NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2661 8.3044 118.1933 53.6288 33.7708 174.0049 2 L 3.2612 7.4374 120.3685 54.3990 39.1437 172.0594 3 T 3.7831 7.4582 113.2716 64.1148 70.5008 173.8860 4 D 4.7328 7.7567 127.4696 50.4023 42.9547 174.2822 5 P 4.2103 0.0000 0.0000 66.0741 31.5491 178.2497 6 I 3.6409 7.9808 117.7441 64.1970 37.1161 177.7971 7 A 3.9415 8.3396 120.9939 55.7676 18.1108 179.0680 8 D 4.1420 8.0172 115.8964 57.6380 41.2573 177.9577 9 M 3.5423 8.4270 119.0544 58.8639 32.0416 178.5406 10 L 3.8435 7.7701 118.5305 57.9538 41.9385 179.1001 11 T 3.7664 7.6311 115.4306 66.9839 68.2607 176.4771 12 R 3.8795 8.7272 120.6128 59.0058 29.8081 178.3036 13 I 3.8693 7.0355 119.1340 63.8671 37.6402 177.6526 14 R 3.7401 8.4313 119.8237 59.8704 29.4452 178.1190 15 N 4.2039 8.4326 115.5992 56.2888 38.4734 177.1370 16 A 4.0089 7.3416 121.1216 55.7107 18.6932 179.4631 17 T 4.8535 8.2005 109.7020 64.3074 68.9086 177.0574 18 R 3.6759 7.4952 119.7575 58.3919 30.1241 178.1572 19 V 4.0874 7.1461 109.2594 59.5843 33.3692 174.7270 20 Y 3.4751 7.2128 116.9093 56.9280 37.9228 168.6355 21 K 4.7179 8.2324 128.6928 56.3383 35.0477 173.5369 22 E 4.3680 8.1790 128.6128 58.5328 30.2530 176.5338 23 S 5.1521 7.4357 109.1026 58.8984 65.5274 173.8946 24 T 4.7178 8.1085 116.0435 62.2099 72.9450 172.5134 25 D 5.8500 8.6679 122.1824 53.1934 44.4037 175.8851 26 V 4.4193 8.4320 120.2728 61.1502 33.2761 169.1132 27 P 3.8362 0.0000 0.0000 62.9912 31.4556 176.0025 28 A 4.2802 8.5001 127.1658 52.0348 19.3831 177.0235 29 S 4.4283 8.5328 110.5313 56.2589 65.2972 176.4765 30 R 3.8299 8.5631 124.5992 60.1600 29.5886 178.3227 31 F 4.2242 8.1897 118.6466 60.9686 39.6350 177.0553 32 K 3.9169 8.0246 118.1040 60.0533 31.9513 178.5690 33 E 3.3342 8.3497 117.6021 59.9841 29.1694 179.2465 34 E 3.9216 7.9781 120.2248 59.8420 30.1065 179.8635 35 I 3.6559 7.5208 119.6426 64.2178 37.1618 178.1594 36 L 3.8355 7.7027 119.1213 58.2368 41.5317 179.4939 37 R 4.1192 8.5295 118.6976 59.9767 29.9717 178.2348 38 I 3.9027 7.7210 119.2424 64.0979 37.0777 178.3171 39 L 4.3250 8.6636 120.0799 57.4539 41.4583 179.0164 40 A 4.1441 8.0947 120.6639 55.3933 18.2144 178.9319 41 R 3.8203 8.0325 115.9443 59.8430 30.3358 178.3300 42 E 4.0645 8.6608 118.5806 56.8953 30.3949 176.8742 43 G 3.7336 7.8728 106.2744 47.1068 0.0000 174.2414 44 F 4.7614 8.8053 116.1409 56.9987 40.8783 176.4707 45 I 4.5921 7.2807 113.1500 59.3675 39.8270 175.6408 46 K 4.1140 8.4233 122.5521 58.0006 32.3794 177.5287 47 G 3.8278 6.6524 106.3519 46.0051 0.0000 171.6079 48 Y 5.3062 7.7868 117.0515 57.0644 40.4587 173.0718 49 E 4.8325 8.8261 116.1467 55.2722 33.1633 175.1258 50 R 4.7331 8.7224 120.1396 57.3215 31.4075 176.2361 51 V 4.5031 8.0759 111.7716 61.4430 36.5238 173.0773 52 D 4.7592 8.5878 121.7740 54.3227 43.3608 175.8403 53 V 3.9234 8.5342 126.7473 61.4374 31.1212 174.2894 54 D 4.2042 8.4391 127.7442 54.5729 37.0067 176.0085 55 G 4.0315 7.9698 104.2367 45.7715 0.0000 173.0141 56 K 4.3507 7.5270 120.0826 55.0238 33.1736 174.0555 57 P 4.9646 0.0000 0.0000 62.6046 32.1614 174.4750 58 Y 5.1644 8.1212 123.0126 55.9908 42.3336 174.2375 59 L 4.9283 8.3433 118.7589 54.7504 46.0696 175.3013 60 R 4.4247 8.9890 124.1753 56.0683 31.5783 176.0862 61 V 4.6203 8.3538 122.6352 60.4943 32.3375 171.6868 62 Y 4.6734 8.3112 119.3570 58.0235 38.6113 175.4577 63 L 4.3359 8.9441 125.2302 54.3479 42.7953 176.6373 64 K 4.7189 8.4241 123.1550 55.1630 34.3389 174.5536 65 Y 4.8768 8.8017 124.2182 56.2201 42.3533 174.3817 66 G 4.4344 8.4939 108.0145 44.9030 0.0000 171.7444 67 P 4.6882 0.0000 0.0000 61.9925 32.7079 176.1193 68 R 4.1076 8.6519 122.6599 57.0889 30.7076 175.0808 69 R 4.7487 8.4583 120.3853 54.3881 33.7826 175.0059 70 Q 4.3910 8.3230 118.0706 55.6774 30.2104 175.5624 71 G 3.7941 8.7516 107.1224 43.5211 0.0000 171.2056 72 P 4.2154 0.0000 0.0000 63.7559 31.7754 175.3298 73 D 4.3009 8.4848 121.1997 54.5883 38.5616 171.5518 74 P 4.5571 0.0000 0.0000 62.5756 32.3037 176.9365 75 R 4.0323 7.5182 119.1203 56.3667 30.3587 174.7742 76 P 4.6531 0.0000 0.0000 62.2780 