NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.3256 8.1593 115.2501 62.3602 68.3514 173.6078 3 T 4.0370 8.5326 116.8189 60.7484 69.4924 173.7340 4 F 4.0198 8.1209 125.2822 59.1684 40.6015 175.8150 5 T 4.0677 7.3074 116.3826 59.0111 71.5610 173.3087 6 L 3.8735 7.8476 126.4603 54.4671 42.9396 176.5764 7 D 4.3046 9.5151 125.4569 54.8887 42.3848 177.1920 8 E 3.9464 8.9358 124.8726 59.9798 29.2102 179.7708 9 R 3.8979 8.6318 119.0857 59.0438 30.2458 178.9731 10 L 3.9736 7.7909 118.3923 57.4285 41.4093 179.0033 11 E 3.8749 7.9566 118.6710 59.3475 29.7214 178.6228 12 R 4.0096 8.0046 117.6046 59.3192 30.2906 177.5902 13 D 4.6166 8.4348 117.1359 54.3405 41.5335 176.4503 14 G 4.1799 7.3325 106.1898 44.2492 0.0000 172.8925 15 I 4.5450 8.5914 124.9203 58.5318 38.9406 173.5779 16 P 4.7209 0.0000 0.0000 62.9415 31.3507 176.2824 17 I 4.3323 9.6163 114.6407 59.3299 39.2661 175.2884 18 G 4.0675 6.8939 108.3807 45.7199 0.0000 171.2050 19 T 4.8678 7.7573 114.7662 61.7567 72.7332 174.8799 20 L 4.7072 8.8432 126.7775 54.8408 41.4959 177.6140 21 G 3.7285 8.8181 110.9783 49.3486 0.0000 174.1990 22 L 4.1550 9.1394 123.0945 56.6848 43.4960 175.7463 23 C 5.0478 8.4569 116.5750 58.3181 30.6621 174.9285 24 Q 4.1941 8.1764 122.1135 55.5206 31.1673 175.0941 *26 R 4.3888 8.4098 117.0803 56.5929 31.8445 174.9939 27 L 4.7971 8.8004 128.2924 54.7267 44.2625 177.7710 *29 N 4.7875 8.3280 106.1458 52.5820 39.0364 173.4664 30 D 4.7727 7.6901 118.9317 53.1787 42.4598 175.3634 31 R 2.8921 8.2850 123.4552 56.7846 29.5790 178.2640 32 R 3.5574 7.1807 118.1057 58.4581 30.0746 177.1658 33 W 5.1072 7.7468 115.1727 53.9120 33.1257 172.6199 34 P 4.5329 0.0000 0.0000 62.9140 31.9032 175.3463 35 W 5.6994 9.0394 134.8287 56.0126 33.2669 174.0421 36 L 5.3126 9.5877 128.1271 53.1237 44.2167 175.6505 37 I 5.2468 8.7710 114.9381 59.2491 40.4028 174.5649 38 L 4.8635 9.0354 125.4714 53.0770 44.3009 175.5083 39 V 4.5160 8.8642 124.6079 60.2152 33.3524 172.8511 40 P 4.4512 0.0000 0.0000 62.4937 31.6998 177.9226 41 Q 2.5200 8.0100 125.6013 53.8749 27.1881 175.4973 42 R 4.5659 6.7506 115.8738 53.6186 34.3342 175.7787 43 A 4.1717 8.7554 125.2478 53.6739 18.9936 176.9541 44 D 4.4339 8.6756 121.5140 55.5446 38.7098 173.7731 45 I 4.4540 7.6260 118.3446 59.7322 39.3565 176.2855 46 K 4.8371 9.2614 123.1228 56.6712 34.2963 176.4722 47 E 4.4186 7.5942 117.1131 53.9437 31.6424 176.9621 48 V 3.5138 8.1873 121.9489 66.1107 31.5564 177.6172 49 F 4.6267 7.4319 111.2489 57.8675 38.0645 175.6555 50 E 4.2190 7.5290 120.7736 57.8474 29.7568 177.1077 51 L 4.1841 7.3026 118.5931 54.2700 42.3989 177.6640 52 T 4.0878 8.2048 111.4100 61.3274 70.6235 173.5768 53 P 4.2847 0.0000 0.0000 65.7900 31.1694 178.9002 54 L 3.9729 7.8755 116.4514 58.1043 41.6504 178.9313 55 D 4.4946 7.9988 117.6278 57.1728 41.0879 178.4836 56 Q 4.2130 8.4680 118.9897 58.8150 28.7272 179.4045 57 A 4.1234 8.0139 119.3232 52.5776 18.2499 178.9183 *59 L 4.2209 7.8799 124.3748 57.0341 44.0981 179.1473 60 T 3.9128 7.9422 114.9316 66.4791 68.2346 176.3370 61 F 4.1233 8.3658 122.5340 61.4725 39.3851 177.1156 62 E 3.7759 8.2302 117.5165 59.6504 29.3656 179.1241 63 T 3.8796 8.3304 116.1560 66.8412 68.4418 176.4362 64 N 4.2947 8.4050 118.5112 55.9765 38.5383 176.9299 65 L 3.7248 7.6440 121.9952 58.4668 42.0611 179.4053 66 V 3.5273 8.1048 117.9448 65.7635 31.4237 177.7827 67 A 3.9992 8.4452 120.8169 55.0981 18.2638 179.4869 68 A 4.0142 8.3972 119.7816 55.1928 18.4030 179.9999 69 G 3.5945 8.2348 104.4379 47.5907 0.0000 175.5768 70 L 4.0213 8.4377 123.4361 57.5849 42.1125 179.0042 71 K 3.9651 8.1087 119.5545 59.4645 31.9824 178.7436 72 K 3.8946 7.9062 117.1516 59.7362 32.1205 178.9633 73 A 4.1555 8.3270 119.8963 54.1443 18.3726 178.6062 74 T 4.6295 7.7897 