NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2711 8.1733 122.0488 56.2708 34.2326 174.1257 2 V 4.5764 8.0261 117.6581 59.1176 34.0157 174.9146 3 F 4.2343 9.0726 124.9842 57.0724 40.4399 175.2993 4 G 4.0198 8.3006 108.1772 45.1661 0.0000 174.7275 5 R 3.5886 8.9056 121.8798 59.8214 29.6172 179.5578 6 C 4.4652 8.1404 114.7849 58.8367 40.0309 175.6293 7 E 3.9936 7.8466 119.4654 59.0632 29.6458 178.3725 8 L 2.9909 8.0844 121.7029 57.1968 41.9439 178.5451 9 A 3.8757 7.7015 120.4559 55.3330 18.2445 179.5289 10 A 3.8330 7.6054 118.1918 55.0473 17.9042 179.6069 11 A 3.8447 7.8449 119.2301 55.5495 18.5344 179.6119 12 M 3.7927 7.9664 117.3340 58.5389 32.1677 178.9827 13 K 3.8680 8.4235 119.8855 59.5039 32.1264 178.7311 14 R 3.9043 8.0978 118.3267 58.6086 29.8674 177.1126 15 H 4.8650 7.4487 113.8806 54.5950 30.5824 174.5243 16 G 4.0125 7.6134 106.4871 46.6354 0.0000 174.9142 17 L 3.6892 7.4151 117.4322 55.4862 42.3855 176.8636 18 D 4.6750 7.7486 118.0502 55.6522 40.9799 175.2160 19 N 4.6400 9.3533 123.2286 53.5575 36.1849 173.4288 20 Y 4.3183 8.3212 121.2286 58.6783 39.1500 175.9951 21 R 3.8602 9.2057 124.6798 57.3098 27.7998 176.8369 22 G 3.7253 8.4222 103.8540 45.9451 0.0000 174.2209 23 Y 4.6126 7.7005 118.5377 55.2374 38.0772 174.9502 24 S 4.4123 8.5316 119.1216 57.9804 64.0782 175.5705 25 L 4.2836 9.2202 124.2309 58.9355 41.6260 179.6423 26 G 4.0757 8.4146 104.7069 47.9736 0.0000 175.1241 27 N 4.4387 8.3565 118.4665 56.2517 38.6961 177.5644 28 W 4.0518 7.9424 119.7245 59.6291 29.1274 178.7302 29 V 3.6081 8.4262 118.7092 66.1521 31.1399 177.3135 30 C 2.6662 7.8677 118.0221 58.9347 44.3391 175.4236 31 A 3.9347 8.0060 122.3584 54.9000 17.9048 179.1808 32 A 3.8864 7.6962 119.2499 55.3754 18.4688 179.8199 33 K 2.6065 7.6317 116.7009 59.4818 31.7706 179.5942 34 F 4.6418 6.9952 115.7349 59.9295 38.9289 177.5912 35 E 4.1746 8.1683 118.7564 58.7808 29.9463 177.5876 36 S 4.5626 8.0090 110.6248 56.4896 64.6283 173.6525 37 N 4.2778 8.7500 117.1828 53.9622 37.1591 174.6070 38 F 4.3251 8.3670 114.0385 57.1387 37.9085 174.4826 39 N 4.7632 8.0896 120.4157 53.0704 37.7497 174.8440 40 T 4.0489 8.6603 118.6048 63.8034 69.6227 175.2803 41 Q 4.7762 7.8078 118.1542 55.6395 29.6058 175.7184 42 A 4.2728 8.3502 123.1164 52.9923 19.4710 177.6651 43 T 4.9292 8.3094 117.9328 61.9242 72.8108 173.3216 44 N 4.8966 9.3463 123.1993 51.5738 42.7294 173.7286 45 R 4.5024 8.5940 124.3286 55.3394 31.2351 174.9758 46 N 5.2464 8.5947 122.5804 50.1897 42.2690 177.3238 47 T 4.4505 8.8733 116.9289 61.4105 68.1034 177.6673 48 D 4.3584 9.4108 117.4276 57.3597 37.2850 174.6095 49 G 4.0451 7.9956 105.6239 46.5677 0.0000 173.5588 50 S 4.8111 8.0755 116.3644 58.1601 64.8558 173.0574 51 T 4.9212 8.4797 116.0952 62.6033 73.3390 172.9833 52 D 5.3240 9.4731 125.9071 53.5761 42.7011 174.9922 53 Y 4.8401 9.3537 122.0055 57.3894 41.1929 177.4574 54 G 4.2093 9.7888 113.6314 45.2244 0.0000 172.9627 55 I 3.6960 8.4522 111.3621 64.1610 37.0501 177.3924 56 L 4.3147 7.5207 119.0253 55.5351 42.2068 178.2153 57 Q 3.2062 7.5487 113.2318 56.9219 25.8275 174.0812 58 I 4.2875 8.1513 124.6361 60.5020 39.4329 175.4604 59 N 5.4788 8.7699 125.4772 53.3066 39.9688 175.4207 60 S 4.9083 9.0029 119.9738 59.1805 63.5387 175.2369 61 R 4.2717 8.6836 121.6629 58.2291 31.0103 175.5261 62 W 5.5319 8.0148 112.0273 56.7450 31.5620 174.0208 63 W 4.4431 8.8865 122.2078 56.8738 26.6344 173.5551 64 C 5.2412 7.6786 110.2776 53.5878 42.7544 171.8095 65 N 5.0425 9.9042 120.5348 52.0589 39.7168 174.9985 66 D 4.6822 8.9666 123.3353 52.4611 43.0977 176.6626 67 G 3.9272 8.8339 110.3739 45.0698 0.0000 177.0199 68 R 3.5609 8.1517 120.4622 58.0088 31.3031 176.5784 69 T 4.3001 9.5600 116.6541 62.2743 69.0050 172.6650 70 P 4.2491 0.0000 