NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3478 8.2493 123.5816 50.7403 20.9952 176.4970 2 K 4.2055 7.5499 112.0408 55.1995 35.2015 174.4252 3 K 4.3360 8.2217 123.5716 55.7533 34.7126 176.3105 4 V 4.4878 7.8744 122.3253 59.1269 34.4373 174.8259 5 Q 3.8149 8.3809 119.2541 56.5438 28.9936 175.7396 6 A 3.8495 9.1686 121.8586 53.8698 19.0181 177.1682 7 Y 3.4367 8.1741 121.8497 58.4303 36.5193 169.7922 8 V 4.2406 7.9239 116.9866 59.8367 34.2289 174.8779 9 K 4.9165 8.1148 120.5044 54.8809 35.8500 175.7832 10 L 4.4032 8.6432 122.1810 55.0241 44.2162 174.3292 11 Q 4.8235 8.7244 120.6066 54.5392 29.0880 174.9742 12 V 4.5280 7.9687 123.3946 59.0981 34.5284 175.2972 13 A 3.7869 8.7965 123.9428 52.4476 18.5532 176.4384 14 A 3.8656 8.3678 118.6446 53.4392 19.1020 179.2581 15 G 3.9714 7.3031 107.4779 41.0000 0.0000 172.0145 16 M 4.1173 7.5694 115.4280 55.4841 35.3303 173.5199 17 A 4.2488 8.5471 126.7434 52.2047 21.8094 174.3380 18 N 4.6209 9.3671 116.6238 53.4144 37.9268 173.2301 19 P 4.2700 0.0000 0.0000 62.8733 31.9566 176.6888 20 S 4.0170 8.6460 117.1315 61.1805 62.7431 173.5409 21 P 4.3872 0.0000 0.0000 65.3684 31.3121 176.1826 22 P 4.4461 0.0000 0.0000 65.2913 32.9307 177.2926 23 V 4.2039 7.5900 113.4878 61.4362 32.4721 181.1303 24 G 3.8439 9.3934 108.7622 45.2786 0.0000 172.9359 25 P 4.0939 0.0000 0.0000 66.0744 31.0607 175.8783 26 A 3.8033 7.7778 117.5591 55.4773 18.3911 178.8003 27 L 4.2108 7.5364 115.7616 56.6692 41.3345 178.9824 28 G 3.6136 8.1011 107.6959 47.8734 0.0000 175.6738 29 Q 3.9568 7.5517 119.2407 59.1224 28.8541 178.5975 30 Q 4.1348 7.4904 117.4420 57.5927 28.6297 177.6220 31 G 4.1403 7.3081 107.8824 45.4367 0.0000 174.0255 32 V 3.4033 7.3342 118.1303 62.1515 32.2608 176.5865 33 N 4.7077 8.1529 122.7829 52.1146 38.2476 175.8947 34 I 3.5504 8.2346 125.0979 64.9073 37.4192 176.9556 35 M 3.9344 8.0970 117.6819 59.0971 32.0709 177.7937 36 E 3.9925 8.4196 118.4113 59.5903 29.6412 178.5138 37 F 4.3699 8.5530 120.2379 61.4580 39.3820 176.1252 38 C 3.9865 8.3696 118.5904 62.8607 31.3618 176.0479 39 K 3.9709 8.0371 119.0353 59.1357 31.7489 179.2523 40 A 4.0808 8.4421 121.5314 55.6673 18.3969 178.9484 41 F 4.3526 8.7585 120.3188 61.5040 39.1631 176.7428 42 N 4.6341 8.5235 117.1521 54.8958 38.5083 177.3608 43 A 4.0685 7.5959 122.1934 55.2977 18.7126 179.7882 44 K 4.0973 7.6266 116.0123 59.0515 32.2520 179.5257 45 T 3.7964 7.5727 109.8835 63.9328 68.1859 176.2984 46 D 4.2513 7.2869 120.4883 57.5241 40.9357 177.8553 47 S 4.1792 7.8011 113.7604 61.4454 63.1110 174.9850 48 I 3.8229 7.1758 118.0091 60.0541 38.0685 174.8534 49 E 3.8494 8.7684 123.1798 56.8987 29.4504 177.1211 50 K 4.2531 8.4919 123.6547 57.1699 32.9282 177.7580 51 G 3.9478 8.9910 110.7204 45.0409 0.0000 172.7491 52 L 4.7824 7.2099 120.5998 51.8499 44.0034 173.8932 53 P 4.5448 0.0000 0.0000 63.2882 31.7699 175.3475 54 I 4.6148 7.9913 125.0156 58.1823 39.8190 173.1318 55 P 4.8104 0.0000 0.0000 62.6365 32.6419 175.3794 56 V 4.8342 8.8909 124.7029 59.6904 34.8749 174.8095 57 V 4.5023 8.0793 122.4957 61.3947 33.5484 174.2025 58 I 4.6842 7.9519 129.6263 60.2295 39.2583 174.8848 59 T 4.5277 8.6999 121.3129 60.2560 69.5922 173.1138 60 V 4.2218 8.2332 128.5015 61.8581 33.1411 174.3603 61 Y 4.8922 7.8805 122.5600 55.8040 40.4506 176.6803 62 A 4.2846 8.6846 122.7491 55.4943 18.5136 178.3971 63 D 4.4342 8.1992 114.2641 55.3674 41.4269 177.8187 64 R 4.1431 8.4726 116.3267 56.9422 29.1708 176.1340 65 S 4.7007 7.8060 113.5942 58.2849 63.5137 171.7518 66 F 5.0758 7.6976 114.5858 56.4244 39.8621 173.1541 67 T 5.0832 8.4438 108.9634 60.2761 72.4927 172.5991 68 F 5.7615 8.1487 115.8168 55.5279 41.4265 173.8694 69 V 4.3028 8.5142 114.4254 59.9333 33.8219 174.6710 70 T 4.4376 8.6570 121.6258 61.4849 67.4642 173.9869 71 K 4.5737 8.1203 133.9237 56.4301 32.8204 175.7198 72 T 4.6141 8.0989 118.1251 60.1502 69.1774 173.4488 73 P 4.4982 0.0000 0.0000 62.2577 31.9201 174.8360 74 P 4.3213 0.0000 0.0000 63.1238 33.1370 177.5425 75 A 3.9888 8.5976 122.0412 55.1104 18.4207 