NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -3 G 3.9354 8.3549 109.7368 45.0207 0.0000 173.2441 -2 S 4.3502 8.0019 114.1229 57.1206 63.3892 172.3232 -1 N 4.6182 9.7896 122.5475 53.5806 39.9060 175.4431 -2 M 4.3602 7.9719 118.0229 54.2206 32.4892 174.0232 -1 K 4.1982 9.6796 124.2475 56.6806 34.1060 176.8431 3 A 5.1879 9.2224 124.1255 50.8627 23.3249 175.3273 4 V 5.0518 9.0112 117.9357 60.4960 35.7016 173.9883 5 C 5.0641 9.3704 122.7732 58.0773 35.1741 172.6431 6 V 4.5354 8.5379 126.8192 62.0509 32.8863 174.0519 7 M 5.1905 9.1163 128.9114 54.0521 34.2301 175.4686 8 T 4.8957 8.7263 112.8815 60.6518 73.3552 172.8033 9 G 4.3418 7.7460 107.2294 46.3573 0.0000 174.0784 10 T 4.4852 8.7904 112.8976 61.4926 68.9104 174.0760 11 A 4.5089 8.0164 122.5333 52.3674 19.3646 178.9381 12 G 3.9114 8.2290 105.4253 46.4905 0.0000 173.4593 13 V 4.5973 7.0269 119.4118 60.8739 33.2867 174.8662 14 K 4.9159 8.3673 124.1895 56.1407 36.6628 174.9804 15 G 4.0175 8.5654 107.2504 46.1453 0.0000 172.0916 16 V 4.8904 7.7450 118.6408 61.0696 35.2148 174.0986 17 V 4.7389 8.9798 127.3606 60.9259 34.5338 174.2241 18 K 5.0989 8.9354 126.2896 54.6033 35.8027 175.1138 19 F 5.6359 9.3558 121.9928 55.9762 43.0813 174.1198 20 T 5.6895 9.0441 111.8628 60.2413 72.3356 172.7074 21 Q 4.6587 8.4898 124.1708 55.0201 31.3494 174.3730 22 E 4.1657 9.2145 126.8746 58.6179 29.7260 176.8479 23 T 4.7257 7.4384 106.7062 59.0801 72.0663 173.8522 24 D 4.4234 8.9178 122.0731 57.1345 40.9714 177.4000 25 N 4.9503 8.0409 112.3237 52.2988 37.7102 174.3202 26 G 4.0440 7.9861 108.3012 43.5178 0.0000 172.0052 27 P 4.6411 0.0000 0.0000 62.9756 32.1588 175.8502 28 V 4.6989 8.9057 121.6185 61.6563 34.0936 174.0839 29 H 5.1230 9.4469 125.8227 55.0481 30.5107 174.3035 30 V 4.8764 9.3371 123.3172 61.3203 34.5339 173.6691 31 H 5.5479 9.1213 126.6622 54.4774 32.9772 171.8030 32 A 4.9947 9.2187 126.7122 50.1646 23.0878 174.3782 33 E 5.0079 8.3036 118.7104 54.6309 33.7168 175.0764 34 F 5.4641 9.2077 121.5738 55.8631 44.0914 173.7535 35 S 5.0578 8.9915 114.3798 57.7455 66.6600 175.0337 36 G 4.0907 8.9406 107.7475 46.6447 0.0000 173.6492 37 L 4.2545 7.7670 119.9105 53.3087 42.6241 176.3575 38 K 4.3362 8.3346 122.5587 55.6642 32.9001 176.6852 39 A 4.2064 8.4937 128.3500 53.4357 19.0434 175.9760 40 G 3.7210 8.2633 107.1512 43.8807 0.0000 172.6380 41 K 4.9307 8.2617 118.2899 55.8688 33.7303 176.4978 42 H 4.9563 9.1530 120.4719 53.6033 32.7554 173.3223 43 G 4.0743 9.0446 111.1215 46.8893 0.0000 172.3148 44 F 5.5566 8.9664 124.8877 56.9662 42.4955 173.0369 45 H 5.1371 8.8859 122.3343 54.1786 34.0942 172.5952 46 V 4.3616 8.6541 120.8062 62.5911 32.7422 174.8845 47 H 5.1742 9.4706 126.1071 54.2771 30.5396 176.0519 48 E 3.7847 8.9380 120.1336 58.8895 29.7441 177.2807 49 F 5.0384 8.0329 118.9425 54.6914 41.7979 176.6189 50 G 4.2204 8.5755 110.8594 45.4958 0.0000 173.2720 51 D 4.8673 8.2237 119.8550 52.5560 42.3366 175.4244 52 T 5.0784 8.5344 117.2890 60.6740 69.2414 175.5010 53 T 3.9975 8.5676 115.1828 64.6296 69.6998 174.0025 54 N 4.9599 7.4398 119.7854 52.3781 39.5523 174.0979 55 G 3.7464 7.4712 116.7182 47.3183 0.0000 174.4906 56 C 4.7912 8.5301 120.3847 57.1732 35.7739 175.5451 57 T 3.8583 7.8204 117.4509 66.6260 67.7777 176.0412 58 S 4.4519 8.0091 114.0075 59.9281 63.1937 175.3917 59 A 4.5507 7.4658 125.3372 53.8496 18.3873 178.6474 60 G 3.9226 8.1677 105.2233 44.9017 0.0000 172.1909 61 A 4.5606 8.4037 122.3539 50.6661 21.5987 176.8887 62 H 4.4411 8.3867 115.1757 55.8000 29.6176 175.9209 63 F 4.2741 9.1698 125.9541 58.1007 40.2338 174.9124 64 N 4.9121 7.8669 125.3599 51.5486 38.7166 173.0421 65 P 4.1544 0.0000 0.0000 65.2341 32.1266 178.0354 66 T 4.0824 7.5529 106.9926 60.9072 69.6440 174.1978 