NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0002 8.0549 114.0549 60.4002 33.7604 175.2751 2 L 4.3765 7.6441 119.6000 51.0053 42.7933 175.4515 3 S 4.5513 8.9111 119.9917 57.4503 66.3502 174.4614 4 E 4.2640 8.8488 122.3223 59.5001 29.3301 178.8776 5 G 3.7016 8.1754 105.2716 48.0013 0.0000 175.3573 6 E 3.9913 8.3338 120.9473 58.8974 29.3654 179.4187 7 W 4.3488 8.3080 119.1065 59.9289 28.9858 178.5975 8 Q 4.1241 8.4761 118.2016 58.8962 28.1735 178.7438 9 L 4.0836 8.1646 120.1891 57.6157 41.6528 179.5767 10 V 3.7247 8.0011 118.2144 66.3227 31.5470 178.2071 11 L 4.2607 8.4539 118.6638 57.6022 41.1285 178.9948 12 H 4.2008 8.7482 119.2139 59.3510 29.9361 177.7979 13 V 3.6124 7.9214 120.8647 64.3688 31.2324 178.0208 14 W 3.8275 8.5214 128.9281 60.1919 30.2687 177.7196 15 A 4.1500 8.0374 119.9389 55.0737 18.1571 179.4865 16 K 3.8759 7.3816 115.7824 59.3531 32.0254 179.5250 17 V 2.7383 7.0631 118.4035 65.8429 31.0430 177.7075 18 E 3.9164 7.4947 115.5384 58.0809 29.2967 178.5966 19 A 4.2262 7.3824 120.3165 53.9778 19.3028 177.6446 20 D 4.6283 7.8928 116.1873 52.2521 43.1144 175.5717 21 V 3.4582 8.0386 123.1881 65.3503 31.9295 176.7533 22 A 4.0589 7.9946 120.1465 55.2043 18.3063 179.7315 23 G 3.5563 8.4686 105.6809 47.6580 0.0000 175.6767 24 H 4.1701 8.2996 118.8560 58.5536 28.6978 178.2163 25 G 3.5233 8.4336 107.9202 47.6478 0.0000 175.6859 26 Q 3.9038 8.3252 120.8553 59.0793 28.7178 178.9917 27 D 4.2922 8.0427 119.6199 57.1830 40.6841 178.9831 28 I 3.6397 7.9390 120.6743 64.3902 37.0526 178.5294 29 L 3.4342 7.7980 119.7810 57.4821 41.3473 179.5853 30 I 3.6184 7.8141 120.1840 64.2511 36.9594 178.4028 31 R 3.7930 8.0550 119.7027 59.2240 29.8193 178.1889 32 L 3.9091 7.9124 120.3580 58.4324 41.9235 179.1203 33 F 4.5809 8.0341 117.8829 60.0318 38.5436 177.7797 34 K 4.0691 7.9953 118.0625 59.8145 32.8262 179.1487 35 S 4.2329 8.2449 115.8567 60.0955 64.3265 174.4113 36 H 4.6866 8.2514 118.2097 52.3291 29.1593 172.1321 37 P 4.6329 0.0000 0.0000 64.3056 31.5787 177.6641 38 E 4.1274 8.2806 116.5947 59.3784 29.4200 179.0282 39 T 3.8191 8.1023 110.8648 64.3396 68.6832 176.1680 40 L 3.8504 8.0007 123.2631 57.6907 41.7783 178.4749 41 E 4.0369 7.9679 117.6146 58.5620 29.4392 178.3972 42 K 4.3426 7.9166 116.9327 56.3968 32.9159 176.9463 43 F 4.6142 7.9804 119.2199 55.0757 39.4148 175.3696 44 D 4.3396 8.6870 128.5833 57.0691 40.8469 178.4437 45 R 4.7098 7.5271 116.3030 55.9523 30.7691 180.0307 46 F 5.2014 7.7384 119.4102 58.5356 40.9605 178.1817 47 K 3.9359 7.9998 118.4392 59.1553 32.5166 177.1484 48 H 4.7448 7.8953 115.0368 55.4744 29.0808 174.7538 49 L 4.2661 7.8494 121.4269 54.5602 41.8697 177.1579 50 K 4.3667 8.6848 122.6745 57.6714 33.2084 177.2954 51 T 4.7242 7.3589 107.9276 58.8639 72.9635 174.0555 52 E 3.9000 8.7969 122.2232 59.5639 29.6762 179.0513 53 A 3.9665 7.9383 120.2734 55.1527 18.2750 179.2785 54 E 3.9501 8.1852 116.4134 59.8414 29.9117 179.1866 55 M 4.1442 8.1858 118.8023 58.2045 31.7786 178.7142 56 K 3.9830 8.1318 118.8522 58.6270 32.4726 177.8232 57 A 4.5041 7.6152 118.6861 51.1831 19.2778 176.8782 58 S 4.2661 7.4362 113.8164 57.3481 62.7234 174.4601 59 E 3.9893 8.8895 129.2757 59.2717 29.3339 178.0388 60 D 4.4380 8.1382 117.8254 57.3263 41.3500 177.8472 61 L 3.4727 8.1544 121.0040 57.7390 41.9705 178.7812 62 K 3.8712 8.0633 119.6970 59.4012 32.0648 178.9269 63 K 4.0235 8.4448 119.0623 59.8183 31.9004 178.9675 64 H 4.2927 8.8087 116.8884 58.8271 28.6630 177.9167 65 G 3.6642 8.4037 107.7821 47.9291 0.0000 175.8588 66 V 3.6416 7.8799 120.6740 65.9403 31.5424 178.1897 67 T 3.8959 8.1398 115.6099 66.6407 68.2440 176.7621 68 V 3.6507 8.1749 120.3394 66.2106 31.5984 178.1648 69 L 