NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 T 4.2644 8.1744 115.2437 61.7185 68.0124 172.9378 13 N 4.2416 8.7214 118.8755 52.8057 39.6326 173.1027 14 L 4.7446 8.9838 127.3670 54.0475 44.7550 175.2197 15 L 4.6337 8.0933 123.8234 53.6881 43.4412 175.7503 16 Y 4.5449 8.4497 122.1209 57.9111 39.8252 174.7198 17 T 3.9357 7.3076 118.2478 60.8139 70.2784 174.0614 18 R 3.9470 8.0405 125.4127 57.0163 29.9888 176.0699 19 N 4.3518 7.5179 117.4642 53.5884 38.2885 175.3879 20 D 4.7025 8.4549 129.5444 53.3829 39.2135 176.5239 21 V 4.3074 6.8443 110.0780 60.3459 33.5479 176.8977 22 S 4.0401 8.6221 118.1140 59.2488 63.8930 175.6364 23 D 4.1964 8.8954 124.9253 57.6086 40.4606 178.3005 24 S 4.1028 8.1009 113.6706 61.5505 61.7195 175.7780 25 E 3.9469 8.5084 120.8177 59.4688 29.2966 179.0771 26 K 3.8056 8.7958 118.8213 59.9620 32.1563 179.0726 27 K 3.8526 8.5549 118.0029 59.5860 31.9589 179.3709 28 A 3.9964 8.2204 121.0783 55.4252 18.3699 179.8177 29 T 3.7698 9.1859 114.4884 66.9784 68.6084 176.9346 30 V 3.7736 7.9689 120.2111 66.2023 31.2425 178.0824 31 E 3.9125 7.7594 117.5395 59.2148 29.4595 178.6583 32 L 3.9203 7.5640 120.3702 58.4321 42.0769 178.7840 33 L 3.9003 8.3841 119.0501 57.9501 41.7045 179.1049 34 N 4.2470 8.4404 116.3800 56.3712 38.6015 177.6091 35 R 3.8761 7.8777 120.1365 59.5049 30.1214 178.5485 36 Q 4.0869 7.7847 117.3655 58.9175 28.7322 178.6112 37 V 3.6317 7.8013 119.3584 66.3870 31.4553 177.7067 38 I 3.6563 7.5599 118.5281 64.6582 36.9933 177.8031 39 Q 3.9890 8.0431 119.4150 59.4884 28.8204 178.9374 40 F 3.7986 9.1787 118.7106 60.5646 39.1551 177.3618 41 I 3.7306 8.2926 119.8804 64.7465 36.8903 177.5888 42 D 4.2776 8.1901 118.2477 57.5050 41.1259 177.7965 43 L 3.7092 7.9811 120.9181 58.3649 41.8580 179.4198 44 S 4.0840 8.1149 114.0382 61.4616 63.0302 176.5061 45 L 3.9367 7.7718 122.5486 57.2223 41.2194 179.4539 46 I 3.4714 7.9076 120.0401 64.7248 37.0531 178.5421 47 T 3.7704 7.7140 116.3143 66.5979 68.1796 176.9213 48 K 3.3144 7.6417 120.2523 58.8785 31.8411 179.0173 49 Q 4.1244 7.8843 119.9041 59.1950 28.7694 178.1025 50 A 3.8889 7.6702 120.7241 55.7420 18.5318 178.5399 51 H 3.9400 8.1877 115.1030 59.5474 29.8897 176.6490 52 W 4.6307 8.0844 119.6813 59.4493 29.9383 178.3074 53 N 5.0695 8.0488 115.1618 52.1306 37.3146 175.3869 54 M 5.1385 7.5960 116.1679 53.5834 34.5716 175.1111 55 R 4.4677 9.1437 120.7353 54.4363 34.4160 173.7086 56 G 4.0366 8.3767 103.3344 44.3172 0.0000 173.2406 57 A 4.1266 8.6605 122.7608 53.0194 19.4414 177.6234 58 N 4.2963 8.9794 118.1974 54.7315 37.1566 175.7206 59 F 4.0937 7.5659 119.1890 61.0185 39.1837 176.3846 60 I 2.8248 7.8687 116.9532 64.0383 37.6968 177.2018 61 A 3.8124 7.8352 120.5379 55.4381 18.0667 179.7056 62 V 3.3474 7.4925 116.3588 65.9829 31.3381 177.3733 63 H 3.8439 8.5687 117.9184 59.4133 29.8992 176.7548 64 E 3.8548 8.1238 120.1576 59.5641 29.2374 178.6105 65 M 3.5053 7.9716 118.6275 58.7486 32.0375 178.2643 66 L 3.3768 7.6426 118.8378 57.6978 41.7467 178.7825 67 D 4.1318 7.5697 117.7073 57.3408 40.8054 178.7054 68 G 3.4719 7.4906 105.4674 47.7061 0.0000 175.5231 69 F 3.9970 7.1107 120.3138 60.1354 38.8793 177.3609 70 R 3.9079 8.0141 118.4651 60.0478 29.7178 178.3967 71 T 3.8596 7.7339 114.4021 66.7049 68.4889 176.4115 72 A 4.1441 7.9557 122.4959 55.2466 18.3607 179.3103 73 L 4.1886 8.8061 117.7413 58.2762 41.7824 179.4966 74 I 3.7363 8.0176 119.3715 64.8416 37.1900 177.6630 75 C 3.9675 8.0825 118.9826 62.9839 31.2617 175.3329 76 H 4.0286 8.2312 117.3141 58.9723 28.2866 177.3093 77 L 3.5390 8.1781 122.1091 58.4727 41.9292 179.0779 78 A 3.9534 8.5236 120.7448 55.3441 18.2056 179.7355 79 T 3.8006 7.8166 114.3410 66.9196 68.4874 176.8323 80 M 3.9006 8.2382 120.5804 58.2736 32.1380 178.2029 81 A 3.9508 7.9923 121.1004 55.5852 18.4108 179.4231 82 E 3.8611 