NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2441 7.8827 121.4482 61.2228 38.6604 173.7782 17 V 4.3150 8.7238 126.3099 61.8764 32.5985 174.5230 18 G 3.9811 8.4800 114.2245 46.7589 0.0000 173.5481 19 G 4.2076 7.7572 110.3210 44.4842 0.0000 172.7672 20 Y 4.9750 8.0218 117.4989 55.2961 42.2264 174.9942 21 T 4.1163 8.5742 117.4054 63.9339 68.4321 175.2526 22 C 4.2070 8.6079 125.4681 59.6863 35.1269 175.5173 23 G 4.0157 8.4238 105.4596 44.7714 0.0000 172.6271 24 A 4.2684 8.4076 125.3950 53.4710 18.6506 177.0439 25 N 4.2834 8.8959 119.2093 54.5074 36.0431 175.3277 26 T 4.2017 7.6169 107.4904 62.6521 69.7553 175.2799 27 V 4.0327 7.0465 122.3569 60.2979 31.2889 173.5238 28 P 4.4885 0.0000 0.0000 63.9474 32.1831 178.2006 29 Y 4.9464 6.8692 116.0276 56.9359 38.8178 174.6022 30 Q 4.5878 7.4946 123.6703 56.2480 29.5101 175.5060 31 V 4.8307 9.0034 119.6011 59.6993 35.5298 174.3107 32 S 5.0280 8.7372 117.9759 56.6715 64.5676 172.7392 33 L 4.6515 8.5111 127.7965 53.5960 43.1521 175.0793 34 N 5.8619 9.0680 122.6822 49.9820 41.9446 174.9933 *37 S 4.2035 8.4400 121.3512 58.3860 64.1398 174.4590 38 G 3.9232 9.1810 109.0122 46.2384 0.0000 173.0859 39 Y 4.5066 6.5271 114.7586 56.1266 39.9271 172.7500 40 H 4.5211 8.9395 121.9428 56.5369 30.3221 174.8351 41 F 5.0743 7.9368 119.3384 56.5636 39.4545 173.7935 42 C 4.7920 6.8486 114.8834 56.2286 44.6001 173.6991 43 G 4.3515 8.8209 110.0465 45.7757 0.0000 172.1592 44 G 4.5970 7.9396 105.2501 46.4720 0.0000 172.4385 45 S 5.4024 8.8450 115.6052 56.3841 66.6506 173.7885 46 L 4.7633 9.2729 128.2603 55.0444 42.3363 177.1548 47 I 4.4716 8.7576 119.4637 61.0128 39.2974 174.3557 48 N 4.8390 7.6471 117.2121 52.0299 39.6091 174.8335 49 S 4.2387 8.7682 111.6744 60.6712 63.2391 175.2076 50 Q 4.5290 8.9551 118.7173 55.1604 30.2428 174.7257 51 W 5.5971 8.2229 118.1922 54.8265 33.6408 174.2856 52 V 4.9292 9.1732 123.6335 61.1710 34.4129 174.1499 53 V 4.8137 8.8640 127.3336 62.0025 33.1626 174.8470 54 S 4.8583 8.9488 120.9139 57.3699 66.4130 172.1875 55 A 4.4678 8.5262 121.3191 51.0820 19.6821 178.5643 56 A 3.8015 8.2980 124.2956 55.2839 18.4042 179.2836 57 H 4.5660 8.3598 109.7230 57.5019 28.6937 175.4337 58 C 4.6788 7.8763 117.1118 57.4375 40.4835 173.2997 59 Y 4.2581 7.7725 122.5392 57.7237 38.7316 175.1443 60 K 3.2484 7.2231 123.9301 55.6954 34.8809 174.7059 61 S 4.3336 7.9653 114.8299 58.2023 64.2639 173.2276 62 G 3.7183 8.3382 105.9617 46.7266 0.0000 173.7389 63 I 4.1939 7.5789 119.9148 60.2643 39.0493 175.0285 64 Q 4.7207 9.0095 128.6185 54.2537 31.2756 174.2915 65 V 4.1581 8.7598 127.4233 62.2300 33.3232 174.7041 66 R 5.1029 9.0659 127.5684 54.8124 32.1100 175.0927 67 L 4.7320 9.1316 124.9781 52.6658 44.7121 177.7180 *69 G 4.1790 8.2493 107.7282 45.3901 0.0000 172.6276 70 E 4.3991 8.2749 118.6572 55.3595 30.0505 174.0009 71 D 4.8416 8.0232 119.0286 55.2555 44.5090 174.6620 72 N 4.8931 8.7428 120.3333 53.1577 39.2874 176.0968 73 I 3.9267 8.4328 120.0097 62.3692 37.8594 176.3123 74 N 4.7350 8.6060 118.0968 53.1523 39.1603 174.9273 75 V 4.3159 7.4487 118.2031 60.6993 34.3635 175.0042 76 V 4.0999 8.4741 126.8128 62.7053 30.9567 175.1159 77 E 4.3773 9.4355 127.7523 55.5702 30.3773 176.9404 78 G 3.9491 