NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2354 8.1727 120.1326 56.8305 34.8820 173.9208 2 V 4.5878 8.0298 121.2658 60.7709 32.4875 174.6368 3 F 4.4625 9.9750 129.0318 57.5327 40.2520 174.9170 4 E 4.2916 8.9274 120.8865 55.5767 31.0461 176.9421 5 R 3.3078 8.9446 121.5403 60.6693 29.9273 179.5426 6 C 4.3374 8.0228 115.2679 59.5766 40.0640 175.6935 7 E 3.8986 8.0929 120.7386 59.2761 29.2566 178.4813 8 L 3.5191 7.9384 120.0357 57.8063 42.0441 178.6118 9 A 3.9304 7.8362 120.6870 55.4139 18.3337 179.8964 10 R 3.8832 8.1153 116.5011 59.5790 30.2198 179.4649 11 T 3.8425 7.9213 115.5575 66.6457 68.4799 176.7137 12 L 3.8675 8.0950 121.2370 57.5250 41.5993 179.4656 13 K 3.9032 7.9831 119.6307 59.5687 31.9267 178.8785 14 R 3.9529 7.7935 117.8821 59.0130 30.0517 177.5303 15 L 4.3455 7.4491 115.9293 54.2091 41.7746 176.9025 16 G 3.8385 7.8313 106.9552 46.9436 0.0000 175.0349 17 M 3.9433 7.7936 120.8879 56.2254 32.4462 175.8003 18 D 4.3725 8.0140 117.9592 56.0515 41.1100 175.8266 19 G 3.9289 9.2977 115.7749 45.3056 0.0000 171.2950 20 Y 4.1879 8.2385 121.8338 58.6340 38.8311 176.3334 21 R 3.6070 9.0121 127.3839 57.2666 27.7371 177.4655 22 G 3.7919 8.2411 104.2631 45.4224 0.0000 174.2187 23 V 3.8614 7.6636 121.2280 60.8675 32.0247 175.6895 24 S 4.6796 8.2999 122.1640 57.7483 64.0813 174.7017 25 L 4.2021 8.9622 123.8094 58.7964 41.6631 179.4848 26 A 4.1730 8.1576 119.8762 55.2908 18.2465 179.2443 27 N 4.4097 8.1873 115.2257 56.2850 38.5642 177.7274 28 W 4.2076 8.0009 119.9554 59.8521 29.1302 178.4163 29 M 4.1621 8.3968 118.8462 58.5600 31.4426 177.8784 30 C 3.1089 8.1116 118.7321 59.0937 43.9818 175.3852 31 L 3.9540 8.1890 121.7019 58.2717 41.7682 178.8325 32 A 4.1238 8.3530 120.8286 54.8915 18.2877 179.3609 33 K 2.7671 8.1118 118.1746 59.4115 32.0247 179.1974 34 W 4.2578 7.6301 117.6047 59.3503 29.0136 178.4499 35 E 4.3165 8.4076 118.6817 58.7884 29.1674 177.9155 36 S 4.5239 7.8458 109.3812 56.6264 64.5812 174.3533 37 G 3.2164 8.1541 108.8469 47.0369 0.0000 173.4087 38 Y 3.6539 7.6488 113.3729 58.6524 35.3037 168.6067 39 N 5.3040 7.6259 118.0300 52.0280 40.0277 175.4010 40 T 4.2590 8.8988 117.3431 63.6808 69.8637 175.8341 41 R 4.7098 8.2336 117.1845 55.7793 30.4944 176.6187 42 A 4.3748 7.7652 122.2637 52.6151 19.4471 177.0436 43 T 5.0311 8.3422 110.6824 59.9917 72.4597 173.0470 44 N 4.8593 8.7046 121.6963 52.1207 41.7638 172.4030 45 Y 4.5143 8.6893 128.3443 57.4210 40.6730 173.9803 46 N 4.5989 8.4608 125.0993 51.1811 38.2990 175.4248 47 A 3.7732 8.2675 127.2827 54.5798 18.9130 179.3840 48 G 3.7050 7.9434 104.3861 47.9638 0.0000 173.8789 49 D 4.6765 7.3486 114.9083 52.0230 40.4656 175.6218 50 R 3.9325 8.1233 116.4763 57.0251 28.1287 175.7945 51 S 4.9307 7.7439 112.5355 57.0929 66.4235 172.7554 52 T 5.0823 8.6192 115.6209 61.9694 72.8267 172.8908 53 D 5.4302 8.8642 125.2461 53.3326 43.1463 175.0361 54 Y 4.8580 9.1101 120.9578 57.4140 41.4283 177.3805 55 G 4.1250 8.9696 112.5650 45.1574 0.0000 173.3001 56 I 3.8892 8.2669 116.8445 62.9287 37.8077 177.3353 57 F 4.7142 7.9245 115.3780 56.4711 39.9795 175.1737 58 Q 3.6266 7.9224 119.2387 57.1148 26.4826 174.0393 59 I 4.3798 8.1868 119.0902 61.0783 39.3016 176.9093 60 N 5.3556 9.2108 126.0778 53.3948 38.6809 175.8152 61 S 4.5765 9.2934 120.4633 60.9474 63.9561 176.1960 62 R 3.7962 8.6748 121.7893 58.6981 30.3889 177.9094 63 Y 4.3386 7.3979 111.7534 58.1032 40.8390 177.3240 64 W 4.8394 8.0526 119.0039 58.0217 30.0025 173.6444 65 C 5.5228 7.9232 109.9201 53.6217 45.7950 172.1774 66 N 4.9316 8.9388 119.3878 52.0492 39.8600 174.6538 67 D 4.8611 8.4646 122.7391 52.1951 40.5399 178.0194 68 G 4.0957 8.4261 109.7431 46.0940 0.0000 174.8224 69 K 4.3762 7.9630 116.1516 56.7414 33.2136 176.1286 70 T 