 171.5515 3 T 5.2620 8.3918 115.7488 60.1291 72.5422 172.5074 4 L 5.0206 9.1934 123.3140 54.7214 44.7725 174.8398 5 A 5.1247 8.3867 119.5761 51.0509 22.1665 175.7527 6 F 5.0356 8.4880 116.9796 55.3554 41.7968 173.8078 7 R 5.1677 8.8295 120.3726 55.6946 31.6342 175.6911 8 F 4.9276 9.4406 116.9309 55.9221 41.0742 174.3156 9 Q 3.6861 8.9971 121.1142 59.6481 28.4256 178.1875 10 G 3.5174 5.3800 102.4789 45.7858 0.0000 172.4551 11 G 4.2870 6.8280 109.0178 43.8737 0.0000 177.1553 12 I 5.1677 8.6054 122.5469 59.3599 41.0229 172.9595 13 I 4.3236 7.8240 126.2155 59.4261 39.9097 174.9751 14 V 4.7521 8.0880 124.3698 61.2716 34.2204 174.2083 15 A 4.8743 8.9062 128.9279 50.4351 22.4993 174.9771 16 V 4.9580 8.2516 112.8554 60.1146 36.3359 174.6545 17 D 4.9599 8.3377 122.6736 52.0274 42.3472 176.5558 18 S 4.8146 8.1878 112.0658 58.5364 64.0562 173.3570 19 R 5.0767 8.7127 120.3100 56.1723 31.5282 175.2372 20 A 4.9270 9.0708 126.0833 50.4503 22.4704 175.1791 21 T 5.1306 8.5691 110.4163 60.2032 72.7788 174.2645 22 A 4.6290 8.9844 124.6317 50.4388 20.4269 177.0379 23 G 4.2092 8.2372 114.0836 45.9464 0.0000 173.3869 24 N 4.6609 8.7624 121.7898 52.8766 39.3156 174.5815 25 W 4.2705 7.8390 129.1906 56.8220 31.1158 175.2661 26 V 3.9171 7.3869 125.9660 61.5980 30.1105 175.1226 27 A 4.1905 8.4791 132.1172 54.7197 18.8667 177.5305 28 S 4.5650 7.4199 107.5471 57.6751 65.0576 174.4910 29 Q 4.6094 8.6236 122.9241 55.7868 30.1936 175.7039 30 T 4.6956 7.5736 108.4641 61.1921 68.5464 174.2637 31 V 4.2296 7.8514 121.2806 62.7951 33.3599 175.3177 32 K 4.3152 8.5629 126.3096 55.4443 32.7412 176.4099 33 K 4.5753 8.6411 123.6974 55.9076 33.7315 175.6501 34 V 4.7874 7.6425 119.9053 61.2120 34.2038 174.2163 35 I 4.3573 8.6141 128.4938 59.4377 40.2290 174.8866 36 E 4.7624 8.7676 129.4272 54.5907 28.1630 175.6159 37 I 3.7630 8.0823 124.7453 63.8738 37.7076 175.8219 38 N 4.2890 7.9546 114.4696 51.7135 38.7842 173.5240 39 P 3.8387 0.0000 0.0000 64.7403 31.4996 177.0900 40 F 5.0810 10.0922 115.1796 56.8692 42.8145 173.7223 41 L 5.1973 8.7971 120.3348 52.9356 44.9192 175.5982 42 L 5.2124 9.5998 123.7234 52.8349 45.6742 175.7018 43 G 4.5063 8.9250 108.5066 44.7405 0.0000 171.9482 44 T 5.0991 8.9268 115.7445 60.7869 70.8389 174.0758 45 M 4.9827 8.8345 122.4861 53.6713 35.1589 175.0862 46 A 4.5445 8.8258 122.5843 50.8171 22.9872 173.8339 47 G 4.1869 9.1595 106.0304 44.2140 0.0000 175.6056 48 G 3.6635 9.8381 115.0073 44.8715 0.0000 173.0759 49 A 3.9452 8.8398 127.2013 55.4768 18.2424 179.1142 50 A 3.9646 8.0144 117.5738 55.6230 18.5636 179.1485 51 D 4.4984 8.2330 116.4532 58.2224 40.8586 178.8167 52 C 4.2757 8.3250 116.8994 62.6669 28.2145 175.7315 53 Q 4.0329 8.3405 119.3722 59.3365 28.5182 179.4513 54 F 3.7668 8.5407 121.3847 61.2714 39.4660 177.3332 55 W 4.5505 8.2419 118.2763 59.6556 28.8588 178.4451 56 E 4.2624 8.9346 119.2537 59.4311 28.8900 179.2542 57 T 3.9162 7.9812 116.0415 66.2021 68.4359 176.5973 58 W 4.0004 8.2605 130.4939 60.0325 30.6704 177.6712 59 L 3.7019 8.4839 120.7018 58.1550 41.5689 178.9898 60 G 3.7344 8.0908 105.4411 48.2934 0.0000 175.6661 61 S 4.0876 7.6175 117.1750 61.3012 62.7652 176.9103 62 Q 3.7749 7.4955 120.8241 58.8536 28.3418 178.4538 63 C 4.0924 8.0759 117.9493 62.6894 28.1772 176.0133 64 R 3.8806 7.9949 120.3017 59.5224 29.6643 178.6190 65 L 4.0008 7.7983 118.3480 57.7888 41.5533 178.9379 66 H 4.0828 8.0553 118.3142 59.4215 29.9557 177.2638 67 E 4.4982 8.0890 121.6140 58.8986 29.0190 179.3725 68 L 4.0402 7.7089 118.3788 57.4390 41.7198 179.1027 69 R 4.0719 7.8747 118.0712 58.5635 30.2578 177.3748 70 E 4.3853 8.3974 115.0306 54.6809 30.4616 175.7323 