NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.1460 8.0549 114.0572 60.8807 33.0380 175.0327 2 L 3.9358 8.2436 123.5462 52.3642 42.2105 176.2997 3 S 4.4247 9.2532 118.7589 58.0218 65.9374 174.9225 4 E 4.2177 8.8439 122.6625 59.6188 29.5063 179.1826 5 G 3.6674 8.0959 105.2543 47.7219 0.0000 175.4564 6 E 3.9647 8.3117 120.9823 59.0765 29.3760 179.4557 7 W 4.2974 8.4025 119.1947 59.5688 29.0132 178.4268 8 Q 4.0764 8.2710 119.9427 59.2157 28.6388 178.1973 9 L 4.0905 7.9578 119.7633 57.6232 41.5571 179.7838 10 V 3.7511 7.9095 118.2823 66.1792 31.6552 178.0832 11 L 4.3364 8.4516 118.2919 57.2699 41.2671 178.9375 12 H 4.2572 8.5730 119.2818 59.2171 29.8609 177.6539 13 V 3.4527 7.8931 120.6366 64.4252 31.3279 178.1413 14 W 3.6566 8.6025 128.9237 60.0000 30.2588 177.7495 15 A 3.9878 7.9510 120.1581 55.0129 18.0336 179.4893 16 K 3.9043 7.3276 116.7146 59.3728 32.0953 179.4854 17 V 2.7567 7.0539 118.5103 65.9027 30.9526 177.6192 18 E 3.9187 7.4646 115.5899 58.0144 29.2982 178.4150 19 A 4.2210 7.4849 120.5856 53.6433 19.9330 177.6856 20 D 4.6635 7.7419 116.4230 52.1707 42.8561 175.5282 21 V 3.4677 7.8830 123.0053 65.5451 31.9565 176.8112 22 A 4.0623 7.9621 120.1942 55.1019 18.4427 179.7351 23 G 3.5758 8.4699 105.7796 47.6428 0.0000 175.7532 24 H 4.1387 8.2386 118.8021 58.4921 28.7081 178.1576 25 G 3.5916 8.4140 107.9395 47.7912 0.0000 175.7640 26 Q 3.8567 8.2758 120.7366 58.8624 28.7840 178.6906 27 D 4.2672 7.8555 119.5040 57.2395 40.7517 178.9959 28 I 3.6339 7.6831 120.2096 64.4676 37.1171 178.5705 29 L 3.4427 7.5826 119.7266 57.4695 41.2024 179.6825 30 I 3.5346 7.5811 119.8515 64.1603 37.0232 178.2881 31 R 3.7796 7.8447 119.4930 59.3546 29.8227 178.1894 32 L 3.9499 7.7955 120.0049 58.3965 41.7906 179.0668 33 F 4.6033 7.9999 117.7513 60.5013 38.5704 177.8948 34 K 4.0633 8.2861 117.8822 59.2729 31.9747 179.2852 35 S 4.2775 8.0344 114.8467 60.2742 64.3967 174.4420 36 H 4.6620 8.1868 118.1656 52.1728 28.9260 172.0541 37 P 4.8241 0.0000 0.0000 64.4684 31.1549 177.5901 38 E 4.1181 8.2572 116.2782 59.3157 29.3805 179.0824 39 T 3.9260 8.3760 111.5086 64.4844 68.9217 176.4286 40 L 3.5760 7.8961 123.1919 57.7832 41.7776 178.6998 41 E 4.1184 7.8056 117.2853 58.8459 29.4309 178.9006 42 K 4.3880 8.0836 117.4489 57.2820 32.6192 177.5173 43 F 4.5260 8.1157 118.9879 55.8316 37.7141 175.7791 44 D 4.4360 8.5262 125.1236 57.3968 40.4392 178.9675 45 R 4.0119 7.8165 117.3987 58.1488 30.2369 177.1918 46 F 5.0099 7.2289 113.1890 56.8950 40.9666 177.0005 47 K 3.8364 8.0297 122.0256 59.6791 31.8586 177.0685 48 H 4.4239 8.1574 111.9411 56.8084 28.9837 175.0449 49 L 4.1854 7.8319 122.1438 54.3174 41.7851 176.4199 50 K 4.3006 9.6708 124.2368 57.4276 33.5001 177.4383 51 T 4.6768 7.4938 107.6757 59.3547 72.7669 174.5455 52 E 3.9094 8.6151 121.5926 59.4078 29.7662 178.7702 53 A 4.0289 7.9752 120.3383 55.2866 18.2484 179.3137 54 E 3.9611 8.0038 116.0989 59.6946 29.6682 179.2414 55 M 4.1806 8.1531 118.7709 58.4045 31.8482 178.9612 56 K 3.9349 8.3369 117.5291 59.2311 32.2482 178.7542 57 A 4.2883 7.6141 119.3560 52.7666 18.7626 177.5073 58 S 4.2202 7.4504 113.7408 58.0027 62.9459 174.5583 59 E 4.0085 8.9113 128.7821 59.1762 29.5500 177.9230 60 D 4.4192 8.1934 117.8263 57.2084 41.3313 177.8331 61 L 3.3879 8.0232 120.7868 57.9663 42.0755 178.6929 62 K 3.7938 7.7424 119.3244 59.4496 32.1294 178.4491 63 K 3.9357 8.3680 119.9911 59.9539 32.1095 178.3357 64 H 4.4710 8.5059 118.5041 58.9640 29.7765 177.3530 65 G 3.5860 8.2462 107.9266 47.7295 0.0000 175.7643 66 V 3.6188 7.8171 120.6441 66.0337 31.6133 178.0950 67 T 3.8901 7.7494 114.9750 66.7867 68.2443 176.7400 68 V 3.6215 7.9266 120.0440 66.0842 