4.2768 8.1800 118.5327 57.7594 41.4456 179.6814 70 T 3.9633 8.4286 116.2666 66.5407 68.5239 176.5825 71 A 4.0105 8.0572 122.7169 55.0827 18.3936 179.4624 72 L 3.7533 8.2543 119.2189 58.0533 42.1419 179.3248 73 G 3.1993 8.5334 105.8884 47.6875 0.0000 175.4552 74 A 3.9964 7.7944 122.1346 54.7602 18.6254 179.6332 75 I 3.7855 7.5584 117.9904 64.6341 37.2408 178.6695 76 L 4.0193 7.9022 120.1527 57.7061 41.1593 179.6934 77 K 3.9588 7.7614 117.0853 58.5104 32.2193 178.6126 78 K 3.9962 7.8517 117.8747 55.6926 32.4757 176.6501 79 K 2.0000 8.3649 118.1588 56.3735 29.8373 175.8053 80 G 3.9093 7.9232 106.4070 45.7114 0.0000 174.3634 81 H 4.5491 7.3670 119.2073 55.0625 27.2650 174.6941 82 H 5.3933 7.3210 111.2357 54.1090 29.8011 176.0232 83 E 3.9249 8.6113 122.4891 60.2927 29.0302 178.7318 84 A 4.0328 7.9130 118.3591 54.7518 17.9064 178.8243 85 E 4.1518 8.1096 116.9600 59.0543 29.7649 178.5540 86 L 4.2490 8.3334 120.6081 57.2927 42.1408 178.6971 87 K 3.9146 8.2738 120.0561 59.2188 32.1966 177.1142 88 P 4.2932 0.0000 0.0000 65.1963 31.1800 178.4612 89 L 4.0548 7.5450 116.1688 57.9834 41.9582 178.7395 90 A 4.1957 8.3220 121.0447 55.2672 18.3549 179.2532 91 Q 3.9203 8.3308 118.3346 59.4619 29.0563 178.9024 92 S 4.0338 8.1650 115.1873 61.8517 63.1076 176.1174 93 H 4.1715 8.7415 119.6498 57.7814 28.2184 177.7058 94 A 2.9150 8.0116 122.8027 54.4581 18.5494 178.9307 95 T 3.9630 7.5007 105.8815 62.2201 69.7205 175.4115 96 K 4.1432 7.4535 120.3470 58.2717 33.3286 176.8921 97 H 4.2936 7.9616 114.5288 56.0892 29.5105 175.5026 98 K 3.1682 7.4590 117.3376 56.9941 28.5211 175.5362 99 I 4.3442 8.0487 118.9907 58.6961 38.2534 174.9651 100 P 4.6666 0.0000 0.0000 62.2845 32.0751 177.4533 101 I 3.6639 8.5756 121.7087 64.5068 36.8442 178.8674 102 K 4.0086 7.7859 120.4249 59.6493 32.1535 178.6694 103 Y 4.0510 7.8293 117.7361 60.6889 37.7510 178.1926 104 L 4.1813 7.9341 119.7326 57.6139 41.5430 179.1237 105 E 4.0322 8.2595 118.8064 59.5080 29.4554 179.3191 106 F 4.6334 8.1023 117.8571 60.8634 38.8970 177.6541 107 I 3.8868 8.2904 118.1932 63.8817 37.7347 178.0932 108 S 4.2048 8.3584 116.3904 61.6868 62.6145 176.4327 109 E 4.0608 8.6599 121.2084 59.3798 29.1433 179.2855 110 A 4.0225 8.1570 120.8240 55.0835 18.3396 179.6463 111 I 3.6743 8.0860 118.4979 64.7661 37.2034 178.7193 112 I 3.9499 8.0221 120.5099 64.5896 36.8826 177.8684 113 H 4.1342 8.5477 119.2617 59.5086 29.7217 177.5264 114 V 3.5345 8.0694 120.0052 65.8914 31.3490 177.9461 115 L 3.8627 8.1425 119.0728 58.0035 41.1220 179.0293 116 H 4.4859 8.4254 117.4474 59.3024 29.8999 177.2066 117 S 4.1788 8.0614 116.4308 61.5024 62.7397 176.3447 118 R 4.1083 7.8155 119.0755 57.4420 30.9486 176.3660 119 H 5.0376 8.1998 116.1703 54.2445 30.0152 173.5322 120 P 4.2376 0.0000 0.0000 65.7651 31.5260 178.4207 121 G 3.8404 8.0817 105.6059 46.9758 0.0000 173.4137 122 D 5.0348 8.1924 118.3608 54.0070 42.1156 176.3725 123 F 5.1859 8.0308 120.5385 56.2673 39.7653 174.3095 124 G 3.9291 7.7408 109.1088 43.9267 0.0000 171.7247 125 A 3.8802 8.4771 120.7584 55.5513 18.3350 179.8669 126 D 4.2103 7.9712 116.4777 57.4294 40.9054 178.7289 127 A 4.0402 7.8562 120.8162 55.1609 18.4593 179.5290 128 Q 3.3700 8.0986 117.1657 58.7653 28.6902 179.2357 129 G 3.5383 8.2982 106.9007 47.5883 0.0000 175.6006 130 A 3.8323 7.9986 123.2388 55.1226 18.3543 179.4428 131 M 3.9904 8.3473 116.9977 58.8149 32.2525 178.0770 132 N 4.3501 8.6772 117.0673 56.3694 38.6419 177.5494 133 K 4.0621 8.1740 119.6045 59.3200 32.1191 179.2995 134 A 3.8598 8.0344 121.2697 55.1558 18.1987 179.7500 135 L 4.0926 8.3141 117.8267 57.8121 41.6619 179.5666 136 E 3.9847 8.5843 119.1020 59.1868 29.3107 179.0142 137 L 3.9702 8.3151 