NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9598 8.3544 109.7353 46.0122 0.0000 172.3724 2 S 4.3777 8.2929 112.0229 56.7511 65.1360 172.6098 3 S 4.8140 8.4352 121.4997 56.3654 66.6694 174.5696 4 G 3.6725 8.6964 109.8041 48.4792 0.0000 173.9760 5 S 4.8259 7.2594 113.8919 56.0317 66.5501 173.5805 6 S 4.6397 7.9626 111.3822 57.9667 65.6663 175.8970 7 G 4.3447 8.4644 120.4069 45.3206 0.0000 175.6206 8 M 4.6816 8.2691 125.8785 53.3042 33.8152 174.7088 9 S 4.5786 8.0069 115.7609 57.9219 65.2336 174.8637 10 A 4.6431 8.1808 122.8873 50.1634 22.0176 175.5694 11 S 4.3960 8.4244 115.2830 57.4886 63.4748 175.2269 12 V 3.4467 8.6752 127.3635 66.4987 31.2397 177.8409 13 K 4.1582 8.1800 117.2919 59.9048 31.9656 178.0158 14 E 3.9340 8.3708 118.2578 60.0007 29.2927 179.3519 15 S 4.0629 7.9374 112.8873 62.2025 63.2347 176.3043 16 L 4.0975 8.2425 121.0663 58.1310 41.4945 179.4917 17 Q 3.9904 8.0298 119.0974 59.4668 28.5552 178.6476 18 L 4.2066 8.1686 119.0826 57.1801 41.4248 178.9744 19 Q 4.5946 7.8656 118.4350 57.0711 28.9800 177.3752 20 L 4.3918 7.6982 119.8213 56.6218 42.3747 178.6550 21 L 4.0641 7.9565 120.1839 58.8162 40.2367 179.1850 22 E 4.0910 8.0513 117.7447 59.1888 29.2460 179.1353 23 M 3.8855 7.7560 119.7945 58.4331 31.5025 178.4553 24 E 4.2309 8.1763 118.1571 59.6136 29.5538 179.4595 25 M 4.1520 7.8984 118.4275 58.2448 32.0914 178.5392 26 L 4.0195 8.1219 119.2991 57.9388 41.5934 179.5524 27 F 4.4685 7.9668 116.6035 60.6288 38.8612 177.4692 28 S 4.3121 7.7218 111.0485 61.7010 62.4265 175.8459 29 M 4.3137 7.8042 118.8705 56.0262 32.3377 176.6797 30 F 4.9799 7.3960 117.9662 54.5656 39.7675 172.7650 31 P 4.4759 0.0000 0.0000 65.1857 31.7792 177.9050 32 N 4.5854 8.0729 116.0227 53.0605 39.0150 175.2349 33 Q 4.1958 8.7955 121.6808 58.5331 29.2255 176.5088 34 G 4.0186 7.8666 106.2657 46.3068 0.0000 173.3736 35 E 4.3427 7.4327 117.0190 56.8487 32.1643 176.2567 36 V 4.1228 7.5586 125.4992 62.5944 32.6438 175.8378 37 K 4.4691 8.7481 129.2468 54.9459 33.2242 175.5056 38 L 4.5091 8.3786 125.8413 53.5014 41.8584 176.9265 39 E 4.0153 8.1198 124.9409 59.5981 29.8973 177.7589 40 D 4.5445 7.6915 116.7487 53.1271 43.9330 176.1982 41 V 3.6724 8.5460 120.3320 63.8742 32.0401 176.4824 42 N 4.7057 8.2415 115.9820 53.2685 39.1315 176.6125 43 A 4.0882 8.1945 122.8056 54.7726 18.4254 179.9519 44 L 4.0148 7.8206 117.2326 57.8626 42.0974 179.0721 45 T 3.8603 7.9208 115.3392 66.6454 68.3065 176.0696 46 N 4.2201 7.9006 117.3774 56.8554 38.9356 177.2518 47 I 3.8462 7.3504 118.7193 64.3529 37.0141 178.4109 48 K 4.0922 8.0392 119.0217 59.9615 32.0064 179.4062 49 R 3.9888 8.0030 117.7973 59.2588 30.0898 178.2593 50 Y 4.0473 8.6603 119.6930 60.5995 38.4946 178.1110 51 L 4.2055 7.5445 119.2251 57.8134 41.7497 178.9958 52 E 4.1157 7.8374 117.6914 57.5298 29.5103 178.1767 53 G 3.8245 7.5888 105.7350 45.1767 0.0000 174.4066 54 T 3.7752 7.6510 113.6227 64.2021 66.6714 173.6639 55 R 4.3579 7.5590 122.6001 54.1746 29.2828 175.6056 56 E 3.9521 8.5726 126.1402 58.4283 30.0530 177.4557 57 A 4.0786 7.2329 119.4256 51.4292 18.7416 176.7454 58 L 4.1047 8.5672 125.9579 54.2972 42.4726 175.1129 59 P 4.5140 0.0000 0.0000 61.4278 32.1353 174.1147 60 P 4.3290 0.0000 0.0000 62.1560 31.7089 176.3379 61 K 4.0417 8.5830 121.8502 57.5140 33.3158 176.8955 62 I 4.2683 8.0051 121.3846 60.0738 37.0154 173.7824 63 E 4.9798 8.4609 127.8368 54.2055 32.5492 174.3817 64 F 5.1726 8.2769 119.9425 56.2325 42.5176 172.5749 65 V 4.6642 8.4475 118.4953 61.1409 34.0875 173.9947 66 I 4.5642 8.6588 129.0743 59.8412 39.4372 174.7695 67 T 4.4551 7.6069 123.9568 62.7115 69.7555 174.8379 68 L 4.2892 8.4992 127.2254 53.5978 42.1481 176.1966 69 Q 4.5481 8.4344 128.3669 54.7453 27.0966 174.2606 70 I 3.6940 7.9586 121.3376 61.3431 