4.3982 7.4118 116.4514 61.7822 69.1761 173.1190 71 P 4.3279 0.0000 0.0000 63.4883 32.0251 176.0683 72 G 3.9231 8.4587 108.0838 46.5690 0.0000 172.8175 73 A 4.7268 7.7533 118.4171 50.2638 21.5601 177.1088 74 V 4.3716 8.2582 112.4035 59.3629 35.7105 176.2119 75 N 4.9805 8.0666 116.8882 52.2034 37.8203 174.6112 76 A 3.9585 9.1267 125.1138 54.7500 19.1298 178.5547 77 C 4.5092 8.3543 111.5307 57.4687 41.0984 173.0338 78 H 4.1298 7.8697 116.1562 56.8395 26.1846 174.2054 79 L 4.8653 8.4422 118.0028 52.7780 46.3131 176.6922 80 S 4.6332 8.3486 115.3721 57.9539 63.3050 176.0184 81 C 4.0932 8.6968 124.5583 59.7370 40.8133 176.3416 82 S 3.9118 7.6864 115.0685 61.3544 61.6354 176.0170 83 A 4.0621 7.8507 122.4493 54.5381 17.9148 177.9847 84 L 4.4195 7.8402 116.1448 55.2221 41.7762 177.6764 85 L 5.3023 7.7385 116.8397 53.7232 42.2861 176.7280 86 Q 4.3606 7.8416 117.7510 55.4472 29.5025 175.9867 87 D 4.3945 8.5184 119.7566 56.9463 41.1666 176.5968 88 N 4.6159 8.0285 118.1715 52.9963 39.0855 174.5575 89 I 4.2483 8.4390 119.1227 61.0462 37.9979 176.9681 90 A 3.9441 8.2641 124.8285 56.0368 18.1839 180.1974 91 D 4.2929 8.0722 116.4379 57.4191 40.9491 178.6637 92 A 4.1172 7.9990 120.8769 55.1681 18.4383 179.7470 93 V 3.4074 8.2351 116.9445 66.0387 31.4791 178.1883 94 A 3.8690 8.0457 120.5601 55.1312 18.0715 178.8273 95 C 4.2175 8.3364 116.9742 59.6148 39.5492 175.5710 96 A 3.8981 8.1174 122.5571 55.0932 17.6004 179.7631 97 K 3.8155 7.5792 116.2026 59.3500 32.3547 179.3029 98 R 4.0606 7.5640 119.1987 59.3599 29.9672 178.5866 99 V 2.3376 7.4761 118.1496 65.7682 31.2339 178.0884 100 V 3.8552 7.8131 110.5965 63.0125 31.3560 177.7410 101 R 4.1445 7.6503 117.4584 57.0907 30.4976 175.9820 102 D 4.7114 7.3147 118.6334 53.3017 41.6465 175.4696 103 P 4.3151 0.0000 0.0000 65.1191 31.2190 176.8682 104 Q 4.3126 8.0365 117.2038 55.1320 31.1096 176.6122 105 G 3.7878 7.8333 106.8869 47.1042 0.0000 176.9961 106 I 3.5624 7.8364 122.0895 63.4200 37.8672 177.8230 107 R 4.1733 7.2488 118.0139 58.1645 30.0044 177.5228 108 A 4.0510 7.6622 120.7844 54.3355 18.5878 177.5286 109 W 4.6622 8.1821 116.4720 55.5236 29.5022 177.4125 110 V 3.7486 8.7340 124.0629 66.0090 30.8499 177.5830 111 A 4.0763 8.2978 120.1659 54.7545 18.1245 179.2281 112 W 3.9746 8.4218 127.0552 60.6055 30.5656 178.4187 113 R 3.6968 8.1971 116.3574 59.2518 29.6876 178.3276 114 N 4.3571 7.9716 114.9268 55.7675 38.7559 176.8805 115 R 4.0773 7.6284 113.4264 55.9700 30.4466 175.5376 116 C 4.5298 7.1278 115.8597 58.1401 42.6555 174.1367 117 Q 3.1333 6.5092 119.5999 57.3933 28.6266 175.6949 118 N 4.1870 8.6661 120.6114 54.3472 36.2100 173.7459 119 R 4.5248 7.3299 115.0205 53.9774 33.4343 175.4891 120 D 4.5496 8.4730 118.7442 54.1729 40.4376 175.8590 121 V 4.5913 8.1909 119.0500 61.1387 32.5468 178.3367 122 R 4.0427 8.0869 121.9796 59.2997 30.4272 178.8202 123 Q 4.0023 8.2101 115.4018 59.3860 28.4078 178.5657 124 Y 4.2597 7.8031 115.2134 60.1828 38.0737 177.0228 125 V 4.3487 7.9367 110.9351 60.8482 32.6717 175.5139 126 Q 4.1665 7.5463 119.9533 57.1022 28.8179 176.8358 127 G 3.9677 8.9716 110.6459 45.8025 0.0000 174.5018 128 C 4.4117 7.9110 115.8017 56.8502 40.5879 174.0328 129 G 3.8679 8.1276 107.2017 46.7131 0.0000 174.1561 130 V 3.9999 7.8924 118.0895 61.0718 32.0102 175.8651 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 4.24 0.00 1.66 2.01 0.00 0.61 0.00 0.00 1.21 0.00 0.00 2.41 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.16 1.26 7.81 2 V 8.03 4.59 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 0.87 0.00 0.00 0.94 0.00 0.00 3 F 9.97 4.46 0.00 2.87 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 4 E 8.93 4.29 0.00 1.97 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 2.30 2.24 0.00 5 R 8.94 3.31 0.00 1.91 1.91 0.00 3.47 0.00 0.00 3.47 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 6 C 8.02 4.34 0.00 3.