NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 N 4.6699 8.2827 118.2162 52.9580 38.2814 174.2275 18 R 3.6457 8.3451 114.3212 59.1413 30.0073 177.5565 19 A 4.1182 8.2338 120.4512 54.7319 18.7347 179.0204 20 G 3.4601 7.9466 104.4022 47.4265 0.0000 176.1652 21 R 3.9414 7.9651 121.1455 59.2297 29.9642 178.4778 22 Q 4.0506 8.3379 117.3399 58.0724 28.7219 178.2495 23 A 3.9931 7.4385 122.0914 55.0001 18.5368 179.6225 24 R 3.8855 8.0039 116.6038 59.5102 30.0458 179.4285 25 I 3.6298 7.7924 119.3445 64.5006 37.0671 178.4320 26 V 3.5391 7.9753 118.9796 66.0896 30.9303 177.9664 27 A 3.9470 7.8315 119.4132 55.3218 18.6723 179.0617 28 I 3.7774 8.1727 118.5551 64.7309 37.0155 178.7388 29 L 4.0550 8.1905 119.9133 57.6718 41.3110 178.8904 30 S 4.6438 7.5418 110.8194 58.7688 63.1271 174.5582 31 S 4.5450 7.9401 114.7497 57.5604 64.2429 172.7505 32 A 4.7982 7.9116 122.6659 50.5008 21.7007 175.4863 33 Q 4.4340 8.3756 116.2207 54.2190 29.4126 174.3306 34 V 4.7741 7.9680 121.5863 61.0867 32.4700 176.5055 35 R 4.7813 8.8457 124.8356 56.2068 31.9637 176.0859 36 S 4.8642 7.5342 111.8124 56.3257 66.8816 175.2810 37 Q 3.8743 8.6418 121.9742 59.1741 28.6106 178.4135 38 N 4.3032 8.2381 117.0811 56.4429 38.6551 176.7870 39 E 3.9255 8.1150 120.1190 59.2611 29.7693 178.6973 40 L 4.0197 7.8796 119.6341 57.5468 41.9523 178.7301 41 A 3.8719 7.9934 121.0125 55.1070 18.4095 179.1178 42 A 3.9323 7.9418 118.8216 55.5008 18.2773 179.8172 43 L 3.9411 7.8842 117.0520 58.0740 41.7327 179.8201 44 L 4.0177 7.9689 118.5916 57.2689 41.4575 179.4094 45 A 4.5912 8.6331 122.5472 54.6664 18.1349 179.3139 46 A 3.9937 7.8412 118.0185 55.4474 18.4919 179.0229 47 E 4.2641 7.5738 113.4441 56.9613 29.4030 176.0759 48 G 4.2209 8.2713 109.8129 45.9423 0.0000 175.2634 49 I 3.7904 7.6866 120.7449 60.9326 37.5759 174.8667 50 E 4.6901 8.6456 123.9310 54.7143 31.1466 175.7741 51 V 4.4788 7.9857 116.1554 58.9861 36.0152 175.7694 52 T 4.4013 8.0196 113.0229 60.5138 71.9547 175.5426 53 Q 3.8843 8.4584 120.1737 59.1069 28.9887 177.3407 54 A 3.9649 8.1001 121.5090 55.9576 18.2915 179.7171 55 T 3.8504 7.3587 111.3125 66.5836 68.4487 177.1288 56 L 3.9145 7.7213 120.5153 57.7724 41.5595 179.3358 57 S 4.0133 8.4694 113.3951 61.5187 62.1879 176.5020 58 R 3.8894 7.9063 120.4838 59.3654 29.7637 178.8211 59 D 4.3031 8.5157 118.8949 57.4339 40.8035 178.8566 60 L 3.8538 8.5136 119.8870 57.6275 41.3333 179.0983 61 E 3.9359 8.1706 118.5397 59.4694 29.6390 178.5660 62 E 4.1102 8.0995 117.3953 59.4348 29.6311 178.9885 63 L 4.1725 8.3997 118.6327 55.7575 41.6457 178.2573 64 G 3.8269 8.4093 105.6958 45.4771 0.0000 173.1124 65 A 4.4538 7.9309 120.6323 51.9082 19.1993 178.3410 66 V 4.4890 8.8228 114.5327 59.2309 35.8513 175.0426 67 K 4.1858 8.5327 125.9141 55.8892 32.4800 175.7557 68 L 4.9217 8.5527 128.5375 53.3937 44.5315 175.8355 69 R 4.6482 8.2258 115.6190 56.0414 32.2044 174.6491 70 G 4.0429 8.1298 109.2145 43.6683 0.0000 172.3650 71 A 4.1450 8.4554 122.0250 53.7759 18.5643 177.1885 72 D 4.4080 8.7370 121.4750 55.4708 38.5141 174.4705 73 G 3.8572 8.0237 104.9936 44.7104 0.0000 176.9196 74 G 3.7945 7.8488 108.2875 45.3382 0.0000 173.2099 75 T 3.8245 8.4996 117.5972 63.4233 68.7119 174.4733 76 G 4.4498 8.4785 114.2378 47.1993 0.0000 171.9610 77 I 4.8730 7.8958 112.0862 58.8026 40.7926 174.6640 78 Y 4.7073 8.8821 122.6907 58.4141 38.4999 175.8252 79 V 4.6227 8.9717 115.8901 59.8919 36.7125 174.6211 80 V 4.5434 8.2686 117.2933 58.7448 33.2083 174.3413 81 P 4.4148 0.0000 0.0000 62.9230 32.2402 176.4028 82 E 4.4676 8.5133 120.3390 56.4826 29.3233 177.6582 83 D 4.3804 8.1574 115.3316 54.9802 40.0465 174.8990 84 G 3.7523 8.0522 