NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.7915 8.0393 120.2954 61.8204 32.6278 175.3508 2 H 4.5793 7.8042 117.9477 53.0977 27.9158 170.0266 3 L 5.2284 7.9469 126.0657 53.3761 44.2983 178.7967 4 T 4.2196 8.3712 113.9976 60.7572 71.0398 173.8564 5 P 4.2141 0.0000 0.0000 65.7402 31.3882 178.9093 6 E 3.9727 8.0734 117.1526 59.3331 29.4891 179.0218 7 E 3.9178 7.7996 118.4613 59.3723 29.4412 179.5840 8 K 4.0035 8.2584 118.5320 58.7679 31.9813 179.6080 9 S 4.1457 7.7399 114.6855 61.2152 63.3495 176.3909 10 A 3.9656 7.8102 124.4809 54.9490 18.0492 179.2664 11 V 3.1703 7.9386 117.2767 66.2867 31.5581 178.2752 12 T 4.0649 7.9766 109.3908 64.5740 68.3342 176.2868 13 A 3.9601 7.8362 123.0429 54.9730 18.6999 178.9445 14 L 3.7753 7.8535 118.5298 58.2014 42.2588 178.8438 15 W 4.2329 9.0123 128.7669 60.6871 30.3084 178.0555 16 G 3.8016 8.1810 104.6092 47.1017 0.0000 174.3639 17 K 4.3460 7.9519 118.3870 56.6895 32.7257 177.2762 18 V 3.5595 7.2613 120.1985 62.3610 32.1362 174.9654 19 N 4.5187 8.4248 125.6170 52.7876 38.4938 175.8471 20 V 3.8110 8.2520 119.6167 63.2837 31.9621 176.9588 21 D 4.6820 8.1328 118.1449 55.0427 41.9386 177.1482 22 E 4.4546 8.9754 117.9961 57.8569 31.2387 178.0415 23 V 3.5757 7.5480 117.8676 66.2156 31.2684 178.3486 24 G 3.6756 8.0370 104.8824 47.7496 0.0000 175.8737 25 G 3.5930 8.0142 107.7264 47.0939 0.0000 175.4045 26 E 3.8208 8.1041 121.3783 59.1057 29.6934 178.7396 27 A 3.8431 7.8404 120.6702 55.2102 18.6612 179.3886 28 L 3.9406 8.2422 119.1806 57.9544 42.0313 179.5322 29 G 3.4781 7.9475 105.8376 47.9366 0.0000 175.9977 30 R 3.8212 8.0145 121.3830 58.3512 29.9070 178.8794 31 L 3.8476 7.9212 120.2641 58.1889 41.5683 178.9995 32 L 3.7084 7.4539 118.3231 57.7105 41.2995 179.8471 33 V 3.4294 7.3261 116.7582 66.0369 31.5979 177.9542 34 V 3.4666 7.7235 116.7713 64.2198 32.9114 175.6505 35 Y 4.1176 7.2211 115.3010 54.2237 37.9214 173.9124 36 P 4.2910 0.0000 0.0000 64.5642 32.0836 177.7846 37 W 4.3988 7.8097 114.3153 58.7206 27.7599 177.2454 38 T 4.1032 7.3413 110.2724 63.0498 68.4968 176.2817 39 Q 4.1052 8.2742 121.9965 58.5342 28.6120 177.6267 40 R 4.0897 7.7428 117.7767 58.4333 30.1784 177.1504 41 F 4.6840 8.2951 115.0168 57.5629 39.8060 175.7542 42 F 4.1591 8.6714 118.1525 56.8272 39.8870 176.9204 43 E 3.9823 8.6491 123.5111 59.8727 29.1771 179.4271 44 S 4.4888 8.0160 109.7631 59.9251 63.0991 174.6581 45 F 4.5274 8.9947 120.1187 58.4819 40.0772 176.6398 46 G 4.0380 7.6885 107.3072 44.5393 0.0000 175.4406 47 D 4.4305 8.6767 126.5434 54.5606 41.0370 175.5748 48 L 4.8370 8.3671 124.3058 54.5040 44.1272 177.2372 49 S 4.2529 8.2494 116.4529 61.1739 62.7308 174.7478 50 T 4.6962 7.4137 109.4863 57.7440 72.9672 172.6295 51 P 4.1588 0.0000 0.0000 66.0573 31.1960 178.6131 52 D 4.2690 8.0780 116.6693 57.2147 40.7580 178.6270 53 A 3.9557 7.6865 120.8312 55.1710 18.2126 179.8570 54 V 3.5345 7.7100 115.5066 66.5721 31.7318 177.9877 55 M 4.2776 8.5775 117.4085 57.5339 31.8708 178.1511 56 G 4.0215 8.0396 104.6052 44.4286 0.0000 173.1388 57 N 4.3419 7.9748 120.3818 53.2232 39.0637 173.6924 58 P 4.3242 0.0000 0.0000 65.4004 31.4460 178.7835 59 K 3.7417 8.3029 117.6602 58.8860 31.7405 179.6256 60 V 3.8496 7.8211 118.8315 65.7791 31.5502 177.7973 61 K 3.8243 8.0980 118.6866 59.6664 31.9009 178.3103 62 A 4.0066 8.1034 120.8449 55.5437 18.4312 179.1394 63 H 4.4016 8.4389 116.4807 58.9323 29.8875 177.8527 64 G 3.6425 8.1816 108.1448 47.4951 0.0000 175.3901 65 K 3.8916 8.1987 122.3619 59.3920 31.9599 178.7544 66 K 3.9986 7.8626 118.4961 59.5675 31.9017 179.4027 67 V 3.7847 7.6477 117.8906 66.1476 31.4938 177.8337 68 L 4.3151 8.6710 120.6160 58.1203 41.7629 179.1433 69 G 3.7631 8.4002 105.7172 47.6888 0.0000 175.6112 70 A 4.1135 8.1329 123.1567 54.9404 18.3472 179.8144 71 F 4.0391 8.5432 116.2858 60.9565 38.8426 177.8860 72 S 3.7626 8.2879 113.4969 61.6104 62.9354 176.2439 73 D 4.4986 7.9511 120.7539 57.3993 40.9674 178.4504 74 G 3.7497 7.9927 106.2205 47.8773 0.0000 175.1930 75 L 3.7909 7.9043 121.5550 57.4842 42.1002 178.1212 76 A 4.3498 7.5961 117.9784 52.6386 19.9767 176.6481 77 H 4.8672 8.3564 115.2662 54.2284 29.8374 175.1778 78 L 3.9807 8.0616 120.2261 57.9719 41.9022 