67 K 3.7022 7.5724 120.8844 58.2244 29.8447 173.7436 68 Q 4.6176 8.2038 115.9803 53.8466 31.9477 175.6766 69 E 4.3838 8.1658 117.9683 55.9060 31.1502 176.1105 70 H 3.9649 8.6741 122.1609 57.0026 30.6152 174.8554 71 G 4.2692 8.1426 109.2199 45.4039 0.0000 172.0575 72 A 4.5378 9.1481 122.7050 50.5811 19.5356 177.0657 73 P 4.2770 0.0000 0.0000 65.7931 31.4590 177.9271 74 E 4.1934 8.0401 115.1703 57.7867 29.8699 176.7132 75 D 4.6657 7.7254 119.0499 53.7281 41.6879 176.8825 76 S 4.1339 8.6192 118.2459 60.9923 63.0589 174.5708 77 I 4.2011 7.4478 122.2942 60.1776 36.9360 174.6394 78 R 4.7058 7.6455 119.3080 56.2128 31.8623 174.2850 79 H 4.6439 8.8878 116.6631 55.1931 29.4656 177.0631 80 V 3.4984 8.3490 122.6127 66.3470 31.4810 177.1733 81 G 3.8754 8.1616 104.8335 47.2417 0.0000 173.2249 82 D 5.0230 8.0777 121.5005 53.7913 40.8499 175.9098 83 L 4.6455 8.3018 123.1845 53.4363 42.7795 178.8478 84 G 4.0495 8.5046 108.2218 46.7735 0.0000 173.6663 85 N 5.6565 8.8422 120.7331 51.3258 42.0631 173.4851 86 V 4.3751 8.8011 122.5640 61.5272 33.5922 174.5682 87 V 4.6895 8.5078 127.4782 61.3970 32.8210 174.3519 88 A 4.8537 9.0887 130.7386 50.3370 21.5257 177.3075 89 G 4.1742 8.7729 111.2686 44.2616 0.0000 174.2128 90 A 3.9994 8.5205 121.3825 55.0496 18.2665 178.3632 91 D 4.4687 8.0277 112.7581 53.8782 40.0901 177.3647 92 G 4.4288 8.4171 109.5546 45.4485 0.0000 172.9748 93 N 5.3940 8.4556 117.2767 52.5329 40.7837 174.0488 94 A 4.9648 8.8452 121.6009 50.6132 23.2171 175.3537 95 V 4.8019 8.4295 119.8173 61.2204 34.6792 174.1292 96 Y 4.8271 9.1192 128.1593 55.9398 42.0464 173.6422 97 N 5.6070 8.1189 122.1808 51.7057 42.5739 173.4185 98 A 4.4994 8.7564 122.4388 51.3238 23.4150 174.9784 99 T 4.8829 8.4431 116.4236 61.7704 70.8757 173.3819 100 D 5.0388 9.2446 126.1258 52.6004 44.0529 176.4540 101 K 4.4821 8.9089 123.0886 57.0786 33.2302 177.6588 102 L 4.3595 8.1463 118.3414 56.5951 42.3764 177.4414 103 I 4.0443 7.9322 110.4590 61.0631 38.3048 174.5694 104 S 4.6078 8.1893 114.3666 57.6661 65.3003 174.0291 105 L 4.6658 8.8181 121.2289 54.4151 41.7433 176.1593 106 N 4.8940 7.8963 115.4840 52.6560 43.1055 175.8023 107 G 3.9245 8.5675 108.7639 44.7987 0.0000 174.2551 108 S 4.2574 8.6597 112.0842 61.1193 63.0669 174.5306 109 H 5.0209 8.0855 116.2614 55.4065 28.7427 174.8927 110 S 4.2953 7.9300 115.6122 58.6470 62.7217 174.0325 111 I 3.8906 8.2258 119.2756 60.3153 38.0710 175.6106 112 I 3.7671 7.1680 123.4927 63.0698 37.3488 176.5534 113 G 3.8774 9.3290 113.7059 45.4110 0.0000 173.1092 114 R 4.9115 7.5204 119.4470 54.6187 33.4950 174.5734 115 S 5.2276 8.2087 112.9227 57.4669 65.7293 173.7112 116 M 4.9130 8.7763 126.0757 54.3061 33.9905 175.3313 117 V 4.8788 8.7732 122.1977 61.1030 35.3862 173.7421 118 I 5.0143 8.5853 127.3691 59.6859 40.3176 174.2559 119 H 5.2843 8.9400 126.3100 54.1519 30.5816 174.7728 120 E 4.1511 9.2031 121.9278 59.1898 29.9949 176.1123 121 N 5.0975 8.3536 115.1667 50.6081 42.8847 173.5993 122 E 4.3292 8.5298 120.5627 56.1877 30.2144 175.4671 123 D 4.6923 9.4202 126.7671 53.8423 41.5017 175.7222 124 D 4.5630 9.1983 125.8601 53.3432 39.8457 176.7551 125 L 3.6280 9.8390 119.4514 56.1185 39.6644 176.0224 126 G 4.3798 8.6732 104.6833 46.2021 0.0000 175.0890 127 R 4.4852 7.9864 117.4927 55.7524 31.0623 177.9306 128 G 3.5960 7.7940 106.0665 45.6437 0.0000 174.5110 129 G 3.8138 7.5442 107.5108 46.5711 0.0000 173.2060 130 H 4.9052 8.0207 116.5396 53.1352 31.2303 175.3288 131 E 3.8806 8.9452 121.8832 59.4934 29.4057 177.9041 132 L 4.4546 7.7668 115.4610 54.6922 42.7311 178.2666 133 S 4.1994 8.2277 117.0789 61.8415 62.8996 176.2865 134 K 4.3454 8.0262 116.6572 56.8403 32.2549 177.7130 135 V 4.0237 7.6413 117.5668 64.2106 32.8588 176.2878 136 T 