NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2075 8.1727 122.0498 56.2606 34.1153 173.8485 2 V 4.7375 8.1580 126.6680 60.6866 32.8353 174.5070 3 F 4.5602 9.9662 128.7205 57.5312 40.3285 174.7049 4 E 4.2327 9.1273 121.0680 55.5163 30.9727 176.6938 5 R 3.3746 9.0663 120.1904 61.0840 30.0780 179.1786 6 C 4.3167 8.0969 115.5015 59.7838 40.2529 175.8078 7 E 3.9199 8.1358 120.6385 59.2680 29.3097 178.5367 8 L 3.5521 7.9669 120.0913 57.7388 42.0571 178.4465 9 A 3.9224 7.8509 120.7657 55.6054 18.2827 179.9818 10 R 3.9378 8.0555 116.2260 59.4309 29.5435 179.4933 11 T 3.8594 7.8659 115.7184 66.6610 68.5289 176.7193 12 L 3.8763 8.2008 121.3104 57.4329 41.5853 179.5009 13 K 3.9182 8.0458 119.6133 59.6620 32.0130 179.1534 14 R 4.0346 7.9921 116.6426 58.3744 29.9313 177.8985 15 L 4.4738 7.1515 116.5554 53.7978 41.8092 176.5670 16 G 3.8393 7.9035 106.6990 46.9709 0.0000 174.9452 17 M 3.8959 7.6808 120.6379 56.3951 32.5926 174.9375 18 D 4.4059 7.9520 117.1981 56.7370 40.3402 175.4509 19 G 3.9702 9.4483 115.2944 45.0042 0.0000 170.7943 20 Y 4.1240 8.2377 121.6938 58.6343 38.8992 176.2966 21 R 3.3326 8.9658 126.6729 57.2851 27.7649 177.3382 22 G 3.8044 8.2710 103.8115 45.7165 0.0000 174.3154 23 I 3.9979 7.5390 122.1753 59.3569 37.4538 175.9391 24 S 4.6161 8.3426 120.4408 57.7370 63.8364 174.9598 25 L 4.2418 8.7995 122.7690 58.5694 41.7008 179.1781 26 A 4.1317 8.1965 120.1159 55.4125 18.1977 179.2436 27 N 4.4180 8.1161 114.4791 56.3292 38.6163 177.6906 28 W 4.2600 8.0645 119.8393 60.0512 29.1982 178.2663 29 M 4.1251 8.5689 118.9831 58.6498 31.4488 178.0531 30 C 3.3693 8.1492 118.5968 59.0061 44.9094 175.2923 31 L 3.9637 8.2905 121.9559 58.2508 41.7663 178.6904 32 A 4.2199 8.2656 122.0343 54.3620 18.2807 179.3562 33 K 3.0655 8.1103 117.9181 59.4704 32.0737 179.0330 34 W 4.2050 7.7923 116.7781 58.8064 29.0680 178.1290 35 E 4.4153 8.2335 118.6440 58.3252 29.2962 177.4285 36 S 4.5066 7.9987 109.1809 56.6417 64.8763 174.5141 37 G 3.2588 8.2455 108.9258 47.0038 0.0000 173.5293 38 Y 3.6472 7.8259 113.6782 58.5658 35.0181 168.3420 39 N 5.3244 7.5887 119.5158 52.0790 39.5679 175.5149 40 T 4.0889 8.8408 117.5425 63.2498 69.8802 175.7896 41 R 4.8893 8.1022 117.9409 55.8138 30.4418 176.0094 42 A 4.3985 7.8728 122.8571 52.7459 19.3238 177.6029 43 T 5.0514 8.3608 111.1730 60.0881 72.6045 172.9969 44 N 4.9070 8.7465 121.2308 52.5258 42.8199 172.3203 45 Y 4.7992 8.7671 127.5324 56.7146 40.9766 173.7944 46 N 4.7534 8.2536 124.3673 51.2081 39.2860 175.3814 47 A 3.6773 8.3482 128.0037 54.7766 18.9069 179.0726 48 G 3.7038 8.0530 104.3627 48.5221 0.0000 174.0844 49 D 4.7096 7.8974 117.9416 51.5358 39.5530 176.4064 50 R 3.9603 7.7205 116.9839 56.6390 28.3341 175.6793 51 S 4.9026 7.1936 111.9492 57.1952 66.6035 172.5224 52 T 5.1267 8.8972 114.5658 62.3742 73.2845 172.9157 53 D 5.5499 9.0285 124.3888 53.0347 43.6354 175.1215 54 Y 5.1028 9.1073 120.0681 57.5167 42.1620 177.0796 55 G 4.2030 9.1319 111.3880 45.4205 0.0000 173.6204 56 I 4.1438 8.0803 116.3571 62.8605 37.9073 177.5466 57 F 4.8383 7.9708 115.6981 56.3422 39.8909 175.3294 58 Q 3.5566 8.0087 119.1682 57.0760 26.5795 174.0972 59 I 4.4188 8.1422 119.0741 60.9860 39.2818 176.9060 60 N 5.3643 9.2256 126.0142 53.5078 39.8207 175.6328 61 S 4.5916 9.2247 120.4869 60.4868 63.3713 175.3712 62 R 3.7352 9.1314 122.5916 58.7134 30.3373 177.7103 63 Y 4.3078 7.6543 114.3185 57.5449 40.6692 176.8171 64 W 5.0562 8.0812 118.9392 57.7335 31.1469 173.9137 65 C 5.5671 8.1526 111.7087 53.9338 46.1684 172.8094 66 N 5.0383 9.0621 118.8862 51.8201 40.1902 174.5524 67 D 4.7677 8.6501 123.7223 52.1549 40.2600 176.4239 68 G 3.9641 8.4363 106.3395 46.4379 0.0000 174.3613 69 K 4.5162 8.3515 115.8142 56.3097 33.4828 176.0239 70 T 4.6254 7.6171 116.4862 60.6093 68.9429 172.1832 