178.6758 79 D 4.6194 7.9166 115.1587 54.9208 41.8229 176.1440 80 N 5.0197 8.0601 117.9993 51.5629 39.5625 174.8080 81 L 4.1055 7.8720 123.2805 57.6661 42.2518 178.7486 82 K 3.8744 8.2082 118.2450 59.7413 32.1415 178.4641 83 G 3.6354 7.9279 105.2163 48.1799 0.0000 175.6097 84 T 3.5920 7.1762 117.1085 65.6198 68.5666 175.5615 85 F 4.7319 7.6831 117.2987 57.0012 39.4835 177.5125 86 A 3.9792 7.9604 123.5938 55.9760 18.1809 180.8873 87 T 3.8715 7.7862 113.5153 66.6515 68.5669 177.0227 88 L 4.1245 7.8838 120.5422 57.5293 41.5856 179.3495 89 S 4.1324 8.0040 114.7472 60.8026 62.3367 175.9780 90 E 3.8527 7.8739 121.4529 59.1628 29.0994 179.0478 91 L 3.9153 7.8357 120.2163 58.7323 42.2216 178.7634 92 H 4.4437 8.6374 115.5472 57.7231 28.5023 176.9023 93 C 4.7217 7.8279 118.5629 60.8656 29.0639 174.8979 94 D 4.4353 7.7696 118.6138 56.1622 41.0069 177.5260 95 K 4.2045 7.9459 118.2724 57.9605 33.0398 177.1427 96 L 4.1262 8.0193 116.9923 55.0916 42.5328 176.2558 97 H 4.2383 8.0262 113.6536 56.6725 25.5163 175.1077 98 V 4.4690 8.3455 118.5612 61.4950 32.8984 174.9800 99 D 4.3491 8.6751 127.1851 53.5288 41.7411 175.1541 100 P 4.0465 0.0000 0.0000 65.3498 31.2720 178.0635 101 E 3.9034 7.9267 119.2366 58.7494 29.3366 177.5607 102 N 4.5440 7.7758 115.2978 54.5498 38.7734 177.0521 103 F 4.5628 7.6386 120.3708 60.1592 39.0900 177.5588 104 R 3.9315 8.0430 117.8927 59.6842 30.0614 178.3418 105 L 3.9410 7.6991 118.1323 57.7743 41.4238 179.2507 106 L 4.2746 8.0196 120.0038 57.4042 42.0099 179.2588 107 G 3.7395 8.1349 106.2152 47.9688 0.0000 175.6240 108 N 4.4818 8.6538 119.6115 55.8979 38.4727 177.7745 109 V 3.6051 7.7938 119.4367 65.5986 31.6004 177.6649 110 L 3.7839 7.6634 120.0041 58.2430 41.8227 178.8683 111 V 3.5173 7.7056 117.9873 66.6182 31.3453 177.8123 112 C 4.0220 7.9930 115.9863 62.6506 27.7699 176.3702 113 V 3.3941 7.6542 120.0698 65.8097 31.0829 178.1729 114 L 3.7378 7.9637 118.9896 57.3921 41.4390 179.3228 115 A 3.4903 7.4385 121.1930 55.0437 18.0203 179.1966 116 H 4.0507 7.8306 116.0056 59.7713 30.0613 176.9991 117 H 4.1365 8.1949 116.8409 57.4900 28.6950 176.6543 118 F 4.7581 8.1069 118.1373 55.1217 40.4762 176.9750 119 G 3.9463 8.5811 107.0073 46.2856 0.0000 177.0968 120 K 4.0189 9.0175 125.0572 58.9662 31.9837 176.9729 121 E 4.1123 8.0288 118.0997 57.6746 30.0599 176.6362 122 F 4.7287 7.6710 121.5694 57.4401 38.4732 175.5460 123 T 4.0678 7.3134 114.5914 61.2053 71.1717 173.1312 124 P 4.2158 0.0000 0.0000 65.4731 31.3045 177.3287 125 P 4.2017 0.0000 0.0000 65.5051 31.4434 178.7897 126 V 3.5403 7.4685 116.6458 65.7613 31.2707 177.9253 127 Q 3.6860 7.8841 119.3946 58.9382 29.0102 177.9508 128 A 4.1348 7.9752 121.3916 54.8840 17.8138 179.5459 129 A 3.9218 7.8447 119.5232 55.5939 18.3698 179.4990 130 Y 4.1395 8.2129 115.2696 60.8933 37.9349 178.1571 131 Q 4.1309 8.7049 119.6692 59.1343 28.8785 178.9277 132 K 3.8644 7.8800 118.7693 59.6923 32.1274 179.2931 133 V 3.5715 7.3925 117.1438 66.3226 31.4207 178.5706 134 V 3.7998 8.3506 112.1725 64.2419 31.3566 178.4031 135 A 4.1208 8.6060 121.2707 55.0218 18.1254 179.8319 136 G 3.4990 8.2030 104.2314 48.0250 0.0000 176.0747 137 V 2.8960 7.6012 120.9936 65.3050 30.9970 178.0008 138 A 3.8745 8.1896 120.7922 54.9304 16.8477 179.0727 139 N 4.4002 8.0743 115.6047 56.5575 38.8551 177.1128 140 A 4.1482 7.9365 121.7266 54.7872 18.1953 179.2448 141 L 3.8340 7.8061 117.4037 56.8148 41.5393 178.2245 142 A 4.6285 7.3244 118.0499 52.1417 18.8726 178.0848 143 H 3.9402 7.4658 117.7841 59.5931 29.9391 177.0982 144 K 4.1389 7.8802 116.0060 57.9162 31.9765 176.8876 145 Y 4.8620 8.1949 116.9375 58.2079 39.0005 175.6525 146 H 4.6555 8.1435 122.4624 55.8617 28.9905 174.4835 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 8.04 3.79 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 0.88 0.00 0.00 0.86 0.00 0.00 2 H 7.80 4.58 0.00 3.33 3.34 0.00 5.51 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 3 L 7.95 5.23 0.00 1.60 1.58 0.86 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.37 4.22 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 1.20 0.00 0.00 5 P 0.00 4.21 0.00 2.16 2.13 0.00 3.58 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 