NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3814 8.3044 120.3493 54.7942 33.4239 174.9028 2 I 3.5842 8.3718 125.7287 61.1104 38.6813 173.3263 3 Q 4.9676 8.4394 125.7841 54.1624 33.0524 174.0735 4 S 5.1141 8.4699 115.4875 56.9526 66.3755 173.1484 5 Q 4.7985 8.8774 120.6944 54.7486 30.1596 175.7323 6 I 4.3903 8.3952 111.7374 59.9318 39.2513 174.6946 7 N 4.8345 7.8786 119.9785 51.1258 40.1379 174.5192 8 R 3.9613 8.6219 124.2862 59.4418 29.1363 178.2182 9 N 4.4275 8.5035 117.1295 55.8238 38.2644 177.4437 10 I 3.6919 7.4767 121.7633 64.6110 37.2474 178.6985 11 R 3.9895 7.9029 118.0187 58.8304 30.0390 178.9343 12 L 4.0252 8.0169 119.3074 57.6692 41.6359 179.0516 13 D 4.3894 8.4021 119.2476 57.0439 40.6255 178.5784 14 L 3.9266 7.7929 120.9587 57.9989 42.0570 178.5370 15 A 4.2366 8.0920 122.2858 54.8438 18.1300 179.4166 16 D 4.2860 8.1066 116.5770 57.3975 40.9080 178.9240 17 A 4.0156 7.9194 120.9296 55.1240 18.3026 179.7124 18 I 3.6636 8.1366 118.7596 64.6396 37.3208 178.7372 19 L 3.9785 8.2544 119.9447 57.4713 41.3222 179.2617 20 L 4.0250 7.8252 120.3779 57.7662 42.0342 178.8567 21 S 4.0281 8.0051 113.2247 61.2623 62.3871 176.0297 22 K 3.8438 8.2678 122.3035 59.2939 31.8163 178.7061 23 A 3.8963 7.8801 120.7074 55.0108 18.1814 179.4047 24 K 3.7724 7.8840 115.9350 59.7240 32.3383 178.8942 25 K 4.1610 7.9270 114.9270 55.5733 32.8174 176.0101 26 D 4.3061 7.6781 117.8895 55.0668 39.9928 173.2943 27 L 4.6072 8.2124 117.2297 53.8431 43.4183 177.4267 28 S 4.6709 8.1754 115.6813 56.7992 66.6433 175.5695 29 F 4.2767 8.4718 120.8217 60.2418 38.2251 177.9538 30 A 4.0375 8.0695 120.4128 55.3319 18.0986 179.3607 31 E 3.9658 7.8011 115.3923 59.4968 29.5442 179.4454 32 I 3.8630 7.4669 118.4439 64.3115 37.3552 178.0094 33 A 4.2297 7.8491 119.1986 52.8112 18.6120 177.1036 34 D 4.3631 7.1551 117.6573 55.1259 41.7660 176.1781 35 G 3.8967 9.0573 114.1789 46.5807 0.0000 173.6927 36 T 4.3202 7.8737 114.0747 60.4758 69.3628 175.0554 37 G 3.9752 8.4654 107.4390 45.4617 0.0000 172.9183 38 L 4.7073 7.4681 117.7624 51.5608 45.3549 176.8367 39 A 4.1527 8.5294 124.1205 52.4253 20.2611 178.8137 40 E 4.0194 8.8479 120.8633 59.3824 29.7012 179.5707 41 A 3.9254 7.9506 121.4545 54.8003 18.5687 179.2312 42 F 3.7614 8.1081 118.6607 61.3616 39.6831 177.4362 43 V 3.6328 7.9775 117.8247 66.3175 31.3926 177.8563 44 T 3.8494 7.9624 115.2481 66.7917 68.2449 176.2306 45 A 3.8451 7.7887 122.1423 54.9358 18.2055 179.5630 46 A 4.0874 7.4424 120.2782 54.9385 18.1592 179.6922 47 L 3.9573 7.9119 117.4153 57.7926 41.4543 178.8723 48 L 4.5525 7.6036 116.0939 54.3309 41.6968 177.3519 49 G 3.8823 8.2250 107.3157 45.9186 0.0000 174.3642 50 Q 4.5300 8.2427 115.8304 55.3351 29.7520 175.1927 51 Q 4.4033 7.4112 115.9932 54.3337 32.9141 172.7181 52 A 4.7229 8.3045 121.3189 50.6512 20.4973 176.8343 53 L 4.4833 9.0361 123.6490 53.4681 43.1524 175.2615 54 P 4.3959 0.0000 0.0000 62.5286 32.3990 177.1964 55 A 3.9897 8.8679 123.8443 55.8016 18.2374 179.6803 56 D 4.2387 8.1706 116.4587 57.3750 40.9297 178.3357 57 A 3.9980 8.1256 120.1799 55.5979 18.3151 179.2870 58 A 3.9628 8.3772 119.1697 55.5792 18.5556 180.1716 59 R 3.9269 8.0812 116.5386 58.9589 30.0435 179.0163 60 L 3.9323 7.9744 120.2289 58.4372 42.1098 179.5948 61 V 3.7843 8.1038 112.5867 64.3013 31.3853 178.8558 62 G 3.6218 8.2482 105.3665 47.4893 0.0000 175.7600 63 A 4.0273 7.9489 122.7241 55.0251 18.2667 179.6530 64 K 3.8044 7.4746 115.1661 59.7230 32.1406 178.2678 65 L 4.2790 8.1162 115.1863 54.3330 41.8704 176.1537 66 D 4.4310 7.5673 117.0379 55.3429 38.4028 174.1461 67 L 4.3503 8.4125 118.8497 53.8703 43.0168 177.6627 68 D 4.6407 8.2912 121.6550 53.3468 41.6267 177.3017 69 E 4.0739 8.5816 118.9470 59.2909 29.4356 179.1551 70 D 4.4059 