NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3192 8.1627 120.3865 56.2472 34.8329 179.3168 2 E 3.0685 9.0703 120.9294 55.7731 31.8475 175.9457 3 R 3.8353 9.8506 118.5460 59.8906 31.7233 176.4230 4 Y 3.7798 7.9203 115.7871 61.8362 37.9699 177.7355 5 E 4.0792 8.6326 118.7134 59.5452 29.3610 178.4583 6 S 4.1492 8.6493 114.1407 61.8530 63.1969 176.6743 7 L 3.8777 8.0325 122.7777 58.5549 41.7266 179.2464 8 F 4.7627 8.2008 117.1547 60.2613 38.6080 177.6973 9 A 4.0596 8.1703 120.7310 55.3430 17.2597 179.2023 10 Q 4.2882 8.3331 114.2716 57.1791 28.6387 177.8998 11 L 4.4709 7.5251 119.9857 56.6076 41.9877 178.4755 12 K 3.9300 7.9541 119.4152 59.4578 32.0136 178.1979 13 E 3.8210 7.8045 119.7033 59.3552 29.5812 178.1680 14 R 4.2173 7.4272 111.8746 55.7123 30.4870 176.2273 15 K 3.9846 9.0532 117.7022 57.0086 30.1442 174.8603 16 E 4.8522 8.4149 114.5752 54.7468 32.8932 175.4132 17 G 4.0948 8.7517 109.3645 45.6970 0.0000 172.3608 18 A 5.7842 8.8432 121.1996 49.7527 21.8371 175.9013 19 F 5.0451 8.9629 122.5753 56.6822 41.8814 174.4908 20 V 4.6823 9.0513 128.1381 58.9495 32.3204 172.9861 21 P 4.7323 0.0000 0.0000 62.2915 32.9202 174.8106 22 F 5.8386 9.5450 123.3132 55.6710 41.6157 174.6844 23 V 4.3640 7.1732 123.2219 60.3613 35.6579 173.8265 24 T 4.8098 8.0548 118.3811 61.5709 70.1852 174.2525 25 L 3.8584 8.1035 126.7811 56.7785 42.0674 177.8876 26 G 3.7860 8.9325 110.4663 45.7350 0.0000 172.0009 27 D 4.8392 7.7165 119.1162 51.4184 42.3269 174.5772 28 P 4.4304 0.0000 0.0000 64.5680 32.1382 176.3922 29 G 4.2400 7.4994 104.4188 41.9362 0.0000 173.5463 30 I 3.6938 8.1085 120.5652 64.3060 37.2379 178.4675 31 E 3.9004 8.0518 119.6502 59.2375 29.3357 178.4544 32 Q 3.9071 7.9036 117.9453 59.1694 29.5251 177.2438 33 S 4.1865 8.5286 114.6121 61.6722 62.3139 176.0229 34 L 3.9167 7.8470 121.1404 57.9251 39.9659 179.5951 35 K 4.0033 8.0772 118.6820 59.0398 31.8530 178.3332 36 I 3.7473 8.2295 120.6848 63.9475 37.2758 177.6007 37 I 3.6313 7.6687 119.8624 64.8523 36.9386 177.7840 38 D 4.3270 8.0056 119.1528 57.9193 40.4850 179.1843 39 T 3.8860 7.1439 113.8701 66.5011 68.5723 176.3647 40 L 4.2270 8.2267 121.1245 58.2585 41.6293 179.0847 41 I 3.7759 7.9326 119.5881 64.7915 36.7777 177.9417 42 E 4.3585 8.5306 115.1461 57.4031 28.6903 177.4788 43 A 4.6131 9.7103 123.1583 51.4370 20.8445 178.3275 44 G 3.9730 8.5030 112.0870 45.6449 0.0000 173.4190 45 A 4.2273 7.1846 124.1497 53.3692 18.7198 177.0179 46 D 4.6576 8.5836 121.2816 55.2400 42.5579 176.3799 47 A 4.6584 7.3311 118.5883 50.7732 22.6762 175.5285 48 L 4.4228 8.3425 122.0284 53.9614 44.0237 175.6593 49 E 4.5842 8.4987 122.8753 54.3056 30.7084 172.7384 50 L 4.3199 8.8480 124.4566 53.3681 43.1674 176.3045 51 G 4.0126 8.9006 113.2281 45.7663 0.0000 172.1769 52 I 4.9782 7.8423 123.5711 58.3662 39.1587 174.2279 53 P 4.4234 0.0000 0.0000 63.4452 32.0314 174.2365 54 F 3.6401 8.4449 122.9791 59.0896 38.6410 174.9734 *76 V 3.8433 7.8045 127.2870 62.6399 32.3720 175.8743 77 T 4.2481 9.7273 119.7843 60.3184 70.9941 173.8413 78 P 4.2655 0.0000 0.0000 65.9288 31.5044 178.6589 79 A 4.2896 8.3385 119.0169 55.5121 18.0033 179.6266 80 Q 3.9716 7.6381 114.1417 59.2554 29.0413 178.1909 81 C 4.0681 7.8231 117.2864 63.0209 28.1559 176.3420 82 F 4.0900 8.8415 119.4743 60.1665 38.4671 177.4731 83 E 4.0454 8.0802 118.9283 59.3255 29.3130 178.8040 84 M 4.0518 8.5580 119.2721 58.2548 31.9766 178.5524 85 L 3.8370 8.0170 118.9433 57.7934 41.7787 179.5032 86 A 4.3711 8.0189 121.9024 54.5349 18.2726 179.6629 87 L 3.9022 7.8007 117.3778 58.0794 41.6852 179.3743 88 I 3.6760 8.4198 120.2603 64.7632 36.8829 177.8382 89 R 3.9884 7.9425 118.0625 59.9774 29.9086 177.3512 90 E 4.0301 8.1114 117.7609 59.6197 29.6484 178.9385 91 K 4.2702 8.2460 117.6660 58.1324 32.9487 177.0063 92 H 4.7950 8.7990 117.2014 52.4138 29.6703 171.6282 93 P 4.3624 0.0000 0.0000 65.5019 31.1778 178.4652 94 T 4.1602 7.6241 106.1823 61.5109 69.6985 174.5333 95 I 3.4228 6.9422 123.6239 60.5720 38.3828 173.0885 96 P 4.0043 0.0000 0.0000 63.0699 32.1334 175.5039 97 I 4.2991 10.9002 127.2330 59.7524 38.6666 175.2809 98 G 4.6371 8.6075 114.1227 43.4827 0.0000 171.5240 99 L 5.3299 8.7772 122.8859 52.9355 45.1796 175.5481 100 L 4.9401 8.5821 122.1815 54.2194 45.3129 174.9561 101 M 4.6793 8.5839 122.8213 54.8009 