NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 H 4.8543 8.4449 116.4710 55.8015 30.2353 172.0537 1 M 4.2531 9.3256 119.0702 53.8583 34.2299 174.0195 2 I 4.8709 8.5593 122.5112 59.8217 41.2000 173.8361 3 Y 5.1393 8.9917 124.1083 56.0768 41.6051 174.4868 4 A 4.6299 8.6560 123.8608 50.7300 21.2857 176.7371 5 G 4.0885 8.8254 109.9120 44.4068 0.0000 171.5275 6 I 4.5525 8.6615 128.9741 59.7453 38.7988 175.4192 7 L 4.6464 8.8507 128.9762 53.1940 42.0375 176.6584 8 A 4.6396 8.2972 127.7458 50.4075 20.5684 175.8528 9 G 3.8865 8.2406 110.4276 44.5847 0.0000 171.3312 *21 P 4.0614 0.0000 0.0000 62.1759 32.7999 178.9189 22 K 3.9974 8.3345 120.3288 59.0782 32.4332 179.1452 23 Q 3.7968 7.6913 116.6447 58.4004 28.4744 177.5269 24 F 4.8071 7.2756 115.0602 57.6132 39.6838 175.9416 25 L 4.3255 7.6663 122.1954 53.8306 42.3666 175.8621 26 E 4.4183 8.6237 122.9050 55.8173 30.4229 175.2033 27 L 4.7405 8.9330 128.3636 53.9164 45.5030 177.2783 28 G 3.9604 9.5361 118.0224 46.7970 0.0000 173.4070 29 D 5.2698 9.2607 115.2411 52.4210 43.5296 175.2890 30 R 4.1889 7.8637 117.6930 53.3532 34.4020 173.0763 31 P 4.6369 0.0000 0.0000 62.6134 32.3293 177.3560 32 I 3.5929 8.8065 123.8011 64.7942 36.9966 178.3796 33 L 3.8234 8.1516 121.1224 58.2986 41.6958 179.2356 34 I 3.6550 7.5866 119.5421 64.6109 36.8075 177.8459 35 H 4.1446 8.0896 116.5458 59.3804 28.3143 177.7976 36 T 3.9155 7.7981 117.0842 66.7163 68.3178 176.9139 37 I 3.7505 7.8767 121.7593 64.4412 37.2235 178.0042 38 E 3.7873 8.4291 119.7295 59.7405 29.1310 179.8416 39 K 4.0026 7.6387 116.4870 58.7605 31.9696 178.5564 40 F 4.3622 8.2189 117.5117 59.0394 39.1874 178.4585 41 V 3.5677 7.1598 110.2277 64.1105 31.2285 177.5039 42 L 4.0457 7.6482 117.2476 56.6514 42.0649 176.3782 43 E 3.9566 7.7989 120.1831 55.3325 29.2191 175.5926 44 P 4.3340 0.0000 0.0000 65.2225 31.4734 177.2469 45 S 4.3902 7.9643 111.7139 58.4291 63.4956 173.9066 46 I 4.1931 7.2421 123.3248 60.7369 37.5398 175.1415 47 E 4.0764 9.0122 128.2773 58.6052 29.5692 176.6357 48 K 4.8251 7.7906 117.0877 54.6063 37.3802 174.8649 49 I 4.5932 8.8342 123.4983 59.8803 39.3643 174.8820 50 V 4.6036 8.8714 128.7809 61.0911 33.5304 174.4589 51 V 4.6262 9.0730 128.9582 61.0766 33.8362 174.4876 52 G 4.2850 9.1231 116.7784 45.2715 0.0000 172.5572 53 V 5.1984 8.7049 126.0317 59.5455 35.5192 174.2219 54 H 4.3170 9.1544 125.1162 56.8208 30.3544 176.0004 55 G 3.9879 9.0966 111.7779 48.5286 0.0000 175.2383 56 D 4.6102 8.6114 118.7591 55.6394 41.1726 177.4456 57 W 4.5424 8.4863 118.6596 56.0454 29.6969 177.5801 58 V 3.7069 7.5777 119.3991 66.3432 30.9525 178.2659 59 S 4.3411 8.0406 113.3343 61.4449 62.8894 175.7086 60 H 4.0296 8.1659 121.2517 59.1571 29.8323 176.7176 61 A 4.1736 8.4220 122.9212 55.5445 18.1402 179.5060 62 E 3.9844 8.3698 116.8962 59.4967 29.4196 179.1712 63 D 4.3678 8.3739 119.2365 57.4510 40.8771 178.8632 64 L 4.1709 7.9877 119.3066 57.8300 41.5674 179.7808 65 V 3.6578 7.8156 117.8845 66.2176 31.2943 177.6710 66 D 4.3523 8.0017 117.2783 57.2953 40.7234 178.5901 67 K 3.9321 8.1594 119.0807 59.2310 32.3901 177.7576 68 Y 4.5418 8.4985 114.8051 58.2115 39.4372 175.7833 69 L 5.1216 8.3775 120.7077 53.2567 42.7156 176.6160 70 P 4.2255 0.0000 0.0000 65.6284 31.6469 178.2125 71 L 3.8383 7.8496 119.3677 56.9693 42.3390 176.6135 72 Y 4.7124 8.0173 115.1350 57.6055 38.7988 177.2251 73 K 3.9025 7.9217 121.9752 59.9373 32.1464 178.9079 74 E 4.1747 8.0709 115.0004 58.4237 29.8843 178.0325 75 R 4.1813 8.0692 117.5244 57.2003 30.6497 175.6543 76 I 4.9700 7.4019 118.5814 59.3379 39.6359 175.1363 77 I 4.4389 8.7096 127.7574 59.5348 39.6873 174.6745 78 I 4.6070 8.3812 128.5508 60.8724 38.0365 175.2924 79 T 4.7328 9.0577 120.9577 59.7026 71.6281 172.5825 80 K 4.4501 8.7032 127.2067 56.6926 32.6985 177.2187 81 G 3.9451 9.3558 117.3331 45.7145 0.0000 171.1213 82 G 4.3982 8.6754 108.5482 43.3456 0.0000 173.4690 83 A 4.2102 8.5638 120.9065 54.1998 18.7491 177.4019 84 D 4.8851 7.5803 112.7737 50.6078 44.0211 176.4105 85 R 3.8971 8.5486 116.4377 59.8492 29.1980 178.6511 86 N 4.3545 8.2210 116.5999 56.1471 38.6074 177.4389 87 T 3.9800 8.6151 117.6171 66.5637 