32.7156 175.0298 77 E 4.5444 8.6238 120.9648 55.8103 31.7321 174.3448 78 Q 5.0642 8.3750 118.3608 54.1892 32.0932 176.2478 79 V 3.9277 8.3981 119.7029 64.6869 32.1664 176.4698 80 I 4.5049 7.1431 120.6284 59.6608 36.2707 174.8029 81 H 4.1258 8.5989 120.6725 58.4048 29.2202 175.9215 82 H 4.1839 8.5766 127.2638 54.0314 30.7735 171.4230 83 I 4.1805 7.5128 124.8975 59.3804 39.5499 174.1511 84 R 4.5247 8.3087 126.7443 55.0613 34.2149 173.0862 85 R 4.2805 8.3994 122.3610 55.4984 31.6511 173.5686 86 I 3.9681 8.3073 125.7011 62.6312 37.9813 176.8982 87 S 4.3205 7.4257 126.1968 58.9826 60.8394 174.4878 88 K 4.2858 8.1675 124.6248 54.5367 32.9216 176.6396 89 P 4.2513 0.0000 0.0000 65.3227 31.2505 177.3411 90 G 3.9158 7.7102 106.1521 44.5655 0.0000 173.8574 91 R 4.5676 7.1252 116.5006 55.5698 32.2860 172.7417 92 R 3.7359 8.2574 121.3355 55.6551 31.0024 176.9404 93 V 4.0935 8.0174 115.7462 59.7587 33.9878 175.0097 94 Y 5.1486 7.9628 123.0612 57.5497 40.1836 175.5813 95 V 4.6156 8.6757 112.6719 60.5469 36.6463 175.1081 96 G 4.1106 10.6633 115.9201 44.8362 0.0000 174.3940 97 V 3.8258 8.3633 117.7444 64.1012 31.0607 178.5980 98 K 3.8747 8.1654 119.6424 58.6836 32.0611 177.9359 99 E 4.0875 8.3384 117.2571 58.5438 29.6972 175.3611 100 I 3.6239 7.3001 119.6917 59.9646 35.9857 173.4484 101 P 4.2480 0.0000 0.0000 62.9732 31.7027 177.2189 102 R 4.3142 8.1472 120.1443 54.3305 29.6159 176.2750 103 V 3.5476 8.1828 116.9298 62.0980 31.9469 175.5930 104 R 3.4394 8.4485 125.4838 59.8651 27.5078 176.6389 105 R 3.6267 8.3553 117.7889 56.8498 28.0450 177.1997 106 G 4.0803 8.2950 110.6696 45.6788 0.0000 175.5650 107 L 4.0457 8.4070 119.3371 56.5737 41.8233 176.7474 108 G 4.4019 7.8260 105.8574 44.6402 0.0000 172.6148 109 I 5.1009 8.9543 118.5110 59.1035 41.9377 174.4462 110 A 4.9928 8.8033 129.8703 50.3891 21.5640 175.7621 111 I 4.6976 9.1294 124.4080 60.8956 39.6522 175.2016 112 L 4.7564 7.9774 118.9310 55.0871 44.0315 173.7577 113 S 4.5683 8.4627 119.3632 58.6860 63.6735 172.9148 114 T 5.2972 8.7172 116.1971 59.5639 72.2138 174.9795 115 S 4.3936 8.1338 115.9057 60.5310 62.9030 174.8448 116 K 4.5155 8.0497 120.9103 56.0245 33.1252 176.8858 117 G 3.8922 8.7542 104.5723 44.7977 0.0000 173.8783 118 V 4.3756 7.3190 116.0002 62.3301 31.0292 175.0703 119 L 4.9972 8.3984 128.6184 53.2042 45.1651 175.2691 120 T 4.9833 8.4887 110.2631 60.1664 71.5339 175.4839 121 D 4.4354 8.8639 121.9603 57.1530 38.8945 179.4353 122 R 3.9074 7.9782 119.3791 58.5245 29.9973 178.5750 123 E 4.0462 7.5284 115.3369 59.5266 29.8550 178.9467 124 A 4.1282 8.2064 120.6953 55.3493 18.4719 179.3863 125 R 3.8261 8.1067 116.6577 59.5949 30.0249 178.2827 126 K 4.1908 8.6311 117.0622 57.7213 32.2908 177.0542 127 L 4.6176 8.2327 118.5843 54.5300 43.1042 176.2655 128 G 3.8757 8.0283 105.8221 46.8647 0.0000 173.2943 129 V 4.5903 7.4832 113.1328 59.6270 35.8970 173.4398 130 G 4.2278 7.7680 106.9557 46.8604 0.0000 171.5550 131 G 4.6089 7.4439 104.4639 46.0852 0.0000 172.0919 132 E 4.6243 8.3524 125.0490 55.2913 30.6109 176.2522 133 L 4.4462 8.4460 132.1458 55.3559 40.2515 176.9530 134 I 3.8563 8.2775 124.5897 62.2944 38.1100 175.3610 135 C 5.2667 7.2533 114.7754 58.1905 33.1895 171.5965 136 E 5.2891 7.6511 117.0215 54.9323 32.4692 175.1157 137 V 4.7444 9.0868 119.8787 61.1419 35.6689 174.5488 138 W 4.4847 7.9139 121.6974 57.6573 27.4387 174.2064 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 M 8.30 4.27 0.00 2.13 2.26 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 2 L 7.44 3.26 0.00 1.87 1.75 0.91 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 3 T 7.46 3.78 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 1.20 0.00 0.00 4 D 7.76 4.73 0.00 2.63 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.21 0.00 2.21 2.06 0.00 3.66 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 6 I 7.98 3.64 2.07 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.11 0.91 0.00 0.00 7 A 8.34 3.94 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 D 8.02 4.14 0.00 2.79 2.82 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 