NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3071 8.3049 118.1926 53.2331 33.3644 171.7680 2 L 3.3683 7.8765 126.4246 52.7808 41.9033 172.8621 3 T 4.0695 8.7609 114.1549 63.3783 70.4308 174.1667 4 D 4.6749 7.6830 120.6712 50.7606 43.5331 173.3016 5 P 4.3958 0.0000 0.0000 66.3932 31.4022 178.0228 6 I 3.7528 8.0607 117.7157 64.6145 37.0433 177.9062 7 A 4.0909 9.6002 122.5420 54.4337 18.2562 179.1953 8 D 4.2062 7.7691 117.4609 57.4982 41.3592 177.8924 9 M 3.9560 7.9482 118.5802 58.8303 32.3397 178.0462 10 L 4.0258 7.9089 118.4967 58.0876 41.6254 179.5537 11 T 3.7274 8.0504 115.5227 66.9761 68.4694 176.3341 12 R 3.8457 8.0797 119.3777 59.7253 30.1398 178.4966 13 I 3.5625 8.3738 119.1605 64.9201 37.0678 177.9571 14 R 3.7183 7.9466 118.0061 59.8153 30.1520 177.8015 15 N 4.3665 8.9113 116.0813 56.5740 38.4987 176.7802 16 A 3.9486 8.5514 122.5567 55.3552 18.4554 179.4417 17 T 3.7814 8.6712 107.7675 65.1349 68.3279 176.2196 18 R 3.8911 7.4651 118.8055 57.5580 30.2399 177.3689 19 V 3.9863 7.6603 109.7710 60.7267 32.7893 176.0241 20 Y 4.3441 7.1467 114.9837 58.7589 36.0341 169.0585 21 K 4.0067 7.7674 117.8864 56.1030 32.8552 175.5034 22 E 4.1995 9.1423 125.3571 58.9680 29.7038 176.3070 23 S 5.3245 7.4372 109.3809 58.0297 65.9742 173.1288 24 T 4.6709 8.0261 116.2322 62.1697 73.0663 173.6669 25 D 5.8500 8.8727 124.8579 53.6381 42.8971 175.6788 26 V 4.4099 8.6130 114.6546 60.8449 33.5721 169.6735 27 P 3.8177 0.0000 0.0000 62.3640 31.9331 175.7144 28 A 4.4894 7.8817 124.6613 51.8422 19.7246 177.3451 29 S 4.5176 8.4082 112.2823 55.9035 65.6805 175.8217 30 R 3.8798 8.8479 123.2890 59.7573 29.4311 178.4872 31 F 4.1850 8.0947 119.5064 61.1148 39.6537 177.4840 32 K 3.8736 9.4093 118.7858 59.6597 31.6575 178.5231 33 E 3.4616 8.2678 118.6999 59.5092 29.1545 178.9138 34 E 3.6231 7.7799 118.7357 59.8506 29.9624 179.7542 35 I 3.6124 7.5925 119.6295 64.3294 37.1492 178.3862 36 L 3.8748 7.8715 120.0083 57.7545 41.5406 179.3979 37 R 4.1157 8.6203 119.1301 58.7667 29.9770 177.4214 38 I 4.3071 7.6280 117.8733 62.7745 38.7913 177.5805 39 L 4.1932 7.8271 119.2257 57.7862 41.3376 178.6572 40 A 4.3715 9.2067 123.0508 53.9075 18.3692 180.0584 41 R 3.6909 7.3068 116.3867 59.1474 30.6236 177.3510 42 E 4.3344 8.1593 114.0916 55.9611 30.0144 176.2017 43 G 3.7213 8.6299 107.2701 46.5068 0.0000 174.8575 44 F 4.5357 8.9751 120.5063 57.6656 40.4820 176.1651 45 I 4.7638 7.3171 112.8721 58.8932 39.8836 177.1933 46 K 4.1013 9.1274 124.3246 57.8598 32.7527 177.4529 47 G 4.2787 7.5178 104.2304 47.0701 0.0000 170.4301 48 Y 6.3000 8.0712 116.2120 56.6159 40.7703 173.9915 49 E 4.7214 8.8099 117.5084 54.0393 33.5185 175.9941 50 R 4.9379 8.2899 120.2686 54.9563 28.2052 176.7550 51 V 3.7845 7.8915 119.2455 63.7037 33.1214 174.4964 52 D 5.3655 8.5962 123.0756 52.6427 44.0294 176.0904 53 V 4.0762 8.5221 122.8845 62.2199 34.0254 174.9284 54 D 4.2584 9.6777 129.3663 55.6188 37.7936 175.8456 55 G 3.9672 7.9078 103.6570 45.9496 0.0000 172.1273 56 K 4.4364 7.8287 120.4157 54.0118 33.1528 174.0625 57 P 4.6278 0.0000 0.0000 64.0395 32.5770 175.1677 58 Y 5.0574 8.7679 119.9066 56.8669 43.2935 173.3877 59 L 5.0065 8.8338 118.5970 53.5856 46.0779 176.4621 60 R 4.3118 8.6992 123.2937 55.6197 31.4554 175.7070 61 V 4.6159 8.1093 125.2469 61.7308 33.3183 174.3442 62 Y 4.8480 9.2863 127.4719 56.8350 38.9989 174.9538 63 L 4.6717 8.8730 125.9636 54.0946 42.5758 177.0338 64 K 4.5454 8.0138 125.3270 56.4321 32.9827 175.2129 65 Y 4.8962 8.5494 122.0066 56.0822 43.1504 174.5996 66 G 3.9230 8.5883 108.6326 45.5247 0.0000 171.5313 67 P 4.7195 0.0000 0.0000 61.4278 32.9920 176.5446 68 R 4.2912 8.4656 121.8122 56.8070 30.3903 175.2217 69 R 4.7496 7.9971 117.1114 54.4563 33.9408 174.9077 70 Q 4.5031 8.5499 118.0870 55.4395 30.9960 177.4188 71 G 3.8024 8.4448 107.6901 43.9038 0.0000 171.0066 72 P 4.0305 0.0000 0.0000 63.7923 31.5985 172.8710 73 D 4.3476 8.7964 127.7000 53.2525 38.7500 172.4555 74 P 4.6726 0.0000 0.0000 62.3441 30.8881 177.2513 75 R 4.0009 7.9500 119.0595 56.4622 30.0771 174.9766 76 P 4.7559 0.0000 0.0000 61.9587 32.3359 