8.5682 116.7781 59.4998 29.3530 179.3326 83 R 3.8109 7.8727 117.3140 59.8174 30.2879 177.5851 84 A 4.0136 8.0107 119.9513 55.6092 18.4353 179.4146 85 V 3.8776 7.7004 116.5706 65.7714 31.2879 178.5417 86 Q 4.0671 8.0484 116.7329 58.3524 28.5115 177.4767 87 L 4.4541 7.8775 118.7013 54.5462 42.1102 177.9172 88 G 3.8963 8.1504 109.4522 45.1777 0.0000 174.6435 89 G 3.9156 7.5922 108.5159 44.8163 0.0000 172.2173 90 V 4.3024 7.9419 117.7702 60.3984 33.2605 175.1006 91 A 4.0203 8.6892 131.0382 52.1723 18.7003 176.1360 92 L 4.7198 9.5904 124.5187 53.1857 42.9851 177.6517 93 G 4.2253 8.3399 115.6185 43.7946 0.0000 172.7791 94 T 4.4335 7.8976 109.7512 60.2631 71.7932 174.1969 95 T 3.8904 8.4972 119.9336 67.2201 68.4802 176.0221 96 Q 4.0231 8.2129 118.5015 59.8564 28.1657 178.9950 97 V 3.5807 7.5569 120.3406 65.7548 31.4518 177.6466 98 I 3.7271 8.1399 119.7155 64.0931 36.7189 177.5519 99 N 4.1844 8.9738 119.6429 57.6152 38.7984 176.3061 100 S 4.3020 8.0887 114.3894 60.2444 62.6240 174.9084 101 K 4.4438 8.3807 121.2117 55.5239 32.3927 177.0515 102 T 3.8680 7.6398 116.1459 61.8948 67.3419 171.7015 103 P 4.6764 0.0000 0.0000 62.7608 31.4783 175.3292 104 L 4.7038 7.3098 118.5558 52.6632 43.6127 176.5496 105 K 4.0336 8.5620 124.0938 56.2334 32.7787 176.3027 106 S 4.2880 8.3944 118.2948 58.4342 63.0856 172.9747 107 Y 4.2529 8.4493 127.0278 55.8188 39.4750 172.5577 108 P 4.2191 0.0000 0.0000 63.4984 31.3782 175.5425 109 L 4.7260 8.4796 123.5826 54.7183 41.6859 177.1617 110 D 4.7978 7.7999 116.9401 52.4582 40.7928 175.6949 111 I 4.0449 7.4657 112.9390 61.3285 38.7777 174.8190 112 H 5.0760 8.5118 114.4890 56.5071 34.0988 173.9007 113 N 4.8042 8.2984 117.3372 54.1154 40.1193 174.5572 114 V 3.5278 8.6596 126.7217 66.7515 31.5069 177.9497 115 Q 3.9896 8.4629 116.7677 59.3953 28.7932 179.4001 116 D 4.3838 8.3762 118.8808 57.8859 40.5649 178.5813 117 H 4.4491 7.9832 117.0558 58.3671 28.0658 177.4724 118 L 4.0690 8.1246 120.8308 58.0593 41.5559 179.6028 119 K 4.0101 8.3030 118.0686 59.8014 32.1316 179.0016 120 E 4.0260 8.5881 118.8003 59.5276 29.4300 179.6153 121 L 4.1877 9.3621 119.3925 57.8743 41.6920 179.0461 122 A 4.0401 9.3510 121.0458 55.6851 18.1393 179.2483 123 D 4.3527 8.2682 116.8092 57.7803 40.9674 179.2039 124 R 3.9556 8.0346 117.7805 59.6191 29.8391 178.8205 125 Y 3.6718 8.9087 116.4875 60.8522 37.8227 178.3204 126 A 4.2736 8.4508 122.0235 55.3410 18.4574 179.4944 127 I 3.6152 7.9515 118.3107 64.7575 37.2697 178.8802 128 V 3.4646 7.6933 118.5019 65.7999 31.3101 177.7181 129 A 3.9294 8.9263 121.5117 55.3147 18.2883 179.4875 130 N 4.2452 8.5081 115.1758 56.3722 38.6942 177.0547 131 D 4.3368 8.1507 119.6810 57.4595 41.2018 178.7768 132 V 3.8950 7.7814 120.8294 64.4136 31.1545 178.0855 133 R 3.8540 7.6066 117.9832 58.9776 29.9094 178.4564 134 K 4.0815 7.9746 117.7415 59.4255 32.2688 178.9753 135 A 3.5061 8.3858 121.3930 55.5312 17.8600 179.6356 136 I 3.7967 7.4098 117.6792 64.2368 37.0879 178.6474 137 G 3.6701 8.8033 107.2743 47.8970 0.0000 175.6231 138 E 4.3096 8.2077 119.7462 57.0287 29.6496 176.8874 139 A 4.0572 7.3202 120.7661 52.2708 17.8236 177.5931 140 K 4.0393 8.5827 121.5634 60.2819 32.6318 178.5476 141 D 4.4448 7.9191 118.8714 53.7050 42.1019 175.6531 142 D 4.3690 8.8274 127.4588 57.8634 40.9400 178.4026 143 D 4.3530 8.2601 118.3029 58.1178 41.0301 179.0568 144 T 3.8938 7.7376 114.1788 66.5362 68.3909 176.4908 145 A 3.9141 8.1367 122.7995 55.1472 18.5030 178.7850 146 D 4.2330 8.3379 116.8458 57.8522 41.2533 178.4529 147 I 3.6651 8.0612 120.3360 64.7490 36.9380 178.3981 148 L 3.9517 7.7836 118.9657 57.9311 41.3930 179.4940 149 T 3.9274 8.3254 115.8957 66.6284 68.4993 176.4323 150 A 3.9198 8.4899 122.6244 54.9843 18.4200 179.4534 151 A 3.4324 7.9283 119.1996 55.2059 18.5144 179.3219 152 S 3.9245 8.9034 112.6326 