NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.8572 8.0549 120.4040 62.4094 32.5985 174.5869 2 E 4.0888 8.1678 122.8018 54.7272 29.5461 174.8504 3 W 5.0902 8.4054 124.0319 54.7932 33.2625 175.8817 4 T 4.5239 9.5824 113.5214 60.8465 71.1596 175.9464 5 D 4.3953 8.5793 121.0184 57.4356 40.8381 178.9210 6 A 4.0657 7.9988 120.9777 55.0621 18.4169 179.3718 7 E 4.0118 8.2680 117.1131 59.5269 29.6182 179.6624 8 K 3.7123 8.0913 118.4882 59.5843 32.0283 179.5867 9 S 4.1447 8.4682 115.7710 61.7359 62.6203 176.9278 10 T 3.8957 7.9386 118.3878 66.8064 68.1997 176.7778 11 I 3.7459 7.7874 121.9399 64.3372 37.0030 178.7378 12 S 4.1575 8.1712 114.9625 61.3273 62.6785 176.2817 13 A 4.0605 8.1862 123.9609 54.8713 18.3515 179.5774 14 V 3.9652 8.2427 116.8310 66.1525 31.8861 178.2195 15 W 4.4308 8.7861 128.2623 60.2434 30.2509 178.1156 16 G 3.6693 8.5358 105.8360 47.3060 0.0000 174.9841 17 K 4.1834 7.6604 117.3810 55.5001 32.6237 177.0153 18 V 3.8000 6.9609 120.4009 62.2055 32.2430 175.5500 19 N 4.5518 8.4387 125.5556 52.0737 39.2421 174.9262 20 I 3.6583 8.0819 129.8929 64.8539 37.0684 177.8861 21 D 4.3760 8.0550 117.9648 56.5192 40.5779 177.7016 22 E 4.2996 7.7604 118.8035 58.4721 30.4149 177.9684 23 I 3.8401 8.2796 120.2750 64.1369 37.0845 178.4133 24 G 3.5910 8.2398 106.8683 47.0699 0.0000 173.5864 25 P 4.2238 0.0000 0.0000 65.1124 31.4620 178.6050 26 L 3.9306 7.6187 116.8636 57.7055 41.6044 179.5604 27 A 3.9560 8.0990 120.6126 55.1114 18.3929 179.4601 28 L 3.8585 8.4964 118.9855 58.3223 42.0692 179.0868 29 A 3.9881 8.2063 120.8640 55.0052 18.1963 179.6154 30 R 3.8537 8.2018 117.4572 59.2292 30.1118 178.9525 31 V 3.6976 7.7590 118.2138 66.0923 31.7209 178.1242 32 L 4.0842 7.6795 119.4140 56.8030 41.1061 179.5051 33 I 3.7891 7.1982 118.9371 63.9988 37.5115 178.1558 34 V 3.4962 7.6737 117.7976 64.2916 32.8063 175.6655 35 Y 3.5582 7.2481 115.8720 54.1047 37.9005 174.1956 36 P 4.8269 0.0000 0.0000 64.4679 31.8644 178.4094 37 W 4.3953 7.9549 116.4540 59.1229 28.3703 177.4986 38 T 4.2778 7.6561 110.1552 63.4311 68.1936 176.0488 39 Q 4.4486 8.2076 121.9356 58.3886 28.5204 178.0302 40 R 3.8036 7.5095 116.1518 58.5556 29.3704 177.4621 41 Y 4.2466 6.7382 114.5358 58.0919 38.4802 175.6672 42 F 4.3347 7.7650 120.1257 56.6578 39.9001 178.5658 43 G 3.6263 8.1482 111.7109 48.8070 0.0000 176.6575 44 S 4.3685 8.0090 112.6609 59.9558 63.2183 174.7240 45 F 4.5334 8.2263 119.3599 58.1910 39.7474 176.8620 46 G 3.9192 7.8257 107.4470 45.0348 0.0000 174.9124 47 N 4.6341 8.6511 124.9588 53.3551 38.3071 175.4999 48 V 4.5597 8.0384 122.2829 61.2355 32.8547 178.3324 49 S 4.2585 9.0813 118.0314 61.3512 62.7848 175.5313 50 T 4.6807 7.4307 109.1377 58.6814 72.3696 172.9626 51 P 4.2573 0.0000 0.0000 65.8148 31.1414 178.5131 52 A 4.2037 8.0261 117.0864 55.3007 18.4235 179.1205 53 A 4.0833 8.0512 118.8963 55.3172 18.6330 179.8306 54 I 3.6415 8.7716 119.0435 64.9593 37.0753 178.6587 55 M 4.1733 9.0609 118.3337 57.2315 31.8681 177.3435 56 G 3.9206 7.5862 105.6554 45.0005 0.0000 173.5057 57 N 4.4972 7.9137 120.0630 52.3973 39.7070 173.5476 58 P 4.2378 0.0000 0.0000 66.0676 31.3519 178.6455 59 K 3.8332 7.9876 117.6968 58.6641 31.8975 179.4087 60 V 3.6693 7.9203 118.3543 65.9119 31.5558 177.7753 61 A 3.9145 7.8495 120.0604 55.1716 18.2681 179.2228 62 A 3.9224 8.2967 119.5246 55.8510 18.4794 179.3968 63 H 4.3607 8.6999 117.0978 59.2439 29.9268 177.5681 64 G 3.6803 8.6497 108.0291 47.8449 0.0000 175.7682 65 K 4.0259 8.1591 120.9551 58.9897 32.0205 179.6046 66 V 3.5764 7.6847 118.4447 66.0525 31.3119 