NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.6013 0.0000 0.0000 61.9718 32.7771 175.8274 2 I 3.6838 8.2556 121.6862 61.0378 37.4049 170.9962 3 V 4.4750 8.4672 119.0989 59.7638 34.9217 175.4096 4 D 5.0014 8.4083 117.7511 52.7530 39.9683 174.9470 5 S 4.5298 7.5282 112.9589 57.9721 67.1631 176.1336 6 G 3.8343 8.6797 110.0112 46.5484 0.0000 175.3312 7 S 4.6361 8.3638 117.1132 56.6485 65.2454 172.9796 8 V 4.4782 7.8704 116.3287 58.9085 35.0983 175.7505 9 A 4.1459 8.3350 124.7564 51.3359 18.9041 176.0343 10 P 4.3373 0.0000 0.0000 62.5938 32.0039 176.4399 11 L 4.2865 8.1839 121.3558 54.4651 42.3896 178.1332 12 S 4.4422 9.1154 119.0327 57.5377 65.3741 175.2399 13 A 3.9674 8.4942 123.6204 55.4219 18.0477 179.8816 14 A 3.9825 7.9253 118.6869 55.2779 18.5734 179.5401 15 E 3.9534 7.9843 117.3037 59.3681 29.5082 179.7312 16 K 3.9251 8.1669 118.4562 59.9184 32.2076 179.4866 17 T 3.9449 7.9757 115.9003 66.4073 68.2425 176.6435 18 K 3.9794 8.2544 121.4922 59.5408 32.2295 178.8866 19 I 3.9151 8.3143 120.3448 64.5831 37.2174 178.4822 20 R 4.0585 8.4802 119.4240 59.5519 29.7483 179.3821 21 S 4.2355 8.1052 112.2807 61.3963 63.1908 176.0523 22 A 4.1637 8.3781 123.8577 54.2331 18.3359 179.1144 23 W 4.4316 8.7924 127.4188 60.3262 30.8308 177.9052 24 A 4.0415 8.0455 120.7312 55.0518 17.5483 177.8872 25 P 4.1303 0.0000 0.0000 65.7577 31.9399 178.7828 26 V 3.5383 7.4332 116.5797 65.9130 31.3789 177.3033 27 Y 3.8449 7.4810 120.0967 60.1476 38.7386 177.0176 28 S 4.2245 7.9179 112.1665 59.7217 63.2215 173.8274 29 N 4.8142 7.5120 118.9164 52.8416 39.6583 175.2605 30 Y 4.0838 7.6958 118.9880 60.0083 37.3616 177.9773 31 E 4.0381 7.4182 118.6225 58.7851 29.8703 178.2281 32 T 4.3793 7.5489 114.4121 64.7622 69.9980 176.8100 33 S 4.1829 8.2681 117.5043 61.4875 62.8491 176.6361 34 G 3.8077 8.1693 108.2887 48.1683 0.0000 175.1692 35 V 3.6341 7.9583 120.6283 66.0353 31.2835 177.3230 36 D 4.3861 8.0826 117.6676 57.6365 40.6814 179.3040 37 I 3.7601 7.8662 119.8450 64.2895 37.2073 178.1440 38 L 4.1078 8.6532 121.4295 58.3323 41.9956 179.0522 39 V 3.5718 8.4606 118.4597 65.8532 31.4896 177.6477 40 K 3.9039 8.3549 119.4544 59.6727 31.9398 178.2913 41 F 4.2159 8.6651 121.1080 61.2707 39.0558 176.7380 42 F 3.6284 8.6400 119.4672 61.5161 39.3596 177.1114 43 T 3.9252 7.9543 107.3900 64.1585 68.7327 175.8933 44 S 4.5386 7.6420 116.2930 58.9073 64.4602 174.5252 45 T 4.3710 6.8991 118.6349 59.6010 68.9397 172.2744 46 P 3.8935 0.0000 0.0000 65.4242 31.4895 177.5635 47 A 3.9298 7.9548 116.8755 54.4094 18.6403 178.2991 48 A 4.2670 7.4449 117.8767 52.8963 19.2839 179.0737 49 Q 3.9358 7.6959 117.2463 58.3446 28.4108 178.1308 50 E 4.0873 7.7973 116.9967 58.2552 29.8999 177.8474 51 F 4.6507 7.6268 116.8976 57.3567 40.7334 175.8135 52 F 4.6240 7.9411 118.1976 54.5767 38.8785 173.8761 53 P 4.2946 0.0000 0.0000 65.6536 31.7639 178.8125 54 K 4.3490 7.9821 114.6290 57.9624 32.2289 177.2363 55 F 4.8615 8.3999 117.7318 56.6343 39.4830 175.3389 56 K 3.9258 7.7752 122.3287 58.4440 32.0222 176.1621 57 G 4.1485 9.2463 114.1020 45.3256 0.0000 173.0087 58 M 4.9680 8.0817 119.4407 53.8144 34.2525 175.6990 59 T 4.8996 8.6011 109.9593 60.2532 71.1499 174.4530 60 S 4.5820 8.2243 116.7905 57.1342 65.0090 174.4351 61 A 3.9996 8.3735 128.0553 55.3542 18.0219 179.8752 62 D 4.3087 7.9808 115.9704 57.5321 41.3254 178.7742 63 Q 4.0556 7.8946 117.8683 58.9910 29.0214 178.1604 64 L 3.6632 7.7028 119.9168 57.8910 41.4410 180.0050 65 K 3.9237 7.6100 116.2240 59.1658 32.0610 178.1250 66 K 4.1747 7.6947 115.5346 56.9313 32.6974 177.1734 67 S 4.4430 7.6403 