NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5293 8.3044 120.2871 55.2978 33.8645 173.9524 3 V 4.2019 8.0722 121.7695 59.8912 33.6613 172.9237 4 W 4.5833 9.1658 135.0000 57.5009 31.6005 174.8992 5 T 4.1372 8.2859 124.0754 61.5134 67.0744 172.4776 6 P 4.5682 0.0000 0.0000 63.0097 32.2198 175.4969 7 V 4.1154 7.4910 119.9177 62.5794 33.2527 175.2672 8 N 4.1982 8.6393 125.1006 54.9271 36.0169 173.7089 9 N 4.9176 7.5824 108.3539 52.9221 40.2097 174.1464 10 K 4.0713 8.2817 116.0042 56.5403 32.6876 176.6397 11 M 4.9236 8.3336 121.3194 54.0082 34.9866 175.4489 12 F 4.5720 8.1138 116.4537 57.2788 41.1078 176.4005 13 E 3.4889 8.4288 121.9347 57.3030 27.9028 175.3480 14 T 3.9494 8.3154 122.1859 66.2049 68.9574 174.4096 15 F 4.4884 9.0104 123.7124 57.7167 36.6719 176.4300 16 S 4.4788 8.2973 114.9270 60.3479 63.0047 174.4841 17 Y 4.3572 8.2726 117.3757 58.1844 38.1851 175.0520 18 L 4.6813 7.6073 120.2945 52.1220 43.6755 174.4643 19 P 4.4412 0.0000 0.0000 61.8428 31.7701 174.9914 20 P 4.2899 0.0000 0.0000 62.9109 31.7476 176.4414 21 L 4.0193 8.3201 122.7753 54.6531 42.2567 177.9328 22 T 4.2154 8.1953 113.9672 61.1555 71.0482 175.1741 23 D 4.4051 8.6289 121.2085 57.8941 40.7780 179.1865 24 E 3.9661 8.0841 118.3424 59.4567 29.5853 179.2878 25 Q 3.9330 7.9517 118.0939 58.7813 28.7577 178.7235 26 I 3.7426 8.1761 121.0762 64.4421 37.1499 178.1411 27 A 4.0569 8.2787 121.4880 55.3566 18.1330 179.5947 28 A 3.9683 8.0295 119.1211 55.3831 18.4285 179.9192 29 Q 4.1581 8.1392 116.5691 59.0997 28.8179 179.1355 30 V 3.7345 8.1354 119.3682 66.1651 31.5761 177.6987 31 D 4.4413 8.4610 118.8378 57.6311 40.4994 178.2919 32 Y 4.2153 8.1217 119.9168 60.6469 38.8146 177.9380 33 I 3.7870 7.9449 120.7973 64.6204 37.3664 178.6139 34 V 3.5310 7.9010 118.5677 65.9388 31.1621 177.8054 35 A 3.9437 8.1593 119.8531 54.6493 18.2541 178.3467 36 N 4.1740 7.1344 111.9496 51.9962 38.7335 175.5779 37 G 3.7624 7.2451 108.1465 46.1864 0.0000 174.1782 38 W 4.9613 7.5354 118.9290 56.0320 30.7132 176.2865 39 I 4.5032 8.8420 123.2121 59.2473 37.9160 174.0389 40 P 4.8885 0.0000 0.0000 63.2186 32.9125 174.8317 41 C 5.0069 8.8424 120.0658 58.4853 35.5710 172.4240 42 L 5.3411 8.7293 123.6515 53.2687 44.5013 175.2008 43 E 5.6335 9.2508 120.6871 55.0038 34.2568 174.4835 44 F 5.6327 9.1129 116.1540 55.9433 42.1390 172.9645 45 A 4.4821 8.2832 120.0114 50.1708 22.5942 176.2691 46 E 4.3208 8.5995 118.6301 55.6562 30.7871 177.7215 47 A 4.2673 8.8402 122.6101 55.8373 18.3693 179.7092 48 D 4.5923 8.1409 112.9291 56.2635 41.0213 177.1293 49 K 4.6216 7.9556 117.2784 56.0126 32.8503 176.7886 50 A 3.8580 7.7123 124.2527 53.9268 18.8750 178.2477 51 Y 4.7126 7.3900 111.1743 55.6924 40.2796 176.0794 52 V 3.9783 8.2830 116.0878 62.2853 32.2252 175.5988 53 S 4.7585 8.8323 116.6618 56.7231 66.3774 173.8721 54 N 5.1732 8.5493 114.4893 52.7711 39.0664 176.2470 55 E 3.9741 8.2129 121.0387 59.7621 29.5425 179.1310 56 S 4.0585 8.7998 115.4028 60.4731 62.8382 175.9623 57 A 2.5800 7.6011 123.3832 53.5390 17.7263 179.0500 58 I 3.5460 7.0129 116.5783 63.5243 38.0583 177.1036 59 R 4.2860 7.5268 116.5043 55.6766 30.5149 176.2068 60 F 5.0732 7.1786 118.0168 55.8577 41.3828 177.1861 61 G 4.0107 8.2344 115.9659 46.2969 0.0000 175.2180 62 S 4.6243 8.4342 113.6524 58.7279 62.2230 174.4693 63 V 4.4518 7.2667 107.1934 61.1390 33.0986 177.8575 64 S 4.4742 8.2518 115.9769 60.0577 63.5289 173.5349 65 C 3.9594 8.1757 118.5507 61.6512 27.9575 173.1853 66 L 3.6419 8.4381 123.1597 55.6009 39.0802 173.1864 67 Y 4.3261 7.8374 119.3742 56.0192 39.8759 174.5246 68 Y 4.8154 7.1430 123.2798 56.3132 42.3307 174.7059 69 D 4.5141 8.8872 123.3014 55.2717 41.7494 177.0418 70 N 4.4497 8.9032 116.3622 54.1260 36.0608 176.0537 71 R 3.9311 7.9663 118.4860 59.3559 30.3409 177.1462 72 Y 4.3838 7.6782 114.6280 57.8958 38.4116 175.4750 73 W 5.0589 8.6778 124.8336 55.5059 32.1984 174.3639 74 T 4.4614 7.9182 115.3673 62.4477 69.9528 174.3030 75 M 4.5208 8.5228 126.2435 55.2485 33.1818 175.1602 76 W 4.7947 9.5352 135.0000 56.2751 