NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3506 8.3049 120.3454 54.3431 33.8018 176.1938 2 L 4.4039 8.0123 117.0946 51.5226 44.4384 175.6530 3 T 4.0734 9.2832 113.4262 61.3369 71.5665 174.8369 4 A 3.9611 8.6127 124.1997 55.9692 18.4091 180.1529 5 E 3.9736 8.0953 116.1173 59.3570 29.5720 179.2923 6 E 3.9259 8.1008 118.8600 59.1577 29.5085 179.1988 7 K 3.7754 8.3607 118.7754 59.6240 32.1648 178.9863 8 A 4.0214 7.9743 120.4663 55.1886 18.3697 179.5826 9 A 3.9701 7.9051 118.8228 55.3272 18.3998 180.1225 10 V 3.6029 7.9104 116.8382 66.2396 31.4109 178.3275 11 T 3.9556 8.4422 115.7160 66.7397 68.1528 176.2380 12 A 4.0796 7.8289 121.1009 55.3933 18.7170 179.1948 13 F 4.2658 8.4039 118.5921 61.1400 39.5531 177.2922 14 W 4.2970 9.1590 128.5486 60.2016 30.2298 177.8702 15 G 3.7806 7.7501 105.3367 47.6307 0.0000 174.9957 16 K 4.1612 7.4146 118.4503 56.3310 32.5186 177.4624 17 V 3.4821 6.2482 120.1010 62.1841 31.4829 175.5467 18 K 4.0399 8.5140 126.9149 56.1118 31.6172 177.9847 19 V 3.4951 8.3550 118.8277 64.2563 31.0815 177.1647 20 D 4.5331 7.0982 119.8031 55.5768 40.5943 178.1499 21 E 3.9938 7.9245 118.2943 59.9505 29.9219 179.6987 22 V 3.6154 7.8008 117.5060 65.9177 31.4589 178.0407 23 G 3.7584 7.8190 104.1177 47.9103 0.0000 175.9474 24 G 3.6141 8.0336 108.0661 47.2576 0.0000 175.2933 25 E 3.9027 8.4819 121.6096 58.9050 29.6045 178.7661 26 A 3.9535 8.1592 120.9222 55.1220 18.5043 179.3373 27 L 4.0008 8.3260 119.3460 58.2618 42.1661 179.4001 28 G 3.5699 8.1937 105.6398 47.9632 0.0000 175.9153 29 R 3.9107 8.4201 121.1098 58.6039 30.0332 178.7852 30 L 4.0992 8.1875 120.4553 58.4339 41.6579 179.2239 31 L 4.0779 7.8286 120.0723 56.9119 41.2306 179.7582 32 V 3.5445 7.4648 117.6692 65.9352 31.6680 178.0664 33 V 3.5540 7.7455 117.0161 64.3016 32.8317 175.5788 34 Y 4.2015 7.2736 115.8837 54.3335 37.8841 174.1366 35 P 4.5059 0.0000 0.0000 64.0871 31.8271 177.7730 36 W 4.4072 8.0943 115.4433 59.3368 27.7515 178.0479 37 T 4.3452 7.4966 110.6689 64.4400 68.2092 176.3657 38 Q 4.1978 8.0589 121.2296 58.6687 28.3972 178.3932 39 R 3.8417 7.7339 119.3004 59.0456 30.0634 177.6740 40 F 4.3281 7.7807 115.0147 57.8574 39.5871 175.5598 41 F 4.6189 8.0057 118.7991 56.4129 39.7885 177.0789 42 E 4.0225 8.5289 120.8307 59.3562 29.4930 177.7774 43 S 4.5193 8.1288 111.9075 59.0995 63.5877 174.8793 44 F 4.5122 8.5258 119.6456 57.7893 39.6250 177.5811 45 G 3.8589 7.6204 108.0629 45.6398 0.0000 174.3891 46 D 4.4902 8.7135 125.0921 54.4268 41.0549 175.9006 47 L 4.8436 8.4115 126.4032 54.5394 42.6297 177.9482 48 S 4.3679 8.5881 115.9784 60.1564 63.5714 174.4458 49 T 4.7253 7.4921 110.3551 58.7420 73.0443 174.3233 50 A 3.9411 8.4395 123.0354 55.5272 18.4713 179.7682 51 D 4.2495 8.0623 116.5773 57.3675 40.7494 178.6312 52 A 3.9724 7.9706 120.2940 55.1035 18.8154 179.4913 53 V 3.6892 7.9632 116.8006 66.6949 31.4456 178.3027 54 M 4.1449 8.0879 116.7860 57.5505 31.8219 177.4984 55 N 4.9109 7.6314 113.6829 51.8476 39.3818 174.8910 56 N 4.4597 7.5900 121.0168 52.6833 39.8886 173.6936 57 P 4.2009 0.0000 0.0000 65.9224 31.2639 178.6347 58 K 3.8199 8.3494 118.4688 58.9016 31.8315 179.5380 59 V 3.7112 7.8111 118.1848 65.8010 31.6018 177.7398 60 K 3.8542 8.3088 119.4409 59.5489 31.7515 178.5559 61 A 3.9663 8.4654 121.2590 55.5193 18.3122 179.1456 62 H 4.3206 8.7025 117.2785 59.2480 29.8878 177.5940 63 G 3.7433 8.7652 108.1264 47.6793 0.0000 175.3978 64 K 3.9460 8.1005 121.8797 59.2993 32.2053 178.9501 65 K 4.0115 7.7387 118.5945 59.4449 31.9109 179.7079 66 V 3.7364 7.8591 119.4220 64.8413 31.3680 178.1537 67 L 4.3365 8.4128 121.4786 58.0839 41.9906 178.6364 68 D 4.6733 8.7682 119.2964 57.3696 40.6353 178.8749 69 S 4.0984 8.3371 113.7859 61.2995 62.3810 176.0512 70 F 4.1901 8.7266 120.8418 60.9685 38.5174 177.6996 71 S 4.3424 8.8365 113.6419 61.7610 62.9596 176.2186 72 N 4.5609 8.5320 119.7060 56.7597 38.7371 177.0936 73 G 3.8607 8.2869 107.2020 48.2967 0.0000 175.3413 74 M 3.9493 8.0685 119.8094 57.4819 31.9455 177.9895 75 K 4.3101 7.6958 116.5236 56.7692 33.2813 176.1223 76 H 5.0347 8.2027 117.4634 55.1124 29.7320 175.5561 77 L 3.9641 8.0843 120.4047 57.7335 41.8487 178.3823 78 