NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2748 8.2549 117.2620 56.2097 30.7598 174.5224 3 H 4.7886 8.6767 118.0370 53.8628 32.1455 171.9143 4 L 4.2079 9.6577 122.9711 54.6330 41.5113 175.3677 5 K 3.9085 8.0029 116.5670 59.2246 32.2045 175.8602 6 S 4.9955 7.4634 112.9588 56.5224 65.7042 171.7162 7 G 3.7877 8.0979 106.9828 45.4825 0.0000 172.2794 8 R 4.0692 8.7794 119.0730 56.4217 26.7964 175.7044 9 K 4.1785 8.0733 121.2719 56.8629 33.3987 177.3637 10 L 4.2319 8.0060 118.8759 54.3862 45.0298 173.8499 11 N 5.0288 8.6181 121.4350 52.4601 42.7925 175.0466 12 R 4.2074 10.6400 118.5959 56.0725 28.0095 175.6694 13 H 4.6338 8.6912 115.6194 56.6680 32.0493 176.5024 14 S 2.9957 8.1617 111.8420 58.3346 65.5388 174.7495 15 S 4.0676 6.1185 114.9099 61.8563 63.6020 175.9806 16 H 4.1215 7.9009 119.7193 57.7157 29.5355 176.5705 17 R 3.7943 7.7722 120.8246 59.2447 30.0393 177.6595 18 L 3.5268 7.4526 119.5659 58.0170 41.9628 178.6577 19 A 4.0841 8.0100 120.1196 54.7165 18.5176 179.0663 20 L 4.0530 7.3547 119.0877 58.4093 42.4747 178.3107 21 Y 4.6517 8.1268 116.1966 61.4352 37.7053 178.6745 22 R 4.4302 8.4307 117.8590 57.7635 30.3018 177.3868 23 N 4.8427 8.7931 115.5758 53.5350 39.2236 175.8696 24 Q 4.4576 8.0175 118.5631 56.0748 29.4728 176.7835 25 A 4.1624 7.4416 121.0616 54.1795 19.4208 179.3776 26 K 3.8560 7.4958 115.5815 59.7263 32.3323 179.4143 27 S 4.3202 7.8269 115.1671 61.5018 62.7935 176.5755 28 L 3.9908 7.4521 122.1706 58.1865 41.6959 179.0797 29 L 4.3453 7.7606 113.5890 55.6396 41.1588 177.8908 30 T 4.7119 7.4864 114.5493 63.3079 70.0261 174.1808 31 H 4.6546 8.6177 116.4025 55.4839 35.2540 175.0249 32 G 4.3522 9.1047 115.1235 45.8003 0.0000 173.7094 33 R 5.1832 7.6649 116.6989 53.9746 33.5916 174.9449 34 I 4.7634 8.9121 122.1350 59.8981 42.1498 174.3873 35 T 5.0219 8.7672 120.3337 61.4982 70.7356 173.1503 36 T 4.7658 8.0799 118.6539 60.8367 72.6017 173.3525 37 T 4.5774 8.0669 110.2112 61.0606 70.5043 175.4775 38 V 3.5351 8.0844 121.4769 66.2540 31.1133 176.2146 39 P 4.2106 0.0000 0.0000 65.6322 31.5066 178.0947 40 K 4.0591 7.6988 115.8621 59.8615 32.1034 178.6499 41 A 3.9605 7.8820 120.1498 55.3001 18.2057 179.6485 42 K 3.8998 8.2205 115.7550 58.5361 32.6572 177.8764 43 E 4.3190 7.7918 119.2618 57.7989 30.6343 177.3162 44 L 3.7964 8.2467 120.7687 58.4809 42.0723 177.8054 45 R 3.9148 7.9703 114.2122 58.9456 28.4898 178.7582 46 G 4.0212 7.9794 104.5990 47.2882 0.0000 174.2826 47 F 4.6071 8.3583 122.2945 61.4100 39.2352 177.0299 48 V 3.3577 8.1172 117.1544 66.4981 31.3982 178.0110 49 D 4.5305 7.9353 118.4247 57.9104 40.6171 178.7033 50 H 4.2044 8.0848 118.1399 59.2245 29.9008 176.8550 51 L 3.8268 7.5569 119.3395 58.0473 41.5590 179.6580 52 I 3.3974 7.8008 119.6216 64.7387 37.0881 177.6002 53 H 3.7421 8.0293 119.1182 59.5377 29.3176 176.7949 54 L 4.1295 7.8069 120.6134 57.7567 42.0993 178.3974 55 A 3.7405 7.9239 121.0911 54.5527 18.0149 179.3765 56 K 3.7438 7.4312 116.7195 59.6172 32.2793 179.7567 57 R 4.4917 7.5508 112.6292 57.0188 31.6872 176.6279 58 G 3.3626 6.8956 109.8837 44.4269 0.0000 172.3927 59 D 5.0619 7.2181 124.5803 51.6963 42.9380 178.4718 60 L 3.8425 8.2959 121.6476 59.0072 42.3586 178.2050 61 H 4.0284 8.5395 117.5345 59.3190 29.5042 176.3795 62 A 4.0588 8.3614 123.0290 55.7071 18.4762 179.0047 63 R 3.8334 8.6506 117.1712 59.8905 29.9329 178.5540 64 R 3.8313 8.1536 117.1975 59.4710 30.0989 178.8024 65 L 3.9313 7.8886 118.2930 57.6333 42.1700 178.3829 66 V 3.9727 7.8573 117.8236 64.9784 31.5482 177.3891 67 L 4.1685 7.3164 120.1998 57.0505 41.1301 179.4606 68 R 3.9684 8.0141 116.7504 60.2071 30.0872 177.2984 69 D 4.4860 8.0320 117.4320 56.5223 41.5887 176.8410 70 L 4.1742 7.4768 123.8417 54.3639 41.5436 177.8022 71 Q 4.1758 8.4625 125.1738 57.3142 29.7192 176.0450 72 D 4.3814 7.9135 118.0630 53.7898 41.9221 176.2725 73 V 3.4811 8.3558 126.7860 65.9593 31.6248 177.4527 74 K 3.7985 8.1654 118.7364 59.6786 32.1504 178.1418 75 L 3.9227 8.3436 120.5878 57.9511 41.6679 179.2948 76 V 3.4694 7.6837 119.1026 64.8731 31.2392 178.6261 77 R 4.0720 7.6376 119.0385 58.6949 30.1013 178.9710 78 K 3.9953 8.4393 119.2356 58.4877 31.8157 178.2707 79 L 4.2260 7.4118 119.4695 57.9117 42.5121 178.0982 80 F 4.3448 9.2111 117.3817 60.4569 38.9736 176.2931 