35.1725 173.3081 102 Y 5.0584 8.0939 116.5748 56.7700 39.4407 176.9875 103 A 3.9644 9.9856 122.4551 54.7612 18.2748 179.6254 104 N 4.5849 8.3188 115.2969 56.5083 38.6937 176.5163 105 L 3.9140 7.9715 120.8797 58.4197 41.7825 179.2179 106 V 2.7992 7.2150 117.0520 65.9364 31.3234 177.8832 107 F 4.4101 8.3935 116.7082 60.2180 38.6832 177.1383 108 N 4.5633 8.4834 116.6755 56.5176 38.9125 176.4495 109 K 4.6383 7.7830 117.2729 54.8868 32.8547 172.8609 110 G 3.8924 7.0674 118.1989 45.5057 0.0000 175.1453 111 I 3.4544 7.9484 125.6805 64.6288 37.8891 177.1794 112 D 4.5076 8.4052 118.5948 57.9389 40.8469 178.3194 113 E 3.9975 8.2719 117.5794 59.4519 29.7814 177.8854 114 F 4.1959 8.3208 121.0280 61.1933 39.4624 176.3360 115 Y 3.8484 8.2926 115.7192 61.2631 37.5347 178.9874 116 A 3.9008 8.3600 121.8120 54.9670 18.1797 179.3907 117 R 3.7150 7.7940 116.4859 58.6291 29.8507 178.1994 118 C 4.1308 7.4095 116.1745 62.4290 28.2698 175.1947 119 E 3.9913 8.5359 120.2161 58.6032 29.2652 178.3001 120 K 4.2048 7.4476 116.8643 57.8383 32.5951 178.3697 121 V 4.1775 7.3589 111.2295 60.5253 31.9241 176.7091 122 G 3.8518 8.0373 108.2193 45.7649 0.0000 174.9147 123 V 3.6773 7.6303 118.0584 63.4676 32.1071 174.9021 124 D 5.0894 9.8161 125.3551 55.0776 43.4050 176.1349 125 S 5.2521 8.0120 111.2091 57.3528 66.9160 173.7722 126 V 4.7485 8.3668 120.4849 61.8638 34.3900 173.6807 127 L 4.2167 8.7575 131.5937 53.8893 43.2460 175.5733 128 V 4.5680 8.4801 127.9024 62.2141 30.1646 176.1737 129 A 3.2188 8.2734 120.6905 53.1356 19.9908 179.3513 130 D 4.2671 9.4460 121.6465 54.8892 40.9325 178.5754 131 V 3.5994 7.4537 120.6467 61.7320 31.6146 173.9468 132 P 4.5382 0.0000 0.0000 62.0409 32.3694 177.3582 133 V 3.5635 8.4766 118.4031 66.4627 31.1062 177.8835 134 E 4.0703 8.1309 115.5089 57.9473 29.4268 177.7658 135 E 4.6886 7.5437 117.0768 56.1857 30.3225 177.5178 136 S 4.3713 8.4154 117.6075 61.8509 63.1889 176.9762 137 A 3.7239 7.3619 123.0346 53.6683 19.2020 177.2645 138 P 4.1997 0.0000 0.0000 65.5029 31.2944 178.6944 139 F 3.9346 9.1197 118.2458 60.2665 38.5960 177.6936 140 R 4.0352 8.2409 117.7774 59.4857 29.7010 178.4588 141 Q 3.9080 8.1066 117.5324 58.7902 28.9223 177.8921 142 A 3.7956 7.6284 121.4965 55.3756 18.2075 179.6157 143 A 3.8342 7.5844 119.2646 55.1581 18.1738 179.9206 144 L 3.7760 7.1978 115.8849 57.8688 41.7334 179.5889 145 R 4.0361 8.3505 117.7738 58.3492 30.2141 177.8182 146 H 4.9253 7.9077 115.2879 56.7528 31.5008 174.6033 147 N 4.1493 8.1353 113.0209 54.4461 35.9734 174.2051 148 V 4.7711 8.5702 117.3640 60.9478 35.9641 175.4048 149 A 4.4634 9.1723 128.7302 50.5933 20.3797 174.8466 150 P 4.4955 0.0000 0.0000 62.4512 32.3650 175.4108 151 I 4.2831 7.8380 125.5897 59.5015 39.0731 175.1263 152 F 5.0275 8.3439 122.7284 55.8093 43.6630 173.4448 153 I 4.7360 8.4999 120.6728 59.9844 39.1437 175.0526 154 C 4.7588 9.1813 128.5733 56.7789 32.7639 171.2581 155 P 4.8154 0.0000 0.0000 61.9526 31.9771 175.5586 156 P 4.4377 0.0000 0.0000 64.4987 32.2432 176.6980 157 N 4.9544 8.1286 116.6061 51.2998 37.8572 174.4276 158 A 4.1785 7.6729 122.4911 52.8425 19.3003 178.9242 159 D 4.6517 8.5181 123.1188 52.8041 41.9305 176.7228 160 D 4.4929 8.8214 119.5959 58.3383 40.9690 178.2568 161 D 4.2698 8.1573 118.5436 57.1332 40.8498 177.9425 162 L 3.9269 9.0998 120.6459 58.4851 42.0253 179.1339 163 L 4.0294 8.0016 118.5066 58.2513 41.5322 179.8120 164 R 3.7784 7.9332 117.4887 59.8853 29.9509 178.4327 165 Q 3.6085 8.1149 117.6219 58.3272 28.6037 178.6580 166 I 3.4836 8.2011 120.0761 64.7672 37.2976 177.8733 167 A 4.0468 7.9610 120.3296 55.5265 18.2380 179.6322 168 S 4.1278 7.3110 110.6840 61.9192 63.3281 175.9924 169 Y 4.5232 7.4050 119.5161 59.0541 37.9258 176.7633 170 G 4.6041 7.8385 108.0254 44.4443 0.0000 172.9179 171 R 4.6586 8.2124 120.3917 54.6297 34.6126 177.3399 172 G 3.6441 9.3016 112.0158 46.0561 0.0000 174.1741 173 Y 5.2115 7.9877 116.4833 55.2756 42.8320 176.3342 174 T 4.5398 9.3257 115.3864 61.9450 72.2738 173.2517 175 Y 4.6484 8.6209 128.6230 56.5856 39.6237 173.6621 176 L 4.7294 8.2873 129.9816 53.9430 43.3001 175.3008 177 L 4.8147 8.9707 130.6488 54.6963 42.7081 176.8775 178 S 4.5413 8.5804 120.1931 57.5161 64.6165 175.3764 179 R 4.3048 8.6277 114.1452 57.0182 28.5833 176.9092 180 A 4.7049 8.0320 119.9989 