109.0363 44.7648 0.0000 174.2383 85 S 4.3884 8.3769 120.1142 57.3505 63.7414 172.0937 86 P 4.4413 0.0000 0.0000 62.5181 31.0700 176.8383 87 V 3.4529 7.6751 111.6660 64.6703 31.8787 177.4298 88 R 4.4636 7.6807 118.1944 55.5867 32.4896 176.0569 89 G 3.7163 8.0113 106.9942 44.2614 0.0000 173.9870 90 V 3.6514 8.2405 120.3589 61.2405 31.1901 176.8636 91 S 4.4437 8.6892 118.2033 59.0103 62.3746 174.4542 92 G 4.1426 7.6895 105.5995 45.3567 0.0000 176.8736 93 G 3.5961 7.9835 109.2652 47.9189 0.0000 175.5532 94 T 3.9460 7.8209 118.0615 66.3771 68.4635 176.4960 95 D 4.3326 7.9228 120.4380 57.2930 40.9309 178.6350 96 R 3.8691 7.9077 118.9194 59.3357 29.9917 178.3091 97 M 3.9540 8.1095 117.9530 58.4492 32.2536 177.9347 98 A 3.9785 8.2148 121.2055 55.2210 18.5801 179.4442 99 R 3.8212 8.1313 117.2073 59.8199 30.0933 178.7918 100 L 4.0215 8.0325 118.5581 57.3635 41.5054 179.3806 101 L 4.0397 8.6916 119.7762 57.8403 41.3878 179.6373 102 G 3.6770 8.2263 104.6689 47.9343 0.0000 174.8904 103 E 4.1938 8.0544 120.4997 57.8800 29.8875 177.1060 104 L 4.6136 8.0886 116.4225 53.9317 43.9927 175.7594 105 L 4.1608 8.0139 121.2438 54.9944 41.9580 176.0940 106 V 4.1616 8.6887 127.6931 65.0234 32.5509 175.5866 107 S 4.7963 7.5547 112.6508 57.8460 66.1249 173.3128 108 T 5.1547 8.1381 109.2357 60.6915 72.1301 172.0024 109 D 4.7089 8.6047 121.1875 54.4643 45.4155 173.0932 110 D 5.0434 8.2871 117.5357 53.1990 42.0996 175.4046 111 S 4.3505 9.5176 112.1320 58.5735 66.8476 175.0270 112 G 4.0320 8.2369 118.1421 47.2801 0.0000 174.0189 113 N 4.7264 8.8118 123.0306 52.4362 37.5277 173.4832 114 L 5.2818 8.1778 119.9370 53.2675 44.5936 175.1428 115 A 5.1104 8.8430 125.1031 50.2929 21.9392 175.7557 116 V 4.7401 8.7419 121.6557 61.1714 34.1596 174.2168 117 L 5.0271 8.9124 128.6460 53.2043 44.0238 175.7639 118 R 5.2108 8.7864 122.3396 54.7756 32.8052 175.2360 119 T 5.2491 8.5843 111.8069 57.7908 73.2060 171.1758 120 P 4.4509 0.0000 0.0000 61.6896 32.6556 174.6460 121 P 4.2976 0.0000 0.0000 64.7536 31.5017 176.9742 122 G 3.9223 8.7587 110.9798 45.8071 0.0000 174.1830 123 A 4.5526 7.9842 120.2518 52.2526 19.2368 178.6940 124 A 3.9578 7.8504 120.6474 55.3786 18.4492 179.8265 125 H 4.1085 8.2123 114.3494 59.0573 28.4211 177.2022 126 Y 4.3353 8.0622 120.9114 60.6747 38.7246 177.7932 127 L 3.7164 8.0394 121.0199 58.0751 42.1958 178.6835 128 A 3.9430 8.3926 121.1593 55.1740 18.2054 179.5665 129 S 4.0094 8.2581 111.5131 61.5115 62.2551 176.2997 130 A 4.0004 7.4141 121.9165 55.0400 18.1451 179.4245 131 I 3.8836 7.7347 118.5450 64.4601 37.0800 178.3221 132 D 4.3873 8.2834 119.8782 57.5519 40.5213 178.7239 133 R 3.8645 7.7826 117.3911 59.4900 30.0438 177.8698 134 A 4.0510 7.6948 118.5989 52.1698 19.5855 176.7691 135 A 3.7270 8.0318 120.2168 53.0056 16.8328 177.5410 136 L 4.1635 7.3807 121.6165 53.8069 42.9068 177.6073 137 P 4.2562 0.0000 0.0000 65.4158 31.5518 177.1746 138 Q 4.2954 8.0106 113.9765 56.0051 28.9977 174.3537 139 V 4.5902 7.4466 119.6087 61.7199 32.2566 175.7345 140 V 3.8069 9.0344 129.4823 65.6359 32.2576 175.6044 141 G 4.2048 7.3605 105.3941 46.1311 0.0000 172.0905 142 T 5.3106 8.5699 109.0267 59.7930 72.1258 173.4053 143 I 4.6121 8.5648 122.9579 59.5295 40.6612 174.1248 144 A 4.8765 8.6463 128.5837 49.2496 20.4019 175.7979 145 G 4.1639 8.7635 114.7269 45.6736 0.0000 174.3572 146 D 4.6500 8.9499 122.3040 55.5107 41.8648 176.7219 147 D 5.1468 7.8513 114.5793 51.8609 41.3993 174.8024 148 T 5.0998 7.8151 115.4617 62.1032 72.8525 172.6486 149 I 4.8438 8.7934 126.0371 59.3691 41.0135 174.0590 150 L 4.8817 8.8542 129.3069 53.6817 43.8298 175.0430 151 V 4.8126 8.9059 126.7522 61.0897 34.3442 