178.1662 67 V 3.5466 7.8735 116.8256 66.3332 31.6124 177.2956 68 C 4.4898 8.3502 118.4523 62.2407 31.3202 175.7102 69 G 3.7635 8.6326 107.9087 47.7261 0.0000 175.4613 70 A 4.1875 8.1932 122.8605 54.6953 18.3097 179.6042 71 L 4.6375 8.0179 118.7474 57.0455 41.6036 178.5788 72 D 3.3700 8.4365 118.5971 57.3175 40.7916 178.8713 73 K 3.8626 7.5434 115.9530 59.0365 32.2586 178.9476 74 A 3.8683 7.7742 120.6202 55.1804 18.2249 179.4390 75 V 3.1532 7.8021 115.5337 65.9459 31.5122 177.6595 76 K 4.1531 7.7611 115.1773 56.6666 32.9427 176.5565 77 N 5.0196 7.8081 117.7232 52.3522 39.2778 176.1452 78 M 3.9474 8.1622 118.6827 57.9727 32.5493 178.7688 79 G 3.8643 8.1505 107.3898 47.6982 0.0000 173.7438 80 N 5.0453 8.0366 116.9945 50.3741 37.2426 174.8673 81 I 3.5893 7.7633 125.8420 64.8309 37.5627 177.3368 82 L 3.9748 8.0429 118.3438 58.2930 41.2981 179.2321 83 A 4.1452 7.9178 119.6226 55.4114 18.1877 179.6251 84 T 3.8403 7.6761 113.1794 65.8045 68.7557 174.9384 85 Y 4.8955 7.4976 116.2994 57.5290 38.8434 177.0637 86 K 3.8205 7.8211 122.0182 60.0265 32.1796 178.3782 87 S 4.2813 8.1021 112.3071 61.6480 62.3425 176.0990 88 L 4.0357 7.9641 120.9975 57.8387 41.3495 179.2974 89 S 4.1620 8.5510 113.5821 61.4424 62.2949 176.1296 90 E 3.8670 8.3670 121.6323 59.3794 29.1699 179.3839 91 T 3.9010 7.8701 109.8736 64.9187 68.8894 176.6191 92 H 4.1003 8.2002 118.9130 58.4461 28.4863 177.6063 93 A 3.1758 7.5943 121.7545 54.1367 18.3192 178.5591 94 N 4.3443 7.9761 112.7403 53.4015 39.6744 176.5710 95 K 4.1421 7.2446 117.8210 56.8393 34.2431 177.3144 96 L 4.2783 7.8474 117.2733 53.5194 42.7628 176.3564 97 F 3.8359 7.2214 115.9294 58.2078 36.4954 175.6483 98 V 3.4819 7.6579 119.5435 61.8167 32.2720 174.9677 99 D 4.3729 8.9600 127.7812 53.6393 41.6198 175.3198 100 P 3.3406 0.0000 0.0000 65.0806 31.3532 177.8974 101 D 4.2978 8.2360 118.0422 56.8678 41.1489 177.6242 102 N 4.2723 7.7861 117.2764 56.2710 38.4532 177.1855 103 F 4.4634 7.3282 119.2568 60.2108 38.8803 177.7720 104 R 3.8662 7.7702 118.3171 59.5922 29.8914 179.0639 105 V 3.5272 7.5545 111.5445 63.7785 31.4255 178.2267 106 L 3.9281 7.8412 120.1095 58.0059 41.9490 178.7169 107 A 4.0864 7.9670 120.6578 55.3358 18.3153 179.3932 108 D 4.3652 8.1132 117.2979 57.5931 40.9370 179.2378 109 V 3.6552 8.0863 118.9444 65.7278 31.5195 177.6562 110 L 3.9507 8.4150 120.5785 58.6508 41.8835 178.9926 111 T 3.7868 8.0822 115.5039 66.9007 68.4175 176.6009 112 I 3.6572 7.7817 121.5357 64.2375 36.9950 178.7586 113 V 3.4878 7.8632 119.1686 65.8197 31.3404 178.0797 114 I 3.0194 7.7514 119.7140 64.0748 36.7438 178.0396 115 A 3.5605 7.3704 121.2743 55.1362 17.9242 179.4926 116 A 3.9242 7.5429 117.8477 55.2989 18.5100 179.6509 117 K 4.1468 7.9358 116.0531 59.0023 32.0695 179.0100 118 F 4.5387 9.0988 118.0270 58.9008 39.4941 177.0339 119 G 4.1415 8.9948 108.1149 45.6606 0.0000 174.9559 120 A 3.8120 8.9328 122.7716 55.1348 18.4252 179.0150 121 S 4.3188 7.6800 108.2628 60.3492 63.3764 175.1526 122 F 4.7025 8.6415 125.9079 57.1543 37.5941 175.4516 123 T 4.1656 7.5898 115.9380 60.1762 71.1207 173.3699 124 P 4.2056 0.0000 0.0000 66.0110 31.3776 178.8687 125 E 3.9683 8.0167 116.8172 59.3111 29.4727 179.2951 126 I 3.7389 7.7088 120.0297 64.2932 37.0973 178.1841 127 Q 3.6964 8.1776 120.4989 58.9275 28.8869 178.2253 128 A 4.0471 8.2950 122.1642 55.5289 18.4310 179.8063 129 T 4.0809 7.8716 113.8330 66.4321 68.5746 176.9211 130 W 4.3208 8.9956 130.7927 60.6177 30.7533 177.7981 131 Q 4.2095 8.7472 119.7959 58.6358 28.5068 177.9680 132 K 4.0218 8.1945 120.8155 