175.9818 77 E 4.2256 8.9492 123.9182 56.9696 31.0906 175.0261 78 Q 4.8355 8.3754 119.2600 53.9117 30.7806 176.2832 79 V 3.5771 8.8170 124.5283 65.1357 31.7928 175.5321 80 I 4.3832 7.3025 120.9628 59.7662 37.4189 175.0951 81 H 4.3152 8.7686 123.1887 58.5077 29.2369 176.0199 82 H 4.2580 7.7703 120.3884 54.4414 32.5615 171.7537 83 I 4.6190 7.5260 125.4765 59.1990 41.1881 174.4459 84 R 4.3669 7.7715 124.9878 55.2351 33.9504 173.9053 85 R 3.7647 8.6929 127.0711 57.1222 30.5139 174.3302 86 I 3.9726 8.0755 124.3968 62.3243 38.7249 175.9119 87 S 4.1926 7.4256 128.3229 59.0508 61.7703 174.5891 88 K 4.3896 8.1621 126.8495 54.4064 33.1216 176.7018 89 P 4.2640 0.0000 0.0000 65.8964 31.2579 178.0812 90 G 3.6768 7.9647 105.9066 47.1630 0.0000 173.8646 91 R 4.4281 7.3854 118.9255 55.3464 31.1395 173.5642 92 R 4.0935 8.4194 123.1824 55.8495 30.9583 176.2627 93 V 4.3318 8.9369 123.1994 61.6368 33.4023 174.5398 94 Y 4.8325 8.4156 124.7477 56.0682 38.5639 173.9843 95 V 3.9010 7.9260 115.6592 60.8884 33.3253 177.4201 96 G 4.2191 8.8996 115.4185 45.3139 0.0000 173.1838 97 V 3.9010 8.2644 117.6762 64.8204 31.8320 179.8921 98 K 4.4019 7.9046 117.8086 55.8520 31.0381 177.4739 99 E 4.6824 8.8964 117.5120 55.4479 31.6639 176.5307 100 I 3.7883 7.7271 119.9296 60.5540 37.6398 174.0518 101 P 4.5198 0.0000 0.0000 63.0433 32.4908 176.8199 102 R 4.4968 7.9751 116.5647 53.6949 30.2531 174.1223 103 V 3.4937 7.8095 117.7721 63.8197 31.8115 175.6130 104 R 3.5936 9.0302 128.8461 57.6102 28.5839 176.1269 105 R 3.6366 8.5176 111.8762 56.7821 27.6318 175.7017 106 G 4.3693 8.3352 112.8205 45.9550 0.0000 173.0064 107 L 4.0729 7.9507 118.5093 56.9987 41.8293 177.9014 108 G 4.2433 8.0394 105.1151 45.4521 0.0000 173.3086 109 I 5.1927 9.0838 122.1909 58.2764 41.5702 174.6411 110 A 4.9410 8.5574 127.7105 50.1579 21.6888 175.7539 111 I 4.5437 8.5125 122.5772 61.3872 38.9897 175.4803 112 L 5.1298 7.7500 125.9066 55.6052 41.6645 174.0070 113 S 4.6439 7.9616 118.5016 59.0910 63.8543 172.6703 114 T 5.0396 9.0614 113.3625 60.5037 71.6134 174.8290 115 S 4.1223 9.0464 117.7094 60.6128 63.0288 175.0505 116 K 4.5850 8.9978 119.6891 54.3661 33.3165 176.5878 117 G 3.6993 7.1391 108.1316 44.9810 0.0000 174.1410 118 V 4.5805 7.6721 115.5344 62.2229 32.4244 177.5369 119 L 4.5104 7.2572 122.8836 54.7886 42.2675 176.5715 120 T 4.8272 8.2789 111.6147 60.0963 72.7313 173.8813 121 D 4.3883 8.3825 120.7788 57.0064 38.7185 179.1345 122 R 4.2201 7.8492 118.1092 57.7430 30.6922 178.4978 123 E 4.2704 7.8553 117.6860 59.5232 29.5777 179.3387 124 A 3.9849 8.6104 121.0644 55.4764 18.4072 178.9805 125 R 3.8245 7.7094 116.1862 59.2598 29.8433 178.2774 126 K 3.8316 9.1726 121.4016 59.7785 32.4664 178.6125 127 L 4.0654 7.9607 119.3824 55.9230 42.8960 176.5625 128 G 3.6947 9.2895 105.8173 45.4361 0.0000 171.4374 129 V 4.5652 7.8194 109.8318 60.0636 36.8207 175.7444 130 G 4.2323 8.5547 107.4913 44.7875 0.0000 171.9414 131 G 4.5904 7.6939 104.8120 45.9837 0.0000 172.3773 132 E 3.9108 7.9622 121.0882 54.8651 30.3320 175.0063 133 L 4.1722 8.4978 130.8812 55.6619 42.0844 177.4432 134 I 3.8329 8.4746 126.9616 62.7488 38.2329 176.1393 135 C 4.7222 7.1639 114.9272 57.7419 31.4595 171.6791 136 E 5.1447 7.7393 116.6518 54.6374 32.3180 175.0911 137 V 4.5991 8.4387 121.0143 61.1126 36.0701 175.1952 138 W 4.6786 7.7618 120.4588 57.3610 28.3603 174.1051 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 4.31 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 2 L 7.88 3.37 0.00 1.87 1.69 0.90 0.56 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 3 T 8.76 4.07 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 1.20 0.00 0.00 4 D 7.68 4.67 0.00 2.55 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 5 P 0.00 4.40 0.00 2.18 2.06 0.00 3.61 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 6 I 8.06 3.75 2.09 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.90 0.97 0.00 0.00 7 A 9.60 4.09 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 0.00 0.00 8 D 7.77 4.21 0.00 2.77 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 9 M 