61.8450 62.4678 176.2882 153 R 3.7580 7.9930 121.0738 59.7811 29.7292 177.9371 154 D 3.7648 7.4223 116.6896 57.0824 40.7416 178.3286 155 L 3.6168 7.2542 119.3715 58.0843 41.6710 179.4793 156 D 4.3132 8.2845 118.5953 57.3727 40.7195 178.8104 157 K 4.0785 7.6572 119.4478 59.5136 32.0992 178.7688 158 F 3.7499 8.3393 118.2707 60.2935 38.7780 176.9749 159 L 3.8840 8.1564 120.2821 58.1695 41.8103 178.5916 160 W 4.5017 8.3686 127.8962 60.9776 30.3764 177.8721 161 F 4.0679 8.2238 116.1640 60.4585 38.6796 177.5891 162 I 3.8652 8.2824 119.7887 64.4352 36.8975 178.0114 163 E 3.9605 8.7325 119.5743 59.8950 29.2377 179.6814 164 S 4.0296 8.2797 113.8918 61.2291 63.0215 175.7459 165 N 4.7061 7.6119 116.7392 52.3637 38.9276 174.9414 166 I 4.2133 7.8120 123.4685 60.4473 37.7764 175.7605 167 E 4.1802 9.0882 123.2134 56.5014 29.6309 176.3048 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 12 T 8.17 4.26 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 13 N 8.72 4.24 0.00 2.79 2.71 0.00 0.00 6.69 6.89 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 14 L 8.98 4.74 0.00 1.68 1.56 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.09 4.63 0.00 1.59 1.60 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 8.45 4.54 0.00 2.95 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 17 T 7.31 3.94 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 1.09 0.00 0.00 18 R 8.04 3.95 0.00 1.74 1.92 0.00 3.23 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.43 0.00 19 N 7.52 4.35 0.00 2.61 2.70 0.00 0.00 7.13 8.65 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 20 D 8.45 4.70 0.00 2.83 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 21 V 6.84 4.31 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 0.72 0.00 0.00 0.97 0.00 0.00 22 S 8.62 4.04 0.00 4.04 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 23 D 8.90 4.20 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 24 S 8.10 4.10 0.00 3.88 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 25 E 8.51 3.95 0.00 2.06 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 2.32 2.34 0.00 26 K 8.80 3.81 0.00 1.96 1.94 0.00 1.68 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.45 1.82 7.81 27 K 8.55 3.85 0.00 2.07 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.22 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.56 7.81 28 A 8.22 4.00 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 29 T 9.19 3.77 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 1.19 0.00 0.00 30 V 7.97 3.77 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 1.02 0.00 0.00 1.00 0.00 0.00 31 E 7.76 3.91 0.00 2.28 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 2.64 2.45 0.00 32 L 7.56 3.92 0.00 1.69 1.84 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.38 3.90 0.00 1.86 1.64 0.86 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.44 4.25 0.00 3.04 2.89 0.00 0.00 6.79 7.22 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 35 R 7.88 3.88 0.00 2.11 2.14 0.00 3.11 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 36 Q 7.78 4.09 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.49 0.00 0.00 0.00 0.00 0.00 2.60 2.47 0.00 37 V 7.80 3.63 2.23 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 1.00 0.00 0.00 0.92 0.00 0.00 38 I 7.56 3.66 2.03 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 1.69 0.93 0.93 0.00 0.00 39 Q 8.04 3.99 0.00 2.21 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.82 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 40 F 9.18 3.80 0.00 3.27 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 41 I 8.29 3.73 2.06 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 1.45 1.47 0.94 0.00 0.00 42 D 8.19 4.28 0.00 2.90 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 43 L 7.98 3.71 