NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 E 4.3485 8.4293 121.4710 56.1490 30.0761 174.6689 4 E 4.6486 8.3239 123.1531 53.0532 32.5823 171.2508 5 E 4.6233 8.7446 118.8840 54.0942 33.5738 176.3585 6 A 4.0656 8.6087 124.6492 52.1579 19.0236 176.9670 7 E 4.0409 8.5166 121.7217 56.1890 30.3568 176.5077 8 Q 4.3125 8.4963 124.7619 55.5237 29.6218 175.2679 9 N 5.0839 8.3601 119.1616 50.2794 42.9731 175.1939 10 L 3.8458 8.6026 122.5982 58.5042 42.0173 179.5778 11 S 4.3778 7.6045 116.3054 60.7688 62.5346 175.4492 12 E 4.2216 8.0888 120.8124 57.6833 29.5674 177.5207 13 L 4.3912 7.6279 117.3796 55.8431 42.3796 177.3155 14 S 4.7553 7.3749 115.2581 58.6424 63.7354 175.2247 15 G 3.9302 8.3131 109.9380 43.8412 0.0000 169.9610 16 P 5.1100 0.0000 0.0000 62.8317 32.3489 175.6356 17 W 5.7075 9.0863 122.3348 55.2160 33.4228 174.7171 18 R 5.0764 9.4624 120.3458 54.8698 34.2135 174.6076 19 T 4.1909 8.7850 118.6530 63.6950 68.9711 174.0066 20 V 3.9156 8.4735 126.7046 64.2439 32.2968 175.1707 21 Y 5.0219 7.2387 116.5584 56.2858 42.6378 173.8604 22 I 4.8910 8.3995 121.7700 59.7696 40.9758 174.8432 23 G 4.2687 9.3152 114.2058 44.6398 0.0000 171.9612 24 S 5.2387 8.2230 114.6240 56.6339 65.0740 174.2649 25 T 4.0187 8.6384 116.5094 63.4744 69.7023 173.7902 26 N 4.8091 8.2879 121.2951 50.4565 39.8913 172.4988 27 P 4.3081 0.0000 0.0000 65.9510 31.0927 177.8962 28 E 4.0228 8.2137 117.3097 59.3223 29.2408 179.3662 29 K 4.3406 8.2828 119.3646 58.0598 31.8089 178.1902 30 I 4.6214 7.3579 110.1926 60.4723 38.0949 175.5282 31 Q 4.3029 7.6320 120.0962 54.8753 29.4975 174.8404 32 E 4.0633 8.4601 119.8954 58.3051 29.6585 176.3217 33 N 4.8165 8.4519 121.3646 54.3115 35.8565 174.2740 34 G 4.0166 8.3660 108.6702 43.9765 0.0000 173.7777 35 P 4.3743 0.0000 0.0000 64.4279 31.5777 176.9928 36 F 4.6581 8.3651 117.1001 57.4460 39.4914 176.9277 37 R 4.3579 7.5678 123.7558 54.9552 28.1552 175.2840 38 T 4.7581 7.5809 109.0607 60.5731 70.7360 174.6501 39 Y 4.6461 9.2924 124.9456 56.4817 39.0508 175.3663 40 F 4.9087 9.4403 124.1784 58.3053 39.7006 174.6520 41 R 4.7037 9.5059 119.2824 57.4576 32.5197 175.6317 42 E 5.3910 7.9465 115.8754 55.2717 34.6286 173.5844 43 L 4.9175 9.0398 120.4287 52.9651 46.4410 175.8938 44 V 4.6147 8.0007 121.7802 61.2459 34.3052 174.0561 45 F 4.8647 9.2899 127.4822 56.0244 40.8929 175.2761 46 D 4.7014 8.8394 122.2355 52.6093 43.0784 175.8841 47 D 4.4523 9.0271 127.0466 57.4038 41.3282 177.9654 48 E 4.0943 8.4119 118.6116 58.9395 29.7568 177.6351 49 K 4.1530 8.2134 115.7765 56.1826 33.2163 176.4909 50 G 3.9208 8.2577 107.5253 46.8513 0.0000 172.5884 51 T 5.3387 7.4971 107.0632 59.7335 73.5346 173.8127 52 V 4.3870 8.3199 121.2786 61.1336 34.8590 173.6383 53 D 5.0530 8.3347 127.5601 52.6460 43.1864 175.2041 54 F 4.5522 8.8691 122.4109 55.6925 41.6608 174.2719 55 Y 4.8831 8.3277 120.8117 56.0631 40.9264 174.8588 56 F 5.4343 8.3365 118.3181 56.0270 42.3488 173.0533 57 S 6.0951 9.7590 113.8611 56.0859 66.8841 174.0098 58 V 5.1483 8.6191 120.5549 60.5924 34.8160 172.7752 59 K 4.4670 8.1913 123.8131 55.2461 34.0546 175.4773 60 R 4.5709 8.6384 126.7909 55.8859 33.1416 174.3145 61 D 4.3770 9.5354 124.7564 55.5385 39.4600 173.7148 62 G 3.9280 8.4897 102.1654 45.7154 0.0000 173.9571 63 K 4.6933 7.6571 118.1195 53.8368 36.1191 175.7077 64 W 4.8443 8.9508 124.1657 56.5778 30.0645 175.7575 65 K 4.7978 9.5414 123.8614 54.6947 35.1766 174.7378 66 N 5.3119 8.7987 121.2685 52.1045 40.1080 174.6703 67 V 4.2983 8.6220 123.3288 61.0827 35.1565 173.4532 68 H 4.9287 8.4858 125.9290 54.1691 32.5403 172.8915 69 V 4.1923 8.0325 124.1334 60.9211 35.0573 173.4935 70 K 4.9120 8.5622 128.2820 54.6534 33.9625 174.8543 71 A 5.1093 9.0057 129.0147 50.5227 22.3581 175.1011 72 T 5.0821 8.5752 116.6145 61.3907 71.6702 173.8334 73 K 3.8631 8.8563 