8.0917 118.7871 57.4094 40.8866 178.8452 71 S 4.1284 8.8014 116.1375 61.6435 62.6721 176.7184 72 I 3.7471 7.4895 121.2918 64.1640 37.0693 177.9651 73 L 4.2905 8.0331 121.3176 58.0192 42.1056 178.8301 74 L 4.0211 8.1655 119.1533 57.8072 41.6007 179.2843 75 L 4.1817 8.0601 118.0337 56.7147 41.3216 178.4059 76 Q 4.8464 7.5460 117.8247 55.0516 29.6913 175.7465 77 M 4.5065 7.1315 119.6197 54.8640 33.1764 176.4273 78 I 4.0126 8.6159 124.0142 60.7781 38.0009 174.2577 79 P 4.6982 0.0000 0.0000 62.2233 32.8297 176.3604 80 L 4.3263 8.3081 123.2747 54.1435 41.4635 176.4257 81 R 4.1457 8.2988 124.8867 55.7398 30.9473 175.1017 82 G 3.0714 8.3677 107.2293 44.8506 0.0000 173.3414 83 C 4.3432 8.1969 122.3011 58.2647 30.7849 174.1942 84 I 3.9789 7.5448 122.1210 60.5280 37.2999 174.6555 85 D 4.5001 8.9275 125.9063 57.0460 41.2937 176.7767 86 D 4.6250 7.2059 116.1320 53.0680 41.4279 174.2754 87 R 4.2206 8.3556 126.5702 56.3555 29.4275 177.0907 88 I 4.1413 7.1648 116.2444 58.2883 39.7043 173.7154 89 P 4.4336 0.0000 0.0000 62.9139 31.7994 176.4156 90 T 4.2210 8.3028 111.0444 62.9959 70.0290 175.2610 91 D 4.5071 7.9754 122.5013 53.2086 42.3700 174.5498 92 P 4.2697 0.0000 0.0000 66.2715 31.1800 178.7634 93 T 3.9786 7.9896 113.0335 66.9697 68.5494 176.1741 94 M 4.5047 8.1923 120.4390 58.3441 32.0825 178.1508 95 Y 3.9999 8.9750 120.4041 60.5751 38.9003 178.1834 96 K 4.0389 8.0881 119.0069 59.4203 31.8992 179.2691 97 F 4.1409 7.8247 118.1105 60.3476 38.7951 177.1571 98 Y 3.9078 7.9057 118.8873 60.5328 38.5819 177.3572 99 E 3.6810 8.1985 120.4980 59.5677 29.7140 178.4582 100 M 4.0902 8.0979 118.6759 58.7745 32.0112 178.8506 101 L 4.0030 7.5235 118.8944 57.7660 41.5206 179.5497 102 Q 3.8350 7.3576 117.3405 58.5709 28.6143 178.5434 103 V 3.6385 7.7624 118.7542 64.9545 31.8812 176.2603 104 Y 4.7236 7.8086 113.4195 57.4576 39.2172 177.6821 105 G 3.6106 8.3014 109.6414 48.1386 0.0000 176.2755 106 T 4.0542 7.8406 111.7553 64.3848 68.9334 176.9965 107 T 3.8764 7.8800 118.2358 66.5279 68.5833 176.1228 108 L 3.9750 8.1889 121.1700 57.8138 41.5968 179.3883 109 K 3.7429 7.9465 118.6657 59.6690 32.1945 178.4330 110 A 4.0311 8.2243 121.0664 55.3058 18.3161 179.3984 111 L 4.1649 8.2727 117.0785 57.0192 41.8474 179.7989 112 V 3.8435 7.9395 118.8630 66.4491 31.0442 177.8635 113 H 4.8007 8.4425 117.4634 57.9904 28.1908 177.5634 114 E 3.9515 7.8660 120.2982 59.3838 29.7209 178.6724 115 K 3.8892 7.9380 117.1416 58.2091 32.0745 177.5578 116 F 4.1238 8.7811 115.2463 59.9024 40.8976 175.0730 117 G 3.9342 8.0858 104.8491 43.1677 0.0000 171.6968 118 D 4.5603 8.8346 119.5688 54.3138 42.1581 176.2593 119 G 4.2050 7.8206 112.8464 45.5605 0.0000 172.1263 120 I 4.7726 8.0685 114.5200 59.3735 41.7009 174.5731 121 I 4.5309 8.1763 124.2741 60.3047 37.8440 175.9207 122 S 4.2300 9.1677 122.7884 58.5180 62.7961 173.7912 123 A 3.9045 8.5300 126.9062 51.8772 19.5117 176.4727 124 I 4.2645 7.6215 115.3625 63.2740 39.2128 177.1284 125 N 4.7597 7.8101 124.0568 52.7801 37.7849 171.9095 126 F 5.2894 8.0174 122.6899 56.6111 42.6712 172.3630 127 K 4.5264 8.5158 126.3767 54.4449 35.8536 174.4249 128 L 5.3791 8.2832 125.6703 52.6483 45.2560 174.6937 129 D 4.9225 8.5311 123.7578 51.7522 43.7872 174.2176 130 V 4.7434 8.2656 117.9684 61.3084 34.2018 174.3865 131 K 4.6287 9.0380 128.2816 54.3220 34.7561 175.5331 132 K 4.7214 8.6831 126.6273 56.1888 33.0137 176.3452 133 V 4.5374 8.5043 120.2947 59.1182 35.2875 175.2872 134 A 4.3794 8.8813 127.2645 52.3475 19.2975 176.1543 135 D 4.5670 9.4053 121.3035 52.5655 41.9605 175.5607 136 P 3.9442 0.0000 0.0000 66.0032 31.3876 177.0833 137 E 4.1190 8.1983 114.3352 56.5298 29.7449 177.0940 138 G 3.9249 8.9241 108.3545 46.0373 0.0000 175.5181 139 G 3.8476 8.7252 109.5225 