NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 V 3.6730 8.0544 120.3980 63.7654 33.2279 176.8684 10 F 3.3541 7.9439 118.1961 56.6198 36.8037 174.0698 11 S 4.2450 7.8535 123.9388 57.9633 65.7594 174.1047 12 E 3.8270 8.4535 122.3765 59.2929 29.4800 178.5426 13 E 3.8611 7.9730 118.1209 59.5140 29.6151 179.4591 14 K 3.6972 7.4278 117.7850 59.0702 31.9407 178.8519 15 E 3.9543 7.8728 119.4662 59.4956 29.5446 178.9247 16 A 4.0923 7.9491 120.5269 54.9713 18.2539 179.6364 17 L 3.9519 7.7229 117.1164 57.9080 41.6675 179.8607 18 V 3.3706 7.6970 118.0701 65.9161 31.4209 178.0381 19 L 4.1851 8.4615 119.3193 57.8028 41.1121 179.6662 20 K 4.2095 8.2420 118.6168 59.3366 32.6282 179.4333 21 S 4.2476 8.1818 115.8748 61.1502 63.4300 176.1236 22 W 4.7381 9.1618 132.5889 60.1877 30.1387 177.4828 23 A 3.8439 8.0348 119.9953 55.2192 17.8899 179.5516 24 I 3.8151 7.2544 117.6619 64.9650 37.2943 178.6864 25 M 4.1225 8.2400 119.4610 58.0239 31.5342 178.4407 26 K 2.8380 7.6704 119.5469 59.2579 32.1506 178.1767 27 K 4.2402 7.3737 116.0618 57.5840 32.1472 177.1143 28 D 4.7800 8.1820 118.4123 53.0906 42.6625 176.9329 29 S 4.2937 8.4020 115.6330 60.9373 62.5756 175.9525 30 A 3.9649 7.9720 123.9916 55.1227 18.2317 178.8669 31 N 4.2137 8.0297 114.8923 56.9087 39.0457 176.8990 32 L 3.8284 8.0859 120.7259 57.5332 41.5859 179.7992 33 G 3.5044 8.0244 106.0286 47.4831 0.0000 175.5777 34 L 3.9800 7.6384 122.9009 58.0691 42.1879 179.0905 35 R 3.8860 8.0472 118.0747 59.2407 29.9885 178.6480 36 F 4.5393 8.2889 121.7721 61.0785 39.4420 177.3533 37 F 3.1417 8.2451 117.1573 60.0116 38.6347 177.8217 38 L 4.1384 8.3230 119.2003 57.4741 41.3695 179.4751 39 K 3.9215 8.0999 119.7376 59.3774 32.0998 178.6754 40 I 3.4804 7.2401 120.0935 64.6748 36.8221 178.3378 41 F 4.7292 7.5438 117.5210 59.8538 38.4879 177.6039 42 E 4.0137 8.0307 118.9822 59.1664 29.5106 178.5572 43 I 4.0184 7.7605 118.6712 63.0074 38.7820 176.6138 44 A 4.7106 8.0546 123.2660 48.4145 18.9570 174.2195 45 P 4.6397 0.0000 0.0000 64.4430 31.8327 178.0659 46 S 4.1722 8.2102 112.4307 61.3231 62.8333 176.1920 47 A 4.1596 8.3511 124.3398 54.8700 18.0391 179.2646 48 R 3.0694 7.9133 117.2226 59.7840 29.7800 178.6574 49 Q 4.0421 7.7293 115.6251 58.5262 28.7132 177.8481 50 M 4.2422 7.8371 118.3010 56.0079 32.4496 175.5148 51 F 4.2438 7.6181 118.7562 55.0101 39.6686 174.4718 52 P 4.2213 0.0000 0.0000 65.7141 31.2247 178.1053 53 F 4.5646 7.9403 109.3294 57.8783 37.8909 175.3522 54 L 4.3253 7.5640 120.6284 54.6065 42.4734 176.6596 55 R 4.2775 7.5431 118.1165 56.7190 29.1792 175.7647 56 D 5.8301 8.3227 135.0000 55.0989 43.5948 177.2353 57 S 4.7165 7.8695 116.4704 58.7700 60.8518 172.5638 58 D 4.6112 7.9243 123.6228 55.2938 41.7414 177.5640 59 V 4.0615 7.2885 112.8441 58.8516 32.6125 174.4314 60 P 4.3847 0.0000 0.0000 62.3400 32.2472 177.2032 61 L 4.0138 8.7525 122.1235 58.1688 41.7103 179.5761 62 E 4.1183 8.2814 116.5424 58.5625 29.5215 177.5607 63 T 4.3093 7.5399 106.9338 61.4471 70.6710 173.6848 64 N 4.1278 7.6142 120.0656 53.4073 39.4219 172.9406 65 P 4.2065 0.0000 0.0000 65.7995 31.5751 178.7965 66 K 3.7083 7.9987 116.6245 59.0742 31.9048 178.9276 67 L 3.9792 8.3212 120.6744 58.1661 42.1169 179.2352 68 K 3.9527 7.7857 117.9776 59.7205 31.8271 179.5359 69 T 3.8052 7.5116 116.0538 66.7634 68.3580 176.2975 70 H 3.9343 8.0481 119.8712 59.1517 29.8795 177.1941 71 A 3.2009 8.1085 123.1961 54.8025 18.0734 179.9963 72 V 3.7826 7.7002 117.5842 64.9246 31.4637 178.5464 73 S 4.0996 7.8516 113.7926 61.1828 62.3006 176.4339 74 V 3.7314 7.9538 120.9134 65.8724 31.3239 177.5624 75 F 4.2786 9.0508 120.9474 61.5393 39.1926 177.2381 76 V 3.4882 8.3824 118.0502 66.1288 