0.0000 65.0894 31.5832 177.9096 71 G 3.9049 7.7187 113.7149 43.9297 0.0000 172.2031 72 S 5.4614 7.6011 119.3069 55.9849 67.1563 173.0525 73 R 4.5410 7.9923 116.3266 55.6900 34.6161 173.8284 74 N 4.8676 8.3711 118.5405 50.5313 37.4688 174.7024 75 L 4.2586 8.6465 127.1404 58.1136 40.7237 178.9247 76 C 4.6508 8.9387 114.9703 56.0880 40.5572 173.5056 77 N 4.3354 8.5639 116.6742 53.9990 36.0438 173.8505 78 I 4.7114 6.9900 107.3031 58.1247 41.1226 172.6089 79 P 4.4982 0.0000 0.0000 62.4605 32.0457 178.5946 80 C 4.0200 9.6748 121.5453 59.4813 34.7386 176.6811 81 S 4.0602 7.8448 115.7619 61.1620 62.5487 175.6050 82 A 4.2773 7.8819 122.1210 53.0256 18.2286 177.4081 83 L 4.6061 7.4769 118.6565 54.6309 42.2265 176.8021 84 L 5.2208 7.7071 112.9935 52.7758 42.9177 176.5648 85 S 4.4098 7.9944 113.8873 58.5051 62.9889 173.7569 86 S 4.6233 8.4368 116.3433 58.1772 62.0404 174.0170 87 D 4.9610 7.7420 120.7305 52.2325 43.1134 176.7805 88 I 3.8590 9.0548 125.9077 65.0054 37.4110 180.4667 89 T 3.2495 7.2200 116.0708 65.3198 68.1576 175.3864 90 A 3.9306 7.7075 121.3560 55.2122 18.5373 179.5406 91 S 4.0065 7.9697 113.6353 62.0238 62.9850 177.5273 92 V 3.0592 7.4701 114.3757 64.1108 31.0159 178.0152 93 N 4.1152 7.3634 116.0367 56.6105 39.1019 175.9392 94 C 4.2508 8.3401 119.8207 59.7526 40.8456 175.2378 95 A 3.9623 8.5681 123.2644 55.3149 17.2739 179.7172 96 K 3.6181 7.7587 116.9140 59.0777 31.8512 179.3962 97 K 3.8025 7.6299 117.6271 58.5452 32.4874 178.8234 98 I 3.2302 6.9887 119.6580 63.3960 37.2616 178.3650 99 V 4.1030 7.4911 114.5983 63.5457 31.2045 177.7865 100 S 4.6830 7.4697 112.0652 59.0796 62.9817 173.7562 101 D 4.8387 7.7120 121.4634 54.6212 40.8093 177.6245 102 G 4.1029 8.8301 107.3713 45.4301 0.0000 174.3181 103 N 4.9298 8.0514 114.3477 51.9551 41.8848 176.1344 104 G 4.2393 7.6545 103.8996 47.0351 0.0000 174.6292 105 M 4.0798 7.5918 123.2054 55.1552 31.8163 177.7429 106 N 4.6412 7.7968 117.5611 55.8958 38.9634 175.9626 107 A 3.7749 7.7312 120.3488 54.2964 18.4492 177.6743 108 W 4.6525 7.8179 116.5895 55.2719 30.1026 177.5566 109 V 3.7277 8.5033 118.5386 64.5105 30.6952 178.3679 110 A 4.1154 7.7733 119.1615 53.9735 18.0866 179.5361 111 W 4.1090 8.2529 127.0912 60.5775 30.8582 178.0450 112 R 3.4531 8.4855 117.2764 57.6877 29.9833 177.8814 113 N 4.2722 9.1073 116.5689 54.3725 37.6740 177.1142 114 R 3.7066 5.8400 127.5489 59.4241 31.1491 175.1729 115 C 4.5263 7.2526 113.0529 57.8476 42.0238 174.1218 116 K 3.1338 6.7928 120.3549 58.0544 31.5777 176.4840 117 G 3.8189 8.8490 113.6232 45.9234 0.0000 172.9485 118 T 4.3364 7.2488 116.1102 62.6018 70.3941 175.3018 119 D 4.7473 8.1119 122.2957 52.9088 39.6826 176.6964 120 V 4.1718 7.7699 122.2667 65.5146 32.0384 176.6631 121 Q 4.2119 7.8167 114.1955 58.8199 28.1595 178.1135 122 A 3.9709 7.9050 122.2765 54.6440 18.3656 179.0664 123 W 4.3413 8.1075 116.4914 58.1934 29.1004 176.7440 124 I 4.5994 7.5823 112.2849 60.3888 37.5733 175.2429 125 R 4.3407 8.0298 120.1996 57.1126 31.1531 176.7933 126 G 4.0687 8.9343 110.8475 45.6729 0.0000 174.7979 127 C 4.2503 7.4107 116.1319 56.7587 40.6215 173.7235 128 R 4.0433 8.4432 122.5416 56.8719 29.6820 176.8334 129 L 4.1740 8.2055 122.2429 55.1323 42.7019 175.8881 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 K 8.17 4.27 0.00 1.77 1.64 0.00 1.36 0.00 0.00 1.42 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.09 1.28 7.81 2 V 8.03 4.58 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.95 0.00 0.00 3 F 9.07 4.23 0.00 2.86 2.65 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 0.00 0.00 0.00 0.00 4 G 8.30 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 5 R 8.91 3.59 0.00 2.13 2.05 0.00 3.31 0.00 0.00 3.83 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.07 