37.9233 177.6396 71 E 3.9282 8.9814 127.4082 59.1614 29.7104 177.3744 72 E 4.5873 7.4966 116.2261 54.3248 32.4679 172.8109 73 P 4.2154 0.0000 0.0000 62.0508 31.9436 175.5630 74 K 4.3457 8.3697 123.3395 56.3503 31.0204 175.2217 75 V 4.6075 7.6281 117.2614 59.2300 37.0382 173.3571 76 K 4.7043 8.5743 121.8846 54.8568 34.8890 175.2319 77 I 4.4929 8.0780 126.0625 59.2585 40.3036 174.5555 78 D 4.5560 8.5202 127.6254 54.3360 41.9495 175.5099 79 L 4.8004 8.7881 127.0045 53.4691 44.2241 175.5808 80 Q 4.6874 9.0562 128.0016 54.9073 29.6549 175.1502 81 V 4.2897 7.8733 124.8124 60.4131 33.4380 175.5654 82 T 4.3754 8.1929 119.8567 62.3490 71.8764 173.0784 83 M 4.2218 8.1433 127.2560 52.7390 32.9093 174.9720 84 P 4.5774 0.0000 0.0000 62.4960 32.8033 176.6854 85 H 4.6228 8.4635 114.2404 57.2939 28.4359 176.0395 86 S 4.5000 7.4083 114.1688 60.1421 64.0484 173.6576 87 Y 4.5996 8.1025 120.4356 56.2792 39.4607 175.0568 88 P 3.4371 0.0000 0.0000 65.3043 31.8619 177.5053 89 Y 4.0001 7.9904 116.4751 60.4332 37.9082 176.4460 90 L 4.5025 7.7889 119.9360 52.9130 43.9226 175.3611 91 A 4.2778 8.3588 126.5323 51.4782 17.2973 177.1997 92 L 4.2330 8.4042 122.2334 57.1424 41.4648 176.0593 93 Q 4.6233 8.3594 118.5013 54.2852 31.3292 174.1862 94 L 5.6631 8.5214 124.9510 52.0626 45.7895 175.9933 95 F 4.8490 8.6137 122.5289 56.8754 42.4967 173.4530 96 G 4.2779 8.1824 114.1311 44.4139 0.0000 172.1995 97 R 4.6833 8.2320 122.4501 54.3738 33.1105 174.1830 98 S 4.7098 8.3637 114.7344 56.5063 65.9104 174.4388 99 S 4.1386 9.1563 120.4235 61.8283 62.4481 175.7899 100 E 4.0469 8.2068 118.9811 58.6636 29.5496 177.0485 101 L 3.5124 6.8004 118.4637 54.9227 42.6555 176.9250 102 D 4.9403 7.9125 119.6001 51.9714 45.0869 177.3782 103 R 3.8215 8.2754 118.9190 60.1537 29.8738 177.5462 104 H 4.0943 8.1678 117.2324 59.5754 29.8901 176.6185 105 Q 3.8953 8.1158 119.0245 59.2710 28.4727 178.5275 106 Q 3.6623 8.2940 118.5285 59.3140 28.7815 179.7397 107 L 3.8576 7.6678 118.9236 58.0561 41.7089 179.6402 108 L 3.9874 7.4581 118.5016 58.2754 41.6405 179.0118 109 L 2.8832 7.4432 119.8571 57.5766 41.8557 178.2812 110 N 4.1380 8.4575 116.3166 56.5189 38.8477 176.8676 111 K 3.9289 7.8454 122.2515 59.0865 32.0355 178.6926 112 G 4.0973 8.2598 104.5807 48.1803 0.0000 174.8046 113 L 2.6489 8.1920 122.7463 57.2253 41.8094 178.9608 114 T 3.7566 8.3074 109.9671 65.0662 68.4594 175.9407 115 S 4.1305 7.6000 116.7143 61.1783 62.7768 175.5756 116 Y 4.2747 7.8374 122.2988 61.0234 38.1747 178.4108 117 I 3.4653 7.4653 118.5970 63.2708 37.3360 177.3693 118 G 4.0308 7.6727 105.1630 44.8301 0.0000 173.8645 119 T 4.5541 7.3405 108.6359 61.0664 69.0599 173.9716 120 F 4.5091 7.9554 119.6873 56.3104 41.2885 175.0139 121 D 4.5477 8.1020 122.2876 52.7186 41.6298 174.8744 122 P 4.3669 0.0000 0.0000 63.3818 29.8546 176.1006 123 G 4.7540 7.4613 126.3281 46.3701 0.0000 170.4153 124 E 4.5788 7.1481 115.4656 53.8872 31.8997 175.4642 125 L 4.2549 8.1234 118.7729 54.8886 42.5749 176.8533 126 C 4.1921 8.5690 116.5827 60.3709 30.5001 176.9949 127 V 3.5956 8.0133 119.2507 65.0729 30.4449 178.0428 128 C 4.3150 8.1874 115.6975 61.9790 28.2235 174.7728 129 A 4.5479 8.2337 122.1622 53.9180 18.9670 179.1400 130 A 4.1153 8.0016 119.1276 55.3877 18.5178 179.5540 131 I 3.7584 7.6099 117.3483 64.6967 37.1874 178.3065 132 Q 3.9888 8.1592 119.6047 58.9658 28.9968 177.6494 133 W 4.0576 8.5253 129.5641 60.7225 30.3876 177.5062 134 L 4.0039 8.1791 117.1203 58.3694 41.2689 179.0442 135 Q 4.0293 7.7533 115.8875 59.6245 28.8151 178.6449 136 D 4.3863 8.1670 118.2421 56.4747 42.1394 177.1653 137 N 4.6851 7.8593 115.8607 52.7154 39.0536 175.2941 138 S 4.6648 7.7066 113.7023 60.1364 64.0872 174.4927 139 A 4.1064 7.7706 122.9396 54.9435 18.0346 178.9899 140 S 3.9342 8.0620 