105.5368 60.4708 70.0512 174.9291 75 G 3.8904 8.2169 109.0863 46.2305 0.0000 173.8117 76 A 4.1451 7.5745 121.9511 52.0633 18.8753 178.8392 77 E 4.2229 8.6637 120.9334 59.1380 30.3924 177.4598 78 K 4.6761 8.3225 119.1521 55.1849 36.1796 174.8995 79 I 4.9069 8.4037 127.0634 60.1407 39.0093 174.6134 80 N 5.1028 9.1035 123.4963 51.5078 41.4019 173.6760 81 I 5.1989 8.4617 122.9737 59.6515 40.7477 175.2494 82 G 4.1563 9.2763 112.2763 44.8714 0.0000 171.5472 83 A 4.6199 8.6157 125.9798 50.6647 20.2516 174.3804 84 L 4.1199 8.5812 119.2251 52.4927 44.6799 177.3768 85 G 4.3408 7.9596 107.1009 46.7478 0.0000 174.3930 86 N 4.4321 8.2747 119.1160 55.7971 38.6349 176.4750 87 I 3.9504 7.5510 117.3368 62.7489 38.2319 175.8997 88 V 4.1323 7.4498 123.0869 61.4804 31.9196 176.8705 89 R 4.1821 8.4918 127.4575 58.5036 30.4836 176.9706 90 Q 4.3713 8.0432 118.8933 55.8458 29.3889 175.4544 91 L 4.2264 8.4183 128.2771 55.7999 42.4314 175.8102 92 H 5.1320 8.5645 120.4805 54.3264 31.7672 172.7078 93 V 4.5305 8.7195 121.0897 61.5087 33.9240 174.1874 94 H 5.3506 9.6697 126.1473 55.6288 30.4237 174.6844 95 V 4.9016 9.4847 122.6956 61.4015 34.4323 174.0731 96 I 5.1264 8.9394 128.9692 59.3682 40.6841 174.5722 97 A 4.8016 9.1237 129.2468 51.2338 19.7071 176.8787 98 R 5.2473 9.1984 121.8590 54.7125 34.4456 174.9245 99 R 4.4688 8.9143 116.2873 54.4049 33.3498 174.0644 100 E 2.0000 7.5914 121.7060 57.0861 29.7413 177.5359 101 G 3.8633 8.3106 114.4440 45.1109 0.0000 173.0379 102 D 4.5600 7.6922 119.5646 51.8481 40.2752 173.9792 103 P 4.4600 0.0000 0.0000 63.9729 31.6666 176.2720 104 N 3.7686 8.8373 119.1834 53.3387 37.4359 173.2137 105 W 4.3007 8.1119 126.6404 57.5163 31.0262 173.8213 106 P 3.0130 0.0000 0.0000 61.9779 31.0180 175.8315 107 G 3.6923 7.5756 109.5458 43.9887 0.0000 171.7631 108 P 3.9943 0.0000 0.0000 62.1200 32.2247 177.1368 109 V 2.5673 6.4785 112.8803 63.2874 31.4540 176.8364 110 W 4.4254 6.8759 120.1192 57.8981 28.9782 176.5411 111 G 4.0499 9.3313 112.0614 45.2913 0.0000 172.6697 112 F 4.5047 8.3226 122.9876 58.1553 40.4169 175.9601 113 G 3.2770 8.1986 117.8372 46.1839 0.0000 172.5988 114 K 4.4919 8.2856 123.1804 53.8141 34.8990 175.9341 115 A 4.6582 8.6820 127.5329 52.0443 19.2786 176.5171 116 E 4.4780 9.0366 121.2654 53.7259 31.5647 174.1803 117 P 5.0786 0.0000 0.0000 61.5328 32.3723 176.7294 118 W 4.1494 9.4806 123.5569 55.7841 29.8026 175.6061 119 P 4.4734 0.0000 0.0000 62.3758 32.9140 176.9890 120 E 3.7853 8.7890 121.4393 59.8108 29.6538 179.3090 121 E 3.9738 8.1226 117.9124 59.2743 29.5799 178.7854 122 E 4.1209 8.2827 119.2225 59.6454 29.7758 178.3914 123 H 3.9245 8.4880 114.9421 58.0273 28.7207 177.9487 124 R 3.8710 7.7116 120.7741 59.5598 29.8554 178.9715 125 T 3.8798 7.9057 115.5170 66.6498 68.4415 176.5377 126 F 3.9040 8.3327 122.3479 60.9878 39.1214 176.9012 127 A 3.8396 7.9869 119.5548 55.0488 18.2257 179.0671 128 A 4.0189 7.4878 117.4712 55.4593 18.5478 179.6029 129 R 3.9539 7.7745 115.4442 59.4227 30.2854 179.2390 130 I 3.7361 7.0290 116.1614 62.0598 36.5844 177.4322 *132 E 4.2645 8.0362 118.7347 56.0595 31.0442 176.0292 133 N 4.7558 8.0326 115.9242 52.8645 39.3006 175.1626 134 L 4.1617 7.7299 123.8149 54.9759 41.8343 176.5961 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 2 T 8.16 4.33 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 1.31 0.00 0.00 3 T 8.53 4.04 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 4 F 8.12 4.02 0.00 2.94 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 5 T 7.31 4.07 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 1.16 0.00 0.00 6 L 7.85 3.87 0.00 1.50 1.50 1.04 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 7 D 9.52 4.30 0.00 2.75 2.51 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 