71 K 3.9218 7.7925 117.3272 56.4020 30.5796 174.4028 72 E 4.6307 7.4443 115.0711 54.7527 32.5968 173.7495 73 R 4.2020 8.3984 125.5021 55.8295 30.6803 176.2210 74 I 3.6499 7.9629 125.9878 61.1226 38.7533 176.1759 75 S 4.4222 8.2513 121.2363 57.8794 65.3499 175.5170 76 V 3.6224 8.3205 122.3837 66.1034 31.2913 178.3592 77 A 3.9510 7.9076 119.8099 55.1355 18.4721 179.3423 78 A 3.9146 8.3037 119.4570 55.1054 18.0280 179.7176 79 A 3.9132 8.4266 120.0112 55.3729 18.4361 180.0599 80 S 4.1232 8.1987 112.8266 61.4873 63.0162 176.5755 81 K 3.9921 8.1385 122.9822 58.7381 31.8534 179.0050 82 I 3.7382 7.5827 120.3572 64.2479 37.0556 177.8634 83 L 4.1980 7.6898 120.5549 58.3547 41.9926 178.7363 84 S 4.1179 8.2927 113.0896 61.8169 62.0939 176.0596 85 N 4.4567 8.4659 117.9443 55.9649 38.5408 177.0877 86 L 4.0456 8.2229 122.2116 58.1772 41.9299 179.2429 87 V 3.4188 8.0603 119.5312 65.1479 30.9397 177.6382 88 Y 4.0717 8.2419 119.9705 60.5100 38.3986 177.6298 89 Q 3.8422 7.8336 118.2101 58.7244 28.9796 177.5639 90 Y 4.2230 7.4950 115.1480 56.3244 38.0943 175.1631 91 K 3.8201 7.2018 122.4976 58.3325 32.4821 176.4431 92 G 3.9671 8.9665 114.2066 45.5064 0.0000 174.2243 93 A 4.0271 7.8747 121.6371 53.2292 18.5156 178.1685 94 G 4.1532 8.3869 102.5253 45.1081 0.0000 174.1762 95 L 4.1471 7.7358 119.4787 54.8161 42.3298 176.7820 96 S 4.6955 9.1704 116.9123 57.0261 64.7483 172.3050 97 M 5.2278 8.5328 123.4492 53.9259 34.2305 174.3435 98 G 4.1056 9.7108 110.8166 44.8709 0.0000 171.7500 99 T 5.0999 8.5525 119.8210 60.0618 71.3830 172.6303 100 M 4.7011 8.5722 123.5648 53.9570 35.4820 173.8693 101 I 4.8051 8.6004 127.5033 60.2278 38.6296 174.6628 102 C 4.8324 9.0255 126.1388 57.9473 30.8086 173.9758 103 G 4.4310 8.3352 109.3172 45.5617 0.0000 171.1752 104 Y 4.8001 8.6218 120.4909 56.1885 41.2079 175.3008 105 T 4.2122 8.6321 116.1856 61.7794 69.0490 173.8892 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 T 8.17 4.55 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 1.29 0.00 0.00 2 T 9.38 4.70 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 1.22 0.00 0.00 3 T 8.39 5.26 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 1.27 0.00 0.00 4 L 9.19 5.02 0.00 1.70 1.80 1.04 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 5 A 8.39 5.12 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.49 5.04 0.00 3.10 3.08 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.83 5.17 0.00 1.80 1.98 0.00 3.16 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 8 F 9.44 4.93 0.00 3.32 3.25 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 0.00 9 Q 9.00 3.69 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.56 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 10 G 5.38 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 G 6.83 4.29 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 0.00 0.00 0.00 12 I 8.61 5.17 1.89 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.70 0.91 0.00 0.00 13 I 7.82 4.32 0.56 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.06 0.39 0.67 0.00 0.00 14 V 8.09 4.75 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 0.83 0.00 0.00 0.88 0.00 0.00 15 A 8.91 4.87 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 16 V 8.25 4.96 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 0.77 0.00 0.00 0.93 0.00 0.00 17 D 8.34 4.96 0.00 2.67 2.71 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 0.00 0.00 0.00 0.00 18 S 8.19 4.81 0.00 4.10 4.02 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.71 5.08 0.00 1.79 1.96 0.00 3.17 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 20 A 9.07 4.93 