4.0532 7.9700 105.2839 60.2640 69.7312 174.6724 137 G 3.7625 7.9898 110.4305 45.0587 0.0000 173.1152 138 N 4.2419 7.7485 115.5617 54.4210 37.8681 174.5328 139 A 4.3431 7.9539 117.6145 51.7628 19.6831 179.7053 140 G 3.9954 7.9582 104.1181 44.8282 0.0000 173.2712 141 G 3.8834 8.6229 107.8223 46.6915 0.0000 172.9711 142 R 4.6982 8.2911 118.8857 54.6306 30.5887 176.6822 143 L 4.2882 8.7798 125.4527 57.3867 42.4270 177.4708 144 A 4.9923 7.6545 118.0413 51.2992 22.9297 173.7709 145 C 5.5891 8.4696 113.0135 56.0887 46.0828 172.7929 146 G 4.7807 8.0570 103.6752 46.2347 0.0000 172.9425 147 V 4.4976 8.4329 121.2373 62.3977 32.8852 175.5342 148 V 4.1925 8.8545 127.6806 62.1981 32.4630 175.1736 149 G 4.4999 9.0075 115.5562 44.1352 0.0000 172.2147 150 L 4.6248 8.4700 120.7214 54.4561 42.3006 176.4623 151 A 4.9132 8.3299 123.8384 49.5132 22.1985 176.0119 152 A 4.0142 8.4735 122.4777 51.9312 19.0204 177.9519 153 E 4.1503 8.9376 121.5107 56.9442 29.4981 177.0957 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 -3 G 8.35 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 -2 S 8.00 4.35 0.00 3.99 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 -1 N 9.79 4.62 0.00 2.82 2.74 0.00 0.00 6.94 7.21 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 -2 M 7.97 4.36 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.49 0.00 -1 K 9.68 4.20 0.00 1.83 1.74 0.00 0.61 0.00 0.00 1.70 0.00 0.00 2.13 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.55 7.81 3 A 9.22 5.19 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 4 V 9.01 5.05 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 0.88 0.00 0.00 0.95 0.00 0.00 5 C 9.37 5.06 0.00 3.18 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 6 V 8.54 4.54 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 0.93 0.00 0.00 0.93 0.00 0.00 7 M 9.12 5.19 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.60 0.00 8 T 8.73 4.90 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 1.22 0.00 0.00 9 G 7.75 4.34 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 0.00 10 T 8.79 4.49 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 1.22 0.00 0.00 11 A 8.02 4.51 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 12 G 8.23 3.91 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 0.00 0.00 0.00 13 V 7.03 4.60 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 0.87 0.00 0.00 0.94 0.00 0.00 14 K 8.37 4.92 0.00 1.93 1.85 0.00 1.39 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.39 7.81 15 G 8.57 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 0.00 0.00 0.00 16 V 7.74 4.89 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 0.85 0.00 0.00 0.85 0.00 0.00 17 V 8.98 4.74 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 0.49 0.00 0.00 1.03 0.00 0.00 18 K 8.94 5.10 0.00 1.62 1.63 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.32 1.33 7.81 19 F 9.36 5.64 0.00 2.99 2.93 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 20 T 9.04 5.69 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 1.25 0.00 0.00 21 Q 8.49 4.66 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 7.13 0.00 0.00 0.00 0.00 0.00 2.44 2.70 0.00 22 E 9.21 4.17 0.00 2.01 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 0.00 2.30 2.28 0.00 23 T 7.44 4.73 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 24 D 8.92 4.42 0.00 2.66 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 25 N 8.04 4.95 0.00 2.82 2.82 0.00 0.00 5.98 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 26 G 7.99 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 0.00 0.00 0.00 27 P 0.00 4.64 0.00 2.14 2.11 0.00 3.76 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 2.06 2.01 0.00 28 V 8.91 4.70 2.22 