NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 33 N 4.6891 8.4249 119.2099 53.2584 40.9539 174.5565 34 S 4.4839 7.9594 113.2742 57.1357 63.8886 171.4994 35 D 4.9307 10.0523 121.7492 52.0991 43.7663 173.7540 36 R 5.3161 8.3701 117.2216 54.6578 33.0406 175.0289 37 Y 4.6929 9.0844 120.5494 56.0890 40.4930 174.8836 38 A 4.7289 8.8181 126.6182 51.5917 20.0272 176.8136 39 V 4.2509 9.1598 121.8787 61.2808 34.3443 174.5624 40 Y 4.7669 8.9651 127.1919 57.1133 37.9405 175.8204 41 W 4.7279 9.2295 135.0000 56.1297 29.5365 174.6963 42 N 5.2332 8.1196 121.0128 51.3558 39.8061 176.1029 43 R 4.0014 9.2274 119.3530 59.0704 30.2856 178.6466 44 S 4.2421 8.4836 113.3826 60.2452 63.3595 173.7524 45 N 4.4993 8.2342 119.7444 52.6163 38.5013 173.6098 46 P 4.4495 0.0000 0.0000 64.7117 31.6988 178.5412 47 R 3.5547 8.0524 118.8136 58.5677 30.0982 178.5445 48 F 4.1809 8.1339 116.4478 58.4133 39.5088 175.1415 49 H 3.8705 7.7637 116.7776 56.7275 25.9758 174.5139 50 A 4.5954 7.8334 122.4139 51.9549 20.4137 178.9704 51 G 3.9888 8.8774 104.9789 46.0457 0.0000 174.0083 52 A 4.5132 7.5418 120.3175 50.9454 20.5947 177.8541 53 G 3.8600 9.8352 102.9733 45.2714 0.0000 173.5843 54 D 4.3202 7.4141 116.3243 53.8335 41.8199 174.5624 55 D 5.2779 8.1068 125.4990 52.4941 40.1914 177.2644 56 G 4.1418 8.8386 107.1170 47.0018 0.0000 173.8240 57 G 3.8933 9.2833 110.0437 44.2711 0.0000 177.1212 58 G 4.0796 8.2190 107.5792 45.2591 0.0000 172.0352 59 Y 4.5982 8.7796 123.1518 56.8270 40.2222 175.5686 60 T 5.3130 8.4194 122.1807 61.8436 71.8866 173.5887 61 V 4.5525 8.8645 125.4687 59.7936 35.1825 173.8848 62 E 4.9913 8.6259 123.6771 54.7166 31.4127 175.0967 63 V 4.3010 8.4528 119.1201 59.7424 36.6910 174.5879 64 S 4.9056 9.0052 117.8032 56.4454 65.7619 174.3175 65 I 4.0011 8.0962 122.1580 63.2969 37.1927 176.4220 66 N 4.2173 8.8216 120.6354 53.6653 36.7839 174.1536 67 D 5.0308 7.9127 119.2730 54.2432 42.7949 174.6705 68 Y 5.1317 9.0794 116.5453 56.2553 42.1035 174.6041 69 L 5.1297 8.6903 124.2200 53.6449 44.5988 174.7151 70 D 4.8809 8.9990 126.8976 52.8436 42.7675 175.5223 71 I 4.5480 8.5234 126.7572 60.0347 39.0311 174.5770 72 Y 4.8300 8.7193 126.5025 56.3832 39.1855 175.2811 73 C 5.0377 9.1319 122.9347 56.1043 38.1851 172.1473 74 P 4.5563 0.0000 0.0000 63.7416 31.9817 174.8912 75 H 5.1041 8.3840 122.2020 54.6143 33.2910 171.8396 76 Y 4.6634 8.5621 121.5586 56.2722 41.0770 175.6605 77 G 4.1572 8.7581 110.9004 44.2911 0.0000 172.9484 78 A 4.3670 8.4026 123.2192 51.1185 18.9369 175.5019 79 P 4.5199 0.0000 0.0000 61.6554 32.2494 176.3952 80 L 4.1682 8.4326 123.6058 54.0655 42.1029 175.2580 81 P 4.5190 0.0000 0.0000 61.0993 32.4920 174.1471 82 P 4.1678 0.0000 0.0000 62.6829 31.7302 177.4745 83 A 3.8944 8.7883 125.2409 55.4878 18.3925 179.6524 84 E 3.9898 8.0481 113.7385 59.0638 29.6353 177.9856 85 R 4.2404 7.8047 116.0117 56.6247 30.6357 176.4044 86 M 3.6935 7.3149 119.3440 54.3240 32.4264 176.1620 87 E 4.0714 9.1730 124.9073 56.6481 30.2505 176.0819 88 H 5.0216 7.5730 117.4607 54.5492 31.7487 172.0392 89 Y 5.2048 8.8540 117.2502 56.7493 43.2355 173.7618 90 V 4.6334 8.7711 121.0850 61.2746 33.9695 174.3118 91 L 4.9447 8.8581 127.9722 53.3512 43.8999 175.0883 92 Y 5.0576 9.0727 120.6916 56.3546 41.9725 174.0835 93 M 4.7149 8.9818 123.1321 54.3212 33.9675 175.3296 94 V 5.0507 8.5039 118.6700 58.8805 36.5281 175.3304 95 N 4.9481 8.6405 120.5976 52.0386 39.9773 176.0543 96 G 2.8329 8.3587 105.7691 47.7835 0.0000 175.5835 97 E 4.0092 8.0657 120.4280 59.0750 29.5917 179.4172 98 G 3.5490 8.6350 106.2236 45.7623 0.0000 175.2038 99 H 4.1317 8.0298 119.5495 59.0681 29.9769 176.9839 100 A 4.0987 8.1415 121.8431 54.4059 18.2951 178.7948 101 S 4.4265 7.8101 110.1691 57.8457 63.8624 174.4253 102 C 3.9301 8.0623 118.4704 57.3407 36.6589 172.0397 103 D 4.8158 7.6513 120.6271 52.4508 41.9216 176.4204 104 H 4.2390 8.4076 123.1008 57.5401 29.0972 175.8123 105 R 3.6956 7.4619 120.0275 57.5877 30.0069 176.1226 106 Q 3.4943 8.7766 119.7482 56.9407 26.5540 173.8878 107 R 4.4988 8.8109 113.6588 54.5970 33.0318 175.5244 108 G 3.8073 6.5645 104.6251 46.4399 0.0000 171.5201 109 F 5.1728 8.3503 118.0909 55.0463 42.4311 175.2010 