110.4487 62.0083 62.1870 176.0159 141 Y 4.1942 7.7595 117.5927 61.0028 38.0257 177.1096 142 F 4.2780 7.9977 116.2117 59.7855 39.2811 175.2833 143 L 3.9030 7.8940 121.4456 54.9704 41.0268 176.1311 144 N 4.9273 8.3122 120.4643 51.8944 42.2485 174.1877 145 R 4.3498 8.3112 121.9826 54.5328 29.1458 174.6364 146 K 4.3986 8.0129 124.3275 54.1692 35.0055 175.9081 147 L 4.2562 8.5585 128.4083 54.8225 40.8419 175.7182 148 V 4.3254 7.9988 118.8598 61.4657 34.1556 177.2310 149 S 4.2396 8.1478 114.2922 58.2208 63.3999 173.6157 150 G 3.9874 7.9117 109.9706 44.2217 0.0000 171.2129 151 P 4.5111 0.0000 0.0000 62.4616 32.1523 175.3833 152 S 4.8378 8.2276 113.8147 56.7606 66.2401 174.0193 153 S 4.4378 8.3143 116.9359 57.9047 65.7364 174.7596 154 G 4.3578 8.9321 113.3281 46.0601 0.0000 172.5966 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 G 8.35 3.96 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 0.00 0.00 0.00 2 S 8.29 4.38 0.00 3.87 3.68 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 3 S 8.44 4.81 0.00 3.87 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 4 G 8.70 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 5 S 7.26 4.83 0.00 3.82 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 7.96 4.64 0.00 3.92 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.46 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 8 M 8.27 4.68 0.00 2.01 1.99 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 2.50 2.50 0.00 9 S 8.01 4.58 0.00 3.91 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 10 A 8.18 4.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 8.42 4.40 0.00 3.86 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 12 V 8.68 3.45 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 0.91 0.00 0.00 0.94 0.00 0.00 13 K 8.18 4.16 0.00 1.90 1.93 0.00 1.73 0.00 0.00 1.85 0.00 0.00 3.05 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.74 1.77 7.81 14 E 8.37 3.93 0.00 2.08 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 2.53 0.00 15 S 7.94 4.06 0.00 3.95 4.08 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 16 L 8.24 4.10 0.00 1.80 1.70 0.31 0.71 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 17 Q 8.03 3.99 0.00 2.32 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.85 0.00 0.00 0.00 0.00 0.00 2.40 2.59 0.00 18 L 8.17 4.21 0.00 2.00 1.75 1.01 0.87 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 19 Q 7.87 4.59 0.00 2.32 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.02 0.00 0.00 0.00 0.00 0.00 2.70 2.68 0.00 20 L 7.70 4.39 0.00 1.86 1.73 0.95 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 21 L 7.96 4.06 0.00 1.98 1.97 0.97 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.05 4.09 0.00 2.35 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 2.54 2.41 0.00 23 M 7.76 3.89 0.00 2.01 2.37 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.90 0.00 24 E 8.18 4.23 0.00 2.09 2.09 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 2.43 2.59 0.00 25 M 7.90 4.15 0.00 2.09 2.29 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.66 0.00 26 L 8.12 4.02 0.00 1.61 1.75 1.07 1.47 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 27 F 7.97 4.47 0.00 3.09 3.06 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 0.00 28 S 7.72 4.31 0.00 4.10 4.03 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 29 M 7.80 4.31 0.00 1.42 1.72 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.43 0.00 30 F 7.40 4.98 0.00 3.13 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 31 P 0.00 4.48 0.00 2.23 2.23 0.00 3.90 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.03 0.00 32 N 8.07 4.59 0.00 2.80 2.85 0.00 0.00 6.98 7.73 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 33 Q 8.80 4.20 