68.4451 177.0293 88 S 4.1233 7.9906 117.2740 61.4337 62.7543 176.6014 89 I 3.4672 7.8739 122.8316 64.1878 36.7237 178.1710 90 K 3.9552 7.9590 120.2555 59.8115 32.0203 178.4083 91 N 4.3275 8.2654 116.5091 56.3366 38.3586 177.3795 92 I 3.6439 8.0806 121.5336 64.5722 37.1397 178.5889 93 I 3.6459 7.9935 120.8095 64.2728 36.9024 178.3520 94 E 3.9481 8.5209 119.5243 59.3666 29.3119 179.2564 95 A 4.0034 8.0379 120.7129 55.1154 18.3912 179.6132 96 I 3.3791 7.8343 118.5273 64.6515 37.2569 178.1643 97 D 4.4103 8.3917 118.7913 57.3054 40.7625 178.1583 98 A 4.1346 7.9315 120.6765 54.8856 18.4054 178.7959 99 Y 4.3747 7.7337 117.5190 59.1758 39.1264 176.3798 100 R 4.2356 7.6961 119.0905 53.7882 32.9251 172.6947 101 P 4.5882 0.0000 0.0000 62.0850 31.8045 176.2743 102 L 4.3519 9.3757 123.8158 55.1162 41.7825 176.5214 103 T 4.7025 8.8554 111.8614 58.9206 71.3263 173.5854 104 P 4.3827 0.0000 0.0000 64.9795 31.3350 177.4556 105 E 4.4205 7.5200 114.9499 56.5840 30.4408 176.1569 106 D 4.8589 7.8700 119.7901 54.6588 41.9653 175.5274 107 I 5.2166 9.0290 123.7882 59.3932 40.9664 174.7633 108 V 4.6908 8.5628 124.8765 59.9855 34.2354 174.9043 109 V 4.0325 9.0395 126.3485 61.7019 31.8605 174.5032 110 T 4.6948 8.1603 119.0637 61.4119 70.6428 173.4177 111 H 5.0139 8.7270 122.3677 54.8706 34.1087 172.4112 112 D 4.6623 8.5620 125.8952 54.2755 41.0104 177.9350 113 S 4.0142 9.1065 118.4119 61.2326 63.3110 175.9525 114 V 4.0367 7.5573 112.9258 61.2422 31.4434 176.0680 115 R 4.7748 7.5819 120.0577 53.3815 29.0680 174.9478 116 P 4.1454 0.0000 0.0000 63.4635 32.1289 177.8590 117 F 4.8211 7.5802 117.0347 57.2538 39.0663 175.6442 118 I 3.8065 7.1095 121.2657 61.2692 38.4130 175.6793 119 T 4.6311 7.8409 115.2469 59.4242 72.8750 175.1247 120 L 3.8061 8.1786 121.3088 57.7615 41.4908 179.7393 121 R 3.8195 7.8374 118.2675 59.6202 30.0589 178.3367 122 M 3.9699 7.7154 117.9950 58.4055 31.9745 178.6508 123 I 3.5925 7.4211 119.8277 64.5935 37.2529 178.5524 124 Q 3.9399 8.5057 118.9146 59.0020 28.4487 178.4270 125 D 4.3413 8.3413 120.2463 57.4882 40.8697 178.6375 126 N 4.2719 8.1824 116.7382 56.4614 38.3461 177.5284 127 I 3.6885 7.4546 119.7454 64.2917 37.5876 178.0770 128 Q 4.0818 8.1941 120.3473 59.2959 28.8425 178.1073 129 L 4.0374 8.2446 120.1302 57.8678 41.4360 179.3878 130 A 4.0894 7.9002 119.4844 54.9105 18.2572 179.3534 131 Q 4.1420 7.8708 116.1874 58.0353 28.8030 176.8974 132 N 4.8424 7.6280 113.9264 52.5257 37.6779 173.2960 133 H 5.0697 7.6558 114.4120 54.2502 33.0259 173.0410 134 D 4.7323 8.8973 120.3867 57.4869 41.3339 176.5246 135 A 4.7130 7.6008 117.6591 50.8925 23.2895 175.0385 136 V 4.8564 8.7601 118.1019 61.2789 35.2677 173.6027 137 D 5.1423 8.8185 126.5818 52.6810 44.3276 174.5242 138 T 4.7346 8.5792 123.1155 63.1941 69.7959 174.3777 139 V 5.0017 8.9609 119.2402 59.7670 36.7205 174.7937 140 V 4.7507 8.4291 114.2215 59.0504 35.8597 175.2080 141 E 4.1877 8.9275 121.5567 56.6398 29.8670 177.0346 142 A 4.1922 8.2321 126.4115 52.2194 18.4066 177.4660 143 V 4.1480 8.4329 120.6034 63.1776 33.7343 175.9785 144 D 4.4663 7.9148 118.8428 54.3049 41.2546 175.5284 145 T 4.1510 8.3017 117.5218 61.5464 68.1339 173.7094 146 I 4.4391 8.2473 129.1822 59.4457 39.1654 174.8241 147 V 4.4523 8.2743 124.7672 60.9890 33.9810 173.9445 148 E 4.6350 9.2477 128.7609 54.7574 31.7508 174.7793 149 S 4.6132 8.3484 121.2728 57.1432 64.2516 173.6254 150 T 3.9894 8.4532 119.1451 64.0894 68.8099 175.3952 151 N 4.3446 7.7885 117.8053 52.5255 38.1150 176.1207 152 G 3.8869 8.0335 106.0983 45.7769 0.0000 173.6214 153 Q 4.5156 8.7496 119.0814 56.4079 30.6168 175.8277 154 F 5.0529 7.3809 109.2413 54.5365 41.1053 174.0161 155 I 4.0250 8.5360 123.1433 61.7570 37.2053 176.3412 156 T 4.3498 8.2974 116.0111 62.1788 69.8661 173.9679 157 D 4.2989 7.0102 120.3190 53.4199 40.9831 174.7490 158 I 4.6672 8.1389 119.9122 58.6665 38.3419 174.3564 159 P 4.3038 0.0000 0.0000 62.0092 31.9923 176.0230 160 N 4.3119 8.6328 119.3164 53.7216 38.7527 175.7638 161 R 3.8888 8.6252 126.9825 58.9003 30.4170 178.1433 162 A 3.9845 7.9114 119.4190 54.4790 18.4211 177.4602 163 H 5.0036 8.0015 111.1476 55.3538 29.8206 173.3767 