44.2697 0.0000 171.3937 140 E 4.9874 8.5082 116.8847 54.6372 32.4784 176.2584 141 R 4.7206 8.6548 122.0227 54.5966 33.5695 174.6890 142 A 5.1632 8.4546 121.9789 50.2576 21.2687 176.0235 143 V 4.3036 8.7051 122.9748 61.2499 33.9652 174.3387 144 I 4.9775 8.4791 128.7196 59.8283 39.9746 175.0847 145 T 4.5275 8.6832 123.9318 61.7145 71.0864 173.3866 146 L 4.3459 8.6526 126.8800 53.4025 42.9697 175.7416 147 D 4.7213 8.5865 126.2451 52.4499 42.3342 175.1703 148 G 4.7145 8.4202 111.9561 44.0203 0.0000 170.6534 149 K 4.4258 8.7208 122.2154 56.0713 33.8396 175.0243 150 Y 4.8189 8.4996 126.8734 56.7267 39.8919 174.6454 151 L 4.4213 8.3671 128.0372 52.0417 43.2021 174.4117 152 P 4.5335 0.0000 0.0000 62.7330 32.8232 175.7782 153 T 4.6559 8.7259 117.9640 61.8721 70.7968 173.8477 154 K 4.8232 8.4984 124.8875 53.4851 36.0022 174.2133 155 P 4.2471 0.0000 0.0000 62.4975 32.2124 176.2952 156 F 4.5315 7.6722 113.1407 57.2517 37.9679 174.5829 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 M 8.30 4.38 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.37 3.58 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.05 0.91 0.00 0.00 3 Q 8.44 4.97 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.46 2.26 0.00 4 S 8.47 5.11 0.00 3.80 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 5 Q 8.88 4.80 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 6 I 8.40 4.39 1.87 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 1.30 0.66 0.91 0.00 0.00 7 N 7.88 4.83 0.00 2.77 2.70 0.00 0.00 6.95 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 8 R 8.62 3.96 0.00 2.06 2.35 0.00 3.09 0.00 0.00 3.32 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 9 N 8.50 4.43 0.00 2.85 2.91 0.00 0.00 6.85 7.19 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 10 I 7.48 3.69 1.87 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 1.52 1.01 0.91 0.00 0.00 11 R 7.90 3.99 0.00 1.81 1.96 0.00 3.28 0.00 0.00 3.48 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 12 L 8.02 4.03 0.00 1.70 1.70 0.91 1.03 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 D 8.40 4.39 0.00 2.92 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 14 L 7.79 3.93 0.00 1.71 1.83 0.93 1.17 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 15 A 8.09 4.24 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 16 D 8.11 4.29 0.00 2.94 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 17 A 7.92 4.02 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 18 I 8.14 3.66 2.05 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 1.53 0.73 0.94 0.00 0.00 19 L 8.25 3.98 0.00 1.85 1.74 1.00 0.88 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 20 L 7.83 4.03 0.00 1.72 1.65 0.92 1.27 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 21 S 8.01 4.03 0.00 3.95 3.99 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 22 K 8.27 3.84 0.00 1.76 1.91 0.00 1.07 0.00 0.00 1.07 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.20 1.29 7.81 23 A 7.88 3.90 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 24 K 7.88 3.77 0.00 1.89 1.90 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.66 7.81 25 K 7.93 4.16 0.00 1.76 1.82 0.00 1.83 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.53 7.81 26 D 7.68 4.31 0.00 2.79 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 27 L 8.21 4.61 0.00 1.63 1.44 0.85 0.70 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 28 S 8.18 4.67 0.00 4.08 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 29 F 8.47 4.28 0.00 3.19 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 30 A 8.07 4.04 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 31 E 7.80 3.97 0.00 2.07 2.02 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 