NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.5450 8.1744 117.3281 63.2080 70.1731 172.9495 6 V 3.4775 8.6601 127.7959 62.0370 32.7450 169.7189 7 V 4.3029 9.2429 129.4865 62.1930 32.8502 174.3369 8 V 4.4896 8.7009 129.9320 61.8802 33.0807 174.5400 9 T 4.7720 8.8909 123.9635 61.6393 69.1643 173.3611 10 T 4.9220 8.5101 121.5731 61.1370 71.7515 171.4774 11 I 4.5625 7.8641 122.6164 58.9152 40.9513 175.7397 12 L 4.3610 8.4115 128.1785 53.8109 40.3705 174.9225 13 E 4.6195 8.5080 121.9733 54.0396 32.4553 175.0921 14 S 4.2349 8.6978 122.9177 57.9324 63.6863 172.0541 15 P 4.2290 0.0000 0.0000 62.5815 31.7100 177.2813 16 Y 3.9614 7.2195 118.2850 61.2118 38.3168 176.0434 17 V 4.7610 8.0363 119.8657 61.6963 35.0173 173.5435 18 M 5.0906 9.1420 126.7597 53.6986 36.8526 174.2499 19 M 4.7518 8.5986 120.9259 54.7287 32.3781 176.7742 20 K 4.2045 9.1742 126.2484 56.8974 33.0509 179.1603 *21 K 4.1287 8.9181 123.9117 56.9454 31.8509 178.3993 22 N 5.0812 7.2104 112.4497 52.3798 37.8587 175.9079 23 H 4.0129 8.5122 119.3747 60.2292 28.6367 174.8643 *24 E 4.3899 7.6504 115.4917 58.2075 28.4625 178.1379 25 M 4.2797 7.7013 134.3017 54.6283 31.0595 175.5893 26 L 4.8057 7.3411 119.1376 53.0008 44.6148 175.2772 27 E 4.6937 7.9389 119.5099 55.0027 34.3643 176.6012 28 G 3.9204 8.4922 107.4157 46.3470 0.0000 175.5081 29 N 4.6251 8.7139 115.6046 56.3381 38.8305 176.9456 30 E 4.1307 7.6012 115.8845 58.8623 29.7901 178.5647 31 R 3.8390 7.7538 117.6462 58.0353 30.2113 175.9651 32 Y 5.3565 7.1711 114.1070 56.2671 40.7312 174.4845 33 E 4.6623 8.7713 118.2527 54.9931 32.9083 174.7219 34 G 2.9212 8.0320 106.3362 42.6313 0.0000 173.5046 35 Y 3.8408 7.3014 120.8680 61.1229 38.6002 178.2007 36 C 4.1299 8.2365 116.8731 62.1033 28.3129 176.3489 37 V 3.5830 7.3796 120.0073 65.9388 31.2462 177.6173 38 D 4.3748 8.0386 118.6693 57.3627 40.7335 178.5096 39 L 3.7472 7.9250 120.7812 57.9010 41.9487 178.9082 40 A 3.7168 7.9340 120.6181 54.8900 18.2686 179.4685 41 A 4.1385 7.7386 120.2697 54.7371 18.4338 179.7688 42 E 3.8994 8.0965 117.3493 59.6080 29.5408 179.7063 43 I 3.6967 7.7607 112.8511 63.6415 37.6231 178.0994 44 A 2.0000 7.6621 122.6540 54.0879 17.8707 179.5330 45 K 3.7365 7.5602 117.0475 60.0893 32.4431 178.6997 46 H 4.2179 8.1330 114.7649 58.1217 28.6764 176.6277 47 C 4.5040 8.0062 116.8550 58.4367 29.8633 173.0066 48 G 3.7174 8.2809 108.2634 45.5318 0.0000 172.9922 49 F 5.0238 7.1870 113.1814 55.7974 41.7166 174.9758 50 K 4.9360 8.7343 125.1308 54.3503 33.6818 175.7560 51 Y 5.5993 8.0430 122.0099 56.0628 42.5130 174.3013 52 K 4.9731 9.3579 122.6071 53.2887 35.4554 174.8340 53 L 4.7724 9.5023 127.5400 53.7574 42.4693 176.8935 54 T 4.6678 8.8422 114.1104 59.7413 71.9696 173.3207 55 I 4.4575 8.3715 126.4934 60.5199 38.3989 176.1545 56 V 3.4774 8.8630 127.3245 62.1562 31.5686 176.7999 57 G 3.8490 9.1823 115.5170 48.7604 0.0000 173.7255 58 D 4.5030 8.1267 116.4261 52.2714 39.9001 176.5649 59 G 3.8462 7.9311 107.4189 46.4711 0.0000 173.6593 60 K 4.6175 7.9837 118.5642 54.4800 34.9655 177.3629 61 Y 3.7541 8.9722 117.5029 61.2357 38.1282 174.3300 62 G 3.6282 7.3934 112.5033 44.6909 0.0000 171.7042 63 A 4.9247 9.2317 128.9702 49.6747 23.3168 174.3804 64 R 3.9751 7.5491 119.9176 53.9483 31.3541 175.5726 65 D 4.2875 8.5413 127.0417 54.4010 41.5733 177.1582 66 A 3.8747 8.8814 131.4592 55.8424 18.5897 178.7850 67 D 4.5482 7.9635 114.0011 56.0827 40.3840 180.6937 68 T 3.9175 8.6321 112.5655 62.8322 69.0314 175.9310 69 K 3.9209 7.8276 122.2202 55.0194 30.0177 180.1228 70 I 4.7267 7.1046 113.2549 60.1131 39.8442 174.9250 71 W 4.8962 9.2795 125.6452 56.6600 30.0381 175.5636 72 N 4.9817 9.1099 122.1099 51.9266 40.4265 174.3767 73 G 3.7585 9.1953 106.6002 46.6970 0.0000 174.5507 74 M 4.0470 8.0597 117.0984 58.3614 31.8096 178.8062 75 V 3.5070 7.8030 118.3537 65.7645 31.6144 178.2597 76 G 3.7540 8.5142 105.9126 48.0954 0.0000 175.5030 77 E 4.0439 8.2123 120.8835 58.8004 29.2281 179.5592 78 L 4.0884 7.4687 119.1433 57.5027 41.6689 179.3729 79 V 3.2456 7.3922 117.4341 65.7226 31.3667 176.1946 80 Y 4.5963 7.8090 114.5764 57.8059 38.0522 176.2592 81 G 3.8628 7.9931 110.5992 