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.66 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 34 G 7.87 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.43 4.34 0.00 2.04 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 2.31 2.35 0.00 36 V 7.56 4.12 2.09 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 0.61 0.00 0.00 0.73 0.00 0.00 37 K 8.75 4.47 0.00 1.81 1.78 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.41 7.81 38 L 8.38 4.51 0.00 1.56 1.63 0.97 0.83 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 E 8.12 4.02 0.00 1.94 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 2.49 2.46 0.00 40 D 7.69 4.54 0.00 2.72 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 41 V 8.55 3.67 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 0.76 0.00 0.00 0.93 0.00 0.00 42 N 8.24 4.71 0.00 2.97 2.83 0.00 0.00 7.44 8.06 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 43 A 8.19 4.09 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 L 7.82 4.01 0.00 1.72 1.74 1.00 0.76 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 45 T 7.92 3.86 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 1.22 0.00 0.00 46 N 7.90 4.22 0.00 2.72 2.94 0.00 0.00 7.39 7.25 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 47 I 7.35 3.85 2.06 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.86 0.88 0.00 0.00 48 K 8.04 4.09 0.00 2.00 1.93 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.77 7.81 49 R 8.00 3.99 0.00 2.12 2.00 0.00 3.14 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 50 Y 8.66 4.05 0.00 2.98 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 51 L 7.54 4.21 0.00 1.82 1.78 0.98 1.05 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 52 E 7.84 4.12 0.00 2.04 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 2.64 2.47 0.00 53 G 7.59 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 0.00 0.00 0.00 54 T 7.65 3.78 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 1.26 0.00 0.00 55 R 7.56 4.36 0.00 1.89 1.86 0.00 3.27 0.00 0.00 3.32 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.61 0.00 56 E 8.57 3.95 0.00 1.94 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 2.28 2.27 0.00 57 A 7.23 4.08 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 L 8.57 4.10 0.00 1.66 1.61 0.50 0.87 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 59 P 0.00 4.51 0.00 2.17 2.19 0.00 3.57 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.90 0.00 60 P 0.00 4.33 0.00 2.21 2.11 0.00 3.77 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 1.99 1.96 0.00 61 K 8.58 4.04 0.00 2.06 1.99 0.00 1.53 0.00 0.00 1.73 0.00 0.00 2.82 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.50 7.81 62 I 8.01 4.27 1.91 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 1.11 1.18 0.98 0.00 0.00 63 E 8.46 4.98 0.00 2.02 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 64 F 8.28 5.17 0.00 3.26 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 65 V 8.45 4.66 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 0.97 0.00 0.00 0.91 0.00 0.00 66 I 8.66 4.56 1.77 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.45 0.52 0.00 0.00 67 T 7.61 4.46 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 1.20 0.00 0.00 68 L 8.50 4.29 0.00 1.78 1.67 1.08 0.76 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 69 Q 8.43 4.55 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 70 I 7.96 3.69 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 1.46 0.98 0.84 0.00 0.00 71 E 8.98 3.93 0.00 1.93 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 2.29 0.00 72 E 7.50 4.59 0.00 1.82 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 2.11 2.19 0.00 73 P 0.00 4.22 0.00 2.03 1.93 0.00 3.58 