8 E 8.94 3.95 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 9 R 8.63 3.90 0.00 1.98 2.00 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 10 L 7.79 3.97 0.00 1.77 1.68 0.89 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 11 E 7.96 3.87 0.00 2.05 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 2.30 2.29 0.00 12 R 8.00 4.01 0.00 1.88 2.10 0.00 3.30 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 13 D 8.43 4.62 0.00 2.66 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 14 G 7.33 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 0.00 0.00 0.00 0.00 15 I 8.59 4.54 1.69 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.81 0.73 0.00 0.00 16 P 0.00 4.72 0.00 2.07 2.06 0.00 3.67 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 1.97 1.96 0.00 17 I 9.62 4.33 1.83 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 1.35 0.73 0.87 0.00 0.00 18 G 6.89 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 19 T 7.76 4.87 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 20 L 8.84 4.71 0.00 1.82 1.61 0.92 1.13 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 21 G 8.82 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 L 9.14 4.16 0.00 1.76 1.85 0.89 0.89 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 23 C 8.46 5.05 0.00 2.99 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 24 Q 8.18 4.19 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.53 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 *26 R 8.41 4.39 0.00 1.79 1.94 0.00 3.13 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 27 L 8.80 4.80 0.00 1.67 1.21 0.92 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 *29 N 8.33 4.79 0.00 2.94 2.77 0.00 0.00 6.33 8.49 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 30 D 7.69 4.77 0.00 2.71 2.70 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 31 R 8.28 2.89 0.00 0.67 0.66 0.00 3.13 0.00 0.00 3.22 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.11 0.00 32 R 7.18 3.56 0.00 0.88 0.66 0.00 2.63 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 1.24 1.36 0.00 33 W 7.75 5.11 0.00 3.38 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.53 0.00 2.31 2.07 0.00 3.93 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.16 0.00 35 W 9.04 5.70 0.00 3.58 3.18 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 0.00 36 L 9.59 5.31 0.00 1.78 1.67 1.02 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 37 I 8.77 5.25 1.97 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 1.25 0.71 1.08 0.00 0.00 38 L 9.04 4.86 0.00 1.67 1.62 0.98 0.64 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 39 V 8.86 4.52 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1.00 0.00 0.00 40 P 0.00 4.45 0.00 1.87 1.90 0.00 3.91 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.09 0.00 41 Q 8.01 2.52 0.00 1.73 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.59 0.00 0.00 0.00 0.00 0.00 1.94 2.23 0.00 42 R 6.75 4.57 0.00 1.69 1.76 0.00 3.35 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.48 0.00 43 A 8.76 4.17 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 44 D 8.68 4.43 0.00 2.84 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 45 I 7.63 4.45 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.10 0.87 0.00 0.00 46 K 9.26 4.84 0.00 1.73 1.74 0.00 1.61 0.00 0.00 1.54 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.30 7.81 47 E 7.59 4.42 0.00 1.16 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 2.03 1.75 0.00 48 V 8.19 3.51 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 1.04 0.00 0.00 0.90 0.00 0.00 49 F 7.43 4.63 0.00 3.15 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 50 E 7.53 4.22 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 