NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.6293 8.4244 119.2056 53.8848 39.3003 171.7514 3 T 3.8969 7.7128 114.7392 60.0687 68.4514 172.3871 4 K 4.2656 9.1073 129.8043 55.6557 34.1821 175.4797 5 Y 4.7828 7.9496 119.9902 56.2560 40.0363 175.8320 6 N 4.5785 8.7193 119.8296 53.7226 41.0537 175.9944 7 K 4.0096 8.6130 126.7891 59.7455 32.5071 179.1946 8 E 4.0678 8.1310 118.3289 59.0125 29.4499 178.8447 9 F 4.3713 8.1226 120.6196 61.0848 39.4531 177.1117 10 L 3.6944 7.9471 118.8266 57.2843 41.3601 179.2819 11 L 3.5369 7.8950 119.4145 57.7100 41.6000 178.9162 12 Y 3.9848 7.8848 119.3285 60.7078 38.8592 177.4286 13 L 3.9706 7.9560 121.0383 58.1896 42.0072 178.8162 14 A 4.0656 8.2141 120.9014 55.1785 18.4675 179.8604 15 G 3.4652 7.5635 102.7222 47.9610 0.0000 175.7196 16 F 3.8689 7.8938 123.0380 60.6823 39.2950 177.4738 17 V 3.7074 8.3032 118.5933 66.0913 31.2242 177.7068 18 D 4.5754 8.0985 117.0276 57.0273 40.6663 177.4691 19 G 3.4656 7.7832 106.6556 44.6238 0.0000 174.0808 20 D 4.6775 7.7059 120.8608 52.5527 42.1299 176.7781 21 G 3.9910 7.1950 106.8963 46.1312 0.0000 173.5697 22 S 4.4511 8.5213 113.6756 57.5086 65.8449 173.4882 23 I 4.6777 8.5628 129.5217 60.5706 37.4471 175.3353 24 I 4.6270 8.7106 128.4178 59.8564 40.1634 175.1692 25 A 5.0729 8.1909 124.8216 51.2323 22.1183 175.5172 26 Q 4.6173 9.8294 121.2599 54.2210 34.0029 174.6833 27 I 4.5476 8.1719 119.6817 59.6898 39.5294 174.7392 28 K 4.4956 8.7444 127.5297 54.0863 33.7414 174.4067 29 P 4.8987 0.0000 0.0000 63.0650 32.1985 175.6333 30 N 4.8545 9.4200 124.4319 51.7812 41.3187 174.7940 31 Q 4.0604 9.2723 126.6851 59.2584 28.9356 178.4554 32 S 4.2459 8.0695 109.1759 59.4942 63.0357 173.4148 33 Y 4.5495 7.7659 119.2756 55.8598 39.9363 176.3693 34 K 3.4736 8.5828 123.5274 59.1240 32.3138 177.5210 35 F 4.8371 7.5795 114.7052 56.8473 39.4893 176.7187 36 K 4.2753 8.5680 118.9544 57.1123 30.3467 174.9499 37 H 5.3946 7.7565 113.5473 54.1401 33.0506 172.4455 38 Q 3.9755 8.9145 123.1042 54.3416 31.3105 174.7496 39 L 4.9265 8.5315 126.2682 53.7508 41.7602 174.8883 40 S 4.6504 8.5790 119.0160 56.9424 63.8110 172.5826 41 L 5.1735 8.4472 126.5287 53.4281 44.6093 175.7954 42 T 4.8211 8.7579 115.8682 61.0353 71.6818 171.8317 43 F 5.1471 9.2022 131.1732 56.9834 41.1648 174.4138 44 Q 5.2220 8.3281 124.8854 53.5117 32.3826 175.3749 45 V 4.5393 7.9200 120.7280 62.2687 34.5961 173.3353 46 T 5.1988 7.9240 124.3824 62.3780 71.0867 173.7518 47 Q 4.6475 8.5597 121.7656 54.6264 34.2510 174.1228 48 K 4.3534 8.5727 120.2591 56.8139 32.9322 178.6150 49 T 3.5081 8.7072 120.1074 66.7057 68.5432 176.1791 50 Q 4.2803 8.1009 117.2710 57.7953 29.2773 176.6736 51 R 4.5516 8.6649 118.3919 55.8915 30.9392 177.3293 52 R 3.8868 8.0344 121.3213 59.5454 29.7509 178.3746 53 W 4.1355 8.4433 115.8046 59.9618 27.5754 177.7938 54 F 3.5910 7.3267 121.3106 60.6545 38.5112 177.2896 55 L 3.8916 8.6778 119.9509 57.7455 41.5209 179.1317 56 D 4.4357 8.0533 118.3719 57.1074 40.7552 178.7830 57 K 4.1027 7.7460 119.2479 59.3232 32.0132 179.3786 58 L 3.7372 7.2952 119.1692 57.5197 41.2308 179.6818 59 V 3.8642 7.3616 118.5108 65.7432 31.1731 177.7312 60 D 4.2629 7.3539 115.7650 57.4210 41.2935 177.1983 61 E 3.8536 7.9103 117.6528 59.3718 29.4875 178.7055 62 I 3.9804 8.0559 118.3437 62.2099 37.5312 176.0542 63 G 4.3174 8.1535 109.7426 44.6892 0.0000 173.1795 64 V 4.4082 7.6244 116.2715 59.5848 34.3830 174.7100 65 G 3.8943 10.0520 106.0967 45.1923 0.0000 171.0548 66 Y 5.0166 7.7196 115.5410 55.7420 42.1619 173.9325 67 V 4.9566 8.6235 119.0820 61.1296 33.8297 174.7121 68 R 4.8455 8.9942 124.6574 54.7442 32.3731 174.4210 69 D 5.2633 8.8024 119.5028 51.4058 43.3523 176.8961 70 R 4.6935 8.3128 120.4784 54.9079 30.5719 175.2173 71 G 4.0872 7.9168 111.3340 45.7484 