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 1.30 0.00 0.00 1.04 0.00 0.00 29 H 9.45 5.12 0.00 3.19 3.27 0.00 5.80 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 9.34 4.88 2.45 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 1.06 0.00 0.00 1.24 0.00 0.00 31 H 9.12 5.55 0.00 3.25 3.06 0.00 5.77 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 32 A 9.22 4.99 0.95 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 0.00 0.00 33 E 8.30 5.01 0.00 1.70 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 2.12 2.07 0.00 34 F 9.21 5.46 0.00 2.80 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 35 S 8.99 5.06 0.00 3.84 3.90 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 36 G 8.94 4.09 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 0.00 0.00 0.00 37 L 7.77 4.25 0.00 1.82 1.43 0.64 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.33 4.34 0.00 1.74 1.77 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.44 7.81 39 A 8.49 4.21 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 40 G 8.26 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 0.00 0.00 0.00 41 K 8.26 4.93 0.00 1.62 1.74 0.00 1.89 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.46 7.81 42 H 9.15 4.96 0.00 2.83 3.17 0.00 5.63 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 43 G 9.04 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 44 F 8.97 5.56 0.00 2.73 2.72 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 45 H 8.89 5.14 0.00 3.02 3.07 0.00 5.85 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 V 8.65 4.36 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 0.88 0.00 0.00 0.87 0.00 0.00 47 H 9.47 5.17 0.00 3.07 3.35 0.00 5.70 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.94 3.78 0.00 1.47 1.90 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 2.01 1.47 0.00 49 F 8.03 5.04 0.00 3.19 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 50 G 8.58 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 0.00 0.00 0.00 0.00 51 D 8.22 4.87 0.00 2.65 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 52 T 8.53 5.08 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 53 T 8.57 4.00 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 1.23 0.00 0.00 54 N 7.44 4.96 0.00 2.81 2.71 0.00 0.00 6.95 7.87 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 55 G 7.47 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 0.00 0.00 0.00 56 C 8.53 4.79 0.00 2.97 3.07 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 0.00 0.00 0.00 57 T 7.82 3.86 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 1.24 0.00 0.00 58 S 8.01 4.45 0.00 3.95 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 59 A 7.47 4.55 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 60 G 8.17 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 61 A 8.40 4.56 1.17 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 0.00 0.00 62 H 8.39 4.44 0.00 2.75 3.10 0.00 5.73 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 63 F 9.17 4.27 0.00 2.87 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 64 N 7.87 4.91 0.00 2.64 2.44 0.00 0.00 6.94 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 65 P 0.00 4.15 0.00 2.04 1.86 0.00 2.93 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.01 0.00 66 T 7.55 4.08 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 1.11 0.00 0.00 67 K 7.57 3.70 0.00 1.89 1.87 0.00 1.64 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.49 1.50 7.81 68 Q 8.20 4.62 0.00 2.14 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.95 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 69 E 8.17 4.38 0.00 1.89 1.83 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 2.38 2.29 