114.9393 57.3206 64.1801 174.5169 68 A 4.1546 8.4952 130.0948 54.7191 18.4507 179.5868 69 D 4.4696 7.9180 118.0132 57.4874 41.0058 178.9364 70 V 3.3650 7.5608 118.2978 65.7552 31.3962 177.8226 71 R 3.9297 7.9128 118.1639 59.1634 29.9753 178.1301 72 W 4.8020 8.2979 128.0376 61.0902 30.8257 177.3351 73 H 3.9729 8.4488 117.4402 59.1477 29.2925 176.9272 74 A 4.0840 8.3027 122.5663 55.4365 18.2687 179.4821 75 E 4.0106 8.6268 117.3668 59.6531 29.5205 179.9139 76 R 3.6945 7.5738 118.0920 58.9507 30.0462 179.0990 77 I 3.6873 7.6099 119.3852 64.5194 37.2254 178.1435 78 I 3.9326 7.9999 119.4257 64.5708 37.7247 177.5900 79 N 4.5730 8.4068 116.7567 55.8583 38.2044 177.3337 80 A 3.9503 8.0627 122.7044 54.9865 18.4108 179.8371 81 V 3.3900 7.9796 116.9476 65.8333 31.5347 177.8056 82 N 4.0401 8.2422 117.0208 56.6891 38.5517 176.6136 83 D 4.2479 8.0224 119.3038 57.1598 41.1354 178.3394 84 A 3.9667 7.4960 121.3092 54.8407 18.2451 179.8003 85 V 3.2132 7.4287 116.5387 65.9707 31.4092 177.7222 86 A 4.2845 7.7280 117.0381 53.3308 18.4046 177.7735 87 S 4.6501 7.4784 113.2131 58.2831 63.6230 176.1651 88 M 4.0332 7.8132 122.4369 57.8494 31.6775 177.0533 89 D 4.8626 7.8509 116.5696 53.7618 42.0558 177.0512 90 D 4.7491 7.9087 117.6818 52.3306 42.2385 175.9743 91 T 3.8653 7.8492 119.5695 66.3363 68.8605 175.7533 92 E 3.8544 8.0639 120.9407 59.2810 29.8800 178.6582 93 K 3.9196 8.2481 119.6174 59.5714 32.2042 178.3489 94 M 3.9653 7.9247 118.3963 58.8230 32.0464 178.4771 95 S 4.1283 8.2628 115.3495 61.5278 63.0049 176.5735 96 M 4.0148 7.9630 121.5443 58.4576 31.7675 179.0127 97 K 4.0332 7.8781 118.0895 59.2810 32.1254 179.5087 98 L 4.0159 7.9045 119.3752 57.5537 41.5514 179.6522 99 R 3.8795 8.2846 118.6075 59.0581 30.0710 178.5456 100 D 4.2717 7.9353 117.5804 57.2189 41.2621 178.0790 101 L 4.0438 8.0342 120.9335 58.0003 42.0174 178.8600 102 S 4.3280 8.3716 113.8003 61.2551 62.3194 176.2917 103 G 3.5332 8.1277 108.3878 47.8069 0.0000 175.7699 104 K 3.5312 7.7491 120.5628 59.1675 31.9809 179.1729 105 H 4.2483 8.2621 116.1779 58.7563 28.4916 177.7833 106 A 3.5598 7.6358 121.1100 55.0271 18.4470 179.6284 107 K 4.0058 8.0287 115.6844 58.2699 30.8092 178.3416 108 S 4.4811 7.3823 112.4227 60.0024 64.7540 176.1324 109 F 4.4348 7.8476 117.9846 57.9381 39.2742 175.3444 110 Q 3.5126 7.2852 116.1080 56.7344 26.8648 174.2888 111 V 3.4565 7.7486 109.4871 59.5409 32.9706 176.0273 112 D 4.1415 6.8549 123.4072 53.8433 40.8084 175.1454 113 P 3.2739 0.0000 0.0000 64.6040 30.7791 177.9220 114 Q 3.7826 7.6927 117.2001 58.9576 28.8081 177.1374 115 Y 4.4163 7.0552 117.4026 59.0425 38.0980 177.3838 116 F 4.3957 7.3861 120.0841 60.5998 39.0843 177.6177 117 K 4.0788 8.1099 117.7503 59.6724 32.1659 179.3427 118 V 3.6431 7.6696 119.1706 65.9496 31.7233 177.6062 119 L 3.5714 7.9095 119.9102 57.8979 41.7257 178.5772 120 A 4.0358 8.1580 120.5319 55.2658 18.2360 179.4331 121 A 4.0065 8.0237 119.2097 55.3593 18.5263 180.0958 122 V 3.6576 7.6366 116.7430 66.0294 31.5315 178.3857 123 I 3.8282 8.0060 119.4863 64.2854 36.9533 178.1153 124 A 4.0611 8.4738 121.8106 55.5025 18.1167 179.2839 125 D 4.3567 8.1468 114.7889 57.4689 41.2403 178.2773 126 T 4.1186 7.4590 115.3092 66.1773 68.7173 176.9614 127 V 3.7914 7.7218 118.9041 64.6187 32.8537 177.1423 128 A 4.4621 7.8339 122.6733 50.5209 20.5581 173.7287 129 A 4.0452 8.0399 123.1797 53.5711 19.2409 176.6584 130 G 4.1989 9.1274 111.3824 45.7834 0.0000 174.2104 131 D 4.3363 7.7671 118.8368 54.8172 41.9780 177.2176 132 A 4.1981 8.8031 129.0206 55.0476 18.7034 179.4872 133 G 3.5541 8.1552 104.0395 47.9175 0.0000 