128.0317 56.3568 33.0766 176.3119 74 Q 4.6195 8.8405 125.5457 53.8984 31.0213 176.5661 75 D 4.5858 8.5591 119.3610 57.4727 40.8699 177.5184 76 D 4.5300 8.0249 116.0669 53.2630 39.4717 177.3693 77 G 3.8450 8.4674 109.2187 45.8727 0.0000 173.9894 78 T 4.5060 7.7868 110.5945 61.2635 71.3174 172.9809 79 Y 5.3155 9.1496 118.1158 56.3522 41.9093 175.5090 80 V 5.1251 8.8113 115.4238 59.8803 35.1212 174.6569 81 A 4.9552 8.7081 123.9081 50.7393 23.1421 174.4316 82 D 5.1582 8.3180 120.3127 53.0431 42.7893 175.3835 83 Y 4.2613 9.0889 122.5041 57.9823 42.1843 173.5577 84 E 3.4362 9.6320 129.5295 57.6434 27.5804 172.4779 85 G 3.7719 7.6922 103.4149 44.2545 0.0000 172.4211 86 Q 4.9913 8.3692 117.0902 54.8377 31.3970 175.0213 87 N 5.6600 8.7839 117.8273 51.6819 43.5805 173.5732 88 V 4.8176 8.8349 122.4519 61.1856 34.4277 173.7242 89 F 5.2458 9.5975 131.2265 56.3475 41.6909 173.9927 90 K 4.8146 8.5366 127.3905 54.5685 35.0153 174.7280 91 I 4.1848 8.5194 128.6537 60.9387 37.0618 175.8474 92 V 3.9542 8.6657 128.6565 65.2555 32.3701 176.3353 93 S 4.7785 7.8353 113.1412 57.1208 65.7427 172.9137 94 L 5.1114 8.4049 127.1471 54.3245 45.0793 174.5133 95 S 4.5827 8.6024 117.8627 57.4967 65.8333 174.8579 96 R 3.8797 8.6902 119.8906 58.8144 29.9162 176.7658 97 T 4.5845 8.0820 105.7036 61.4974 71.4235 173.1747 98 H 5.8607 8.2151 116.9545 54.1199 33.0755 172.2567 99 L 5.0884 9.1785 120.4850 53.8616 45.5826 174.5029 100 V 5.0339 9.1368 126.5073 61.2014 34.1845 174.1804 101 A 5.0643 8.9219 128.0290 50.5491 23.4075 173.8692 102 H 5.2558 8.7685 118.6274 54.3128 32.9939 171.8857 103 N 5.3912 9.2874 124.3160 51.8147 42.1949 172.6720 104 I 4.7726 8.7328 126.9714 59.5658 39.7047 173.9907 105 N 5.4504 9.1970 125.9870 51.6605 42.1857 173.1036 106 V 4.8630 8.6157 125.4798 61.1592 34.4658 175.0683 107 D 5.2662 8.9893 129.1678 51.9183 41.7416 177.4285 108 K 4.2668 8.5906 114.4393 58.4845 32.0105 176.7587 109 H 4.7695 8.5090 114.2978 55.3736 30.1594 174.4128 110 G 3.9027 8.5743 108.0771 45.2421 0.0000 173.2493 111 Q 4.2690 8.0256 121.7399 55.6567 30.3479 174.2167 112 T 5.0706 8.4645 121.0330 61.0238 69.2910 173.6960 113 T 4.6980 8.9632 124.3341 61.8525 73.0329 172.4861 114 E 5.1163 8.8848 125.0362 54.5952 32.4177 175.1094 115 L 5.3643 9.0265 123.4213 53.0934 46.2486 175.5874 116 T 5.1372 8.6321 111.1130 60.2314 72.4132 172.9849 117 G 4.2700 8.8037 109.1396 44.8220 0.0000 171.2330 118 L 5.2246 8.4305 124.4406 52.9428 45.0184 175.3163 119 F 5.5079 9.3367 124.1709 55.6614 43.3772 174.2935 120 V 5.0931 9.0695 120.0430 59.9588 34.8459 174.3426 121 K 3.8492 8.0958 123.9507 55.1493 33.2593 176.1184 122 L 4.3267 8.0802 127.2526 53.7077 42.2086 175.9891 123 N 4.5905 8.5324 122.4057 51.5977 39.5409 175.2367 124 V 4.2355 8.1372 117.1939 59.4436 33.1967 176.0435 125 E 4.3307 8.4058 124.8556 55.5217 31.7179 177.4155 126 D 4.4212 8.6252 122.3381 57.7224 41.0710 179.1937 127 E 4.0667 8.1668 117.4104 59.3879 29.6483 178.7766 128 D 4.3964 8.0402 119.6010 57.1198 40.9677 178.4135 129 L 4.0686 7.9676 119.5634 57.7992 41.5750 179.1639 130 E 4.1348 8.5127 119.3144 59.2170 29.5833 179.0525 131 K 3.9929 8.2540 118.6165 59.3365 32.1016 179.0582 132 F 4.0935 8.2777 120.8516 61.1799 39.3263 177.2569 133 W 4.1201 8.3626 118.6661 59.5037 28.7978 178.4589 134 K 4.1277 8.4125 119.8314 59.4163 31.5609 178.5583 135 L 3.8997 7.8974 120.5576 58.5520 41.9865 179.0963 136 T 3.7168 7.7114 115.9192 66.4629 68.2059 176.4578 137 E 4.0755 8.3726 119.5361 59.2777 29.5275 178.7767 138 D 4.3524 8.0588 119.2959 56.8716 40.9438 177.9162 139 K 4.3873 7.6845 115.8625 55.4186 32.3567 176.8397 140 G 3.8788 8.0070 107.3867 46.6217 0.0000 173.8985 141 I 4.2132 7.5299 120.4773 59.4906 38.4158 175.8028 142 D 4.5758 8.5021 124.7443 53.6766 41.8534 177.1582 143 K 4.3333 8.7362 125.2234 