81 D 4.6615 8.7425 116.8749 55.4257 41.2028 175.9846 82 E 4.5178 7.5756 116.7726 57.5158 32.2887 177.3468 83 I 3.7949 7.7197 120.2993 63.6620 37.7994 177.2208 84 A 4.4908 7.8989 123.3673 53.7040 19.4027 177.6359 85 P 4.3065 0.0000 0.0000 65.4030 31.5133 177.9940 86 R 3.9625 7.9610 114.0567 57.2297 30.2275 175.8073 87 Y 4.1684 7.8967 113.7835 55.3888 39.9110 177.1216 88 R 3.4830 9.1507 125.9294 58.2123 31.2034 175.8666 89 D 4.7392 9.0286 115.4048 54.6783 42.8997 176.2496 90 R 4.1358 8.0252 119.2167 55.7236 29.8704 176.2987 91 Q 4.1835 8.4726 126.2493 54.9417 27.5137 176.4545 92 G 3.2333 7.8434 110.1991 44.9172 0.0000 170.1123 93 G 3.8050 7.8746 102.4205 46.9120 0.0000 173.3390 94 Y 4.7002 7.4219 109.6590 58.1334 38.7027 175.4385 95 T 4.9367 7.5458 112.6203 60.6650 71.1931 172.9818 96 R 4.6547 8.6391 125.1399 54.8574 34.0723 173.8225 97 V 5.5815 8.4094 125.0260 60.3659 34.2831 174.3934 98 L 4.8428 8.3882 128.5917 52.4457 44.3966 176.0549 99 K 4.4521 8.7669 124.3951 56.8126 33.2638 176.5547 100 L 4.7992 7.8616 123.7902 52.6995 44.0470 176.2264 101 A 4.1643 8.3364 124.0792 52.7099 19.3007 174.5762 102 E 4.0630 8.7221 122.9903 56.4888 29.0605 174.5000 103 R 4.7187 8.0609 120.0288 53.6632 33.7543 175.4633 104 R 4.0336 8.0130 117.9085 56.7603 30.7870 178.2490 105 R 4.3936 8.4053 123.0853 54.8985 29.2967 176.9517 106 G 4.1291 7.0056 99.9881 45.2259 0.0000 172.4606 107 D 4.5430 8.6177 123.4366 52.0653 41.0562 175.8248 108 G 3.6693 8.0374 107.9171 47.0101 0.0000 173.6935 109 A 4.8364 7.7815 120.6485 48.8090 22.0893 175.3339 110 P 4.4312 0.0000 0.0000 63.0809 32.4020 176.3940 111 L 5.1329 8.4640 123.5583 53.9033 44.6498 174.2467 112 A 4.6763 9.2438 121.4820 51.4465 23.3068 174.5133 113 L 4.9906 8.5805 119.2841 53.4597 45.1742 175.6973 114 V 4.9735 8.6388 125.3493 61.2070 34.8621 173.8074 115 E 5.1908 9.2625 127.8295 54.1675 33.2477 175.7701 116 L 4.4062 8.3841 121.2931 54.5662 41.9782 177.5468 117 V 3.4613 7.9616 119.5847 62.1639 31.8499 171.2218 118 E 4.6950 8.9738 121.7608 55.7832 30.0315 176.1635 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 2 R 8.25 4.27 0.00 1.91 1.99 0.00 2.93 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.63 0.00 3 H 8.68 4.79 0.00 3.20 3.17 0.00 5.66 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 9.66 4.21 0.00 1.72 2.08 0.93 0.44 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 5 K 8.00 3.91 0.00 1.77 1.89 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.51 7.81 6 S 7.46 5.00 0.00 3.91 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 7 G 8.10 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 8 R 8.78 4.07 0.00 1.86 2.37 0.00 3.27 0.00 0.00 3.28 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.61 0.00 9 K 8.07 4.18 0.00 1.88 1.83 0.00 1.64 0.00 0.00 1.73 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.66 1.51 7.81 10 L 8.01 4.23 0.00 1.60 1.56 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.62 5.03 0.00 2.65 2.68 0.00 0.00 7.41 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 12 R 10.64 4.21 0.00 1.81 1.96 0.00 3.10 0.00 0.00 2.99 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.52 0.00 13 H 8.69 4.63 0.00 3.27 3.36 0.00 5.65 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.16 3.00 0.00 3.94 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 15 S 6.12 4.07 0.00 4.18 4.11 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 16 H 7.90 4.12 0.00 2.85 3.03 0.00 5.92 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.77 3.79 0.00 1.75 1.85 0.00 2.96 0.00 0.00 2.97 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.32 0.00 18 L 7.45 3.53 0.00 1.58 1.65 0.87 1.15 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 19 A 8.01 4.08 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 20 L 7.35 4.05 0.00 1.79 1.82 0.95 0.87 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 21 Y 8.13 4.65 0.00 3.20 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 22 R 8.43 4.43 0.00 1.98 2.06 0.00 3.18 0.00 0.00 3.44 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.05 0.00 23 N 8.79 4.84 0.00 2.87 2.87 0.00 0.00 6.75 7.39 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 24 Q 8.02 4.46 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.43 2.72 0.00 