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.57 5.13 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 22 A 8.98 4.63 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.24 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.76 4.66 0.00 2.81 2.92 0.00 0.00 6.71 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 25 W 7.84 4.27 0.00 3.43 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.39 3.92 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.75 0.00 0.00 27 A 8.48 4.19 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.42 4.57 0.00 3.82 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 8.62 4.61 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.29 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 30 T 7.57 4.70 4.23 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 1.19 0.00 0.00 31 V 7.85 4.23 2.08 0.00 0.00 0.00 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 0.93 0.00 0.00 32 K 8.56 4.32 0.00 1.66 1.75 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.52 7.81 33 K 8.64 4.58 0.00 1.70 1.94 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.77 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.42 7.81 34 V 7.64 4.79 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.94 0.00 0.00 35 I 8.61 4.36 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.29 1.01 0.00 0.00 36 E 8.77 4.76 0.00 1.98 1.88 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 2.27 2.31 0.00 37 I 8.08 3.76 1.95 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.76 0.92 0.00 0.00 38 N 7.95 4.29 0.00 2.94 2.92 0.00 0.00 6.21 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 39 P 0.00 3.84 0.00 1.45 1.57 0.00 3.65 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.00 0.00 40 F 10.09 5.08 0.00 2.71 3.01 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 41 L 8.80 5.20 0.00 1.60 1.57 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 42 L 9.60 5.21 0.00 1.54 1.53 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.92 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 8.93 5.10 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 45 M 8.83 4.98 0.00 1.90 2.01 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 2.59 2.64 0.00 46 A 8.83 4.54 1.28 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 0.00 0.00 0.00 47 G 9.16 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 9.84 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 A 8.84 3.95 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 A 8.01 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.23 4.50 0.00 2.94 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 52 C 8.32 4.28 0.00 3.19 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.34 4.03 0.00 2.36 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 54 F 8.54 3.77 0.00 3.00 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 0.00 55 W 8.24 4.55 0.00 3.77 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.93 4.26 0.00 2.26 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 57 T 7.98 3.92 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 58 W 8.26 4.00 0.00 3.05 3.38 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.48 3.70 0.00 2.16 1.93 0.99 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.09 3.73 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 0.00 0.00 0.00 0.00 61 S 7.62 4.09 0.00 3.76 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 62 Q 7.50 3.77 0.00 1.76 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 63 C 8.08 4.09 0.00 3.07 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 R 7.99 3.88 0.00 1.90 2.04 0.00 3.14 