NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.5533 8.4244 119.1658 52.0242 40.8499 173.7324 4 Q 4.3496 7.8146 118.9768 54.5574 31.7706 173.1599 5 Y 5.1427 9.2747 121.1092 56.5147 42.9481 173.3405 6 Y 5.3666 9.4704 121.6960 55.9744 43.0068 174.2146 7 G 4.1260 8.4768 112.5616 44.4348 0.0000 172.1631 8 T 3.7330 7.8955 116.2043 59.8622 68.4448 171.0969 9 G 4.0011 9.7123 114.0667 44.6296 0.0000 172.9377 10 R 5.2482 7.9337 117.9174 56.5015 31.7437 173.8968 11 R 4.3150 8.2480 113.6386 56.9800 31.0994 174.0000 12 K 3.9747 9.4687 117.1841 58.0044 29.4625 175.4945 13 S 3.6613 7.9868 106.7134 59.2268 61.9309 170.9575 14 S 5.5861 8.1857 116.1357 56.8138 63.7259 172.4432 15 A 4.6686 8.6721 130.4777 50.8439 19.8752 175.8126 16 A 5.0391 8.5336 124.0835 50.2559 22.7155 176.1086 17 R 4.4417 8.2020 116.9356 54.8818 34.0516 174.5784 18 V 4.3373 8.4168 125.0283 61.2298 34.2066 174.6886 19 F 6.1690 8.1772 124.0206 54.1174 39.9581 172.3718 20 I 4.0916 8.2288 121.8606 61.5843 38.4788 174.6120 21 K 5.0346 8.8116 128.2532 53.6790 35.9307 173.5069 22 P 4.4836 0.0000 0.0000 61.4520 32.2024 175.3894 23 G 4.4010 9.1090 124.2026 45.8479 0.0000 175.0799 24 N 3.7914 8.9763 124.3619 52.5008 39.2911 176.1486 25 G 4.9300 8.5399 99.0463 44.4618 0.0000 174.9581 26 K 4.4368 7.9743 119.1386 56.2422 34.3240 177.8592 27 I 4.5573 8.2432 122.9116 60.1755 41.2123 174.3939 28 V 5.0164 8.2715 127.3279 60.3942 33.3222 173.8528 29 I 4.1781 8.0335 128.9393 60.0194 38.4251 176.0649 30 N 3.6577 9.5460 127.6476 54.4159 36.1269 175.5872 31 Q 3.7625 8.1121 115.8879 56.5891 29.0572 172.4668 32 R 4.4901 7.1625 116.0124 54.8855 32.6227 175.1738 33 S 4.6481 8.0970 112.7621 57.6204 63.5307 174.1256 34 L 3.9105 8.3536 127.3521 58.8081 41.7571 179.5259 35 E 4.3400 8.1503 116.7108 58.4829 29.3885 178.1008 36 Q 4.4815 7.6687 116.0736 56.5227 28.6104 175.2296 37 Y 4.5282 7.6201 119.3526 58.8713 41.0072 176.5061 38 F 5.3704 8.2061 117.1712 56.9563 39.8501 175.1903 39 G 3.6525 8.1876 110.8480 46.7531 0.0000 174.2043 40 R 3.9124 8.8758 122.9372 57.0456 28.7463 175.1086 41 E 4.7628 7.6735 114.3884 53.9706 32.5424 176.9763 42 T 4.0717 8.5255 113.2037 63.4230 67.5234 174.7203 43 A 3.9911 8.2557 125.1241 54.9039 19.0105 180.3089 44 R 4.3743 7.9970 106.7878 57.8654 29.5365 177.6652 45 M 4.2504 8.2973 120.1062 58.3550 32.4192 178.7650 46 V 3.7891 7.5046 113.2608 63.9854 31.5169 178.7130 47 V 3.5718 7.8336 110.6370 64.0321 31.0506 177.6656 48 R 4.3745 7.8525 115.8867 56.3227 30.4734 178.1402 49 Q 4.0249 7.9294 119.5073 58.7732 28.5411 177.7479 50 P 4.1382 0.0000 0.0000 65.7226 31.6160 178.0839 51 L 4.0672 7.6351 118.2006 57.7153 41.5305 179.0867 52 E 4.2479 9.2285 117.5929 59.1822 29.4531 178.7858 53 L 4.3582 7.4499 119.2929 56.3232 42.6825 176.7058 54 V 4.4809 7.8228 112.3494 60.8443 32.6884 172.1864 55 D 4.5497 8.7798 124.6485 54.2550 40.9182 173.4201 56 M 4.3754 8.3903 119.6447 56.1099 34.9982 173.8027 57 V 3.8018 8.7776 122.7557 63.4589 31.3094 172.8787 58 E 4.7233 7.9486 114.0711 55.9493 29.8443 175.7316 59 K 4.5221 7.8469 117.6361 56.9239 34.3884 176.3631 60 L 4.9564 7.2501 116.7959 56.0242 43.4435 171.5945 61 D 5.6190 8.9854 117.8934 50.5408 42.6513 174.8912 62 L 5.8649 8.5219 119.5416 52.6354 46.4393 174.7703 63 Y 5.0426 8.6397 121.3875 56.1963 40.2424 173.9255 64 I 4.2922 8.1947 127.3535 61.0740 38.6602 175.6897 65 T 4.6427 9.2593 123.4516 61.4698 69.9133 173.0106 66 V 4.6430 7.4457 124.1586 59.8889 34.6037 175.0755 67 K 4.3897 9.6372 119.6838 57.6068 36.4538 171.7445 68 G 4.3477 8.6611 114.6773 46.6455 0.0000 171.3683 69 G 4.2565 9.4838 108.6674 43.6092 0.0000 177.0155 70 G 4.0305 8.5446 116.3291 44.0305 0.0000 172.0475 71 I 3.9805 7.8205 118.9582 63.9813 36.8802 177.9409 