52.5658 20.3414 177.8967 181 G 2.9089 8.0254 102.7996 44.5943 0.0000 172.7073 *189 A 3.9595 7.7151 121.8374 51.4206 19.5966 176.0898 190 A 4.4729 8.4269 123.6938 51.5186 18.9061 177.4891 191 L 4.4039 8.4066 123.5530 53.5873 42.9650 175.6158 192 P 4.2822 0.0000 0.0000 63.0457 30.9921 177.1243 193 L 4.0541 8.8505 120.8911 56.5499 42.1710 178.3020 194 N 4.6750 8.6109 118.5482 55.5859 39.1507 176.5349 195 H 4.0726 8.1867 119.1227 59.4220 29.8240 176.7609 196 L 3.7834 7.8576 119.9002 57.9247 41.4703 179.2352 197 V 3.4978 7.2436 117.9110 66.1522 31.2681 178.0196 198 A 3.8530 7.8333 119.9352 55.1916 17.9030 179.7276 199 K 3.4938 8.3416 116.6918 58.5106 32.0932 179.2053 200 L 4.0568 7.4512 119.4831 57.1597 41.9259 178.7055 201 K 3.7973 7.8507 117.1261 59.6642 31.9842 178.6668 202 E 4.0086 8.0787 118.8412 59.1512 29.8228 178.7254 203 Y 4.7347 6.9883 113.6715 59.7375 39.8589 175.2603 204 N 4.0735 8.3859 112.7808 54.0048 36.5602 174.5516 205 A 4.6149 7.5823 118.4405 51.1365 19.7704 178.6946 206 A 4.1706 8.6253 121.2004 51.5536 19.5807 175.9319 207 P 4.1535 0.0000 0.0000 62.5220 32.5495 173.7726 208 P 5.0646 0.0000 0.0000 62.3590 33.3551 174.8640 209 L 5.0211 9.5066 125.7778 52.7531 43.9205 175.5128 210 Q 4.4499 8.7740 127.0155 55.8719 29.9863 175.1428 211 G 4.6044 8.4220 111.8781 43.7448 0.0000 170.3797 212 F 3.6994 8.9262 122.8707 59.3724 38.4129 173.9661 213 G 3.6857 8.0545 115.5299 46.4361 0.0000 173.1057 214 I 4.5583 7.6831 121.7024 59.1320 37.0234 175.5013 215 S 4.9275 8.9247 123.4346 55.4696 63.7697 175.1060 216 A 4.7057 7.8692 120.3941 50.2852 23.2274 175.1019 217 P 4.1242 0.0000 0.0000 65.9830 31.3601 178.3187 218 D 4.4698 8.2248 116.9654 58.1521 40.7434 178.8903 219 Q 4.0319 7.9575 117.4428 58.9481 28.8551 179.1653 220 V 3.6051 7.9348 119.3856 65.8040 31.4768 177.8813 221 K 4.5352 8.9677 121.2347 58.9991 31.8891 178.6169 222 A 3.9620 8.2361 120.6935 54.8427 18.2336 179.0488 223 A 3.9473 8.3348 119.8277 55.8421 18.3598 180.0564 224 I 3.8583 7.7631 117.8293 64.6033 36.9219 178.4143 225 D 4.3813 7.6703 118.6556 57.2342 40.7821 178.2803 226 A 4.1791 8.0018 119.4496 53.2773 18.4083 178.1643 227 G 3.8575 8.2069 105.9143 44.6817 0.0000 174.1347 228 A 4.0712 7.3172 122.0475 51.9941 18.9593 177.7678 229 A 4.2518 8.9568 122.5189 51.7617 19.4244 177.6800 230 G 4.6075 6.7943 106.4099 46.2719 0.0000 171.6167 231 A 5.4856 8.3624 122.3544 49.9907 22.6392 175.4781 232 I 5.5381 8.1173 118.6079 58.5701 40.2365 175.3103 233 S 4.7414 8.6814 119.5747 57.0537 65.9211 174.1731 234 G 4.2006 8.6442 109.8873 46.0402 0.0000 174.6060 235 S 3.9518 8.2766 113.7260 61.3345 62.2629 175.6922 236 A 3.8277 7.9730 122.5742 55.5643 17.8686 179.4355 237 I 3.3806 7.5270 117.3474 64.3034 37.0137 178.7762 238 V 3.5678 7.6573 119.0272 65.8996 31.4135 177.8895 239 K 3.8026 8.2162 118.6722 59.8378 31.8698 179.1614 240 I 3.6900 7.7499 119.5337 64.5980 36.8235 178.6069 241 I 3.7565 7.2714 119.3676 64.1270 37.2327 178.0042 242 E 4.0404 8.3133 120.5055 59.5121 29.4362 178.9454 243 Q 4.1443 8.2265 116.6877 58.0059 28.9139 176.8493 244 H 5.0618 7.7847 116.8215 55.5812 29.6776 174.7003 245 I 3.9456 7.7689 115.9744 61.7221 37.1831 175.9536 246 N 5.0013 8.0068 115.0015 52.6368 40.7369 174.6081 247 E 4.6347 7.8459 118.7180 52.9978 28.9094 174.1986 248 P 4.3107 0.0000 0.0000 65.8041 31.5375 177.3328 249 E 3.8077 8.0752 117.1379 58.8879 29.7919 178.7059 250 K 3.8599 7.8322 118.2739 59.4001 32.3837 178.5268 251 M 3.8986 9.1085 119.4140 58.9409 31.9413 178.3931 252 L 4.0193 7.5552 118.3270 57.5132 41.7088 179.2782 253 A 3.9809 7.5939 120.2297 55.1128 18.3149 179.4228 254 A 3.9258 7.7944 119.0314 55.4683 18.4385 179.9398 255 L 4.0933 7.8019 116.9881 57.9133 41.4840 179.8869 256 K 4.0561 8.6786 118.7589 59.3676 32.0150 179.2177 257 V 3.7861 8.2200 118.2179 65.3094 31.3482 177.7526 258 F 4.3491 8.3294 120.9126 61.6545 39.3351 176.4786 259 V 3.0399 8.6023 117.9653 64.0077 30.8336 179.7788 260 Q 3.1965 7.1380 116.1515 57.1537 29.3767 177.1929 261 P 4.1549 0.0000 0.0000 66.2412 31.0192 177.7962 262 M 3.5371 6.7029 118.6262 57.5738 32.3110 178.5764 263 K 3.8357 7.3194 118.8830 59.4380 32.1746 178.6444 264 A 4.0074 8.4679 121.2719 54.5752 18.3333 178.7573 265 A 4.2293 8.0063 118.4035 53.6430 18.2626 178.3824 266 T 4.2936 7.6150 107.2684 