NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4102 8.2893 120.3486 55.3901 33.1251 174.6375 2 N 4.6983 8.5916 123.9805 51.2632 39.0452 172.9656 3 I 4.5917 8.8081 121.2182 59.5702 41.8676 176.3037 4 I 4.3695 8.3276 123.8922 59.6145 38.5118 175.1634 5 K 4.4436 8.6041 124.8440 54.3928 34.0696 176.2688 6 A 4.5313 8.3973 126.5154 50.8860 20.4497 175.0509 7 N 5.0346 8.1888 116.8530 51.9694 41.4379 175.5950 8 V 3.8951 8.1558 113.8450 62.4766 32.3058 176.8217 9 A 4.2583 8.1420 123.6325 52.1060 18.6730 177.9933 10 A 4.6107 8.2828 122.3937 51.2460 21.6004 174.1125 11 P 4.6855 0.0000 0.0000 64.9432 32.1644 178.8575 12 D 4.6087 8.0757 115.4712 54.3324 40.5140 175.7551 13 A 4.6093 7.6743 124.5724 51.8234 20.2135 178.2897 14 R 4.8231 9.6283 120.8690 55.1239 32.7358 175.7321 15 V 4.9275 8.8259 124.4123 60.0014 34.7496 173.9634 16 A 4.9547 8.4828 128.5606 50.0799 21.5177 175.2146 17 I 4.7794 8.5960 123.7864 59.5583 39.4894 174.6809 18 T 4.7589 8.6197 117.8408 59.9701 70.8098 173.3801 19 I 5.1524 8.3897 126.6460 58.2276 40.4699 174.5035 20 A 5.0129 8.4262 127.9798 51.2639 19.1631 177.9376 21 R 4.4466 9.3600 119.7413 58.5548 30.2299 177.0613 22 F 4.6085 8.1634 121.0453 59.9945 39.6974 174.3822 23 N 4.6550 9.8436 123.6148 54.4570 35.6720 176.0267 24 Q 4.1597 8.4397 120.4013 59.4808 28.0187 178.1087 25 F 3.9650 8.5094 121.4955 61.1817 39.4168 176.4859 26 I 4.1808 8.2620 118.7500 63.8865 37.5504 177.7480 27 N 4.3498 8.3146 116.6542 56.4078 38.2669 176.9410 28 D 4.4653 8.7166 120.6824 57.6417 40.9742 178.8524 29 S 4.0943 7.9560 112.9987 60.9425 62.4439 175.4722 30 L 4.0484 7.7984 123.3508 58.6583 41.6841 178.2068 31 L 3.8539 8.4754 120.5558 57.6294 41.9369 178.6152 32 D 4.4971 8.5366 118.4350 57.3564 40.9440 179.8655 33 G 3.5677 8.1011 105.7965 47.7246 0.0000 175.4095 34 A 3.9342 7.8008 123.3226 54.6879 18.4650 179.3844 35 V 3.4525 7.8600 116.7024 66.2824 31.5423 177.3730 36 D 4.2967 8.1120 117.1730 57.6593 40.9900 177.6984 37 A 3.9397 8.2299 121.0748 55.7025 18.3913 179.0564 38 L 3.8844 8.4558 116.7978 59.0275 41.9242 179.9145 39 T 4.1892 8.2146 110.8206 64.1584 68.6985 176.4210 40 R 3.8722 8.2309 123.4641 58.1692 30.6391 177.8437 41 I 4.0963 7.9754 117.1575 63.4071 37.8913 177.0558 42 G 3.7499 7.9331 106.5807 45.1558 0.0000 174.1097 43 Q 3.7817 8.2222 119.5800 56.4691 27.8883 172.8592 44 V 3.8189 7.4549 116.5676 62.0133 32.2986 175.0429 45 K 4.3535 8.5863 128.9615 56.3252 32.5467 176.5651 46 D 4.7305 8.8054 124.4620 53.9724 39.1289 176.1850 47 D 4.8107 7.9945 117.0335 53.8037 40.1716 176.1198 48 N 4.8236 8.5979 117.5973 53.6677 40.1678 174.2751 49 I 4.9845 7.6807 120.8024 60.1650 38.5237 175.1785 50 T 4.7100 8.7664 117.2585 59.7029 71.9216 172.9834 51 V 4.6160 8.4293 123.8006 61.0604 34.0293 174.5132 52 V 4.3276 8.9717 128.7986 60.8350 33.6991 174.4116 53 W 4.8894 9.0062 128.9812 56.4575 29.6447 176.4965 54 V 4.4033 8.6815 118.9750 59.0349 33.8683 174.7395 55 P 4.3304 0.0000 0.0000 65.0999 31.3858 176.9053 56 G 4.4757 7.9740 108.5435 42.7995 0.0000 174.0815 57 A 4.1024 8.4793 120.6798 54.7567 18.1126 179.2977 58 Y 4.2091 8.1576 117.0682 60.5636 39.2446 177.2902 59 E 4.1306 8.2528 118.9385 57.9774 29.6546 178.5724 60 L 3.8799 7.5654 119.7069 58.1548 41.6050 177.0172 61 P 4.1859 0.0000 0.0000 64.7396 31.1321 178.0967 62 L 3.8907 7.6306 117.9890 58.4041 42.4484 179.3081 63 A 3.9858 7.7987 120.1175 55.6307 18.3776 179.8351 64 T 3.8457 8.1750 108.3858 64.5308 68.7475 176.0996 65 E 3.8439 8.9607 123.0140 59.2187 29.5499 178.2962 66 A 3.9999 8.0201 120.4467 55.6681 18.2136 179.5509 67 L 4.0696 7.6054 114.8419 57.9613 41.9508 179.4982 68 A 