120.7910 58.0706 42.1033 178.5428 138 F 4.1409 8.3974 120.5292 61.7235 39.2015 177.4318 139 R 3.4965 8.3155 117.5554 58.7859 29.8335 178.9398 140 K 3.8146 8.4050 119.8814 59.7452 32.2326 178.6777 141 D 4.3482 8.2728 119.3071 57.3048 40.6985 178.8637 142 I 3.4870 7.6623 120.3812 64.0633 36.9797 178.2663 143 A 3.6372 7.9604 121.7700 54.8963 18.1356 179.5330 144 A 3.9335 7.9466 119.2583 55.2782 18.4456 180.0726 145 K 4.1295 8.0269 116.9960 59.6540 32.0309 178.8791 146 Y 4.4060 8.5109 117.6281 61.5232 37.7996 179.2699 147 K 4.1051 8.2318 118.9229 59.6045 31.9264 179.3180 148 E 3.9904 8.0645 117.8497 59.0310 29.4514 178.5064 149 L 4.3925 7.7724 116.5427 54.6976 42.0019 177.6992 150 G 3.8800 8.2329 107.7977 45.4135 0.0000 172.4066 151 Y 4.7529 8.0165 120.9286 56.0067 39.6996 175.6864 152 Q 4.4772 8.2648 127.1518 55.5351 29.8610 175.8268 153 G 3.1646 6.1308 112.5673 45.5479 0.0000 174.4899 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 4.00 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 0.86 0.00 0.00 0.92 0.00 0.00 2 L 7.64 4.38 0.00 1.29 0.70 0.59 -0.89 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 3 S 8.91 4.55 0.00 4.09 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 E 8.85 4.26 0.00 2.20 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 5 G 8.18 3.70 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 0.00 0.00 0.00 6 E 8.33 3.99 0.00 2.07 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 2.24 2.28 0.00 7 W 8.31 4.35 0.00 3.59 3.18 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 0.00 0.00 0.00 8 Q 8.48 4.12 0.00 2.33 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.46 2.77 0.00 9 L 8.16 4.08 0.00 1.92 1.80 0.95 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 10 V 8.00 3.72 2.46 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 1.16 0.00 0.00 0.86 0.00 0.00 11 L 8.45 4.26 0.00 1.85 1.80 0.95 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.75 4.20 0.00 3.35 3.58 0.00 5.78 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.92 3.61 2.19 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 0.85 0.00 0.00 0.58 0.00 0.00 14 W 8.52 3.83 0.00 3.64 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 15 A 8.04 4.15 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.38 3.88 0.00 1.47 1.39 0.00 1.59 0.00 0.00 1.44 0.00 0.00 2.75 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.40 1.35 7.81 17 V 7.06 2.74 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 0.03 0.00 0.00 0.21 0.00 0.00 18 E 7.49 3.92 0.00 2.03 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 2.27 2.18 0.00 19 A 7.38 4.23 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 20 D 7.89 4.63 0.00 2.66 2.52 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 21 V 8.04 3.46 2.04 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 1.05 0.00 0.00 0.85 0.00 0.00 22 A 7.99 4.06 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 23 G 8.47 3.56 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 0.00 0.00 0.00 24 H 8.30 4.17 0.00 3.23 3.21 0.00 5.82 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 25 G 8.43 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 0.00 0.00 0.00 26 Q 8.33 3.90 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.54 0.00 27 D 8.04 4.29 0.00 2.65 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 28 I 7.94 3.64 1.94 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 1.51 0.78 0.88 0.00 0.00 29 L 7.80 3.43 0.00 1.34 0.93 0.80 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.81 3.62 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.89 0.88 0.00 0.00 31 R 8.05 3.79 0.00 1.91 2.08 0.00 3.02 0.00 0.00 