31.5552 178.1455 69 L 4.2303 8.1456 118.6842 57.8554 41.4626 179.6445 70 T 3.9754 8.2435 115.8566 66.5079 68.4631 176.6200 71 A 3.9954 7.9820 122.6175 55.0598 18.3666 179.4454 72 L 3.7210 8.1986 119.2124 58.0225 42.1080 179.2377 73 G 3.2655 8.4039 105.8695 47.8198 0.0000 175.4395 74 A 3.9957 7.7976 121.9776 54.6564 18.5742 179.7166 75 I 3.7720 7.3324 117.8799 64.6304 37.2651 178.4657 76 L 3.9437 7.7794 120.0937 57.7897 41.1997 179.4761 77 K 4.0783 7.7828 116.2401 57.8774 32.2364 178.3594 78 K 4.0551 7.7706 118.4403 55.2386 33.1635 176.1521 79 K 2.0000 8.3671 119.0556 56.4923 29.6237 175.8310 80 G 3.7829 7.4675 103.6100 46.1812 0.0000 172.9237 81 H 4.5550 7.8015 119.5527 55.2716 27.7467 174.9639 82 H 5.1666 7.5779 110.6771 54.5179 29.6248 177.0049 83 E 4.0155 8.2672 121.5830 60.2026 29.1344 178.5094 84 A 4.0652 7.9572 120.2508 54.4650 18.2637 178.6262 85 E 4.2180 8.1120 116.3293 58.3290 29.9815 178.2697 86 L 4.2205 8.0554 120.7656 57.3613 42.2994 178.8305 87 K 4.0507 8.1235 119.0688 59.4293 32.5414 177.5073 88 P 4.2623 0.0000 0.0000 65.0488 31.3007 178.2481 89 L 3.9879 7.4609 115.7625 58.2315 42.0032 178.9791 90 A 4.1443 8.0938 120.6646 55.2039 18.3239 179.6152 91 Q 3.8146 8.2024 116.8329 59.1248 28.7437 179.2685 92 S 4.0322 8.1240 115.2749 61.7833 63.0582 176.1847 93 H 4.2420 8.5718 119.4722 57.9003 28.2228 177.7713 94 A 2.9580 7.7060 122.5665 54.6709 18.2427 179.0878 95 T 3.8411 7.1907 105.4061 61.8469 69.6376 175.2367 96 K 4.1898 7.4605 120.4740 58.2700 33.4691 176.7623 97 H 4.3038 7.9705 113.7200 55.8887 29.5199 175.3166 98 K 3.7801 7.6378 117.4878 57.3879 28.8161 175.5807 99 I 4.2820 8.2831 118.6702 58.6628 39.0529 175.0921 100 P 4.4206 0.0000 0.0000 62.2981 32.0746 177.4384 101 I 3.4383 8.4589 122.3636 64.5764 36.8748 178.5843 102 K 3.6992 7.8933 119.7253 59.5934 31.9079 178.2906 103 Y 3.9468 8.0722 117.0876 60.7684 37.7406 178.2569 104 L 4.1217 8.0219 120.2279 57.3791 41.7593 178.9592 105 E 3.9196 7.9117 118.9796 59.4329 29.6520 178.7015 106 F 4.4866 7.6080 117.7001 60.8174 38.9062 177.5919 107 I 3.8704 8.2406 118.2394 63.9129 37.7730 177.9548 108 S 4.1874 8.3127 116.3479 61.8410 62.6868 176.5871 109 E 4.0891 8.3249 120.5677 59.2880 29.1814 179.3068 110 A 4.0542 8.0272 120.9026 55.0794 18.3484 179.7847 111 I 3.6810 8.0474 118.4437 64.7482 37.2701 178.7828 112 I 3.8581 7.9598 120.5984 64.5399 36.8943 178.0936 113 H 4.1620 8.2848 119.2701 59.3406 29.7871 177.6151 114 V 3.6206 7.9282 120.1091 65.8431 31.3368 177.9626 115 L 3.7945 8.1261 119.2584 57.8278 41.0239 178.9784 116 H 4.4146 8.0372 117.3885 59.4436 29.9151 177.2374 117 S 4.1749 7.8279 115.9824 61.3913 62.7380 176.2797 118 R 4.1236 7.7678 118.9528 57.3147 31.4246 176.6384 119 H 4.9144 8.0924 115.8990 53.4039 29.7595 171.9764 120 P 4.1487 0.0000 0.0000 66.2692 31.5802 179.0951 121 G 3.7162 8.1677 108.1908 47.3605 0.0000 173.4855 122 D 4.8646 7.9289 116.4662 54.0464 41.7853 176.2490 123 F 5.0019 8.6606 120.7394 56.4246 39.5246 174.2559 124 G 3.9204 7.5233 109.2744 44.0088 0.0000 171.5745 125 A 3.8875 8.4608 120.7646 55.2616 18.3015 179.6714 126 D 4.2653 7.9475 116.8155 56.1240 39.7229 178.6155 127 A 3.9069 7.7204 121.7931 54.9208 18.4137 179.0128 128 Q 3.2753 7.6942 118.5527 59.0808 28.9888 178.9591 129 G 3.4879 8.2770 106.7631 47.7006 0.0000 175.5475 130 A 3.8653 7.8977 123.3542 55.0213 18.3091 179.4274 131 M 4.0163 8.4125 117.1707 58.6135 32.2456 177.9449 132 N 4.2954 8.4079 117.3931 56.7391 39.2190 176.8515 133 K 3.9727 8.0832 119.6095 59.4986 32.1198 179.1752 134 A 3.8323 7.9920 120.8757 55.2078 18.3489 179.7879 135 L 4.0881 8.2686 117.7239 57.7611 41.5445 179.6043 136 E 4.0194 8.5458 119.1693 