46.4919 0.0000 175.4719 82 K 4.2417 8.0723 120.2882 55.2902 32.1721 180.4171 83 A 4.7394 7.5214 118.2829 51.7228 21.9110 175.3516 84 D 4.8292 8.0849 118.4353 53.0563 40.6223 176.0746 85 I 4.3793 7.1488 117.1125 60.2148 41.7499 172.4625 86 A 5.3978 8.8771 130.6919 49.6132 21.2898 175.3501 87 I 4.2608 8.1847 123.8508 60.4525 38.2637 174.8139 88 A 4.3666 8.0541 128.5243 50.7073 22.2467 175.2377 89 P 3.4446 0.0000 0.0000 61.3363 29.6391 174.9899 90 L 4.7460 7.3010 123.5144 54.1805 44.3494 175.9493 91 T 4.6215 8.6246 123.7009 63.6076 69.3904 174.4255 92 I 2.7319 8.1336 127.8922 60.6840 37.3138 175.6188 93 T 4.6184 8.0148 116.6056 58.7266 72.1631 174.6034 94 L 3.9352 8.6056 124.1838 58.5318 41.8884 179.4181 95 V 3.9486 7.9804 118.4433 65.4391 30.9354 178.3340 96 R 3.7928 7.8868 117.1098 58.8159 29.7855 178.8208 97 E 4.3365 8.3178 118.8879 58.7448 29.4886 178.8971 98 E 4.1518 8.2296 117.7648 58.2761 29.5706 177.8854 99 V 4.1485 6.8433 110.3746 60.8052 34.0747 174.8743 100 I 4.5458 7.6625 112.4515 59.1142 41.3665 173.7021 101 D 5.0488 8.6596 121.9287 52.7863 42.9652 175.9668 102 F 5.3083 8.5670 120.2403 55.6493 42.3178 175.3118 103 S 4.6301 9.0668 118.5816 57.4797 64.4164 173.8522 104 K 4.3837 9.0813 120.0535 55.2962 32.5111 176.0333 105 P 5.0154 0.0000 0.0000 62.9566 31.3779 176.2949 106 F 4.7567 8.1682 116.0146 57.5380 39.0336 175.1717 107 M 4.5825 6.9761 120.0623 54.8077 35.2782 173.5704 108 S 4.9672 8.3417 121.6462 57.6719 65.2037 172.7528 109 L 4.2175 7.8603 120.4989 55.6397 44.1787 173.3677 110 G 4.3164 8.0459 104.7976 45.9462 0.0000 172.8353 111 I 4.3923 8.5883 122.5125 61.2802 38.1801 175.9290 112 S 4.8216 9.1038 120.6433 56.9477 67.5277 172.2597 113 I 4.7831 7.9152 119.7683 59.7241 39.5274 174.6677 114 M 5.1818 9.0533 127.4478 53.7830 34.2397 174.5623 115 I 4.9710 8.7388 119.4371 58.5813 41.8029 174.5683 116 K 4.5737 8.5311 124.8986 55.9723 33.4174 176.1433 117 K 4.0569 8.6440 127.4553 57.4390 31.8125 175.9903 118 G 3.8110 9.3854 115.5404 46.2794 0.0000 174.6785 119 T 3.8749 7.6187 117.8793 63.1560 69.1369 173.7333 120 P 4.6631 0.0000 0.0000 62.3090 30.2088 176.5179 121 I 4.6348 7.2056 117.1970 60.5216 41.0520 175.7269 122 E 4.6393 8.9505 121.8661 55.1681 31.6239 175.6082 123 S 4.5334 7.3863 112.7091 56.2548 66.7653 175.4487 124 A 3.9469 8.4121 123.2563 55.2536 17.7680 179.2418 125 E 3.9968 8.1455 118.6833 58.8666 29.4522 178.6308 126 D 4.3345 7.7687 117.8404 57.2965 41.2356 178.3537 127 L 3.8185 7.6739 119.5453 57.8832 41.3161 179.7735 128 S 4.2899 8.6249 116.5964 61.9607 62.4510 176.5952 129 K 4.3387 7.5369 124.7493 58.3658 32.0278 179.8334 130 Q 4.6831 8.0467 116.5947 57.7035 31.3062 176.5287 *131 T 4.5793 8.2327 111.8927 61.7292 69.7638 170.9862 *132 E 4.2621 8.7474 121.0124 58.3203 30.4264 179.1072 133 I 4.6486 8.2738 121.0546 59.3532 38.2909 176.2850 134 A 4.6961 9.1746 129.7388 51.6833 19.7336 175.5343 135 Y 5.0192 7.5656 115.7279 56.4844 41.6950 174.2749 136 G 4.8172 8.4500 107.3314 45.7087 0.0000 170.4623 137 T 5.2810 8.6270 108.6884 59.5411 72.8141 172.7626 138 L 4.6348 8.8929 122.8981 55.8442 42.5081 177.2882 139 D 4.5177 9.6208 127.5940 57.3756 41.6363 176.9773 *140 S 4.5692 7.9366 113.5644 57.1483 66.6587 178.2151 141 G 4.1751 8.7354 108.1807 43.1633 0.0000 174.7976 142 S 4.1987 8.5466 114.1970 61.4383 62.4731 176.6420 143 T 3.9143 7.8302 119.3395 66.1912 68.3782 176.5165 144 K 4.3026 8.2477 123.5699 60.2739 32.2879 179.0294 *145 E 3.9667 8.0539 118.3212 61.0333 29.6054 180.2699 146 F 4.1493 8.2719 122.0642 61.5478 39.0646 177.5367 147 F 4.1310 7.9402 117.6623 61.0115 38.8047 178.2875 *148 R 4.1492 7.0763 121.8850 61.6104 29.3032 181.4495 149 R 4.2340 7.6821 120.0839 58.7758 30.0897 178.9558 150 S 4.0270 7.0593 113.6610 59.9965 62.5968 174.7388 151 K 4.5115 8.2921 125.6394 54.2049 32.9156 175.8151 152 I 3.9809 7.6480 121.2082 61.3654 38.5911 176.2952 153 A 3.9779 8.5281 126.8115 55.4124 18.2698 179.9545 154 V 3.5406 7.5086 115.8377 66.4377 31.6735 178.1365 155 F 4.9877 7.7606 116.9324 60.8410 38.7962 177.0503 156 D 4.7199 8.9243 120.6585 57.7310 40.8731 179.1330 *157 K 4.0577 8.3813 124.6269 60.0575 