31.3603 177.4216 77 M 3.9446 8.1769 117.8984 59.0615 32.0044 178.3568 78 T 3.8095 7.9113 115.5672 66.9617 68.6330 176.5847 79 C 3.9991 7.5643 118.5713 62.5672 27.8962 176.0670 80 E 3.6764 7.8884 120.2574 58.8838 28.7749 179.0903 81 A 3.9346 7.6814 119.9463 55.0438 18.6854 179.2519 82 A 3.6375 7.8729 119.0110 55.1482 18.2158 179.7670 83 A 3.9622 7.9232 117.9798 54.2473 18.7023 178.7332 84 Q 4.3717 7.6566 114.9950 55.7906 28.9003 177.3752 85 L 3.9496 7.2859 122.6275 58.0863 42.2139 178.8421 86 R 3.7935 7.8998 118.0496 59.3884 30.0206 177.9482 87 K 3.8020 8.1039 117.7889 59.2932 32.2099 177.2025 88 A 4.1251 8.3822 120.2046 52.2587 18.9356 178.2638 89 G 3.9323 8.6038 102.8985 45.5192 0.0000 173.1171 90 K 4.3837 7.0977 116.4374 55.3982 35.4752 175.3104 91 I 3.7704 8.1432 121.3047 61.3950 37.4362 175.9344 92 T 4.7036 8.2020 114.5459 59.7357 71.4438 173.5742 93 V 4.3611 8.0789 115.1846 59.5279 35.0909 175.4843 94 R 4.3154 8.6145 122.7309 57.0098 30.4470 175.1226 95 E 4.1036 10.0658 123.8401 56.5888 26.6047 174.5188 96 T 4.6618 7.3663 114.4680 61.8428 72.5342 173.1136 97 T 4.7552 8.0651 110.6791 59.6920 73.0022 174.2863 98 L 3.9334 8.4889 121.8173 58.0202 41.5743 179.8523 99 K 4.0597 7.9634 118.7085 59.6093 32.2196 178.5827 100 R 3.9549 8.0381 118.3102 59.4604 30.0287 178.7227 101 L 4.1983 8.2224 118.6821 57.9691 41.6438 179.8730 102 G 3.8165 8.4720 105.6785 47.8381 0.0000 175.5041 103 G 3.7950 8.2406 108.6134 47.9593 0.0000 175.5455 104 T 4.0119 8.2244 118.9305 66.7219 68.6267 176.5787 105 H 4.2785 8.5332 117.7635 58.4094 28.6887 177.7733 106 L 4.0371 8.4773 123.0377 58.1325 41.7465 179.1428 107 K 3.9776 8.1438 117.4528 59.2090 32.0102 177.9597 108 Y 4.3140 8.0976 114.5062 57.0496 38.0873 175.4547 109 G 3.7584 7.8662 107.7868 46.5529 0.0000 174.3522 110 V 3.5901 7.9078 119.9406 61.7245 32.1582 175.2579 111 A 4.7910 8.4808 129.6363 50.3711 21.5455 176.8364 112 D 4.8012 8.9067 119.2297 57.9780 40.7823 179.8659 113 G 3.7278 8.0603 105.3685 45.6086 0.0000 175.4429 114 H 4.2152 7.8658 118.1522 58.9977 28.7068 177.9115 115 F 4.5453 8.0934 119.0219 60.4816 38.5951 177.5577 116 E 4.1230 8.4855 118.5429 59.4109 29.2377 179.4253 117 V 3.6717 7.9041 118.2321 66.4609 31.5853 178.1325 118 T 3.8395 8.2383 115.5640 66.5119 68.2456 176.4863 119 R 2.8718 8.2461 120.6415 59.0875 30.0208 178.2619 120 F 3.9834 8.1951 120.0142 61.3748 39.4244 176.8946 121 A 3.9982 8.4676 120.5897 54.9953 18.0266 179.4466 122 L 3.4786 8.1637 118.9608 58.1793 42.1125 179.2274 123 L 3.9274 7.8083 118.9648 57.7845 41.6542 179.3411 124 E 3.5955 7.9796 118.7452 59.4668 29.1824 179.6108 125 T 3.7307 7.7273 115.7492 66.4906 68.4201 176.8459 126 I 3.4337 7.6872 121.9444 64.0596 37.1150 177.9807 127 K 2.4800 7.1874 120.4785 59.3600 31.5302 177.9350 128 E 4.0440 7.4173 114.2287 57.3455 29.5657 177.7587 129 A 4.3919 7.6613 120.2456 51.1719 20.0061 176.7125 130 L 4.8044 6.7970 116.3643 51.5502 45.0345 174.8002 131 P 4.2753 0.0000 0.0000 62.8563 32.0696 177.5793 132 A 4.2007 8.6710 124.2378 55.1552 18.6661 179.5817 133 D 4.4616 8.2108 115.0850 57.7138 40.9398 177.4220 134 M 4.3150 8.0178 116.2968 55.9048 32.4570 175.9504 135 W 4.7229 8.2720 128.5575 54.7897 32.4537 175.4321 136 G 3.9551 6.0909 113.6170 43.5258 0.0000 171.4931 137 P 4.0066 0.0000 0.0000 65.5164 30.9379 178.6436 138 E 3.8157 7.8342 118.2261 59.3802 29.3640 178.5606 139 M 3.9437 7.5770 117.6623 58.5624 32.2759 177.9268 140 R 3.7512 7.2257 118.9495 59.5717 30.2071 178.2445 141 N 4.3523 8.2160 116.0001 56.0864 38.5183 177.1987 142 A 4.0260 8.0366 122.1876 55.1614 18.4101 179.8061 143 W 4.2008 8.1626 117.4755 59.7477 29.0180 179.0783 144 G 3.7266 8.7022 106.1638 