110 K 3.8892 9.0824 124.9267 57.1976 32.0845 175.2887 111 R 3.9599 8.4898 125.7556 56.8459 31.5995 176.4354 112 W 4.7555 7.1665 116.9938 54.7888 33.8869 173.5957 113 E 4.6954 8.4187 122.5017 54.9303 30.7622 177.4523 114 C 4.8805 9.3262 126.4042 55.1056 38.8396 173.9744 115 N 4.8325 8.2138 114.7978 52.3632 38.3454 176.9922 116 R 4.7302 7.6440 116.6712 54.5598 30.9700 174.0438 117 P 4.7352 0.0000 0.0000 64.3081 32.0861 178.4976 118 A 4.6994 7.8916 120.2418 51.4580 19.2817 175.9296 119 A 4.0530 7.9818 122.5518 53.5249 18.6889 178.1597 120 P 4.3083 0.0000 0.0000 65.5072 31.6105 178.2642 121 G 3.5564 7.9510 105.7800 46.3520 0.0000 171.6083 122 G 3.5654 7.2470 104.3619 42.8563 0.0000 171.6380 123 P 4.3393 0.0000 0.0000 62.1906 31.8987 176.6261 124 L 3.8940 8.5531 122.5346 55.0777 42.6915 175.8494 125 K 4.4599 7.8478 123.6806 54.3416 34.8097 175.0295 126 F 4.7128 8.4696 125.1603 55.6029 42.6874 174.0213 127 S 5.0733 8.5948 117.9841 56.5753 66.0651 173.1400 128 E 4.5904 8.9671 124.0861 54.3088 32.1477 174.2210 129 K 3.8914 8.4568 128.6261 54.4445 33.4277 177.1705 130 F 3.6672 7.7857 129.1552 56.2725 37.1844 175.5053 131 Q 4.5178 7.6447 118.5516 55.9838 30.1747 179.2578 132 L 3.9844 8.4264 120.9063 56.5906 41.8675 177.7200 133 F 5.3168 7.6755 115.1666 55.7881 41.8170 174.1575 134 T 4.5623 8.9467 120.3192 60.0808 68.3069 172.8800 135 P 4.5123 0.0000 0.0000 63.5083 32.3568 175.4082 136 F 5.0926 7.9147 122.6779 56.0299 40.9304 176.2405 137 S 3.8233 8.3975 122.7548 60.7976 62.8380 174.9119 138 L 3.9149 5.6200 118.2428 53.9211 41.5717 176.7271 139 G 3.9804 7.0526 109.7858 44.3143 0.0000 173.4522 140 F 4.5733 8.3921 116.1767 55.4758 42.4812 174.0921 141 E 4.9686 8.2250 121.8794 54.6724 32.2480 175.2142 142 F 4.8680 8.9154 119.2223 55.9307 43.7112 174.1791 143 R 4.7736 8.9547 118.8292 53.6212 34.3866 173.3811 144 P 4.2404 0.0000 0.0000 63.6486 31.7730 177.0071 145 G 3.9392 9.0271 110.3343 45.7703 0.0000 172.8181 146 H 4.8834 7.7884 116.8441 54.2332 31.6749 173.4771 147 E 5.1426 8.1558 118.4659 54.9366 32.2041 175.3092 148 Y 4.5999 8.5473 119.3018 56.5080 42.9283 173.8967 149 Y 5.5573 8.3401 118.0901 56.7282 42.5425 173.9566 150 Y 5.5755 9.7194 119.9143 56.5203 42.7170 174.3603 151 I 5.7872 9.2710 115.3078 59.6052 41.8945 173.8054 152 S 5.5263 9.0639 116.2600 56.6046 65.5879 173.2462 153 A 5.1326 8.9943 122.6524 50.6805 22.8014 175.4268 154 T 4.8506 8.3969 116.6207 61.1621 69.8979 173.0946 155 P 4.7007 0.0000 0.0000 62.3990 31.9315 174.3736 156 P 4.7669 0.0000 0.0000 63.0249 31.5075 175.3219 157 N 4.8104 8.1519 116.3761 52.5928 39.7130 175.5100 158 A 4.2405 8.6050 125.0437 54.0922 19.0055 178.1692 159 V 4.4483 7.5338 114.0665 61.0932 34.2608 174.2248 160 D 4.7950 8.7088 126.6140 53.2998 41.9913 176.5441 161 R 4.4723 8.2567 121.6141 53.7616 32.2710 173.0053 162 P 4.5432 0.0000 0.0000 62.0657 32.4326 175.2479 163 C 4.7295 8.4466 115.3674 54.5029 37.8595 172.5072 164 L 4.6634 7.7522 120.8720 53.9115 42.7535 176.3726 165 R 5.4987 8.5179 117.8632 54.9309 33.5341 173.3455 166 L 5.3419 9.7279 122.1429 53.4146 45.8223 174.7115 167 K 5.0254 9.8382 128.0426 54.7633 34.5952 174.5821 168 V 4.8247 9.3161 128.1713 61.3903 33.8582 173.4127 169 Y 5.0366 8.7327 129.7020 55.9376 40.8505 174.4039 170 V 4.1048 8.2456 127.8963 61.6422 32.7220 175.5937 171 R 3.7699 8.5918 127.8769 55.7777 31.1348 174.8030 172 P 4.4901 0.0000 0.0000 62.4133 32.4009 176.5188 173 T 3.8159 8.5748 119.2728 64.2379 68.7404 174.4459 174 Q 4.3715 8.5379 124.4452 56.9383 29.7167 173.5022 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 33 N 8.42 4.69 0.00 2.70 2.94 0.00 0.00 7.04 6.75 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 34 S 7.96 4.48 0.00 4.03 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 35 D 10.05 4.93 0.00 2.57 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 R 8.37 5.32 0.00 1.62 1.98 0.00 3.00 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 37 Y 9.08 4.69 0.00 3.01 2.94 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 38 A 8.82 4.73 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 39 V 9.16 4.25 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 0.90 