31.7463 182.3260 158 M 4.7914 8.5579 121.3591 57.2713 31.8172 178.8595 159 W 4.4484 8.5983 129.1488 60.8572 30.8319 178.3127 160 T 3.6691 8.0078 108.2858 64.6729 68.1772 175.6117 161 Y 4.0663 7.8441 122.2805 60.7863 38.6252 177.3653 162 M 3.0461 7.6860 119.7147 58.0791 31.8957 179.1203 163 R 3.6080 6.9943 113.5448 58.1750 29.4566 177.3048 164 S 4.4147 6.7221 111.8448 57.6914 64.1431 174.2990 165 A 3.7913 6.7770 123.7699 52.1695 18.4642 176.9631 166 E 4.6381 8.2026 120.7264 53.6861 33.2979 174.0451 167 P 4.3696 0.0000 0.0000 61.8388 32.2191 175.8388 168 S 3.8280 8.4387 112.8659 59.5086 62.4926 174.6103 169 V 4.0620 7.8846 119.0438 61.8521 32.5878 175.5283 170 F 5.8216 7.4250 119.7465 56.2367 40.0847 175.6370 171 V 4.4662 8.4812 115.1351 59.5780 34.2946 177.0223 172 R 4.0027 8.8190 124.0731 58.7464 30.4345 176.8771 173 T 4.8545 7.4633 106.3456 59.3929 73.3171 174.8815 174 T 4.1789 8.6949 118.7579 66.2800 68.5001 176.9014 175 A 4.0849 8.1122 122.2490 55.1214 18.2830 179.1827 176 E 3.9049 8.0001 118.2236 59.3438 29.5864 179.2849 177 G 2.5644 7.6117 105.5253 47.1868 0.0000 175.9895 178 V 3.6583 7.7451 120.2767 65.8547 31.6668 178.0451 179 A 4.0141 8.1632 120.7288 55.1235 17.8449 179.6149 180 R 3.7290 8.2786 117.7555 59.2788 29.8425 178.9443 181 V 3.8533 7.4483 117.2381 66.3563 31.7398 178.1518 182 R 4.1304 8.0389 116.0576 58.1411 29.9160 178.1454 183 K 4.5420 7.8554 115.4401 56.2323 32.9891 177.0811 184 S 4.6021 7.7941 115.3148 56.9487 63.1198 174.1139 185 K 3.8316 9.1986 119.5110 57.6359 29.3723 176.0705 186 G 3.9497 8.5486 103.4980 45.8145 0.0000 174.3226 187 K 4.6164 8.0673 117.6111 56.0541 33.4621 175.0519 188 Y 5.3943 7.9183 120.7421 55.8936 42.0607 173.9071 189 A 4.8953 8.3376 127.6407 50.1452 22.0096 174.1319 190 Y 5.1995 8.7249 122.1422 55.7916 41.8594 174.4847 191 L 4.8257 8.3614 127.2098 53.5284 42.6551 175.5974 192 L 4.5560 8.1237 123.7770 53.7329 44.9509 175.3800 193 E 4.4183 8.6393 118.2570 56.0392 30.1194 178.3371 194 S 4.4614 9.4223 120.9247 61.1650 62.7782 177.2412 195 T 4.6047 7.8461 113.9542 64.4768 68.5743 175.9763 196 M 4.2575 8.2637 121.1178 58.1246 32.5249 177.1941 197 N 4.3818 8.3827 117.4803 56.9825 39.2869 176.6327 198 E 4.2159 8.7379 118.7071 59.1224 29.6840 178.5184 199 Y 3.8839 8.0777 120.6059 60.7565 38.9216 177.5516 200 I 3.4738 7.9946 120.7752 64.1785 36.9247 177.9938 201 E 4.0266 8.0173 119.1368 58.5293 29.6609 177.8260 202 Q 4.4100 7.6546 116.6712 54.6696 29.2657 174.7794 203 R 4.7985 7.2339 122.5112 54.4496 32.4902 176.7469 204 K 4.4736 8.8450 123.6803 53.8672 32.2325 175.0943 205 P 4.5109 0.0000 0.0000 63.1450 31.0018 176.8763 206 C 4.2490 8.1461 115.0972 58.9933 39.4348 173.1497 207 D 5.0238 8.0937 115.4003 53.2237 40.5406 175.4891 208 T 5.2000 7.8590 108.3516 60.6788 72.0419 172.7997 209 M 5.0173 9.0582 121.1219 54.1377 36.2865 173.1821 210 K 4.9391 9.1748 127.2885 55.5083 33.2038 176.1007 211 V 4.4597 8.5662 120.2697 60.5156 35.7222 176.2204 212 G 4.2199 8.9600 109.3527 45.2205 0.0000 173.5550 213 G 3.9137 8.1944 108.0956 44.1291 0.0000 173.5348 214 N 4.5641 8.3892 117.0933 53.4574 38.9578 175.8179 215 L 4.2541 8.7422 122.5867 56.9152 42.2057 175.9002 216 D 4.6930 7.1612 116.1015 52.5128 42.8304 173.8009 217 S 4.7475 8.3485 113.2279 57.2492 66.6178 173.8537 218 K 4.5816 8.9693 123.3632 55.1442 36.9661 174.9854 219 G 4.0963 7.9419 105.2930 45.4999 0.0000 171.9308 220 Y 5.1138 8.1369 120.1717 56.8661 39.6883 175.0306 221 G 4.6808 8.7679 108.6451 44.7908 0.0000 171.9654 222 I 4.6840 8.8954 122.1371 60.5483 38.6492 175.1269 223 A 5.1211 8.6086 128.3416 50.5318 21.9671 175.3886 224 T 4.7824 8.2860 108.6322 59.2302 73.0286 171.7357 225 P 4.5250 0.0000 0.0000 62.1733 32.7484 176.2675 226 K 4.2588 7.7665 121.2226 57.3859 32.4474 177.7206 227 G 3.8646 8.9793 110.3417 45.6623 0.0000 173.6021 228 S 4.1330 7.7435 116.9471 58.6785 62.7910 176.0224 *229 S 4.3736 8.4675 122.3373 60.0555 62.6310 174.9402 230 L 4.4020 7.9070 118.7698 57.3139 41.5364 179.0253 231 G 3.7568 7.6257 105.4193 47.9202 0.0000 175.0741 232 N 4.2840 8.1280 118.8613 56.3546 39.1448 176.5894 233 A 4.0406 7.9736 121.6046 55.3512 