59.2359 29.3942 179.0371 137 L 3.9759 8.0894 120.4601 57.9545 42.1779 178.6620 138 F 4.1866 8.2858 120.5966 61.5690 39.2568 177.4031 139 R 3.5511 8.1084 117.5119 58.9116 29.8749 178.9796 140 K 3.8587 8.2368 119.6703 59.6854 32.0187 178.6717 141 D 4.3764 8.1809 119.1400 57.2375 40.6583 178.8065 142 I 3.5381 7.5545 120.1849 64.1830 36.9175 178.2702 143 A 3.6702 8.0877 121.7655 55.0586 18.2288 179.5807 144 A 3.9393 7.8248 118.7760 55.1408 18.3833 180.0720 145 K 4.0299 7.7885 117.1509 59.5648 32.1632 179.0695 146 Y 4.1010 8.4722 117.4526 61.0049 37.9173 178.6754 147 K 3.9406 8.4379 120.5943 59.5527 32.1157 178.0512 148 E 3.9499 7.8481 117.9750 59.5691 29.6319 178.4319 149 L 4.3728 7.8424 115.6728 55.4371 41.8861 177.8227 150 G 3.8494 7.9973 107.1810 45.7871 0.0000 173.6417 151 Y 4.3602 8.2946 114.9156 57.0177 38.3840 174.3721 152 Q 4.1352 7.9596 123.6377 55.2379 28.6694 177.1022 153 G 3.6726 8.5578 110.7192 45.6139 0.0000 169.9511 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 V 8.05 4.15 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 0.92 0.00 0.00 0.97 0.00 0.00 2 L 8.24 3.94 0.00 0.65 0.72 0.48 -0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.25 4.42 0.00 4.02 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 4 E 8.84 4.22 0.00 2.19 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 2.43 2.52 0.00 5 G 8.10 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 6 E 8.31 3.96 0.00 1.96 1.73 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 2.22 2.27 0.00 7 W 8.40 4.30 0.00 3.58 3.20 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 8 Q 8.27 4.08 0.00 2.36 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 9 L 7.96 4.09 0.00 1.95 1.76 0.94 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 10 V 7.91 3.75 2.47 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 1.23 0.00 0.00 0.89 0.00 0.00 11 L 8.45 4.34 0.00 1.96 1.82 0.95 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.57 4.26 0.00 3.45 3.54 0.00 5.78 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.89 3.45 2.25 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 0.97 0.00 0.00 0.74 0.00 0.00 14 W 8.60 3.66 0.00 3.69 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 15 A 7.95 3.99 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 16 K 7.33 3.90 0.00 1.60 1.66 0.00 1.73 0.00 0.00 1.50 0.00 0.00 2.69 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.28 1.35 7.81 17 V 7.05 2.76 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 0.00 0.00 -0.09 0.00 0.00 0.18 0.00 0.00 18 E 7.46 3.92 0.00 2.00 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 2.23 2.11 0.00 19 A 7.48 4.22 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.74 4.66 0.00 2.70 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 21 V 7.88 3.47 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 1.06 0.00 0.00 0.88 0.00 0.00 22 A 7.96 4.06 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 23 G 8.47 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 H 8.24 4.14 0.00 3.35 3.25 0.00 5.82 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 25 G 8.41 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 26 Q 8.28 3.86 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.31 2.47 0.00 27 D 7.86 4.27 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 28 I 7.68 3.63 1.81 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 1.51 0.61 0.88 0.00 0.00 29 L 7.58 3.44 0.00 1.28 0.78 0.71 0.65 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 30 I 7.58 3.53 1.82 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 1.34 0.66 0.86 0.00 0.00 31 R 7.84 3.78 0.00 1.95 