7.95 3.96 0.00 2.25 2.01 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.52 0.00 10 L 7.91 4.03 0.00 1.64 1.60 0.83 0.65 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 11 T 8.05 3.73 4.44 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 1.17 0.00 0.00 12 R 8.08 3.85 0.00 1.94 1.97 0.00 3.34 0.00 0.00 3.16 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.86 0.00 13 I 8.37 3.56 1.98 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.76 0.81 0.00 0.00 14 R 7.95 3.72 0.00 1.76 2.03 0.00 3.18 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 15 N 8.91 4.37 0.00 2.69 2.82 0.00 0.00 7.02 8.24 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 16 A 8.55 3.95 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 17 T 8.67 3.78 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 1.08 0.00 0.00 18 R 7.47 3.89 0.00 1.94 1.89 0.00 3.04 0.00 0.00 3.36 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 19 V 7.66 3.99 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 0.65 0.00 0.00 1.00 0.00 0.00 20 Y 7.15 4.34 0.00 3.14 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 21 K 7.77 4.01 0.00 1.81 1.81 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.76 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.44 7.81 22 E 9.14 4.20 0.00 2.03 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 0.00 2.58 2.46 0.00 23 S 7.44 5.32 0.00 3.36 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.03 4.67 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 1.18 0.00 0.00 25 D 8.87 5.85 0.00 2.38 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 26 V 8.61 4.41 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 0.74 0.00 0.00 0.91 0.00 0.00 27 P 0.00 3.82 0.00 1.74 1.66 0.00 3.64 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 1.90 1.63 0.00 28 A 7.88 4.49 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 29 S 8.41 4.52 0.00 3.98 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 30 R 8.85 3.88 0.00 1.93 2.07 0.00 3.20 0.00 0.00 3.32 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.76 0.00 31 F 8.09 4.18 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 K 9.41 3.87 0.00 1.78 1.76 0.00 1.81 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.54 7.81 33 E 8.27 3.46 0.00 2.27 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 0.00 2.55 2.41 0.00 34 E 7.78 3.62 0.00 1.83 1.80 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 2.32 2.53 0.00 35 I 7.59 3.61 1.83 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.97 0.78 0.00 0.00 36 L 7.87 3.87 0.00 1.18 1.30 0.54 0.67 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 37 R 8.62 4.12 0.00 1.93 2.10 0.00 3.10 0.00 0.00 3.37 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 38 I 7.63 4.31 2.03 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.78 0.94 0.00 0.00 39 L 7.83 4.19 0.00 1.75 1.80 0.89 0.87 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 40 A 9.21 4.37 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 0.00 0.00 41 R 7.31 3.69 0.00 2.19 2.14 0.00 3.27 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 42 E 8.16 4.33 0.00 2.16 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 2.45 2.48 0.00 43 G 8.63 3.72 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 0.00 0.00 0.00 44 F 8.98 4.54 0.00 3.21 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 45 I 7.32 4.76 2.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.12 0.98 0.00 0.00 46 K 9.13 4.10 0.00 1.95 1.96 0.00 1.96 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.53 1.51 7.81 47 G 7.52 4.28 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 0.00 48 Y 8.07 6.30 0.00 3.06 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 49 E 8.81 4.72 0.00 2.05 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 2.55 2.49 0.00 50 R 8.29 4.94 0.00 1.76 2.05 0.00 3.49 0.00 0.00 3.87 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 51 V 7.89 3.78 2.15 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 0.96 0.00 0.00 1.06 0.00 0.00 52 D 8.60 5.37 0.00 2.72 