9 M 8.43 3.54 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 10 L 7.77 3.84 0.00 1.80 1.55 0.83 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.63 3.77 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 1.16 0.00 0.00 12 R 8.73 3.88 0.00 1.79 2.12 0.00 3.04 0.00 0.00 3.43 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 13 I 7.04 3.87 1.91 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.60 0.79 0.00 0.00 14 R 8.43 3.74 0.00 1.80 1.98 0.00 2.99 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 15 N 8.43 4.20 0.00 2.74 2.80 0.00 0.00 6.85 7.16 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 16 A 7.34 4.01 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 17 T 8.20 4.85 4.20 0.00 0.00 0.00 0.00 0.00 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 18 R 7.50 3.68 0.00 1.99 1.98 0.00 3.06 0.00 0.00 3.43 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 19 V 7.15 4.09 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 0.75 0.00 0.00 1.00 0.00 0.00 20 Y 7.21 3.48 0.00 3.01 2.57 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 0.00 0.00 0.00 0.00 21 K 8.23 4.72 0.00 1.79 1.91 0.00 1.84 0.00 0.00 1.64 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.19 7.81 22 E 8.18 4.37 0.00 2.17 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 2.66 2.58 0.00 23 S 7.44 5.15 0.00 3.56 3.43 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 24 T 8.11 4.72 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 1.21 0.00 0.00 25 D 8.67 5.85 0.00 2.66 2.83 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 26 V 8.43 4.42 2.02 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 0.65 0.00 0.00 0.78 0.00 0.00 27 P 0.00 3.84 0.00 1.69 1.75 0.00 3.40 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.22 0.00 28 A 8.50 4.28 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 29 S 8.53 4.43 0.00 3.97 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 30 R 8.56 3.83 0.00 1.93 2.06 0.00 3.23 0.00 0.00 3.30 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.79 0.00 31 F 8.19 4.22 0.00 2.96 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 32 K 8.02 3.92 0.00 1.94 1.67 0.00 1.88 0.00 0.00 1.52 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.45 7.81 33 E 8.35 3.33 0.00 2.12 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 0.00 2.21 2.48 0.00 34 E 7.98 3.92 0.00 1.79 1.97 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 2.37 2.40 0.00 35 I 7.52 3.66 1.78 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.73 0.73 0.00 0.00 36 L 7.70 3.84 0.00 1.44 1.51 0.32 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.53 4.12 0.00 2.07 2.13 0.00 3.14 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.87 0.00 38 I 7.72 3.90 2.05 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.69 0.95 0.00 0.00 39 L 8.66 4.33 0.00 1.78 1.86 0.75 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.09 4.14 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.03 3.82 0.00 1.86 2.14 0.00 3.32 0.00 0.00 3.25 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 42 E 8.66 4.06 0.00 2.25 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 0.00 2.56 2.63 0.00 43 G 7.87 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 44 F 8.81 4.76 0.00 3.18 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 45 I 7.28 4.59 2.15 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 1.53 0.82 0.95 0.00 0.00 46 K 8.42 4.11 0.00 1.81 1.94 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.18 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.54 1.50 7.81 47 G 6.65 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 0.00 0.00 0.00 48 Y 7.79 5.31 0.00 3.15 2.99 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 0.00 0.00 0.00 49 E 8.83 4.83 0.00 2.06 2.06 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 2.63 2.48 0.00 50 R 8.72 4.73 0.00 1.80 2.00 0.00 3.28 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.80 0.00 51 V 8.08 4.50 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 0.96 0.00 0.00 