D 4.6176 7.9692 115.7158 55.0605 41.7610 176.0065 79 D 4.7828 8.1892 119.5194 52.0456 41.7043 175.9801 80 L 4.1442 7.9116 122.9455 57.8037 41.9406 179.3267 81 K 3.9880 8.1101 117.3945 59.6763 32.2134 179.0757 82 G 3.6745 8.1463 105.1980 48.0374 0.0000 175.6400 83 T 3.6951 7.4153 117.2763 65.6837 68.5633 175.5987 84 F 4.5655 8.1945 118.4270 57.9037 40.0660 177.9815 85 A 4.0205 7.7168 121.5631 55.2286 18.1307 180.0153 86 A 4.0103 7.7604 117.8224 54.5587 18.7117 179.8245 87 L 3.9945 7.7897 117.6010 57.9565 41.8744 179.2373 88 S 4.2795 8.5625 115.0852 60.6627 62.2879 176.0603 89 E 3.9020 8.2042 120.5619 59.1143 29.4428 178.6378 90 L 3.8439 7.8254 121.2726 58.5478 42.2316 178.8857 91 H 4.2248 8.8992 116.2521 58.4454 28.4361 177.1107 92 C 3.9285 7.9498 118.1672 61.8828 28.3248 175.7444 93 D 4.4653 7.8684 119.1402 55.9767 41.0819 177.7906 94 K 4.3016 7.9359 116.8296 57.7705 33.3108 177.4021 95 L 4.3265 7.7919 116.2911 54.8190 42.3504 176.2772 96 H 4.4358 7.3873 112.6490 55.4963 26.7442 175.2813 97 V 3.6623 7.8149 118.2749 62.0772 32.2385 175.0122 98 D 4.2685 8.6469 126.8336 53.6054 41.9193 175.2522 99 P 3.0638 0.0000 0.0000 64.5030 32.0118 177.9659 100 E 3.8932 8.3703 119.3475 59.5012 29.2823 178.5530 101 N 4.4464 8.2382 116.2930 55.7971 38.5202 177.3754 102 F 4.5177 7.4257 119.5526 60.5753 38.8979 177.7358 103 K 4.0998 8.0935 117.6565 59.3847 31.8713 179.2875 104 L 3.9118 7.7844 119.1801 57.6805 41.4680 179.3288 105 L 4.1544 8.3014 120.5349 57.9697 42.0646 178.9451 106 G 3.8949 8.2885 105.8024 48.3111 0.0000 175.3797 107 N 4.4631 8.4935 119.3643 55.7030 38.4946 177.6501 108 V 3.6414 8.2762 120.1813 65.9932 31.5862 177.6718 109 L 3.8741 8.2943 120.3686 58.2471 41.8586 179.1077 110 V 3.5959 7.7567 117.9648 66.0763 31.4047 178.1051 111 V 3.6445 8.0102 118.0095 66.0354 31.3550 178.2030 112 V 3.5283 8.1993 118.4241 65.8569 31.2905 177.9351 113 L 3.9198 8.1754 118.9956 57.6020 41.2644 179.4023 114 A 4.0331 7.7622 120.5536 55.2628 18.1791 179.6768 115 R 3.8077 7.9552 116.1153 59.5910 30.2014 178.0417 116 N 4.3086 8.0595 115.1272 54.7099 39.0465 176.3769 117 F 4.6798 8.4741 117.0850 55.1822 40.6492 177.3551 118 G 3.9760 8.9602 109.1750 46.2245 0.0000 177.8422 119 K 4.0532 8.8895 123.7171 58.9364 32.5367 177.6937 120 E 4.1330 8.1059 119.7908 58.5872 29.9391 177.0307 121 F 4.4546 8.1090 123.2293 56.7486 37.8302 175.4572 122 T 4.0792 7.3002 115.6173 60.2522 71.1078 173.3104 123 P 4.0762 0.0000 0.0000 65.9103 31.2727 179.1191 124 V 3.4725 7.5641 116.2403 65.7982 31.5453 177.6481 125 L 3.8137 7.6649 120.0715 58.1564 41.8148 178.7111 126 Q 3.3800 7.7889 119.5941 58.8447 28.7694 177.8719 127 A 3.9554 8.0694 122.0085 55.2813 18.4467 179.2862 128 D 4.1840 7.9845 117.1772 57.7291 40.8720 179.2342 129 F 4.1052 8.2720 117.9646 60.4139 38.8351 177.7908 130 Q 4.1047 8.4751 118.3928 58.8209 28.4094 178.8682 131 K 3.9625 7.8875 119.3703 59.3080 32.0161 179.5007 132 V 3.5288 7.6186 118.1329 66.3106 31.5204 178.6291 133 V 3.8691 8.3279 112.2227 64.2436 31.2521 178.5515 134 A 4.1520 8.2634 120.9941 54.8621 18.1608 179.6954 135 G 3.6089 8.4229 104.7544 48.0534 0.0000 175.9637 136 V 2.9458 8.0343 121.2781 65.1895 31.4812 177.7535 137 A 3.8808 8.2387 120.8627 55.3853 18.0339 179.1732 138 N 4.3307 8.2757 114.1958 56.6704 39.1376 176.6674 139 A 4.1072 8.0884 122.4229 55.1424 18.0154 179.6571 140 L 3.6606 7.8362 117.5245 57.3726 41.4981 178.8117 141 A 4.6624 7.9765 118.9297 53.2505 18.7282 178.4647 142 H 3.9754 7.9445 117.7525 59.3357 29.6456 177.0874 143 R 3.9593 7.6142 117.7812 58.4428 29.6706 177.7901 144 Y 4.5277 7.9858 116.6806 60.0926 37.8664 175.2332 145 H 4.5813 7.9795 121.2486 56.0408 28.8812 174.9840 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 M 8.30 4.35 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.59 0.00 2 L 8.01 4.40 0.00 1.67 1.52 0.84 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 3 T 9.28 4.07 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 4 A 8.61 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 5 E 8.10 3.97 0.00 1.98 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 2.39 2.33 0.00 6 E 8.10 3.93 0.00 2.19 