48.0051 0.0000 175.6971 145 E 4.0583 8.8897 121.5011 58.8724 29.4629 179.2502 146 A 3.5176 8.0915 120.8920 55.1293 18.3559 178.9543 147 Y 3.9864 8.3173 118.2134 61.0777 38.7789 178.0711 148 D 4.3589 8.6159 120.0712 57.5893 40.9294 178.9467 149 Q 3.8689 7.9836 118.5055 58.5219 28.6636 178.4173 150 L 3.7494 7.7916 121.4688 58.1419 42.1465 179.2787 151 V 3.0128 7.5985 118.2814 65.6376 31.3743 177.7002 152 A 3.8674 8.0442 120.6442 55.1674 17.9416 179.5219 153 A 3.9322 7.7198 118.2718 55.1202 18.6992 179.6918 154 I 3.8034 7.5740 118.5284 64.4664 37.1810 178.8172 155 K 4.0406 8.3476 119.6878 59.4010 31.5508 179.4312 156 Q 4.0782 7.7337 117.3227 58.3659 28.6120 176.9342 157 E 4.4419 7.7562 117.1746 56.6628 29.5287 176.5049 158 M 4.5975 7.8685 117.5278 54.9315 32.9905 175.6975 159 K 4.7326 7.5779 117.1722 53.3444 35.9386 174.3049 160 P 4.4225 0.0000 0.0000 63.2709 31.2129 176.5196 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 9 V 8.05 3.67 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 0.95 0.00 0.00 0.94 0.00 0.00 10 F 7.94 3.35 0.00 3.00 3.33 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 11 S 7.85 4.25 0.00 3.94 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 12 E 8.45 3.83 0.00 2.00 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 2.33 2.36 0.00 13 E 7.97 3.86 0.00 1.90 1.87 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 2.33 2.33 0.00 14 K 7.43 3.70 0.00 0.79 0.93 0.00 1.17 0.00 0.00 1.26 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.17 1.09 7.81 15 E 7.87 3.95 0.00 2.12 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 2.33 2.40 0.00 16 A 7.95 4.09 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 17 L 7.72 3.95 0.00 1.81 1.75 0.83 0.70 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 18 V 7.70 3.37 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 0.52 0.00 0.00 0.33 0.00 0.00 19 L 8.46 4.19 0.00 1.73 1.78 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.24 4.21 0.00 2.08 2.12 0.00 1.35 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.76 1.55 7.81 21 S 8.18 4.25 0.00 4.34 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 W 9.16 4.74 0.00 3.75 3.37 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 23 A 8.03 3.84 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 24 I 7.25 3.82 2.10 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 1.53 0.94 0.96 0.00 0.00 25 M 8.24 4.12 0.00 2.44 2.47 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.61 0.00 26 K 7.67 2.84 0.00 0.79 1.26 0.00 1.52 0.00 0.00 1.52 0.00 0.00 2.41 0.00 0.00 2.25 0.00 0.00 0.00 0.00 1.12 0.87 7.81 27 K 7.37 4.24 0.00 1.79 1.78 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.38 1.44 7.81 28 D 8.18 4.78 0.00 2.64 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 0.00 0.00 0.00 0.00 29 S 8.40 4.29 0.00 4.55 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.97 3.96 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 31 N 8.03 4.21 0.00 2.81 3.20 0.00 0.00 7.11 6.66 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 32 L 8.09 3.83 0.00 1.18 0.87 1.02 1.03 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 33 G 8.02 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 34 L 7.64 3.98 0.00 1.72 1.80 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 35 R 8.05 3.89 0.00 1.98 1.92 0.00 3.09 0.00 0.00 3.01 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.88 0.00 36 F 8.29 4.54 0.00 2.90 3.32 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 37 F 8.25 3.14 0.00 3.05 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 38 L 8.32 4.14 0.00 1.82 1.75 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.10 3.92 0.00 1.94 1.95 0.00 1.61 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.55 7.81 40 I 7.24 3.48 0.92 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 1.06 -0.14 0.54 0.00 0.00 41 F 7.54 4.73 0.00 3.05 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 42 E 8.03 4.01 0.00 2.08 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 0.00 2.35 2.37 0.00 43 I 7.76 4.02 2.