0.00 0.00 0.73 0.00 0.00 40 Y 8.97 4.77 0.00 3.05 3.09 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 0.00 0.00 0.00 0.00 41 W 9.23 4.73 0.00 3.62 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 42 N 8.12 5.23 0.00 3.19 3.08 0.00 0.00 6.14 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 43 R 9.23 4.00 0.00 1.91 2.09 0.00 3.28 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.94 0.00 44 S 8.48 4.24 0.00 4.07 3.95 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 45 N 8.23 4.50 0.00 2.92 3.24 0.00 0.00 6.77 9.05 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 46 P 0.00 4.45 0.00 2.18 2.26 0.00 3.74 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 2.00 1.95 0.00 47 R 8.05 3.55 0.00 1.50 0.66 0.00 2.95 0.00 0.00 2.92 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.36 0.00 48 F 8.13 4.18 0.00 3.23 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 49 H 7.76 3.87 0.00 3.61 3.39 0.00 5.80 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 A 7.83 4.60 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 51 G 8.88 3.99 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 0.00 0.00 0.00 52 A 7.54 4.51 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 53 G 9.84 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 0.00 0.00 0.00 54 D 7.41 4.32 0.00 2.60 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 55 D 8.11 5.28 0.00 3.29 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 56 G 8.84 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 9.28 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 58 G 8.22 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 59 Y 8.78 4.60 0.00 2.32 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.42 5.31 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 1.23 0.00 0.00 61 V 8.86 4.55 2.29 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 0.65 0.00 0.00 0.72 0.00 0.00 62 E 8.63 4.99 0.00 2.02 1.82 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 2.15 2.51 0.00 63 V 8.45 4.30 1.81 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 0.07 0.00 0.00 -0.10 0.00 0.00 64 S 9.01 4.91 0.00 3.93 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 65 I 8.10 4.00 1.84 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 1.37 0.70 0.90 0.00 0.00 66 N 8.82 4.22 0.00 2.88 2.97 0.00 0.00 7.05 8.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 D 7.91 5.03 0.00 2.93 2.97 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 68 Y 9.08 5.13 0.00 2.89 2.76 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 0.00 0.00 0.00 0.00 69 L 8.69 5.13 0.00 1.71 1.35 1.08 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 70 D 9.00 4.88 0.00 2.53 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 0.00 0.00 0.00 71 I 8.52 4.55 1.46 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.38 0.82 0.00 0.00 72 Y 8.72 4.83 0.00 2.53 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 C 9.13 5.04 0.00 2.92 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 74 P 0.00 4.56 0.00 2.41 2.13 0.00 3.79 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.71 0.00 75 H 8.38 5.10 0.00 3.11 3.06 0.00 5.67 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 8.56 4.66 0.00 2.79 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 77 G 8.76 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.40 4.37 1.26 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 0.00 0.00 0.00 79 P 0.00 4.52 0.00 2.20 2.08 0.00 3.80 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 80 L 8.43 4.17 0.00 1.64 1.62 0.92 1.21 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 81 P 0.00 4.52 0.00 2.00 1.99 0.00 3.68 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 82 P 0.00 4.17 0.00 2.14 1.99 0.00 3.55 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 83 A 8.79 3.89 1.26 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 0.00 0.00 0.00 84 E 8.05 3.99 0.00 1.92 2.01 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 2.30 2.37 0.00 85 R 7.80 4.24 0.00 1.82 1.87 0.00 3.18 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 86 M 7.31 3.69 0.00 1.80 1.95 