175.6181 134 F 3.9778 9.0492 123.4854 60.9915 39.2136 177.1725 135 E 3.9940 8.2523 117.8796 59.2430 29.1416 179.2264 136 K 3.9412 8.2984 119.9221 59.3533 32.1719 178.6126 137 L 3.7286 7.4762 120.1206 58.3878 41.9309 178.8404 138 M 3.8380 7.8935 118.7607 58.2824 31.8026 178.9853 139 S 4.4075 8.0510 116.9026 61.3695 63.1648 176.4153 140 M 3.9576 8.0584 121.4788 58.5420 31.6111 179.0284 141 I 3.5547 7.7651 119.7402 64.6661 36.9149 178.4171 142 C 3.9406 8.3383 117.9023 62.6615 27.6329 176.3096 143 I 4.0345 7.8165 122.6018 63.8661 36.9955 178.1779 144 L 4.0925 7.7529 119.5410 57.5389 41.2276 179.3961 145 L 3.8664 7.7465 118.1176 56.5613 41.7117 178.5375 146 R 4.7279 7.2658 115.8242 55.8830 30.1422 178.1405 147 S 4.1446 7.9200 115.0604 60.6846 63.0993 174.9892 148 A 4.3846 7.9997 121.8375 52.3879 19.2185 176.5872 149 Y 4.1483 7.8378 118.5135 58.0629 37.9725 175.3762 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 P 0.00 4.60 0.00 2.07 2.07 0.00 3.70 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.09 0.00 2 I 8.26 3.68 1.89 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.61 0.91 0.00 0.00 3 V 8.47 4.47 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 0.97 0.00 0.00 0.90 0.00 0.00 4 D 8.41 5.00 0.00 2.84 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 5 S 7.53 4.53 0.00 3.92 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 6 G 8.68 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 7 S 8.36 4.64 0.00 3.76 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 7.87 4.48 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 0.75 0.00 0.00 0.88 0.00 0.00 9 A 8.34 4.15 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.34 0.00 2.03 1.99 0.00 3.66 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 11 L 8.18 4.29 0.00 1.59 1.57 0.82 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 12 S 9.12 4.44 0.00 4.03 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 13 A 8.49 3.97 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 14 A 7.93 3.98 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 15 E 7.98 3.95 0.00 2.13 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 2.35 2.36 0.00 16 K 8.17 3.93 0.00 2.00 1.85 0.00 1.66 0.00 0.00 1.62 0.00 0.00 3.05 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.42 1.64 7.81 17 T 7.98 3.94 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 18 K 8.25 3.98 0.00 2.04 2.00 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.67 7.81 19 I 8.31 3.92 2.05 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 1.78 0.73 0.96 0.00 0.00 20 R 8.48 4.06 0.00 2.05 2.06 0.00 3.14 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 21 S 8.11 4.24 0.00 4.08 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 22 A 8.38 4.16 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 0.00 0.00 0.00 0.00 0.00 23 W 8.79 4.43 0.00 3.59 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.05 4.04 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 25 P 0.00 4.13 0.00 1.98 2.09 0.00 3.76 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 2.02 2.13 0.00 26 V 7.43 3.54 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.83 0.00 0.00 27 Y 7.48 3.84 0.00 1.86 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 7.92 4.22 0.00 3.99 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 29 N 7.51 4.81 0.00 2.69 2.60 0.00 0.00 6.83 7.44 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 30 Y 7.70 4.08 0.00 3.07 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 31 E 7.42 4.04 0.00 1.67 1.96 