0.00 1.52 1.48 0.35 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.11 4.08 0.00 4.08 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 45 L 7.77 3.94 0.00 1.89 1.78 0.99 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.91 3.47 1.95 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 1.71 0.95 0.62 0.00 0.00 47 T 7.71 3.77 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 1.30 0.00 0.00 48 K 7.64 3.31 0.00 1.42 0.74 0.00 0.65 0.00 0.00 0.70 0.00 0.00 2.63 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.06 1.22 7.81 49 Q 7.88 4.12 0.00 2.25 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.54 2.63 0.00 50 A 7.67 3.89 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 51 H 8.19 3.94 0.00 2.84 3.03 0.00 5.96 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 52 W 8.08 4.63 0.00 3.53 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 53 N 8.05 5.07 0.00 2.86 2.95 0.00 0.00 6.90 8.31 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 54 M 7.60 5.14 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.98 0.00 55 R 9.14 4.47 0.00 1.82 1.70 0.00 3.02 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.46 0.00 56 G 8.38 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 57 A 8.66 4.13 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 58 N 8.98 4.30 0.00 2.97 2.86 0.00 0.00 6.79 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 59 F 7.57 4.09 0.00 3.30 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 I 7.87 2.82 1.92 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.21 0.87 0.00 0.00 61 A 7.84 3.81 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 62 V 7.49 3.35 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 0.98 0.00 0.00 0.88 0.00 0.00 63 H 8.57 3.84 0.00 2.11 2.84 0.00 5.81 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 64 E 8.12 3.85 0.00 1.84 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.41 0.00 65 M 7.97 3.51 0.00 1.79 1.82 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.53 0.00 66 L 7.64 3.38 0.00 1.79 1.45 0.70 0.97 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 67 D 7.57 4.13 0.00 2.44 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 68 G 7.49 3.47 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 0.00 0.00 0.00 0.00 0.00 0.00 69 F 7.11 4.00 0.00 2.97 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 8.01 3.91 0.00 1.75 2.01 0.00 3.02 0.00 0.00 3.00 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 71 T 7.73 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 1.23 0.00 0.00 72 A 7.96 4.14 1.75 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 73 L 8.81 4.19 0.00 2.14 1.87 1.13 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 74 I 8.02 3.74 2.04 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 1.81 0.84 0.94 0.00 0.00 75 C 8.08 3.97 0.00 3.11 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 76 H 8.23 4.03 0.00 3.39 3.15 0.00 5.71 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 77 L 8.18 3.54 0.00 1.91 2.00 1.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.52 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 79 T 7.82 3.80 4.33 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 1.17 0.00 0.00 80 M 8.24 3.90 0.00 1.90 2.07 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.38 0.00 81 A 7.99 3.95 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 82 E 8.57 3.86 0.00 2.08 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 2.31 2.57 0.00 83 R 7.87 3.81 0.00 1.84 2.14 0.00 3.30 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 84 A 8.01 4.01 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 85 V 7.70 3.88 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 1.29 0.00 0.00 0.99 0.00 0.00 86 Q 8.05 4.07 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.11 