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 8.09 3.90 0.00 2.06 2.25 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 2.62 2.44 0.00 8 L 7.94 3.52 0.00 1.33 1.36 -0.10 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.84 3.93 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 10 R 8.12 3.88 0.00 1.87 1.99 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 11 T 7.92 3.84 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 12 L 8.10 3.87 0.00 1.59 1.58 0.94 0.41 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 13 K 7.98 3.90 0.00 1.93 1.95 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.79 3.95 0.00 2.04 2.02 0.00 3.30 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.45 4.35 0.00 1.70 1.55 0.84 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.83 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 7.79 3.94 0.00 1.35 1.96 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.22 0.00 18 D 8.01 4.37 0.00 2.68 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 9.30 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.24 4.19 0.00 3.35 3.20 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 21 R 9.01 3.61 0.00 1.88 1.85 0.00 3.25 0.00 0.00 3.00 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 1.33 0.00 22 G 8.24 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 23 V 7.66 3.86 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.61 0.00 0.00 24 S 8.30 4.68 0.00 4.10 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 25 L 8.96 4.20 0.00 2.08 1.82 0.98 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.16 4.17 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 27 N 8.19 4.41 0.00 2.80 2.74 0.00 0.00 7.07 7.83 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 28 W 8.00 4.21 0.00 3.55 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 29 M 8.40 4.16 0.00 2.17 2.35 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.91 0.00 30 C 8.11 3.11 0.00 2.49 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 31 L 8.19 3.95 0.00 1.84 1.83 0.70 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.35 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.11 2.77 0.00 1.65 1.45 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.32 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.63 1.47 7.81 34 W 7.63 4.26 0.00 3.34 3.25 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 35 E 8.41 4.32 0.00 2.01 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 0.00 2.60 2.48 0.00 36 S 7.85 4.52 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 8.15 3.22 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 38 Y 7.65 3.65 0.00 3.23 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 N 7.63 5.30 0.00 2.85 2.81 0.00 0.00 7.03 7.11 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 40 T 8.90 4.26 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 1.48 0.00 0.00 41 R 8.23 4.71 0.00 1.88 2.09 0.00 3.08 0.00 0.00 3.24 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.59 0.00 42 A 7.77 4.37 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 8.34 5.03 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 1.20 0.00 0.00 44 N 8.70 4.86 0.00 2.91 2.74 0.00 0.00 6.87 7.88 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 45 Y 8.69 4.51 0.00 3.07 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 8.46 4.60 0.00 2.63 2.59 0.00 0.00 6.88 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.27 3.77 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 48 G 7.94 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 7.35 4.68 0.00 2.68 