59.3607 32.1817 178.1239 144 K 4.2998 8.1858 115.6797 58.1008 32.8258 176.8307 145 N 5.0292 8.2839 117.6746 53.3641 39.0338 175.1106 146 V 4.5801 7.7459 110.0782 59.5862 35.4170 175.1633 147 V 4.1251 8.4508 123.3059 61.0531 32.9084 174.8416 148 N 4.7190 8.3607 125.5894 52.5087 38.4733 175.2147 149 F 4.0551 8.8738 126.2335 59.9377 39.1775 177.3923 150 L 3.9610 8.0066 119.7334 58.4421 41.7112 178.8718 151 E 4.1322 8.0922 116.3116 58.9893 29.8481 178.6928 152 N 4.4705 7.5569 117.0116 56.4012 38.4253 177.2828 153 E 3.9889 7.9538 118.6900 59.3383 29.6250 178.6365 154 D 4.5747 7.8354 116.9584 55.7043 42.2807 176.2374 155 H 4.8848 7.6662 115.6981 53.7605 29.6427 171.1081 156 P 4.5410 0.0000 0.0000 63.0387 33.3217 176.9476 157 H 4.4119 8.2043 113.4024 56.6801 28.0343 173.0448 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 E 8.43 4.35 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.31 0.00 4 E 8.32 4.65 0.00 2.14 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.31 0.00 5 E 8.74 4.62 0.00 2.01 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 2.17 2.35 0.00 6 A 8.61 4.07 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 7 E 8.52 4.04 0.00 1.95 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 0.00 2.30 2.34 0.00 8 Q 8.50 4.31 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.53 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 9 N 8.36 5.08 0.00 2.70 2.65 0.00 0.00 6.73 6.81 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 10 L 8.60 3.85 0.00 1.75 2.09 0.85 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 11 S 7.60 4.38 0.00 4.00 3.96 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 12 E 8.09 4.22 0.00 1.96 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 13 L 7.63 4.39 0.00 1.62 1.69 0.90 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.37 4.76 0.00 4.06 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 15 G 8.31 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 P 0.00 5.11 0.00 2.15 2.44 0.00 3.64 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.99 0.00 17 W 9.09 5.71 0.00 3.31 3.34 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 18 R 9.46 5.08 0.00 1.77 1.89 0.00 3.42 0.00 0.00 3.52 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 19 T 8.78 4.19 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 0.89 0.00 0.00 20 V 8.47 3.92 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.00 0.00 0.85 0.00 0.00 21 Y 7.24 5.02 0.00 2.76 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 22 I 8.40 4.89 1.84 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 1.15 0.39 0.94 0.00 0.00 23 G 9.32 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 0.00 0.00 0.00 0.00 24 S 8.22 5.24 0.00 3.79 3.66 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 25 T 8.64 4.02 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 1.23 0.00 0.00 26 N 8.29 4.81 0.00 2.69 2.70 0.00 0.00 7.11 7.21 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 27 P 0.00 4.31 0.00 2.30 2.31 0.00 3.75 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 28 E 8.21 4.02 0.00 2.18 2.27 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 2.49 2.39 0.00 29 K 8.28 4.34 0.00 1.97 2.10 0.00 1.82 0.00 0.00 1.79 0.00 0.00 3.13 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.49 1.59 7.81 30 I 7.36 4.62 1.92 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.68 1.03 0.00 0.00 31 Q 7.63 4.30 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 7.00 0.00 0.00 0.00 0.00 0.00 2.61 2.45 0.00 32 E 8.46 4.06 0.00 1.94 1.88 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 2.26 2.31 0.00 33 N 8.45 4.82 0.00 2.91 2.95 0.00 0.00 7.15 7.61 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 34 G 8.37 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 