NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2788 8.2644 123.5800 52.2784 18.5630 175.8584 3 R 4.2969 8.3132 118.6667 55.8886 31.2674 174.3509 4 R 4.2312 8.3947 115.3627 56.5809 32.9903 175.5035 5 R 4.4472 7.8994 117.2514 54.9822 32.2623 177.7126 6 R 3.7745 8.7166 119.3875 56.4239 30.0087 172.5560 7 A 3.5326 8.2816 125.0518 51.6933 18.9998 177.4023 8 E 4.1531 8.6257 121.6340 55.7553 29.9017 178.6123 9 V 3.9164 8.4373 125.8132 62.9765 28.9859 173.9436 10 R 3.6280 7.3207 120.0387 54.8012 31.3898 175.5944 11 Q 4.3382 8.4677 124.1688 55.3442 29.8464 175.0133 12 L 4.6806 8.0637 120.4043 52.8087 43.7651 176.3510 13 Q 4.1639 8.4501 124.2236 54.8493 29.7914 173.9647 14 P 4.4675 0.0000 0.0000 62.5557 32.0976 175.5736 15 D 4.6539 8.4179 120.0074 54.6416 42.0224 177.0614 16 L 4.3756 8.4560 121.1052 56.7843 41.9397 178.3569 17 V 3.4472 7.2403 117.0369 65.4979 31.8126 175.7962 18 Y 4.1997 9.0555 119.9176 57.7559 38.4504 176.0020 19 G 4.4773 8.0943 106.2744 45.5528 0.0000 171.2528 20 D 4.6338 7.7910 120.9523 52.2001 44.8429 176.5558 21 V 3.5892 8.4985 120.4319 64.5809 30.7045 178.5516 22 L 4.0684 7.9072 119.3817 57.4545 41.7367 178.9821 23 V 3.5547 7.5639 117.6822 65.7283 31.7060 177.4822 24 T 3.6760 7.8016 108.8308 64.8715 68.3981 175.6053 25 A 3.9730 7.8457 123.2273 54.9751 18.3133 179.5029 26 F 4.1259 7.6029 115.9470 61.5920 39.3531 177.5682 27 I 3.3899 7.9117 118.4428 64.2189 37.0197 177.9535 28 N 4.4171 8.9521 118.6262 56.1769 38.1860 177.5207 29 K 3.8642 7.5280 118.7504 59.5809 32.1600 179.1320 30 I 3.7688 7.2067 119.0297 62.6413 37.1976 176.4492 31 M 4.0050 7.3769 120.3161 55.4574 32.5907 175.2298 32 R 4.5367 8.2939 125.0293 54.9165 33.0767 174.2190 33 D 4.3375 9.9167 117.9377 55.0216 38.9055 174.6991 34 G 3.9671 8.4329 109.1096 45.3305 0.0000 174.2455 35 K 4.0691 7.7600 118.8579 56.6473 30.7759 177.2888 36 K 4.0082 8.6313 124.5324 60.2143 32.3737 177.1391 37 N 3.9820 8.3981 114.1051 56.5519 38.3412 176.2776 38 L 3.8698 7.9228 120.3215 58.7499 42.4077 179.0005 39 A 3.8854 7.5894 118.5238 55.5561 18.2350 179.0003 40 A 3.7775 8.4040 118.1954 56.4514 18.5116 179.7222 41 R 3.7255 8.5945 113.9014 59.4091 30.1660 178.7673 42 I 3.6186 8.5704 119.5119 64.8855 37.4288 177.6187 43 F 4.1032 8.0969 120.8659 61.9739 39.0012 176.9126 44 Y 4.0473 7.4172 115.4878 61.3561 37.6646 178.2088 45 D 4.3926 8.4577 118.6196 57.1768 41.1435 178.9544 46 A 4.2028 7.7408 121.1904 55.0853 18.9054 179.1050 47 C 3.8482 7.7687 115.3133 62.9925 28.2938 176.3248 48 K 4.1100 8.4423 121.0310 59.0596 31.6562 178.0370 49 I 4.1314 8.2863 119.1301 62.6149 37.3390 177.7294 50 I 3.8287 8.1980 122.2015 64.2925 36.9680 177.9403 51 Q 4.6121 8.0132 119.2411 58.3094 28.6153 178.4995 52 E 4.1403 7.6103 118.7049 58.8186 29.7523 178.0922 53 K 4.5139 7.0415 114.5062 55.5542 32.8633 175.8806 54 T 4.0985 7.2890 111.1836 61.8247 70.5888 173.6717 55 G 3.8740 8.7906 114.4827 46.0128 0.0000 173.7493 56 Q 3.9894 7.6944 120.4273 55.4137 28.7686 176.4228 57 E 4.0376 9.2899 121.8279 56.4918 28.1195 178.3201 58 P 3.3613 0.0000 0.0000 61.4284 33.8100 177.6897 59 L 3.6670 8.4421 119.6844 58.7910 42.3457 178.9878 60 K 3.5281 8.4502 119.4254 60.0284 31.9446 178.2641 61 V 3.7222 8.6183 119.1834 64.9128 31.4753 177.4204 62 F 3.9105 8.1315 119.6425 61.5271 39.4859 177.3728 63 K 3.6729 9.1608 120.0354 59.6066 31.8908 178.1145 64 Q 4.0912 7.7799 118.4121 57.8560 28.7789 177.7709 65 A 3.9273 7.5183 121.5339 55.3142 18.6251 179.3445 66 V 3.4109 7.1768 116.7859 65.8529 31.5050 177.9510 67 E 3.8587 7.5938 118.0822 59.2355 29.4230 178.1606 68 N 4.5586 8.1634 113.7479 54.7127 38.6268 175.4233 69 V 4.3429 7.1344 118.2612 61.9192 33.2176 175.1719 70 K 3.8150 7.7505 118.8456 56.2596 31.6704 174.9287 71 P 4.5734 0.0000 0.0000 62.7898 31.4082 176.5269 72 R 4.0885 9.1642 124.7900 59.1739 30.3845 