72 S 4.0754 8.0147 114.7941 61.6684 62.7989 177.0684 73 G 3.5113 7.9679 108.4987 47.9052 0.0000 174.6773 74 Q 4.1578 9.0829 124.4846 58.4366 28.9766 178.3777 75 A 4.2465 8.4500 121.1178 55.3825 18.2833 179.4765 76 G 3.6749 8.3425 103.1568 48.0199 0.0000 175.1938 77 A 4.0146 8.5717 123.8457 54.9145 18.2931 179.6041 78 I 3.5970 7.9164 118.1298 64.7577 37.2649 178.4826 79 R 3.7517 7.9537 119.2875 59.6273 29.6474 177.9787 80 H 4.2316 7.9920 117.9673 59.2840 29.8856 177.3525 81 G 3.6087 7.7671 108.4708 47.3733 0.0000 175.0562 82 I 3.5913 7.8584 122.0764 64.6449 36.9187 178.2563 83 T 3.8353 7.7978 113.7716 65.4852 67.3429 176.0375 84 R 3.9098 8.0524 120.1217 59.1158 30.1212 178.6506 85 A 4.1049 7.8117 119.9282 55.3065 18.3895 179.3074 86 L 3.9315 7.9234 117.4081 58.0538 41.3445 179.3851 87 M 4.3110 7.9439 119.4306 57.8699 32.2212 177.6729 88 E 4.1673 7.9613 118.1207 59.6351 29.7483 178.4174 89 Y 4.0184 7.3727 117.9736 59.1399 38.7789 175.0057 90 D 4.1695 7.7931 120.5584 53.2276 43.1783 175.3083 91 E 4.1874 8.6497 127.2771 58.5319 30.0092 179.6819 92 S 4.2887 8.1785 115.7768 61.0550 63.0847 175.7148 93 L 4.2709 7.8097 120.9797 57.5315 40.1947 179.1099 94 R 3.9257 7.5733 118.9844 59.5645 29.5663 178.5081 95 S 4.0400 7.7774 111.4069 61.2034 62.0061 175.6761 96 E 4.2715 7.8899 119.2522 57.8490 29.9926 178.2249 97 L 4.3203 7.7142 119.2957 57.8730 41.7337 179.3520 98 R 3.8439 8.2562 118.9832 59.2360 29.8177 178.1754 99 K 3.2252 7.4188 117.0754 58.8182 32.0408 177.3495 100 A 4.2863 6.9681 117.8096 50.4744 20.5259 175.8857 101 G 3.5118 8.3854 106.2696 46.7091 0.0000 172.7243 102 F 5.1380 7.5788 118.4028 59.5467 41.8636 178.9921 103 V 3.9877 8.0759 111.9757 64.2774 31.5862 177.2872 104 T 3.9683 7.2417 109.7523 61.5528 69.0414 173.3830 105 R 4.2099 8.2147 123.9788 54.3029 30.4764 175.8922 106 D 4.4756 8.4004 124.9290 54.1646 39.3957 176.0030 107 A 4.1794 8.3158 128.6476 54.1194 18.8889 178.4715 108 R 3.8564 6.8709 114.6804 57.1812 30.5194 175.7050 109 Q 4.5403 8.4061 121.5513 54.2295 32.0451 173.6984 110 V 3.5670 8.2244 122.4152 63.5078 31.9913 174.9818 111 E 4.5880 8.4463 125.0048 54.1435 30.9066 176.2845 112 R 3.8626 8.5541 120.0964 56.2493 29.7332 176.1922 113 K 4.1587 8.4553 121.8774 55.9729 32.0126 176.7908 114 K 4.2588 8.4289 126.5572 55.8429 32.8700 177.0610 115 V 3.9080 8.0184 121.6514 62.8399 32.3354 174.6946 116 G 4.2512 9.0557 111.4555 46.2008 0.0000 173.7831 117 L 4.5285 6.8172 120.1106 53.8707 43.2594 176.1084 118 R 4.5650 8.1945 118.1027 56.6158 32.0936 176.5343 119 K 4.2790 8.0325 115.6301 56.1469 32.7387 176.1373 120 A 3.9448 8.3408 118.8525 53.4385 17.8259 177.9497 121 R 4.6720 8.1431 110.6851 57.1367 37.7400 176.0238 122 R 3.8426 8.1132 118.8761 56.6461 30.2695 174.9529 123 R 4.7143 8.3873 124.8680 53.3212 31.4616 174.2286 124 P 4.2800 0.0000 0.0000 62.4593 31.5045 176.0996 125 Q 4.0825 8.8017 121.2589 56.8870 28.5301 176.9190 126 F 4.4837 9.2718 115.8148 56.2705 38.5236 176.5478 127 S 2.9544 6.9585 113.0675 58.4796 63.8378 171.6761 128 K 3.6212 7.6348 122.0271 56.0583 32.6718 176.9469 129 R 4.4562 8.3805 125.2969 56.5585 30.3239 174.7776 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 3 N 8.42 4.55 0.00 2.60 2.57 0.00 0.00 6.88 6.19 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 4 Q 7.81 4.35 0.00 2.07 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.65 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 5 Y 9.27 5.14 0.00 3.15 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 6 Y 9.47 5.37 0.00 3.18 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.48 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 T 7.90 3.73 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 1.32 0.00 0.00 9 