31.3961 176.7359 77 K 3.4277 8.5637 128.4079 57.5597 30.6780 177.9859 78 L 4.9146 8.2550 124.6482 52.6829 45.1611 174.0280 79 P 4.3459 0.0000 0.0000 63.5623 32.2045 177.4449 80 M 4.2948 8.5645 123.1190 53.7045 30.4488 175.7195 81 F 4.5198 7.3508 118.5292 58.8121 40.0177 176.6057 82 G 3.9885 9.1330 112.7380 45.5588 0.0000 173.0087 83 C 4.2815 7.9679 120.9732 59.5995 31.6803 173.1285 84 R 4.5035 8.6633 124.1263 55.5952 31.0980 174.6748 85 D 4.8210 7.7699 119.0384 51.4729 42.0709 174.5865 86 P 4.3470 0.0000 0.0000 66.2961 31.1515 178.1864 87 M 4.1235 8.3017 118.3901 58.2416 31.8523 178.6259 88 Q 4.0498 7.9981 118.0488 58.8302 28.8749 179.0499 89 V 3.6008 7.7355 118.7190 66.0920 31.7332 177.8960 90 L 4.0332 7.9263 118.7310 57.9519 41.4330 179.7792 91 R 3.9702 8.1520 117.9803 59.3207 29.9308 178.9862 92 E 4.1453 8.2975 118.3151 59.1109 29.4670 179.2554 93 I 3.5221 7.8149 120.1126 64.3232 37.1645 178.5052 94 V 3.4778 7.6903 118.6436 65.9135 31.3805 177.9288 95 A 3.9257 7.9979 120.4587 55.1348 18.1980 179.1221 96 C 2.0000 7.6155 117.6793 62.1442 31.0798 176.0374 97 T 3.6946 7.4988 111.1868 64.4094 67.9987 176.3602 98 K 3.8248 7.7714 121.7999 59.2666 32.2851 178.4008 99 A 4.0210 7.6423 120.1208 53.3645 19.7507 177.5880 100 F 4.6773 7.8359 116.1263 55.0100 39.0610 173.8582 101 P 4.4619 0.0000 0.0000 63.9508 31.9438 177.8471 102 D 4.6502 8.0488 116.7608 53.9417 41.3261 175.6076 103 A 4.7219 7.3695 121.2025 50.6386 20.9749 177.1117 104 Y 4.2112 8.5711 117.7545 57.9095 39.4260 175.3209 105 V 5.2570 8.9002 123.0448 61.1554 35.2471 174.2690 106 R 4.9778 9.5122 123.9095 54.2606 33.0300 173.8261 107 L 4.7856 8.1225 123.6238 53.9854 43.8448 175.7055 108 V 4.7775 8.7068 118.3559 59.5547 36.4357 174.0762 109 A 4.8687 8.0813 121.3139 50.5455 22.8444 175.2298 110 F 5.2422 8.9405 118.8349 55.6941 42.8513 174.1293 111 D 5.3514 8.8357 122.4316 52.6844 42.3935 176.6280 112 N 4.7138 9.1760 123.2606 54.4373 38.3473 176.3983 113 Q 4.1987 8.7790 118.9050 58.9019 29.0384 177.6759 114 K 4.0080 8.3621 114.9212 57.2040 32.9167 176.6129 115 Q 3.4522 8.0541 118.4810 55.9808 26.9823 172.4571 116 V 4.5113 7.7634 117.4750 60.0419 35.0450 174.1725 117 Q 4.3074 8.7110 122.9570 56.4745 29.2649 175.5313 118 I 4.2273 8.1424 124.9008 61.1383 39.8264 174.4632 119 M 4.6365 6.7670 117.3963 54.6386 34.4195 173.7079 120 G 4.2724 8.3112 105.0718 46.1423 0.0000 172.4490 121 F 5.0365 7.6016 116.4884 55.2614 41.7010 173.0012 122 L 4.5486 8.8043 122.7479 55.5380 42.0172 176.7798 123 V 4.5217 9.0558 118.1103 61.4660 34.1174 175.6808 124 Q 4.6090 7.8310 121.2176 54.3781 32.4244 173.3356 125 R 4.2791 8.1035 121.2998 53.1207 32.7694 173.6998 126 P 4.2279 0.0000 0.0000 62.2106 31.9048 178.0003 127 K 4.1000 8.4159 120.8179 59.6521 32.7666 178.0573 128 T 3.9994 7.8250 112.7400 63.5876 67.6599 174.3156 129 A 4.2894 7.7915 124.8394 53.0408 18.6743 177.2625 130 R 4.6212 8.8116 120.5474 55.9129 31.5573 175.4855 131 D 4.9911 8.5233 116.3131 52.7395 39.6989 175.3072 132 F 5.4022 7.5641 112.1290 54.7692 41.0979 173.4032 133 Q 4.4590 8.3747 119.8094 52.9839 31.3899 174.2386 134 P 4.4982 0.0000 0.0000 62.3068 32.2929 176.9257 135 A 3.9529 8.8579 122.8545 55.6431 18.1635 179.2043 136 N 4.6580 8.0834 109.2866 53.8788 37.6801 175.4365 137 K 4.4461 7.8760 117.6228 56.3620 33.1625 177.3162 138 R 3.5774 7.6706 121.0064 57.7746 30.1377 176.6731 139 S 5.0678 7.4646 109.9873 56.3208 66.0678 174.2284 140 V 3.9920 8.5637 114.4370 61.7465 32.1907 175.6548 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 2 M 8.30 4.53 0.00 1.99 2.16 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.58 0.00 3 V 8.07 4.20 2.11 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 1.08 0.00 0.00 0.97 0.00 0.00 4 W 9.17 4.58 0.00 3.50 3.06 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 5 T 8.29 4.14 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 6 P 0.00 4.57 0.00 2.23 2.19 0.00 3.77 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 1.95 1.96 0.00 7 V 7.49 4.12 