2.10 2.16 0.00 6 E 8.07 3.97 0.00 1.98 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 2.38 2.38 0.00 7 E 7.80 3.92 0.00 2.23 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 2.28 2.31 0.00 8 K 8.26 4.00 0.00 1.86 1.80 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.39 1.60 7.81 9 S 7.74 4.15 0.00 4.00 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 10 A 7.81 3.97 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 11 V 7.94 3.17 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 0.65 0.00 0.00 0.39 0.00 0.00 12 T 7.98 4.06 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 1.17 0.00 0.00 13 A 7.84 3.96 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 14 L 7.85 3.78 0.00 2.06 1.92 0.50 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 15 W 9.01 4.23 0.00 3.88 3.28 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 16 G 8.18 3.80 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 0.00 17 K 7.95 4.35 0.00 2.08 2.08 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.53 7.81 18 V 7.26 3.56 1.48 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 0.07 0.00 0.00 0.69 0.00 0.00 19 N 8.42 4.52 0.00 2.68 2.61 0.00 0.00 7.23 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 20 V 8.25 3.81 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 0.79 0.00 0.00 0.96 0.00 0.00 21 D 8.13 4.68 0.00 2.77 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 8.98 4.45 0.00 1.93 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 2.19 2.36 0.00 23 V 7.55 3.58 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 0.80 0.00 0.00 0.84 0.00 0.00 24 G 8.04 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 25 G 8.01 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 26 E 8.10 3.82 0.00 2.05 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 0.00 2.15 2.24 0.00 27 A 7.84 3.84 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 28 L 8.24 3.94 0.00 1.78 1.80 0.56 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.95 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 0.00 0.00 0.00 30 R 8.01 3.82 0.00 1.87 1.84 0.00 3.00 0.00 0.00 2.95 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 31 L 7.92 3.85 0.00 1.72 1.74 0.98 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.45 3.71 0.00 1.77 1.53 0.58 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.33 3.43 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 0.66 0.00 0.00 0.90 0.00 0.00 34 V 7.72 3.47 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 0.03 0.00 0.00 0.67 0.00 0.00 35 Y 7.22 4.12 0.00 2.60 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 36 P 0.00 4.29 0.00 2.14 2.08 0.00 3.66 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 37 W 7.81 4.40 0.00 3.58 3.52 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 0.00 0.00 0.00 0.00 38 T 7.34 4.10 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 0.78 0.00 0.00 39 Q 8.27 4.11 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 40 R 7.74 4.09 0.00 2.11 2.57 0.00 3.38 0.00 0.00 3.49 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 41 F 8.30 4.68 0.00 3.02 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 8.67 4.16 0.00 2.99 2.42 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 43 E 8.65 3.98 0.00 2.04 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 0.00 2.44 2.36 0.00 44 S 8.02 4.49 0.00 4.09 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 45 F 8.99 4.53 0.00 3.23 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 7.69 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 0.00 0.00 0.00 47 D 8.68 4.43 0.00 2.67 2.64 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 48 L 8.37 4.84 0.00 1.72 1.57 0.98 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.25 4.25 0.00 3.93 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 50 T 7.41 4.70 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 1.20 0.00 0.00 51 P 0.00 4.16 0.00 2.13 2.09 0.00 3.57 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 2.13 0.00 52 D 8.08 4.27 0.00 2.66 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 53 A 7.69 3.96 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 54 V 7.71 