G 9.71 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.93 5.25 0.00 1.99 1.86 0.00 2.74 0.00 0.00 3.96 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.48 0.00 11 R 8.25 4.31 0.00 1.95 1.98 0.00 3.08 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.44 0.00 12 K 9.47 3.97 0.00 1.90 1.90 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.34 1.39 7.81 13 S 7.99 3.66 0.00 4.17 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 14 S 8.19 5.59 0.00 3.97 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 15 A 8.67 4.67 1.31 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 0.00 0.00 16 A 8.53 5.04 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 17 R 8.20 4.44 0.00 1.71 1.85 0.00 3.14 0.00 0.00 3.12 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 18 V 8.42 4.34 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 0.92 0.00 0.00 0.78 0.00 0.00 19 F 8.18 6.17 0.00 3.57 2.97 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 20 I 8.23 4.09 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 1.19 0.57 0.88 0.00 0.00 21 K 8.81 5.03 0.00 1.80 1.90 0.00 1.59 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.37 7.81 22 P 0.00 4.48 0.00 2.12 2.04 0.00 3.98 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 2.00 2.02 0.00 23 G 9.11 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 0.00 0.00 0.00 0.00 24 N 8.98 3.79 0.00 3.09 2.83 0.00 0.00 5.90 6.92 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 25 G 8.54 4.93 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 26 K 7.97 4.44 0.00 1.75 1.76 0.00 1.62 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.48 7.81 27 I 8.24 4.56 1.89 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 1.25 1.21 0.93 0.00 0.00 28 V 8.27 5.02 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 1.08 0.00 0.00 0.99 0.00 0.00 29 I 8.03 4.18 1.51 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 1.26 0.50 0.59 0.00 0.00 30 N 9.55 3.66 0.00 2.22 2.61 0.00 0.00 7.05 7.57 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 31 Q 8.11 3.76 0.00 2.23 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.81 0.00 0.00 0.00 0.00 0.00 2.26 2.46 0.00 32 R 7.16 4.49 0.00 1.86 1.79 0.00 3.18 0.00 0.00 3.11 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 33 S 8.10 4.65 0.00 3.86 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 34 L 8.35 3.91 0.00 1.94 1.70 1.04 1.39 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 35 E 8.15 4.34 0.00 2.13 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 2.43 2.51 0.00 36 Q 7.67 4.48 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 37 Y 7.62 4.53 0.00 2.61 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 0.00 0.00 0.00 38 F 8.21 5.37 0.00 3.18 2.93 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 39 G 8.19 3.65 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 0.00 0.00 0.00 40 R 8.88 3.91 0.00 1.97 2.02 0.00 3.19 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 41 E 7.67 4.76 0.00 2.19 1.77 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 2.22 2.44 0.00 42 T 8.53 4.07 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 1.15 0.00 0.00 43 A 8.26 3.99 0.53 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 0.00 0.00 44 R 8.00 4.37 0.00 2.04 2.37 0.00 3.10 0.00 0.00 3.49 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.70 0.00 45 M 8.30 4.25 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.83 0.00 46 V 7.50 3.79 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 0.96 0.00 0.00 0.91 0.00 0.00 47 V 7.83 3.57 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.98 0.00 0.00 48 R 7.85 4.37 0.00 1.95 2.03 0.00 3.20 0.00 0.00 3.29 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 