174.1766 152 V 4.5699 8.7166 128.3357 61.6781 32.7421 174.7914 153 A 4.7486 8.9508 130.9969 51.5869 19.7842 176.6553 154 R 4.1830 8.8683 122.8906 55.3174 31.2284 175.8444 155 E 4.1255 8.9799 126.0270 56.9186 29.8959 175.1496 156 P 4.7192 0.0000 0.0000 62.4958 31.9339 175.6886 157 T 4.0547 7.4605 115.8209 64.9431 69.0042 174.3796 158 T 4.6100 8.7273 116.2989 60.2484 72.1511 176.3148 159 G 3.6752 8.9200 108.5920 47.8947 0.0000 176.0075 160 A 4.1041 7.9156 122.5341 55.0671 18.4510 179.5848 161 Q 3.9201 8.1682 116.6561 58.9350 28.7172 178.7705 162 L 3.7870 8.0601 121.1399 57.9794 42.0890 178.7049 163 A 4.3105 8.6863 121.2877 55.4268 18.2627 179.9310 164 G 3.4093 8.3217 104.1753 47.8825 0.0000 175.5470 165 M 3.9122 7.9363 119.8646 58.6114 32.3738 178.1366 166 F 4.4161 8.1167 117.9108 60.4562 39.0397 177.2288 167 E 4.0859 9.0419 118.9712 59.8084 29.0686 179.5213 168 N 4.9303 8.0382 111.3597 53.7854 38.3477 175.7929 169 L 4.7105 8.0614 119.8874 54.1149 44.3970 176.6722 170 R 4.0799 7.6369 123.1930 56.8236 29.8933 175.6670 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 17 N 8.28 4.67 0.00 2.88 2.97 0.00 0.00 5.77 6.77 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 18 R 8.35 3.65 0.00 1.97 1.92 0.00 3.18 0.00 0.00 3.33 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 19 A 8.23 4.12 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 20 G 7.95 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 7.97 3.94 0.00 2.04 2.05 0.00 3.07 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 22 Q 8.34 4.05 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.61 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 23 A 7.44 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 24 R 8.00 3.89 0.00 2.03 1.99 0.00 3.29 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.82 0.00 25 I 7.79 3.63 1.96 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.67 0.86 0.00 0.00 26 V 7.98 3.54 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 1.01 0.00 0.00 0.99 0.00 0.00 27 A 7.83 3.95 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 8.17 3.78 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.85 0.91 0.00 0.00 29 L 8.19 4.05 0.00 1.70 1.75 0.95 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 30 S 7.54 4.64 0.00 3.98 3.97 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 31 S 7.94 4.55 0.00 3.91 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 32 A 7.91 4.80 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 33 Q 8.38 4.43 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 34 V 7.97 4.77 2.22 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 1.47 0.00 0.00 0.97 0.00 0.00 35 R 8.85 4.78 0.00 2.00 1.94 0.00 3.30 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.59 0.00 36 S 7.53 4.86 0.00 4.07 3.97 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 37 Q 8.64 3.87 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.89 0.00 0.00 0.00 0.00 0.00 2.18 2.32 0.00 38 N 8.24 4.30 0.00 2.74 2.89 0.00 0.00 6.75 7.66 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 39 E 8.12 3.93 0.00 2.10 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 2.33 2.33 0.00 40 L 7.88 4.02 0.00 1.77 1.75 0.88 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 41 A 7.99 3.87 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 42 A 7.94 3.93 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 43 L 7.88 3.94 0.00 1.91 1.73 0.93 0.62 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 44 L 7.97 4.02 0.00 1.85 1.69 0.92 1.03 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 45 A 8.63 4.59 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 