0.00 6 C 8.14 4.47 0.00 3.01 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 7 E 7.85 3.99 0.00 2.27 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 2.69 2.95 0.00 8 L 8.08 2.99 0.00 1.13 1.22 0.08 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.70 3.88 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 10 A 7.61 3.83 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 11 A 7.84 3.84 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 M 7.97 3.79 0.00 1.86 2.13 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.28 0.00 13 K 8.42 3.87 0.00 1.86 1.75 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.44 7.81 14 R 8.10 3.90 0.00 2.00 1.73 0.00 3.29 0.00 0.00 3.13 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 15 H 7.45 4.87 0.00 2.98 3.11 0.00 6.05 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.61 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 0.00 0.00 0.00 17 L 7.42 3.69 0.00 1.40 0.70 -0.28 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 18 D 7.75 4.67 0.00 2.69 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 19 N 9.35 4.64 0.00 3.06 3.04 0.00 0.00 6.72 7.48 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 20 Y 8.32 4.32 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 21 R 9.21 3.86 0.00 2.47 2.23 0.00 3.43 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.88 0.00 22 G 8.42 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 Y 7.70 4.61 0.00 3.23 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 24 S 8.53 4.41 0.00 4.13 4.15 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 25 L 9.22 4.28 0.00 1.85 1.85 1.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.41 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 0.00 0.00 0.00 27 N 8.36 4.44 0.00 3.14 2.69 0.00 0.00 6.96 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 28 W 7.94 4.05 0.00 3.47 2.97 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 0.00 0.00 0.00 29 V 8.43 3.61 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 1.32 0.00 0.00 1.03 0.00 0.00 30 C 7.87 2.67 0.00 1.88 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 A 8.01 3.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.70 3.89 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 0.00 0.00 33 K 7.63 2.61 0.00 0.79 0.74 0.00 1.46 0.00 0.00 0.98 0.00 0.00 3.40 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.30 1.18 7.81 34 F 7.00 4.64 0.00 3.03 2.97 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 0.00 0.00 0.00 35 E 8.17 4.17 0.00 2.25 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 2.41 2.46 0.00 36 S 8.01 4.56 0.00 4.25 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 37 N 8.75 4.28 0.00 2.77 2.84 0.00 0.00 7.48 7.02 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 38 F 8.37 4.33 0.00 3.40 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 39 N 8.09 4.76 0.00 2.88 2.93 0.00 0.00 6.83 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.66 4.05 4.55 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 1.29 0.00 0.00 41 Q 7.81 4.78 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.86 0.00 0.00 0.00 0.00 0.00 2.26 2.45 0.00 42 A 8.35 4.27 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 43 T 8.31 4.93 4.12 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 0.62 0.00 0.00 44 N 9.35 4.90 0.00 2.54 2.64 0.00 0.00 6.37 6.36 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 45 R 8.59 4.50 0.00 1.77 1.80 0.00 3.31 0.00 0.00 2.54 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 46 N 8.59 5.25 0.00 2.76 2.74 0.00 0.00 7.01 7.16 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 47 T 8.87 4.45 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 48 D 9.41 4.36 0.00 2.81 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 49 G 8.