1.04 0.00 0.00 52 D 8.59 4.76 0.00 2.62 2.57 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 0.00 0.00 0.00 0.00 53 V 8.53 3.92 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 0.50 0.00 0.00 0.53 0.00 0.00 54 D 8.44 4.20 0.00 2.89 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 55 G 7.97 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.53 4.35 0.00 2.08 2.10 0.00 1.84 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.54 1.63 7.81 57 P 0.00 4.96 0.00 2.09 2.03 0.00 3.59 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 58 Y 8.12 5.16 0.00 2.94 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 4.93 0.00 1.50 1.51 0.70 0.97 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 60 R 8.99 4.42 0.00 1.54 1.08 0.00 3.08 0.00 0.00 3.15 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 61 V 8.35 4.62 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.87 0.00 0.00 62 Y 8.31 4.67 0.00 3.09 3.04 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 63 L 8.94 4.34 0.00 1.84 1.27 0.92 1.32 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 64 K 8.42 4.72 0.00 1.87 1.69 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.49 7.81 65 Y 8.80 4.88 0.00 3.03 3.06 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 66 G 8.49 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 67 P 0.00 4.69 0.00 2.14 2.20 0.00 3.78 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 68 R 8.65 4.11 0.00 1.81 1.88 0.00 3.13 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 69 R 8.46 4.75 0.00 1.92 1.79 0.00 3.24 0.00 0.00 3.54 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.75 0.00 70 Q 8.32 4.39 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.69 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 71 G 8.75 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 0.00 0.00 0.00 72 P 0.00 4.22 0.00 2.06 2.01 0.00 3.84 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 73 D 8.48 4.30 0.00 2.81 2.69 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 0.00 0.00 0.00 0.00 74 P 0.00 4.56 0.00 2.21 2.24 0.00 3.76 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.94 0.00 75 R 7.52 4.03 0.00 1.83 2.00 0.00 3.23 0.00 0.00 3.73 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 76 P 0.00 4.65 0.00 2.16 2.06 0.00 2.58 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.47 0.00 77 E 8.62 4.54 0.00 2.16 1.97 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 2.44 2.45 0.00 78 Q 8.37 5.06 0.00 1.86 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.79 0.00 0.00 0.00 0.00 0.00 2.61 2.51 0.00 79 V 8.40 3.93 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 0.86 0.00 0.00 0.92 0.00 0.00 80 I 7.14 4.50 1.72 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.81 0.57 0.00 0.00 81 H 8.60 4.13 0.00 3.21 3.45 0.00 5.83 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 82 H 8.58 4.18 0.00 1.94 1.31 0.00 5.76 0.00 0.00 0.00 0.00 6.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.51 4.18 1.54 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.70 0.67 0.00 0.00 84 R 8.31 4.52 0.00 1.68 1.51 0.00 3.13 0.00 0.00 3.03 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 85 R 8.40 4.28 0.00 1.77 1.72 0.00 3.39 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.53 0.00 86 I 8.31 3.97 2.23 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.02 0.90 0.00 0.00 87 S 7.43 4.32 0.00 3.85 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 K 8.17 4.29 0.00 1.82 1.68 0.00 1.70 0.00 0.00 1.84 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.68 7.81 89 P 0.00 4.25 0.00 2.15 2.17 0.00 3.72 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 90 G 7.71 3.92 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 0.00 0.00 0.00 91 R 7.13 4.57 0.00 1.72 1.77 0.00 3.23 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.38 0.00 92 R 8.26 3.74 0.00 1.52 1.28 0.00 3.40 0.00 0.00 3.32 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 93 V 8.02 4.09 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 0.82 0.00 0.00 0.89 