71 P 4.0886 0.0000 0.0000 64.0776 31.5786 176.5626 72 G 3.8146 8.7427 110.8888 46.4120 0.0000 173.3834 73 A 4.2578 7.4211 121.8046 51.1602 19.4309 177.6069 74 V 4.4500 8.2330 112.9678 59.8445 35.2649 176.4525 75 N 4.9144 7.9575 115.3537 52.1839 38.7845 174.3627 76 A 3.9662 8.7073 124.3559 55.0543 19.0846 178.3979 77 C 4.5944 8.3646 110.9050 57.1298 41.1691 173.0452 78 H 4.0628 7.9746 116.6799 56.6427 26.4291 174.4504 79 L 4.7914 8.2698 117.2110 52.7205 46.3671 176.8096 80 A 4.5217 8.3026 124.2161 51.9627 19.2952 179.6525 81 C 4.1381 8.6078 118.6694 59.4292 39.5692 176.6381 82 S 3.9046 7.9517 114.6617 61.2148 61.7453 175.6575 83 A 4.0411 7.8295 122.3714 54.2746 17.8220 177.9012 84 L 4.4674 7.8675 116.4902 55.0060 41.9339 177.5549 85 L 5.3398 7.9051 117.2215 53.6805 42.3243 176.6602 86 Q 4.3706 7.8245 117.5971 55.3799 29.5573 176.0302 87 D 4.4077 8.5755 120.4315 57.0277 41.1667 176.6333 88 N 4.6273 8.0272 118.1720 53.0375 39.3294 174.5825 89 I 4.2907 8.4441 118.9031 61.0621 38.0496 177.0569 90 A 3.9373 8.3356 125.0603 56.0199 18.1779 180.2511 91 D 4.2920 8.0748 116.4997 57.4168 40.9039 178.6747 92 A 4.1128 7.9882 120.8881 55.1791 18.4581 179.7302 93 V 3.3250 8.1961 116.9267 65.9222 31.5619 178.1841 94 A 3.8532 8.0467 120.6637 55.1487 18.0878 178.8381 95 C 4.2099 8.3149 116.9025 59.6134 40.2110 175.6306 96 A 3.8838 8.1577 122.7591 54.8981 17.5963 179.7436 97 K 3.6100 7.4637 116.1683 59.4714 32.3672 179.1132 98 R 4.0489 7.7846 118.9116 59.3443 29.8593 178.5308 99 V 2.3257 7.5733 118.1990 65.7310 31.1238 177.8000 100 V 3.9706 7.6427 109.4836 62.1324 31.2761 177.6007 101 R 4.1774 7.6967 118.7249 57.1673 30.6253 175.8696 102 D 4.7338 7.4946 118.6436 52.9945 42.0110 175.3939 103 P 4.2141 0.0000 0.0000 66.2396 31.2773 178.3732 104 Q 4.0177 8.1561 116.2610 56.8081 29.9510 177.7577 105 G 3.8166 7.8185 106.6657 46.9194 0.0000 176.2640 106 I 3.4536 7.7427 120.4795 63.4380 37.9184 177.6026 107 R 4.2990 7.2103 117.0910 57.1781 29.8940 177.3074 108 A 4.1610 7.6676 121.2773 53.5227 18.5392 177.9388 109 W 4.7806 8.0462 116.6035 55.2886 30.4274 177.5885 110 V 3.7087 8.7624 123.0727 66.0220 31.0019 177.7243 111 A 4.0319 8.3060 120.1971 54.9163 18.2016 179.2273 112 W 3.9784 8.2450 126.9513 60.6589 30.5731 178.4661 113 R 3.8004 8.2051 116.5656 59.1841 29.6382 178.4378 114 N 4.3394 8.1144 115.3054 55.8560 38.8111 176.9922 115 R 4.0019 7.8198 116.0713 56.0283 31.3625 176.2272 116 C 4.4979 7.1203 115.0295 57.3866 42.7301 173.9828 117 Q 3.3272 6.9413 121.4096 56.8133 28.5574 176.1528 118 N 4.3476 8.6485 121.3454 53.5397 36.7809 174.1560 119 R 4.3475 7.0773 116.6079 54.4151 32.1342 175.0961 120 D 4.6617 8.4169 118.9143 54.3873 41.0141 177.5890 121 V 4.8140 8.2660 116.5344 61.2291 33.2260 177.5947 122 R 4.0440 8.0902 119.3336 59.2824 29.4691 177.9153 123 Q 4.0149 8.1792 117.1049 59.5099 28.0897 178.2629 124 Y 3.9276 7.9773 117.7258 59.9491 38.2058 176.8524 125 V 4.3289 7.7286 110.9046 60.8114 32.9764 175.6796 126 Q 4.1567 7.4437 120.2314 57.4442 28.7292 177.0610 127 G 3.9483 8.9660 110.4376 46.0070 0.0000 174.4175 128 C 4.4636 8.1521 116.0350 56.5220 40.6521 173.9033 129 G 3.8338 8.1082 107.2543 46.8883 0.0000 174.1716 130 V 4.0078 7.9022 117.9838 61.0780 32.0429 175.9151 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 4.21 0.00 1.88 1.71 0.00 1.28 0.00 0.00 1.21 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.94 1.12 7.81 2 V 8.16 4.74 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 0.93 0.00 0.00 0.95 0.00 0.00 3 F 9.97 4.56 0.00 2.80 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 E 9.13 4.23 0.00 1.97 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 5 R 9.07 3.37 0.00 2.03 1.93 0.00 3.44 0.00 0.00 3.47 7.