175.9545 73 M 5.0543 7.6905 115.6254 53.9560 36.9824 173.8332 74 E 4.8532 8.9015 119.5709 54.9212 34.1397 174.1787 75 V 4.8351 8.4063 112.4124 59.9618 33.1913 176.0303 76 R 4.8016 9.4859 124.5611 54.1345 32.7464 175.5331 77 S 4.2144 8.9996 119.0218 59.3255 63.5041 173.8305 78 R 3.6736 7.8832 121.7323 55.4029 33.3993 174.2505 79 R 4.8653 8.3418 127.5161 55.4805 29.3269 175.7560 80 V 3.6238 8.9862 124.6156 65.0066 32.5478 174.5142 81 G 3.4213 8.0514 106.9411 45.0331 0.0000 174.3647 82 G 3.9406 9.1119 113.9318 45.4164 0.0000 173.3784 83 A 4.2066 6.8308 119.4533 51.8114 22.6423 175.2080 84 N 4.9704 7.5466 119.7165 50.2657 38.3464 173.3139 85 Y 4.5761 7.2190 119.6228 58.9225 39.6071 175.8149 86 Q 4.6733 8.8777 122.4060 54.6085 28.4216 174.4221 87 V 3.9949 8.3856 123.8466 62.1035 32.7620 172.7545 88 P 5.4361 0.0000 0.0000 62.0538 33.3711 174.1508 89 M 4.5290 8.2785 117.6269 54.8034 34.9480 173.6238 90 E 4.4111 8.8714 118.5708 56.3308 30.6783 176.6411 91 V 4.2202 7.7072 121.6928 61.2413 32.7750 176.0358 92 S 4.2577 8.7041 122.1680 57.7355 63.2543 173.1675 93 P 4.2273 0.0000 0.0000 65.9580 30.8673 178.8481 94 R 3.8211 7.8729 117.5403 58.9732 29.6949 178.3195 95 R 3.7885 7.9277 119.0628 58.9325 29.9842 177.7347 96 Q 3.7948 8.0722 119.0827 59.6977 28.9578 179.0809 97 Q 3.8487 7.9368 119.6484 58.9983 28.6729 178.0704 98 S 3.9971 8.4155 116.6761 61.8278 62.9439 176.5562 99 L 3.3999 8.8373 121.7976 57.4239 41.1367 179.3820 100 A 3.6936 7.3255 120.3856 55.2386 18.4219 179.7952 101 L 4.0576 7.7216 117.1731 57.9776 41.8973 179.2008 102 R 3.8828 7.6390 118.2807 59.5239 29.8370 177.9885 103 W 4.6288 8.0504 118.2608 60.6202 28.9823 177.8956 104 L 4.1783 7.8220 116.2282 58.7809 40.9680 179.7815 105 V 3.2873 8.0838 118.3655 65.8131 31.7661 177.8303 106 Q 4.2521 7.9692 117.2152 58.4230 29.0361 177.5682 107 A 4.0040 9.0198 122.2003 55.4478 18.7207 179.3999 108 A 4.0461 9.1316 120.2330 54.8551 18.4871 177.5676 109 N 4.9104 8.0505 114.6846 53.3864 39.8857 176.1160 110 Q 4.5536 7.7448 113.1152 56.5061 32.1644 175.2607 111 R 4.4101 7.7010 117.8268 54.4042 31.1537 175.7752 112 P 4.3615 0.0000 0.0000 65.5860 31.2850 176.7442 113 E 4.0353 7.1852 112.3832 56.6451 29.9122 177.4476 114 R 4.1514 8.4936 118.8794 58.9757 31.0730 177.6408 115 R 4.2495 7.6474 116.3881 55.2165 31.2303 177.3979 116 A 4.0240 8.7232 122.3557 56.0701 18.1872 179.1997 117 A 3.9776 8.1387 118.8936 54.7533 18.2744 179.5639 118 V 3.4067 7.6837 108.1242 64.3776 31.9362 178.8179 119 R 3.8796 7.7456 117.0275 59.5141 29.8901 179.0402 120 I 3.7787 8.0829 118.9868 65.0540 37.2121 177.6175 121 A 3.7522 8.9222 118.2686 56.3873 17.8874 179.2293 122 H 3.8784 8.4196 111.9474 58.0907 29.4577 176.6343 123 E 3.9358 8.4036 120.2650 59.7720 29.6883 179.1933 124 L 3.9716 8.3359 120.1927 58.5203 42.0261 178.7608 125 M 4.0345 8.2201 118.5504 58.6983 32.0420 178.4378 126 D 4.3904 8.5698 118.9167 57.2531 40.8227 178.9653 127 A 3.9192 7.9730 121.3617 55.1920 18.2695 179.4892 128 A 3.9243 7.7506 117.8823 54.6620 18.4498 177.8781 129 E 4.3438 8.1808 116.8223 57.1034 31.9051 177.0869 130 G 3.9195 8.0388 103.2029 44.7814 0.0000 174.6124 131 K 4.3396 8.4416 112.7094 56.9316 35.3573 175.6715 132 G 3.8306 8.4624 109.8708 46.2147 0.0000 176.7808 133 G 3.7852 7.7551 112.5659 47.1837 0.0000 176.0763 134 A 3.9330 8.3331 122.1908 54.6642 18.3170 179.5599 135 V 3.5466 8.5254 117.3848 66.4327 31.2568 177.8306 136 K 3.7449 7.6785 117.5937 59.5998 32.0290 178.1496 137 K 3.7088 8.3022 119.8037 59.3769 31.9859 178.6618 138 K 3.6130 7.8726 119.2020 59.3800 31.5899 177.3464 139 E 4.3740 8.4181 117.2221 56.8036 29.5835 177.0617 140 D 4.3142 8.4846 119.4432 56.2809 42.0357 177.9343 141 V 3.5923 7.7092 116.6888 66.8137 31.2902 177.1258 142 E 4.2894 8.2307 119.3583 58.4110 29.1277 179.5324 143 R 3.8732 7.7689 117.3558 60.5051 