164 L 4.8938 7.4721 120.3906 53.3704 43.8776 175.2157 165 Y 5.0762 8.3970 118.8672 56.1734 42.2722 174.5786 166 Q 4.2926 9.3434 125.0506 55.4455 30.4007 175.1166 167 G 4.1413 8.7941 114.4807 46.5572 0.0000 172.6070 168 Q 5.1881 9.2397 124.6557 54.3471 32.7952 174.1814 169 T 5.0416 8.3204 108.4752 59.6516 72.3314 172.0799 170 P 5.3944 0.0000 0.0000 62.7389 33.1233 175.3251 171 Q 5.0666 8.2453 120.5817 54.5591 32.1998 174.7169 172 T 4.7312 8.3823 120.5182 61.6094 72.3605 173.0569 173 F 4.9313 7.5582 118.0624 56.1032 41.9602 173.5212 174 R 4.5739 8.5789 119.1154 56.3200 30.8750 177.5295 175 C 4.3035 9.2136 121.4354 63.1065 28.1533 176.4670 176 K 4.0213 8.2175 120.4506 59.6158 31.8084 178.2184 177 D 4.3948 8.2987 118.6338 57.4331 40.7833 178.3951 178 F 3.7877 8.5163 120.9854 61.4385 39.3191 176.9140 179 M 4.1217 8.3075 118.2189 58.6111 31.6074 178.3405 180 D 4.3093 8.1087 117.7022 57.5015 41.3694 178.8322 181 L 3.9024 7.5233 119.1774 57.8471 41.6178 178.9118 182 Y 3.9090 7.7085 119.8416 60.4861 38.3925 178.3185 183 G 3.5934 8.0385 105.8932 46.8963 0.0000 174.7583 184 S 4.3754 7.2759 113.8646 57.7687 63.8148 173.7295 185 L 4.6753 6.6796 122.5791 53.2365 43.2487 177.2228 186 S 4.3273 8.5295 117.7158 57.8988 65.1740 175.1348 187 D 4.3256 8.5696 122.3631 57.9201 40.3936 179.2082 188 E 4.1559 8.0638 118.2613 59.4410 29.4505 179.1502 189 E 3.9127 8.1818 118.6681 59.2895 29.2998 179.4192 190 K 3.9941 8.1510 117.9950 59.6013 32.1621 178.8818 191 E 4.1095 8.1494 117.8829 58.9668 29.3585 178.6657 192 I 4.1944 7.0673 118.0517 62.1385 39.3563 177.3626 193 L 4.5116 7.8874 121.8758 53.6664 38.4022 176.7120 194 T 4.1608 7.7100 109.1658 62.9320 70.1172 175.1186 195 D 4.8419 7.8345 121.5841 52.3829 42.8153 175.7981 196 A 4.4140 8.8040 129.2239 55.6934 18.9935 179.4929 197 C 4.2814 8.4430 113.3815 62.8109 28.0434 175.8653 198 K 3.9271 8.6618 121.3507 59.7631 31.5301 178.8463 199 I 3.6797 7.6667 119.9184 64.3393 37.0049 178.4495 200 F 3.9561 8.3442 118.1455 60.4113 38.8393 177.6481 201 V 3.6324 8.2880 118.2665 66.2316 31.1784 177.9993 202 I 3.8597 7.8982 116.7882 63.3284 37.8131 176.8697 203 K 4.3958 7.5511 117.8536 55.8419 31.8542 177.0096 204 G 3.8470 7.8108 106.8162 46.3623 0.0000 174.3028 205 K 4.4415 7.9468 118.6010 55.1011 34.2834 176.4061 206 D 4.6063 9.8323 122.2657 53.4628 41.7832 175.4588 207 V 4.7563 8.1981 126.8886 60.8818 32.6615 175.0915 208 A 4.1397 8.5717 130.6100 51.7162 19.7657 175.8707 209 L 4.7716 8.2325 119.8149 53.7735 42.8952 176.1565 210 A 4.6996 8.7082 125.7452 49.8171 22.0089 175.6736 211 K 4.1784 8.5303 122.4870 56.3096 32.5794 176.9988 212 G 4.3356 8.6902 119.8555 45.3443 0.0000 171.8894 213 E 4.6625 8.5565 119.5119 54.5929 32.8428 176.8327 214 Y 4.1503 8.3473 122.6123 60.9966 38.1112 177.8072 215 S 4.1913 7.9780 112.6529 60.0980 63.9366 174.5575 216 N 4.7728 7.8006 122.0890 52.6967 37.3625 174.9492 217 L 4.0007 7.8763 120.9781 55.3819 43.1573 175.0892 218 K 4.4813 8.5105 126.5581 55.1689 32.7265 176.3951 219 I 4.1712 8.5006 129.1487 60.8186 36.0694 175.0192 220 T 4.3076 8.6763 120.5367 64.7204 70.3592 175.8626 221 T 4.5660 7.8519 110.9659 59.7965 72.5657 175.5283 222 V 3.6605 8.1367 119.9527 66.1412 31.4557 178.1724 223 T 3.8983 7.8517 115.4222 66.6864 68.3236 176.0838 224 D 4.3990 8.0131 120.8422 57.1898 40.7382 178.5643 225 L 3.9645 7.9950 120.8354 58.1045 42.1072 179.1987 226 K 3.9512 7.9435 117.9471 59.4771 32.0246 179.2326 227 I 3.6440 7.8280 119.6910 64.3996 37.1625 177.9943 228 A 4.2256 8.3550 121.8285 55.5388 17.9671 179.7971 229 K 3.9683 8.0925 115.6723 59.6997 32.3812 179.4406 230 S 4.2617 8.2141 114.4585 61.7239 62.5940 176.5346 231 M 4.0424 7.8217 121.8574 57.7565 31.7523 177.8949 232 I 4.0247 7.4823 109.8488 61.0537 37.8926 175.8440 233 E 4.1755 7.7362 125.6126 57.1963 29.8085 174.0473 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 0 H 8.44 4.85 0.00 3.31 3.42 0.00 5.68 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 9.33 4.25 0.00 1.41 2.21 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.80 0.00 2 I 8.56 4.87 1.97 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 1.36 0.88 