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.52 4.08 1.80 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 0.66 0.00 0.00 0.70 0.00 0.00 54 D 9.68 4.26 0.00 2.98 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 55 G 7.91 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 56 K 7.83 4.44 0.00 2.22 1.80 0.00 1.84 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.77 7.81 57 P 0.00 4.63 0.00 2.00 2.01 0.00 3.54 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 58 Y 8.77 5.06 0.00 2.93 2.82 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 59 L 8.83 5.01 0.00 1.60 1.63 0.80 1.19 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 60 R 8.70 4.31 0.00 1.63 1.01 0.00 3.08 0.00 0.00 3.02 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 61 V 8.11 4.62 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 0.98 0.00 0.00 0.92 0.00 0.00 62 Y 9.29 4.85 0.00 3.05 2.95 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 63 L 8.87 4.67 0.00 1.93 1.38 1.15 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.01 4.55 0.00 1.84 1.75 0.00 1.88 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.48 7.81 65 Y 8.55 4.90 0.00 2.92 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 66 G 8.59 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 67 P 0.00 4.72 0.00 2.09 1.98 0.00 3.65 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 68 R 8.47 4.29 0.00 1.71 1.85 0.00 3.13 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 69 R 8.00 4.75 0.00 1.84 1.77 0.00 3.42 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 1.66 0.00 70 Q 8.55 4.50 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.57 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 71 G 8.44 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 72 P 0.00 4.03 0.00 2.06 2.02 0.00 3.81 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 73 D 8.80 4.35 0.00 2.83 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 74 P 0.00 4.67 0.00 2.18 2.11 0.00 3.83 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 1.97 0.00 75 R 7.95 4.00 0.00 1.89 2.07 0.00 3.47 0.00 0.00 3.59 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.70 0.00 76 P 0.00 4.76 0.00 1.81 2.06 0.00 3.22 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.64 0.00 77 E 8.95 4.23 0.00 2.16 1.94 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 2.47 2.52 0.00 78 Q 8.38 4.84 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.83 0.00 0.00 0.00 0.00 0.00 2.46 2.34 0.00 79 V 8.82 3.58 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.91 0.00 0.00 80 I 7.30 4.38 1.72 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.77 0.59 0.00 0.00 81 H 8.77 4.32 0.00 3.22 3.55 0.00 5.87 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.77 4.26 0.00 2.26 1.31 0.00 5.72 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.53 4.62 1.54 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 1.02 0.80 0.69 0.00 0.00 84 R 7.77 4.37 0.00 1.75 1.60 0.00 3.15 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 1.46 1.48 0.00 85 R 8.69 3.76 0.00 1.82 1.77 0.00 3.25 0.00 0.00 3.29 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.84 0.00 86 I 8.08 3.97 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 1.18 1.02 0.91 0.00 0.00 87 S 7.43 4.19 0.00 3.91 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 88 K 8.16 4.39 0.00 1.86 1.70 0.00 1.71 0.00 0.00 1.85 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.56 7.81 89 P 0.00 4.26 0.00 2.16 2.16 0.00 3.75 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 1.98 1.95 0.00 90 G 7.96 3.68 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 0.00 0.00 0.00 91 R 7.39 4.43 0.00 1.79 1.82 0.00 3.28 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 92 R 8.42 4.09 0.00 2.07 2.49 0.00 3.48 0.00 0.00 3.37 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.82 0.00 93 V 8.94 4.33 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 0.97 0.00 0.00 0.98 0.00 0.00 94 Y 8.42 4.83 0.00 2.82 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 95 V 7.93 3.90 