18.3171 179.8783 234 V 3.6792 7.6605 110.0055 64.3457 32.0007 178.1221 235 N 4.4981 8.1329 116.4953 56.7904 38.8930 176.9243 236 L 4.0219 7.9997 120.1885 57.8464 41.5758 179.4460 237 A 3.9977 8.1533 120.7373 55.0265 18.2433 179.9131 238 V 3.5658 7.6740 116.5024 65.9804 31.5498 178.3038 239 L 3.9883 7.8649 118.3148 57.6079 41.4865 179.0132 240 K 3.8643 8.0018 119.4299 59.7319 32.1406 178.6262 241 L 4.0861 8.0959 119.2796 57.7858 41.5310 179.2076 242 N 4.3195 8.3480 116.8453 56.9322 38.7789 176.8735 243 E 4.0281 8.1611 118.5963 59.3996 29.6327 178.8497 244 Q 4.2406 8.3428 116.5343 56.4175 28.9794 177.2099 245 G 3.9498 8.1051 108.8717 46.0291 0.0000 175.3407 246 L 3.9901 8.1773 123.4297 57.9303 41.9907 179.0275 247 L 4.1417 7.9671 118.5494 58.0009 41.5974 179.1050 248 D 4.4891 8.1434 118.4276 57.1351 40.8163 178.7386 249 K 4.0535 7.8921 119.2298 59.4923 32.0623 179.3742 250 L 4.2152 8.2330 119.2954 57.7547 41.4708 179.5532 251 K 4.3145 8.5834 119.7444 59.5995 32.0617 178.4548 252 N 4.7202 8.4873 117.5274 56.5232 38.7586 176.6689 253 K 4.2816 8.3221 122.4442 58.9696 32.1142 178.6744 254 W 4.4322 8.3933 117.0792 58.3544 29.1867 178.2710 255 W 4.3300 8.8292 118.3451 58.7334 29.2892 177.1810 256 Y 4.6012 7.7676 114.6978 60.0294 38.4646 177.6266 257 D 4.3963 8.4279 119.7936 57.3607 41.0867 178.3242 258 K 4.5213 7.7313 115.9616 56.0898 32.0384 177.2344 259 G 3.7890 8.0798 108.9181 45.7619 0.0000 174.0314 260 E 4.3655 9.0438 122.0134 57.0428 30.5093 176.4163 *261 C 4.5192 8.0713 121.1590 55.1903 41.7698 178.3940 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 5 T 8.17 4.55 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 1.24 0.00 0.00 6 V 8.66 3.48 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 0.50 0.00 0.00 0.53 0.00 0.00 7 V 9.24 4.30 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 0.84 0.00 0.00 0.93 0.00 0.00 8 V 8.70 4.49 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 0.87 0.00 0.00 0.97 0.00 0.00 9 T 8.89 4.77 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 1.17 0.00 0.00 10 T 8.51 4.92 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 0.98 0.00 0.00 11 I 7.86 4.56 1.52 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.84 0.63 0.00 0.00 12 L 8.41 4.36 0.00 1.65 1.63 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.51 4.62 0.00 2.09 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 2.38 2.58 0.00 14 S 8.70 4.23 0.00 3.86 3.53 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 15 P 0.00 4.23 0.00 1.62 1.09 0.00 2.20 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 0.49 0.44 0.00 16 Y 7.22 3.96 0.00 3.11 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 17 V 8.04 4.76 2.20 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 0.74 0.00 0.00 0.84 0.00 0.00 18 M 9.14 5.09 0.00 1.93 1.83 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 19 M 8.60 4.75 0.00 1.60 1.93 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 20 K 9.17 4.20 0.00 1.69 1.89 0.00 1.81 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.53 1.56 7.81 *21 K 8.92 4.13 0.00 1.77 1.73 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.36 1.00 7.81 22 N 7.21 5.08 0.00 2.83 2.90 0.00 0.00 6.99 7.78 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 23 H 8.51 4.01 0.00 3.26 3.49 0.00 5.65 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *24 E 7.65 4.39 0.00 2.01 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 2.23 1.86 0.00 25 M 7.70 4.28 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.27 0.00 26 L 7.34 4.81 0.00 1.67 1.49 1.01 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 27 E 7.94 4.69 0.00 1.91 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 2.26 2.19 0.00 28 G 8.49 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 0.00 0.00 0.00 29 N 8.71 4.63 0.00 2.75 2.97 0.00 0.00 6.88 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 30 E 7.60 4.13 0.00 2.25 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 2.36 2.28 0.00 31 R 7.75 3.84 0.00 0.72 1.32 0.00 2.83 0.00 0.00 3.06 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.49 0.00 32 Y 7.17 