25 A 7.44 4.16 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 7.50 3.86 0.00 1.69 1.89 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.74 7.81 27 S 7.83 4.32 0.00 4.08 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 28 L 7.45 3.99 0.00 1.90 1.73 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 29 L 7.76 4.35 0.00 1.76 1.65 0.86 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.49 4.71 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 1.15 0.00 0.00 31 H 8.62 4.65 0.00 3.30 3.39 0.00 5.80 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 9.10 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 0.00 0.00 0.00 0.00 33 R 7.66 5.18 0.00 1.67 1.81 0.00 3.17 0.00 0.00 3.46 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 34 I 8.91 4.76 1.88 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 1.24 0.96 0.91 0.00 0.00 35 T 8.77 5.02 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 36 T 8.08 4.77 4.26 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 1.22 0.00 0.00 37 T 8.07 4.58 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 1.22 0.00 0.00 38 V 8.08 3.54 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 1.08 0.00 0.00 1.02 0.00 0.00 39 P 0.00 4.21 0.00 2.07 2.12 0.00 3.78 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 2.20 0.00 40 K 7.70 4.06 0.00 2.09 2.10 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.54 7.81 41 A 7.88 3.96 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 42 K 8.22 3.90 0.00 1.94 1.90 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.60 7.81 43 E 7.79 4.32 0.00 2.04 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 2.27 1.99 0.00 44 L 8.25 3.80 0.00 1.67 1.72 0.89 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.97 3.91 0.00 2.20 2.04 0.00 2.86 0.00 0.00 3.17 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.66 0.00 46 G 7.98 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 F 8.36 4.61 0.00 2.91 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 48 V 8.12 3.36 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 0.76 0.00 0.00 49 D 7.94 4.53 0.00 3.13 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 50 H 8.08 4.20 0.00 3.29 3.57 0.00 5.81 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 51 L 7.56 3.83 0.00 1.77 1.62 0.65 0.62 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 52 I 7.80 3.40 1.33 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.51 -0.38 0.00 0.00 53 H 8.03 3.74 0.00 3.29 3.39 0.00 5.58 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.81 4.13 0.00 1.69 1.69 0.88 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.92 3.74 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.43 3.74 0.00 1.77 1.80 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.32 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.48 1.37 7.81 57 R 7.55 4.49 0.00 2.00 1.99 0.00 3.13 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.83 0.00 58 G 6.90 3.36 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 0.00 59 D 7.22 5.06 0.00 2.84 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 60 L 8.30 3.84 0.00 1.83 1.74 0.94 0.87 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 61 H 8.54 4.03 0.00 3.25 3.40 0.00 5.75 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 62 A 8.36 4.06 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 R 8.65 3.83 0.00 2.32 2.14 0.00 3.15 0.00 0.00 3.12 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.87 0.00 64 R 8.15 3.83 0.00 2.00 1.93 0.00 3.19 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 65 L 7.89 3.93 0.00 1.60 1.84 0.96 1.36 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 66 V 7.86 3.97 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 0.92 0.00 0.00 1.04 0.00 0.00 67 L 7.32 4.17 0.00 1.78 1.68 0.82 0.64 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 68 R 8.01 3.97 0.00 1.94 2.05 0.00 3.22 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.90 0.00 69 D 8.03 4.49 0.00 2.69 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 70 L 7.48 4.17 0.00 1.62 1.55 0.82 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.46 4.18 0.00 1.98 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.97 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 