1.90 0.00 51 L 7.30 4.18 0.00 1.73 1.60 0.90 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.20 4.09 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 53 P 0.00 4.28 0.00 2.19 2.16 0.00 3.62 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 54 L 7.88 3.97 0.00 1.60 1.73 0.91 1.02 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 55 D 8.00 4.49 0.00 2.79 2.71 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 56 Q 8.47 4.21 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.09 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 57 A 8.01 4.12 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 *59 L 7.88 4.22 0.00 1.89 1.92 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 60 T 7.94 3.91 4.48 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 1.26 0.00 0.00 61 F 8.37 4.12 0.00 3.16 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 62 E 8.23 3.78 0.00 2.09 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 0.00 2.52 2.64 0.00 63 T 8.33 3.88 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 1.24 0.00 0.00 64 N 8.40 4.29 0.00 2.70 2.80 0.00 0.00 6.66 7.09 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 65 L 7.64 3.72 0.00 1.28 1.59 0.74 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.10 3.53 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 0.90 0.00 0.00 0.98 0.00 0.00 67 A 8.45 4.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.40 4.01 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 69 G 8.23 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.44 4.02 0.00 1.91 1.90 1.23 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 71 K 8.11 3.97 0.00 1.92 1.95 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.66 7.81 72 K 7.91 3.89 0.00 1.94 1.87 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.47 7.81 73 A 8.33 4.16 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 74 T 7.79 4.63 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 1.60 0.00 0.00 75 G 8.22 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 76 A 7.57 4.15 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 77 E 8.66 4.22 0.00 1.77 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 2.25 2.21 0.00 78 K 8.32 4.68 0.00 2.04 1.80 0.00 1.55 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.52 7.81 79 I 8.40 4.91 1.90 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 1.38 1.16 0.98 0.00 0.00 80 N 9.10 5.10 0.00 2.38 2.57 0.00 0.00 6.63 6.86 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 81 I 8.46 5.20 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.65 0.96 0.00 0.00 82 G 9.28 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 83 A 8.62 4.62 1.16 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 84 L 8.58 4.12 0.00 1.34 1.26 -0.58 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 85 G 7.96 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 86 N 8.27 4.43 0.00 2.70 2.88 0.00 0.00 7.09 7.45 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 87 I 7.55 3.95 1.93 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.54 0.95 0.00 0.00 88 V 7.45 4.13 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 0.98 0.00 0.00 0.94 0.00 0.00 89 R 8.49 4.18 0.00 1.88 1.95 0.00 3.35 0.00 0.00 3.31 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.56 0.00 90 Q 8.04 4.37 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.92 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 91 L 8.42 4.23 0.00 1.65 1.58 0.86 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.56 5.13 0.00 3.17 3.22 0.00 5.53 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 93 V 8.72 4.53 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 1.11 0.00 0.00 0.93 0.00 0.00 94 H 9.67 5.35 0.00 