NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2410 7.8827 121.4477 61.2302 38.4752 173.7608 17 V 4.3375 8.7793 126.5108 61.9222 32.6253 174.6174 18 G 4.0345 8.6925 114.5001 46.8377 0.0000 172.9981 19 G 4.2208 7.5758 109.3265 44.2999 0.0000 172.4553 20 Y 4.9542 7.7492 116.1155 55.3976 42.1729 174.6670 21 T 4.2363 8.5775 117.2512 64.0483 68.4084 175.2208 22 C 4.2278 8.6912 125.4253 60.3291 41.2406 175.2755 23 G 4.0352 8.7368 106.3016 44.5056 0.0000 172.6324 24 A 4.4315 8.5800 124.5937 53.1554 18.4657 176.8017 25 N 4.2270 8.8515 119.6616 54.5530 36.2664 175.1626 26 T 4.2518 7.8218 106.4047 62.4119 69.8373 175.2162 27 V 4.0247 6.9602 121.8187 60.5265 31.4898 173.5984 28 P 4.4832 0.0000 0.0000 64.4246 32.3142 178.4759 29 Y 5.1601 7.1830 116.0051 57.5760 38.6984 174.6228 30 Q 4.6313 7.3693 123.6441 56.3223 29.4368 175.5987 31 V 4.8384 9.0577 119.5295 59.6970 35.7969 174.2416 32 S 5.0365 8.5696 117.1793 56.6690 64.6021 172.7767 33 L 4.6394 8.5341 127.7045 53.7059 43.0226 175.1414 34 N 5.9471 8.9977 122.3871 50.0445 42.1770 175.0129 *37 S 4.3202 8.5569 121.0964 58.3106 64.2102 174.5517 38 G 3.9390 9.6554 109.3614 46.1254 0.0000 173.3037 39 Y 4.5733 6.5373 114.8365 56.0835 40.0337 172.8902 40 H 4.6602 8.8669 121.9145 56.4159 30.4113 174.8414 41 F 5.0503 8.0845 119.0904 56.3501 39.4029 173.7223 42 C 4.8279 6.9567 114.5938 56.3679 44.3416 173.5188 43 G 4.3520 9.3729 110.1549 45.9061 0.0000 172.3217 44 G 4.5135 8.2691 105.7829 46.2342 0.0000 172.4472 45 S 5.3303 9.1992 115.5887 56.1840 66.4882 174.0147 46 L 4.5870 8.9840 128.5427 55.4997 42.2518 177.3353 47 I 4.5481 8.8765 119.7273 60.9650 39.2802 174.3680 48 N 4.7163 7.6299 117.2574 52.1674 39.5635 174.9077 49 S 4.2229 8.6793 111.8024 60.8746 63.0970 175.0500 50 Q 4.5499 9.1111 118.6409 55.1325 30.7067 175.0076 51 W 5.5620 8.4120 119.7067 54.9045 33.7363 174.2071 52 V 4.9967 9.0538 123.4795 61.1584 34.3308 174.1465 53 V 4.8703 9.1653 127.7311 61.7775 33.7415 174.6705 54 S 4.9083 8.9682 120.5508 57.3589 66.3985 172.1469 55 A 4.4300 8.5303 121.8933 51.2436 19.3760 178.5581 56 A 3.7368 8.4407 124.9794 55.2701 18.3943 179.2357 57 H 4.5222 8.3878 109.9859 57.6692 28.8438 175.4373 58 C 4.7354 7.9577 117.1618 57.1526 40.3175 173.2041 59 Y 4.3767 7.7917 122.3354 57.8229 38.7901 175.3000 60 K 2.9804 7.1417 123.0269 55.5814 34.5506 174.6289 61 S 4.2635 8.0693 115.3019 58.2446 63.9799 173.2999 62 G 3.8231 8.2667 106.0449 46.7108 0.0000 173.5849 63 I 4.4872 7.5111 119.2567 59.6593 39.6006 175.1723 64 Q 4.7626 8.8633 128.3350 54.2046 31.4243 174.3569 65 V 4.1886 8.6866 127.2157 62.3301 33.3472 174.6872 66 R 5.1228 9.0350 127.1486 54.6914 32.5298 175.0545 67 L 4.7518 9.1916 124.7674 52.6021 44.8645 177.3715 *69 G 4.0471 8.3167 107.6826 44.8155 0.0000 172.9366 70 E 4.4615 8.3046 118.2381 55.3081 30.1304 174.0952 71 D 4.8334 7.9497 116.9539 55.2305 44.4548 174.5336 72 N 5.0310 9.0854 119.7525 53.1011 39.3328 176.0434 73 I 4.0171 8.1983 119.5126 62.0583 37.8546 176.1430 74 N 4.8375 8.3752 117.3407 52.9126 39.7335 174.4623 75 V 4.2814 7.5297 118.3553 60.6243 33.9565 174.9893 76 V 4.0523 8.5036 127.1313 62.8650 31.0004 175.1080 77 E 4.4021 9.8975 127.7061 55.7447 30.3648 177.1911 78 G 4.0713 8.4768 106.3846 45.3987 0.0000 173.9552 79 N 4.9036 7.8191 114.5078 52.6724 39.9154 174.3465 80 E 4.5803 7.8401 117.8217 56.3199 30.9058 176.1994 81 Q 4.3586 8.9470 120.5287 54.2597 32.4614 174.2781 82 F 5.5829 8.6523 123.2186 56.0948 40.6854 175.5032 83 I 4.6547 8.7795 124.6794 59.3716 41.0453 175.5248 84 S 4.5611 8.7818 122.7764 58.3459 64.2264 173.3028 85 A 4.6519 8.6508 125.7744 52.0906 18.2180 177.9307 86 S 4.5215 8.7421 117.6547 60.1271 64.4861 174.5689 87 K 4.5747 7.5084 116.7348 56.0192 35.2363 174.5209 88 S 5.3583 8.8168 117.2192 57.0117 66.2104 173.9866 89 I 4.5640 9.1745 123.8298 59.5609 40.1340 174.9699 90 V 4.1672 8.4082 127.1948 62.1919 32.6810 175.1596 91 H 3.5749 8.6747 126.3329 55.8826 