0.00 0.00 0.00 0.00 35 P 0.00 4.37 0.00 1.89 2.07 0.00 3.82 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 2.16 2.00 0.00 36 F 8.37 4.66 0.00 3.23 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.57 4.36 0.00 1.97 1.95 0.00 3.34 0.00 0.00 3.48 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.61 0.00 38 T 7.58 4.76 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 39 Y 9.29 4.65 0.00 3.19 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 F 9.44 4.91 0.00 3.12 3.32 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 41 R 9.51 4.70 0.00 1.94 2.04 0.00 3.17 0.00 0.00 3.23 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 42 E 7.95 5.39 0.00 1.90 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.33 0.00 43 L 9.04 4.92 0.00 1.27 0.68 -0.08 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 44 V 8.00 4.61 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 1.01 0.00 0.00 1.00 0.00 0.00 45 F 9.29 4.86 0.00 3.02 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 46 D 8.84 4.70 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 47 D 9.03 4.45 0.00 2.75 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.41 4.09 0.00 1.95 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 2.31 2.35 0.00 49 K 8.21 4.15 0.00 1.86 1.87 0.00 1.91 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.66 7.81 50 G 8.26 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 51 T 7.50 5.34 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 1.25 0.00 0.00 52 V 8.32 4.39 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 -0.52 0.00 0.00 0.24 0.00 0.00 53 D 8.33 5.05 0.00 2.56 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 54 F 8.87 4.55 0.00 2.73 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Y 8.33 4.88 0.00 2.97 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.34 5.43 0.00 3.37 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 57 S 9.76 6.10 0.00 3.97 4.05 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 58 V 8.62 5.15 2.41 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 1.13 0.00 0.00 1.04 0.00 0.00 59 K 8.19 4.47 0.00 0.79 1.14 0.00 1.15 0.00 0.00 0.61 0.00 0.00 2.62 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.03 0.71 7.81 60 R 8.64 4.57 0.00 1.75 1.67 0.00 3.44 0.00 0.00 3.08 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.68 0.00 61 D 9.54 4.38 0.00 2.79 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 62 G 8.49 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.66 4.69 0.00 1.81 1.69 0.00 1.68 0.00 0.00 1.66 0.00 0.00 3.19 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.50 7.81 64 W 8.95 4.84 0.00 3.20 3.15 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 65 K 9.54 4.80 0.00 1.70 1.72 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.56 7.81 66 N 8.80 5.31 0.00 2.63 2.76 0.00 0.00 6.88 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 V 8.62 4.30 0.95 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 0.60 0.00 0.00 0.93 0.00 0.00 68 H 8.49 4.93 0.00 2.86 2.98 0.00 5.92 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.03 4.19 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 0.64 0.00 0.00 0.76 0.00 0.00 70 K 8.56 4.91 0.00 1.67 1.60 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.31 1.51 7.81 71 A 9.01 5.11 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 72 T 8.58 5.08 4.29 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 1.23 0.00 0.00 73 K 8.86 3.86 0.00 1.64 1.56 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.17 0.58 7.81 74 Q 8.84 4.62 0.00 2.23 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.55 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 75 D 8.56 4.59 0.00 2.64 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.02 4.53 0.00 2.76 