NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3769 8.3044 120.3494 54.8325 33.2649 174.8984 2 I 3.5623 8.4775 126.5873 61.2923 38.6791 173.1187 3 Q 4.9071 8.4608 125.7237 54.1336 33.2458 173.9904 4 S 5.1677 8.5848 116.0205 56.9094 66.5437 172.9450 5 Q 4.8579 8.7270 119.8034 54.5249 30.5918 175.8203 6 I 4.4263 8.3762 111.2172 60.0096 39.1135 174.7213 7 N 4.8422 7.8512 119.9164 51.0107 40.4599 174.5837 8 R 3.9474 8.5878 124.1357 59.3039 29.4054 178.2088 9 N 4.3537 8.3243 116.5986 55.6594 38.2717 177.3412 10 I 3.7036 7.4526 121.9262 64.6217 37.3333 178.6479 11 R 3.9991 7.8823 118.2509 59.0965 30.0199 179.0390 12 L 4.1793 8.2678 119.3037 57.6700 41.6805 179.2034 13 D 4.3540 8.2694 119.1092 57.0335 40.7521 178.4697 14 L 3.8933 7.8051 120.4030 58.1382 42.1915 178.5093 15 A 4.2376 8.3077 122.4506 54.9874 18.3289 179.4527 16 D 4.3508 8.1409 116.5339 57.3080 40.8246 178.9874 17 A 4.0182 7.8693 121.0682 55.0211 18.3387 179.5434 18 I 3.6563 8.2490 118.7577 64.8123 37.3786 178.7267 19 L 3.9550 8.0782 119.5205 57.4080 41.2987 179.4349 20 L 3.9383 7.8359 120.1102 57.9985 42.0863 178.7663 21 S 4.0179 8.0470 113.0807 61.4411 62.2836 175.7463 22 K 3.6993 8.6622 122.3943 59.6637 31.7567 178.4445 23 A 3.9051 7.7637 120.1431 55.1207 18.2559 179.4405 24 K 3.8003 7.8968 115.8012 59.6328 32.2973 178.8345 25 K 4.1781 7.9560 115.3590 55.5397 32.7204 175.9955 26 D 4.3464 7.8025 117.7506 55.1114 39.9470 173.4622 27 L 4.3574 7.8886 116.9706 53.9070 43.2667 177.2119 28 S 4.6742 7.9548 115.2165 56.7360 66.6457 175.4367 29 F 4.2320 8.4070 120.8539 60.4491 38.5977 177.8797 30 A 4.0966 8.1368 120.5658 55.0875 18.0369 179.2899 31 E 4.0259 8.0054 115.0360 59.3765 29.8688 179.0827 32 I 3.8361 7.5157 119.6010 64.1888 37.3978 177.8847 33 A 4.2378 8.1797 121.1632 53.2267 18.3018 176.9446 34 D 4.4483 7.2286 117.8175 55.5087 41.6333 176.4963 35 G 4.0344 9.0949 114.9020 45.6118 0.0000 173.9905 36 T 4.0832 7.5401 115.2868 63.7821 68.9721 176.3111 37 G 3.9516 8.3601 107.5820 45.1947 0.0000 172.7619 38 L 4.6162 7.4711 118.4650 51.9165 44.4728 176.7111 39 A 4.0003 8.6117 124.1733 52.7068 19.6464 178.0087 40 E 3.8683 9.1212 124.3912 59.7569 29.5256 179.3886 41 A 3.9516 7.9754 119.9809 54.9428 18.5473 179.2127 42 F 3.8295 8.1537 118.7061 61.4568 39.5586 177.4580 43 V 3.7176 7.9535 117.8977 66.1741 31.3619 178.0452 44 T 3.7762 8.0004 115.2937 66.6091 68.2973 176.2796 45 A 3.8390 8.0408 122.5051 55.1083 18.3212 179.5669 46 A 4.2654 7.6838 120.4071 54.8418 18.1532 179.8100 47 L 4.0399 8.1375 117.5388 57.4180 41.3854 178.7217 48 L 4.6153 7.5712 116.5918 54.1697 41.7391 177.1821 49 G 3.8789 7.9055 106.5372 46.0242 0.0000 174.5821 50 Q 4.4925 8.2657 116.3743 55.3966 30.0749 175.0771 51 Q 4.4064 7.4272 115.8627 54.2672 33.0489 172.6527 52 A 4.9999 8.2494 120.5930 50.3984 20.8323 176.7990 53 L 4.5020 8.7480 122.5862 53.7631 43.3548 175.2698 54 P 4.5690 0.0000 0.0000 62.0778 32.6397 177.3169 55 A 3.9094 8.7601 123.0035 55.6497 18.1281 179.9492 56 D 4.3013 8.0701 116.6094 57.3099 40.9343 178.6325 57 A 3.9645 7.9884 120.5739 55.0491 18.5230 179.1089 58 A 3.9622 8.7017 119.8170 55.6509 18.4841 179.9872 59 R 3.8922 8.3643 116.7004 59.3346 30.0306 179.1759 60 L 3.9601 8.1081 120.1495 58.3810 42.0714 179.5178 61 V 3.8417 8.2726 112.7030 64.0726 31.4056 178.8564 62 G 3.5887 8.2888 105.6820 47.3550 0.0000 175.7882 63 A 3.9775 8.1020 123.0552 55.1834 18.2711 180.0051 64 K 4.0455 7.7847 115.1594 58.4898 32.0963 178.0619 65 L 4.4714 7.3525 116.5790 53.4879 42.6421 176.2705 66 D 4.3453 7.4743 117.5058 55.2295 38.5845 173.3922 67 L 4.5076 8.2682 118.5917 53.3851 43.8743 177.7804 68 D 4.6873 8.2247 121.7627 53.1146 41.9792 176.9902 69 E 4.1628 8.5502 117.8283 58.6530 29.4825 