8.0727 105.3825 45.3657 0.0000 174.0940 79 N 4.9196 8.1252 116.0251 52.9006 40.1873 174.4441 80 E 4.4763 8.0388 118.5841 56.4074 30.7666 176.1793 81 Q 4.4325 8.9480 121.0553 54.1476 32.5056 174.2786 82 F 5.6093 8.7719 122.6926 56.0016 41.0090 175.2413 83 I 4.6502 8.8719 124.9164 59.3950 40.9102 175.4966 84 S 4.7194 8.7488 122.8863 58.2083 64.1918 173.4738 85 A 4.5315 8.5474 125.8540 52.2328 18.1613 177.8997 86 S 4.4178 8.8591 117.1612 60.0409 64.4848 174.5523 87 K 4.7182 7.5736 119.7894 55.0905 35.4288 174.3512 88 S 5.2878 8.8003 120.4368 56.6714 65.9363 173.4774 89 I 4.5596 9.2682 123.9403 59.3738 39.5234 174.8720 90 V 4.0994 8.3932 127.3522 62.3724 32.5389 175.1747 91 H 3.6255 8.7307 127.2423 55.8712 30.0044 174.4199 92 P 4.2798 0.0000 0.0000 65.3698 31.1860 177.1112 93 S 4.6434 7.9247 112.3172 57.9496 62.9945 173.2675 94 Y 4.3519 8.0391 123.6145 57.8976 39.0187 174.5293 95 N 4.7137 8.3801 125.7231 51.4084 40.1793 175.1529 96 S 3.8395 7.7349 120.1402 59.7937 63.7833 175.4846 97 N 4.3360 8.1360 118.6441 56.1750 38.4451 176.1489 98 T 3.9056 7.9365 105.5951 61.1339 69.5548 175.2708 99 L 3.7545 7.7821 120.4538 55.3011 40.0496 173.9254 100 N 4.3818 7.7837 118.2966 54.8358 39.4847 174.6147 101 N 4.9599 8.7219 120.8590 54.2730 35.7260 175.6849 102 D 4.6417 7.8941 117.7024 52.9368 39.7362 174.8808 103 I 4.7683 7.0612 120.9990 59.3870 42.2319 172.6398 104 M 5.5064 9.2406 126.2716 54.0005 36.3027 173.5555 105 L 5.4149 9.2662 124.1075 53.1929 45.0299 175.4621 106 I 5.0112 9.1459 123.2988 59.4819 40.6736 174.2651 107 K 3.8158 8.6113 128.9496 54.5847 33.6396 175.5102 108 L 4.4319 8.2284 127.7422 54.1298 41.9268 177.4849 109 K 4.1991 8.8445 123.0213 58.9141 32.4841 177.4797 110 S 4.6095 7.7158 111.4557 55.8205 66.1607 173.1861 111 A 4.3992 8.3883 123.2842 51.7106 18.7347 177.4839 112 A 4.2319 8.8332 124.6842 51.9680 19.4555 177.2123 113 S 4.3608 9.1352 116.8293 57.7050 62.9605 173.7166 114 L 4.6827 8.5108 127.8840 53.8741 41.3398 175.6919 115 N 4.9011 8.9472 119.6035 51.9053 40.1331 174.9244 116 S 4.4127 8.7605 111.9416 61.3920 62.8696 175.3703 117 R 4.2319 7.5314 117.2068 56.2982 30.6794 176.3446 118 V 4.4579 8.2811 117.3571 61.0284 33.5807 173.6494 119 A 5.1445 8.5500 128.5291 50.4293 22.8358 175.3644 120 S 4.9470 8.7509 114.9267 58.1198 64.6228 173.0565 121 I 4.3670 8.2366 122.0415 59.0399 39.5012 175.3038 122 S 4.3032 8.4410 123.7502 58.1673 63.4425 173.6123 123 L 4.2234 8.4135 126.4024 53.6173 42.2684 175.2089 124 P 4.4740 0.0000 0.0000 63.0609 32.0993 176.4180 125 T 4.0854 8.2814 109.6827 63.0400 69.8340 174.7878 *127 S 4.5282 7.5498 114.1838 57.8633 64.0545 173.9326 128 C 4.5280 8.4164 118.0606 56.7303 40.6647 173.5103 129 A 4.4036 8.1516 125.6984 51.4700 19.6210 177.5664 130 S 4.2781 8.1286 116.7880 57.4938 64.3522 173.4039 *132 A 4.3625 8.2118 124.3138 53.5854 19.2525 177.0328 133 G 4.0089 9.0761 110.9615 45.3633 0.0000 174.3878 134 T 3.9706 7.6724 117.2672 63.8469 69.4285 173.7181 135 Q 4.5383 8.5897 125.2270 55.8291 29.8750 175.8593 136 C 5.2636 9.2463 119.9292 55.1431 46.4792 172.4076 137 L 5.2118 9.1615 122.4538 53.5363 44.0526 175.0179 138 I 5.3003 9.1373 127.4108 58.8676 39.9930 174.8666 139 S 4.8641 8.5000 119.2709 56.4995 