2.35 2.35 0.00 32 I 7.47 3.86 1.92 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 1.43 0.51 0.97 0.00 0.00 33 A 7.85 4.23 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 34 D 7.16 4.36 0.00 2.85 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 35 G 9.06 3.90 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 0.00 0.00 0.00 36 T 7.87 4.32 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 1.36 0.00 0.00 37 G 8.47 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 0.00 0.00 0.00 0.00 38 L 7.47 4.71 0.00 1.66 1.60 0.99 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.53 4.15 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 40 E 8.85 4.02 0.00 2.26 2.28 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 2.38 2.38 0.00 41 A 7.95 3.93 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 42 F 8.11 3.76 0.00 3.20 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 43 V 7.98 3.63 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 1.06 0.00 0.00 1.07 0.00 0.00 44 T 7.96 3.85 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 0.32 0.00 0.00 45 A 7.79 3.85 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 46 A 7.44 4.09 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 47 L 7.91 3.96 0.00 1.98 1.85 1.14 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.60 4.55 0.00 1.68 1.64 0.76 1.03 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 49 G 8.22 3.88 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 0.00 0.00 0.00 50 Q 8.24 4.53 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.24 6.63 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 51 Q 7.41 4.40 0.00 1.49 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.92 0.00 0.00 0.00 0.00 0.00 2.00 1.35 0.00 52 A 8.30 4.72 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 53 L 9.04 4.48 0.00 1.62 1.66 0.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.40 0.00 2.09 1.98 0.00 3.69 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 55 A 8.87 3.99 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 56 D 8.17 4.24 0.00 2.71 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 57 A 8.13 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 58 A 8.38 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 59 R 8.08 3.93 0.00 2.06 1.99 0.00 3.14 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 60 L 7.97 3.93 0.00 1.93 1.78 0.95 0.97 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 61 V 8.10 3.78 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 0.90 0.00 0.00 1.01 0.00 0.00 62 G 8.25 3.62 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 0.00 0.00 0.00 63 A 7.95 4.03 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 64 K 7.47 3.80 0.00 1.90 1.89 0.00 1.89 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.43 7.81 65 L 8.12 4.28 0.00 1.61 1.69 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.57 4.43 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 67 L 8.41 4.35 0.00 1.59 1.59 0.93 0.42 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 68 D 8.29 4.64 0.00 2.94 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 69 E 8.58 4.07 0.00 2.00 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 2.40 2.34 0.00 70 D 8.09 4.41 0.00 2.85 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 71 S 8.80 4.13 0.00 4.07 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 72 I 7.49 3.75 2.