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 50 R 8.12 3.93 0.00 2.04 2.19 0.00 3.12 0.00 0.00 3.20 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.53 0.00 51 S 7.74 4.93 0.00 3.87 3.89 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 52 T 8.62 5.08 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 0.64 0.00 0.00 53 D 8.86 5.43 0.00 2.72 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 54 Y 9.11 4.86 0.00 2.95 2.89 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 55 G 8.97 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 0.00 0.00 0.00 56 I 8.27 3.89 1.69 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.82 0.07 0.00 0.00 57 F 7.92 4.71 0.00 3.26 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 7.92 3.63 0.00 2.54 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 7.25 0.00 0.00 0.00 0.00 0.00 2.52 2.69 0.00 59 I 8.19 4.38 2.14 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.18 1.15 0.00 0.00 60 N 9.21 5.36 0.00 3.07 3.02 0.00 0.00 7.00 7.73 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 61 S 9.29 4.58 0.00 4.10 4.51 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 62 R 8.67 3.80 0.00 1.57 1.35 0.00 2.68 0.00 0.00 2.83 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.99 0.00 63 Y 7.40 4.34 0.00 1.47 1.82 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 64 W 8.05 4.84 0.00 3.67 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 C 7.92 5.52 0.00 3.13 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 8.94 4.93 0.00 2.78 2.69 0.00 0.00 7.10 9.21 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 67 D 8.46 4.86 0.00 2.96 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 68 G 8.43 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 7.96 4.38 0.00 1.93 1.94 0.00 1.63 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.58 1.48 7.81 70 T 7.41 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 1.15 0.00 0.00 71 P 0.00 4.33 0.00 2.01 1.97 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 2.03 2.09 0.00 72 G 8.46 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 73 A 7.75 4.73 1.20 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 74 V 8.26 4.37 2.01 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 0.64 0.00 0.00 0.91 0.00 0.00 75 N 8.07 4.98 0.00 2.76 2.61 0.00 0.00 6.95 8.34 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 76 A 9.13 3.96 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 C 8.35 4.51 0.00 3.31 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 7.87 4.13 0.00 3.33 3.38 0.00 5.79 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.44 4.87 0.00 1.66 1.50 0.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.35 4.63 0.00 3.83 3.69 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 81 C 8.70 4.09 0.00 2.24 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 82 S 7.69 3.91 0.00 3.80 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 83 A 7.85 4.06 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 7.84 4.42 0.00 1.94 1.83 1.06 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.74 5.30 0.00 1.78 1.71 1.11 0.98 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 86 Q 7.84 4.36 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 7.34 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 87 D 8.52 4.39 0.00 2.65 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 4.62 0.00 2.70 2.75 0.00 0.00 6.97 7.96 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 89 I 8.44 4.25 1.80 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.89 0.95 0.00 0.00 90 A 8.26 3.94 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 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 8.00 4.12 