30.0306 174.2946 92 P 4.2207 0.0000 0.0000 65.7564 31.0567 177.1201 93 S 4.5689 7.7779 111.6219 57.8286 62.7890 173.3140 94 Y 4.2653 7.7863 123.3071 58.2191 38.9568 174.7449 95 N 4.5587 8.2964 125.5672 51.2448 39.9279 174.9443 96 S 3.9933 7.8062 120.8082 60.3669 63.3320 175.6507 97 N 4.3797 8.2590 118.5767 55.2463 38.3274 175.7570 98 T 4.1339 7.4313 105.0441 60.1833 70.5854 174.4270 99 L 3.7297 8.1571 120.9712 55.3647 39.6404 173.7176 100 N 4.4474 7.8376 117.9455 54.6033 39.5641 174.5613 101 N 5.0154 8.7841 121.8731 54.2582 35.8657 175.6085 102 D 4.8194 7.9652 117.3344 53.1807 39.4379 174.7630 103 I 4.9064 7.1566 121.0184 59.3932 42.2332 173.0789 104 M 5.5529 9.4973 124.8715 53.9632 35.2017 173.4648 105 L 5.3917 9.2155 120.6116 53.3179 44.9544 175.4770 106 I 5.0922 9.0868 123.2908 59.4958 40.7259 174.2860 107 K 3.8971 8.9015 128.7319 54.5560 33.7778 175.4905 108 L 4.3556 7.9569 127.2399 54.0368 41.9623 177.1638 109 K 4.1597 9.0109 125.0386 58.9677 32.6687 177.2950 110 S 4.5899 7.7170 111.5704 55.6539 66.0398 173.2440 111 A 4.2663 8.5554 124.0969 52.1202 18.4788 177.3918 112 A 4.0255 8.9518 125.4114 52.2411 19.4723 177.6540 113 S 4.4664 9.3105 116.8131 56.8562 62.2398 173.9836 114 L 4.4043 8.4060 127.5135 54.7436 42.4878 176.5909 115 N 4.6092 8.9264 118.3676 52.4130 40.3783 174.7728 116 S 4.0974 8.9972 112.2000 61.7484 62.7130 175.4952 117 R 4.2756 8.7558 118.2649 55.9761 30.5285 176.0304 118 V 4.5879 7.8675 117.6587 60.8998 32.6583 173.3089 119 A 5.2198 8.5282 127.7028 49.8183 22.8225 175.1129 120 S 5.0314 8.7497 114.1935 57.7849 64.9244 173.0381 121 I 4.3743 8.0098 121.4867 59.0977 39.2432 175.5353 122 S 4.3573 8.4404 125.0297 58.4473 63.8931 174.0469 123 L 4.1817 8.3724 123.4973 53.7236 42.3487 175.2972 124 P 4.4860 0.0000 0.0000 62.8531 31.6211 176.7620 125 T 4.1470 8.2424 110.0712 62.4054 69.8128 174.5287 *127 S 4.2176 7.5450 115.0769 58.1515 64.0383 173.7930 128 C 4.5603 8.3148 117.4297 56.1320 41.5852 172.7171 129 A 4.7983 7.9847 121.8239 50.7121 21.7411 175.9221 130 S 4.3890 8.1098 114.1545 56.8369 65.0503 173.2635 *132 A 4.1351 8.1716 123.4223 53.3799 19.2404 177.1035 133 G 4.0020 8.9863 109.9587 45.4422 0.0000 174.4787 134 T 3.9938 7.4697 117.1443 63.7375 69.4083 173.8654 135 Q 4.4717 8.6145 125.2697 55.9326 29.8787 175.8286 136 C 5.2589 9.3221 120.0550 55.0342 42.6474 172.3507 137 L 5.2283 9.0747 122.1792 53.5340 44.0929 174.9455 138 I 5.3251 8.8223 127.0171 58.8077 39.9139 174.8860 139 S 4.8749 8.5123 119.6560 56.5261 66.4313 173.1345 140 G 3.7970 7.6276 108.5979 46.2118 0.0000 172.8613 141 W 4.6486 8.7294 117.1868 56.3209 29.5003 177.1153 142 G 4.1901 8.2190 108.9988 44.1188 0.0000 173.6967 143 N 3.7606 8.4489 118.3466 53.9727 39.0124 174.7230 144 T 5.0819 7.8760 111.7078 60.4374 69.6620 174.0253 145 K 4.5558 7.8621 121.5177 54.9004 34.2082 176.3243 146 S 4.4006 8.6599 117.0995 59.7035 62.7129 174.1836 147 S 4.5194 8.1669 113.9086 57.4846 64.1572 173.8809 148 G 3.9210 9.7671 114.9608 44.5159 0.0000 171.6208 149 T 4.8146 7.7951 107.1324 60.2571 72.0375 173.8778 150 S 4.4439 9.3410 118.7899 58.0240 65.9328 172.6704 151 Y 4.8821 8.8592 125.8554 55.9444 39.1819 174.1802 152 P 4.7108 0.0000 0.0000 62.6121 33.0015 175.3392 153 D 4.8773 8.6003 117.5425 55.2643 42.7471 177.1341 154 V 5.1138 7.7457 110.5040 59.0180 33.8720 175.6091 155 L 3.2266 8.2757 123.7475 54.8480 42.9164 175.9026 156 K 4.9201 8.2088 124.9786 54.8818 35.2815 174.5759 157 C 5.2009 8.4239 119.4594 55.1026 45.6375 173.0271 158 L 5.0558 8.6397 123.2300 53.5230 45.3643 174.6577 159 K 5.0599 9.0595 127.7306 55.7295 33.4012 175.5857 160 A 4.7984 8.9326 128.5461 49.9264 23.0879 173.6303 161 P 4.9091 0.0000 0.0000 62.0692 33.6979 175.5250 162 I 4.3816 8.4733 122.8719 61.6041 37.9888 175.5156 163 L 4.8963 8.6660 127.1597 52.8819 43.6657 176.9443 164 S 4.2671 8.5275 115.6222 58.5112 63.6763 175.2628 165 D 4.4677 8.7841 122.5329 57.5974 40.6342 179.2585 166 S 