0.0000 177.1038 72 S 3.9895 8.8269 118.0448 60.0228 63.3079 173.8072 73 V 4.9599 7.2994 120.1480 61.1688 34.6118 174.4261 74 S 5.1126 8.8875 119.0896 56.9449 67.4334 172.8779 75 D 5.2307 8.8543 122.0611 52.7031 44.9165 174.0973 76 Y 4.8744 9.0255 123.6962 56.0974 40.9090 174.2357 77 I 4.4503 7.7571 127.6282 59.0642 40.6062 174.3679 78 L 4.3932 8.4985 128.4246 53.7859 43.6155 176.4700 79 S 4.8202 8.6975 121.6927 58.5331 65.1878 175.4223 80 E 4.1102 8.1472 121.2074 56.1203 30.0478 177.1130 81 I 3.7319 8.5130 125.5849 64.4370 37.2526 178.1709 82 K 3.9356 8.0642 119.6403 59.3548 32.1060 176.9447 83 P 4.4217 0.0000 0.0000 65.0593 31.3029 178.3849 84 L 4.0221 8.1055 119.4800 58.5291 42.1125 178.1961 85 H 4.0806 8.4625 118.2439 59.6951 29.3364 176.6049 86 N 4.4595 8.2435 118.4145 56.3463 38.7234 176.7839 87 F 4.3447 8.2891 122.3269 61.4668 39.6614 177.4693 88 L 3.5829 8.3049 118.8933 57.7475 41.0814 179.6247 89 T 3.8426 7.7322 115.2575 66.4953 68.3834 176.1072 90 Q 4.1918 7.3150 118.5531 57.7607 29.1783 177.6056 91 L 4.1149 7.6029 121.4372 57.6602 42.1887 178.6230 92 Q 3.6961 8.1052 120.7496 58.4856 29.2382 177.5168 93 P 4.0235 0.0000 0.0000 65.2313 31.0258 176.8588 94 F 4.6717 7.5849 115.6289 57.9556 39.4635 175.9968 95 L 4.3606 7.3778 120.2503 54.7208 41.9993 176.8428 96 K 4.5432 9.8678 116.8386 56.3909 35.2227 177.7383 97 L 4.5756 8.5154 116.4034 54.7433 43.6837 176.7469 98 K 4.8921 8.0131 117.7094 54.7918 32.9109 177.8115 99 Q 4.0884 7.9547 121.1720 58.5037 29.5044 176.2163 100 K 3.8915 7.9277 119.3615 59.5496 31.9605 179.0683 101 Q 3.9499 8.0352 117.0516 59.0983 28.5985 177.7509 102 A 4.0499 7.5784 121.5159 55.3934 18.3143 179.4797 103 N 4.2624 8.2151 114.4046 56.1581 38.5779 177.7109 104 L 3.8374 8.0100 120.5168 57.7780 41.6918 179.5054 105 V 3.6316 8.1680 118.4420 66.2697 31.5317 177.9934 106 L 3.9866 7.8882 118.4497 57.5544 41.1811 179.4400 107 K 3.8715 8.3011 119.1558 59.6121 32.4905 178.3917 108 I 4.0982 8.3324 120.2910 64.7605 37.1870 178.0347 109 I 3.7437 8.0896 120.4358 64.8268 36.8431 177.8898 110 E 4.0473 7.9618 117.8925 58.9407 29.0011 177.9931 111 Q 4.6564 7.9389 116.2852 56.0013 29.2851 177.8667 112 L 4.2814 7.8398 123.4611 57.3868 41.5461 177.4241 113 P 4.3490 0.0000 0.0000 64.9073 31.6477 176.7377 114 S 4.4534 7.5583 112.2042 58.5365 62.4881 173.8739 115 A 4.6537 7.7477 121.8995 53.0237 19.7630 178.5713 116 K 4.2246 8.1452 115.8661 58.3659 32.4878 177.3612 117 E 4.2809 7.5696 118.0357 58.3989 30.3606 176.4240 118 S 4.6542 7.8009 112.5399 56.5384 64.0989 172.9990 119 P 3.4541 0.0000 0.0000 64.7734 30.9919 177.9164 120 D 4.3937 7.9235 118.0834 56.4993 41.0958 178.5749 121 K 3.8700 7.7552 119.7289 59.4383 32.3534 178.4718 122 F 3.9724 8.2454 120.9970 61.1741 38.9945 176.8108 123 L 3.8211 7.2026 118.2487 57.4854 42.0989 178.1770 124 E 3.6574 7.5040 119.4291 58.8726 29.5613 178.8245 125 V 2.1067 7.2177 118.2178 65.3201 31.3366 177.3969 126 C 3.9781 7.2141 114.8188 61.7499 28.0827 175.2680 127 T 4.1245 7.0510 117.9344 65.4176 68.4504 176.7467 128 W 4.7504 7.4839 120.9578 60.3660 29.2720 179.0481 129 V 3.7624 7.8795 111.3706 64.3437 31.1287 178.1976 130 D 4.4227 8.0960 118.8344 57.1677 40.5276 178.7722 131 Q 4.1491 8.2007 118.8808 58.7692 28.8142 178.3741 132 I 3.6806 7.8104 120.1597 64.4363 36.9904 178.1035 133 A 3.9936 7.7023 119.5661 55.0795 18.2368 179.1938 134 A 4.0832 7.4110 117.1320 55.4071 18.5558 179.6684 135 L 4.0829 7.6943 116.3684 58.0081 41.9809 177.9205 136 N 4.7714 7.9985 115.4409 52.0796 43.0808 174.4927 137 D 4.8864 8.1542 118.4269 53.7136 40.2634 176.5499 138 S 4.3577 7.6131 114.1516 58.5897 64.2326 174.5103 139 K 4.3789 7.8355 119.1956 57.4086 34.1377 175.1931 140 T 4.5595 7.8704 107.2523 60.9304 69.9294 173.9720 141 R 3.9834 