0.89 0.00 0.00 3 Y 8.99 5.14 0.00 2.91 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 4 A 8.66 4.63 0.71 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 0.00 0.00 5 G 8.83 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 0.00 0.00 0.00 6 I 8.66 4.55 1.72 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.58 0.79 0.00 0.00 7 L 8.85 4.65 0.00 1.49 1.55 0.86 0.54 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 8 A 8.30 4.64 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 G 8.24 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 0.00 0.00 0.00 *21 P 0.00 4.06 0.00 2.13 2.02 0.00 3.36 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 22 K 8.33 4.00 0.00 1.75 1.82 0.00 1.70 0.00 0.00 1.84 0.00 0.00 2.97 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.49 1.38 7.81 23 Q 7.69 3.80 0.00 1.80 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.88 0.00 0.00 0.00 0.00 0.00 1.16 1.38 0.00 24 F 7.28 4.81 0.00 2.96 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 25 L 7.67 4.33 0.00 1.99 1.56 0.96 0.60 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 26 E 8.62 4.42 0.00 2.02 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 2.43 2.38 0.00 27 L 8.93 4.74 0.00 1.60 1.35 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 28 G 9.54 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 29 D 9.26 5.27 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 30 R 7.86 4.19 0.00 1.46 1.28 0.00 3.23 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.50 0.00 31 P 0.00 4.64 0.00 2.10 2.00 0.00 2.70 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.02 0.00 32 I 8.81 3.59 1.86 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.75 0.80 0.00 0.00 33 L 8.15 3.82 0.00 1.55 1.62 0.81 1.07 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 34 I 7.59 3.65 1.76 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.59 0.81 0.00 0.00 35 H 8.09 4.14 0.00 3.22 3.19 0.00 5.62 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 36 T 7.80 3.92 4.36 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 1.37 0.00 0.00 37 I 7.88 3.75 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.71 0.88 0.00 0.00 38 E 8.43 3.79 0.00 2.12 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 2.25 2.40 0.00 39 K 7.64 4.00 0.00 1.68 1.60 0.00 1.67 0.00 0.00 1.64 0.00 0.00 3.24 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.65 1.71 7.81 40 F 8.22 4.36 0.00 3.12 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 7.16 3.57 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 0.47 0.00 0.00 0.27 0.00 0.00 42 L 7.65 4.05 0.00 1.56 1.68 0.89 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 43 E 7.80 3.96 0.00 1.94 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 2.26 2.27 0.00 44 P 0.00 4.33 0.00 2.20 2.17 0.00 3.78 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 45 S 7.96 4.39 0.00 3.99 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.24 4.19 1.89 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.96 0.95 0.00 0.00 47 E 9.01 4.08 0.00 1.61 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 2.43 2.41 0.00 48 K 7.79 4.83 0.00 1.84 1.54 0.00 1.55 0.00 0.00 1.64 0.00 0.00 2.13 0.00 0.00 2.44 0.00 0.00 0.00 0.00 1.06 0.55 7.81 49 I 8.83 4.59 1.83 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 1.06 0.78 0.75 0.00 0.00 50 V 8.87 4.60 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 0.76 0.00 0.00 0.83 0.00 0.00 51 V 9.07 4.63 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 0.94 0.00 0.00 0.88 0.00 0.00 52 G 9.12 4.28 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 0.00 53 V 8.70 5.20 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 1.49 0.00 0.00 1.08 0.00 0.00 54 H 9.15 4.32 0.00 3.37 3.44 0.00 5.75 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 55 G 9.10 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 56 D 8.61 4.61 0.00 2.75 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.49 4.54 0.00 3.54 3.10 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 0.00 0.00 0.00 58 V 7.58 3.71 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.07 