2.87 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 32 L 7.91 3.91 0.00 1.70 1.39 1.05 1.11 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 33 F 8.03 4.58 0.00 3.04 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.00 4.07 0.00 2.17 2.15 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.34 7.81 35 S 8.24 4.23 0.00 3.74 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 H 8.25 4.69 0.00 3.03 2.77 0.00 5.62 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.63 0.00 2.16 2.11 0.00 3.83 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 38 E 8.28 4.13 0.00 2.31 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 0.00 2.34 2.62 0.00 39 T 8.10 3.82 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 0.80 0.00 0.00 40 L 8.00 3.85 0.00 1.83 1.67 -0.29 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.97 4.04 0.00 2.16 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 2.36 2.51 0.00 42 K 7.92 4.34 0.00 1.48 1.37 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.17 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.62 1.78 7.81 43 F 7.98 4.61 0.00 2.99 2.50 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 44 D 8.69 4.34 0.00 2.59 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 45 R 7.53 4.71 0.00 1.78 1.74 0.00 3.22 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.17 0.00 46 F 7.74 5.20 0.00 2.75 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 47 K 8.00 3.94 0.00 1.76 2.15 0.00 1.46 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.03 7.81 48 H 7.90 4.74 0.00 3.16 3.35 0.00 5.89 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 49 L 7.85 4.27 0.00 1.72 1.62 1.00 0.76 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 50 K 8.68 4.37 0.00 2.05 1.86 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.41 1.23 7.81 51 T 7.36 4.72 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 1.21 0.00 0.00 52 E 8.80 3.90 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 53 A 7.94 3.97 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 8.19 3.95 0.00 2.10 2.04 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 2.35 2.35 0.00 55 M 8.19 4.14 0.00 2.02 2.24 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.52 0.00 56 K 8.13 3.98 0.00 1.78 1.80 0.00 1.62 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.46 7.81 57 A 7.62 4.50 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.44 4.27 0.00 3.90 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 59 E 8.89 3.99 0.00 2.09 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 2.41 2.38 0.00 60 D 8.14 4.44 0.00 2.94 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 61 L 8.15 3.47 0.00 0.94 1.49 0.60 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.06 3.87 0.00 1.94 1.97 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.46 7.81 63 K 8.44 4.02 0.00 2.09 1.91 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.50 1.69 7.81 64 H 8.81 4.29 0.00 3.41 3.47 0.00 5.63 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 65 G 8.40 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 0.00 0.00 0.00 66 V 7.88 3.64 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 1.14 0.00 0.00 1.00 0.00 0.00 67 T 8.14 3.90 4.47 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 1.27 0.00 0.00 68 V 8.17 3.65 2.15 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 1.18 0.00 0.00 1.06 0.00 0.00 69 L 8.18 4.28 0.00 1.81 1.85 0.83 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.43 3.96 4.47 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 1.26 0.00 0.00 71 A 8.06 4.01 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 72 L 8.25 3.75 0.00 1.61 1.66 