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 93 V 8.24 3.41 2.12 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 0.70 0.00 0.00 0.93 0.00 0.00 94 A 8.05 3.87 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 8.34 4.22 0.00 3.07 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.12 3.90 0.80 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 97 K 7.58 3.82 0.00 1.64 1.49 0.00 1.26 0.00 0.00 0.80 0.00 0.00 2.20 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.30 0.84 7.81 98 R 7.56 4.06 0.00 1.92 2.12 0.00 3.27 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.90 0.00 99 V 7.48 2.34 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 -0.37 0.00 0.00 -0.71 0.00 0.00 100 V 7.81 3.86 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 1.44 0.00 0.00 101 R 7.65 4.14 0.00 2.21 2.01 0.00 3.38 0.00 0.00 3.60 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 102 D 7.31 4.71 0.00 3.12 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 0.00 103 P 0.00 4.32 0.00 2.15 2.19 0.00 3.76 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 1.97 2.00 0.00 104 Q 8.04 4.31 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 5.84 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 105 G 7.83 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 0.00 106 I 7.84 3.56 1.06 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.28 -0.36 -0.59 0.00 0.00 107 R 7.25 4.17 0.00 1.97 2.00 0.00 3.29 0.00 0.00 3.38 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.88 0.00 108 A 7.66 4.05 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.18 4.66 0.00 3.54 3.25 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 0.00 110 V 8.73 3.75 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 1.10 0.00 0.00 1.00 0.00 0.00 111 A 8.30 4.08 1.52 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 0.00 0.00 0.00 112 W 8.42 3.97 0.00 3.46 3.48 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 0.00 113 R 8.20 3.70 0.00 2.06 1.99 0.00 3.34 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.03 0.00 114 N 7.97 4.36 0.00 2.71 2.71 0.00 0.00 6.97 6.91 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 0.00 115 R 7.63 4.08 0.00 0.86 0.85 0.00 2.74 0.00 0.00 2.85 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.83 0.00 116 C 7.13 4.53 0.00 1.82 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 0.00 117 Q 6.51 3.13 0.00 0.93 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.76 0.00 0.00 0.00 0.00 0.00 2.18 2.19 0.00 118 N 8.67 4.19 0.00 2.79 2.81 0.00 0.00 6.86 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 0.00 119 R 7.33 4.52 0.00 1.79 1.80 0.00 3.22 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.53 0.00 120 D 8.47 4.55 0.00 2.64 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 8.19 4.59 2.39 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 1.04 0.00 0.00 1.05 0.00 0.00 122 R 8.09 4.04 0.00 2.11 2.02 0.00 3.24 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 123 Q 8.21 4.00 0.00 2.03 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.80 0.00 0.00 0.00 0.00 0.00 2.22 1.77 0.00 124 Y 7.80 4.26 0.00 3.24 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 0.00 125 V 7.94 4.35 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 1.09 0.00 0.00 1.04 0.00 0.00 126 Q 7.55 4.17 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 5.63 0.00 0.00 0.00 0.00 0.00 2.54 2.46 0.00 127 G 8.97 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 0.00 128 C 7.91 4.41 0.00 3.06 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 0.00 129 G 8.13 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.89 4.00 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 0.80 0.00 0.00 0.96 0.00 0.00