7.9741 122.4196 56.8801 29.9890 174.2869 142 K 4.3375 7.7571 120.3261 58.1058 35.3423 176.7003 143 T 3.9408 7.6953 126.7259 64.0798 67.9353 174.4623 144 T 4.5207 7.9115 120.7865 59.6916 71.1159 174.4660 145 S 4.0134 8.2844 117.9814 61.2730 63.0046 175.8917 146 E 4.0329 8.0462 122.9160 59.4393 29.1697 178.9780 147 T 3.9731 7.6588 108.0978 64.5253 69.5095 176.3393 148 V 3.6765 7.8058 120.8470 64.9857 31.9409 176.4277 149 R 4.4429 7.5605 118.2459 56.0750 27.1727 176.4654 150 A 4.5894 7.5504 119.6873 52.0308 20.1990 179.3288 151 V 3.7509 7.2416 115.3104 65.1445 31.7284 177.1098 152 L 4.3424 7.0791 118.5799 54.4424 39.3379 176.7096 153 D 4.5398 8.1296 121.6009 54.1819 41.4817 176.0648 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 N 8.42 4.63 0.00 2.71 2.83 0.00 0.00 6.95 6.82 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 3 T 7.71 3.90 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 1.15 0.00 0.00 4 K 9.11 4.27 0.00 1.74 1.73 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.41 7.81 5 Y 7.95 4.78 0.00 3.30 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 6 N 8.72 4.58 0.00 2.94 2.99 0.00 0.00 6.58 6.28 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 7 K 8.61 4.01 0.00 1.89 1.78 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.61 7.81 8 E 8.13 4.07 0.00 2.09 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 2.39 2.38 0.00 9 F 8.12 4.37 0.00 3.10 3.30 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 10 L 7.95 3.69 0.00 1.86 1.72 1.28 0.41 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 11 L 7.89 3.54 0.00 1.63 1.55 0.75 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.88 3.98 0.00 3.05 2.91 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 13 L 7.96 3.97 0.00 1.46 1.34 1.06 1.05 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 14 A 8.21 4.07 1.47 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 0.00 0.00 15 G 7.56 3.47 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 0.00 0.00 0.00 16 F 7.89 3.87 0.00 2.84 3.16 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 0.00 0.00 0.00 0.00 17 V 8.30 3.71 2.35 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 1.19 0.00 0.00 1.34 0.00 0.00 18 D 8.10 4.58 0.00 2.81 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 19 G 7.78 3.47 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 0.00 0.00 0.00 20 D 7.71 4.68 0.00 1.96 2.61 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 21 G 7.19 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 0.00 0.00 0.00 22 S 8.52 4.45 0.00 3.84 3.60 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 23 I 8.56 4.68 1.94 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.87 1.00 0.00 0.00 24 I 8.71 4.63 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.87 0.92 0.00 0.00 25 A 8.19 5.07 1.21 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 26 Q 9.83 4.62 0.00 1.92 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.70 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 27 I 8.17 4.55 1.79 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 1.21 0.52 0.80 0.00 0.00 28 K 8.74 4.50 0.00 1.69 1.73 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.34 7.81 29 P 0.00 4.90 0.00 2.11 2.20 0.00 3.73 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 30 N 9.42 4.85 0.00 2.69 2.87 0.00 0.00 6.81 6.60 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 31 Q 9.27 4.06 0.00 2.11 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.89 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 32 S 8.07 4.25 0.00 3.82 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 33 Y 7.77 4.55 0.00 3.18 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 34 K 8.58 3.47 0.00 1.33 1.37 0.00 1.16 0.00 0.00 