59.2742 32.1895 178.6150 133 F 4.5116 8.4592 120.9550 61.6811 39.3117 176.7751 134 M 3.4590 8.0465 118.6471 58.4028 31.7820 178.8777 135 K 3.8867 8.0109 118.2859 59.4682 32.1662 179.6251 136 V 3.5688 7.6807 118.0024 65.8120 31.4233 178.2182 137 V 3.4296 7.6519 118.2457 65.9327 31.3102 178.0389 138 V 3.4220 8.1806 117.9450 66.0276 31.1251 177.7943 139 A 3.9677 7.6741 118.8122 55.0669 18.3675 179.1725 140 A 4.1023 8.4335 119.6959 55.6804 18.2867 179.8659 141 M 3.8704 8.1210 116.5185 57.4313 31.9726 178.1948 142 G 4.1473 7.7635 104.4864 44.5173 0.0000 175.4792 143 S 4.2226 7.9309 116.4381 60.0934 63.4038 175.2263 144 R 4.5873 8.1202 119.5792 56.0349 30.0815 175.6234 145 Y 3.9832 7.1227 116.7904 57.1371 37.4881 175.9085 146 F 4.4749 8.2730 122.8745 57.5282 39.7549 175.3661 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 V 8.05 3.86 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 -0.12 0.00 0.00 0.80 0.00 0.00 2 E 8.17 4.09 0.00 1.94 1.81 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 2.23 2.29 0.00 3 W 8.41 5.09 0.00 3.23 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 T 9.58 4.52 4.30 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 1.30 0.00 0.00 5 D 8.58 4.40 0.00 2.81 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 6 A 8.00 4.07 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 7 E 8.27 4.01 0.00 2.59 2.36 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 2.53 2.49 0.00 8 K 8.09 3.71 0.00 1.95 1.74 0.00 1.54 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.30 1.76 7.81 9 S 8.47 4.14 0.00 3.99 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 10 T 7.94 3.90 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 1.29 0.00 0.00 11 I 7.79 3.75 1.41 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 1.36 -0.07 -0.02 0.00 0.00 12 S 8.17 4.16 0.00 4.08 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 13 A 8.19 4.06 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 14 V 8.24 3.97 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 0.85 0.00 0.00 1.22 0.00 0.00 15 W 8.79 4.43 0.00 3.64 3.29 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 16 G 8.54 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 17 K 7.66 4.18 0.00 1.52 1.33 0.00 1.55 0.00 0.00 1.61 0.00 0.00 2.57 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.42 7.81 18 V 6.96 3.80 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 0.59 0.00 0.00 1.01 0.00 0.00 19 N 8.44 4.55 0.00 2.80 2.66 0.00 0.00 7.19 8.28 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 20 I 8.08 3.66 1.77 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.67 0.91 0.00 0.00 21 D 8.06 4.38 0.00 2.82 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 22 E 7.76 4.30 0.00 1.99 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 0.00 2.28 2.35 0.00 23 I 8.28 3.84 1.91 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.52 0.85 0.00 0.00 24 G 8.24 3.59 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 0.00 0.00 0.00 25 P 0.00 4.22 0.00 2.15 2.13 0.00 3.56 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.20 0.00 26 L 7.62 3.93 0.00 1.78 1.69 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.10 3.96 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 28 L 8.50 3.86 0.00 1.70 1.64 0.87 1.22 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 29 A 8.21 3.99 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 30 R 8.20 3.85 0.00 2.07 2.06 0.00 3.09 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 31 V 7.76 3.70 2.28 