0.15 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.53 3.20 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 74 A 7.79 4.00 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 75 I 7.56 3.79 1.90 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 1.55 0.64 0.94 0.00 0.00 76 L 7.90 4.02 0.00 1.11 1.56 -0.09 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.76 3.96 0.00 1.70 1.80 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.49 7.81 78 K 7.85 4.00 0.00 1.79 1.82 0.00 1.77 0.00 0.00 1.56 0.00 0.00 3.13 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.62 1.75 7.81 79 K 8.36 2.00 0.00 1.18 0.74 0.00 1.28 0.00 0.00 1.59 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.63 1.05 7.81 80 G 7.92 3.91 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 0.00 0.00 0.00 81 H 7.37 4.55 0.00 3.11 3.20 0.00 5.79 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 82 H 7.32 5.39 0.00 3.26 3.43 0.00 5.66 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.61 3.92 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 84 A 7.91 4.03 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.11 4.15 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 86 L 8.33 4.25 0.00 1.80 1.67 0.97 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 87 K 8.27 3.91 0.00 1.95 1.91 0.00 1.87 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.51 7.81 88 P 0.00 4.29 0.00 2.24 2.11 0.00 3.81 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 2.14 2.16 0.00 89 L 7.55 4.05 0.00 1.84 1.89 0.99 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.32 4.20 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 91 Q 8.33 3.92 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 92 S 8.16 4.03 0.00 4.01 4.12 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 0.00 0.00 0.00 93 H 8.74 4.17 0.00 3.60 3.65 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 94 A 8.01 2.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.50 3.96 4.12 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 0.00 0.00 1.13 0.00 0.00 96 K 7.45 4.14 0.00 1.55 1.67 0.00 1.69 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.22 1.34 7.81 97 H 7.96 4.29 0.00 3.04 3.20 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.46 3.17 0.00 1.75 1.67 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.00 1.19 7.81 99 I 8.05 4.34 2.14 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.02 1.21 0.00 0.00 100 P 0.00 4.67 0.00 1.95 1.99 0.00 3.20 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.32 0.00 101 I 8.58 3.66 1.77 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.65 0.79 0.00 0.00 102 K 7.79 4.01 0.00 1.60 1.91 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.26 1.19 7.81 103 Y 7.83 4.05 0.00 3.22 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 0.00 104 L 7.93 4.18 0.00 1.83 1.84 0.74 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.26 4.03 0.00 2.06 2.04 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 2.34 2.45 0.00 106 F 8.10 4.63 0.00 3.18 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 0.00 107 I 8.29 3.89 2.02 0.00 0.00 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 1.58 1.61 1.12 0.00 0.00 108 S 8.36 4.20 0.00 4.21 3.99 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 0.00 109 E 8.66 4.06 0.00 2.31 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 0.00 2.43 2.59 0.00 110 A 8.16 4.02 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.09 3.67 2.13 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 1.60 0.83 1.04 0.00 0.00 112 I 8.02 3.95 2.13 0.00 0.00 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 1.78 1.06 1.10 0.00 0.00 