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.64 0.97 0.00 0.00 73 L 8.03 4.29 0.00 1.82 1.94 0.93 0.58 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 74 L 8.17 4.02 0.00 1.89 1.71 0.92 0.71 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 75 L 8.06 4.18 0.00 1.90 1.73 0.94 0.94 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 76 Q 7.55 4.85 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.89 0.00 0.00 0.00 0.00 0.00 2.53 2.36 0.00 77 M 7.13 4.51 0.00 1.95 2.10 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.53 0.00 78 I 8.62 4.01 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.86 0.92 0.00 0.00 79 P 0.00 4.70 0.00 2.13 2.03 0.00 3.75 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 1.95 2.13 0.00 80 L 8.31 4.33 0.00 1.67 1.65 0.91 0.93 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 81 R 8.30 4.15 0.00 1.81 1.87 0.00 3.23 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 82 G 8.37 3.07 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 0.00 0.00 0.00 0.00 83 C 8.20 4.34 0.00 3.05 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 84 I 7.54 3.98 1.85 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 0.52 0.91 0.00 0.00 85 D 8.93 4.50 0.00 2.62 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 86 D 7.21 4.62 0.00 2.59 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.36 4.22 0.00 1.96 2.03 0.00 3.19 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 88 I 7.16 4.14 1.76 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.77 0.71 0.00 0.00 89 P 0.00 4.43 0.00 2.16 2.03 0.00 3.31 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 90 T 8.30 4.22 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 91 D 7.98 4.51 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 92 P 0.00 4.27 0.00 2.23 2.13 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 93 T 7.99 3.98 4.50 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 1.36 0.00 0.00 94 M 8.19 4.50 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.60 0.00 95 Y 8.98 4.00 0.00 3.20 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 96 K 8.09 4.04 0.00 1.62 1.55 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.66 1.61 7.81 97 F 7.82 4.14 0.00 3.31 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 98 Y 7.91 3.91 0.00 2.95 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 99 E 8.20 3.68 0.00 1.94 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 0.00 2.31 2.42 0.00 100 M 8.10 4.09 0.00 2.15 2.32 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.62 0.00 101 L 7.52 4.00 0.00 1.45 1.55 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.36 3.83 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.97 0.00 0.00 0.00 0.00 0.00 1.71 2.36 0.00 103 V 7.76 3.64 1.84 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 0.12 0.00 0.00 0.89 0.00 0.00 104 Y 7.81 4.72 0.00 3.31 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 0.00 105 G 8.30 3.61 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 0.00 0.00 0.00 106 T 7.84 4.05 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 0.00 107 T 7.88 3.88 4.59 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 1.32 0.00 0.00 108 L 8.19 3.97 0.00 1.85 1.74 0.94 1.16 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 0.00 109 K 7.95 3.74 0.00 1.85 2.04 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.44 7.81 110 A 8.22 4.03 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 0.00 111 L 8.27 4.16 0.00 1.79 1.76 0.94 1.10 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 0.00 112 V 7.94 3.84 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 1.01 0.00 0.00 0.96 0.00 0.00 113 H 8.44 4.80 0.00 3.40 3.35 0.00 5.68 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 0.00 114 E 7.87 3.95 0.00 2.09 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 0.00 2.29 2.33 0.00 115 K 7.94 3.89 0.00 1.55 1.11 0.00 1.82 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.30 1.38 7.81 116 F 8.78 4.12 0.00 2.12 1.45 