4.2422 8.1602 120.6402 55.0400 18.2587 179.7664 69 K 3.9169 8.2216 116.3630 59.6617 32.1645 178.8948 70 S 4.1957 8.1469 112.9360 59.5557 62.1779 175.9258 71 G 3.9462 8.4276 110.3811 46.2906 0.0000 176.0281 72 K 3.8808 7.7436 120.5146 56.3005 31.8657 182.1571 73 Y 5.1080 6.9718 113.8539 56.8633 40.7407 175.4617 74 D 4.7240 9.2761 122.1405 56.1647 41.8414 176.4067 75 A 4.5658 7.4193 117.3152 51.1729 22.5625 175.0931 76 V 4.7600 8.3507 119.9013 61.0374 34.6551 174.4624 77 V 4.4367 8.7143 128.1038 61.3994 33.5351 174.0881 78 A 4.9749 8.5609 129.9085 49.5495 21.0674 175.0992 79 L 5.4079 7.9815 123.1070 52.4862 44.6217 176.3037 80 G 4.2042 7.7135 108.2089 46.2332 0.0000 171.9263 81 T 5.0432 8.1596 116.4407 61.5026 72.0034 174.3931 82 V 4.2208 8.9832 125.3231 61.3293 34.0862 173.8812 83 I 4.6459 8.1853 128.6857 59.5870 38.6564 176.0045 84 R 3.6614 8.4524 127.7354 56.5825 30.2909 176.3245 85 G 4.4509 8.3391 115.9693 44.2952 0.0000 172.8732 86 G 3.6418 8.7986 107.6665 47.4871 0.0000 173.3344 87 T 4.5286 7.6038 108.3157 59.7143 71.6048 173.4814 88 A 4.4874 8.3685 121.3229 52.7341 18.8849 178.6840 89 H 4.3033 8.3039 120.3267 60.2930 29.6658 176.9205 90 F 4.0467 8.4889 121.9795 61.5013 39.0138 176.6007 91 E 3.5843 7.9528 118.2220 59.5557 29.3489 178.4308 92 Y 4.3017 7.4190 115.9273 60.7783 38.1953 177.5645 93 V 3.6535 7.6516 119.0869 65.8953 31.6309 177.8253 94 A 4.0805 7.7720 120.3204 55.1696 18.0786 179.6628 95 G 3.6122 8.1531 104.6902 47.7724 0.0000 176.0690 96 G 3.8707 8.6767 108.3522 45.8375 0.0000 174.8432 97 A 4.2528 7.8853 122.8434 54.4285 19.6188 179.1629 98 S 4.1676 8.1838 111.6902 61.8710 62.3549 176.2578 99 N 4.4490 8.5019 119.3624 55.9861 38.3304 177.3462 100 G 3.7363 7.7160 106.1682 48.0672 0.0000 175.4009 101 L 3.9897 8.0950 121.5450 57.2470 41.8391 179.5872 102 A 3.9774 8.0378 120.4674 55.1635 18.2531 179.4622 103 S 3.9434 8.3438 111.7751 61.5404 62.4263 176.1786 104 V 3.5446 7.7819 120.6333 66.2265 31.1064 177.7251 105 A 4.3391 7.8192 121.1630 54.8085 18.0257 179.3800 106 Q 3.8878 7.6871 116.4443 59.3109 29.1381 177.9207 107 D 4.5214 8.0659 119.3148 57.1080 41.2182 178.5541 108 S 4.3358 8.3650 113.1687 58.7959 63.4051 175.5251 109 G 3.8801 8.0882 109.4368 45.7296 0.0000 173.6787 110 V 3.9992 7.5234 120.8947 61.5574 33.0651 173.5790 111 P 4.5389 0.0000 0.0000 62.5933 32.5040 175.1656 112 V 4.8454 8.4065 123.5635 61.0244 34.0670 174.2166 113 A 4.4813 8.9593 130.3227 50.8967 20.5706 176.2328 114 F 4.8475 8.9903 126.5904 56.1476 38.3254 175.9383 115 G 3.9344 8.0667 118.0605 44.8776 0.0000 171.0304 116 V 4.4971 6.1258 117.4578 60.5627 33.8617 176.0944 117 L 4.2396 8.6836 129.4203 55.1673 42.7396 176.6921 118 T 5.0082 8.5100 112.9029 59.8496 68.8566 172.5596 119 T 4.6078 8.6454 121.4593 61.0014 71.9964 175.1887 120 E 4.1192 9.9026 120.9520 57.2465 30.5296 177.2453 121 S 4.7202 7.6054 111.9740 55.5549 67.6656 174.7682 122 I 3.6856 8.2298 123.1177 64.3264 36.5828 178.0073 123 E 3.9274 8.1689 118.9556 59.7484 29.5550 178.6368 124 Q 4.2841 8.1153 117.5093 58.8078 28.8088 178.5876 125 A 4.0113 7.8459 121.6684 55.3713 18.1629 179.7306 126 I 3.7589 7.9214 118.2072 64.6376 37.1120 178.5463 127 E 4.5526 8.0101 120.6029 58.0981 29.2839 178.4320 128 R 4.5361 7.8948 115.4959 55.6591 30.5043 176.6625 129 A 4.7952 7.2052 121.5429 52.6958 19.4828 177.2444 130 G 4.4580 8.1560 108.0430 48.0710 0.0000 175.3613 131 T 4.6001 7.5325 115.1486 60.0105 68.8545 175.7544 132 K 3.7780 9.2115 117.0730 59.3177 31.7962 177.8622 133 A 4.5862 7.7642 119.3642 52.0346 20.0288 178.9102 134 G 3.7352 8.2503 110.4830 47.4306 0.0000 174.0866 135 N 5.2152 8.2429 