NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9353 8.0549 120.3763 62.9421 32.5048 174.7911 2 H 4.5575 8.6091 123.5174 53.8079 30.8969 171.0025 3 L 4.8266 8.0692 124.8042 52.9434 44.6691 177.2614 4 T 4.2329 8.8179 113.4907 60.8158 70.9333 174.1435 5 P 4.3529 0.0000 0.0000 65.5007 31.3717 178.8962 6 E 3.9767 8.0906 117.2547 59.3654 29.3360 179.0901 7 E 3.9283 8.1556 118.6008 59.3308 29.5984 179.3369 8 K 3.8079 8.3955 118.9841 59.5681 31.9814 179.3565 9 S 4.0510 7.9334 112.7934 61.3244 62.4472 176.0853 10 A 3.9884 7.9038 123.2824 54.9526 18.0772 179.8289 11 V 3.5185 7.9845 117.0675 66.3720 31.5065 178.3326 12 T 3.9337 7.8445 115.1523 66.7965 68.1346 176.4439 13 A 4.0512 8.1058 121.4558 55.1216 18.6800 179.1230 14 L 3.8904 7.9896 118.4258 57.7811 42.1913 178.9097 15 W 4.3886 8.6944 128.6576 60.3077 30.3741 178.1897 16 G 3.7664 8.0211 104.7710 46.9849 0.0000 174.2371 17 K 4.4070 7.6021 118.1124 56.1769 32.5347 176.9817 18 V 3.6871 7.2677 120.1369 62.4194 31.9684 175.5983 19 N 4.4827 8.2955 125.4847 52.1872 37.1549 175.0577 20 V 3.4852 8.3183 126.6094 66.0995 31.5880 177.7377 21 D 4.4518 8.4915 117.6998 55.8952 41.2910 176.4901 22 E 4.4445 7.6816 117.7202 57.5718 31.9724 178.2473 23 V 3.4777 7.8629 118.0986 66.1067 31.3155 178.3253 24 G 3.7531 8.0170 105.0144 47.5148 0.0000 175.8788 25 G 3.6558 7.9822 107.5420 47.4194 0.0000 175.7056 26 E 3.9024 8.3452 120.7700 59.1140 29.4678 179.2598 27 A 3.8986 8.2746 121.1948 55.1269 18.5071 179.4587 28 L 3.9690 8.0054 119.0583 58.2266 42.1320 179.4586 29 G 3.5252 8.2837 105.9216 47.8194 0.0000 176.0237 30 R 3.9009 8.3192 120.7944 58.5462 29.9286 178.8052 31 L 4.0273 7.9280 120.4375 58.3660 41.9016 179.2066 32 L 3.9551 7.5605 118.6632 56.7585 41.4949 179.3768 33 V 3.7045 7.3312 117.6310 65.7198 31.7257 178.0037 34 V 3.5789 7.6656 117.0351 64.1780 32.4985 175.4271 35 Y 3.9558 7.2724 117.4789 54.1311 37.8196 174.0404 36 P 4.3008 0.0000 0.0000 65.1617 31.4569 178.1809 37 W 4.4366 8.0460 115.7851 58.8061 27.7084 177.7786 38 T 4.3773 7.5282 110.9742 64.1955 68.2635 176.2961 39 Q 4.2498 8.1652 121.3166 58.4667 28.4032 178.0722 40 R 4.0080 7.6388 119.4289 59.4114 30.0954 177.7117 41 F 4.3744 7.9205 114.5483 58.1625 39.2997 175.7240 42 F 4.5346 8.1247 118.1647 56.8891 39.9087 176.9810 43 E 4.0092 8.5727 122.4927 58.9430 29.3877 178.0532 44 S 4.7442 8.0893 111.5230 58.2741 63.2429 174.5320 45 F 4.4941 8.5340 118.9567 58.0622 39.2882 175.2775 46 G 3.8424 8.1030 105.9121 43.8521 0.0000 172.1825 47 D 4.4306 8.6442 120.3959 54.7180 40.0004 176.8481 48 L 4.8424 8.4470 125.7661 54.4939 42.7455 178.5674 49 S 4.3204 8.2990 115.8711 60.4615 63.4263 174.5718 50 T 4.7248 7.2998 109.3575 58.3016 73.0319 172.7077 51 P 4.1832 0.0000 0.0000 66.1908 31.3982 178.7489 52 D 4.3668 8.0550 116.7235 57.1346 40.5734 178.3917 53 A 3.9845 7.9324 120.7577 55.1616 18.5818 179.6498 54 V 3.6964 7.9637 116.6870 66.4597 31.4719 178.3202 55 M 4.0294 8.3782 117.7072 57.9499 31.8736 177.4712 56 G 3.8299 7.8038 104.8403 45.2771 0.0000 173.6313 57 N 4.3126 7.7997 119.9391 53.1347 39.7270 173.4618 58 P 4.2825 0.0000 0.0000 66.0458 31.2979 178.5401 59 K 3.9586 8.3537 118.0919 58.6112 31.8177 179.5620 60 V 3.7625 8.0459 118.3605 66.1156 31.3940 178.0010 61 K 3.9501 7.8726 116.5297 59.3359 31.6593 178.9938 62 A 4.1418 8.0583 120.9769 55.5847 18.4329 179.2602 63 H 4.3387 8.7080 117.1239 59.2930 29.9472 177.5860 64 G 3.7298 8.6115 108.1051 47.5954 0.0000 175.5748 65 K 4.0761 7.8196 121.1465 59.3485 32.2094 179.1870 66 K 4.0431 7.9847 118.4319 59.2965 32.2444 179.3276 67 V 3.6673 7.7633 118.5436 66.0970 31.4218 177.9316 68 L 4.5153 8.7418 120.5497 58.0003 41.8649 179.0388 69 G 3.7612 8.5660 106.1784 47.8362 0.0000 175.5534 70 A 4.1364 8.2434 123.1291 54.7675 18.3093 179.6257 71 F 3.7486 8.2768 115.9379 60.9804 39.2146 177.7460 72 S 4.1416 8.7255 114.8225 62.0686 62.4625 176.8055 73 D 4.4460 7.9970 120.3457 57.3885 40.8731 178.7300 74 G 3.7749 8.1176 106.1637 47.8558 0.0000 175.6237 75 L 3.8385 7.9270 120.3867 57.3391 41.6398 178.9586 76 A 4.1553 7.5267 118.5271 53.4068 19.3610 176.8436 77 H 4.9164 8.0266 115.0873 54.4495 29.7586 175.3253 78 L 4.0567 8.1426 120.5616 