0.00 0.00 94 Y 7.96 5.15 0.00 2.90 2.96 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.68 4.62 2.15 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 0.75 0.00 0.00 0.98 0.00 0.00 96 G 10.66 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 97 V 8.36 3.83 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 1.03 0.00 0.00 0.98 0.00 0.00 98 K 8.17 3.87 0.00 1.77 1.97 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.51 7.81 99 E 8.34 4.09 0.00 2.12 2.02 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 2.34 2.29 0.00 100 I 7.30 3.62 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 1.33 0.78 0.99 0.00 0.00 101 P 0.00 4.25 0.00 2.06 2.03 0.00 3.68 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.22 0.00 102 R 8.15 4.31 0.00 1.76 1.89 0.00 3.26 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.69 0.00 103 V 8.18 3.55 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 0.93 0.00 0.00 1.09 0.00 0.00 104 R 8.45 3.44 0.00 1.40 1.71 0.00 2.62 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.30 0.00 105 R 8.36 3.63 0.00 1.83 2.15 0.00 3.36 0.00 0.00 3.19 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 106 G 8.30 4.08 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 0.00 0.00 0.00 107 L 8.41 4.05 0.00 1.57 1.72 0.85 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.83 4.40 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 0.00 109 I 8.95 5.10 2.14 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.56 1.13 0.00 0.00 110 A 8.80 4.99 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 0.00 111 I 9.13 4.70 1.83 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.38 0.90 0.00 0.00 112 L 7.98 4.76 0.00 1.94 1.76 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.46 4.57 0.00 4.25 3.96 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.72 5.30 4.38 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 1.34 0.00 0.00 115 S 8.13 4.39 0.00 4.03 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 0.00 116 K 8.05 4.52 0.00 1.75 1.81 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.37 1.35 7.81 117 G 8.75 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 0.00 0.00 0.00 118 V 7.32 4.38 2.14 0.00 0.00 0.00 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 1.00 0.00 0.00 119 L 8.40 5.00 0.00 1.62 1.73 0.94 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.49 4.98 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 1.34 0.00 0.00 121 D 8.86 4.44 0.00 2.93 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.98 3.91 0.00 1.90 2.04 0.00 3.16 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.76 0.00 123 E 7.53 4.05 0.00 2.05 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 2.37 2.37 0.00 124 A 8.21 4.13 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 0.00 125 R 8.11 3.83 0.00 2.12 2.06 0.00 3.11 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 126 K 8.63 4.19 0.00 1.76 2.02 0.00 1.82 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.45 7.81 127 L 8.23 4.62 0.00 1.79 1.70 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.03 3.88 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 0.00 0.00 0.00 129 V 7.48 4.59 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 0.79 0.00 0.00 0.95 0.00 0.00 130 G 7.77 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 0.00 0.00 0.00 0.00 131 G 7.44 4.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 E 8.35 4.62 0.00 2.54 2.06 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 2.37 2.06 0.00 133 L 8.45 4.45 0.00 2.00 1.56 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 134 I 8.28 3.86 1.88 0.00 0.00 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 1.78 1.10 0.88 0.00 0.00 135 C 7.25 5.27 0.00 3.16 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 E 7.65 5.29 0.00 2.21 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 0.00 2.21 2.27 0.00 137 V 9.09 4.74 1.64 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 -0.18 0.00 0.00 0.61 0.00 0.00 138 W 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