179.1373 70 D 4.3576 8.0555 119.1917 57.3233 40.9742 178.5369 71 S 4.1117 9.1812 116.1243 61.8116 62.6746 176.7578 72 I 3.7096 7.4127 120.8171 64.3556 37.1463 177.9970 73 L 4.2494 7.8421 120.6071 58.0492 41.8875 178.8285 74 L 3.9714 8.0663 119.0331 58.0187 41.5531 179.4417 75 L 3.9612 8.0991 118.5984 57.7353 41.2974 179.0617 76 Q 4.5795 7.6183 117.2102 55.7867 29.4095 176.1602 77 M 4.4574 7.5138 120.3586 55.1603 33.0012 176.4513 78 I 4.0034 8.8724 124.9994 60.7710 38.0402 174.2467 79 P 4.7279 0.0000 0.0000 62.0800 32.8673 176.2179 80 L 4.2691 8.3202 123.0681 54.4284 41.7164 176.3444 81 R 4.2547 8.6328 125.5806 54.9667 30.9829 175.8518 82 G 3.7263 7.9910 117.2130 45.4626 0.0000 172.3410 83 C 4.3078 7.9474 122.0456 58.4659 30.7099 174.2980 84 I 4.0434 7.4795 122.1806 60.3824 37.5083 174.5712 85 D 4.5136 8.9295 125.9141 57.1413 41.3705 176.8992 86 D 4.6336 7.3710 114.7480 53.1830 41.5696 173.7408 87 R 4.2781 8.1797 127.0774 56.4459 29.1014 176.9998 88 I 4.0380 7.1284 115.9411 58.2634 39.1632 173.9761 89 P 4.4209 0.0000 0.0000 62.9337 31.7630 176.5771 90 T 4.1330 8.3326 111.5419 63.2212 69.7099 175.1430 91 D 4.5393 7.9926 122.6211 53.1312 42.5902 174.4925 92 P 4.2370 0.0000 0.0000 66.2896 31.1507 178.8221 93 T 3.9478 7.9594 112.8880 66.9968 68.6195 176.3260 94 M 4.5049 8.3776 120.3633 58.5381 32.0172 177.8564 95 Y 4.1176 9.1196 120.9402 61.0732 38.7891 178.6099 96 K 3.9134 8.0194 118.4448 59.4422 31.8961 179.3558 97 F 4.1224 7.7387 118.0548 60.4619 38.8098 176.9193 98 Y 3.9758 8.0013 118.7713 60.7445 38.4550 177.7535 99 E 3.6301 7.9626 120.4179 59.4057 29.6758 178.4245 100 M 4.0850 8.1442 118.9361 58.6943 32.0956 178.8243 101 L 4.0399 7.4831 119.0137 57.7703 41.5689 179.4957 102 Q 3.8222 7.4947 117.1791 58.3060 28.5765 178.5946 103 V 3.6469 7.6381 118.5344 65.1893 32.2123 176.8941 104 Y 4.6521 8.0622 114.3131 57.5862 38.3154 177.7170 105 G 3.6813 7.8867 108.9357 48.2563 0.0000 176.1475 106 T 4.0244 7.8248 111.8833 64.4437 68.8430 176.8419 107 T 3.9581 7.8456 118.3824 66.4474 68.5601 176.5340 108 L 4.0038 8.4558 121.4097 57.5555 41.6401 179.5716 109 K 3.8038 8.0300 118.9666 59.4882 32.1063 178.5620 110 A 4.0522 8.3240 121.4506 55.4702 18.2670 179.6147 111 L 4.0478 8.3483 117.5132 57.4298 41.6442 179.7529 112 V 3.7999 8.0623 118.7193 66.5871 31.3851 177.9326 113 H 4.9156 8.1939 117.0854 58.0238 28.2297 177.5717 114 E 3.8851 7.7884 120.6315 59.4113 29.6916 178.7558 115 K 3.9038 7.8821 117.1714 58.2850 32.1052 177.4765 116 F 4.1450 8.9458 115.3601 60.0737 41.0471 175.1094 117 G 3.9531 7.7965 104.7598 43.3017 0.0000 171.6518 118 D 4.5633 8.9783 120.9232 55.0039 40.9684 175.5345 119 G 4.1570 7.8943 117.4157 46.7281 0.0000 170.4963 120 I 4.8095 7.5774 113.5659 59.2887 41.7890 174.5838 121 I 4.7241 8.1244 123.6113 59.6926 38.2006 175.8475 122 S 4.1611 9.1324 123.0735 58.5794 62.6485 173.7760 123 A 3.8918 8.5315 128.0479 51.8774 19.3849 176.6386 124 I 4.2621 7.7099 116.1529 63.1010 39.3564 176.0937 125 N 4.7835 7.8377 123.3565 51.9972 38.1294 172.7264 126 F 5.2790 8.0273 122.5878 56.9025 42.6067 172.3396 127 K 4.6103 8.1951 123.8412 55.0287 36.4710 174.7788 128 L 5.5017 8.2387 119.6844 53.1625 43.6286 175.0412 129 D 4.8646 8.4677 119.0901 51.7627 43.6329 174.3251 130 V 4.6080 8.3726 118.8011 61.3692 33.7292 174.4478 131 K 4.6772 8.7255 127.9899 54.3559 34.7822 175.6558 132 K 4.6894 8.5850 125.8245 56.0299 33.3839 176.1637 133 V 4.4344 8.8260 126.5846 60.9015 34.5474 174.3763 134 A 4.5143 8.7807 129.9731 52.1160 19.4050 175.9687 135 D 4.5726 9.6691 121.7742 52.6123 42.2137 175.5290 136 P 4.1722 0.0000 0.0000 66.0566 31.3673 176.9439 137 E 4.1776 8.1788 113.7594 56.0872 29.8025 176.3650 138 G 4.0665 9.0734 107.5908 45.1547 0.0000 