5.36 0.00 2.94 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 33 E 8.77 4.66 0.00 2.37 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 0.00 2.25 2.29 0.00 34 G 8.03 2.92 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 0.00 0.00 0.00 35 Y 7.30 3.84 0.00 3.09 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 36 C 8.24 4.13 0.00 3.26 2.92 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 37 V 7.38 3.58 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 1.22 0.00 0.00 0.93 0.00 0.00 38 D 8.04 4.37 0.00 2.93 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 39 L 7.93 3.75 0.00 1.31 1.42 0.72 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.93 3.72 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 7.74 4.14 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 42 E 8.10 3.90 0.00 2.08 1.96 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 2.42 2.42 0.00 43 I 7.76 3.70 1.84 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.41 0.87 0.00 0.00 44 A 7.66 2.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 K 7.56 3.74 0.00 1.84 1.96 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.41 7.81 46 H 8.13 4.22 0.00 3.18 3.34 0.00 5.89 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 C 8.01 4.50 0.00 2.92 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 48 G 8.28 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 F 7.19 5.02 0.00 3.03 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 50 K 8.73 4.94 0.00 1.46 1.71 0.00 1.75 0.00 0.00 1.87 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 0.99 7.81 51 Y 8.04 5.60 0.00 3.22 3.40 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 52 K 9.36 4.97 0.00 1.37 1.67 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.77 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.25 1.25 7.81 53 L 9.50 4.77 0.00 1.68 1.48 1.00 0.76 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 54 T 8.84 4.67 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 1.28 0.00 0.00 55 I 8.37 4.46 1.85 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.80 0.85 0.00 0.00 56 V 8.86 3.48 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 0.65 0.00 0.00 0.95 0.00 0.00 57 G 9.18 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 58 D 8.13 4.50 0.00 2.79 2.80 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 0.00 0.00 0.00 0.00 59 G 7.93 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 60 K 7.98 4.62 0.00 1.99 1.80 0.00 1.88 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.63 7.81 61 Y 8.97 3.75 0.00 3.14 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 62 G 7.39 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 9.23 4.92 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 R 7.55 3.98 0.00 0.67 1.07 0.00 3.12 0.00 0.00 2.85 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.50 0.00 65 D 8.54 4.29 0.00 2.69 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 66 A 8.88 3.87 1.24 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 67 D 7.96 4.55 0.00 2.71 2.55 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 0.00 68 T 8.63 3.92 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 1.19 0.00 0.00 69 K 7.83 3.92 0.00 1.98 1.80 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.28 1.23 7.81 70 I 7.10 4.73 1.94 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.70 0.92 0.00 0.00 71 W 9.28 4.90 0.00 3.16 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.11 4.98 0.00 3.13 3.03 0.00 0.00 6.64 6.32 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 73 G 9.20 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 74 M 8.06 4.05 0.00 1.97 2.22 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 2.63 2.45 0.00 75 V 7.80 3.51 2.18 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 0.29 0.00 0.00 0.99 0.00 0.00 76 G 8.51 3.75 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 0.00 0.00 0.00 77 E 8.21 4.04 0.00 2.17 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 2.38 2.53 0.00 78 L 7.47 4.09 0.00 1.54 1.51 0.70 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.39 3.25 