4.2136 8.0448 114.6460 61.1061 63.1766 176.3613 167 S 4.2357 8.3483 117.7100 60.7092 62.9424 175.7507 168 C 4.2963 8.0350 122.5263 59.8228 40.9266 175.7544 169 K 3.9970 8.3253 119.9974 59.4120 31.3506 179.5889 170 S 4.1767 7.8951 114.4736 61.1335 62.7763 176.1260 171 A 3.9671 7.5507 123.2362 53.8512 19.6493 177.3927 172 Y 4.9201 7.5383 113.0209 55.1336 38.3970 173.1194 173 P 4.4899 0.0000 0.0000 63.4260 32.3019 177.2078 174 G 3.9859 8.9993 109.5917 46.2803 0.0000 173.7659 175 Q 4.5424 8.3783 116.9217 55.3669 30.3638 175.5023 176 I 4.4756 7.8545 119.5334 59.9179 38.7756 175.4328 177 T 4.5661 8.2284 115.3762 59.6204 70.8307 175.4144 178 S 4.3159 8.5523 115.4035 60.5281 63.1191 174.5001 179 N 4.9324 7.9590 117.3725 53.3732 38.5124 173.8942 180 M 5.5762 7.9488 117.2038 53.6225 35.9504 174.7704 181 F 5.1177 8.6404 115.3445 55.6489 42.0619 172.8903 182 C 5.3916 8.9571 116.7978 56.1946 41.9603 172.4568 183 A 4.9791 9.3237 122.0257 51.1434 22.4943 174.9882 184 G 4.1660 7.1033 105.6275 44.5388 0.0000 173.2283 184A Y 4.6779 8.4775 119.1739 56.2141 41.4327 176.2366 185 L 4.2014 8.6471 124.6649 57.1751 42.1017 178.8855 186 E 3.8993 8.1911 117.1732 57.5079 29.9168 177.0713 187 G 3.7624 7.7586 105.8701 44.5967 0.0000 173.3005 188 G 3.9805 9.3754 106.3802 44.9543 0.0000 173.4402 188A K 4.8950 7.3290 118.0727 55.1009 35.4339 175.3440 189 D 4.6482 9.1256 123.7887 53.8258 45.6726 174.8011 190 S 4.8795 8.1563 114.5781 58.0476 65.3434 171.5746 191 C 4.7512 9.1692 118.5495 55.6372 45.5082 172.3801 192 Q 4.4256 8.5425 119.2909 57.8942 28.5202 178.0791 193 G 4.2543 9.2814 110.7042 45.6083 0.0000 173.8623 194 D 4.7028 8.3833 118.4843 55.1660 41.6629 176.4959 195 S 4.3878 8.0197 115.1169 60.2483 63.2621 175.5305 196 G 3.9845 8.7229 113.3298 46.2763 0.0000 173.5529 197 G 4.3549 7.7874 107.1890 45.1573 0.0000 171.1776 198 P 5.1018 0.0000 0.0000 62.2085 33.4592 175.4433 199 V 4.5719 8.9435 122.6054 61.4532 33.8770 174.2299 200 V 4.7317 8.9493 129.6606 61.4243 33.4971 173.7857 201 C 5.0973 8.7138 124.9796 55.7397 44.0445 174.6552 202 S 3.6228 9.6760 118.9247 59.7692 60.1084 173.0498 203 G 3.9229 8.3011 103.2870 45.9433 0.0000 173.4798 204 K 4.7195 7.6294 117.6223 52.9101 35.5644 175.4607 *209 L 4.2755 8.2139 121.2624 55.5497 42.0913 175.9491 210 Q 4.6116 9.0063 125.7203 56.1767 31.2427 175.7337 211 G 5.3310 8.0218 104.7699 45.8230 0.0000 171.4634 212 I 5.2927 8.2254 119.7011 58.8895 41.3564 175.1041 213 V 3.6870 9.0089 127.2570 64.0147 31.7895 174.2980 214 S 4.8321 8.4384 120.6913 58.6892 64.4405 174.2807 215 W 4.9973 7.4872 114.4569 56.0581 31.8114 172.5200 216 G 4.0381 8.4078 107.3701 46.6401 0.0000 172.6091 217 S 4.6800 8.9166 115.8022 56.7391 63.0438 173.4659 *219 G 4.0089 8.2070 118.4106 45.6533 0.0000 171.4595 220 C 4.9152 8.1136 116.3141 56.4640 42.2939 173.9944 221 A 3.7855 9.1635 125.4794 53.1540 16.5811 177.0518 221A Q 4.5356 7.7498 117.2377 56.0604 29.7928 175.6784 222 K 4.1706 8.5340 122.4538 58.1499 32.5821 175.9941 223 N 4.2884 9.0568 122.1642 54.2501 36.8181 175.4192 224 K 4.3558 7.6244 115.8986 54.0532 32.7313 174.0091 225 P 4.6555 0.0000 0.0000 61.8327 33.3219 177.1614 226 G 3.6492 8.4871 106.4739 46.0885 0.0000 172.7595 227 V 4.3462 7.8577 122.9419 60.6692 33.8277 174.0308 228 Y 4.8466 8.1025 125.0342 55.9409 41.5006 175.2921 229 T 4.3897 8.7705 120.4281 63.8212 70.1048 173.9467 230 K 5.1044 9.4055 128.6549 55.0351 31.5178 176.9592 231 V 3.9576 9.1475 127.7857 65.6882 31.8045 175.9141 232 C 4.4528 8.2556 112.9040 57.8343 41.5237 174.2078 233 N 4.1278 8.0531 116.8938 54.8888 38.4998 175.1895 234 Y 4.8038 8.1637 115.3742 57.5490 39.1714 177.6366 235 V 3.6904 8.0261 121.4275 66.3046 31.5588 178.0397 236 S 4.1263 8.1108 114.4023 61.3394 62.6402 176.3334 237 W 4.2027 8.3130 130.5804 60.4539 30.5040 177.9256 238 I 3.0181 8.5110 120.0884 64.1454 36.5205 178.6124 239 K 3.7985 8.0887 119.3551 59.5176 31.6501 179.5395 240 Q 3.9101 8.0177 