61.0312 69.0828 174.1118 267 R 4.6077 7.2226 120.3946 55.1776 33.3006 176.0945 268 S 4.0961 8.0386 112.3208 58.6346 64.6417 172.2624 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 M 8.16 4.32 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.60 0.00 2 E 9.07 3.07 0.00 2.20 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 2.34 2.35 0.00 3 R 9.85 3.84 0.00 1.69 1.76 0.00 3.55 0.00 0.00 3.36 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 4 Y 7.92 3.78 0.00 3.30 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.63 4.08 0.00 2.14 2.17 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 2.47 2.52 0.00 6 S 8.65 4.15 0.00 3.88 3.94 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 7 L 8.03 3.88 0.00 1.58 1.65 0.91 1.06 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 8 F 8.20 4.76 0.00 3.41 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 9 A 8.17 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 10 Q 8.33 4.29 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.62 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 11 L 7.53 4.47 0.00 2.11 2.02 1.25 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 12 K 7.95 3.93 0.00 1.90 1.98 0.00 1.55 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.51 7.81 13 E 7.80 3.82 0.00 1.94 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 2.35 2.33 0.00 14 R 7.43 4.22 0.00 1.99 2.13 0.00 3.55 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 15 K 9.05 3.98 0.00 1.73 1.89 0.00 1.67 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.50 7.81 16 E 8.41 4.85 0.00 2.13 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.29 0.00 17 G 8.75 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 18 A 8.84 5.78 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 19 F 8.96 5.05 0.00 3.11 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 20 V 9.05 4.68 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 1.10 0.00 0.00 0.87 0.00 0.00 21 P 0.00 4.73 0.00 2.19 2.15 0.00 3.50 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.91 0.00 22 F 9.54 5.84 0.00 3.01 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 23 V 7.17 4.36 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 0.58 0.00 0.00 0.86 0.00 0.00 24 T 8.05 4.81 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 1.27 0.00 0.00 25 L 8.10 3.86 0.00 1.55 1.57 0.79 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.93 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 27 D 7.72 4.84 0.00 2.67 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.43 0.00 2.21 2.16 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 29 G 7.50 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 0.00 0.00 0.00 0.00 30 I 8.11 3.69 1.86 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 1.50 0.51 0.89 0.00 0.00 31 E 8.05 3.90 0.00 2.02 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 2.37 2.36 0.00 32 Q 7.90 3.91 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 33 S 8.53 4.19 0.00 4.09 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 34 L 7.85 3.92 0.00 1.89 1.71 0.91 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 35 K 8.08 4.00 0.00 2.11 1.90 0.00 1.51 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.53 7.81 36 I 8.23 3.75 2.02 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 1.52 0.74 0.90 0.00 0.00 37 I 7.67 3.63 1.82 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 1.56 0.38 0.82 0.00 0.00 38 D 8.01 4.33 0.00 2.72 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 39 T 7.14 3.89 4.43 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 1.24 0.00 0.00 40 L 8.23 4.23 0.00 1.89 1.76 0.92 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 41 I 7.93 3.78 2.02 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.67 0.88 0.00 0.00 42 E 8.53 4.36 0.00 2.02 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 2.37 2.39 0.00 43 A 9.71 4.61 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 44 G 8.50 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 0.00 0.00 0.00 45 A 7.18 4.23 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 46 D 8.58 4.66 0.00 2.71 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 47 A 7.33 4.66 1.07 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 0.00 0.00 