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 2.17 2.51 0.00 32 T 7.55 4.38 4.32 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 1.21 0.00 0.00 33 S 8.27 4.18 0.00 3.83 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 34 G 8.17 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 35 V 7.96 3.63 2.26 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 1.03 0.00 0.00 0.97 0.00 0.00 36 D 8.08 4.39 0.00 2.91 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 37 I 7.87 3.76 2.12 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.93 1.02 0.00 0.00 38 L 8.65 4.11 0.00 1.82 1.73 1.15 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 39 V 8.46 3.57 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 0.93 0.00 0.00 0.91 0.00 0.00 40 K 8.35 3.90 0.00 2.10 2.11 0.00 1.62 0.00 0.00 1.61 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.59 7.81 41 F 8.67 4.22 0.00 3.24 3.35 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 42 F 8.64 3.63 0.00 2.93 3.13 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 0.00 0.00 0.00 0.00 43 T 7.95 3.93 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 44 S 7.64 4.54 0.00 3.92 3.93 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 45 T 6.90 4.37 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 1.09 0.00 0.00 46 P 0.00 3.89 0.00 2.04 1.97 0.00 3.50 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 2.01 0.00 47 A 7.95 3.93 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 48 A 7.44 4.27 0.69 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 0.00 0.00 49 Q 7.70 3.94 0.00 1.89 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 1.16 1.94 0.00 50 E 7.80 4.09 0.00 1.85 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 1.63 1.47 0.00 51 F 7.63 4.65 0.00 3.13 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 52 F 7.94 4.62 0.00 2.95 1.95 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 53 P 0.00 4.29 0.00 2.19 2.15 0.00 3.52 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 54 K 7.98 4.35 0.00 1.86 2.05 0.00 1.77 0.00 0.00 1.82 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.48 7.81 55 F 8.40 4.86 0.00 3.17 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.78 3.93 0.00 2.09 1.84 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.15 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.53 7.81 57 G 9.25 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 M 8.08 4.97 0.00 1.87 1.97 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 2.39 0.00 59 T 8.60 4.90 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 1.29 0.00 0.00 60 S 8.22 4.58 0.00 3.94 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 61 A 8.37 4.00 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 62 D 7.98 4.31 0.00 2.62 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 63 Q 7.89 4.06 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.84 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 64 L 7.70 3.66 0.00 1.53 1.36 0.88 0.00 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 65 K 7.61 3.92 0.00 1.73 1.83 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.59 7.81 66 K 7.69 4.17 0.00 1.86 1.81 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.49 7.81 67 S 7.64 4.44 0.00 3.78 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 68 A 8.50 4.15 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 69 D 7.92 4.47 0.00 2.75 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 70 V 7.56 3.36 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 0.69 0.00 0.00 -0.35 0.00 0.00 71 R 7.91 3.93 0.00 2.20 2.16 