117.4941 59.1518 28.7191 178.6797 241 T 3.7297 7.6209 117.2181 66.4060 68.1654 176.9207 242 I 2.6986 7.2087 113.7462 63.1794 37.5294 177.7794 243 A 4.1327 7.4586 121.4794 53.9330 18.2280 178.6599 244 S 4.6974 7.3225 111.2364 58.2886 63.4870 174.0411 245 N 4.6924 7.8904 124.9681 53.5615 39.4400 174.1281 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 16 I 7.88 4.24 1.79 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 1.39 0.53 0.86 0.00 0.00 17 V 8.78 4.34 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.97 0.00 0.00 18 G 8.69 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 0.00 0.00 0.00 19 G 7.58 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 20 Y 7.75 4.95 0.00 2.98 2.98 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 21 T 8.58 4.24 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 1.22 0.00 0.00 22 C 8.69 4.23 0.00 2.72 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 23 G 8.74 4.04 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 0.00 24 A 8.58 4.43 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 25 N 8.85 4.23 0.00 2.84 2.89 0.00 0.00 7.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.82 4.25 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 1.24 0.00 0.00 27 V 6.96 4.02 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.00 0.00 0.74 0.00 0.00 28 P 0.00 4.48 0.00 2.38 2.38 0.00 3.58 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 2.15 1.97 0.00 29 Y 7.18 5.16 0.00 3.15 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 30 Q 7.37 4.63 0.00 1.79 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.73 0.00 0.00 0.00 0.00 0.00 1.92 2.52 0.00 31 V 9.06 4.84 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 1.00 0.00 0.00 1.01 0.00 0.00 32 S 8.57 5.04 0.00 3.30 3.18 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 33 L 8.53 4.64 0.00 0.41 0.99 0.75 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.00 5.95 0.00 2.47 2.51 0.00 0.00 6.78 7.15 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 *37 S 8.56 4.32 0.00 3.65 3.62 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 38 G 9.66 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 0.00 0.00 0.00 39 Y 6.54 4.57 0.00 3.05 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.87 4.66 0.00 2.86 3.14 0.00 5.87 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 41 F 8.08 5.05 0.00 3.07 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 42 C 6.96 4.83 0.00 2.10 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 43 G 9.37 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.27 4.51 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 0.00 0.00 0.00 45 S 9.20 5.33 0.00 3.77 3.83 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 0.00 0.00 0.00 46 L 8.98 4.59 0.00 1.90 1.69 1.09 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.88 4.55 1.90 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 1.63 0.92 1.03 0.00 0.00 48 N 7.63 4.72 0.00 2.99 3.01 0.00 0.00 6.02 7.73 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 49 S 8.68 4.22 0.00 4.20 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 50 Q 9.11 4.55 0.00 1.74 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 51 W 8.41 5.56 0.00 3.31 2.98 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 52 V 9.05 5.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.99 0.00 0.00 53 V 9.17 4.87 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 1.00 0.00 0.00 54 S 8.97 4.91 0.00 3.91 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.53 4.43 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.44 3.74 0.15 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 57 H 8.39 4.52 0.00 3.37 3.58 0.00 5.55 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.96 4.74 0.00 3.21 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 59 Y 7.79 4.38 0.00 2.92 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 60 K 