176.3919 139 G 3.8764 8.7159 108.6517 45.1228 0.0000 172.1042 140 E 4.9603 8.6013 117.9151 54.6025 33.2836 175.7586 141 R 4.7640 9.0709 120.5793 54.3967 33.7416 174.5005 142 A 4.8963 8.5915 124.4315 50.6256 20.8765 176.7641 143 V 4.1908 8.9819 123.8433 61.3338 33.0785 173.8062 144 I 4.9303 8.2452 128.2843 60.0800 38.9302 175.3352 145 T 4.6293 8.7031 123.4291 61.6437 71.4645 172.9211 146 L 4.7927 8.6080 126.0615 53.0091 43.8304 175.4145 147 D 4.7356 8.5640 124.0391 52.3740 43.6503 174.5371 148 G 4.6609 8.5583 112.1988 43.9742 0.0000 171.2218 149 K 4.3254 9.0845 124.5257 56.4442 33.7022 174.8713 150 Y 4.9087 8.4885 126.8879 56.5654 40.1406 174.4442 151 L 4.3855 8.1066 126.9521 51.9836 43.9038 174.4567 152 P 4.5561 0.0000 0.0000 62.7923 32.2382 175.7406 153 T 4.6244 8.9509 117.9480 62.3784 70.3605 174.4503 154 K 4.6452 8.4032 123.3023 53.6890 36.2942 174.5456 155 P 4.2789 0.0000 0.0000 63.0382 31.9102 176.5078 156 F 4.5847 7.9968 114.8907 57.0229 37.9139 175.1668 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 4.38 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.48 3.56 1.88 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 1.42 1.05 0.91 0.00 0.00 3 Q 8.46 4.91 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.47 2.26 0.00 4 S 8.58 5.17 0.00 3.80 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 5 Q 8.73 4.86 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.73 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 6 I 8.38 4.43 1.87 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 1.30 0.66 0.91 0.00 0.00 7 N 7.85 4.84 0.00 2.76 2.68 0.00 0.00 6.94 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 8 R 8.59 3.95 0.00 2.06 2.31 0.00 3.11 0.00 0.00 3.32 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 9 N 8.32 4.35 0.00 2.79 2.91 0.00 0.00 6.86 6.81 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 10 I 7.45 3.70 1.87 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 1.64 1.69 0.91 0.00 0.00 11 R 7.88 4.00 0.00 1.81 1.96 0.00 3.29 0.00 0.00 3.43 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 12 L 8.27 4.18 0.00 1.67 1.71 0.91 1.30 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 13 D 8.27 4.35 0.00 2.95 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 14 L 7.81 3.89 0.00 1.72 1.86 0.93 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.31 4.24 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 16 D 8.14 4.35 0.00 2.91 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 17 A 7.87 4.02 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 18 I 8.25 3.66 2.07 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 1.54 0.91 0.96 0.00 0.00 19 L 8.08 3.96 0.00 1.73 1.75 0.99 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.84 3.94 0.00 1.78 1.80 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.05 4.02 0.00 3.99 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 22 K 8.66 3.70 0.00 1.81 1.87 0.00 0.99 0.00 0.00 1.10 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.27 1.22 7.81 23 A 7.76 3.91 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 24 K 7.90 3.80 0.00 1.95 1.90 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.62 7.81 25 K 7.96 4.18 0.00 1.77 1.82 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.42 1.41 7.81 26 D 7.80 4.35 0.00 2.79 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 4.36 0.00 1.53 1.45 0.93 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 28 S 7.95 4.67 0.00 4.00 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 29 F 8.41 4.23 0.00 3.20 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.14 4.10 1.42 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 0.00 0.00 31 E 8.01 4.03 0.00 