117.8370 50.8878 40.9381 175.4210 136 K 3.9553 8.9297 128.9116 59.2275 32.0682 178.9780 137 G 4.0649 8.2645 107.6398 47.3234 0.0000 175.5625 138 A 4.0406 7.8814 123.3005 54.3519 18.4270 179.2372 139 E 3.8497 8.5269 117.9759 59.3569 29.7336 178.9154 140 A 4.0363 8.5829 122.4316 54.3973 18.4747 179.3435 141 A 3.8867 8.2293 119.5759 55.3542 18.3918 179.8925 142 L 3.9263 8.0340 117.6113 58.2202 41.8886 179.9703 143 T 3.8604 8.1662 109.2148 64.3114 68.5073 176.3067 144 A 4.0424 7.8731 124.2036 55.1395 18.4712 179.1078 145 L 3.8857 7.8062 116.9066 58.1482 41.7760 179.2383 146 E 4.1856 8.3299 120.2726 59.0836 29.4255 178.9886 147 M 4.0428 7.9258 117.7799 58.4043 31.9357 178.3716 148 I 3.6880 7.8106 119.9343 64.8842 37.3015 178.0928 149 N 4.3124 7.9934 116.2600 56.2983 38.1793 177.5005 150 V 3.5780 7.9160 118.8982 66.2349 31.7350 177.8505 151 L 4.0763 8.4237 118.8802 57.6753 41.3685 179.2055 152 K 3.8664 8.2020 118.9648 59.5444 32.1322 177.0266 153 A 4.4727 8.0251 120.0456 51.7684 19.3558 177.2488 154 I 3.8862 7.8506 120.9545 63.1898 37.7305 173.9749 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.29 4.41 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 2 N 8.59 4.70 0.00 2.94 2.79 0.00 0.00 6.06 6.93 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 3 I 8.81 4.59 1.87 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 1.41 0.67 0.91 0.00 0.00 4 I 8.33 4.37 1.87 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 1.41 0.61 0.91 0.00 0.00 5 K 8.60 4.44 0.00 1.70 1.70 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.39 7.81 6 A 8.40 4.53 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 7 N 8.19 5.03 0.00 2.73 2.65 0.00 0.00 6.86 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 8 V 8.16 3.90 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 0.75 0.00 0.00 0.93 0.00 0.00 9 A 8.14 4.26 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.28 4.61 1.25 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 11 P 0.00 4.69 0.00 2.23 2.38 0.00 3.86 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.94 0.00 12 D 8.08 4.61 0.00 2.69 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 13 A 7.67 4.61 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 14 R 9.63 4.82 0.00 1.43 1.78 0.00 3.21 0.00 0.00 3.09 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.40 0.00 15 V 8.83 4.93 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 0.87 0.00 0.00 0.95 0.00 0.00 16 A 8.48 4.95 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 8.60 4.78 1.68 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.86 0.69 0.00 0.00 18 T 8.62 4.76 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 1.09 0.00 0.00 19 I 8.39 5.15 0.69 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.30 0.43 0.00 0.00 20 A 8.43 5.01 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 21 R 9.36 4.45 0.00 2.09 2.52 0.00 2.87 0.00 0.00 3.11 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.64 0.00 22 F 8.16 4.61 0.00 3.16 2.99 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 23 N 9.84 4.66 0.00 2.96 2.98 0.00 0.00 6.88 8.09 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 24 Q 8.44 4.16 0.00 2.52 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.70 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 25 F 8.51 3.96 0.00 3.13 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 26 I 8.26 4.18 2.11 0.00 0.00 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 1.67 0.77 0.95 0.00 0.00 27 N 8.31 4.35 0.00 2.87 2.92 0.00 0.00 7.07 8.08 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 28 D 8.72 4.47 0.00 2.65 