57.7485 41.8095 178.5281 79 D 4.6561 7.9221 114.9993 53.7912 40.3773 175.9025 80 N 4.9860 8.4082 120.2787 51.1293 39.5127 175.6314 81 L 3.9475 8.3330 120.6366 58.0023 41.8929 178.9544 82 K 3.9655 8.0507 118.7313 59.6485 32.0084 178.9788 83 G 3.6718 8.2469 104.4272 47.8246 0.0000 175.5620 84 T 3.8014 7.7591 117.5765 65.4935 68.6020 175.8028 85 F 4.7589 7.9260 117.1222 56.9231 39.3610 177.0996 86 A 4.1176 7.5722 122.2023 55.8468 18.0613 180.4760 87 T 3.9282 7.8541 107.4919 64.8549 68.9871 176.7746 88 L 4.0284 7.9452 121.4105 57.5109 41.6840 179.2029 89 S 4.1317 8.5223 113.7038 61.2767 62.3317 175.8985 90 E 3.7984 8.1288 122.0593 59.0681 29.4510 178.2934 91 L 3.8909 8.0884 120.5824 58.8063 42.1546 178.8528 92 H 4.2359 8.6674 116.2054 58.6143 28.2364 177.0971 93 C 3.6735 7.8954 120.6464 62.0863 31.2567 175.3949 94 D 4.2580 8.2196 120.1758 56.7055 40.5339 177.7142 95 K 4.2182 7.7318 116.8472 57.8083 33.0822 177.4990 96 L 4.3165 7.7461 116.7219 54.5790 42.5397 176.0989 97 H 4.1731 7.3460 114.0520 56.6834 26.4135 175.1443 98 V 3.9371 7.8361 118.4815 61.7668 32.6061 174.9142 99 D 4.3964 8.5854 126.7772 53.4476 41.8539 175.1053 100 P 2.9700 0.0000 0.0000 64.1411 31.3225 178.2454 101 E 3.8767 8.3323 118.9294 59.0218 29.4363 178.2047 102 N 4.4234 7.9355 116.2290 55.6120 38.5387 177.2948 103 F 4.4699 7.4463 119.8719 60.3966 38.8394 177.9128 104 R 4.0016 7.9270 117.4147 59.2359 29.8935 178.8490 105 L 3.8974 7.7530 118.4733 57.6395 41.5374 179.3748 106 L 4.1067 8.2854 120.5800 58.0328 42.0419 179.2387 107 G 3.7383 8.3400 105.7455 48.0517 0.0000 175.4966 108 N 4.4786 8.6190 119.3810 55.9038 38.4933 177.7696 109 V 3.6315 8.2410 120.2220 65.7733 31.5284 177.7716 110 L 3.8600 8.3930 120.6301 58.0501 41.7951 179.1643 111 V 3.4758 7.7150 118.1560 66.2234 31.4277 177.8249 112 C 4.0520 8.0138 116.4749 62.7852 27.9348 176.3114 113 V 3.4933 8.0361 120.2818 65.8673 31.0096 178.1329 114 L 3.8195 7.8841 118.7934 57.4492 41.3258 179.2974 115 A 3.6669 7.3182 120.8080 55.1959 18.0749 179.0366 116 H 4.0871 7.9995 115.7714 59.8696 29.9719 176.9203 117 H 3.9139 7.8685 116.6665 58.1040 28.9206 176.9450 118 F 4.7435 8.5143 117.7900 56.8518 39.7051 177.3199 119 G 3.7867 8.6922 109.3994 46.1757 0.0000 176.9615 120 K 4.2552 8.8543 121.3922 58.9944 32.0799 177.8817 121 E 4.1169 8.2552 117.7632 58.7086 29.9407 177.5712 122 F 4.4581 8.4570 123.7682 56.9346 37.8844 175.0586 123 T 4.1332 7.2493 115.5470 60.4570 71.2643 173.4776 124 P 4.1446 0.0000 0.0000 65.5618 31.3959 177.3163 125 P 4.2409 0.0000 0.0000 65.1175 31.1732 178.9659 126 V 3.5242 7.3290 117.0573 65.8125 31.3609 177.6868 127 Q 3.5872 8.2020 119.5245 59.1609 28.6725 178.3410 128 A 4.0032 8.0626 121.4705 55.1160 18.4928 179.5267 129 A 3.9179 7.8751 119.2241 55.4789 18.4924 179.5346 130 Y 3.8496 8.4135 115.5245 60.9826 37.8999 178.6039 131 Q 4.1895 8.6500 119.8096 58.9734 28.8107 178.9937 132 K 4.0301 7.9048 119.7085 59.1866 31.9639 179.6566 133 V 3.5118 7.5954 118.2560 66.2299 31.5339 178.5655 134 V 3.7960 8.4707 112.2945 64.4665 31.2940 178.5122 135 A 4.1893 8.2833 120.7932 54.8836 18.0941 179.9392 136 G 3.5057 8.0170 104.5080 47.8854 0.0000 176.1952 137 V 3.2577 8.1108 120.7380 65.5555 31.2813 178.0134 138 A 3.9344 7.7154 119.4281 55.0357 18.5068 179.1068 139 N 4.4083 8.3808 114.8967 56.5277 38.7980 177.4492 140 A 4.0207 8.1559 122.3123 55.2826 18.2728 179.6965 141 L 3.8251 8.0146 116.2644 57.0723 41.6855 178.6152 142 A 4.3894 7.8194 119.5817 52.8723 18.3069 178.6860 143 H 4.3263 8.1738 114.7891 58.3647 28.2176 176.8334 144 K 4.7867 7.7426 118.5947 56.7085 31.5792 177.0146 145 Y 4.3200 7.6575 116.5126 57.8603 38.5974 175.5871 146 H 4.3105 7.6134 120.5756 56.4672 29.2045 174.1168 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 V 8.05 3.94 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 0.94 0.00 0.00 0.90 0.00 0.00 2 H 8.61 4.56 0.00 3.19 3.17 0.00 5.75 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.07 4.83 0.00 1.57 1.62 0.79 0.89 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 4 T 8.82 4.23 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 1.19 0.00 0.00 5 P 0.00 4.35 0.00 2.17 2.12 