48 L 8.34 4.42 0.00 1.57 1.49 0.82 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.50 4.58 0.00 2.07 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 2.48 2.61 0.00 50 L 8.85 4.32 0.00 1.54 1.42 0.83 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.90 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 52 I 7.84 4.98 1.85 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.61 0.93 0.00 0.00 53 P 0.00 4.42 0.00 2.24 2.09 0.00 3.81 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 2.08 0.00 54 F 8.44 3.64 0.00 3.10 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 *76 V 7.80 3.84 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 0.85 0.00 0.00 0.90 0.00 0.00 77 T 9.73 4.25 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 1.16 0.00 0.00 78 P 0.00 4.27 0.00 2.38 2.43 0.00 3.71 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 2.26 2.30 0.00 79 A 8.34 4.29 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 80 Q 7.64 3.97 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 81 C 7.82 4.07 0.00 2.96 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 82 F 8.84 4.09 0.00 3.14 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 83 E 8.08 4.05 0.00 2.32 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 0.00 2.31 2.36 0.00 84 M 8.56 4.05 0.00 2.00 2.18 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 85 L 8.02 3.84 0.00 1.85 1.69 0.57 0.59 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 86 A 8.02 4.37 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 87 L 7.80 3.90 0.00 1.94 1.72 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 88 I 8.42 3.68 1.97 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 1.39 1.15 0.88 0.00 0.00 89 R 7.94 3.99 0.00 1.81 2.22 0.00 3.31 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 90 E 8.11 4.03 0.00 1.98 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 2.32 2.40 0.00 91 K 8.25 4.27 0.00 2.00 1.72 0.00 1.91 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.43 7.81 92 H 8.80 4.80 0.00 3.03 3.13 0.00 5.64 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 4.36 0.00 2.15 2.18 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 94 T 7.62 4.16 4.19 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 1.19 0.00 0.00 95 I 6.94 3.42 1.81 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.57 0.91 0.00 0.00 96 P 0.00 4.00 0.00 1.57 0.65 0.00 3.62 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 97 I 10.90 4.30 1.81 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.02 0.87 0.00 0.00 98 G 8.61 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.78 5.33 0.00 1.66 1.58 0.81 0.19 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 0.00 100 L 8.58 4.94 0.00 1.81 1.72 0.98 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 101 M 8.58 4.68 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.59 0.00 102 Y 8.09 5.06 0.00 2.89 3.13 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 0.00 103 A 9.99 3.96 1.49 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 0.00 0.00 104 N 8.32 4.58 0.00 2.84 2.89 0.00 0.00 6.76 6.74 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 0.00 105 L 7.97 3.91 0.00 1.68 1.53 1.04 0.99 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 0.00 106 V 7.22 2.80 1.82 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 0.79 0.00 0.00 0.05 0.00 0.00 107 F 8.39 4.41 0.00 3.28 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 0.00 108 N 8.48 4.56 0.00 2.74 3.12 0.00 0.00 7.19 6.56 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 0.00 109 K 7.78 4.64 0.00 1.94 2.03 0.00 2.07 0.00 0.00 2.05 0.00 0.00 3.06 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.53 1.56 7.81 110 G 7.07 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 0.00 111 I 7.95 3.45 1.79 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 0.74 0.54 0.77 0.00 0.00 112 D 8.41 4.51 0.00 2.76 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 0.00 113 E 8.27 4.00 0.00 2.