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 29 S 7.96 4.09 0.00 3.81 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 30 L 7.80 4.05 0.00 1.92 1.63 0.96 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.48 3.85 0.00 1.77 1.77 0.77 1.02 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 32 D 8.54 4.50 0.00 2.86 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 33 G 8.10 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.80 3.93 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 35 V 7.86 3.45 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 0.98 0.00 0.00 0.95 0.00 0.00 36 D 8.11 4.30 0.00 2.85 2.88 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 37 A 8.23 3.94 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 38 L 8.46 3.88 0.00 1.84 1.74 0.89 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.21 4.19 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 1.26 0.00 0.00 40 R 8.23 3.87 0.00 1.79 2.23 0.00 3.24 0.00 0.00 3.45 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 41 I 7.98 4.10 2.08 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 1.23 0.97 0.91 0.00 0.00 42 G 7.93 3.75 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 0.00 0.00 0.00 43 Q 8.22 3.78 0.00 2.35 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.95 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 44 V 7.45 3.82 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 0.91 0.00 0.00 1.03 0.00 0.00 45 K 8.59 4.35 0.00 1.80 1.68 0.00 1.92 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.37 7.81 46 D 8.81 4.73 0.00 2.83 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 7.99 4.81 0.00 2.78 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 48 N 8.60 4.82 0.00 2.76 2.99 0.00 0.00 6.91 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 49 I 7.68 4.98 1.88 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 1.40 0.53 0.89 0.00 0.00 50 T 8.77 4.71 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 1.49 0.00 0.00 51 V 8.43 4.62 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 0.52 0.00 0.00 0.84 0.00 0.00 52 V 8.97 4.33 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.87 0.00 0.00 53 W 9.01 4.89 0.00 3.21 3.21 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 54 V 8.68 4.40 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 0.75 0.00 0.00 1.04 0.00 0.00 55 P 0.00 4.33 0.00 2.19 2.31 0.00 3.75 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.04 0.00 56 G 7.97 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 57 A 8.48 4.10 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 58 Y 8.16 4.21 0.00 2.92 3.09 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 59 E 8.25 4.13 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.57 0.00 60 L 7.57 3.88 0.00 1.70 1.70 0.87 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.19 0.00 2.03 1.85 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.10 0.00 62 L 7.63 3.89 0.00 1.63 1.65 0.91 0.90 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 63 A 7.80 3.99 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 64 T 8.17 3.85 4.19 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 1.19 0.00 0.00 65 E 8.96 3.84 0.00 1.99 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 0.00 2.31 2.34 0.00 66 A 8.02 4.00 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 67 L 7.61 4.07 0.00 1.77 1.68 0.64 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.16 4.24 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 69 K 8.22 3.92 0.00 1.87 1.90 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.64 1.60 7.81 