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.92 0.00 6 C 8.10 4.32 0.00 3.01 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 7 E 8.14 3.92 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.45 0.00 8 L 7.97 3.55 0.00 1.29 1.35 -0.13 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.85 3.92 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 10 R 8.06 3.94 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.87 3.86 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 12 L 8.20 3.88 0.00 1.71 1.57 0.91 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.05 3.92 0.00 1.93 1.92 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 7.99 4.03 0.00 1.80 1.97 0.00 3.20 0.00 0.00 3.22 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 15 L 7.15 4.47 0.00 1.64 1.56 0.90 0.84 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 16 G 7.90 3.84 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 0.00 0.00 0.00 17 M 7.68 3.90 0.00 1.83 1.82 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.11 0.00 18 D 7.95 4.41 0.00 2.72 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 19 G 9.45 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 0.00 0.00 0.00 20 Y 8.24 4.12 0.00 3.33 3.17 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 21 R 8.97 3.33 0.00 1.97 1.89 0.00 3.30 0.00 0.00 3.00 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 1.46 0.00 22 G 8.27 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 0.00 0.00 0.00 23 I 7.54 4.00 1.73 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.59 -0.24 0.00 0.00 24 S 8.34 4.62 0.00 4.07 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 25 L 8.80 4.24 0.00 2.04 1.82 0.98 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.20 4.13 1.53 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 0.00 0.00 27 N 8.12 4.42 0.00 2.82 2.74 0.00 0.00 7.02 8.86 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 28 W 8.06 4.26 0.00 3.56 3.10 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 29 M 8.57 4.13 0.00 2.13 2.36 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 2.70 2.92 0.00 30 C 8.15 3.37 0.00 2.52 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 31 L 8.29 3.96 0.00 1.81 1.89 0.49 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 0.00 0.00 0.00 0.00 32 A 8.27 4.22 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 33 K 8.11 3.07 0.00 1.90 1.54 0.00 0.62 0.00 0.00 0.87 0.00 0.00 2.66 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.57 1.64 7.81 34 W 7.79 4.21 0.00 3.36 3.31 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 35 E 8.23 4.42 0.00 2.10 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 2.54 2.51 0.00 36 S 8.00 4.51 0.00 4.05 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 8.25 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 0.00 0.00 0.00 38 Y 7.83 3.65 0.00 3.23 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 39 N 7.59 5.32 0.00 2.80 2.84 0.00 0.00 7.00 6.90 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 40 T 8.84 4.09 4.46 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 1.47 0.00 0.00 41 R 8.10 4.89 0.00 1.85 2.05 0.00 3.13 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.73 0.00 42 A 7.87 4.40 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 43 T 8.36 5.05 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 1.19 0.00 0.00 44 N 8.75 4.91 0.00 2.90 2.87 0.00 0.00 6.97 6.96 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 45 Y 8.77 4.80 0.00 3.06 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 46 N 8.25 4.75 0.00 2.62 2.59 0.00 0.00 6.63 7.64 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 47 A 8.35 3.68 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 48 G 8.05 3.70 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 0.00 0.00 0.00 49 D 7.90 