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 114 F 8.32 4.20 0.00 3.14 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 0.00 115 Y 8.29 3.85 0.00 3.13 3.13 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 0.00 116 A 8.36 3.90 1.10 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 0.00 0.00 117 R 7.79 3.72 0.00 1.79 1.03 0.00 2.43 0.00 0.00 2.80 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.22 0.00 118 C 7.41 4.13 0.00 3.04 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 E 8.54 3.99 0.00 2.20 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 0.00 2.33 2.39 0.00 120 K 7.45 4.20 0.00 1.68 1.79 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.64 7.81 121 V 7.36 4.18 2.17 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 1.01 0.00 0.00 1.21 0.00 0.00 122 G 8.04 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 0.00 123 V 7.63 3.68 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 0.93 0.00 0.00 0.90 0.00 0.00 124 D 9.82 5.09 0.00 2.52 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 0.00 125 S 8.01 5.25 0.00 4.00 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 0.00 126 V 8.37 4.75 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 0.87 0.00 0.00 0.98 0.00 0.00 127 L 8.76 4.22 0.00 1.76 1.70 0.83 0.58 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 0.00 128 V 8.48 4.57 1.70 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 0.77 0.00 0.00 0.92 0.00 0.00 129 A 8.27 3.22 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 0.00 130 D 9.45 4.27 0.00 2.84 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 0.00 131 V 7.45 3.60 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.09 0.00 0.00 132 P 0.00 4.54 0.00 2.26 2.17 0.00 3.78 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.96 0.00 133 V 8.48 3.56 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 0.86 0.00 0.00 0.94 0.00 0.00 134 E 8.13 4.07 0.00 1.95 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 2.30 2.44 0.00 135 E 7.54 4.69 0.00 2.00 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 2.27 2.46 0.00 136 S 8.42 4.37 0.00 4.28 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 0.00 137 A 7.36 3.72 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 0.00 138 P 0.00 4.20 0.00 1.99 2.28 0.00 4.02 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 139 F 9.12 3.93 0.00 3.18 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 R 8.24 4.04 0.00 2.07 2.16 0.00 3.42 0.00 0.00 3.64 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.94 0.00 141 Q 8.11 3.91 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.50 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 142 A 7.63 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 A 7.58 3.83 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 0.00 144 L 7.20 3.78 0.00 1.80 1.73 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 145 R 8.35 4.04 0.00 1.54 1.77 0.00 3.05 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 146 H 7.91 4.93 0.00 3.22 3.45 0.00 5.78 0.00 0.00 0.00 0.00 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 N 8.14 4.15 0.00 2.95 2.87 0.00 0.00 6.85 7.68 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 0.00 148 V 8.57 4.77 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 0.98 0.00 0.00 1.15 0.00 0.00 149 A 9.17 4.46 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 0.00 150 P 0.00 4.50 0.00 2.12 1.94 0.00 3.60 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.09 0.00 151 I 7.84 4.28 1.60 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.28 0.52 0.00 0.00 152 F 8.34 5.03 0.00 2.97 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 0.00 153 I 8.50 4.74 1.89 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.54 0.97 0.00 0.00 154 C 9.18 4.76 0.00 3.04 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 0.00 155 P 0.00 4.82 0.00 2.36 2.17 0.00 3.80 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.98 0.00 156 P 0.00 4.44 0.00 2.14 2.56 0.00 3.63 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 2.06 2.09 0.00 157 N 8.13 4.95 0.00 2.84 2.91 0.00 0.00 6.38 7.26 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 0.00 158 A 7.67 4.18 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 0.00 159 D 8.52 4.65 0.00 2.94 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 0.00 160 D 8.82 4.49 0.00 2.88 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 0.00 161 D 8.16 4.27 0.00 3.08 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 0.00 162 L 9.10 3.93 0.00 1.79 1.90 