70 S 8.15 4.20 0.00 3.90 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.43 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 0.00 0.00 0.00 72 K 7.74 3.88 0.00 1.81 1.75 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.39 1.28 7.81 73 Y 6.97 5.11 0.00 3.00 2.94 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 74 D 9.28 4.72 0.00 2.55 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 75 A 7.42 4.57 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.35 4.76 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.85 0.00 0.00 77 V 8.71 4.44 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.88 0.00 0.00 78 A 8.56 4.97 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 79 L 7.98 5.41 0.00 1.38 1.39 0.80 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 80 G 7.71 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 0.00 0.00 0.00 0.00 81 T 8.16 5.04 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 82 V 8.98 4.22 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 0.93 0.00 0.00 0.87 0.00 0.00 83 I 8.19 4.65 1.85 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 1.24 0.69 0.88 0.00 0.00 84 R 8.45 3.66 0.00 0.67 1.38 0.00 3.06 0.00 0.00 2.97 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.18 0.00 85 G 8.34 4.45 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 0.00 86 G 8.80 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.60 4.53 4.31 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 1.24 0.00 0.00 88 A 8.37 4.49 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 89 H 8.30 4.30 0.00 3.25 3.42 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 F 8.49 4.05 0.00 3.12 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 E 7.95 3.58 0.00 1.96 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.18 0.00 92 Y 7.42 4.30 0.00 2.98 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 93 V 7.65 3.65 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 1.04 0.00 0.00 0.75 0.00 0.00 94 A 7.77 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 G 8.15 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 96 G 8.68 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 97 A 7.89 4.25 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 98 S 8.18 4.17 0.00 3.74 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 99 N 8.50 4.45 0.00 2.80 2.83 0.00 0.00 6.95 8.10 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 0.00 100 G 7.72 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 0.00 0.00 0.00 101 L 8.09 3.99 0.00 2.04 1.82 1.03 0.82 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 0.00 102 A 8.04 3.98 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 0.00 103 S 8.34 3.94 0.00 3.95 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.78 3.54 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.95 0.00 0.00 105 A 7.82 4.34 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 0.00 106 Q 7.69 3.89 0.00 2.08 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 107 D 8.07 4.52 0.00 2.69 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 0.00 108 S 8.37 4.34 0.00 4.02 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 G 8.09 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 0.00 110 V 7.52 4.00 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 1.00 0.00 0.00 1.01 0.00 0.00 111 P 0.00 4.54 0.00 2.12 1.96 0.00 3.79 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 112 V 8.41 4.85 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 0.86 0.00 0.00 0.96 0.00 0.00 113 A 8.96 4.48 1.26 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 0.00 