0.00 70 H 8.67 3.96 0.00 3.20 3.15 0.00 5.97 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.14 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 0.00 0.00 0.00 0.00 72 A 9.15 4.54 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 73 P 0.00 4.28 0.00 2.10 2.22 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.35 0.00 74 E 8.04 4.19 0.00 1.96 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 0.00 2.32 2.34 0.00 75 D 7.73 4.67 0.00 2.82 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.62 4.13 0.00 3.85 3.91 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 77 I 7.45 4.20 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.19 0.87 0.00 0.00 78 R 7.65 4.71 0.00 1.78 1.89 0.00 2.90 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 79 H 8.89 4.64 0.00 3.52 3.38 0.00 5.65 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 V 8.35 3.50 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 0.83 0.00 0.00 0.57 0.00 0.00 81 G 8.16 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 82 D 8.08 5.02 0.00 2.66 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 83 L 8.30 4.65 0.00 1.43 1.82 0.82 1.49 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 84 G 8.50 4.05 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 0.00 0.00 0.00 85 N 8.84 5.66 0.00 2.65 2.74 0.00 0.00 6.60 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 86 V 8.80 4.38 1.70 0.00 0.00 0.00 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 0.04 0.00 0.00 87 V 8.51 4.69 2.11 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 0.85 0.00 0.00 0.97 0.00 0.00 88 A 9.09 4.85 1.27 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 0.00 0.00 0.00 89 G 8.77 4.17 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 0.00 0.00 0.00 90 A 8.52 4.00 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 91 D 8.03 4.47 0.00 2.78 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 92 G 8.42 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 93 N 8.46 5.39 0.00 2.79 2.75 0.00 0.00 6.56 7.23 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 94 A 8.85 4.96 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 95 V 8.43 4.80 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 0.84 0.00 0.00 0.94 0.00 0.00 96 Y 9.12 4.83 0.00 2.93 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 97 N 8.12 5.61 0.00 2.48 2.59 0.00 0.00 6.82 7.35 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 98 A 8.76 4.50 1.14 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 99 T 8.44 4.88 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 1.13 0.00 0.00 100 D 9.24 5.04 0.00 2.84 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 0.00 101 K 8.91 4.48 0.00 1.80 1.86 0.00 1.80 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.46 7.81 102 L 8.15 4.36 0.00 1.78 1.70 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.93 4.04 1.88 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.60 1.02 0.00 0.00 104 S 8.19 4.61 0.00 3.87 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 0.00 105 L 8.82 4.67 0.00 1.74 1.61 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 106 N 7.90 4.89 0.00 2.88 2.71 0.00 0.00 6.91 7.80 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 0.00 107 G 8.57 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 0.00 108 S 8.66 4.26 0.00 4.06 4.05 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 0.00 109 H 8.09 5.02 0.00 3.20 3.51 0.00 5.73 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 S 7.93 4.30 0.00 3.90 3.77 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 0.00 111 I 8.23 3.89 1.58 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.30 0.88 0.00 0.00 112 I 7.17 3.77 1.80 