66.4239 173.1358 140 G 3.7669 7.5474 108.4972 46.2757 0.0000 172.8939 141 W 4.5880 8.6113 116.8767 56.2900 29.3117 177.0370 142 G 4.1061 8.5753 109.3930 44.2943 0.0000 173.4794 143 N 3.6328 8.5333 118.3416 54.3548 38.8750 174.5542 144 T 5.0361 8.2556 113.5513 60.6646 69.6287 174.4727 145 K 4.6229 7.8421 121.6613 54.8292 34.5112 176.1628 146 S 4.3922 8.5478 116.3250 59.4204 63.8936 174.3071 147 S 4.3681 8.0502 115.9354 59.2833 65.1466 173.0491 148 G 3.8505 9.7803 112.2693 44.4010 0.0000 171.3085 149 T 4.7476 7.9404 114.1223 62.1644 72.4632 174.0970 150 S 4.5049 9.2751 121.3618 57.4917 66.1480 172.0562 151 Y 4.9324 8.7117 125.4819 55.5689 39.3241 174.2505 152 P 4.6582 0.0000 0.0000 62.5367 32.8778 175.8893 153 D 4.6095 8.7522 118.6721 56.4292 41.4850 177.2753 154 V 5.1849 7.4235 109.9561 58.7478 34.1033 175.8525 155 L 3.1573 8.4580 125.1410 54.9200 42.9457 176.0169 156 K 4.8898 8.1551 125.0326 54.9574 35.1451 174.6008 157 C 5.2097 8.4500 119.1145 55.1903 42.7966 173.0427 158 L 5.0407 8.6817 122.9233 53.7635 45.4427 174.7695 159 K 5.0943 9.0823 125.7075 55.6819 33.3296 176.0113 160 A 4.8944 9.2270 125.5533 50.0776 23.1247 173.4497 161 P 5.0127 0.0000 0.0000 61.6874 33.8855 175.3719 162 I 4.2804 8.4367 122.9982 61.7088 38.0287 175.4444 163 L 4.9297 8.7543 126.9645 52.8854 43.5627 176.9544 164 S 4.2668 8.4982 115.5410 58.2432 63.7970 174.7497 165 D 4.3794 8.8900 121.5322 57.6919 40.7438 178.9339 166 S 4.1518 8.0796 114.4441 61.5662 63.0153 176.5779 167 S 4.0947 8.1071 118.1750 60.9640 62.7789 175.4810 168 C 4.2820 8.4730 122.3174 59.6517 42.7638 175.9054 169 K 4.0212 8.4832 120.2356 59.4842 31.3500 179.6122 170 S 4.2091 8.2453 114.9595 61.5094 62.7934 176.2570 171 A 4.0268 8.0333 122.6787 53.8938 19.8128 177.4021 172 Y 4.9049 7.8704 114.0533 55.1246 38.3274 173.0296 173 P 4.5787 0.0000 0.0000 63.5834 32.1194 177.8970 174 G 4.0051 9.0550 108.8540 45.9824 0.0000 173.6201 175 Q 4.4850 8.1057 116.3889 55.2790 30.9399 175.5276 176 I 4.3390 7.9151 119.1423 60.1449 37.7351 175.5876 177 T 4.4962 8.2636 116.3081 59.8606 70.4805 175.5915 178 S 4.3568 8.5676 115.2744 60.3433 63.0666 174.4380 179 N 5.0274 8.3401 118.8882 53.2927 38.5783 173.7633 180 M 5.5694 7.9689 116.7803 53.7143 36.0585 174.6331 181 F 5.1474 8.8595 115.6823 55.6316 42.2078 172.7488 182 C 5.4248 8.9605 116.4881 56.0227 40.8981 172.5822 183 A 5.0515 9.4218 122.4325 50.7759 22.4180 174.2240 184 G 3.8549 7.4649 106.3914 44.3586 0.0000 175.4489 184A Y 4.5514 8.5078 123.3428 56.1126 41.0365 175.8909 185 L 4.1135 8.7080 126.2095 57.3733 41.9721 179.2229 186 E 4.1306 8.1945 115.3341 57.2517 29.8659 177.4953 187 G 3.8770 7.6385 105.9579 45.2938 0.0000 172.8692 188 G 4.0092 9.7295 106.4342 44.6891 0.0000 173.4715 188A K 5.0533 7.3861 117.4041 55.2236 35.4563 175.1385 189 D 4.7240 8.8703 123.4076 53.4307 45.5235 174.8924 190 S 4.9139 8.1819 114.7047 58.4936 64.8455 171.6191 191 C 4.7536 9.2548 118.7269 55.4233 45.4131 172.3736 192 Q 4.3194 8.6275 119.1981 58.0772 28.4727 178.3439 193 G 4.2665 9.2660 110.7868 45.6730 0.0000 173.9877 194 D 4.6524 8.5214 118.7325 55.7831 41.5377 176.4331 195 S 4.3846 7.9758 114.8613 59.9014 63.4715 175.5157 196 G 3.9873 8.9834 113.6657 46.3478 