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 0.89 0.00 0.00 1.00 0.00 0.00 96 G 8.90 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 0.00 0.00 0.00 0.00 97 V 8.26 3.90 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 0.82 0.00 0.00 1.02 0.00 0.00 98 K 7.90 4.40 0.00 1.78 1.88 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.47 7.81 99 E 8.90 4.68 0.00 2.03 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 2.24 2.26 0.00 100 I 7.73 3.79 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 1.53 0.76 0.92 0.00 0.00 101 P 0.00 4.52 0.00 2.06 2.03 0.00 3.63 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 102 R 7.98 4.50 0.00 1.81 1.81 0.00 3.14 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 103 V 7.81 3.49 2.24 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 1.34 0.00 0.00 1.05 0.00 0.00 104 R 9.03 3.59 0.00 1.44 1.64 0.00 2.21 0.00 0.00 2.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.08 0.00 105 R 8.52 3.64 0.00 1.95 1.90 0.00 3.42 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.65 0.00 106 G 8.34 4.37 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 0.00 107 L 7.95 4.07 0.00 1.68 1.81 0.88 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.04 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 0.00 0.00 0.00 0.00 109 I 9.08 5.19 2.08 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 2.80 1.12 0.00 0.00 110 A 8.56 4.94 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 0.00 111 I 8.51 4.54 1.82 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.94 0.89 0.00 0.00 112 L 7.75 5.13 0.00 1.65 1.63 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 7.96 4.64 0.00 4.08 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 0.00 114 T 9.06 5.04 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 1.27 0.00 0.00 115 S 9.05 4.12 0.00 4.02 4.08 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 0.00 116 K 9.00 4.59 0.00 1.74 1.82 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.34 1.34 7.81 117 G 7.14 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 0.00 118 V 7.67 4.58 2.00 0.00 0.00 0.00 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 0.98 0.00 0.00 119 L 7.26 4.51 0.00 1.56 1.58 0.93 0.67 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 0.00 120 T 8.28 4.83 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 1.35 0.00 0.00 121 D 8.38 4.39 0.00 3.02 3.04 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 0.00 122 R 7.85 4.22 0.00 1.89 2.01 0.00 3.14 0.00 0.00 3.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 123 E 7.86 4.27 0.00 2.15 2.00 0.00 0.00 0.00 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 2.34 0.00 124 A 8.61 3.98 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 0.00 125 R 7.71 3.82 0.00 2.33 1.97 0.00 3.13 0.00 0.00 3.10 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 126 K 9.17 3.83 0.00 1.68 1.91 0.00 1.87 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.47 7.81 127 L 7.96 4.07 0.00 1.98 1.82 0.93 1.47 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 0.00 128 G 9.29 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 0.00 0.00 0.00 129 V 7.82 4.57 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 0.68 0.00 0.00 1.01 0.00 0.00 130 G 8.55 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 0.00 0.00 0.00 0.00 131 G 7.69 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 0.00 0.00 0.00 0.00 132 E 7.96 3.91 0.00 1.16 1.62 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 2.13 1.73 0.00 133 L 8.50 4.17 0.00 1.72 1.55 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 134 I 8.47 3.83 1.85 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.83 0.94 0.00 0.00 135 C 7.16 4.72 0.00 3.21 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 0.00 136 E 7.74 5.14 0.00 2.23 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 0.00 2.23 2.28 0.00 137 V 8.44 4.60 1.48 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 0.22 0.00 0.00 0.64 0.00 0.00 138 W 7.76 4.68 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