46 A 7.84 3.99 1.36 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 47 E 7.57 4.26 0.00 2.06 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 2.34 2.45 0.00 48 G 8.27 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 0.00 0.00 0.00 0.00 49 I 7.69 3.79 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.72 0.90 0.00 0.00 50 E 8.65 4.69 0.00 1.90 1.85 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 2.18 2.27 0.00 51 V 7.99 4.48 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 0.73 0.00 0.00 0.91 0.00 0.00 52 T 8.02 4.40 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 53 Q 8.46 3.88 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.53 2.37 0.00 54 A 8.10 3.96 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 55 T 7.36 3.85 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 1.22 0.00 0.00 56 L 7.72 3.91 0.00 1.75 1.60 0.90 0.84 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 57 S 8.47 4.01 0.00 4.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 R 7.91 3.89 0.00 2.06 1.95 0.00 3.17 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 59 D 8.52 4.30 0.00 2.70 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 60 L 8.51 3.85 0.00 1.55 1.63 0.32 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 61 E 8.17 3.94 0.00 2.11 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 0.00 2.33 2.51 0.00 62 E 8.10 4.11 0.00 2.07 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 2.33 2.64 0.00 63 L 8.40 4.17 0.00 1.84 1.74 0.96 1.07 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 64 G 8.41 3.83 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 0.00 0.00 0.00 65 A 7.93 4.45 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 66 V 8.82 4.49 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 0.71 0.00 0.00 1.01 0.00 0.00 67 K 8.53 4.19 0.00 1.28 1.49 0.00 1.11 0.00 0.00 1.46 0.00 0.00 2.69 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.05 0.75 7.81 68 L 8.55 4.92 0.00 1.59 1.50 0.89 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.23 4.65 0.00 1.73 1.80 0.00 2.97 0.00 0.00 3.43 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.56 0.00 70 G 8.13 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 71 A 8.46 4.15 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.74 4.41 0.00 2.79 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 73 G 8.02 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.85 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 0.00 0.00 0.00 75 T 8.50 3.82 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 76 G 8.48 4.45 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 0.00 77 I 7.90 4.87 1.97 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 1.33 1.30 0.91 0.00 0.00 78 Y 8.88 4.71 0.00 2.86 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 79 V 8.97 4.62 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 0.75 0.00 0.00 0.95 0.00 0.00 80 V 8.27 4.54 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 0.76 0.00 0.00 0.94 0.00 0.00 81 P 0.00 4.41 0.00 2.04 2.13 0.00 3.68 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 82 E 8.51 4.47 0.00 2.07 1.92 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 2.33 2.38 0.00 83 D 8.16 4.38 0.00 2.82 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.05 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 0.00 0.00 0.00 85 S 8.38 4.39 0.00 3.87 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 86 P 0.00 4.44 0.00 2.27 1.98 0.00 3.72 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 2.03 2.10 0.00 87 V 7.68 3.45 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 