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 1.01 0.00 0.00 1.01 0.00 0.00 32 L 7.68 4.08 0.00 1.83 1.67 0.67 0.94 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 33 I 7.20 3.79 1.80 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 1.37 0.57 0.84 0.00 0.00 34 V 7.67 3.50 1.76 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 0.06 0.00 0.00 0.86 0.00 0.00 35 Y 7.25 3.56 0.00 2.73 1.68 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 36 P 0.00 4.83 0.00 2.31 2.28 0.00 3.54 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.87 0.00 37 W 7.95 4.40 0.00 3.57 3.48 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 38 T 7.66 4.28 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 1.07 0.00 0.00 39 Q 8.21 4.45 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.84 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 40 R 7.51 3.80 0.00 1.81 2.02 0.00 2.87 0.00 0.00 3.00 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.93 0.00 41 Y 6.74 4.25 0.00 1.77 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.77 4.33 0.00 3.11 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.15 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.01 4.37 0.00 4.17 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 0.00 45 F 8.23 4.53 0.00 3.24 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 46 G 7.83 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 47 N 8.65 4.63 0.00 2.71 2.81 0.00 0.00 6.61 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 48 V 8.04 4.56 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 0.94 0.00 0.00 1.07 0.00 0.00 49 S 9.08 4.26 0.00 3.88 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 50 T 7.43 4.68 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 1.22 0.00 0.00 51 P 0.00 4.26 0.00 2.16 2.13 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 52 A 8.03 4.20 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 53 A 8.05 4.08 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 54 I 8.77 3.64 2.04 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 1.52 1.08 0.92 0.00 0.00 55 M 9.06 4.17 0.00 1.84 2.22 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 2.62 2.61 0.00 56 G 7.59 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 57 N 7.91 4.50 0.00 3.01 2.88 0.00 0.00 6.89 6.99 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 58 P 0.00 4.24 0.00 2.24 2.26 0.00 3.73 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 59 K 7.99 3.83 0.00 1.63 0.74 0.00 1.56 0.00 0.00 1.76 0.00 0.00 2.55 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.23 1.31 7.81 60 V 7.92 3.67 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 0.81 0.00 0.00 1.09 0.00 0.00 61 A 7.85 3.91 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 62 A 8.30 3.92 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 63 H 8.70 4.36 0.00 3.59 3.61 0.00 5.80 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 64 G 8.65 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 0.00 0.00 0.00 65 K 8.16 4.03 0.00 2.06 1.89 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.44 7.81 66 V 7.68 3.58 2.25 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 1.06 0.00 0.00 1.00 0.00 0.00 67 V 7.87 3.55 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 0.86 0.00 0.00 0.87 0.00 0.00 68 C 8.35 4.49 0.00 3.18 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 69 G 8.63 3.76 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 0.00 0.00 0.00 70 A 8.19 4.19 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 