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 0.77 0.00 0.00 0.91 0.00 0.00 8 N 8.64 4.20 0.00 2.95 2.86 0.00 0.00 6.52 6.92 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 9 N 7.58 4.92 0.00 2.65 2.68 0.00 0.00 7.30 6.68 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 10 K 8.28 4.07 0.00 1.97 1.58 0.00 1.38 0.00 0.00 0.61 0.00 0.00 2.44 0.00 0.00 2.43 0.00 0.00 0.00 0.00 1.25 1.38 7.81 11 M 8.33 4.92 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.67 0.00 12 F 8.11 4.57 0.00 3.12 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 13 E 8.43 3.49 0.00 2.13 1.72 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 2.21 2.13 0.00 14 T 8.32 3.95 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 0.16 0.00 0.00 15 F 9.01 4.49 0.00 3.31 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 16 S 8.30 4.48 0.00 4.13 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 17 Y 8.27 4.36 0.00 3.04 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 18 L 7.61 4.68 0.00 1.83 1.61 0.87 1.09 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 19 P 0.00 4.44 0.00 2.03 2.00 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 20 P 0.00 4.29 0.00 2.04 2.02 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.17 0.00 21 L 8.32 4.02 0.00 1.56 1.50 0.76 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.20 4.22 4.37 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 1.18 0.00 0.00 23 D 8.63 4.41 0.00 2.70 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.08 3.97 0.00 2.03 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 2.39 2.45 0.00 25 Q 7.95 3.93 0.00 2.26 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 26 I 8.18 3.74 2.06 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 1.66 1.08 1.08 0.00 0.00 27 A 8.28 4.06 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 28 A 8.03 3.97 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 29 Q 8.14 4.16 0.00 2.57 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.44 2.04 0.00 30 V 8.14 3.73 2.30 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 1.13 0.00 0.00 1.07 0.00 0.00 31 D 8.46 4.44 0.00 2.98 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 32 Y 8.12 4.22 0.00 3.08 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 33 I 7.94 3.79 2.12 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 1.62 0.83 1.06 0.00 0.00 34 V 7.90 3.53 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 1.04 0.00 0.00 1.00 0.00 0.00 35 A 8.16 3.94 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 36 N 7.13 4.17 0.00 1.44 1.42 0.00 0.00 7.03 8.45 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 37 G 7.25 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 38 W 7.54 4.96 0.00 3.32 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 I 8.84 4.50 2.13 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.01 0.76 0.00 0.00 40 P 0.00 4.89 0.00 2.20 2.19 0.00 3.65 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 41 C 8.84 5.01 0.00 3.11 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 42 L 8.73 5.34 0.00 1.84 1.61 0.86 0.80 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 43 E 9.25 5.63 0.00 2.03 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 2.32 0.00 44 F 9.11 5.63 0.00 3.08 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.28 4.48 -0.23 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 0.00 0.00 0.00 46 E 8.60 4.32 0.00 2.18 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 2.29 2.28 0.00 47 A 8.84 4.27 1.50 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 48 D 8.14 4.59 0.00 2.70 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 49 K 7.96 4.62 0.00 1.59 1.66 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.42 7.81 50 A 7.71 3.86 0.46 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 51 Y 7.39 4.71 0.00 2.91 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 52 V 8.28 3.98 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 0.56 0.00 0.00 0.79 0.00 0.00 53 S 8.83 4.76 0.00 4.03 