0.0000 173.5878 197 G 4.5164 7.9153 107.6662 44.8350 0.0000 171.1163 198 P 5.1041 0.0000 0.0000 62.2687 33.5075 175.6034 199 V 4.5915 8.7128 121.7059 61.4143 34.0571 174.1250 200 V 4.8781 8.7472 128.7530 61.2567 34.2789 173.6711 201 C 5.1743 8.8569 124.6241 55.7020 43.9599 174.5478 202 S 3.6053 9.8933 120.3498 59.7022 60.1653 173.2433 203 G 3.9166 8.5023 104.2407 45.6769 0.0000 173.9637 204 K 4.7444 7.5983 117.8398 53.0136 35.0459 175.5230 *209 L 4.3245 8.2782 123.2279 55.4349 42.0170 175.6828 210 Q 4.4901 8.8479 126.0012 56.7085 30.7685 175.9277 211 G 5.3008 8.0472 104.4271 45.6531 0.0000 171.4422 212 I 5.2875 8.2087 119.9472 58.8160 41.0966 175.1974 213 V 3.8491 8.9517 127.2772 64.1071 31.8228 174.2504 214 S 4.9006 8.4168 120.4797 58.5783 64.3685 173.8268 215 W 4.8489 7.1518 114.0250 55.7064 31.8453 172.3351 216 G 3.9735 8.3991 107.6850 46.5340 0.0000 172.5156 217 S 4.6603 8.4432 115.2315 56.8367 62.8043 172.6402 *219 G 4.2397 8.0828 118.0985 45.7195 0.0000 171.3388 220 C 4.9429 8.2371 116.8348 56.4620 43.8142 173.3354 221 A 3.8294 9.3772 125.2053 53.1970 16.8182 177.0399 221A Q 4.5467 7.7352 117.0080 55.9564 29.8983 175.6292 222 K 4.1625 8.5307 122.1831 58.2868 32.5281 176.0239 223 N 4.2629 9.2768 121.7436 54.1092 36.9242 175.3350 224 K 4.2119 7.6347 116.5808 53.8607 32.3277 173.7486 225 P 4.6426 0.0000 0.0000 61.7629 33.3469 177.3851 226 G 3.5681 8.4125 106.1459 46.2254 0.0000 172.7705 227 V 4.4384 7.6279 122.7300 60.6474 34.1728 174.0396 228 Y 4.9609 8.0909 124.1379 55.9848 42.2535 174.9423 229 T 4.3161 8.6510 120.3645 63.6991 69.9600 174.2606 230 K 5.1652 9.3971 128.2747 55.3138 31.1972 177.1663 231 V 3.9574 8.9443 126.0396 65.8179 31.4422 174.8572 232 C 4.3935 8.3361 112.6819 58.4329 41.4547 175.0282 233 N 4.1636 8.1032 117.3784 54.7268 38.3890 175.5658 234 Y 4.7758 7.9998 117.5631 57.4949 38.8107 177.4345 235 V 3.6877 7.8095 121.0726 66.1081 31.6176 177.8687 236 S 4.1175 8.1062 114.3723 61.3982 62.7048 176.2776 237 W 4.2076 8.3298 130.4055 60.5365 30.4412 177.7851 238 I 3.0105 8.3275 120.0242 64.1626 36.5969 178.5764 239 K 3.7743 8.1289 119.6527 59.4770 31.6877 179.4930 240 Q 3.9713 7.9392 116.6569 59.1236 28.8052 178.3555 241 T 3.7043 7.5838 118.0276 66.4668 68.2657 176.6131 242 I 2.7353 7.1418 121.5276 64.0365 36.7844 178.3805 243 A 4.0429 7.7247 120.1787 54.0667 18.1808 178.1885 244 S 4.6900 7.5146 110.4758 58.1947 64.0929 174.0164 245 N 4.7133 8.0231 124.1345 53.5345 39.2101 174.1062 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 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.53 0.92 0.00 0.00 17 V 8.72 4.32 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 0.92 0.00 0.00 0.95 0.00 0.00 18 G 8.48 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 19 G 7.76 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 0.00 0.00 0.00 0.00 20 Y 8.02 4.97 0.00 2.94 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 21 T 8.57 4.12 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 1.21 0.00 0.00 22 C 8.61 4.21 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 8.42 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 0.00 0.00 0.00 24 A 8.41 4.27 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 