0.00 0.00 59 S 8.04 4.34 0.00 4.07 4.10 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 0.00 0.00 0.00 60 H 8.17 4.03 0.00 3.13 3.49 0.00 5.88 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 61 A 8.42 4.17 1.59 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 62 E 8.37 3.98 0.00 2.21 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 2.59 0.00 63 D 8.37 4.37 0.00 2.82 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 7.99 4.17 0.00 2.04 1.87 1.04 0.79 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 65 V 7.82 3.66 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 1.17 0.00 0.00 1.02 0.00 0.00 66 D 8.00 4.35 0.00 2.87 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 67 K 8.16 3.93 0.00 1.69 1.73 0.00 1.64 0.00 0.00 1.17 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.61 1.17 7.81 68 Y 8.50 4.54 0.00 3.12 3.01 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 69 L 8.38 5.12 0.00 1.87 1.81 0.95 1.10 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 70 P 0.00 4.23 0.00 2.19 2.47 0.00 3.72 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 2.06 1.94 0.00 71 L 7.85 3.84 0.00 1.38 1.00 0.78 0.68 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 72 Y 8.02 4.71 0.00 3.03 2.91 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 73 K 7.92 3.90 0.00 1.94 1.91 0.00 1.70 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.61 7.81 74 E 8.07 4.17 0.00 1.95 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 2.33 2.40 0.00 75 R 8.07 4.18 0.00 2.06 2.01 0.00 3.28 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.95 0.00 76 I 7.40 4.97 1.90 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 1.23 0.69 0.96 0.00 0.00 77 I 8.71 4.44 1.80 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.74 0.89 0.00 0.00 78 I 8.38 4.61 1.90 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 1.26 0.81 0.98 0.00 0.00 79 T 9.06 4.73 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 1.19 0.00 0.00 80 K 8.70 4.45 0.00 1.83 1.73 0.00 1.84 0.00 0.00 1.72 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.55 7.81 81 G 9.36 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 82 G 8.68 4.40 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 0.00 83 A 8.56 4.21 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 84 D 7.58 4.89 0.00 2.91 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 85 R 8.55 3.90 0.00 2.05 2.24 0.00 2.98 0.00 0.00 3.49 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.85 0.00 86 N 8.22 4.35 0.00 2.87 2.69 0.00 0.00 7.13 7.05 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 87 T 8.62 3.98 4.40 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 1.29 0.00 0.00 88 S 7.99 4.12 0.00 4.03 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 89 I 7.87 3.47 1.48 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 1.23 0.73 -0.01 0.00 0.00 90 K 7.96 3.96 0.00 1.93 2.00 0.00 1.80 0.00 0.00 1.98 0.00 0.00 3.12 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.53 1.65 7.81 91 N 8.27 4.33 0.00 3.08 2.96 0.00 0.00 7.08 7.07 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 92 I 8.08 3.64 1.97 0.00 0.00 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 1.44 0.69 0.80 0.00 0.00 93 I 7.99 3.65 2.05 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 1.54 0.79 0.98 0.00 0.00 94 E 8.52 3.95 0.00 2.18 2.01 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 2.36 2.52 0.00 95 A 8.04 4.00 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 96 I 7.83 3.38 1.82 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.42 0.04 0.00 0.00 97 D 8.39 4.41 0.00 2.88 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 98 A 7.93 4.13 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 99 Y 7.73 4.37 0.00 2.94 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 0.00 100 R 7.70 4.24 0.00 1.06 1.70 0.00 3.17 0.00 0.00 2.93 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 101 P 0.00 4.59 0.00 2.07 2.01 0.00 3.73 0.00 0.