2.02 0.00 3.05 0.00 0.00 2.99 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 32 L 7.80 3.95 0.00 1.76 1.46 1.08 1.00 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 33 F 8.00 4.60 0.00 3.09 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 34 K 8.29 4.06 0.00 1.74 1.84 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.69 7.81 35 S 8.03 4.28 0.00 3.84 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 36 H 8.19 4.66 0.00 3.06 2.89 0.00 5.63 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.82 0.00 2.15 2.11 0.00 3.80 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.98 0.00 38 E 8.26 4.12 0.00 2.28 2.28 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 2.26 2.52 0.00 39 T 8.38 3.93 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 40 L 7.90 3.58 0.00 1.38 1.76 0.03 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.81 4.12 0.00 2.19 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 0.00 2.38 2.43 0.00 42 K 8.08 4.39 0.00 1.86 1.65 0.00 1.86 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.72 1.89 7.81 43 F 8.12 4.53 0.00 3.25 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 44 D 8.53 4.44 0.00 2.72 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 45 R 7.82 4.01 0.00 1.07 0.66 0.00 3.03 0.00 0.00 2.96 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.49 0.00 46 F 7.23 5.01 0.00 2.83 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 47 K 8.03 3.84 0.00 1.89 1.91 0.00 2.10 0.00 0.00 1.94 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.44 7.81 48 H 8.16 4.42 0.00 3.32 3.41 0.00 5.57 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.83 4.19 0.00 1.61 1.60 1.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.67 4.30 0.00 1.82 1.85 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.59 1.50 7.81 51 T 7.49 4.68 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 52 E 8.62 3.91 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 53 A 7.98 4.03 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 54 E 8.00 3.96 0.00 2.12 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 2.35 0.00 55 M 8.15 4.18 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.60 0.00 56 K 8.34 3.93 0.00 1.87 1.85 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.42 7.81 57 A 7.61 4.29 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 58 S 7.45 4.22 0.00 3.86 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.91 4.01 0.00 2.14 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 2.40 2.45 0.00 60 D 8.19 4.42 0.00 2.96 2.95 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 61 L 8.02 3.39 0.00 1.47 1.64 -0.01 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.74 3.79 0.00 1.79 1.97 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.43 7.81 63 K 8.37 3.94 0.00 1.98 2.07 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.51 7.81 64 H 8.51 4.47 0.00 3.69 3.46 0.00 5.84 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 65 G 8.25 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 66 V 7.82 3.62 2.27 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 1.04 0.00 0.00 0.99 0.00 0.00 67 T 7.75 3.89 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 1.28 0.00 0.00 68 V 7.93 3.62 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 1.16 0.00 0.00 0.99 0.00 0.00 69 L 8.15 4.23 0.00 1.81 1.88 0.94 0.69 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 70 T 8.24 3.98 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 1.25 0.00 0.00 71 A 7.98 4.00 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 72 L 8.20 3.72 0.00 1.64 1.65 0.17 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.40 