0.00 3.22 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.68 0.00 72 W 8.30 4.80 0.00 3.58 3.35 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 73 H 8.45 3.97 0.00 3.51 3.69 0.00 5.67 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 A 8.30 4.08 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 75 E 8.63 4.01 0.00 2.37 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 0.00 2.84 2.61 0.00 76 R 7.57 3.69 0.00 1.51 1.70 0.00 2.21 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.50 0.00 77 I 7.61 3.69 2.08 0.00 0.00 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 1.50 1.29 0.98 0.00 0.00 78 I 8.00 3.93 2.11 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.52 1.01 0.00 0.00 79 N 8.41 4.57 0.00 2.96 2.82 0.00 0.00 6.89 6.41 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 80 A 8.06 3.95 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 81 V 7.98 3.39 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 0.53 0.00 0.00 1.02 0.00 0.00 82 N 8.24 4.04 0.00 3.27 2.97 0.00 0.00 7.17 8.10 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 83 D 8.02 4.25 0.00 2.77 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 A 7.50 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.43 3.21 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 0.81 0.00 0.00 0.08 0.00 0.00 86 A 7.73 4.28 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 87 S 7.48 4.65 0.00 3.95 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 M 7.81 4.03 0.00 1.91 2.07 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.38 0.00 89 D 7.85 4.86 0.00 2.62 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 7.91 4.75 0.00 2.68 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 0.00 0.00 0.00 0.00 91 T 7.85 3.87 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 1.16 0.00 0.00 92 E 8.06 3.85 0.00 2.00 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 0.00 2.35 2.34 0.00 93 K 8.25 3.92 0.00 1.99 1.85 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.42 7.81 94 M 7.92 3.97 0.00 2.20 1.96 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 2.48 2.48 0.00 95 S 8.26 4.13 0.00 3.99 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 96 M 7.96 4.01 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.55 0.00 97 K 7.88 4.03 0.00 1.78 1.81 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.44 7.81 98 L 7.90 4.02 0.00 1.71 1.59 0.83 0.81 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 99 R 8.28 3.88 0.00 1.84 1.94 0.00 3.17 0.00 0.00 3.06 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 100 D 7.94 4.27 0.00 2.77 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 0.00 101 L 8.03 4.04 0.00 2.03 1.73 1.05 0.62 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 0.00 102 S 8.37 4.33 0.00 4.12 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 0.00 103 G 8.13 3.53 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 0.00 0.00 0.00 104 K 7.75 3.53 0.00 1.75 0.74 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.26 1.56 7.81 105 H 8.26 4.25 0.00 3.75 3.94 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 A 7.64 3.56 0.37 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 0.00 107 K 8.03 4.01 0.00 1.63 1.75 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.31 7.81 108 S 7.38 4.48 0.00 3.28 3.67 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 0.00 109 F 7.85 4.43 0.00 3.05 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 Q 7.29 3.51 0.00 2.30 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.72 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 