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 0.09 0.00 0.00 0.28 0.00 0.00 80 Y 7.81 4.60 0.00 3.15 2.92 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 81 G 7.99 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 82 K 8.07 4.24 0.00 1.81 1.72 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.75 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.37 1.25 7.81 83 A 7.52 4.74 1.15 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 0.00 0.00 84 D 8.08 4.83 0.00 2.56 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 85 I 7.15 4.38 1.71 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 1.21 1.00 0.79 0.00 0.00 86 A 8.88 5.40 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 I 8.18 4.26 1.76 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.62 0.77 0.00 0.00 88 A 8.05 4.37 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 3.44 0.00 0.92 0.49 0.00 3.50 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.08 0.00 90 L 7.30 4.75 0.00 1.90 1.78 1.20 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.62 4.62 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 1.11 0.00 0.00 92 I 8.13 2.73 1.47 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.03 -0.01 0.46 0.00 0.00 93 T 8.01 4.62 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 1.23 0.00 0.00 94 L 8.61 3.94 0.00 1.78 1.73 0.98 0.84 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 95 V 7.98 3.95 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 1.12 0.00 0.00 1.09 0.00 0.00 96 R 7.89 3.79 0.00 2.37 2.13 0.00 3.47 0.00 0.00 3.43 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.88 0.00 97 E 8.32 4.34 0.00 2.28 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 0.00 2.70 2.41 0.00 98 E 8.23 4.15 0.00 2.17 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 2.38 2.70 0.00 99 V 6.84 4.15 1.62 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 0.75 0.00 0.00 -0.05 0.00 0.00 100 I 7.66 4.55 1.61 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.39 0.53 0.00 0.00 101 D 8.66 5.05 0.00 2.61 2.55 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 0.00 102 F 8.57 5.31 0.00 3.04 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 0.00 103 S 9.07 4.63 0.00 3.96 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 9.08 4.38 0.00 1.69 1.80 0.00 1.74 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.81 1.56 7.81 105 P 0.00 5.02 0.00 2.02 1.91 0.00 3.34 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.84 0.00 106 F 8.17 4.76 0.00 3.26 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 M 6.98 4.58 0.00 1.92 1.97 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 108 S 8.34 4.97 0.00 3.64 3.60 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 0.00 109 L 7.86 4.22 0.00 1.45 1.44 0.19 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 110 G 8.05 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.59 4.39 1.36 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.56 0.80 0.00 0.00 112 S 9.10 4.82 0.00 3.80 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 0.00 113 I 7.92 4.78 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.63 0.86 0.00 0.00 114 M 9.05 5.18 0.00 2.22 2.10 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.55 0.00 115 I 8.74 4.97 1.88 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 1.23 1.20 0.90 0.00 0.00 116 K 8.53 4.57 0.00 2.06 1.76 0.00 1.76 0.00 0.00 1.95 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.62 7.81 117 K 8.64 4.06 0.00 1.70 1.77 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.45 7.81 118 G 9.39 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 0.00 0.00 0.00 119 T 7.62 3.87 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 1.21 0.00 0.00 120 P 0.00 4.66 0.00 2.17 2.10 0.00 3.71 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 121 I 7.21 4.63 1.83 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 1.38 0.88 0.83 0.00 0.00 122 E 8.95 4.64 0.00 2.00 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 2.22 2.20 0.00 123 S 7.39 4.53 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 0.00 124 A 8.41 