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 0.00 0.00 0.00 74 A 7.80 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 75 I 7.33 3.77 1.85 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 1.54 0.63 0.89 0.00 0.00 76 L 7.78 3.94 0.00 1.24 1.56 -0.02 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.78 4.08 0.00 1.65 1.80 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.47 1.50 7.81 78 K 7.77 4.06 0.00 1.88 1.90 0.00 1.76 0.00 0.00 1.57 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.49 1.75 7.81 79 K 8.37 2.00 0.00 1.16 0.74 0.00 1.59 0.00 0.00 1.43 0.00 0.00 2.74 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.43 0.73 7.81 80 G 7.47 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 81 H 7.80 4.55 0.00 3.17 3.25 0.00 5.82 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 82 H 7.58 5.17 0.00 3.29 3.44 0.00 5.64 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.27 4.02 0.00 2.20 2.28 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 2.38 2.33 0.00 84 A 7.96 4.07 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 85 E 8.11 4.22 0.00 2.21 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 2.42 0.00 86 L 8.06 4.22 0.00 1.86 1.68 0.84 0.23 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 87 K 8.12 4.05 0.00 2.10 2.20 0.00 1.26 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.53 7.81 88 P 0.00 4.26 0.00 2.21 2.16 0.00 3.67 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 89 L 7.46 3.99 0.00 1.86 1.82 0.99 1.12 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 90 A 8.09 4.14 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 91 Q 8.20 3.81 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.66 0.00 92 S 8.12 4.03 0.00 4.00 4.13 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 93 H 8.57 4.24 0.00 3.48 3.55 0.00 5.81 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 94 A 7.71 2.96 -0.20 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 95 T 7.19 3.84 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 0.91 0.00 0.00 96 K 7.46 4.19 0.00 1.55 1.72 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.02 1.30 7.81 97 H 7.97 4.30 0.00 2.99 3.19 0.00 5.86 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.64 3.78 0.00 1.86 1.84 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.36 7.81 99 I 8.28 4.28 2.04 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 1.45 0.93 1.08 0.00 0.00 100 P 0.00 4.42 0.00 1.75 1.77 0.00 2.53 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.73 0.00 101 I 8.46 3.44 1.73 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.86 0.72 0.00 0.00 102 K 7.89 3.70 0.00 1.70 1.71 0.00 1.79 0.00 0.00 2.06 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 0.40 7.81 103 Y 8.07 3.95 0.00 3.22 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.02 4.12 0.00 1.75 1.76 0.56 0.69 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 0.00 105 E 7.91 3.92 0.00 1.92 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.42 0.00 106 F 7.61 4.49 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 0.00 107 I 8.24 3.87 2.02 0.00 0.00 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 1.58 1.61 1.09 0.00 0.00 108 S 8.31 4.19 0.00 4.17 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 0.00 109 E 8.32 4.09 0.00 2.38 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 2.43 2.53 0.00 110 A 8.03 4.05 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 0.00 111 I 8.05 3.68 2.11 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 1.59 0.91 1.02 0.00 0.00 112 I 7.96 3.86 2.12 0.00 0.00 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 