25 N 8.90 4.28 0.00 2.87 2.93 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 7.62 4.20 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 1.23 0.00 0.00 27 V 7.05 4.03 1.73 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 0.28 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.49 0.00 2.37 2.38 0.00 3.63 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 2.18 1.99 0.00 29 Y 6.87 4.95 0.00 3.27 3.43 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 0.00 30 Q 7.49 4.59 0.00 1.80 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.71 0.00 0.00 0.00 0.00 0.00 1.94 2.52 0.00 31 V 9.00 4.83 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 1.09 0.00 0.00 1.02 0.00 0.00 32 S 8.74 5.03 0.00 3.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.51 4.65 0.00 0.41 1.01 0.84 0.14 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 34 N 9.07 5.86 0.00 2.44 2.48 0.00 0.00 6.78 8.33 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 *37 S 8.44 4.20 0.00 3.70 3.71 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 38 G 9.18 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 39 Y 6.53 4.51 0.00 3.14 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 40 H 8.94 4.52 0.00 2.87 3.20 0.00 5.87 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.94 5.07 0.00 3.12 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 6.85 4.79 0.00 2.17 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 43 G 8.82 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 7.94 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 45 S 8.84 5.40 0.00 3.81 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.27 4.76 0.00 1.87 1.68 1.09 1.04 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 47 I 8.76 4.47 1.89 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.93 0.95 0.00 0.00 48 N 7.65 4.84 0.00 3.00 3.01 0.00 0.00 6.02 8.21 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 49 S 8.77 4.24 0.00 4.20 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 0.00 50 Q 8.96 4.53 0.00 2.15 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.80 0.00 0.00 0.00 0.00 0.00 2.20 2.30 0.00 51 W 8.22 5.60 0.00 3.31 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 52 V 9.17 4.93 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 1.07 0.00 0.00 0.99 0.00 0.00 53 V 8.86 4.81 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 1.04 0.00 0.00 1.01 0.00 0.00 54 S 8.95 4.86 0.00 3.92 3.71 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 55 A 8.53 4.47 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 56 A 8.30 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.36 4.57 0.00 3.39 3.59 0.00 5.55 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.88 4.68 0.00 3.22 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 7.77 4.26 0.00 2.96 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 60 K 7.22 3.25 0.00 1.42 1.26 0.00 0.61 0.00 0.00 1.23 0.00 0.00 2.40 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.73 1.00 7.81 61 S 7.97 4.33 0.00 3.96 3.90 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 62 G 8.34 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 63 I 7.58 4.19 1.88 