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 77 G 8.47 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 7.79 4.51 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 1.24 0.00 0.00 79 Y 9.15 5.32 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 80 V 8.81 5.13 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 0.85 0.00 0.00 1.04 0.00 0.00 81 A 8.71 4.96 1.15 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 0.00 0.00 82 D 8.32 5.16 0.00 2.69 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 83 Y 9.09 4.26 0.00 2.85 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 84 E 9.63 3.44 0.00 1.70 1.75 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 1.47 1.47 0.00 85 G 7.69 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 8.37 4.99 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.73 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 87 N 8.78 5.66 0.00 2.78 2.76 0.00 0.00 7.04 9.02 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 88 V 8.83 4.82 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 1.07 0.00 0.00 0.97 0.00 0.00 89 F 9.60 5.25 0.00 3.14 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 90 K 8.54 4.81 0.00 1.85 1.66 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.40 7.81 91 I 8.52 4.18 1.99 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.87 0.97 0.00 0.00 92 V 8.67 3.95 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 0.71 0.00 0.00 0.92 0.00 0.00 93 S 7.84 4.78 0.00 3.98 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 94 L 8.40 5.11 0.00 1.64 1.47 0.96 0.79 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 95 S 8.60 4.58 0.00 4.11 4.06 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 0.00 0.00 0.00 96 R 8.69 3.88 0.00 1.80 2.01 0.00 3.17 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 97 T 8.08 4.58 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 1.14 0.00 0.00 98 H 8.22 5.86 0.00 3.28 3.50 0.00 5.43 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 9.18 5.09 0.00 1.73 1.72 1.02 0.81 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 0.00 100 V 9.14 5.03 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.06 0.00 0.00 101 A 8.92 5.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 H 8.77 5.26 0.00 3.11 3.03 0.00 5.55 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 N 9.29 5.39 0.00 2.90 2.60 0.00 0.00 6.84 7.72 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 0.00 104 I 8.73 4.77 1.84 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 1.05 0.31 0.89 0.00 0.00 105 N 9.20 5.45 0.00 2.68 2.43 0.00 0.00 6.59 7.94 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 0.00 106 V 8.62 4.86 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 0.95 0.00 0.00 0.94 0.00 0.00 107 D 8.99 5.27 0.00 2.84 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 0.00 108 K 8.59 4.27 0.00 1.77 1.89 0.00 1.47 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.26 1.23 7.81 109 H 8.51 4.77 0.00 3.29 3.29 0.00 5.70 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 G 8.57 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 Q 8.03 4.27 0.00 2.17 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 112 T 8.46 5.07 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 1.20 0.00 0.00 113 T 8.96 4.70 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 1.09 0.00 0.00 114 E 8.88 5.12 0.00 1.91 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 2.21 2.24 0.00 115 L 9.03 5.36 0.00 1.44 1.43 0.29 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 116 T 8.63 5.14 4.20 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 1.17 0.00 0.00 117 G 8.80 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 0.00 0.00 0.00 0.00 118 L 8.43 5.22 0.00 1.71 1.45 1.01 0.94 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 0.00 119 F 9.34 5.51 0.00 3.23 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 0.00 120 V 9.07 5.