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.65 0.00 74 K 8.37 4.35 0.00 1.68 1.79 0.00 1.53 0.00 0.00 2.61 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.48 7.81 75 V 7.63 4.61 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 0.63 0.00 0.00 0.64 0.00 0.00 76 K 8.57 4.70 0.00 1.72 1.65 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.74 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.42 7.81 77 I 8.08 4.49 1.90 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.09 0.90 0.00 0.00 78 D 8.52 4.56 0.00 2.77 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 79 L 8.79 4.80 0.00 1.73 1.74 0.91 0.48 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 80 Q 9.06 4.69 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.62 0.00 0.00 0.00 0.00 0.00 2.38 2.59 0.00 81 V 7.87 4.29 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 0.64 0.00 0.00 82 T 8.19 4.38 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 1.19 0.00 0.00 83 M 8.14 4.22 0.00 1.43 1.77 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.29 0.00 84 P 0.00 4.58 0.00 2.16 2.16 0.00 3.68 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.98 0.00 85 H 8.46 4.62 0.00 3.12 3.27 0.00 5.70 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 86 S 7.41 4.50 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 87 Y 8.10 4.60 0.00 3.11 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 88 P 0.00 3.44 0.00 1.90 1.26 0.00 3.83 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.73 0.00 89 Y 7.99 4.00 0.00 3.14 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 90 L 7.79 4.50 0.00 1.74 1.69 0.94 1.17 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 91 A 8.36 4.28 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 92 L 8.40 4.23 0.00 1.75 1.81 0.84 0.48 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 93 Q 8.36 4.62 0.00 2.14 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.71 0.00 0.00 0.00 0.00 0.00 2.18 2.32 0.00 94 L 8.52 5.66 0.00 1.47 1.48 0.85 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 95 F 8.61 4.85 0.00 2.96 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 96 G 8.18 4.28 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 97 R 8.23 4.68 0.00 1.65 1.37 0.00 2.80 0.00 0.00 3.07 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.46 0.00 98 S 8.36 4.71 0.00 4.01 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 S 9.16 4.14 0.00 4.03 4.03 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 0.00 100 E 8.21 4.05 0.00 2.22 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 0.00 2.41 2.44 0.00 101 L 6.80 3.51 0.00 1.61 1.45 0.86 0.28 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 0.00 102 D 7.91 4.94 0.00 2.58 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 0.00 103 R 8.28 3.82 0.00 1.87 1.92 0.00 3.20 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 104 H 8.17 4.09 0.00 3.27 3.29 0.00 5.94 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 0.00 105 Q 8.12 3.90 0.00 2.14 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.69 0.00 0.00 0.00 0.00 0.00 2.39 2.24 0.00 106 Q 8.29 3.66 0.00 2.21 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.51 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 107 L 7.67 3.86 0.00 1.84 1.72 0.93 0.98 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 0.00 108 L 7.46 3.99 0.00 1.81 1.95 0.90 0.56 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 0.00 109 L 7.44 2.88 0.00 1.07 1.42 0.51 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 110 N 8.46 4.14 0.00 2.77 2.86 0.00 0.00 6.74 7.06 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 0.00 111 K 7.85 3.93 0.00 2.01 1.98 0.00 1.74 0.00 0.00 1.78 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.36 