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 54 N 8.55 5.17 0.00 2.75 2.85 0.00 0.00 6.56 7.66 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 55 E 8.21 3.97 0.00 2.15 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 2.38 2.37 0.00 56 S 8.80 4.06 0.00 3.84 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 7.60 2.58 1.13 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 0.00 0.00 58 I 7.01 3.55 1.78 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 0.81 0.85 0.00 0.00 59 R 7.53 4.29 0.00 1.87 2.00 0.00 3.19 0.00 0.00 3.22 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 60 F 7.18 5.07 0.00 2.99 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 61 G 8.23 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 0.00 0.00 0.00 62 S 8.43 4.62 0.00 3.86 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 63 V 7.27 4.45 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.46 0.00 0.00 64 S 8.25 4.47 0.00 4.09 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 C 8.18 3.96 0.00 2.97 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 66 L 8.44 3.64 0.00 1.77 1.76 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 7.84 4.33 0.00 2.93 3.06 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 68 Y 7.14 4.82 0.00 2.80 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 69 D 8.89 4.51 0.00 2.79 2.66 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 70 N 8.90 4.45 0.00 3.05 3.23 0.00 0.00 6.98 7.66 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 71 R 7.97 3.93 0.00 1.50 1.69 0.00 3.07 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 72 Y 7.68 4.38 0.00 3.05 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 73 W 8.68 5.06 0.00 3.19 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 74 T 7.92 4.46 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 75 M 8.52 4.52 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.77 0.00 76 W 9.54 4.79 0.00 3.67 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 77 K 8.56 3.43 0.00 1.70 0.78 0.00 1.73 0.00 0.00 1.54 0.00 0.00 2.71 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.78 0.21 7.81 78 L 8.26 4.91 0.00 1.59 1.54 1.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.35 0.00 0.68 1.81 0.00 3.61 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.15 0.00 80 M 8.56 4.29 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 81 F 7.35 4.52 0.00 3.10 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 82 G 9.13 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 0.00 0.00 0.00 83 C 7.97 4.28 0.00 3.05 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 84 R 8.66 4.50 0.00 1.80 1.88 0.00 3.22 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 85 D 7.77 4.82 0.00 2.73 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 86 P 0.00 4.35 0.00 2.33 2.33 0.00 3.77 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 87 M 8.30 4.12 0.00 2.13 2.27 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.60 0.00 88 Q 8.00 4.05 0.00 2.33 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 89 V 7.74 3.60 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.03 0.00 0.00 90 L 7.93 4.03 0.00 1.90 1.72 0.95 1.04 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 91 R 8.15 3.97 0.00 2.07 2.01 0.00 3.14 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.94 0.00 92 E 8.30 4.15 0.00 2.25 2.16 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 2.60 2.65 0.00 93 I 7.81 3.52 2.00 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 1.34 1.04 0.85 0.00 0.00 94 V 7.69 3.48 2.21 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 0.97 0.00 0.00 0.94 0.00 0.00 95 A 8.00 3.93 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 96 C 7.62 2.00 0.00 1.23 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 0.00 0.00 0.00 97 T 7.50 3.69 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 1.14 0.00 0.00 98 K 7.77 3.82 0.00 1.79 1.95 0.00 1.76 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.38 1.39 7.81 99 A 