4.71 0.00 2.76 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 50 R 7.72 3.96 0.00 2.00 2.13 0.00 3.12 0.00 0.00 3.38 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.51 0.00 51 S 7.19 4.90 0.00 4.07 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 52 T 8.90 5.13 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 53 D 9.03 5.55 0.00 2.76 2.77 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 54 Y 9.11 5.10 0.00 2.99 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 9.13 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 56 I 8.08 4.14 1.67 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.23 0.09 0.00 0.00 57 F 7.97 4.84 0.00 3.22 2.98 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 58 Q 8.01 3.56 0.00 2.53 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.82 0.00 0.00 0.00 0.00 0.00 2.43 2.68 0.00 59 I 8.14 4.42 2.14 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.10 1.14 0.00 0.00 60 N 9.23 5.36 0.00 3.11 3.06 0.00 0.00 6.98 7.60 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 61 S 9.22 4.59 0.00 4.03 4.33 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 62 R 9.13 3.74 0.00 1.47 1.26 0.00 2.66 0.00 0.00 2.85 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.95 0.00 63 Y 7.65 4.31 0.00 1.43 1.89 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.08 5.06 0.00 3.53 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 65 C 8.15 5.57 0.00 3.04 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 66 N 9.06 5.04 0.00 2.82 2.68 0.00 0.00 7.11 9.19 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 67 D 8.65 4.77 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 68 G 8.44 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 69 K 8.35 4.52 0.00 1.89 1.86 0.00 1.59 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.47 7.81 70 T 7.62 4.63 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 1.19 0.00 0.00 71 P 0.00 4.09 0.00 2.01 2.01 0.00 3.81 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 72 G 8.74 3.81 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 0.00 0.00 0.00 73 A 7.42 4.26 1.23 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 0.00 0.00 0.00 74 V 8.23 4.45 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 0.64 0.00 0.00 0.84 0.00 0.00 75 N 7.96 4.91 0.00 2.69 2.55 0.00 0.00 6.78 7.71 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 76 A 8.71 3.97 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 77 C 8.36 4.59 0.00 3.37 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 78 H 7.97 4.06 0.00 3.28 3.37 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.27 4.79 0.00 1.69 1.50 0.96 0.68 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 80 A 8.30 4.52 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 81 C 8.61 4.14 0.00 2.19 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 82 S 7.95 3.90 0.00 3.86 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 83 A 7.83 4.04 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 84 L 7.87 4.47 0.00 1.93 1.82 1.06 0.42 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 85 L 7.91 5.34 0.00 1.74 1.71 1.12 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.82 4.37 0.00 2.20 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.42 7.09 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 87 D 8.58 4.41 0.00 2.63 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 88 N 8.03 4.63 0.00 2.69 2.74 0.00 0.00 6.94 7.94 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 89 I 8.44 4.29 1.82 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.70 1.02 0.00 0.00 90 A 8.34 3.94 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 91 D 8.07 4.29 0.00 2.72 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 92 A 