180.0227 76 A 3.9234 7.9786 118.8745 55.3518 18.4992 179.8495 77 V 3.4995 7.7178 116.0247 66.2800 31.7672 177.8933 78 L 4.0132 8.0548 118.7020 58.0181 41.4022 179.6791 79 L 4.0570 8.3215 119.1267 57.5266 41.4510 179.6189 80 K 3.9881 7.9553 118.5420 59.3021 31.9316 179.5118 81 K 3.9221 8.0635 118.3845 59.4559 31.8417 179.0392 82 A 3.9657 7.8111 119.2945 55.4386 18.4000 179.3140 83 A 4.3059 8.3610 117.6349 52.9133 18.4884 178.5818 84 G 3.7928 7.9007 105.1159 46.0386 0.0000 173.5532 85 I 4.3484 7.6730 113.0682 59.2521 39.5979 175.3878 86 K 4.2904 8.4701 118.7937 57.3677 33.1745 176.1736 87 S 4.7753 7.5890 110.2579 55.9373 66.4537 174.7826 88 G 4.0437 8.4254 112.7182 45.5147 0.0000 174.2277 89 S 4.5122 8.1339 114.0846 57.2909 63.9297 175.2999 90 G 4.0577 8.2251 113.6662 45.6432 0.0000 174.6565 91 K 4.5231 7.2130 119.5154 52.2394 31.9895 173.8447 92 P 4.6589 0.0000 0.0000 63.2110 32.5141 175.8799 93 N 4.8823 8.9512 121.1650 54.0079 37.4051 176.1905 94 K 4.0367 7.8133 117.3654 58.6235 32.4214 176.3904 95 D 4.7727 7.7969 116.8895 51.9095 43.4446 174.4349 96 K 5.0428 8.5597 125.5501 55.8124 33.7205 176.8771 97 V 4.1200 8.3165 115.6843 62.4295 33.2109 175.3521 98 G 4.3058 7.6369 106.3053 45.3613 0.0000 171.7931 99 K 5.3273 8.3886 117.6867 55.3904 36.0286 175.9338 100 I 4.9417 8.9528 121.8982 59.5550 41.8303 175.3391 101 S 5.1869 9.0765 120.8439 57.4789 63.5782 175.5963 102 R 3.9564 8.6757 120.9889 59.3301 29.7884 179.3089 103 A 4.2696 7.8094 121.6641 54.6473 18.4885 179.4002 104 Q 4.1919 7.8479 117.5467 58.6654 28.8430 178.9956 105 L 4.0459 7.9836 119.3583 58.1409 41.7461 179.5589 106 Q 4.1164 7.8681 117.5801 58.8968 28.0601 178.7034 107 E 4.0947 8.0034 119.2999 59.5018 29.4405 179.4682 108 I 3.7971 8.3159 120.1297 64.2114 37.2212 178.3838 109 A 3.9906 8.5462 122.0818 54.9695 17.9281 179.4245 110 Q 3.9874 7.8797 117.6116 59.2967 29.1566 178.1101 111 T 4.0937 7.5481 116.2585 66.3814 68.8675 176.6283 112 K 4.1846 8.5853 119.2683 57.6872 32.0619 178.9957 113 A 3.9423 7.7277 121.9350 55.3823 18.0337 179.3109 114 A 3.9629 8.0295 117.1683 55.1313 18.5675 178.5900 115 D 4.6227 8.1588 114.5569 54.1453 41.8413 176.6867 116 M 4.4754 6.9327 119.3929 54.3888 33.2812 176.2646 117 T 4.1333 8.4757 115.2403 62.6916 68.0898 175.0136 118 G 3.8652 8.0708 108.5699 46.3876 0.0000 173.3177 119 A 4.1043 8.8256 128.1793 54.3339 19.0753 177.1531 120 D 5.0725 7.6281 114.0064 50.7296 43.9120 176.6284 121 I 3.7175 8.2039 113.3540 64.1734 37.2854 177.9438 122 E 3.9103 8.2604 119.5149 59.1451 29.2873 178.8863 123 A 3.9846 8.9655 120.8452 55.6150 18.3696 179.5381 124 M 3.9945 7.8973 116.6890 58.8917 32.0498 179.1590 125 T 3.8752 8.3237 116.2283 66.7150 68.5965 176.7157 126 R 4.1314 8.1127 121.9538 58.9174 29.8329 178.4379 127 S 4.1226 8.3281 115.2718 61.9467 62.7399 176.8326 128 I 4.0158 7.6345 122.2215 64.0052 36.4388 178.1350 129 E 4.0562 8.1774 119.7604 59.4053 29.0255 179.6420 130 G 3.6755 8.1649 105.2493 47.6170 0.0000 175.5621 131 T 4.1130 7.4071 112.1730 64.3952 68.8928 176.9550 132 A 3.9937 8.2155 123.8861 55.1377 18.2958 179.8940 133 R 3.8771 8.0848 115.1254 58.9442 30.1411 178.7406 134 S 4.4365 7.5716 113.5759 59.9341 61.9090 175.1555 135 M 4.4507 8.2320 120.7632 54.3578 32.1954 176.9338 136 G 3.8480 7.9659 107.4705 46.0326 0.0000 172.5001 137 L 4.8278 7.7249 119.5473 52.6250 42.9021 176.8443 138 V 3.9303 8.3666 124.6327 62.6349 33.2338 175.0325 139 V 5.5524 8.4380 123.8787 60.1639 34.1956 174.1747 140 E 4.5712 8.6659 126.5612 54.5159 31.6736 175.7512 141 D 4.4587 8.6561 122.9494 54.3633 41.3816 175.5470 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 A 8.25 4.35 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 2 K 7.55 4.21 0.00 1.90 1.75 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.45 7.81 3 K 8.22 4.34 0.00 1.70 1.76 0.00 1.59 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.48 7.81 4 V 7.87 4.49 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 0.76 0.00 0.00 0.93 0.00 0.00 5 Q 8.38 3.81 0.00 2.45 