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 0.00 117 G 8.09 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 0.00 118 D 8.83 4.56 0.00 2.76 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 0.00 119 G 7.82 4.21 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 0.00 0.00 0.00 120 I 8.07 4.77 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.01 0.91 0.00 0.00 121 I 8.18 4.53 1.83 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.66 0.92 0.00 0.00 122 S 9.17 4.23 0.00 3.82 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 0.00 123 A 8.53 3.90 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 0.00 124 I 7.62 4.26 1.87 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 1.14 0.94 0.93 0.00 0.00 125 N 7.81 4.76 0.00 2.80 2.76 0.00 0.00 6.47 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 0.00 126 F 8.02 5.29 0.00 3.06 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 0.00 127 K 8.52 4.53 0.00 1.68 1.36 0.00 1.45 0.00 0.00 1.50 0.00 0.00 2.85 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.17 1.20 7.81 128 L 8.28 5.38 0.00 1.48 1.41 1.05 1.19 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 0.00 129 D 8.53 4.92 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 0.00 130 V 8.27 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 0.87 0.00 0.00 0.90 0.00 0.00 131 K 9.04 4.63 0.00 1.68 1.68 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.49 7.81 132 K 8.68 4.72 0.00 1.79 1.75 0.00 1.86 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.49 7.81 133 V 8.50 4.54 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 0.71 0.00 0.00 0.94 0.00 0.00 134 A 8.88 4.38 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 0.00 135 D 9.41 4.57 0.00 2.73 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 0.00 136 P 0.00 3.94 0.00 2.08 2.13 0.00 3.73 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 137 E 8.20 4.12 0.00 1.96 1.99 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 2.31 2.31 0.00 138 G 8.92 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 0.00 139 G 8.73 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 0.00 0.00 0.00 140 E 8.51 4.99 0.00 1.83 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 2.20 2.30 0.00 141 R 8.65 4.72 0.00 1.89 1.83 0.00 3.28 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 142 A 8.45 5.16 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 0.00 143 V 8.71 4.30 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 1.06 0.00 0.00 0.94 0.00 0.00 144 I 8.48 4.98 1.98 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.87 0.93 0.00 0.00 145 T 8.68 4.53 4.40 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 1.18 0.00 0.00 146 L 8.65 4.35 0.00 1.62 1.95 1.00 1.33 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 0.00 147 D 8.59 4.72 0.00 2.61 2.44 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 0.00 148 G 8.42 4.71 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 0.00 0.00 0.00 149 K 8.72 4.43 0.00 1.95 1.70 0.00 1.56 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.46 7.81 150 Y 8.50 4.82 0.00 2.51 2.86 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 0.00 151 L 8.37 4.42 0.00 1.42 1.43 0.87 0.88 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 0.00 152 P 0.00 4.53 0.00 2.04 1.97 0.00 3.44 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.93 0.00 153 T 8.73 4.66 4.27 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 1.25 0.00 0.00 154 K 8.50 4.82 0.00 1.72 1.69 0.00 1.82 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.46 7.81 155 P 0.00 4.25 0.00 2.01 1.94 0.00 3.64 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 156 F 7.67 4.53 0.00 3.05 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