49 Q 7.93 4.02 0.00 2.11 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.54 0.00 50 P 0.00 4.14 0.00 2.04 1.62 0.00 3.55 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.80 0.00 51 L 7.64 4.07 0.00 1.79 1.73 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 52 E 9.23 4.25 0.00 2.08 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 2.45 2.46 0.00 53 L 7.45 4.36 0.00 1.92 2.06 1.02 0.93 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 54 V 7.82 4.48 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.07 0.00 0.00 55 D 8.78 4.55 0.00 2.85 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 56 M 8.39 4.38 0.00 1.90 1.92 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 57 V 8.78 3.80 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 0.84 0.00 0.00 0.94 0.00 0.00 58 E 7.95 4.72 0.00 2.07 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 2.27 2.23 0.00 59 K 7.85 4.52 0.00 1.76 1.81 0.00 1.97 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.36 1.32 7.81 60 L 7.25 4.96 0.00 1.90 1.66 0.82 0.63 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 D 8.99 5.62 0.00 2.72 2.97 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 62 L 8.52 5.86 0.00 1.63 1.72 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 8.64 5.04 0.00 3.07 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 I 8.19 4.29 1.73 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 1.19 0.62 0.81 0.00 0.00 65 T 9.26 4.64 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 66 V 7.45 4.64 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 1.02 0.00 0.00 67 K 9.64 4.39 0.00 1.81 1.90 0.00 1.27 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.23 1.34 7.81 68 G 8.66 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 G 9.48 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 0.00 0.00 0.00 0.00 70 G 8.54 4.03 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 0.00 0.00 0.00 71 I 7.82 3.98 1.84 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 1.69 0.67 0.80 0.00 0.00 72 S 8.01 4.08 0.00 3.96 4.07 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 73 G 7.97 3.51 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 0.00 74 Q 9.08 4.16 0.00 2.81 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.85 2.56 0.00 75 A 8.45 4.25 0.80 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 76 G 8.34 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.57 4.01 1.49 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 0.00 0.00 78 I 7.92 3.60 2.11 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.83 0.91 0.00 0.00 79 R 7.95 3.75 0.00 1.81 1.99 0.00 2.68 0.00 0.00 3.03 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.74 0.00 80 H 7.99 4.23 0.00 3.19 3.42 0.00 5.85 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 G 7.77 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 82 I 7.86 3.59 1.94 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 1.34 0.75 0.83 0.00 0.00 83 T 7.80 3.84 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 84 R 8.05 3.91 0.00 1.82 1.79 0.00 3.24 0.00 0.00 3.02 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.49 0.00 85 A 7.81 4.10 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 86 L 7.92 3.93 0.00 1.88 1.76 0.97 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 87 M 7.94 4.31 0.00 2.12 2.08 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 2.67 2.58 0.00 88 E 7.96 4.17 0.00 2.23 2.33 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 2.47 2.38 0.00 89 Y 7.37 4.02 0.00 1.60 2.58 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 90 D 7.79 4.17 0.00 2.23 2.37 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 