2.17 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 2.41 2.30 0.00 32 I 7.52 3.84 1.93 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.60 0.96 0.00 0.00 33 A 8.18 4.24 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.23 4.45 0.00 2.77 2.73 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 35 G 9.09 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 36 T 7.54 4.08 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 1.36 0.00 0.00 37 G 8.36 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.47 4.62 0.00 1.67 1.62 1.02 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.61 4.00 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 40 E 9.12 3.87 0.00 2.08 2.03 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 2.45 2.50 0.00 41 A 7.98 3.95 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 42 F 8.15 3.83 0.00 3.19 3.24 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 43 V 7.95 3.72 2.18 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 1.07 0.00 0.00 1.14 0.00 0.00 44 T 8.00 3.78 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 0.41 0.00 0.00 45 A 8.04 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 46 A 7.68 4.27 1.22 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 0.00 0.00 0.00 47 L 8.14 4.04 0.00 1.94 1.83 1.16 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.57 4.62 0.00 1.55 1.63 0.75 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 49 G 7.91 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 0.00 0.00 0.00 50 Q 8.27 4.49 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.22 6.64 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 51 Q 7.43 4.41 0.00 1.41 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.89 0.00 0.00 0.00 0.00 0.00 1.96 1.27 0.00 52 A 8.25 5.00 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 53 L 8.75 4.50 0.00 1.66 1.72 0.97 1.19 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 54 P 0.00 4.57 0.00 2.09 1.98 0.00 3.67 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 55 A 8.76 3.91 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 56 D 8.07 4.30 0.00 2.71 2.73 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 57 A 7.99 3.96 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 58 A 8.70 3.96 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.36 3.89 0.00 2.03 2.01 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 60 L 8.11 3.96 0.00 1.96 1.79 0.93 1.19 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 61 V 8.27 3.84 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 0.84 0.00 0.00 0.96 0.00 0.00 62 G 8.29 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 63 A 8.10 3.98 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 64 K 7.78 4.05 0.00 1.71 1.88 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.68 7.81 65 L 7.35 4.47 0.00 1.64 1.65 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.47 4.35 0.00 2.69 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 67 L 8.27 4.51 0.00 1.58 1.59 0.93 1.05 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 68 D 8.22 4.69 0.00 2.95 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 69 E 8.55 4.16 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 2.40 2.34 0.00 70 D 8.06 4.36 0.00 2.72 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 71 S 9.18 4.11 0.00 4.03 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 72 I 7.41 3.71 1.88 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 1.58 0.47 0.92 0.00 0.00 73 L 7.84 4.25 0.00 1.91 1.88 0.93 0.64 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 74 L 8.07 3.97 0.00 1.92 1.71 0.92 0.47 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 75 L 8.10 3.96 