7.14 2.98 0.00 1.37 1.22 0.00 0.65 0.00 0.00 1.24 0.00 0.00 2.45 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.79 0.95 7.81 61 S 8.07 4.26 0.00 3.97 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 62 G 8.27 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.51 4.49 1.90 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.89 0.94 0.00 0.00 64 Q 8.86 4.76 0.00 2.01 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.96 0.00 0.00 0.00 0.00 0.00 2.14 2.24 0.00 65 V 8.69 4.19 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 0.97 0.00 0.00 0.91 0.00 0.00 66 R 9.03 5.12 0.00 1.70 1.86 0.00 2.72 0.00 0.00 2.76 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.31 0.00 67 L 9.19 4.75 0.00 1.63 1.64 1.00 0.70 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 *69 G 8.32 4.05 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 0.00 0.00 0.00 70 E 8.30 4.46 0.00 2.18 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 2.14 0.00 71 D 7.95 4.83 0.00 2.73 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.09 5.03 0.00 2.79 2.83 0.00 0.00 7.19 7.69 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 73 I 8.20 4.02 1.44 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.51 -0.38 0.00 0.00 74 N 8.38 4.84 0.00 2.85 2.86 0.00 0.00 6.63 7.02 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 75 V 7.53 4.28 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 0.79 0.00 0.00 0.95 0.00 0.00 76 V 8.50 4.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.02 0.00 0.00 77 E 9.90 4.40 0.00 1.96 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 2.28 2.47 0.00 78 G 8.48 4.07 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 0.00 79 N 7.82 4.90 0.00 2.66 2.80 0.00 0.00 7.04 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 80 E 7.84 4.58 0.00 1.44 1.71 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 2.71 2.45 0.00 81 Q 8.95 4.36 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 82 F 8.65 5.58 0.00 2.83 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 83 I 8.78 4.65 1.87 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 1.23 0.86 0.93 0.00 0.00 84 S 8.78 4.56 0.00 3.75 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 85 A 8.65 4.65 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.74 4.52 0.00 3.82 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 87 K 7.51 4.57 0.00 1.85 1.90 0.00 1.58 0.00 0.00 1.88 0.00 0.00 2.79 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.24 1.44 7.81 88 S 8.82 5.36 0.00 3.96 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 89 I 9.17 4.56 2.01 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.98 1.11 0.00 0.00 90 V 8.41 4.17 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 0.62 0.00 0.00 0.79 0.00 0.00 91 H 8.67 3.57 0.00 2.86 3.04 0.00 5.65 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.22 0.00 2.16 2.18 0.00 2.42 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.89 0.00 93 S 7.78 4.57 0.00 3.96 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 94 Y 7.79 4.27 0.00 2.90 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 95 N 8.30 4.56 0.00 2.56 2.44 0.00 0.00 6.58 7.16 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 96 S 7.81 3.99 0.00 3.99 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 97 N 8.26 4.38 0.00 2.78 2.80 0.00 0.00 6.79 7.18 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 98 T 7.43 4.13 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 1.09 0.00 0.00 99 L 8.16 3.73 0.00 1.48 1.94 0.86 1.10 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 0.00 100 N 7.84 4.45 0.00 2.78 2.65 0.00 0.00 7.11 6.71 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 0.00 101 N 8.78 5.02 0.00 2.97 2.67 0.00 0.00 7.24 8.06 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 0.00 102 D 7.97 4.82 0.00 3.10 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 0.00 103 I 7.16 4.91 1.53 