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 7 K 8.36 3.78 0.00 1.93 1.84 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.67 7.81 8 A 7.97 4.02 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 9 A 7.91 3.97 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 10 V 7.91 3.60 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 0.83 0.00 0.00 0.15 0.00 0.00 11 T 8.44 3.96 4.42 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 1.28 0.00 0.00 12 A 7.83 4.08 1.45 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 0.00 0.00 13 F 8.40 4.27 0.00 3.29 3.43 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 14 W 9.16 4.30 0.00 3.85 3.34 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 15 G 7.75 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 0.00 0.00 0.00 16 K 7.41 4.16 0.00 1.16 1.78 0.00 1.44 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.22 7.81 17 V 6.25 3.48 0.96 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 0.13 0.00 0.00 0.02 0.00 0.00 18 K 8.51 4.04 0.00 1.73 1.83 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.33 7.81 19 V 8.35 3.50 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 0.65 0.00 0.00 0.91 0.00 0.00 20 D 7.10 4.53 0.00 2.72 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.92 3.99 0.00 1.97 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 2.34 2.40 0.00 22 V 7.80 3.62 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 1.05 0.00 0.00 0.87 0.00 0.00 23 G 7.82 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.03 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 25 E 8.48 3.90 0.00 2.00 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 2.27 2.29 0.00 26 A 8.16 3.95 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 27 L 8.33 4.00 0.00 1.84 1.68 0.64 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.19 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 R 8.42 3.91 0.00 2.00 1.96 0.00 3.12 0.00 0.00 3.07 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 30 L 8.19 4.10 0.00 1.92 1.87 1.02 0.97 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 31 L 7.83 4.08 0.00 1.81 1.65 0.68 0.68 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 32 V 7.46 3.54 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 0.72 0.00 0.00 0.94 0.00 0.00 33 V 7.75 3.55 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 -0.01 0.00 0.00 0.74 0.00 0.00 34 Y 7.27 4.20 0.00 2.57 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 35 P 0.00 4.51 0.00 2.23 2.12 0.00 3.93 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 36 W 8.09 4.41 0.00 3.60 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 37 T 7.50 4.35 4.42 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 1.01 0.00 0.00 38 Q 8.06 4.20 0.00 2.32 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 39 R 7.73 3.84 0.00 1.75 1.57 0.00 3.11 0.00 0.00 2.88 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.50 0.00 40 F 7.78 4.33 0.00 2.72 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 41 F 8.01 4.62 0.00 2.84 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 0.00 0.00 0.00 0.00 42 E 8.53 4.02 0.00 2.10 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 2.29 2.24 0.00 43 S 8.13 4.52 0.00 4.16 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 0.00 44 F 8.53 4.51 0.00 3.22 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 7.62 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 46 D 8.71 4.49 0.00 2.65 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 47 L 8.41 4.84 0.00 1.67 1.63 1.05 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.59 4.37 0.00 4.00 4.01 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 49 T 7.49 4.73 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 50 A 8.44 3.94 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 51 D 8.06 4.25 0.00 2.69 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.97 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 53 V 7.96 3.69 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 1.01 0.00 0.00 0.98 0.00 0.00 54 M 8.09 4.14 0.00 2.00 2.10 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 2.61 