30.1295 177.8458 144 M 3.8145 8.2852 115.9474 59.3875 32.1588 178.4840 145 A 4.5790 7.9269 126.3433 51.6567 18.2312 177.8236 146 E 4.5054 10.7800 120.8129 58.8855 35.1997 178.6173 147 A 3.9158 7.8065 120.3681 55.5275 18.5111 178.1877 148 N 4.6334 8.0333 110.9129 53.8327 38.3441 176.8748 149 R 4.1489 7.4488 116.7222 57.5468 30.3237 177.9407 150 A 3.9644 7.7647 122.8185 55.6476 18.4192 179.0818 151 Y 4.5350 7.5610 109.4460 58.3163 37.9207 176.4577 152 A 4.1948 7.8031 126.7571 55.7067 18.4400 181.4387 153 H 4.6357 8.3263 108.2455 56.1771 27.6352 175.4845 154 Y 4.7672 8.3094 119.2567 59.5091 39.7248 176.3465 155 R 3.9890 7.3112 118.5241 55.5638 27.8908 175.9283 156 W 4.5685 9.2594 119.6656 56.4272 28.4765 176.5555 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 A 8.26 4.28 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 3 R 8.31 4.30 0.00 1.83 1.90 0.00 3.20 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.71 0.00 4 R 8.39 4.23 0.00 1.81 1.72 0.00 3.24 0.00 0.00 3.22 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 5 R 7.90 4.45 0.00 1.90 1.82 0.00 3.18 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 6 R 8.72 3.77 0.00 1.74 1.92 0.00 3.36 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 7 A 8.28 3.53 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 8 E 8.63 4.15 0.00 1.96 1.91 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 2.30 2.28 0.00 9 V 8.44 3.92 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.91 0.00 0.00 10 R 7.32 3.63 0.00 1.81 1.78 0.00 3.27 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 1.60 1.71 0.00 11 Q 8.47 4.34 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.48 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 12 L 8.06 4.68 0.00 1.60 1.56 0.94 0.89 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 13 Q 8.45 4.16 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 14 P 0.00 4.47 0.00 2.10 2.01 0.00 3.75 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 2.10 0.00 15 D 8.42 4.65 0.00 2.96 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 16 L 8.46 4.38 0.00 1.67 1.68 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.24 3.45 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 0.31 0.00 0.00 0.15 0.00 0.00 18 Y 9.06 4.20 0.00 3.17 3.05 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 0.00 0.00 0.00 19 G 8.09 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.79 4.63 0.00 2.73 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.50 3.59 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.95 0.00 0.00 22 L 7.91 4.07 0.00 1.76 1.91 0.93 1.38 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 23 V 7.56 3.55 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.66 0.00 0.00 24 T 7.80 3.68 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 1.35 0.00 0.00 25 A 7.85 3.97 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 26 F 7.60 4.13 0.00 3.20 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 27 I 7.91 3.39 1.81 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.31 0.75 0.00 0.00 28 N 8.95 4.42 0.00 2.74 2.80 0.00 0.00 6.92 7.55 0.00 0.00 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 K 7.53 3.86 0.00 1.72 1.76 0.00 1.67 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.66 1.62 7.81 30 I 7.21 3.77 1.77 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.24 0.79 0.00 0.00 31 M 7.38 4.00 0.00 2.11 1.92 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.45 0.00 32 R 8.29 4.54 0.00 1.81 1.70 0.00 3.36 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 33 D 9.92 4.34 0.00 2.77 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 34 G 8.43 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 35 K 7.76 4.07 0.00 1.82 1.80 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.43 7.81 36 K 8.63 4.01 0.00 1.81 1.80 0.00 1.76 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.52 7.81 37 N 8.40 3.98 0.00 2.86 2.81 0.00 0.00 6.64 6.74 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 38 L 7.92 3.87 0.00 1.75 1.70 0.93 1.15 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 39 A 7.59 3.89 1.43 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 0.00 0.00 40 A 8.40 3.78 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.59 3.73 0.00 2.05 1.96 0.00 3.20 0.00 0.00 3.20 7.