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 1.57 1.31 -0.06 0.00 0.00 104 M 9.50 5.55 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.67 0.00 105 L 9.22 5.39 0.00 1.65 1.86 -0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.09 5.09 1.94 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 1.22 0.98 0.91 0.00 0.00 107 K 8.90 3.90 0.00 0.79 1.11 0.00 1.24 0.00 0.00 1.32 0.00 0.00 2.60 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.64 0.21 7.81 108 L 7.96 4.36 0.00 1.48 1.56 0.93 0.93 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 0.00 109 K 9.01 4.16 0.00 1.88 1.80 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.35 7.81 110 S 7.72 4.59 0.00 3.92 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 0.00 111 A 8.56 4.27 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 0.00 112 A 8.95 4.03 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 9.31 4.47 0.00 3.83 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.41 4.40 0.00 1.70 1.70 0.95 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.93 4.61 0.00 2.87 2.91 0.00 0.00 6.67 7.25 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 0.00 116 S 9.00 4.10 0.00 4.01 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.76 4.28 0.00 2.00 2.00 0.00 3.07 0.00 0.00 3.26 7.28 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.55 4.22 0.00 4.00 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 0.00 128 C 8.31 4.56 0.00 2.93 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 0.00 129 A 7.98 4.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.11 4.39 0.00 3.98 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 *132 A 8.17 4.14 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 0.00 133 G 8.99 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 0.00 0.00 0.00 134 T 7.47 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 nan 0.00 0.00 135 Q 8.61 4.47 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 136 C 9.32 5.26 0.00 2.80 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 0.00 137 L 9.07 5.23 0.00 1.74 1.56 1.02 1.34 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 0.00 138 I 8.82 5.33 1.87 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.50 0.98 0.00 0.00 139 S 8.51 4.87 0.00 3.57 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 0.00 140 G 7.63 3.80 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 0.00 0.00 0.00 141 W 8.73 4.65 0.00 3.20 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 0.00 142 G 8.22 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 0.00 0.00 0.00 0.00 143 N 8.45 3.76 0.00 1.85 2.51 0.00 0.00 7.05 7.31 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 0.00 144 T 7.88 5.08 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 1.24 0.00 0.00 145 K 7.86 4.56 0.00 1.94 1.90 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.32 1.34 7.81 146 S 8.66 4.40 0.00 3.83 3.88 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 0.00 147 S 8.17 4.52 0.00 3.83 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 9.77 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 0.00 149 T 7.80 4.81 4.41 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 1.29 0.00 0.00 150 S 9.34 4.44 0.00 3.84 3.67 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 0.00 151 Y 8.86 4.88 0.00 2.93 2.98 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 0.00 152 P 0.00 4.71 0.00 2.45 2.08 0.00 4.12 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 2.16 2.03 0.00 153 D 8.60 4.88 0.00 2.69 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 0.00 154 V 7.75 5.11 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 1.05 0.00 0.00 0.96 0.00 0.00 155 L 8.28 3.23 0.00 1.17 1.17 -0.74 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.21 4.92 0.00 1.68 1.50 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.46 7.81 157 C 8.42 5.20 0.00 1.47 2.34 