2.92 0.00 55 N 7.63 4.91 0.00 2.85 2.82 0.00 0.00 6.97 7.85 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 56 N 7.59 4.46 0.00 3.05 2.83 0.00 0.00 6.92 7.13 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 57 P 0.00 4.20 0.00 2.25 2.26 0.00 3.72 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 2.02 2.03 0.00 58 K 8.35 3.82 0.00 1.70 0.74 0.00 1.65 0.00 0.00 1.10 0.00 0.00 2.78 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.09 1.23 7.81 59 V 7.81 3.71 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 0.92 0.00 0.00 1.03 0.00 0.00 60 K 8.31 3.85 0.00 1.98 1.92 0.00 1.56 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.50 7.81 61 A 8.47 3.97 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 62 H 8.70 4.32 0.00 3.62 3.59 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 63 G 8.77 3.74 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 0.00 0.00 0.00 64 K 8.10 3.95 0.00 1.88 1.98 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.65 7.81 65 K 7.74 4.01 0.00 1.98 1.86 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.61 7.81 66 V 7.86 3.74 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 1.28 0.00 0.00 67 L 8.41 4.34 0.00 1.91 1.95 1.06 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.77 4.67 0.00 2.98 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 69 S 8.34 4.10 0.00 4.06 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 70 F 8.73 4.19 0.00 3.50 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 71 S 8.84 4.34 0.00 4.27 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 0.00 72 N 8.53 4.56 0.00 2.97 2.88 0.00 0.00 7.06 7.30 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 73 G 8.29 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 74 M 8.07 3.95 0.00 1.70 2.09 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.40 0.00 75 K 7.70 4.31 0.00 1.77 1.65 0.00 1.62 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.64 7.81 76 H 8.20 5.03 0.00 3.08 3.17 0.00 5.62 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 77 L 8.08 3.96 0.00 1.60 1.70 0.82 1.12 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 78 D 7.97 4.62 0.00 2.64 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 79 D 8.19 4.78 0.00 2.67 2.48 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 0.00 80 L 7.91 4.14 0.00 1.76 1.80 0.91 1.28 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 81 K 8.11 3.99 0.00 1.67 1.78 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.40 7.81 82 G 8.15 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 83 T 7.42 3.70 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 0.69 0.00 0.00 84 F 8.19 4.57 0.00 2.96 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 85 A 7.72 4.02 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 86 A 7.76 4.01 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 87 L 7.79 3.99 0.00 1.89 1.76 0.96 0.83 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 88 S 8.56 4.28 0.00 3.94 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 E 8.20 3.90 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.36 0.00 90 L 7.83 3.84 0.00 1.86 1.95 0.90 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 91 H 8.90 4.22 0.00 3.26 3.60 0.00 5.85 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 C 7.95 3.93 0.00 2.69 1.87 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 93 D 7.87 4.47 0.00 2.75 2.68 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 94 K 7.94 4.30 0.00 1.91 1.81 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.34 1.39 7.81 95 L 7.79 4.33 0.00 1.78 1.73 0.72 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 96 H 7.39 4.44 0.00 3.50 3.51 0.00 5.61 0.00 0.00 0.00 0.00 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 7.81 3.66 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 0.25 0.00 0.00 0.33 0.00 0.00 98 D 8.65 4.27 0.00 2.67 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 0.00 0.00 0.00 99 P 0.00 3.06 0.00 2.18 2.24 0.00 3.35 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.11 0.00 100 E 8.37 3.89 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 2.27 2.39 0.00 