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 102 L 9.38 4.35 0.00 1.63 1.66 0.97 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 103 T 8.86 4.70 4.28 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 1.25 0.00 0.00 104 P 0.00 4.38 0.00 2.10 2.20 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 2.05 2.14 0.00 105 E 7.52 4.42 0.00 2.10 1.91 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 2.30 2.41 0.00 106 D 7.87 4.86 0.00 2.78 2.86 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 0.00 107 I 9.03 5.22 1.92 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 1.31 0.98 0.88 0.00 0.00 108 V 8.56 4.69 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 0.55 0.00 0.00 0.81 0.00 0.00 109 V 9.04 4.03 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 0.96 0.00 0.00 0.92 0.00 0.00 110 T 8.16 4.69 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 111 H 8.73 5.01 0.00 3.34 3.08 0.00 5.78 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 D 8.56 4.66 0.00 2.46 2.45 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 0.00 113 S 9.11 4.01 0.00 3.78 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 0.00 114 V 7.56 4.04 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 0.59 0.00 0.00 0.84 0.00 0.00 115 R 7.58 4.77 0.00 1.80 2.03 0.00 3.04 0.00 0.00 3.47 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.41 0.00 116 P 0.00 4.15 0.00 1.53 1.86 0.00 3.10 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.49 0.00 117 F 7.58 4.82 0.00 3.20 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 7.11 3.81 1.76 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.58 0.82 0.00 0.00 119 T 7.84 4.63 4.18 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 1.19 0.00 0.00 120 L 8.18 3.81 0.00 1.62 1.67 0.85 0.68 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 0.00 121 R 7.84 3.82 0.00 1.79 1.87 0.00 3.38 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 122 M 7.72 3.97 0.00 1.99 2.14 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.68 0.00 123 I 7.42 3.59 1.78 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.19 0.80 0.00 0.00 124 Q 8.51 3.94 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 125 D 8.34 4.34 0.00 2.89 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 0.00 126 N 8.18 4.27 0.00 2.96 2.82 0.00 0.00 7.07 7.00 0.00 0.00 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 I 7.45 3.69 1.98 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 1.39 0.53 0.91 0.00 0.00 128 Q 8.19 4.08 0.00 2.17 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.78 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 129 L 8.24 4.04 0.00 1.90 1.72 0.94 0.84 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 0.00 130 A 7.90 4.09 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 Q 7.87 4.14 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.97 0.00 0.00 0.00 0.00 0.00 2.41 2.64 0.00 132 N 7.63 4.84 0.00 2.50 2.78 0.00 0.00 6.79 8.80 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 0.00 133 H 7.66 5.07 0.00 3.10 3.38 0.00 5.70 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 D 8.90 4.73 0.00 2.88 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 0.00 135 A 7.60 4.71 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 V 8.76 4.86 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 0.88 0.00 0.00 0.94 0.00 0.00 137 D 8.82 5.14 0.00 2.71 2.41 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 0.00 138 T 8.58 4.73 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 1.24 0.00 0.00 139 V 8.96 5.00 2.22 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 0.70 0.00 0.00 0.67 0.00 0.00 140 V 8.43 4.75 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 0.22 0.00 0.00 0.81 0.00 0.00 141 E 8.93 4.19 0.00 2.00 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 2.19 2.42 0.00 142 A 8.23 4.19 1.25 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 0.00 0.00 143 V 8.43 4.15 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 0.86 0.00 0.00 144 D 7.91 4.47 0.00 2.72 2.59 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 0.00 145 T 8.30 4.15 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 0.00 146 I 8.25 4.44 1.87 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 