3.53 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 0.84 0.00 0.00 0.96 0.00 0.00 55 M 8.58 4.28 0.00 1.95 2.07 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.81 0.00 56 G 8.04 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 57 N 7.97 4.34 0.00 2.97 2.78 0.00 0.00 7.03 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 58 P 0.00 4.32 0.00 2.15 2.06 0.00 3.62 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 59 K 8.30 3.74 0.00 1.65 0.74 0.00 1.59 0.00 0.00 1.15 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.19 1.27 7.81 60 V 7.82 3.85 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 1.02 0.00 0.00 1.13 0.00 0.00 61 K 8.10 3.82 0.00 1.86 1.97 0.00 1.76 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.52 7.81 62 A 8.10 4.01 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 63 H 8.44 4.40 0.00 3.76 3.72 0.00 5.78 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 8.18 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 65 K 8.20 3.89 0.00 2.02 2.05 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.49 1.54 7.81 66 K 7.86 4.00 0.00 2.05 1.89 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.50 7.81 67 V 7.65 3.78 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 1.27 0.00 0.00 1.12 0.00 0.00 68 L 8.67 4.32 0.00 1.84 1.97 0.93 0.98 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 69 G 8.40 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 8.13 4.11 1.52 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 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.54 4.04 0.00 3.38 3.11 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 72 S 8.29 3.76 0.00 4.19 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 73 D 7.95 4.50 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 74 G 7.99 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 75 L 7.90 3.79 0.00 1.40 1.48 0.11 1.06 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 76 A 7.60 4.35 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 77 H 8.36 4.87 0.00 3.05 3.15 0.00 5.84 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 78 L 8.06 3.98 0.00 1.59 1.71 0.85 1.05 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 79 D 7.92 4.62 0.00 2.63 2.68 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 80 N 8.06 5.02 0.00 2.73 2.62 0.00 0.00 7.15 6.38 0.00 0.00 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 L 7.87 4.11 0.00 1.78 1.88 0.88 0.78 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 82 K 8.21 3.87 0.00 1.65 1.81 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.31 1.15 7.81 83 G 7.93 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 84 T 7.18 3.59 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 0.24 0.00 0.00 85 F 7.68 4.73 0.00 3.01 2.84 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 86 A 7.96 3.98 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 87 T 7.79 3.87 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 1.20 0.00 0.00 88 L 7.88 4.12 0.00 1.87 1.68 1.05 0.92 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 89 S 8.00 4.13 0.00 3.93 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 7.87 3.85 0.00 2.09 1.95 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 2.44 2.44 0.00 91 L 7.84 3.92 0.00 1.80 2.00 0.89 1.14 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 92 H 8.64 4.44 0.00 3.33 3.73 0.00 5.84 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.83 4.72 0.00 2.56 1.53 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 94 D 7.77 4.44 0.00 2.83 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 95 K 7.95 4.20 0.00 1.65 1.97 0.00 1.64 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.47 7.81 96 L 8.02 4.13 0.00 1.77 1.76 0.86 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.03 4.24 0.00 3.36 3.45 0.00 5.69 0.00 0.00 0.00 0.00 8.