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.58 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 6 A 9.17 3.85 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 7 Y 8.17 3.44 0.00 3.07 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 8 V 7.92 4.24 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.67 0.00 0.00 9 K 8.11 4.92 0.00 1.56 1.62 0.00 1.98 0.00 0.00 1.82 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.29 1.43 7.81 10 L 8.64 4.40 0.00 1.66 1.61 0.77 0.48 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 11 Q 8.72 4.82 0.00 1.94 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 12 V 7.97 4.53 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 0.27 0.00 0.00 0.94 0.00 0.00 13 A 8.80 3.79 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 14 A 8.37 3.87 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 15 G 7.30 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 16 M 7.57 4.12 0.00 1.94 1.91 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 17 A 8.55 4.25 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 18 N 9.37 4.62 0.00 2.75 3.27 0.00 0.00 6.96 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.27 0.00 2.20 1.97 0.00 3.66 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 20 S 8.65 4.02 0.00 3.81 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 4.39 0.00 2.06 2.09 0.00 3.73 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 22 P 0.00 4.45 0.00 2.02 2.09 0.00 3.66 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 23 V 7.59 4.20 2.19 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 0.97 0.00 0.00 0.92 0.00 0.00 24 G 9.39 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.09 0.00 2.13 2.12 0.00 3.97 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 2.10 2.16 0.00 26 A 7.78 3.80 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 27 L 7.54 4.21 0.00 1.54 1.63 0.27 0.27 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 28 G 8.10 3.61 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 29 Q 7.55 3.96 0.00 1.94 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.92 0.00 0.00 0.00 0.00 0.00 2.35 2.69 0.00 30 Q 7.49 4.13 0.00 1.92 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.40 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 31 G 7.31 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 32 V 7.33 3.40 1.65 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 -0.64 0.00 0.00 0.58 0.00 0.00 33 N 8.15 4.71 0.00 3.18 2.92 0.00 0.00 6.89 7.34 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 34 I 8.23 3.55 1.88 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 1.49 0.95 0.93 0.00 0.00 35 M 8.10 3.93 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.73 0.00 36 E 8.42 3.99 0.00 2.22 2.41 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 2.46 2.44 0.00 37 F 8.55 4.37 0.00 3.41 3.21 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 38 C 8.37 3.99 0.00 3.10 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 39 K 8.04 3.97 0.00 1.87 1.85 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.61 7.81 40 A 8.44 4.08 1.62 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 0.00 0.00 41 F 8.76 4.35 0.00 1.51 2.38 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 42 N 8.52 4.63 0.00 2.76 2.80 0.00 0.00 6.56 8.88 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 43 A 7.60 4.07 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 44 K 7.63 4.10 0.00 1.89 1.80 0.00 1.58 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.42 7.81 45 T 7.57 3.80 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 -0.12 0.00 0.00 46 D 7.29 4.25 0.00 2.77 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 47 S 7.80 4.18 0.00 3.94 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 48 I 7.18 3.82 1.82 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 1.29 0.74 0.89 0.00 0.00 49 E 8.77 3.85 0.00 2.03 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.32 0.00 50 K 8.49 4.25 0.00 1.73 1.71 