114 F 8.99 4.85 0.00 3.00 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 0.00 115 G 8.07 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 0.00 116 V 6.13 4.50 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.04 0.00 0.00 117 L 8.68 4.24 0.00 1.62 1.58 0.92 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 118 T 8.51 5.01 4.46 0.00 0.00 0.00 0.00 0.00 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 0.00 119 T 8.65 4.61 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 1.24 0.00 0.00 120 E 9.90 4.12 0.00 1.95 1.92 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 2.30 2.30 0.00 121 S 7.61 4.72 0.00 3.95 3.85 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 0.00 122 I 8.23 3.69 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 1.47 0.74 0.86 0.00 0.00 123 E 8.17 3.93 0.00 1.93 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.48 0.00 124 Q 8.12 4.28 0.00 2.30 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 125 A 7.85 4.01 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 0.00 126 I 7.92 3.76 2.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.03 0.99 0.00 0.00 127 E 8.01 4.55 0.00 2.20 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 2.34 2.40 0.00 128 R 7.89 4.54 0.00 1.88 1.94 0.00 3.12 0.00 0.00 3.19 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 129 A 7.21 4.80 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 0.00 130 G 8.16 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.53 4.60 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 1.28 0.00 0.00 132 K 9.21 3.78 0.00 1.77 1.96 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.49 7.81 133 A 7.76 4.59 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 0.00 134 G 8.25 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 0.00 0.00 0.00 135 N 8.24 5.22 0.00 2.69 2.65 0.00 0.00 6.93 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 0.00 136 K 8.93 3.96 0.00 1.82 1.83 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.48 7.81 137 G 8.26 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 0.00 0.00 0.00 138 A 7.88 4.04 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 0.00 139 E 8.53 3.85 0.00 2.03 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 0.00 2.31 2.33 0.00 140 A 8.58 4.04 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 0.00 141 A 8.23 3.89 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 0.00 142 L 8.03 3.93 0.00 1.98 1.72 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 143 T 8.17 3.86 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 1.29 0.00 0.00 144 A 7.87 4.04 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 0.00 145 L 7.81 3.89 0.00 1.86 1.88 0.98 0.82 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 0.00 146 E 8.33 4.19 0.00 2.02 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 2.32 2.24 0.00 147 M 7.93 4.04 0.00 2.09 2.35 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.89 0.00 148 I 7.81 3.69 2.04 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 1.67 0.93 0.92 0.00 0.00 149 N 7.99 4.31 0.00 2.95 2.86 0.00 0.00 6.74 8.53 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 0.00 150 V 7.92 3.58 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.98 0.00 0.00 151 L 8.42 4.08 0.00 1.95 1.69 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 152 K 8.20 3.87 0.00 1.82 2.10 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.51 7.81 153 A 8.03 4.47 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 0.00 154 I 7.85 3.89 1.87 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 1.16 0.73 0.91 0.00 0.00