3.51 3.62 0.00 5.61 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 V 9.48 4.90 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 1.14 0.00 0.00 1.02 0.00 0.00 96 I 8.94 5.13 1.47 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.43 0.49 0.00 0.00 97 A 9.12 4.80 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 98 R 9.20 5.25 0.00 2.04 2.25 0.00 3.26 0.00 0.00 2.82 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.83 0.00 99 R 8.91 4.47 0.00 1.55 1.82 0.00 2.71 0.00 0.00 2.97 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.35 0.00 100 E 7.59 2.00 0.00 1.22 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.94 0.00 101 G 8.31 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 0.00 102 D 7.69 4.56 0.00 2.99 2.86 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 0.00 103 P 0.00 4.46 0.00 1.85 2.10 0.00 3.38 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.86 0.00 104 N 8.84 3.77 0.00 1.44 2.38 0.00 0.00 6.84 7.95 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 0.00 105 W 8.11 4.30 0.00 3.74 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 P 0.00 3.01 0.00 1.47 0.90 0.00 3.61 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 107 G 7.58 3.69 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 0.00 108 P 0.00 3.99 0.00 2.24 2.12 0.00 3.66 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.02 0.00 109 V 6.48 2.57 0.67 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 -1.52 0.00 0.00 -1.71 0.00 0.00 110 W 6.88 4.43 0.00 3.42 3.03 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 0.00 111 G 9.33 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 0.00 112 F 8.32 4.50 0.00 3.07 3.41 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 0.00 113 G 8.20 3.28 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 0.00 114 K 8.29 4.49 0.00 1.62 1.60 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.39 7.81 115 A 8.68 4.66 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 0.00 116 E 9.04 4.48 0.00 1.72 1.72 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 2.12 2.29 0.00 117 P 0.00 5.08 0.00 1.97 2.03 0.00 3.70 0.00 0.00 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.97 0.00 118 W 9.48 4.15 0.00 3.37 3.28 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 0.00 119 P 0.00 4.47 0.00 2.23 2.02 0.00 3.81 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 2.29 2.15 0.00 120 E 8.79 3.79 0.00 2.05 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 2.36 2.32 0.00 121 E 8.12 3.97 0.00 2.04 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 2.41 2.32 0.00 122 E 8.28 4.12 0.00 2.20 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.57 0.00 123 H 8.49 3.92 0.00 2.95 3.24 0.00 5.52 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 R 7.71 3.87 0.00 2.06 2.00 0.00 3.10 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 125 T 7.91 3.88 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 126 F 8.33 3.90 0.00 3.16 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 0.00 127 A 7.99 3.84 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 0.00 128 A 7.49 4.02 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 0.00 129 R 7.77 3.95 0.00 1.49 1.72 0.00 3.21 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 130 I 7.03 3.74 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 0.82 0.65 0.86 0.00 0.00 *132 E 8.04 4.26 0.00 1.93 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 2.35 2.26 0.00 133 N 8.03 4.76 0.00 2.92 2.89 0.00 0.00 6.91 6.26 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 0.00 134 L 7.73 4.16 0.00 1.61 1.54 0.90 0.81 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 * Residues marked with a * may have inaccurate shift predictions.