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 6 E 8.09 3.98 0.00 2.03 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 2.39 2.45 0.00 7 E 8.16 3.93 0.00 2.27 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 2.28 2.31 0.00 8 K 8.40 3.81 0.00 1.72 1.83 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.65 7.81 9 S 7.93 4.05 0.00 3.99 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 10 A 7.90 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 11 V 7.98 3.52 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 0.63 0.00 0.00 0.57 0.00 0.00 12 T 7.84 3.93 4.52 0.00 0.00 0.00 0.00 0.00 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 13 A 8.11 4.05 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 14 L 7.99 3.89 0.00 1.93 1.86 0.53 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.69 4.39 0.00 3.73 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 16 G 8.02 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 0.00 0.00 0.00 17 K 7.60 4.41 0.00 1.97 2.06 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.39 7.81 18 V 7.27 3.69 1.46 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 0.09 0.00 0.00 0.61 0.00 0.00 19 N 8.30 4.48 0.00 2.68 2.60 0.00 0.00 6.80 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 20 V 8.32 3.49 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 0.95 0.00 0.00 0.87 0.00 0.00 21 D 8.49 4.45 0.00 2.75 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 22 E 7.68 4.44 0.00 2.07 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.30 0.00 23 V 7.86 3.48 1.74 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 0.86 0.00 0.00 0.55 0.00 0.00 24 G 8.02 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 25 G 7.98 3.66 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 26 E 8.35 3.90 0.00 2.21 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 2.30 2.29 0.00 27 A 8.27 3.90 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 28 L 8.01 3.97 0.00 1.78 1.70 0.78 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.28 3.53 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 0.00 30 R 8.32 3.90 0.00 1.88 1.91 0.00 3.06 0.00 0.00 3.00 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 31 L 7.93 4.03 0.00 1.79 1.84 0.98 0.54 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 32 L 7.56 3.96 0.00 1.57 1.63 0.57 0.69 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 33 V 7.33 3.70 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.87 0.00 0.00 34 V 7.67 3.58 1.69 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 -0.13 0.00 0.00 0.75 0.00 0.00 35 Y 7.27 3.96 0.00 2.53 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 36 P 0.00 4.30 0.00 2.33 2.30 0.00 3.54 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.04 0.00 37 W 8.05 4.44 0.00 3.64 3.56 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 38 T 7.53 4.38 4.38 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 0.99 0.00 0.00 39 Q 8.17 4.25 0.00 2.26 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 40 R 7.64 4.01 0.00 1.74 1.74 0.00 3.09 0.00 0.00 2.70 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.51 0.00 41 F 7.92 4.37 0.00 2.96 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 8.12 4.53 0.00 2.82 2.31 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 43 E 8.57 4.01 0.00 1.96 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 2.34 2.61 0.00 44 S 8.09 4.74 0.00 4.06 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 45 F 8.53 4.49 0.00 3.18 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 46 G 8.10 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 47 D 8.64 4.43 0.00 2.65 2.63 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 0.00 0.00 0.00 0.00 48 L 8.45 4.84 0.00 1.73 1.60 1.04 0.89 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 49 S 8.30 4.32 0.00 4.01 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 50 T 7.30 4.72 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 1.21 0.00 0.00 51 P 0.00 4.18 0.00 2.14 2.11 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 2.15 0.00 52 D 8.05 4.37 0.00 2.75 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 A 7.93 3.98 