91 E 8.65 4.19 0.00 2.01 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 2.52 2.27 0.00 92 S 8.18 4.29 0.00 3.98 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 93 L 7.81 4.27 0.00 1.94 1.93 1.00 0.75 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 94 R 7.57 3.93 0.00 2.08 2.03 0.00 3.32 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 1.65 1.79 0.00 95 S 7.78 4.04 0.00 3.92 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 96 E 7.89 4.27 0.00 2.08 1.98 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 2.27 2.33 0.00 97 L 7.71 4.32 0.00 1.98 1.99 0.99 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 98 R 8.26 3.84 0.00 1.86 2.01 0.00 3.11 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 99 K 7.42 3.23 0.00 1.90 1.96 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.42 7.81 100 A 6.97 4.29 0.41 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 0.00 101 G 8.39 3.51 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 0.00 102 F 7.58 5.14 0.00 3.07 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 0.00 103 V 8.08 3.99 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 0.77 0.00 0.00 0.96 0.00 0.00 104 T 7.24 3.97 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 1.22 0.00 0.00 105 R 8.21 4.21 0.00 1.79 1.85 0.00 3.37 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.54 0.00 106 D 8.40 4.48 0.00 2.71 2.55 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 0.00 0.00 0.00 0.00 107 A 8.32 4.18 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 0.00 108 R 6.87 3.86 0.00 1.99 1.93 0.00 3.18 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 109 Q 8.41 4.54 0.00 2.16 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.82 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 110 V 8.22 3.57 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.93 0.00 0.00 111 E 8.45 4.59 0.00 1.99 1.86 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 2.23 2.27 0.00 112 R 8.55 3.86 0.00 1.91 1.96 0.00 3.03 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 113 K 8.46 4.16 0.00 1.74 1.79 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.46 7.81 114 K 8.43 4.26 0.00 1.86 1.70 0.00 1.84 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.52 1.58 7.81 115 V 8.02 3.91 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.93 0.00 0.00 116 G 9.06 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 0.00 0.00 0.00 0.00 117 L 6.82 4.53 0.00 1.48 1.92 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.19 4.56 0.00 1.71 1.86 0.00 3.30 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 119 K 8.03 4.28 0.00 1.77 1.64 0.00 1.92 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.38 7.81 120 A 8.34 3.94 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 0.00 121 R 8.14 4.67 0.00 1.76 1.91 0.00 3.34 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 122 R 8.11 3.84 0.00 1.89 1.91 0.00 3.20 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 123 R 8.39 4.71 0.00 1.84 1.86 0.00 3.26 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 124 P 0.00 4.28 0.00 2.20 2.10 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 1.98 0.00 125 Q 8.80 4.08 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.99 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 126 F 9.27 4.48 0.00 3.19 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 0.00 127 S 6.96 2.95 0.00 3.90 3.71 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 0.00 128 K 7.63 3.62 0.00 1.64 1.77 0.00 1.59 0.00 0.00 1.59 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.51 7.81 129 R 8.38 4.46 0.00 1.98 1.78 0.00 3.40 0.00 0.00 3.40 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.82 0.00