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.90 0.00 42 I 8.57 3.62 2.05 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 1.42 0.92 0.93 0.00 0.00 43 F 8.10 4.10 0.00 2.89 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 44 Y 7.42 4.05 0.00 3.19 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 45 D 8.46 4.39 0.00 2.69 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 46 A 7.74 4.20 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 47 C 7.77 3.85 0.00 3.02 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 48 K 8.44 4.11 0.00 1.82 2.03 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.50 7.81 49 I 8.29 4.13 1.99 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 1.73 1.35 0.96 0.00 0.00 50 I 8.20 3.83 2.02 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 1.70 1.21 1.02 0.00 0.00 51 Q 8.01 4.61 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.03 0.00 0.00 0.00 0.00 0.00 2.41 2.26 0.00 52 E 7.61 4.14 0.00 2.27 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 2.33 2.54 0.00 53 K 7.04 4.51 0.00 1.76 1.77 0.00 1.93 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.35 7.81 54 T 7.29 4.10 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 1.27 0.00 0.00 55 G 8.79 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Q 7.69 3.99 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.09 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 57 E 9.29 4.04 0.00 2.23 2.19 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 2.40 2.39 0.00 58 P 0.00 3.36 0.00 2.54 2.15 0.00 3.73 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.27 0.00 59 L 8.44 3.67 0.00 1.36 1.85 1.09 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.45 3.53 0.00 2.04 1.96 0.00 1.81 0.00 0.00 1.60 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.53 7.81 61 V 8.62 3.72 2.19 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 0.96 0.00 0.00 0.98 0.00 0.00 62 F 8.13 3.91 0.00 3.16 3.19 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 63 K 9.16 3.67 0.00 1.99 1.90 0.00 1.53 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.49 7.81 64 Q 7.78 4.09 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.60 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 65 A 7.52 3.93 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 66 V 7.18 3.41 1.67 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 0.78 0.00 0.00 0.03 0.00 0.00 67 E 7.59 3.86 0.00 2.15 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 2.27 2.36 0.00 68 N 8.16 4.56 0.00 2.92 2.89 0.00 0.00 6.81 7.87 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 69 V 7.13 4.34 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 1.11 0.00 0.00 1.05 0.00 0.00 70 K 7.75 3.81 0.00 1.79 1.73 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.53 1.52 7.81 71 P 0.00 4.57 0.00 2.39 2.66 0.00 3.69 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.67 0.00 72 R 9.16 4.09 0.00 1.95 2.14 0.00 3.16 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 73 M 7.69 5.05 0.00 2.01 1.91 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 2.62 2.76 0.00 74 E 8.90 4.85 0.00 2.05 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 0.00 2.25 2.35 0.00 75 V 8.41 4.84 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 0.79 0.00 0.00 1.01 0.00 0.00 76 R 