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 65 L 7.80 4.00 0.00 2.01 1.67 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 66 H 8.06 4.08 0.00 3.24 3.49 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.09 4.50 0.00 2.23 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.34 0.00 68 L 7.71 4.04 0.00 1.76 1.71 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 69 R 7.87 4.07 0.00 2.05 1.87 0.00 3.23 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 70 E 8.40 4.39 0.00 1.76 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 2.12 2.22 0.00 71 K 7.79 3.92 0.00 1.87 1.83 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.33 7.81 72 E 7.44 4.63 0.00 2.01 1.72 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 0.00 2.28 2.25 0.00 73 R 8.40 4.20 0.00 1.69 1.71 0.00 2.57 0.00 0.00 2.63 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 74 I 7.96 3.65 1.76 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.67 0.94 0.00 0.00 75 S 8.25 4.42 0.00 4.07 3.94 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 0.00 0.00 0.00 0.00 76 V 8.32 3.62 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.96 0.00 0.00 77 A 7.91 3.95 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.30 3.91 1.25 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 0.00 0.00 0.00 79 A 8.43 3.91 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.20 4.12 0.00 4.09 4.24 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.14 3.99 0.00 2.07 1.85 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.47 7.81 82 I 7.58 3.74 2.06 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.72 0.94 0.00 0.00 83 L 7.69 4.20 0.00 1.92 1.93 1.14 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 84 S 8.29 4.12 0.00 3.99 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 85 N 8.47 4.46 0.00 2.99 2.94 0.00 0.00 7.06 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 8.22 4.05 0.00 1.89 1.78 -0.82 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 87 V 8.06 3.42 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.78 0.00 0.00 88 Y 8.24 4.07 0.00 3.11 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.83 3.84 0.00 2.17 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.74 0.00 0.00 0.00 0.00 0.00 2.62 2.50 0.00 90 Y 7.49 4.22 0.00 2.92 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 91 K 7.20 3.82 0.00 1.47 1.37 0.00 1.82 0.00 0.00 1.48 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.37 7.81 92 G 8.97 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 0.00 0.00 0.00 93 A 7.87 4.03 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 G 8.39 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 0.00 0.00 0.00 0.00 95 L 7.74 4.15 0.00 1.60 1.57 0.38 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 96 S 9.17 4.70 0.00 3.86 3.72 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 0.00 0.00 0.00 0.00 97 M 8.53 5.23 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 98 G 9.71 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 0.00 0.00 0.00 99 T 8.55 5.10 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 100 M 8.57 4.70 0.00 2.05 1.87 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 101 I 8.60 4.81 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.65 0.94 0.00 0.00 102 C 9.03 4.83 0.00 2.85 2.81 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 0.00 103 G 8.34 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 0.00 0.00 0.00 0.00 104 Y 8.62 4.80 0.00 3.02 2.79 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 0.00 105 T 8.63 4.21 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