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.75 0.86 0.00 0.00 113 G 9.33 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 0.00 114 R 7.52 4.91 0.00 1.61 1.88 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.31 0.00 115 S 8.21 5.23 0.00 4.01 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.78 4.91 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.79 0.00 117 V 8.77 4.88 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 0.70 0.00 0.00 0.71 0.00 0.00 118 I 8.59 5.01 1.56 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 1.12 0.73 0.00 0.00 119 H 8.94 5.28 0.00 3.15 3.49 0.00 5.72 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 E 9.20 4.15 0.00 1.98 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 0.00 2.34 2.32 0.00 121 N 8.35 5.10 0.00 2.67 2.67 0.00 0.00 6.71 7.99 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 0.00 122 E 8.53 4.33 0.00 1.89 1.83 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 2.30 2.44 0.00 123 D 9.42 4.69 0.00 2.73 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 0.00 124 D 9.20 4.56 0.00 2.94 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 0.00 125 L 9.84 3.63 0.00 1.86 1.79 0.95 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 126 G 8.67 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 0.00 0.00 0.00 0.00 127 R 7.99 4.49 0.00 2.03 1.94 0.00 3.14 0.00 0.00 3.18 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 128 G 7.79 3.60 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 0.00 0.00 0.00 129 G 7.54 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 0.00 130 H 8.02 4.91 0.00 3.18 3.18 0.00 5.65 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 E 8.95 3.88 0.00 1.92 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 2.30 2.42 0.00 132 L 7.77 4.45 0.00 1.72 1.63 0.91 0.91 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 0.00 133 S 8.23 4.20 0.00 3.97 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 0.00 134 K 8.03 4.35 0.00 1.78 1.82 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.36 7.81 135 V 7.64 4.02 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 0.80 0.00 0.00 0.91 0.00 0.00 136 T 7.97 4.05 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 1.09 0.00 0.00 137 G 7.99 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 0.00 0.00 0.00 138 N 7.75 4.24 0.00 2.84 2.86 0.00 0.00 7.06 7.94 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 0.00 139 A 7.95 4.34 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 0.00 140 G 7.96 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.62 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 0.00 142 R 8.29 4.70 0.00 1.66 1.81 0.00 3.20 0.00 0.00 3.14 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.64 0.00 143 L 8.78 4.29 0.00 1.56 1.67 0.88 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 144 A 7.65 4.99 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 0.00 145 C 8.47 5.59 0.00 3.06 3.15 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 0.00 146 G 8.06 4.78 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 0.00 0.00 0.00 147 V 8.43 4.50 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 0.99 0.00 0.00 148 V 8.85 4.19 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 0.74 0.00 0.00 0.89 0.00 0.00 149 G 9.01 4.50 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 0.00 150 L 8.47 4.62 0.00 1.55 1.62 0.91 0.79 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 0.00 151 A 8.33 4.91 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 0.00 152 A 8.47 4.01 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 0.00 153 E 8.94 4.15 0.00 1.97 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 2.33 2.33 0.00