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 54 V 7.96 3.70 2.20 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 0.99 0.00 0.00 0.98 0.00 0.00 55 M 8.38 4.03 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.91 0.00 56 G 7.80 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 57 N 7.80 4.31 0.00 3.05 2.92 0.00 0.00 6.90 9.04 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 58 P 0.00 4.28 0.00 2.27 2.28 0.00 3.74 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 59 K 8.35 3.96 0.00 1.84 1.11 0.00 1.38 0.00 0.00 0.98 0.00 0.00 2.76 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.16 1.27 7.81 60 V 8.05 3.76 2.26 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 1.11 0.00 0.00 1.00 0.00 0.00 61 K 7.87 3.95 0.00 1.94 1.86 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.56 7.81 62 A 8.06 4.14 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 63 H 8.71 4.34 0.00 3.70 3.64 0.00 5.80 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 64 G 8.61 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 65 K 7.82 4.08 0.00 1.88 1.99 0.00 1.65 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.50 7.81 66 K 7.98 4.04 0.00 2.01 1.89 0.00 1.84 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.70 7.81 67 V 7.76 3.67 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 1.00 0.00 0.00 68 L 8.74 4.52 0.00 1.96 1.82 0.92 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.57 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.24 4.14 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.28 3.75 0.00 3.52 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.73 4.14 0.00 4.29 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 73 D 8.00 4.45 0.00 2.72 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 74 G 8.12 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 0.00 0.00 0.00 75 L 7.93 3.84 0.00 1.42 1.48 -0.28 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.53 4.16 1.15 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 0.00 0.00 77 H 8.03 4.92 0.00 3.04 3.15 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.14 4.06 0.00 1.57 1.71 0.82 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.92 4.66 0.00 2.76 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 80 N 8.41 4.99 0.00 2.68 2.65 0.00 0.00 7.11 6.41 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 81 L 8.33 3.95 0.00 1.79 1.81 1.05 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.05 3.97 0.00 1.73 1.73 0.00 1.19 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.04 7.81 83 G 8.25 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.76 3.80 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 0.41 0.00 0.00 85 F 7.93 4.76 0.00 3.02 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 86 A 7.57 4.12 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 87 T 7.85 3.93 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 88 L 7.95 4.03 0.00 2.00 1.81 1.00 1.03 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 89 S 8.52 4.13 0.00 4.04 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 90 E 8.13 3.80 0.00 2.35 1.95 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 2.27 2.27 0.00 91 L 8.09 3.89 0.00 1.78 1.93 0.89 1.27 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 92 H 8.67 4.24 0.00 3.51 3.76 0.00 5.85 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 93 C 7.90 3.67 0.00 1.24 2.40 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 94 D 8.22 4.26 0.00 2.70 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 95 K 7.73 4.22 0.00 1.83 1.81 0.00 1.59 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.48 7.81 96 L 7.75 4.32 0.00 1.75 1.70 0.69 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.35 4.17 0.00 3.49 3.50 0.00 5.65 0.00 0.00 0.00 0.00 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.84 3.94 2.16 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 0.35 0.00 0.00 0.46 0.00 0.00 99 D 8.59 4.40 0.00 2.72 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 2.97 0.00 1.85 1.60 0.00 3.37 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.69 0.00 101 E 8.33 3.88 0.00 2.06 1.86 