101 N 8.24 4.45 0.00 2.69 2.87 0.00 0.00 6.98 8.72 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 0.00 102 F 7.43 4.52 0.00 3.19 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 K 8.09 4.10 0.00 2.01 1.89 0.00 1.82 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.61 7.81 104 L 7.78 3.91 0.00 1.68 1.19 0.65 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.30 4.15 0.00 1.90 1.85 1.04 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 106 G 8.29 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 0.00 107 N 8.49 4.46 0.00 3.06 2.97 0.00 0.00 6.71 7.53 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 0.00 108 V 8.28 3.64 2.30 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 1.16 0.00 0.00 1.24 0.00 0.00 109 L 8.29 3.87 0.00 1.76 1.59 0.18 0.71 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 0.00 110 V 7.76 3.60 2.33 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 1.24 0.00 0.00 1.12 0.00 0.00 111 V 8.01 3.64 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 0.99 0.00 0.00 112 V 8.20 3.53 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.01 0.00 0.00 113 L 8.18 3.92 0.00 0.94 0.56 0.51 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 114 A 7.76 4.03 1.53 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 0.00 115 R 7.96 3.81 0.00 1.90 1.92 0.00 3.22 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 116 N 8.06 4.31 0.00 2.65 2.13 0.00 0.00 6.90 6.73 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 0.00 117 F 8.47 4.68 0.00 3.33 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 0.00 118 G 8.96 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 0.00 0.00 0.00 119 K 8.89 4.05 0.00 1.92 2.01 0.00 1.62 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.50 7.81 120 E 8.11 4.13 0.00 2.19 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 2.68 2.44 0.00 121 F 8.11 4.45 0.00 2.96 3.14 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 0.00 122 T 7.30 4.08 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 123 P 0.00 4.08 0.00 2.12 2.10 0.00 3.54 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 2.08 2.11 0.00 124 V 7.56 3.47 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 0.98 0.00 0.00 0.89 0.00 0.00 125 L 7.66 3.81 0.00 1.62 1.35 0.99 -0.15 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 0.00 126 Q 7.79 3.38 0.00 1.17 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 127 A 8.07 3.96 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 0.00 128 D 7.98 4.18 0.00 2.75 2.43 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 0.00 129 F 8.27 4.11 0.00 3.38 3.27 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 0.00 130 Q 8.48 4.10 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.69 2.58 0.00 131 K 7.89 3.96 0.00 1.87 1.82 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.59 7.81 132 V 7.62 3.53 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 1.10 0.00 0.00 0.71 0.00 0.00 133 V 8.33 3.87 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 0.79 0.00 0.00 1.12 0.00 0.00 134 A 8.26 4.15 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 0.00 135 G 8.42 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 0.00 136 V 8.03 2.95 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 -0.11 0.00 0.00 0.78 0.00 0.00 137 A 8.24 3.88 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 0.00 138 N 8.28 4.33 0.00 2.79 3.05 0.00 0.00 7.27 7.76 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 0.00 139 A 8.09 4.11 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 0.00 140 L 7.84 3.66 0.00 0.96 0.30 0.08 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 141 A 7.98 4.66 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 0.00 0.00 0.00 0.00 0.00 0.00 142 H 7.94 3.98 0.00 3.20 3.40 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 7.61 3.96 0.00 1.71 1.77 0.00 3.33 0.00 0.00 3.33 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.83 0.00 144 Y 7.99 4.53 0.00 3.15 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 0.00 145 H 7.98 4.58 0.00 3.23 3.19 0.00 5.69 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