0.70 0.00 0.00 0.93 0.00 0.00 88 R 7.68 4.46 0.00 1.72 1.91 0.00 3.25 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 89 G 8.01 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 90 V 8.24 3.65 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 0.84 0.00 0.00 0.94 0.00 0.00 91 S 8.69 4.44 0.00 3.83 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 G 7.69 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 7.98 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.82 3.95 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 95 D 7.92 4.33 0.00 2.68 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 96 R 7.91 3.87 0.00 1.92 2.12 0.00 3.10 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 97 M 8.11 3.95 0.00 2.28 2.26 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 2.63 2.62 0.00 98 A 8.21 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 99 R 8.13 3.82 0.00 1.88 2.08 0.00 3.11 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 100 L 8.03 4.02 0.00 1.59 1.50 0.23 0.37 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 0.00 101 L 8.69 4.04 0.00 1.83 1.76 1.16 1.03 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 0.00 102 G 8.23 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 0.00 103 E 8.05 4.19 0.00 2.01 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 104 L 8.09 4.61 0.00 1.74 1.62 0.96 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.01 4.16 0.00 1.82 1.60 1.01 0.76 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 0.00 106 V 8.69 4.16 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 0.83 0.00 0.00 0.97 0.00 0.00 107 S 7.55 4.80 0.00 3.90 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 T 8.14 5.15 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 1.25 0.00 0.00 109 D 8.60 4.71 0.00 2.73 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 0.00 110 D 8.29 5.04 0.00 2.71 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.52 4.35 0.00 3.80 3.71 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 0.00 112 G 8.24 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 0.00 113 N 8.81 4.73 0.00 2.89 3.05 0.00 0.00 5.79 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 0.00 114 L 8.18 5.28 0.00 1.70 1.59 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.84 5.11 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.74 4.74 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 0.95 0.00 0.00 0.93 0.00 0.00 117 L 8.91 5.03 0.00 1.42 1.37 0.03 0.41 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 0.00 118 R 8.79 5.21 0.00 1.68 1.79 0.00 3.34 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 119 T 8.58 5.25 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 1.17 0.00 0.00 120 P 0.00 4.45 0.00 2.11 2.02 0.00 3.65 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 121 P 0.00 4.30 0.00 2.04 2.04 0.00 3.70 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 2.04 2.12 0.00 122 G 8.76 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 0.00 123 A 7.98 4.55 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 0.00 124 A 7.85 3.96 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 0.00 125 H 8.21 4.11 0.00 3.23 3.41 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 0.00 126 Y 8.06 4.34 0.00 2.91 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 L 8.04 3.72 0.00 1.73 1.56 0.81 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.39 3.94 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 0.00 129 S 8.26 4.01 0.00 3.99 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 0.00 130 A 7.41 4.00 1.17 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 0.00 0.00 0.00 131 I 7.73 3.88 2.