1.69 1.00 1.13 0.00 0.00 113 H 8.28 4.16 0.00 3.33 3.49 0.00 5.78 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 7.93 3.62 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 0.89 0.00 0.00 0.98 0.00 0.00 115 L 8.13 3.79 0.00 0.90 0.22 0.64 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.04 4.41 0.00 3.43 3.53 0.00 5.95 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 0.00 117 S 7.83 4.17 0.00 3.91 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 R 7.77 4.12 0.00 1.64 1.48 0.00 2.49 0.00 0.00 2.80 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.55 0.00 119 H 8.09 4.91 0.00 3.18 3.19 0.00 5.66 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.15 0.00 2.20 2.27 0.00 3.61 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 121 G 8.17 3.72 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 0.00 0.00 0.00 122 D 7.93 4.86 0.00 2.72 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 0.00 123 F 8.66 5.00 0.00 2.94 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 0.00 124 G 7.52 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 0.00 125 A 8.46 3.89 1.26 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 0.00 0.00 0.00 126 D 7.95 4.27 0.00 2.91 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.72 3.91 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 0.00 128 Q 7.69 3.28 0.00 1.45 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.23 2.17 0.00 129 G 8.28 3.49 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 0.00 130 A 7.90 3.87 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 0.00 131 M 8.41 4.02 0.00 2.51 2.48 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.86 0.00 132 N 8.41 4.30 0.00 2.96 2.92 0.00 0.00 7.21 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 K 8.08 3.97 0.00 1.86 1.69 0.00 1.56 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.56 7.81 134 A 7.99 3.83 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.27 4.09 0.00 1.74 1.80 0.98 1.07 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 0.00 136 E 8.55 4.02 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.60 0.00 137 L 8.09 3.98 0.00 1.83 1.98 1.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.29 4.19 0.00 3.07 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 0.00 139 R 8.11 3.55 0.00 2.05 1.85 0.00 3.11 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 1.57 1.86 0.00 140 K 8.24 3.86 0.00 1.87 1.97 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.46 7.81 141 D 8.18 4.38 0.00 2.80 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 0.00 142 I 7.55 3.54 1.46 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 -0.13 0.39 0.00 0.00 143 A 8.09 3.67 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 A 7.82 3.94 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 0.00 145 K 7.79 4.03 0.00 2.07 1.93 0.00 1.58 0.00 0.00 1.66 0.00 0.00 3.14 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.54 7.81 146 Y 8.47 4.10 0.00 3.08 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 0.00 147 K 8.44 3.94 0.00 1.94 2.02 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.48 7.81 148 E 7.85 3.95 0.00 2.06 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 2.35 2.39 0.00 149 L 7.84 4.37 0.00 1.80 1.94 0.80 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 150 G 8.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.29 4.36 0.00 2.61 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 Q 7.96 4.14 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.27 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 153 G 8.56 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