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.39 1.48 7.81 51 G 8.99 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 0.00 0.00 0.00 52 L 7.21 4.78 0.00 1.58 1.60 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.54 0.00 2.10 2.13 0.00 3.74 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 2.01 1.99 0.00 54 I 7.99 4.61 1.96 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 1.36 1.31 1.18 0.00 0.00 55 P 0.00 4.81 0.00 2.19 2.21 0.00 3.83 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.00 0.00 56 V 8.89 4.83 2.42 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 0.56 0.00 0.00 1.34 0.00 0.00 57 V 8.08 4.50 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 0.50 0.00 0.00 0.94 0.00 0.00 58 I 7.95 4.68 1.43 0.00 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.24 0.63 0.00 0.00 59 T 8.70 4.53 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 1.25 0.00 0.00 60 V 8.23 4.22 1.98 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 0.93 0.00 0.00 0.70 0.00 0.00 61 Y 7.88 4.89 0.00 3.14 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 62 A 8.68 4.28 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 D 8.20 4.43 0.00 2.77 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 64 R 8.47 4.14 0.00 2.05 2.17 0.00 3.25 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.80 0.00 65 S 7.81 4.70 0.00 4.17 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 66 F 7.70 5.08 0.00 3.00 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 67 T 8.44 5.08 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 68 F 8.15 5.76 0.00 3.17 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 69 V 8.51 4.30 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 0.83 0.00 0.00 1.00 0.00 0.00 70 T 8.66 4.44 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 1.25 0.00 0.00 71 K 8.12 4.57 0.00 1.95 2.11 0.00 1.95 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.52 1.59 7.81 72 T 8.10 4.61 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 1.30 0.00 0.00 73 P 0.00 4.50 0.00 2.24 2.18 0.00 3.87 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 74 P 0.00 4.32 0.00 2.19 2.06 0.00 3.68 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 75 A 8.60 3.99 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.98 3.92 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 77 V 7.72 3.50 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 1.08 0.00 0.00 0.95 0.00 0.00 78 L 8.05 4.01 0.00 1.90 1.72 0.98 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.32 4.06 0.00 1.86 1.72 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 80 K 7.96 3.99 0.00 2.04 2.03 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.73 7.81 81 K 8.06 3.92 0.00 1.96 1.86 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.69 7.81 82 A 7.81 3.97 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 83 A 8.36 4.31 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 84 G 7.90 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 85 I 7.67 4.35 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.71 0.95 0.00 0.00 86 K 8.47 4.29 0.00 1.75 1.89 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.40 7.81 87 S 7.59 4.78 0.00 3.76 3.71 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 88 G 8.43 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 89 S 8.13 4.51 0.00 4.12 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 90 G 8.23 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 0.00 0.00 0.00 91 K 7.21 4.52 0.00 1.83 1.72 0.00 1.59 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.47 7.81 92 P 0.00 4.66 0.00 2.03 2.09 0.00 3.80 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 93 N 8.95 4.88 0.00 2.90 3.02 0.00 0.00 6.92 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 7.81 4.04 0.00 1.69 2.03 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.37 7.81 95 D 7.80 4.77 0.00 2.60 2.49 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 96 K 8.56 5.04 0.00 1.97 1.80 0.00 1.22 0.00 0.00 2.36 