1.35 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.30 0.21 7.81 35 F 7.58 4.84 0.00 2.32 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 36 K 8.57 4.28 0.00 1.94 1.75 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.37 7.81 37 H 7.76 5.39 0.00 3.30 3.23 0.00 5.82 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 8.91 3.98 0.00 0.93 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.86 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 39 L 8.53 4.93 0.00 1.65 1.65 0.91 0.64 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 40 S 8.58 4.65 0.00 3.92 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.45 5.17 0.00 1.57 1.59 0.96 0.91 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 42 T 8.76 4.82 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 1.23 0.00 0.00 43 F 9.20 5.15 0.00 3.29 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 44 Q 8.33 5.22 0.00 2.06 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.50 0.00 0.00 0.00 0.00 0.00 2.13 1.99 0.00 45 V 7.92 4.54 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.77 0.00 0.00 46 T 7.92 5.20 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 1.37 0.00 0.00 47 Q 8.56 4.65 0.00 1.99 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.98 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 48 K 8.57 4.35 0.00 1.78 1.75 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.41 7.81 49 T 8.71 3.51 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 1.29 0.00 0.00 50 Q 8.10 4.28 0.00 2.23 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.21 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 51 R 8.66 4.55 0.00 1.86 1.74 0.00 3.29 0.00 0.00 3.01 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.58 0.00 52 R 8.03 3.89 0.00 1.96 2.16 0.00 3.20 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.71 0.00 53 W 8.44 4.14 0.00 3.64 3.42 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 54 F 7.33 3.59 0.00 1.62 2.59 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 55 L 8.68 3.89 0.00 1.96 1.76 1.03 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.05 4.44 0.00 2.92 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 57 K 7.75 4.10 0.00 1.79 1.60 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.54 1.85 7.81 58 L 7.30 3.74 0.00 1.38 0.90 0.52 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.36 3.86 2.32 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 1.13 0.00 0.00 1.23 0.00 0.00 60 D 7.35 4.26 0.00 2.73 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 61 E 7.91 3.85 0.00 1.64 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 2.15 2.22 0.00 62 I 8.06 3.98 1.95 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.57 0.63 0.00 0.00 63 G 8.15 4.32 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 0.00 64 V 7.62 4.41 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 0.85 0.00 0.00 1.00 0.00 0.00 65 G 10.05 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 0.00 0.00 0.00 66 Y 7.72 5.02 0.00 2.99 2.98 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 67 V 8.62 4.96 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.14 0.00 0.00 68 R 8.99 4.85 0.00 2.05 2.24 0.00 2.87 0.00 0.00 3.14 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.73 0.00 69 D 8.80 5.26 0.00 2.72 2.61 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 70 R 8.31 4.69 0.00 1.95 1.92 0.00 3.13 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 71 G 7.92 4.09 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 0.00 0.00 0.00 72 S 8.83 3.99 0.00 4.02 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 V 7.30 4.96 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 1.01 0.00 0.00 0.93 0.00 0.00 74 S 8.89 5.11 0.00 3.79 