0.00 1.89 1.76 0.94 0.95 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 Q 7.62 4.58 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.83 0.00 0.00 0.00 0.00 0.00 2.52 2.41 0.00 77 M 7.51 4.46 0.00 1.90 2.09 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.53 0.00 78 I 8.87 4.00 1.87 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 1.30 0.73 0.92 0.00 0.00 79 P 0.00 4.73 0.00 2.13 2.02 0.00 3.74 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 1.94 2.11 0.00 80 L 8.32 4.27 0.00 1.67 1.65 0.91 0.92 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 81 R 8.63 4.25 0.00 1.81 1.79 0.00 3.30 0.00 0.00 3.19 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 82 G 7.99 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 83 C 7.95 4.31 0.00 3.06 3.02 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 84 I 7.48 4.04 1.85 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 1.30 0.54 0.91 0.00 0.00 85 D 8.93 4.51 0.00 2.62 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 86 D 7.37 4.63 0.00 2.60 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 87 R 8.18 4.28 0.00 1.96 2.05 0.00 3.37 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 1.49 1.56 0.00 88 I 7.13 4.04 1.74 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.72 0.65 0.00 0.00 89 P 0.00 4.42 0.00 2.27 2.06 0.00 3.48 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 90 T 8.33 4.13 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 1.18 0.00 0.00 91 D 7.99 4.54 0.00 2.85 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 92 P 0.00 4.24 0.00 2.23 2.15 0.00 3.69 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 93 T 7.96 3.95 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 1.36 0.00 0.00 94 M 8.38 4.50 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.61 0.00 95 Y 9.12 4.12 0.00 3.11 3.26 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 96 K 8.02 3.91 0.00 1.50 1.50 0.00 1.67 0.00 0.00 1.57 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.58 1.57 7.81 97 F 7.74 4.12 0.00 3.27 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 98 Y 8.00 3.98 0.00 2.98 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 7.96 3.63 0.00 1.73 1.93 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 2.26 2.36 0.00 100 M 8.14 4.08 0.00 2.16 2.34 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.62 0.00 101 L 7.48 4.04 0.00 1.44 1.55 0.94 0.77 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 0.00 102 Q 7.49 3.82 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.88 0.00 0.00 0.00 0.00 0.00 1.73 2.37 0.00 103 V 7.64 3.65 1.76 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 0.80 0.00 0.00 104 Y 8.06 4.65 0.00 3.23 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 0.00 105 G 7.89 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 0.00 0.00 0.00 106 T 7.82 4.02 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 1.20 0.00 0.00 107 T 7.85 3.96 4.58 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 1.32 0.00 0.00 108 L 8.46 4.00 0.00 1.84 1.73 0.96 0.97 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 0.00 109 K 8.03 3.80 0.00 1.86 1.95 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.44 7.81 110 A 8.32 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 L 8.35 4.05 0.00 1.77 1.75 0.94 0.96 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 0.00 112 V 8.06 3.80 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 1.05 0.00 0.00 0.98 0.00 0.00 113 H 8.19 4.92 0.00 3.27 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 7.79 3.89 0.00 2.03 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 2.29 2.33 0.00 115 K 7.88 3.90 0.00 1.79 1.12 