L 8.02 4.64 0.00 2.24 1.97 0.87 1.64 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 72 D 8.44 3.37 0.00 3.39 2.83 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 73 K 7.54 3.86 0.00 1.51 1.69 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.18 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.48 1.72 7.81 74 A 7.77 3.87 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 75 V 7.80 3.15 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 0.40 0.00 0.00 0.29 0.00 0.00 76 K 7.76 4.15 0.00 1.65 1.71 0.00 1.90 0.00 0.00 1.64 0.00 0.00 3.15 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.20 7.81 77 N 7.81 5.02 0.00 2.65 2.63 0.00 0.00 6.89 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 M 8.16 3.95 0.00 1.26 1.83 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.06 0.00 79 G 8.15 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 0.00 0.00 0.00 80 N 8.04 5.05 0.00 2.83 2.92 0.00 0.00 7.03 7.03 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 81 I 7.76 3.59 1.93 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.24 0.93 0.00 0.00 82 L 8.04 3.97 0.00 1.63 1.78 0.96 0.80 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 83 A 7.92 4.15 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 84 T 7.68 3.84 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 0.77 0.00 0.00 85 Y 7.50 4.90 0.00 2.94 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 86 K 7.82 3.82 0.00 1.97 1.85 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.49 1.51 7.81 87 S 8.10 4.28 0.00 3.94 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 88 L 7.96 4.04 0.00 1.89 1.60 0.80 0.83 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 89 S 8.55 4.16 0.00 4.02 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 90 E 8.37 3.87 0.00 2.17 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 0.00 2.35 2.47 0.00 91 T 7.87 3.90 4.16 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 1.23 0.00 0.00 92 H 8.20 4.10 0.00 3.55 3.71 0.00 5.81 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 93 A 7.59 3.18 0.21 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 94 N 7.98 4.34 0.00 2.60 2.76 0.00 0.00 6.91 7.32 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 95 K 7.24 4.14 0.00 1.63 1.70 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.21 1.34 7.81 96 L 7.85 4.28 0.00 1.35 1.53 0.61 0.80 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 97 F 7.22 3.84 0.00 3.32 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 98 V 7.66 3.48 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 0.13 0.00 0.00 0.27 0.00 0.00 99 D 8.96 4.37 0.00 2.81 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 0.00 100 P 0.00 3.34 0.00 1.96 1.37 0.00 3.45 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.01 0.00 101 D 8.24 4.30 0.00 2.74 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 0.00 102 N 7.79 4.27 0.00 2.51 2.71 0.00 0.00 6.84 7.45 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 0.00 103 F 7.33 4.46 0.00 3.08 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 0.00 104 R 7.77 3.87 0.00 1.89 2.06 0.00 3.08 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 105 V 7.55 3.53 1.14 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 0.35 0.00 0.00 0.58 0.00 0.00 106 L 7.84 3.93 0.00 1.80 1.84 0.98 1.08 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 0.00 107 A 7.97 4.09 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 0.00 108 D 8.11 4.37 0.00 2.89 2.79 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 