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.79 0.88 0.00 0.00 44 A 8.05 4.71 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 45 P 0.00 4.64 0.00 2.19 2.16 0.00 3.92 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 2.14 2.17 0.00 46 S 8.21 4.17 0.00 4.07 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 47 A 8.35 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 48 R 7.91 3.07 0.00 1.49 1.79 0.00 2.92 0.00 0.00 2.94 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.86 0.00 49 Q 7.73 4.04 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 50 M 7.84 4.24 0.00 1.55 2.06 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 2.53 2.57 0.00 51 F 7.62 4.24 0.00 2.72 1.74 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 52 P 0.00 4.22 0.00 2.31 2.21 0.00 3.54 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 53 F 7.94 4.56 0.00 3.14 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 54 L 7.56 4.33 0.00 1.59 1.39 0.25 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 55 R 7.54 4.28 0.00 1.80 1.87 0.00 3.28 0.00 0.00 3.50 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 56 D 8.32 5.83 0.00 2.78 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 57 S 7.87 4.72 0.00 3.95 3.89 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 0.00 58 D 7.92 4.61 0.00 2.74 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 59 V 7.29 4.06 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 0.70 0.00 0.00 0.99 0.00 0.00 60 P 0.00 4.38 0.00 2.18 2.02 0.00 3.62 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 61 L 8.75 4.01 0.00 1.74 1.80 0.98 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.28 4.12 0.00 1.94 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 2.33 2.39 0.00 63 T 7.54 4.31 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 64 N 7.61 4.13 0.00 2.93 2.86 0.00 0.00 7.01 7.59 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 65 P 0.00 4.21 0.00 2.16 2.06 0.00 3.65 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 66 K 8.00 3.71 0.00 1.76 0.99 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.13 1.31 7.81 67 L 8.32 3.98 0.00 1.93 1.87 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.79 3.95 0.00 1.78 1.81 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.73 7.81 69 T 7.51 3.81 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 1.15 0.00 0.00 70 H 8.05 3.93 0.00 2.93 3.20 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 71 A 8.11 3.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 7.70 3.78 2.12 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 0.99 0.00 0.00 1.06 0.00 0.00 73 S 7.85 4.10 0.00 3.92 4.09 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 74 V 7.95 3.73 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 1.38 0.00 0.00 1.04 0.00 0.00 75 F 9.05 4.28 0.00 3.52 3.30 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 76 V 8.38 3.49 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 1.19 0.00 0.00 1.31 0.00 0.00 77 M 8.18 3.94 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.60 0.00 78 T 7.91 3.81 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 1.31 0.00 0.00 79 C 7.56 4.00 0.00 1.36 1.18 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 80 E 7.89 