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 0.00 158 L 8.64 5.06 0.00 1.71 1.46 1.04 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.06 5.06 0.00 1.96 1.82 0.00 1.87 0.00 0.00 1.78 0.00 0.00 2.75 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.51 7.81 160 A 8.93 4.80 1.20 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 0.00 161 P 0.00 4.91 0.00 2.01 2.07 0.00 2.98 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.68 0.00 162 I 8.47 4.38 1.90 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.51 0.80 0.00 0.00 163 L 8.67 4.90 0.00 1.65 1.59 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.53 4.27 0.00 4.00 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 0.00 165 D 8.78 4.47 0.00 2.77 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 0.00 166 S 8.04 4.21 0.00 4.06 4.13 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 0.00 167 S 8.35 4.24 0.00 4.07 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.04 4.30 0.00 3.23 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.33 4.00 0.00 1.88 1.90 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.72 7.81 170 S 7.90 4.18 0.00 3.85 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 0.00 171 A 7.55 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.54 4.92 0.00 3.17 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.49 0.00 2.08 2.06 0.00 3.92 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 174 G 9.00 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 0.00 175 Q 8.38 4.54 0.00 2.48 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.59 6.58 0.00 0.00 0.00 0.00 0.00 2.28 2.58 0.00 176 I 7.85 4.48 1.99 0.00 0.00 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 1.85 0.95 1.00 0.00 0.00 177 T 8.23 4.57 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 1.29 0.00 0.00 178 S 8.55 4.32 0.00 4.01 4.06 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 0.00 179 N 7.96 4.93 0.00 3.11 3.11 0.00 0.00 6.61 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 7.95 5.58 0.00 1.87 2.11 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.59 0.00 181 F 8.64 5.12 0.00 3.04 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 0.00 182 C 8.96 5.39 0.00 2.97 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 0.00 183 A 9.32 4.98 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 7.10 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A Y 8.48 4.68 0.00 2.97 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 0.00 185 L 8.65 4.20 0.00 1.74 1.73 0.92 0.96 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 0.00 186 E 8.19 3.90 0.00 1.97 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 2.35 2.42 0.00 187 G 7.76 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 0.00 188 G 9.38 3.98 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 0.00 188A K 7.33 4.90 0.00 1.46 1.72 0.00 1.81 0.00 0.00 1.48 0.00 0.00 2.13 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.29 1.15 7.81 189 D 9.13 4.65 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 0.00 190 S 8.16 4.88 0.00 4.10 4.02 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 0.00 191 C 9.17 4.75 0.00 2.94 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 0.00 192 Q 8.54 4.43 0.00 2.30 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.15 0.00 0.00 0.00 0.00 0.00 2.53 2.42 0.00 193 G 9.28 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 0.00 0.00 0.00 0.00 194 D 8.38 4.70 0.00 2.97 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 0.00 195 S 8.02 4.39 0.00 4.00 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 0.00 196 G 8.72 3.98 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 0.00 197 G 7.79 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.10 0.00 2.33 2.36 0.00 3.92 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 2.27 2.27 0.00 199 V 8.94 4.57 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 0.93 0.00 0.00 0.77 0.00 