7.81 112 G 8.26 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.19 2.65 0.00 1.52 1.68 0.71 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 114 T 8.31 3.76 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 115 S 7.60 4.13 0.00 3.93 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.84 4.27 0.00 2.52 2.36 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 0.00 117 I 7.47 3.47 1.71 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 1.53 0.76 0.69 0.00 0.00 118 G 7.67 4.03 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 0.00 0.00 0.00 119 T 7.34 4.55 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 1.27 0.00 0.00 120 F 7.96 4.51 0.00 2.94 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.10 4.55 0.00 2.59 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 P 0.00 4.37 0.00 1.37 2.01 0.00 3.75 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 123 G 7.46 4.75 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 0.00 124 E 7.15 4.58 0.00 2.17 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 2.19 2.33 0.00 125 L 8.12 4.25 0.00 1.74 1.78 1.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 126 C 8.57 4.19 0.00 2.81 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 0.00 0.00 0.00 0.00 127 V 8.01 3.60 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 1.00 0.00 0.00 0.92 0.00 0.00 128 C 8.19 4.32 0.00 3.04 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 0.00 129 A 8.23 4.55 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.00 4.12 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 I 7.61 3.76 1.98 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.43 1.10 0.00 0.00 132 Q 8.16 3.99 0.00 2.24 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 133 W 8.53 4.06 0.00 3.37 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 L 8.18 4.00 0.00 2.07 1.84 1.06 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 7.75 4.03 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.96 0.00 0.00 0.00 0.00 0.00 2.44 2.71 0.00 136 D 8.17 4.39 0.00 2.56 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 0.00 137 N 7.86 4.69 0.00 1.55 2.13 0.00 0.00 5.26 6.62 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 0.00 138 S 7.71 4.66 0.00 3.90 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 0.00 139 A 7.77 4.11 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 0.00 140 S 8.06 3.93 0.00 3.62 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 0.00 141 Y 7.76 4.19 0.00 3.23 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 F 8.00 4.28 0.00 3.18 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 0.00 143 L 7.89 3.90 0.00 1.76 1.71 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 144 N 8.31 4.93 0.00 2.76 2.64 0.00 0.00 7.10 7.65 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 0.00 145 R 8.31 4.35 0.00 1.78 1.85 0.00 3.29 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 146 K 8.01 4.40 0.00 1.69 1.62 0.00 1.83 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.41 7.81 147 L 8.56 4.26 0.00 1.65 1.61 0.94 0.95 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 0.00 148 V 8.00 4.33 2.09 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 0.84 0.00 0.00 0.94 0.00 0.00 149 S 8.15 4.24 0.00 3.98 3.88 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 0.00 150 G 7.91 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 0.00 0.00 0.00 151 P 0.00 4.51 0.00 2.19 2.08 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 152 S 8.23 4.84 0.00 3.83 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 S 8.31 4.44 0.00 3.79 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 0.00 154 G 8.93 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 0.00 0.00 0.00 0.00