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.35 4.47 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 0.50 0.00 0.00 1.46 0.00 0.00 99 D 8.68 4.35 0.00 2.71 2.39 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 0.00 100 P 0.00 4.05 0.00 2.50 2.71 0.00 3.55 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 101 E 7.93 3.90 0.00 2.02 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 2.20 2.31 0.00 102 N 7.78 4.54 0.00 2.38 2.69 0.00 0.00 6.85 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 0.00 103 F 7.64 4.56 0.00 3.22 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 0.00 104 R 8.04 3.93 0.00 1.93 2.13 0.00 3.21 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 105 L 7.70 3.94 0.00 1.60 1.35 0.75 0.31 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 0.00 106 L 8.02 4.27 0.00 1.82 1.97 0.94 1.58 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 0.00 107 G 8.13 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 0.00 108 N 8.65 4.48 0.00 2.80 2.96 0.00 0.00 6.70 7.27 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 0.00 109 V 7.79 3.61 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.09 0.00 0.00 110 L 7.66 3.78 0.00 1.58 1.77 0.77 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.71 3.52 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 1.25 0.00 0.00 1.21 0.00 0.00 112 C 7.99 4.02 0.00 3.12 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 0.00 113 V 7.65 3.39 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 0.78 0.00 0.00 0.84 0.00 0.00 114 L 7.96 3.74 0.00 0.95 1.31 0.62 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.44 3.49 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 0.00 116 H 7.83 4.05 0.00 3.18 3.38 0.00 5.75 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.19 4.14 0.00 2.66 2.52 0.00 5.69 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.11 4.76 0.00 3.39 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 0.00 119 G 8.58 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 0.00 120 K 9.02 4.02 0.00 1.75 1.91 0.00 1.72 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.53 7.81 121 E 8.03 4.11 0.00 2.07 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 2.34 2.30 0.00 122 F 7.67 4.73 0.00 3.12 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 0.00 123 T 7.31 4.07 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 1.21 0.00 0.00 124 P 0.00 4.22 0.00 2.17 2.17 0.00 3.59 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 125 P 0.00 4.20 0.00 2.11 2.05 0.00 3.50 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 2.08 2.11 0.00 126 V 7.47 3.54 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.85 0.00 0.00 127 Q 7.88 3.69 0.00 1.90 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.51 2.78 0.00 128 A 7.98 4.13 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.84 3.92 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 0.00 130 Y 8.21 4.14 0.00 3.18 3.17 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 0.00 0.00 0.00 131 Q 8.70 4.13 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.72 0.00 0.00 0.00 0.00 0.00 2.73 2.65 0.00 132 K 7.88 3.86 0.00 2.02 1.87 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.52 1.67 7.81 133 V 7.39 3.57 2.31 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 1.01 0.00 0.00 0.84 0.00 0.00 134 V 8.35 3.80 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 1.08 0.00 0.00 1.17 0.00 0.00 135 A 8.61 4.12 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 0.00 136 G 8.20 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 7.60 2.90 1.71 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 -0.53 0.00 0.00 0.79 0.00 0.00 138 A 8.19 3.87 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 0.00 139 N 8.07 4.40 0.00 2.87 2.95 0.00 0.00 7.00 8.31 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 0.00 140 A 7.94 4.15 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 0.00 141 L 7.81 3.83 0.00 1.26 0.69 0.15 -0.08 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 0.00 142 A 7.32 4.63 1.55 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 0.00 0.00 143 H 7.47 3.94 0.00 3.25 3.29 0.00 5.79 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.88 4.14 0.00 1.53 1.76 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.55 7.81 145 Y 8.19 4.86 0.00 3.29 2.95 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 0.00 146 H 8.14 4.66 0.00 3.20 3.20 0.00 5.70 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