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 2.24 2.34 0.00 102 N 7.94 4.42 0.00 2.73 2.81 0.00 0.00 6.90 7.45 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 0.00 103 F 7.45 4.47 0.00 2.96 2.85 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 0.00 104 R 7.93 4.00 0.00 2.03 1.98 0.00 3.25 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 105 L 7.75 3.90 0.00 1.70 1.23 0.45 0.00 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 0.00 106 L 8.29 4.11 0.00 1.85 1.80 0.98 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.34 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.62 4.48 0.00 2.94 2.95 0.00 0.00 6.68 7.81 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 0.00 109 V 8.24 3.63 2.26 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 1.07 0.00 0.00 1.14 0.00 0.00 110 L 8.39 3.86 0.00 1.59 1.71 0.77 -0.01 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 0.00 111 V 7.72 3.48 2.30 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 1.30 0.00 0.00 1.13 0.00 0.00 112 C 8.01 4.05 0.00 3.16 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 0.00 113 V 8.04 3.49 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 0.90 0.00 0.00 0.92 0.00 0.00 114 L 7.88 3.82 0.00 0.95 1.26 0.51 1.11 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 0.00 115 A 7.32 3.67 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 0.00 116 H 8.00 4.09 0.00 3.22 3.43 0.00 5.77 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.87 3.91 0.00 2.54 2.32 0.00 5.71 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.51 4.74 0.00 3.24 3.09 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 0.00 0.00 0.00 119 G 8.69 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 0.00 120 K 8.85 4.26 0.00 1.78 1.94 0.00 1.69 0.00 0.00 1.73 0.00 0.00 3.16 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.57 7.81 121 E 8.26 4.12 0.00 2.35 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 0.00 2.38 2.31 0.00 122 F 8.46 4.46 0.00 3.05 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 0.00 123 T 7.25 4.13 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 1.23 0.00 0.00 124 P 0.00 4.14 0.00 2.15 2.14 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.24 0.00 2.11 2.06 0.00 3.54 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 2.07 2.10 0.00 126 V 7.33 3.52 1.86 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 1.04 0.00 0.00 0.87 0.00 0.00 127 Q 8.20 3.59 0.00 1.77 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 128 A 8.06 4.00 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 0.00 129 A 7.88 3.92 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 0.00 130 Y 8.41 3.85 0.00 3.37 3.29 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 0.00 131 Q 8.65 4.19 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.73 2.62 0.00 132 K 7.90 4.03 0.00 1.85 1.84 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.64 7.81 133 V 7.60 3.51 2.16 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 1.12 0.00 0.00 0.69 0.00 0.00 134 V 8.47 3.80 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.13 0.00 0.00 135 A 8.28 4.19 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 0.00 136 G 8.02 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 0.00 0.00 0.00 137 V 8.11 3.26 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 -0.29 0.00 0.00 0.87 0.00 0.00 138 A 7.72 3.93 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 0.00 139 N 8.38 4.41 0.00 3.01 2.87 0.00 0.00 6.90 8.22 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 0.00 140 A 8.16 4.02 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 0.00 141 L 8.01 3.83 0.00 0.93 0.45 -0.09 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.82 4.39 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 0.00 143 H 8.17 4.33 0.00 3.55 3.66 0.00 5.46 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.74 4.79 0.00 1.73 1.79 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.38 1.71 7.81 145 Y 7.66 4.32 0.00 2.88 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 H 7.61 4.31 0.00 3.11 3.29 0.00 5.61 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00