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.41 7.81 97 V 8.32 4.12 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 0.73 0.00 0.00 0.97 0.00 0.00 98 G 7.64 4.31 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 0.00 99 K 8.39 5.33 0.00 1.90 1.73 0.00 1.55 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.29 1.44 7.81 100 I 8.95 4.94 1.87 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 1.29 0.78 0.95 0.00 0.00 101 S 9.08 5.19 0.00 4.01 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 R 8.68 3.96 0.00 1.89 2.04 0.00 3.29 0.00 0.00 3.34 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 103 A 7.81 4.27 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 0.00 104 Q 7.85 4.19 0.00 2.32 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.27 0.00 105 L 7.98 4.05 0.00 1.84 1.73 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 7.87 4.12 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.68 0.00 107 E 8.00 4.09 0.00 2.23 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 2.33 2.63 0.00 108 I 8.32 3.80 2.00 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 1.46 0.97 0.92 0.00 0.00 109 A 8.55 3.99 1.42 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 0.00 0.00 110 Q 7.88 3.99 0.00 2.18 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 111 T 7.55 4.09 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 1.22 0.00 0.00 112 K 8.59 4.18 0.00 1.76 1.86 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.64 1.61 7.81 113 A 7.73 3.94 1.42 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 0.00 0.00 114 A 8.03 3.96 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 0.00 115 D 8.16 4.62 0.00 2.66 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 0.00 116 M 6.93 4.48 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.48 0.00 117 T 8.48 4.13 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 0.00 118 G 8.07 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 8.83 4.10 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 0.00 120 D 7.63 5.07 0.00 3.00 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 0.00 121 I 8.20 3.72 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.40 0.91 0.00 0.00 122 E 8.26 3.91 0.00 2.31 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 0.00 2.40 2.45 0.00 123 A 8.97 3.98 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 0.00 124 M 7.90 3.99 0.00 2.12 2.24 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.59 0.00 125 T 8.32 3.88 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 1.29 0.00 0.00 126 R 8.11 4.13 0.00 2.00 2.03 0.00 3.16 0.00 0.00 3.27 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.53 0.00 127 S 8.33 4.12 0.00 4.09 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 0.00 128 I 7.63 4.02 2.01 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 1.53 0.88 0.92 0.00 0.00 129 E 8.18 4.06 0.00 2.22 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 2.33 2.58 0.00 130 G 8.16 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 T 7.41 4.11 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 1.25 0.00 0.00 132 A 8.22 3.99 1.38 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 0.00 133 R 8.08 3.88 0.00 1.78 2.02 0.00 3.16 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.96 0.00 134 S 7.57 4.44 0.00 3.98 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 0.00 135 M 8.23 4.45 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.54 0.00 136 G 7.97 3.85 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 0.00 0.00 0.00 137 L 7.72 4.83 0.00 1.62 1.63 0.93 0.97 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 0.00 138 V 8.37 3.93 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 0.82 0.00 0.00 0.93 0.00 0.00 139 V 8.44 5.55 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 1.00 0.00 0.00 0.96 0.00 0.00 140 E 8.67 4.57 0.00 2.04 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 2.28 2.23 0.00 141 D 8.66 4.46 0.00 2.64 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00