0.00 0.00 0.00 0.00 0.00 2.36 2.59 0.00 87 L 7.88 4.45 0.00 1.70 1.66 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.15 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 0.00 0.00 0.00 89 G 7.59 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 90 V 7.94 4.30 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 0.85 0.00 0.00 0.93 0.00 0.00 91 A 8.69 4.02 1.24 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 0.00 0.00 0.00 92 L 9.59 4.72 0.00 1.66 1.61 0.92 0.59 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 93 G 8.34 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 0.00 0.00 0.00 0.00 94 T 7.90 4.43 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 95 T 8.50 3.89 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 1.24 0.00 0.00 96 Q 8.21 4.02 0.00 2.25 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.86 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 97 V 7.56 3.58 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 1.12 0.00 0.00 0.94 0.00 0.00 98 I 8.14 3.73 2.04 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 1.67 0.75 0.93 0.00 0.00 99 N 8.97 4.18 0.00 2.69 3.00 0.00 0.00 7.34 8.26 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 0.00 100 S 8.09 4.30 0.00 3.93 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 0.00 101 K 8.38 4.44 0.00 1.77 1.83 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.46 1.44 7.81 102 T 7.64 3.87 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 1.29 0.00 0.00 103 P 0.00 4.68 0.00 2.22 2.12 0.00 3.78 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 1.97 1.99 0.00 104 L 7.31 4.70 0.00 1.77 1.63 0.89 1.23 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 0.00 105 K 8.56 4.03 0.00 1.73 1.75 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.45 7.81 106 S 8.39 4.29 0.00 3.91 3.78 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 0.00 107 Y 8.45 4.25 0.00 3.04 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 0.00 108 P 0.00 4.22 0.00 1.64 1.82 0.00 2.20 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.88 0.00 109 L 8.48 4.73 0.00 1.65 1.73 1.07 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 110 D 7.80 4.80 0.00 2.70 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 0.00 111 I 7.47 4.04 1.68 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.41 0.80 0.00 0.00 112 H 8.51 5.08 0.00 3.19 3.33 0.00 5.63 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.30 4.80 0.00 2.78 2.89 0.00 0.00 6.74 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 0.00 114 V 8.66 3.53 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 1.09 0.00 0.00 1.15 0.00 0.00 115 Q 8.46 3.99 0.00 2.33 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.53 0.00 0.00 0.00 0.00 0.00 2.41 2.60 0.00 116 D 8.38 4.38 0.00 2.94 2.66 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 0.00 117 H 7.98 4.45 0.00 3.50 3.48 0.00 5.65 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 0.00 118 L 8.12 4.07 0.00 1.97 1.77 1.01 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 119 K 8.30 4.01 0.00 2.02 1.89 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.52 7.81 120 E 8.59 4.03 0.00 2.23 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 2.39 2.20 0.00 121 L 9.36 4.19 0.00 1.81 1.76 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 122 A 9.35 4.04 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 0.00 0.00 0.00 0.00 0.00 123 D 8.27 4.35 0.00 3.01 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 0.00 124 R 8.03 3.96 0.00 1.91 2.03 0.00 3.48 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 125 Y 8.91 3.67 0.00 3.13 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 0.00 126 A 8.45 4.27 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 0.00 0.00 