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 75 D 8.85 5.23 0.00 2.58 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 9.03 4.87 0.00 2.99 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 I 7.76 4.45 0.71 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.43 0.61 0.00 0.00 78 L 8.50 4.39 0.00 1.80 1.69 0.88 0.90 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 79 S 8.70 4.82 0.00 3.96 3.94 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 80 E 8.15 4.11 0.00 2.08 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 2.45 2.46 0.00 81 I 8.51 3.73 1.93 0.00 0.00 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 1.60 0.65 0.98 0.00 0.00 82 K 8.06 3.94 0.00 1.90 1.86 0.00 1.62 0.00 0.00 1.83 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.63 7.81 83 P 0.00 4.42 0.00 2.29 2.17 0.00 3.87 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.20 0.00 84 L 8.11 4.02 0.00 1.97 2.00 1.09 1.01 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 85 H 8.46 4.08 0.00 3.29 3.58 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.24 4.46 0.00 2.96 3.13 0.00 0.00 6.90 8.52 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 87 F 8.29 4.34 0.00 3.24 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 88 L 8.30 3.58 0.00 1.59 1.55 0.95 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.73 3.84 4.32 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 1.19 0.00 0.00 90 Q 7.32 4.19 0.00 2.26 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.80 0.00 91 L 7.60 4.11 0.00 1.06 1.10 0.76 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 8.11 3.70 0.00 2.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.53 0.00 0.00 0.00 0.00 0.00 2.25 2.58 0.00 93 P 0.00 4.02 0.00 1.34 1.81 0.00 3.50 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.60 0.00 94 F 7.58 4.67 0.00 3.03 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 95 L 7.38 4.36 0.00 1.68 1.60 0.88 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 96 K 9.87 4.54 0.00 1.70 1.76 0.00 1.56 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.42 7.81 97 L 8.52 4.58 0.00 1.57 1.66 0.88 0.78 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 98 K 8.01 4.89 0.00 1.81 1.75 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.32 1.48 7.81 99 Q 7.95 4.09 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.89 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 100 K 7.93 3.89 0.00 1.78 1.81 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.42 7.81 101 Q 8.04 3.95 0.00 2.26 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.56 2.38 0.00 102 A 7.58 4.05 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.22 4.26 0.00 2.90 2.79 0.00 0.00 7.13 6.18 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 0.00 104 L 8.01 3.84 0.00 1.90 1.73 0.94 0.56 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 0.00 105 V 8.17 3.63 2.38 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 1.17 0.00 0.00 1.01 0.00 0.00 106 L 7.89 3.99 0.00 1.91 1.68 0.88 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 107 K 8.30 3.87 0.00 1.65 1.73 0.00 1.47 0.00 0.00 1.22 0.00 0.00 2.13 0.00 0.00 2.28 0.00 0.00 0.00 0.00 1.06 1.30 7.81 108 I 8.33 4.10 2.15 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 1.94 1.29 1.00 0.00 0.00 109 I 8.09 3.74 2.10 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.99 1.00 0.00 0.00 110 E 7.96 4.05 0.00 2.20 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 2.36 2.44 0.00 111 Q 7.94 4.66 0.00 2.33 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.60 0.00 0.00 0.00 0.00 0.00 2.43 2.74 0.00 112 L 7.84 4.28 0.00 2.06 1.79 1.01 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.35 0.00 2.22 2.23 0.00 3.85 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 114 S 7.56 4.45 0.00 4.09 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 0.00 115 A 7.75 4.65 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 0.00 116 K 8.15 4.22 0.00 1.83 1.91 0.00 1.85 0.00 0.00 1.81 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.56 7.81 117 E 7.57 4.28 0.00 2.09 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 2.33 2.31 0.00 118 S 7.80 4.65 0.00 3.93 3.78 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 0.00 119 P 0.00 3.45 0.00 2.11 1.85 0.00 3.69 0.00 0.