9.49 4.80 0.00 2.14 2.38 0.00 3.16 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 77 S 9.00 4.21 0.00 3.96 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 78 R 7.88 3.67 0.00 1.07 1.57 0.00 2.49 0.00 0.00 2.31 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.23 0.00 79 R 8.34 4.87 0.00 1.69 1.72 0.00 3.14 0.00 0.00 3.65 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.43 0.00 80 V 8.99 3.62 1.50 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 0.66 0.00 0.00 0.62 0.00 0.00 81 G 8.05 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 0.00 0.00 0.00 82 G 9.11 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 0.00 0.00 0.00 83 A 6.83 4.21 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 84 N 7.55 4.97 0.00 2.56 2.71 0.00 0.00 7.60 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 Y 7.22 4.58 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 86 Q 8.88 4.67 0.00 2.31 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 87 V 8.39 3.99 2.29 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 1.10 0.00 0.00 0.92 0.00 0.00 88 P 0.00 5.44 0.00 2.16 2.07 0.00 3.94 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.08 0.00 89 M 8.28 4.53 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.58 0.00 90 E 8.87 4.41 0.00 1.89 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 2.34 2.34 0.00 91 V 7.71 4.22 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 0.69 0.00 0.00 1.02 0.00 0.00 92 S 8.70 4.26 0.00 3.85 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 93 P 0.00 4.23 0.00 2.27 2.27 0.00 3.73 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 94 R 7.87 3.82 0.00 1.83 1.96 0.00 3.12 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 95 R 7.93 3.79 0.00 1.81 2.01 0.00 3.23 0.00 0.00 3.32 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.50 0.00 96 Q 8.07 3.79 0.00 2.30 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.59 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 97 Q 7.94 3.85 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.55 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 98 S 8.42 4.00 0.00 3.86 3.81 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 99 L 8.84 3.40 0.00 0.88 0.13 0.77 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.33 3.69 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 0.00 101 L 7.72 4.06 0.00 1.88 1.93 0.98 0.82 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 0.00 102 R 7.64 3.88 0.00 1.94 1.94 0.00 3.22 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 103 W 8.05 4.63 0.00 3.47 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 0.00 104 L 7.82 4.18 0.00 2.31 2.07 0.93 0.92 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 0.00 105 V 8.08 3.29 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 0.72 0.00 0.00 0.75 0.00 0.00 106 Q 7.97 4.25 0.00 2.47 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.42 2.71 0.00 107 A 9.02 4.00 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 0.00 108 A 9.13 4.05 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 0.00 109 N 8.05 4.91 0.00 3.05 2.83 0.00 0.00 7.03 6.57 0.00 0.00 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 Q 7.74 4.55 0.00 2.27 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.59 0.00 0.00 0.00 0.00 0.00 2.31 2.53 0.00 111 R 7.70 4.41 0.00 1.91 2.26 0.00 3.28 0.00 0.00 3.32 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 112 P 0.00 4.36 0.00 2.19 2.21 0.00 3.82 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 2.02 1.99 0.00 113 E 7.19 4.04 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 114 R 8.49 4.15 0.00 1.83 2.02 0.00 3.37 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 115 R 7.65 4.25 0.00 1.92 1.84 0.00 3.20 0.00 0.00 3.35 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 