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 S 8.08 4.81 0.00 3.85 3.93 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 51 T 8.48 4.92 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 52 D 9.47 5.32 0.00 2.57 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 53 Y 9.35 4.84 0.00 3.02 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 54 G 9.79 4.21 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 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.45 3.70 1.84 0.00 0.00 nan 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 0.63 0.98 0.00 0.00 56 L 7.52 4.31 0.00 1.60 1.60 0.67 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 7.55 3.21 0.00 2.31 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.87 6.78 0.00 0.00 0.00 0.00 0.00 2.42 2.63 0.00 58 I 8.15 4.29 1.96 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 1.20 0.80 0.85 0.00 0.00 59 N 8.77 5.48 0.00 3.03 2.99 0.00 0.00 6.97 7.63 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 60 S 9.00 4.91 0.00 4.04 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 R 8.68 4.27 0.00 2.13 2.27 0.00 3.33 0.00 0.00 3.39 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 62 W 8.01 5.53 0.00 2.87 2.61 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 63 W 8.89 4.44 0.00 3.66 3.21 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 0.00 0.00 0.00 64 C 7.68 5.24 0.00 3.13 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 65 N 9.90 5.04 0.00 2.90 2.68 0.00 0.00 6.96 8.37 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 66 D 8.97 4.68 0.00 2.83 2.58 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 67 G 8.83 3.93 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 0.00 0.00 0.00 68 R 8.15 3.56 0.00 2.00 2.10 0.00 3.08 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.06 0.00 69 T 9.56 4.30 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 70 P 0.00 4.25 0.00 2.04 2.10 0.00 3.68 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 2.04 2.10 0.00 71 G 7.72 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 72 S 7.60 5.46 0.00 4.01 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 73 R 7.99 4.54 0.00 1.73 1.77 0.00 3.05 0.00 0.00 3.35 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 74 N 8.37 4.87 0.00 2.87 3.06 0.00 0.00 5.95 6.67 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 75 L 8.65 4.26 0.00 1.47 1.87 0.75 0.75 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 76 C 8.94 4.65 0.00 3.31 3.13 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 77 N 8.56 4.34 0.00 2.80 2.88 0.00 0.00 6.68 7.35 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 78 I 6.99 4.71 1.84 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 1.43 0.95 0.89 0.00 0.00 79 P 0.00 4.50 0.00 2.16 1.97 0.00 3.57 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.08 0.00 80 C 9.67 4.02 0.00 2.15 1.18 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 81 S 7.84 4.06 0.00 4.06 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 82 A 7.88 4.28 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 83 L 7.48 4.61 0.00 1.75 1.74 0.92 0.49 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 84 L 7.71 5.22 0.00 1.96 1.66 1.08 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 85 S 7.99 4.41 0.00 3.93 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 86 S 8.44 4.62 0.00 3.85 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 87 D 7.74 4.96 0.00 2.77 2.56 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 88 I 9.05 3.86 1.73 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.61 0.67 0.00 0.00 89 T 7.22 3.25 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 