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.56 0.00 120 D 7.92 4.39 0.00 2.77 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 0.00 121 K 7.76 3.87 0.00 1.91 1.84 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.52 1.63 7.81 122 F 8.25 3.97 0.00 3.20 2.59 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 0.00 123 L 7.20 3.82 0.00 1.88 1.53 0.84 0.85 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 0.00 124 E 7.50 3.66 0.00 1.78 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 1.85 1.47 0.00 125 V 7.22 2.11 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.73 0.00 0.00 126 C 7.21 3.98 0.00 2.84 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 0.00 127 T 7.05 4.12 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 1.35 0.00 0.00 128 W 7.48 4.75 0.00 3.37 3.03 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 0.00 0.00 0.00 129 V 7.88 3.76 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 0.95 0.00 0.00 0.92 0.00 0.00 130 D 8.10 4.42 0.00 2.92 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 0.00 131 Q 8.20 4.15 0.00 2.38 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.79 0.00 0.00 0.00 0.00 0.00 2.45 2.79 0.00 132 I 7.81 3.68 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.96 0.93 0.00 0.00 133 A 7.70 3.99 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 0.00 134 A 7.41 4.08 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 0.00 135 L 7.69 4.08 0.00 1.87 1.86 0.95 1.11 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 0.00 136 N 8.00 4.77 0.00 2.82 2.78 0.00 0.00 6.89 7.62 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 0.00 137 D 8.15 4.89 0.00 2.62 2.59 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 0.00 138 S 7.61 4.36 0.00 3.97 3.86 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 0.00 139 K 7.84 4.38 0.00 1.81 1.86 0.00 1.50 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.29 7.81 140 T 7.87 4.56 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 1.21 0.00 0.00 141 R 7.97 3.98 0.00 1.78 1.86 0.00 3.16 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 142 K 7.76 4.34 0.00 1.73 1.66 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.41 7.81 143 T 7.70 3.94 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 1.20 0.00 0.00 144 T 7.91 4.52 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 1.26 0.00 0.00 145 S 8.28 4.01 0.00 3.87 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 0.00 146 E 8.05 4.03 0.00 2.11 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 2.29 2.35 0.00 147 T 7.66 3.97 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 1.21 0.00 0.00 148 V 7.81 3.68 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 1.13 0.00 0.00 0.80 0.00 0.00 149 R 7.56 4.44 0.00 2.01 1.90 0.00 3.15 0.00 0.00 3.19 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.91 0.00 150 A 7.55 4.59 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 0.00 151 V 7.24 3.75 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 0.77 0.00 0.00 0.95 0.00 0.00 152 L 7.08 4.34 0.00 1.69 1.63 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.13 4.54 0.00 2.63 2.52 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