0.00 200 V 8.95 4.73 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 0.88 0.00 0.00 0.70 0.00 0.00 201 C 8.71 5.10 0.00 2.80 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 0.00 202 S 9.68 3.62 0.00 3.92 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 0.00 203 G 8.30 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 0.00 204 K 7.63 4.72 0.00 1.70 1.64 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.30 1.40 7.81 *209 L 8.21 4.28 0.00 1.50 1.63 0.96 0.74 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 0.00 210 Q 9.01 4.61 0.00 1.93 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.39 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 211 G 8.02 5.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.23 5.29 1.93 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 1.31 0.91 1.01 0.00 0.00 213 V 9.01 3.69 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 0.92 0.00 0.00 1.17 0.00 0.00 214 S 8.44 4.83 0.00 3.90 3.80 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 0.00 215 W 7.49 5.00 0.00 3.28 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 0.00 216 G 8.41 4.04 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 0.00 217 S 8.92 4.68 0.00 4.22 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 *219 G 8.21 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 0.00 220 C 8.11 4.92 0.00 2.94 2.94 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 0.00 221 A 9.16 3.79 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 221A Q 7.75 4.54 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 7.01 0.00 0.00 0.00 0.00 0.00 2.47 2.32 0.00 222 K 8.53 4.17 0.00 1.88 1.73 0.00 1.93 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.48 7.81 223 N 9.06 4.29 0.00 2.85 2.81 0.00 0.00 6.78 8.07 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 0.00 224 K 7.62 4.36 0.00 1.72 1.80 0.00 1.95 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.30 1.58 7.81 225 P 0.00 4.66 0.00 2.13 2.10 0.00 3.60 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 226 G 8.49 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 0.00 0.00 0.00 227 V 7.86 4.35 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 0.00 0.00 0.35 0.00 0.00 -0.79 0.00 0.00 228 Y 8.10 4.85 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.77 4.39 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 1.23 0.00 0.00 230 K 9.41 5.10 0.00 2.10 1.90 0.00 1.89 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.53 1.66 7.81 231 V 9.15 3.96 2.34 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 1.15 0.00 0.00 1.09 0.00 0.00 232 C 8.26 4.45 0.00 3.11 3.41 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 0.00 233 N 8.05 4.13 0.00 2.18 2.37 0.00 0.00 6.79 7.62 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 0.00 234 Y 8.16 4.80 0.00 3.15 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 8.03 3.69 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 1.21 0.00 0.00 1.08 0.00 0.00 236 S 8.11 4.13 0.00 3.97 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 0.00 237 W 8.31 4.20 0.00 3.48 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.51 3.02 1.96 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.92 0.71 0.00 0.00 239 K 8.09 3.80 0.00 1.82 1.78 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.42 7.81 240 Q 8.02 3.91 0.00 1.91 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 241 T 7.62 3.73 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 0.70 0.00 0.00 242 I 7.21 2.70 0.77 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.21 -0.57 0.00 0.00 243 A 7.46 4.13 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 0.00 244 S 7.32 4.70 0.00 3.77 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 0.00 245 N 7.89 4.69 0.00 2.98 2.95 0.00 0.00 6.89 7.56 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 * Residues marked with a * may have inaccurate shift predictions.