1.14 0.00 0.00 90 A 7.71 3.93 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 91 S 7.97 4.01 0.00 3.93 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 92 V 7.47 3.06 1.67 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 0.65 0.00 0.00 nan 0.00 0.00 93 N 7.36 4.12 0.00 2.77 2.76 0.00 0.00 7.19 7.51 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 94 C 8.34 4.25 0.00 3.08 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 95 A 8.57 3.96 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 96 K 7.76 3.62 0.00 1.79 1.52 0.00 1.32 0.00 0.00 1.12 0.00 0.00 2.54 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.30 0.90 7.81 97 K 7.63 3.80 0.00 1.64 1.92 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.60 7.81 98 I 6.99 3.23 1.06 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.38 -0.25 0.00 0.00 99 V 7.49 4.10 2.37 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 1.36 0.00 0.00 1.41 0.00 0.00 100 S 7.47 4.68 0.00 3.89 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 0.00 101 D 7.71 4.84 0.00 2.95 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 0.00 102 G 8.83 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 0.00 103 N 8.05 4.93 0.00 2.68 2.85 0.00 0.00 7.14 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 0.00 104 G 7.65 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 0.00 0.00 0.00 0.00 105 M 7.59 4.08 0.00 0.51 0.57 0.00 0.00 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.88 0.00 106 N 7.80 4.64 0.00 2.76 3.00 0.00 0.00 6.97 7.35 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 0.00 107 A 7.73 3.77 0.38 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 0.00 108 W 7.82 4.65 0.00 3.37 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 0.00 109 V 8.50 3.73 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 0.90 0.00 0.00 1.01 0.00 0.00 110 A 7.77 4.12 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 0.00 111 W 8.25 4.11 0.00 3.32 3.32 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 0.00 112 R 8.49 3.45 0.00 2.18 2.10 0.00 3.46 0.00 0.00 3.50 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 113 N 9.11 4.27 0.00 2.74 2.44 0.00 0.00 6.95 7.33 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 0.00 114 R 5.84 3.71 0.00 1.66 0.97 0.00 3.02 0.00 0.00 2.90 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.56 0.00 115 C 7.25 4.53 0.00 2.34 2.82 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 0.00 116 K 6.79 3.13 0.00 0.79 1.35 0.00 1.74 0.00 0.00 1.62 0.00 0.00 3.09 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.27 1.21 7.81 117 G 8.85 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 0.00 118 T 7.25 4.34 4.53 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 1.42 0.00 0.00 119 D 8.11 4.75 0.00 2.69 2.58 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 0.00 120 V 7.77 4.17 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 1.25 0.00 0.00 1.08 0.00 0.00 121 Q 7.82 4.21 0.00 2.37 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 122 A 7.90 3.97 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 W 8.11 4.34 0.00 3.51 3.42 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 0.00 124 I 7.58 4.60 1.93 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.78 1.04 0.00 0.00 125 R 8.03 4.34 0.00 1.94 1.85 0.00 3.28 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.52 0.00 126 G 8.93 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 C 7.41 4.25 0.00 3.13 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 0.00 128 R 8.44 4.04 0.00 1.79 1.91 0.00 3.36 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 129 L 8.21 4.17 0.00 1.70 1.50 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00