0.00 109 V 8.09 3.66 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 1.08 0.00 0.00 1.16 0.00 0.00 110 L 8.41 3.95 0.00 2.07 1.96 1.28 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.08 3.79 4.61 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 1.45 0.00 0.00 112 I 7.78 3.66 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.75 0.90 0.00 0.00 113 V 7.86 3.49 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 1.04 0.00 0.00 0.91 0.00 0.00 114 I 7.75 3.02 1.10 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.34 -1.06 0.00 0.00 115 A 7.37 3.56 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 0.00 116 A 7.54 3.92 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 0.00 117 K 7.94 4.15 0.00 1.87 1.96 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.56 7.81 118 F 9.10 4.54 0.00 2.90 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 0.00 119 G 8.99 4.14 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 0.00 0.00 0.00 120 A 8.93 3.81 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 0.00 121 S 7.68 4.32 0.00 4.06 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 0.00 122 F 8.64 4.70 0.00 2.96 3.13 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 0.00 123 T 7.59 4.17 4.34 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 1.27 0.00 0.00 124 P 0.00 4.21 0.00 2.16 2.15 0.00 3.57 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 2.11 2.19 0.00 125 E 8.02 3.97 0.00 2.03 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 2.40 2.46 0.00 126 I 7.71 3.74 1.73 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.55 0.87 0.00 0.00 127 Q 8.18 3.70 0.00 1.41 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.45 2.62 0.00 128 A 8.30 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 0.00 129 T 7.87 4.08 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 1.39 0.00 0.00 130 W 9.00 4.32 0.00 3.67 3.48 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 0.00 131 Q 8.75 4.21 0.00 2.37 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.59 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 132 K 8.19 4.02 0.00 2.13 2.25 0.00 1.61 0.00 0.00 1.74 0.00 0.00 2.13 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.28 1.36 7.81 133 F 8.46 4.51 0.00 2.97 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 0.00 134 M 8.05 3.46 0.00 1.88 1.94 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.14 0.00 135 K 8.01 3.89 0.00 2.01 1.84 0.00 1.79 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.62 7.81 136 V 7.68 3.57 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 1.11 0.00 0.00 1.12 0.00 0.00 137 V 7.65 3.43 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 0.72 0.00 0.00 0.29 0.00 0.00 138 V 8.18 3.42 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 0.96 0.00 0.00 0.90 0.00 0.00 139 A 7.67 3.97 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 0.00 140 A 8.43 4.10 1.46 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 0.00 141 M 8.12 3.87 0.00 0.51 1.63 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.15 0.00 142 G 7.76 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 0.00 0.00 0.00 143 S 7.93 4.22 0.00 4.03 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 0.00 144 R 8.12 4.59 0.00 1.79 2.05 0.00 3.45 0.00 0.00 3.42 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.91 0.00 145 Y 7.12 3.98 0.00 2.83 2.83 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 0.00 146 F 8.27 4.47 0.00 3.11 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