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 163 L 8.00 4.03 0.00 2.11 1.90 0.95 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 0.00 164 R 7.93 3.78 0.00 1.91 1.71 0.00 2.95 0.00 0.00 2.87 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 1.43 0.00 165 Q 8.11 3.61 0.00 2.27 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.67 0.00 0.00 0.00 0.00 0.00 2.41 2.64 0.00 166 I 8.20 3.48 2.03 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.88 1.02 0.00 0.00 167 A 7.96 4.05 1.46 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 0.00 168 S 7.31 4.13 0.00 3.76 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 Y 7.40 4.52 0.00 2.50 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 0.00 170 G 7.84 4.60 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 0.00 171 R 8.21 4.66 0.00 1.80 1.89 0.00 3.50 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 172 G 9.30 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 Y 7.99 5.21 0.00 3.11 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 0.00 174 T 9.33 4.54 4.30 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 1.29 0.00 0.00 175 Y 8.62 4.65 0.00 3.25 3.08 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 0.00 176 L 8.29 4.73 0.00 1.85 1.50 0.98 0.30 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 0.00 177 L 8.97 4.81 0.00 1.77 1.70 0.88 0.79 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 0.00 178 S 8.58 4.54 0.00 4.09 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 0.00 179 R 8.63 4.30 0.00 1.94 2.09 0.00 3.08 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 180 A 8.03 4.70 1.56 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 0.00 181 G 8.03 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 0.00 0.00 0.00 *189 A 7.72 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 0.00 190 A 8.43 4.47 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 0.00 191 L 8.41 4.40 0.00 1.63 1.59 1.00 1.12 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 0.00 192 P 0.00 4.28 0.00 2.12 2.21 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.02 0.00 193 L 8.85 4.05 0.00 1.74 1.76 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 194 N 8.61 4.67 0.00 2.74 2.84 0.00 0.00 6.60 7.75 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 0.00 195 H 8.19 4.07 0.00 3.22 3.49 0.00 5.88 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 0.00 196 L 7.86 3.78 0.00 1.67 1.67 0.93 0.90 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 0.00 197 V 7.24 3.50 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 1.05 0.00 0.00 0.93 0.00 0.00 198 A 7.83 3.85 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 0.00 199 K 8.34 3.49 0.00 1.64 1.60 0.00 1.16 0.00 0.00 1.36 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.12 1.46 7.81 200 L 7.45 4.06 0.00 1.79 1.65 0.91 0.63 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 0.00 201 K 7.85 3.80 0.00 1.77 1.84 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.61 7.81 202 E 8.08 4.01 0.00 1.75 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 2.32 2.31 0.00 203 Y 6.99 4.73 0.00 2.98 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 0.00 204 N 8.39 4.07 0.00 2.79 2.91 0.00 0.00 7.13 7.35 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 0.00 205 A 7.58 4.61 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 A 8.63 4.17 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 P 0.00 4.15 0.00 1.00 1.15 0.00 3.97 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 1.96 1.92 0.00 208 P 0.00 5.06 0.00 2.09 2.17 0.00 3.50 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 209 L 9.51 5.02 0.00 1.37 1.45 0.42 0.64 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 0.00 210 Q 8.77 4.45 0.00 2.11 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.63 0.00 0.00 0.00 0.00 0.00 2.35 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2.12 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.92 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 220 V 7.93 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 1.09 0.00 0.00 1.01 0.00 0.00 221 K 8.97 4.54 0.00 2.04 1.93 0.00 1.76 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.45 7.81 222 A 8.24 3.96 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 