116 A 8.72 4.02 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 0.00 117 A 8.14 3.98 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 0.00 118 V 7.68 3.41 1.87 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 0.85 0.00 0.00 0.97 0.00 0.00 119 R 7.75 3.88 0.00 2.03 2.23 0.00 3.14 0.00 0.00 3.39 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.95 0.00 120 I 8.08 3.78 2.14 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 1.64 1.07 1.25 0.00 0.00 121 A 8.92 3.75 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 0.00 122 H 8.42 3.88 0.00 3.21 3.33 0.00 5.68 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.40 3.94 0.00 2.22 2.26 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 2.51 2.49 0.00 124 L 8.34 3.97 0.00 2.20 1.72 1.20 1.00 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 0.00 125 M 8.22 4.03 0.00 2.11 2.26 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.61 0.00 126 D 8.57 4.39 0.00 2.83 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 0.00 127 A 7.97 3.92 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 0.00 128 A 7.75 3.92 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 0.00 129 E 8.18 4.34 0.00 2.04 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 2.29 2.31 0.00 130 G 8.04 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 0.00 131 K 8.44 4.34 0.00 1.76 1.82 0.00 1.60 0.00 0.00 1.83 0.00 0.00 3.06 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.28 7.81 132 G 8.46 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 0.00 0.00 0.00 133 G 7.76 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 0.00 134 A 8.33 3.93 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 0.00 135 V 8.53 3.55 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.00 0.00 0.00 136 K 7.68 3.74 0.00 1.76 1.99 0.00 1.83 0.00 0.00 1.59 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.43 7.81 137 K 8.30 3.71 0.00 1.44 0.87 0.00 0.61 0.00 0.00 0.65 0.00 0.00 2.63 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.94 0.56 7.81 138 K 7.87 3.61 0.00 2.49 2.11 0.00 1.86 0.00 0.00 1.90 0.00 0.00 3.19 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.72 1.83 7.81 139 E 8.42 4.37 0.00 2.22 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 2.31 2.32 0.00 140 D 8.48 4.31 0.00 2.81 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 0.00 141 V 7.71 3.59 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.79 0.00 0.00 142 E 8.23 4.29 0.00 2.27 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 2.36 2.27 0.00 143 R 7.77 3.87 0.00 1.85 1.98 0.00 3.14 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.91 0.00 144 M 8.29 3.81 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 3.01 0.00 145 A 7.93 4.58 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 0.00 146 E 10.78 4.51 0.00 2.16 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 2.22 2.39 0.00 147 A 7.81 3.92 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 0.00 148 N 8.03 4.63 0.00 2.82 2.97 0.00 0.00 7.08 7.66 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 0.00 149 R 7.45 4.15 0.00 1.89 1.95 0.00 3.18 0.00 0.00 3.34 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 150 A 7.76 3.96 0.94 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 0.00 0.00 151 Y 7.56 4.54 0.00 2.83 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 0.00 152 A 7.80 4.19 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 0.00 153 H 8.33 4.64 0.00 3.37 3.41 0.00 5.48 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 8.31 4.77 0.00 2.86 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 0.00 155 R 7.31 3.99 0.00 1.94 2.01 0.00 3.27 0.00 0.00 3.35 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.02 0.00 156 W 9.26 4.57 0.00 3.55 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