1.30 1.04 0.92 0.00 0.00 147 V 8.27 4.45 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 0.78 0.00 0.00 0.94 0.00 0.00 148 E 9.25 4.64 0.00 2.03 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 2.20 2.22 0.00 149 S 8.35 4.61 0.00 3.79 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 T 8.45 3.99 4.18 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 1.17 0.00 0.00 151 N 7.79 4.34 0.00 2.67 2.78 0.00 0.00 6.06 7.00 0.00 0.00 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 G 8.03 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 0.00 0.00 0.00 153 Q 8.75 4.52 0.00 2.19 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.66 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 154 F 7.38 5.05 0.00 3.05 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 0.00 155 I 8.54 4.02 1.95 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.59 1.05 0.00 0.00 156 T 8.30 4.35 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 1.04 0.00 0.00 157 D 7.01 4.30 0.00 2.86 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 0.00 158 I 8.14 4.67 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.55 0.91 0.00 0.00 159 P 0.00 4.30 0.00 2.05 2.01 0.00 3.90 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 2.04 2.09 0.00 160 N 8.63 4.31 0.00 2.77 2.77 0.00 0.00 6.64 7.65 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 0.00 161 R 8.63 3.89 0.00 1.85 1.87 0.00 3.21 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 162 A 7.91 3.98 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 H 8.00 5.00 0.00 3.16 3.33 0.00 5.65 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 L 7.47 4.89 0.00 1.46 1.54 0.92 1.04 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 0.00 165 Y 8.40 5.08 0.00 2.79 2.91 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 0.00 166 Q 9.34 4.29 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.02 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 167 G 8.79 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 Q 9.24 5.19 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.26 2.40 0.00 169 T 8.32 5.04 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 1.25 0.00 0.00 170 P 0.00 5.39 0.00 2.29 2.10 0.00 3.80 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.02 0.00 171 Q 8.25 5.07 0.00 2.20 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.76 0.00 0.00 0.00 0.00 0.00 2.44 2.32 0.00 172 T 8.38 4.73 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 1.14 0.00 0.00 173 F 7.56 4.93 0.00 2.94 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 R 8.58 4.57 0.00 2.23 2.04 0.00 3.39 0.00 0.00 3.54 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.74 0.00 175 C 9.21 4.30 0.00 3.10 3.10 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 0.00 0.00 0.00 176 K 8.22 4.02 0.00 1.90 1.89 0.00 1.77 0.00 0.00 1.86 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.72 1.59 7.81 177 D 8.30 4.39 0.00 3.34 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 F 8.52 3.79 0.00 2.86 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 0.00 179 M 8.31 4.12 0.00 2.17 2.31 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 3.14 0.00 180 D 8.11 4.31 0.00 2.55 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 0.00 181 L 7.52 3.90 0.00 1.12 1.28 -0.05 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 7.71 3.91 0.00 1.89 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 0.00 183 G 8.04 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 0.00 184 S 7.28 4.38 0.00 3.94 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 0.00 185 L 6.68 4.68 0.00 1.42 1.45 0.81 0.96 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 0.00 186 S 8.53 4.33 0.00 4.01 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 0.00 187 D 8.57 4.33 0.00 2.71 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 0.00 188 E 8.06 4.16 0.00 2.02 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 2.38 2.45 0.00 189 E 8.18 3.91 0.00 2.09 1.94 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 2.29 2.30 0.00 190 K 8.15 3.99 0.00 1.81 1.93 0.00 1.48 0.00 0.00 