3.68 0.00 1.94 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 2.38 2.29 0.00 81 A 7.68 3.93 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 82 A 7.87 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.92 3.96 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 84 Q 7.66 4.37 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 85 L 7.29 3.95 0.00 1.57 1.34 0.78 0.30 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 86 R 7.90 3.79 0.00 2.17 2.13 0.00 3.41 0.00 0.00 3.41 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 87 K 8.10 3.80 0.00 1.76 1.84 0.00 1.83 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.46 7.81 88 A 8.38 4.13 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 89 G 8.60 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 90 K 7.10 4.38 0.00 1.62 1.72 0.00 1.59 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.46 1.35 7.81 91 I 8.14 3.77 1.78 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.83 0.82 0.00 0.00 92 T 8.20 4.70 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 1.17 0.00 0.00 93 V 8.08 4.36 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 0.71 0.00 0.00 0.95 0.00 0.00 94 R 8.61 4.32 0.00 1.74 1.85 0.00 3.27 0.00 0.00 3.40 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 95 E 10.07 4.10 0.00 2.14 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 0.00 2.18 2.31 0.00 96 T 7.37 4.66 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 1.25 0.00 0.00 97 T 8.07 4.76 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 98 L 8.49 3.93 0.00 1.70 1.77 0.88 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.96 4.06 0.00 1.83 1.81 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.52 1.67 7.81 100 R 8.04 3.95 0.00 2.07 2.02 0.00 3.22 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 101 L 8.22 4.20 0.00 1.92 1.85 0.96 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 102 G 8.47 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 0.00 0.00 0.00 103 G 8.24 3.79 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 0.00 0.00 0.00 104 T 8.22 4.01 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 1.21 0.00 0.00 105 H 8.53 4.28 0.00 3.46 3.49 0.00 5.81 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 0.00 106 L 8.48 4.04 0.00 1.99 1.86 1.04 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 107 K 8.14 3.98 0.00 2.00 1.63 0.00 1.76 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.45 7.81 108 Y 8.10 4.31 0.00 2.90 2.82 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 0.00 109 G 7.87 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 0.00 110 V 7.91 3.59 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 0.09 0.00 0.00 0.83 0.00 0.00 111 A 8.48 4.79 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 0.00 112 D 8.91 4.80 0.00 2.85 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 0.00 113 G 8.06 3.73 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 0.00 0.00 0.00 114 H 7.87 4.22 0.00 3.20 3.19 0.00 5.82 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 0.00 115 F 8.09 4.55 0.00 3.35 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 0.00 116 E 8.49 4.12 0.00 2.27 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 2.60 0.00 117 V 7.90 3.67 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 1.12 0.00 0.00 0.93 0.00 0.00 118 T 8.24 3.84 4.55 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 1.43 0.00 0.00 119 R 8.25 2.87 0.00 2.00 2.13 0.00 3.31 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.39 0.00 120 F 8.20 3.98 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 0.00 121 A 8.47 4.00 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 