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.23 0.00 87 E 9.17 4.07 0.00 2.14 1.77 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 2.44 2.42 0.00 88 H 7.57 5.02 0.00 3.24 3.17 0.00 5.49 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Y 8.85 5.20 0.00 2.87 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 90 V 8.77 4.63 2.05 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 0.21 0.00 0.00 0.92 0.00 0.00 91 L 8.86 4.94 0.00 1.58 1.34 -0.03 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 92 Y 9.07 5.06 0.00 2.91 2.75 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 93 M 8.98 4.71 0.00 1.77 1.56 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.31 0.00 94 V 8.50 5.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.05 0.00 0.00 95 N 8.64 4.95 0.00 3.08 3.00 0.00 0.00 7.29 7.08 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 96 G 8.36 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 0.00 0.00 0.00 97 E 8.07 4.01 0.00 2.17 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 2.35 2.37 0.00 98 G 8.64 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.03 4.13 0.00 2.99 3.13 0.00 5.76 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.14 4.10 1.30 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 0.00 0.00 101 S 7.81 4.43 0.00 4.02 3.99 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 0.00 102 C 8.06 3.93 0.00 3.18 3.42 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 0.00 103 D 7.65 4.82 0.00 2.53 2.44 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 0.00 104 H 8.41 4.24 0.00 2.80 2.89 0.00 5.72 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 R 7.46 3.70 0.00 1.76 1.77 0.00 3.22 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.14 0.00 106 Q 8.78 3.49 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.19 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 107 R 8.81 4.50 0.00 1.71 1.91 0.00 3.24 0.00 0.00 3.21 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.65 0.00 108 G 6.56 3.81 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 0.00 109 F 8.35 5.17 0.00 3.01 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 0.00 110 K 9.08 3.89 0.00 1.83 1.72 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.78 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.17 0.99 7.81 111 R 8.49 3.96 0.00 0.79 0.66 0.00 3.03 0.00 0.00 2.58 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.02 0.00 112 W 7.17 4.76 0.00 2.70 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 0.00 0.00 0.00 113 E 8.42 4.70 0.00 1.85 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 114 C 9.33 4.88 0.00 3.24 3.22 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 0.00 115 N 8.21 4.83 0.00 2.81 2.91 0.00 0.00 6.11 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 0.00 116 R 7.64 4.73 0.00 1.88 1.88 0.00 3.16 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 117 P 0.00 4.74 0.00 2.54 2.75 0.00 3.87 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.99 0.00 118 A 7.89 4.70 1.30 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 0.00 0.00 119 A 7.98 4.05 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 0.00 120 P 0.00 4.31 0.00 2.07 2.15 0.00 3.71 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 121 G 7.95 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 0.00 122 G 7.25 3.57 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 0.00 0.00 0.00 123 P 0.00 4.34 0.00 2.26 2.31 0.00 3.68 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 124 L 8.55 3.89 0.00 1.52 1.12 1.05 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 125 K 7.85 4.46 0.00 1.36 1.25 0.00 1.53 0.00 0.00 1.45 0.00 0.00 2.75 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.72 0.24 7.81 126 F 8.47 4.71 0.00 2.04 1.45 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 0.00 127 S 8.59 5.07 0.00 3.68 3.76 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 0.00 0.00 0.00 0.00 128 E 8.97 4.59 0.00 2.05 1.43 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 1.86 1.47 0.00 129 K 8.46 3.89 0.00 1.41 1.47 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.96 0.28 7.81 130 F 7.79 3.67 0.00 2.73 2.52 