7.64 4.02 1.23 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 0.00 0.00 0.00 100 F 7.84 4.68 0.00 2.80 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 0.00 101 P 0.00 4.46 0.00 2.12 2.10 0.00 3.26 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.87 0.00 102 D 8.05 4.65 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 0.00 103 A 7.37 4.72 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 0.00 104 Y 8.57 4.21 0.00 2.54 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 0.00 105 V 8.90 5.26 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 0.97 0.00 0.00 0.89 0.00 0.00 106 R 9.51 4.98 0.00 1.81 1.89 0.00 2.33 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.36 0.00 107 L 8.12 4.79 0.00 1.52 0.82 0.85 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.71 4.78 1.63 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 0.47 0.00 0.00 0.50 0.00 0.00 109 A 8.08 4.87 1.17 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 0.00 0.00 110 F 8.94 5.24 0.00 3.01 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 0.00 111 D 8.84 5.35 0.00 2.33 2.43 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 0.00 112 N 9.18 4.71 0.00 2.93 3.05 0.00 0.00 6.33 7.39 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 0.00 113 Q 8.78 4.20 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.05 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 114 K 8.36 4.01 0.00 1.75 1.87 0.00 2.03 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.47 7.81 115 Q 8.05 3.45 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 116 V 7.76 4.51 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 0.49 0.00 0.00 0.91 0.00 0.00 117 Q 8.71 4.31 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.86 0.00 0.00 0.00 0.00 0.00 2.16 1.98 0.00 118 I 8.14 4.23 1.22 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.58 -0.47 0.00 0.00 119 M 6.77 4.64 0.00 2.22 2.29 0.00 0.00 0.00 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.74 0.00 120 G 8.31 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 F 7.60 5.04 0.00 3.23 3.27 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 0.00 122 L 8.80 4.55 0.00 1.55 1.61 0.61 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 123 V 9.06 4.52 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 0.72 0.00 0.00 0.89 0.00 0.00 124 Q 7.83 4.61 0.00 1.99 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.79 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 125 R 8.10 4.28 0.00 1.27 1.52 0.00 2.55 0.00 0.00 2.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.29 0.00 126 P 0.00 4.23 0.00 2.07 2.00 0.00 2.62 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.81 0.00 127 K 8.42 4.10 0.00 1.87 1.93 0.00 1.56 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.42 7.81 128 T 7.83 4.00 4.26 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 1.22 0.00 0.00 129 A 7.79 4.29 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.81 4.62 0.00 1.79 1.86 0.00 3.32 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.53 0.00 131 D 8.52 4.99 0.00 2.89 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 0.00 132 F 7.56 5.40 0.00 3.21 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 Q 8.37 4.46 0.00 1.88 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.06 0.00 0.00 0.00 0.00 0.00 2.28 2.04 0.00 134 P 0.00 4.50 0.00 2.33 2.19 0.00 3.56 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.89 0.00 135 A 8.86 3.95 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 0.00 136 N 8.08 4.66 0.00 2.83 2.94 0.00 0.00 5.84 7.13 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 0.00 137 K 7.88 4.45 0.00 1.73 1.71 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.30 1.43 7.81 138 R 7.67 3.58 0.00 1.48 0.66 0.00 3.06 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.53 0.00 139 S 7.46 5.07 0.00 4.06 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 V 8.56 3.99 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 0.61 0.00 0.00 0.95 0.00 0.00