0.00 0.00 0.00 127 I 7.95 3.62 1.99 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 1.67 0.91 0.90 0.00 0.00 128 V 7.69 3.46 1.84 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 0.52 0.00 0.00 0.76 0.00 0.00 129 A 8.93 3.93 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 0.00 130 N 8.51 4.25 0.00 2.86 2.87 0.00 0.00 6.68 7.62 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 0.00 131 D 8.15 4.34 0.00 2.83 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 V 7.78 3.90 2.23 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 1.10 0.00 0.00 1.01 0.00 0.00 133 R 7.61 3.85 0.00 1.90 2.17 0.00 3.23 0.00 0.00 3.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 134 K 7.97 4.08 0.00 2.12 1.83 0.00 1.63 0.00 0.00 1.88 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.49 7.81 135 A 8.39 3.51 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 0.00 136 I 7.41 3.80 1.94 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.87 0.89 0.00 0.00 137 G 8.80 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 0.00 0.00 0.00 138 E 8.21 4.31 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 139 A 7.32 4.06 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 0.00 140 K 8.58 4.04 0.00 1.75 2.04 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.55 7.81 141 D 7.92 4.44 0.00 2.72 2.53 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 0.00 142 D 8.83 4.37 0.00 2.71 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 0.00 143 D 8.26 4.35 0.00 2.86 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 0.00 144 T 7.74 3.89 4.37 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 1.18 0.00 0.00 145 A 8.14 3.91 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 0.00 146 D 8.34 4.23 0.00 2.75 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 0.00 147 I 8.06 3.67 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 1.49 0.80 0.84 0.00 0.00 148 L 7.78 3.95 0.00 1.87 1.68 0.93 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.33 3.93 4.36 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 1.18 0.00 0.00 150 A 8.49 3.92 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 0.00 151 A 7.93 3.43 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 0.00 152 S 8.90 3.92 0.00 3.74 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 0.00 153 R 7.99 3.76 0.00 2.06 1.96 0.00 3.10 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 1.58 1.64 0.00 154 D 7.42 3.76 0.00 2.59 1.56 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 0.00 155 L 7.25 3.62 0.00 1.68 1.62 0.65 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 156 D 8.28 4.31 0.00 2.72 2.66 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 0.00 157 K 7.66 4.08 0.00 1.79 1.77 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.72 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.10 1.42 7.81 158 F 8.34 3.75 0.00 2.89 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 0.00 0.00 0.00 159 L 8.16 3.88 0.00 1.92 1.98 1.04 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 160 W 8.37 4.50 0.00 3.44 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 0.00 161 F 8.22 4.07 0.00 3.18 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 I 8.28 3.87 1.94 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.19 0.93 0.00 0.00 163 E 8.73 3.96 0.00 2.29 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 0.00 2.40 2.56 0.00 164 S 8.28 4.03 0.00 3.63 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 N 7.61 4.71 0.00 2.80 2.79 0.00 0.00 7.01 7.26 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 0.00 166 I 7.81 4.21 1.96 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 1.37 0.79 0.97 0.00 0.00 167 E 9.09 4.18 0.00 2.08 1.92 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 2.49 2.25 0.00