0.00 122 L 8.16 3.48 0.00 1.41 1.49 0.03 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 123 L 7.81 3.93 0.00 1.68 1.78 0.97 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 124 E 7.98 3.60 0.00 1.74 1.77 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 1.56 2.10 0.00 125 T 7.73 3.73 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 1.11 0.00 0.00 126 I 7.69 3.43 1.60 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.40 0.62 0.00 0.00 127 K 7.19 2.48 0.00 0.79 1.24 0.00 1.12 0.00 0.00 1.23 0.00 0.00 2.70 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.64 0.21 7.81 128 E 7.42 4.04 0.00 1.84 1.84 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 2.16 2.21 0.00 129 A 7.66 4.39 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 0.00 130 L 6.80 4.80 0.00 1.67 1.66 1.20 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.28 0.00 2.22 2.01 0.00 3.66 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.13 0.00 132 A 8.67 4.20 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 0.00 133 D 8.21 4.46 0.00 2.72 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 0.00 134 M 8.02 4.32 0.00 2.19 2.36 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 2.70 2.54 0.00 135 W 8.27 4.72 0.00 3.42 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 0.00 136 G 6.09 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 0.00 0.00 0.00 137 P 0.00 4.01 0.00 2.20 2.26 0.00 3.57 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 1.98 2.00 0.00 138 E 7.83 3.82 0.00 1.92 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 2.32 2.28 0.00 139 M 7.58 3.94 0.00 1.63 2.07 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.95 0.00 140 R 7.23 3.75 0.00 1.24 1.68 0.00 3.52 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 141 N 8.22 4.35 0.00 2.88 2.84 0.00 0.00 6.95 7.23 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 0.00 142 A 8.04 4.03 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 0.00 143 W 8.16 4.20 0.00 3.45 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 0.00 144 G 8.70 3.73 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 0.00 0.00 0.00 145 E 8.89 4.06 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 2.40 2.50 0.00 146 A 8.09 3.52 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 Y 8.32 3.99 0.00 3.19 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 D 8.62 4.36 0.00 2.91 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 0.00 149 Q 7.98 3.87 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.48 0.00 150 L 7.79 3.75 0.00 1.57 1.58 0.82 0.66 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 0.00 151 V 7.60 3.01 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 -0.05 0.00 0.00 152 A 8.04 3.87 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 0.00 153 A 7.72 3.93 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 0.00 154 I 7.57 3.80 1.79 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 1.50 0.66 0.96 0.00 0.00 155 K 8.35 4.04 0.00 1.83 1.80 0.00 1.54 0.00 0.00 1.64 0.00 0.00 3.19 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.44 1.17 7.81 156 Q 7.73 4.08 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.10 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 157 E 7.76 4.44 0.00 2.13 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 2.30 2.53 0.00 158 M 7.87 4.60 0.00 2.08 2.25 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.79 0.00 159 K 7.58 4.73 0.00 1.70 1.68 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.37 7.81 160 P 0.00 4.42 0.00 2.04 1.99 0.00 3.72 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 2.04 2.10 0.00