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.28 1.38 7.81 116 F 8.95 4.14 0.00 2.31 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 0.00 117 G 7.80 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 D 8.98 4.56 0.00 2.75 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 7.89 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 0.00 0.00 0.00 0.00 120 I 7.58 4.81 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.81 0.93 0.00 0.00 121 I 8.12 4.72 1.83 0.00 0.00 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 1.10 0.70 0.98 0.00 0.00 122 S 9.13 4.16 0.00 3.90 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 0.00 123 A 8.53 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.71 4.26 1.87 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 1.26 0.97 0.93 0.00 0.00 125 N 7.84 4.78 0.00 2.82 2.75 0.00 0.00 6.75 7.82 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 0.00 126 F 8.03 5.28 0.00 3.15 2.83 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 0.00 0.00 0.00 0.00 127 K 8.20 4.61 0.00 1.62 1.71 0.00 1.23 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.16 1.14 7.81 128 L 8.24 5.50 0.00 1.63 1.37 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.47 4.86 0.00 2.65 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.37 4.61 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 0.88 0.00 0.00 0.91 0.00 0.00 131 K 8.73 4.68 0.00 1.75 1.68 0.00 1.78 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.35 7.81 132 K 8.59 4.69 0.00 1.79 1.72 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.45 7.81 133 V 8.83 4.43 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 0.93 0.00 0.00 0.94 0.00 0.00 134 A 8.78 4.51 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 D 9.67 4.57 0.00 2.59 2.75 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 0.00 136 P 0.00 4.17 0.00 2.07 2.14 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 137 E 8.18 4.18 0.00 1.96 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 2.30 2.30 0.00 138 G 9.07 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 0.00 139 G 8.72 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 0.00 0.00 0.00 140 E 8.60 4.96 0.00 1.81 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.36 0.00 141 R 9.07 4.76 0.00 1.83 1.78 0.00 3.42 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 142 A 8.59 4.90 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 0.00 143 V 8.98 4.19 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 0.97 0.00 0.00 0.94 0.00 0.00 144 I 8.25 4.93 1.99 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 1.52 0.64 0.93 0.00 0.00 145 T 8.70 4.63 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 1.18 0.00 0.00 146 L 8.61 4.79 0.00 1.62 1.92 1.01 1.16 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 0.00 147 D 8.56 4.74 0.00 2.61 2.41 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 0.00 148 G 8.56 4.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 K 9.08 4.33 0.00 1.87 1.71 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.44 7.81 150 Y 8.49 4.91 0.00 2.40 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 0.00 151 L 8.11 4.39 0.00 1.44 1.39 0.86 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.56 0.00 2.05 2.00 0.00 3.44 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.92 0.00 153 T 8.95 4.62 4.35 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 1.26 0.00 0.00 154 K 8.40 4.65 0.00 1.71 1.68 0.00 1.79 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.47 7.81 155 P 0.00 4.28 0.00 2.02 1.93 0.00 3.64 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 2.03 2.07 0.00 156 F 8.00 4.58 0.00 3.08 2.92 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