72 D 7.91 4.38 0.00 2.80 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 73 V 8.36 3.48 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 0.93 0.00 0.00 0.90 0.00 0.00 74 K 8.17 3.80 0.00 1.86 2.15 0.00 1.65 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.55 7.81 75 L 8.34 3.92 0.00 2.09 1.73 0.88 0.83 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 76 V 7.68 3.47 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 0.67 0.00 0.00 0.36 0.00 0.00 77 R 7.64 4.07 0.00 2.01 2.16 0.00 3.13 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 78 K 8.44 4.00 0.00 1.80 2.02 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.45 7.81 79 L 7.41 4.23 0.00 1.84 1.87 1.17 0.56 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 80 F 9.21 4.34 0.00 2.90 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 81 D 8.74 4.66 0.00 2.77 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 82 E 7.58 4.52 0.00 1.98 1.83 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 2.29 2.31 0.00 83 I 7.72 3.79 2.06 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.77 1.04 0.00 0.00 84 A 7.90 4.49 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 85 P 0.00 4.31 0.00 2.03 2.13 0.00 3.83 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 86 R 7.96 3.96 0.00 1.40 1.73 0.00 3.10 0.00 0.00 3.37 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.75 0.00 87 Y 7.90 4.17 0.00 3.24 2.96 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 88 R 9.15 3.48 0.00 1.91 2.01 0.00 3.36 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 89 D 9.03 4.74 0.00 2.60 2.68 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 90 R 8.03 4.14 0.00 1.90 2.13 0.00 3.34 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 91 Q 8.47 4.18 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.29 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 92 G 7.84 3.23 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 0.00 93 G 7.87 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 94 Y 7.42 4.70 0.00 2.83 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.55 4.94 4.34 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 1.38 0.00 0.00 96 R 8.64 4.65 0.00 1.91 1.70 0.00 3.10 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 97 V 8.41 5.58 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 1.08 0.00 0.00 0.93 0.00 0.00 98 L 8.39 4.84 0.00 1.60 1.54 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.77 4.45 0.00 1.76 1.82 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.42 7.81 100 L 7.86 4.80 0.00 1.49 1.62 0.96 0.80 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 0.00 101 A 8.34 4.16 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 0.00 102 E 8.72 4.06 0.00 2.16 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 2.19 2.32 0.00 103 R 8.06 4.72 0.00 1.75 1.96 0.00 3.21 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 104 R 8.01 4.03 0.00 2.06 1.86 0.00 3.12 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 105 R 8.41 4.39 0.00 1.80 1.92 0.00 3.24 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 106 G 7.01 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 0.00 0.00 0.00 107 D 8.62 4.54 0.00 2.74 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 0.00 108 G 8.04 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 0.00 109 A 7.78 4.84 1.26 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 0.00 110 P 0.00 4.43 0.00 2.13 2.21 0.00 3.69 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 111 L 8.46 5.13 0.00 1.62 1.80 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 112 A 9.24 4.68 1.19 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 0.00 0.00 113 L 8.58 4.99 0.00 1.77 1.66 1.01 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.64 4.97 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 0.98 0.00 0.00 0.93 0.00 0.00 115 E 9.26 5.19 0.00 2.02 1.75 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 2.33 2.27 0.00 116 L 8.38 4.41 0.00 1.65 1.80 0.97 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 117 V 7.96 3.46 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 0.82 0.00 0.00 1.02 0.00 0.00 118 E 8.97 4.69 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00