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.15 4.00 0.00 2.06 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 2.37 2.27 0.00 126 D 7.77 4.33 0.00 2.86 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 0.00 127 L 7.67 3.82 0.00 1.69 1.05 0.66 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 128 S 8.62 4.29 0.00 4.09 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 0.00 129 K 7.54 4.34 0.00 1.88 1.75 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.31 7.81 130 Q 8.05 4.68 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 7.32 0.00 0.00 0.00 0.00 0.00 2.20 2.55 0.00 *131 T 8.23 4.58 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 *132 E 8.75 4.26 0.00 1.98 1.88 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 2.19 1.89 0.00 133 I 8.27 4.65 1.88 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 1.17 0.93 0.90 0.00 0.00 134 A 9.17 4.70 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 Y 7.57 5.02 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 0.00 136 G 8.45 4.82 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 0.00 137 T 8.63 5.28 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 138 L 8.89 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0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.53 7.81 188 Y 7.92 5.39 0.00 2.89 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 0.00 189 A 8.34 4.90 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 0.00 190 Y 8.72 5.20 0.00 3.12 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 0.00 191 L 8.36 4.83 0.00 1.66 1.65 0.85 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 192 L 8.12 4.56 0.00 1.58 1.03 1.16 0.78 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 0.00 193 E 8.64 4.42 0.00 2.09 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 2.39 2.24 0.00 194 S 9.42 4.46 0.00 3.98 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 0.00 195 T 7.85 4.60 4.77 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 1.18 0.00 0.00 196 M 8.26 4.26 0.00 2.44 2.32 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.85 0.00 197 N 8.38 4.38 0.00 3.05 3.04 0.00 0.00 7.04 6.98 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 0.00 198 E 8.74 4.22 0.00 2.46 2.36 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 2.84 2.65 0.00 199 Y 8.08 3.88 0.00 2.65 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 I 7.99 3.47 1.92 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 1.76 1.02 0.92 0.00 0.00 201 E 8.02 4.03 0.00 2.19 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 0.00 2.37 2.59 0.00 202 Q 7.65 4.41 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 203 R 7.23 4.80 0.00 1.76 1.64 0.00 3.00 0.00 0.00 3.00 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.14 0.00 204 K 8.85 4.47 0.00 1.75 1.60 0.00 1.81 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.25 7.81 205 P 0.00 4.51 0.00 2.17 2.17 0.00 3.87 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 2.32 1.98 0.00 206 C 8.15 4.25 0.00 3.11 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 D 8.09 5.02 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 0.00 208 T 7.86 5.20 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 1.25 0.00 0.00 209 M 9.06 5.02 0.00 2.06 1.90 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.51 0.00 210 K 9.17 4.94 0.00 2.00 1.88 0.00 1.87 0.00 0.00 1.78 0.00 0.00 2.74 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.44 7.81 211 V 8.57 4.46 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 0.74 0.00 0.00 0.89 0.00 0.00 212 G 8.96 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 G 8.19 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 N 8.39 4.56 0.00 2.64 2.83 0.00 0.00 6.96 7.85 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 0.00 215 L 8.74 4.25 0.00 1.24 1.02 0.97 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 216 D 7.16 4.69 0.00 2.53 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.35 4.75 0.00 3.62 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 K 8.97 4.58 0.00 1.36 1.47 0.00 1.61 0.00 0.00 1.50 0.00 0.00 2.70 