7.99 4.11 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 93 V 8.20 3.32 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 0.69 0.00 0.00 0.87 0.00 0.00 94 A 8.05 3.85 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 95 C 8.31 4.21 0.00 3.14 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 A 8.16 3.88 0.77 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 0.00 0.00 97 K 7.46 3.61 0.00 1.60 1.33 0.00 1.31 0.00 0.00 1.01 0.00 0.00 2.34 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 0.80 7.81 98 R 7.78 4.05 0.00 1.97 2.09 0.00 3.28 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.89 0.00 99 V 7.57 2.33 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 -0.24 0.00 0.00 -0.50 0.00 0.00 100 V 7.64 3.97 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 1.00 0.00 0.00 1.36 0.00 0.00 101 R 7.70 4.18 0.00 2.18 2.06 0.00 3.34 0.00 0.00 3.30 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 102 D 7.49 4.73 0.00 3.06 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 0.00 103 P 0.00 4.21 0.00 2.01 2.14 0.00 3.68 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 2.14 0.00 104 Q 8.16 4.02 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.81 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.82 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 0.00 106 I 7.74 3.45 0.99 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.32 -0.77 0.00 0.00 107 R 7.21 4.30 0.00 1.95 2.03 0.00 3.23 0.00 0.00 3.29 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.55 0.00 108 A 7.67 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.05 4.78 0.00 3.53 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 0.00 110 V 8.76 3.71 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 1.10 0.00 0.00 1.00 0.00 0.00 111 A 8.31 4.03 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.24 3.98 0.00 3.42 3.51 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 0.00 113 R 8.21 3.80 0.00 2.12 2.01 0.00 3.56 0.00 0.00 3.56 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.18 0.00 114 N 8.11 4.34 0.00 2.68 2.69 0.00 0.00 6.96 7.17 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 0.00 115 R 7.82 4.00 0.00 0.67 0.67 0.00 2.76 0.00 0.00 2.83 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.50 0.00 116 C 7.12 4.50 0.00 1.58 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 0.00 117 Q 6.94 3.33 0.00 0.93 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 5.77 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 118 N 8.65 4.35 0.00 2.79 2.91 0.00 0.00 7.09 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 0.00 119 R 7.08 4.35 0.00 1.79 1.83 0.00 3.10 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.54 0.00 120 D 8.42 4.66 0.00 2.67 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 8.27 4.81 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 1.01 0.00 0.00 1.04 0.00 0.00 122 R 8.09 4.04 0.00 1.92 1.96 0.00 3.21 0.00 0.00 3.41 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 123 Q 8.18 4.01 0.00 2.14 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.68 0.00 0.00 0.00 0.00 0.00 2.37 1.74 0.00 124 Y 7.98 3.93 0.00 3.22 3.16 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 0.00 125 V 7.73 4.33 2.14 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 0.84 0.00 0.00 1.06 0.00 0.00 126 Q 7.44 4.16 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.78 0.00 0.00 0.00 0.00 0.00 2.64 2.47 0.00 127 G 8.97 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 0.00 128 C 8.15 4.46 0.00 3.09 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 0.00 129 G 8.11 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 0.00 130 V 7.90 4.01 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 0.75 0.00 0.00 0.96 0.00 0.00