0.00 223 A 8.33 3.95 1.56 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 0.00 224 I 7.76 3.86 1.87 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 1.54 0.50 0.91 0.00 0.00 225 D 7.67 4.38 0.00 2.72 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 0.00 226 A 8.00 4.18 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 0.00 227 G 8.21 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 0.00 0.00 0.00 228 A 7.32 4.07 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 0.00 229 A 8.96 4.25 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 G 6.79 4.61 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 0.00 231 A 8.36 5.49 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 0.00 232 I 8.12 5.54 1.83 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.51 1.00 0.00 0.00 233 S 8.68 4.74 0.00 4.25 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 0.00 234 G 8.64 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 0.00 0.00 0.00 235 S 8.28 3.95 0.00 3.81 3.81 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 0.00 236 A 7.97 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 I 7.53 3.38 2.07 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.38 0.91 0.00 0.00 238 V 7.66 3.57 2.24 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 1.12 0.00 0.00 1.06 0.00 0.00 239 K 8.22 3.80 0.00 1.85 1.82 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.62 7.81 240 I 7.75 3.69 1.76 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.27 0.93 0.00 0.00 241 I 7.27 3.76 2.03 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 1.40 0.66 0.91 0.00 0.00 242 E 8.31 4.04 0.00 2.18 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 2.29 2.34 0.00 243 Q 8.23 4.14 0.00 1.89 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.14 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 244 H 7.78 5.06 0.00 3.21 3.27 0.00 5.61 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 I 7.77 3.95 2.01 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 1.30 0.75 0.96 0.00 0.00 246 N 8.01 5.00 0.00 2.70 2.79 0.00 0.00 6.89 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 0.00 247 E 7.85 4.63 0.00 2.11 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 2.25 2.30 0.00 248 P 0.00 4.31 0.00 2.15 2.27 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 249 E 8.08 3.81 0.00 2.03 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 2.36 2.39 0.00 250 K 7.83 3.86 0.00 1.97 1.76 0.00 1.90 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.49 7.81 251 M 9.11 3.90 0.00 2.04 2.36 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.60 0.00 252 L 7.56 4.02 0.00 1.79 1.70 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 253 A 7.59 3.98 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 0.00 254 A 7.79 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 0.00 255 L 7.80 4.09 0.00 1.95 1.81 0.93 0.47 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 0.00 256 K 8.68 4.06 0.00 1.86 1.89 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.58 7.81 257 V 8.22 3.79 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 0.82 0.00 0.00 1.01 0.00 0.00 258 F 8.33 4.35 0.00 3.26 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 V 8.60 3.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.20 0.00 0.00 260 Q 7.14 3.20 0.00 2.27 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.54 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 261 P 0.00 4.15 0.00 2.08 2.17 0.00 3.54 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.02 0.00 262 M 6.70 3.54 0.00 0.74 0.94 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 1.59 1.85 0.00 263 K 7.32 3.84 0.00 1.67 1.75 0.00 1.57 0.00 0.00 1.87 0.00 0.00 3.56 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.47 7.81 264 A 8.47 4.01 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 0.00 265 A 8.01 4.23 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 0.00 266 T 7.62 4.29 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 1.34 0.00 0.00 267 R 7.22 4.61 0.00 1.72 1.86 0.00 3.14 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.51 0.00 268 S 8.04 4.10 0.00 4.05 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 * Residues marked with a * may have inaccurate shift predictions.