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.77 1.04 0.00 0.00 132 D 8.28 4.39 0.00 2.89 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 R 7.78 3.86 0.00 1.92 1.98 0.00 3.31 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 134 A 7.69 4.05 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 A 8.03 3.73 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 0.00 136 L 7.38 4.16 0.00 1.73 1.80 0.92 1.03 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 0.00 137 P 0.00 4.26 0.00 2.02 2.11 0.00 3.64 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 138 Q 8.01 4.30 0.00 2.17 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.87 0.00 0.00 0.00 0.00 0.00 2.30 2.19 0.00 139 V 7.45 4.59 2.13 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 0.83 0.00 0.00 1.04 0.00 0.00 140 V 9.03 3.81 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 0.78 0.00 0.00 0.97 0.00 0.00 141 G 7.36 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 0.00 0.00 0.00 0.00 142 T 8.57 5.31 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 1.27 0.00 0.00 143 I 8.56 4.61 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 1.15 1.09 0.90 0.00 0.00 144 A 8.65 4.88 0.93 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 0.00 145 G 8.76 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 0.00 146 D 8.95 4.65 0.00 2.70 2.66 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 0.00 147 D 7.85 5.15 0.00 2.92 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 0.00 148 T 7.82 5.10 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 0.00 149 I 8.79 4.84 1.73 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.66 0.87 0.00 0.00 150 L 8.85 4.88 0.00 1.72 1.51 0.91 0.64 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 0.00 151 V 8.91 4.81 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 1.09 0.00 0.00 0.78 0.00 0.00 152 V 8.72 4.57 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 0.95 0.00 0.00 0.94 0.00 0.00 153 A 8.95 4.75 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 0.00 154 R 8.87 4.18 0.00 1.90 1.82 0.00 3.13 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 155 E 8.98 4.13 0.00 1.99 1.90 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 2.33 2.33 0.00 156 P 0.00 4.72 0.00 2.16 2.13 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.96 0.00 157 T 7.46 4.05 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 1.24 0.00 0.00 158 T 8.73 4.61 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 1.21 0.00 0.00 159 G 8.92 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 0.00 160 A 7.92 4.10 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 0.00 161 Q 8.17 3.92 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 162 L 8.06 3.79 0.00 1.94 1.91 0.79 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 0.00 163 A 8.69 4.31 1.48 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 0.00 0.00 164 G 8.32 3.41 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 0.00 165 M 7.94 3.91 0.00 1.79 2.02 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 166 F 8.12 4.42 0.00 3.26 2.99 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 0.00 167 E 9.04 4.09 0.00 2.21 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 2.48 2.56 0.00 168 N 8.04 4.93 0.00 2.67 2.83 0.00 0.00 6.87 8.20 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 0.00 169 L 8.06 4.71 0.00 1.79 1.68 0.92 0.76 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 0.00 170 R 7.64 4.08 0.00 1.83 1.96 0.00 3.44 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.63 0.00