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.92 0.00 0.00 121 K 8.10 3.85 0.00 0.79 1.01 0.00 1.40 0.00 0.00 1.37 0.00 0.00 2.64 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.84 0.21 7.81 122 L 8.08 4.33 0.00 1.49 1.55 0.90 0.78 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 0.00 123 N 8.53 4.59 0.00 2.60 2.69 0.00 0.00 6.96 7.52 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 0.00 124 V 8.14 4.24 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 0.69 0.00 0.00 0.92 0.00 0.00 125 E 8.41 4.33 0.00 2.23 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 2.38 2.45 0.00 126 D 8.63 4.42 0.00 2.71 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.17 4.07 0.00 2.21 2.23 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 2.37 2.41 0.00 128 D 8.04 4.40 0.00 2.85 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 0.00 129 L 7.97 4.07 0.00 2.04 1.96 1.03 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 130 E 8.51 4.13 0.00 2.18 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 0.00 2.36 2.46 0.00 131 K 8.25 3.99 0.00 2.06 1.88 0.00 1.75 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.61 7.81 132 F 8.28 4.09 0.00 2.97 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 0.00 133 W 8.36 4.12 0.00 3.43 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 K 8.41 4.13 0.00 1.90 1.89 0.00 1.53 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.50 7.81 135 L 7.90 3.90 0.00 1.83 1.73 0.89 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 136 T 7.71 3.72 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 1.15 0.00 0.00 137 E 8.37 4.08 0.00 2.21 2.23 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 2.54 2.35 0.00 138 D 8.06 4.35 0.00 2.87 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 7.68 4.39 0.00 1.66 1.82 0.00 1.82 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.63 1.56 7.81 140 G 8.01 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.53 4.21 2.01 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.61 0.96 0.00 0.00 142 D 8.50 4.58 0.00 2.70 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 K 8.74 4.33 0.00 1.77 1.87 0.00 1.63 0.00 0.00 1.48 0.00 0.00 2.60 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.25 1.45 7.81 144 K 8.19 4.30 0.00 1.91 1.95 0.00 1.51 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.78 7.81 145 N 8.28 5.03 0.00 2.97 2.91 0.00 0.00 6.73 7.34 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 0.00 146 V 7.75 4.58 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 0.97 0.00 0.00 1.25 0.00 0.00 147 V 8.45 4.13 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 0.13 0.00 0.00 0.89 0.00 0.00 148 N 8.36 4.72 0.00 2.83 2.70 0.00 0.00 7.24 7.83 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 0.00 149 F 8.87 4.06 0.00 3.06 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 L 8.01 3.96 0.00 1.75 1.68 0.93 0.99 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 0.00 151 E 8.09 4.13 0.00 1.97 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 2.47 2.35 0.00 152 N 7.56 4.47 0.00 2.75 2.78 0.00 0.00 6.57 7.21 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 0.00 153 E 7.95 3.99 0.00 2.11 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 2.32 2.37 0.00 154 D 7.84 4.57 0.00 2.73 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 0.00 155 H 7.67 4.88 0.00 3.12 3.16 0.00 5.85 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 0.00 156 P 0.00 4.54 0.00 2.02 1.97 0.00 3.76 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.87 0.00 157 H 8.20 4.41 0.00 3.19 3.27 0.00 5.75 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