113 H 8.55 4.13 0.00 3.27 3.53 0.00 5.59 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 0.00 114 V 8.07 3.53 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 0.90 0.00 0.00 1.00 0.00 0.00 115 L 8.14 3.86 0.00 1.50 0.64 0.82 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.43 4.49 0.00 3.51 3.45 0.00 5.95 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.06 4.18 0.00 3.90 3.82 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 0.00 0.00 0.00 0.00 118 R 7.82 4.11 0.00 1.55 1.54 0.00 2.70 0.00 0.00 2.93 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 119 H 8.20 5.04 0.00 3.18 3.18 0.00 5.62 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 0.00 120 P 0.00 4.24 0.00 2.17 2.19 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 2.04 1.90 0.00 121 G 8.08 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 0.00 122 D 8.19 5.03 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 0.00 123 F 8.03 5.19 0.00 2.96 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 0.00 124 G 7.74 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 0.00 125 A 8.48 3.88 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 0.00 126 D 7.97 4.21 0.00 2.67 2.69 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 0.00 0.00 0.00 0.00 127 A 7.86 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 0.00 128 Q 8.10 3.37 0.00 1.95 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.16 1.54 0.00 129 G 8.30 3.54 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 0.00 0.00 0.00 130 A 8.00 3.83 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 0.00 131 M 8.35 3.99 0.00 2.42 2.42 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.91 0.00 132 N 8.68 4.35 0.00 2.89 2.85 0.00 0.00 7.04 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 0.00 133 K 8.17 4.06 0.00 1.76 1.71 0.00 1.53 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.53 7.81 134 A 8.03 3.86 1.20 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 0.00 135 L 8.31 4.09 0.00 1.75 1.82 1.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.58 3.98 0.00 2.22 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 2.34 2.41 0.00 137 L 8.32 3.97 0.00 1.87 1.98 0.99 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.40 4.14 0.00 3.03 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 8.32 3.50 0.00 1.99 1.85 0.00 3.19 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 2.03 0.00 140 K 8.40 3.81 0.00 1.80 1.97 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.45 7.81 141 D 8.27 4.35 0.00 2.76 2.69 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 0.00 0.00 0.00 0.00 142 I 7.66 3.49 1.25 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.02 0.14 0.00 0.00 143 A 7.96 3.64 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 A 7.95 3.93 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 0.00 145 K 8.03 4.13 0.00 2.00 1.93 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.63 7.81 146 Y 8.51 4.41 0.00 3.10 3.22 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 0.00 147 K 8.23 4.11 0.00 2.00 1.87 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.66 1.61 7.81 148 E 8.06 3.99 0.00 2.16 2.04 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 2.36 2.52 0.00 149 L 7.77 4.39 0.00 1.83 1.70 1.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 150 G 8.23 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 0.00 151 Y 8.02 4.75 0.00 2.65 2.81 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 0.00 0.00 0.00 152 Q 8.26 4.48 0.00 1.92 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.21 2.21 0.00 153 G 6.13 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 0.00 0.00 0.00