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.19 1.17 7.81 219 G 7.94 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 0.00 0.00 0.00 220 Y 8.14 5.11 0.00 1.74 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 G 8.77 4.68 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 0.00 0.00 0.00 222 I 8.90 4.68 1.98 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.87 1.01 0.00 0.00 223 A 8.61 5.12 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 0.00 224 T 8.29 4.78 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 1.12 0.00 0.00 225 P 0.00 4.53 0.00 2.00 1.90 0.00 3.49 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 226 K 7.77 4.26 0.00 1.65 1.68 0.00 1.80 0.00 0.00 0.61 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.46 7.81 227 G 8.98 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 S 7.74 4.13 0.00 3.87 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *229 S 8.47 4.37 0.00 3.67 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 0.00 230 L 7.91 4.40 0.00 1.65 1.65 0.74 0.39 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 0.00 231 G 7.63 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 0.00 232 N 8.13 4.28 0.00 2.85 2.83 0.00 0.00 7.02 8.26 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 0.00 233 A 7.97 4.04 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 0.00 234 V 7.66 3.68 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 0.93 0.00 0.00 1.05 0.00 0.00 235 N 8.13 4.50 0.00 2.91 2.99 0.00 0.00 7.18 5.95 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 0.00 236 L 8.00 4.02 0.00 1.92 1.73 0.94 0.94 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 0.00 237 A 8.15 4.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 V 7.67 3.57 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 1.24 0.00 0.00 1.11 0.00 0.00 239 L 7.86 3.99 0.00 1.90 1.71 0.94 0.97 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 0.00 240 K 8.00 3.86 0.00 1.87 2.03 0.00 1.55 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.46 7.81 241 L 8.10 4.09 0.00 1.71 1.70 0.84 0.81 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 0.00 242 N 8.35 4.32 0.00 2.93 3.00 0.00 0.00 7.21 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 0.00 243 E 8.16 4.03 0.00 2.10 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 2.35 2.57 0.00 244 Q 8.34 4.24 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.97 0.00 0.00 0.00 0.00 0.00 2.40 2.53 0.00 245 G 8.11 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 0.00 246 L 8.18 3.99 0.00 1.78 1.77 0.93 0.46 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 0.00 247 L 7.97 4.14 0.00 1.85 1.96 1.14 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 248 D 8.14 4.49 0.00 2.88 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 0.00 249 K 7.89 4.05 0.00 2.05 1.91 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.56 7.81 250 L 8.23 4.22 0.00 2.07 1.77 1.00 0.13 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 0.00 251 K 8.58 4.31 0.00 1.85 1.81 0.00 1.10 0.00 0.00 1.26 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.76 0.21 7.81 252 N 8.49 4.72 0.00 3.04 3.07 0.00 0.00 6.86 7.41 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 0.00 253 K 8.32 4.28 0.00 1.92 2.02 0.00 1.58 0.00 0.00 1.49 0.00 0.00 2.13 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.54 1.00 7.81 254 W 8.39 4.43 0.00 3.72 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 0.00 255 W 8.83 4.33 0.00 3.41 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 256 Y 7.77 4.60 0.00 3.46 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 257 D 8.43 4.40 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 0.00 258 K 7.73 4.52 0.00 1.68 1.83 0.00 0.99 0.00 0.00 1.46 0.00 0.00 2.25 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.27 1.22 7.81 259 G 8.08 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 0.00 260 E 9.04 4.37 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 2.22 2.17 0.00 *261 C 8.07 4.52 0.00 2.72 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 * Residues marked with a * may have inaccurate shift predictions.