111 V 7.75 3.46 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 0.79 0.00 0.00 0.65 0.00 0.00 112 D 6.85 4.14 0.00 2.54 2.39 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 0.00 113 P 0.00 3.27 0.00 1.73 0.50 0.00 3.55 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.56 0.00 114 Q 7.69 3.78 0.00 1.92 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.98 0.00 0.00 0.00 0.00 0.00 1.55 1.16 0.00 115 Y 7.06 4.42 0.00 2.94 3.29 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 0.00 116 F 7.39 4.40 0.00 2.98 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 0.00 117 K 8.11 4.08 0.00 2.00 2.09 0.00 1.49 0.00 0.00 1.89 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.68 1.52 7.81 118 V 7.67 3.64 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 1.45 0.00 0.00 1.10 0.00 0.00 119 L 7.91 3.57 0.00 0.45 1.33 0.70 0.91 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 0.00 120 A 8.16 4.04 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 0.00 121 A 8.02 4.01 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 V 7.64 3.66 2.35 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 1.19 0.00 0.00 1.14 0.00 0.00 123 I 8.01 3.83 2.24 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.73 1.32 0.00 0.00 124 A 8.47 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.15 4.36 0.00 2.79 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 0.00 126 T 7.46 4.12 4.44 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 1.21 0.00 0.00 127 V 7.72 3.79 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 0.50 0.00 0.00 1.18 0.00 0.00 128 A 7.83 4.46 1.10 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 0.00 0.00 129 A 8.04 4.05 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.13 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 0.00 0.00 0.00 0.00 131 D 7.77 4.34 0.00 2.79 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 0.00 132 A 8.80 4.20 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 0.00 133 G 8.16 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 0.00 134 F 9.05 3.98 0.00 3.31 3.11 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 0.00 135 E 8.25 3.99 0.00 2.23 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 2.45 2.69 0.00 136 K 8.30 3.94 0.00 1.86 1.96 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.40 7.81 137 L 7.48 3.73 0.00 1.60 1.18 0.35 0.50 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 0.00 138 M 7.89 3.84 0.00 2.01 2.18 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.62 0.00 139 S 8.05 4.41 0.00 4.00 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 0.00 140 M 8.06 3.96 0.00 1.94 2.15 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.52 0.00 141 I 7.77 3.55 1.84 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.68 0.73 0.00 0.00 142 C 8.34 3.94 0.00 3.05 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 0.00 143 I 7.82 4.03 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.33 0.91 0.00 0.00 144 L 7.75 4.09 0.00 1.75 1.61 0.86 0.40 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 0.00 145 L 7.75 3.87 0.00 0.88 0.24 0.24 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 146 R 7.27 4.73 0.00 1.88 1.93 0.00 3.34 0.00 0.00 3.39 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.82 0.00 147 S 7.92 4.14 0.00 4.00 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 0.00 148 A 8.00 4.38 1.20 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 0.00 0.00 0.00 149 Y 7.84 4.15 0.00 3.14 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