1.45 0.00 0.00 2.13 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.18 1.38 7.81 191 E 8.15 4.11 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 2.48 0.00 192 I 7.07 4.19 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.61 0.91 0.00 0.00 193 L 7.89 4.51 0.00 1.60 1.66 0.89 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 194 T 7.71 4.16 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 1.28 0.00 0.00 195 D 7.83 4.84 0.00 2.68 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 0.00 196 A 8.80 4.41 1.59 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 0.00 197 C 8.44 4.28 0.00 3.23 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 0.00 198 K 8.66 3.93 0.00 1.92 2.12 0.00 1.56 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.57 7.81 199 I 7.67 3.68 1.98 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 1.52 1.20 0.64 0.00 0.00 200 F 8.34 3.96 0.00 3.25 3.12 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 0.00 201 V 8.29 3.63 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 1.02 0.00 0.00 1.01 0.00 0.00 202 I 7.90 3.86 1.94 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.93 0.98 0.00 0.00 203 K 7.55 4.40 0.00 1.78 1.72 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.40 7.81 204 G 7.81 3.85 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 0.00 0.00 0.00 205 K 7.95 4.44 0.00 1.97 2.11 0.00 1.79 0.00 0.00 1.67 0.00 0.00 2.70 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.55 1.59 7.81 206 D 9.83 4.61 0.00 2.76 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 0.00 207 V 8.20 4.76 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 0.81 0.00 0.00 0.99 0.00 0.00 208 A 8.57 4.14 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 L 8.23 4.77 0.00 1.36 1.36 0.28 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 210 A 8.71 4.70 1.16 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 0.00 211 K 8.53 4.18 0.00 1.75 1.70 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.40 7.81 212 G 8.69 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 E 8.56 4.66 0.00 1.94 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 2.25 2.37 0.00 214 Y 8.35 4.15 0.00 3.05 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 0.00 215 S 7.98 4.19 0.00 3.78 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 N 7.80 4.77 0.00 2.71 3.09 0.00 0.00 7.08 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 0.00 217 L 7.88 4.00 0.00 1.83 1.78 0.96 0.44 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 0.00 218 K 8.51 4.48 0.00 1.75 1.71 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.33 1.41 7.81 219 I 8.50 4.17 1.82 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.79 0.89 0.00 0.00 220 T 8.68 4.31 4.40 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 1.20 0.00 0.00 221 T 7.85 4.57 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 0.00 222 V 8.14 3.66 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 1.06 0.00 0.00 0.93 0.00 0.00 223 T 7.85 3.90 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 0.00 224 D 8.01 4.40 0.00 2.88 2.74 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 0.00 225 L 8.00 3.96 0.00 1.93 1.81 0.92 0.66 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 0.00 226 K 7.94 3.95 0.00 2.04 1.85 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.79 7.81 227 I 7.83 3.64 2.04 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.02 0.88 0.00 0.00 228 A 8.36 4.23 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 0.00 0.00 229 K 8.09 3.97 0.00 1.93 1.91 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.12 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.69 7.81 230 S 8.21 4.26 0.00 4.04 4.20 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 0.00 231 M 7.82 4.04 0.00 1.53 2.05 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.27 0.00 232 I 7.48 4.02 1.93 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.69 1.12 0.00 0.00 233 E 7.74 4.18 0.00 2.16 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 0.00 2.22 2.39 0.00 * Residues marked with a * may have inaccurate shift predictions.