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 0.00 131 Q 7.64 4.52 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.37 6.92 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 132 L 8.43 3.98 0.00 0.93 0.17 0.66 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 133 F 7.68 5.32 0.00 3.04 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 0.00 134 T 8.95 4.56 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 1.21 0.00 0.00 135 P 0.00 4.51 0.00 2.28 2.21 0.00 3.87 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 136 F 7.91 5.09 0.00 3.01 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 0.00 137 S 8.40 3.82 0.00 3.74 3.80 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 0.00 138 L 5.62 3.91 0.00 0.60 1.28 0.55 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 139 G 7.05 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 0.00 140 F 8.39 4.57 0.00 3.00 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 0.00 141 E 8.23 4.97 0.00 1.69 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 2.24 2.22 0.00 142 F 8.92 4.87 0.00 3.05 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.95 4.77 0.00 1.46 1.71 0.00 3.28 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 144 P 0.00 4.24 0.00 2.04 2.15 0.00 3.77 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.04 0.00 145 G 9.03 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 0.00 0.00 0.00 146 H 7.79 4.88 0.00 3.42 2.90 0.00 5.76 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.16 5.14 0.00 1.58 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 2.17 2.33 0.00 148 Y 8.55 4.60 0.00 3.16 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 Y 8.34 5.56 0.00 3.00 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 0.00 150 Y 9.72 5.58 0.00 3.36 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 9.27 5.79 2.08 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 1.10 0.00 0.00 152 S 9.06 5.53 0.00 3.82 3.76 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 0.00 0.00 0.00 0.00 153 A 8.99 5.13 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 T 8.40 4.85 4.39 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 1.04 0.00 0.00 155 P 0.00 4.70 0.00 2.13 2.06 0.00 3.69 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 156 P 0.00 4.77 0.00 2.20 2.16 0.00 3.79 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 157 N 8.15 4.81 0.00 2.88 2.82 0.00 0.00 6.83 6.92 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 0.00 158 A 8.60 4.24 1.29 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 0.00 159 V 7.53 4.45 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 0.92 0.00 0.00 0.90 0.00 0.00 160 D 8.71 4.80 0.00 2.81 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 R 8.26 4.47 0.00 1.75 1.84 0.00 3.21 0.00 0.00 3.28 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 162 P 0.00 4.54 0.00 2.21 2.06 0.00 3.79 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 163 C 8.45 4.73 0.00 3.40 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 0.00 164 L 7.75 4.66 0.00 1.37 0.33 0.19 0.46 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 0.00 165 R 8.52 5.50 0.00 2.12 2.11 0.00 2.65 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 166 L 9.73 5.34 0.00 1.92 2.06 0.59 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 167 K 9.84 5.03 0.00 1.98 1.75 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.25 1.30 7.81 168 V 9.32 4.82 2.34 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 0.52 0.00 0.00 1.22 0.00 0.00 169 Y 8.73 5.04 0.00 2.97 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 0.00 170 V 8.25 4.10 2.21 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 0.80 0.00 0.00 0.89 0.00 0.00 171 R 8.59 3.77 0.00 1.61 1.74 0.00 3.14 0.00 0.00 3.16 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 172 P 0.00 4.49 0.00 1.94 2.00 0.00 3.67 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.20 0.00 173 T 8.57 3.82 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 1.21 0.00 0.00 174 Q 8.54 4.37 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.65 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00