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.63 0.94 0.00 0.00 64 Q 9.01 4.72 0.00 1.97 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.94 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 65 V 8.76 4.16 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 0.99 0.00 0.00 0.91 0.00 0.00 66 R 9.07 5.10 0.00 1.70 1.99 0.00 2.73 0.00 0.00 2.78 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.29 0.00 67 L 9.13 4.73 0.00 1.64 1.62 1.04 0.66 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 8.25 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 0.00 0.00 0.00 70 E 8.27 4.40 0.00 2.19 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 2.37 2.08 0.00 71 D 8.02 4.84 0.00 2.79 2.72 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 72 N 8.74 4.89 0.00 2.82 2.83 0.00 0.00 7.19 8.66 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 73 I 8.43 3.93 1.43 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 1.10 0.51 -0.48 0.00 0.00 74 N 8.61 4.73 0.00 2.85 2.89 0.00 0.00 6.63 7.32 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 75 V 7.45 4.32 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 0.78 0.00 0.00 0.99 0.00 0.00 76 V 8.47 4.10 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 0.86 0.00 0.00 1.02 0.00 0.00 77 E 9.44 4.38 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 2.46 0.00 78 G 8.07 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 79 N 8.13 4.92 0.00 2.63 2.80 0.00 0.00 7.15 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 8.04 4.48 0.00 1.37 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 2.60 2.44 0.00 81 Q 8.95 4.43 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 82 F 8.77 5.61 0.00 2.83 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 83 I 8.87 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 1.24 0.85 0.91 0.00 0.00 84 S 8.75 4.72 0.00 3.75 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 85 A 8.55 4.53 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 86 S 8.86 4.42 0.00 3.79 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 87 K 7.57 4.72 0.00 1.79 1.55 0.00 1.77 0.00 0.00 1.99 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.48 7.81 88 S 8.80 5.29 0.00 4.06 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 89 I 9.27 4.56 2.07 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.03 1.17 0.00 0.00 90 V 8.39 4.10 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 0.70 0.00 0.00 0.82 0.00 0.00 91 H 8.73 3.63 0.00 2.83 2.95 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 4.28 0.00 2.17 2.18 0.00 2.55 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 1.62 1.89 0.00 93 S 7.92 4.64 0.00 3.94 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 94 Y 8.04 4.35 0.00 3.03 2.93 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 95 N 8.38 4.71 0.00 2.58 2.45 0.00 0.00 6.61 6.95 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 96 S 7.73 3.84 0.00 3.97 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 97 N 8.14 4.34 0.00 2.77 2.79 0.00 0.00 6.90 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 98 T 7.94 3.91 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 1.10 0.00 0.00 99 L 7.78 3.75 0.00 1.52 1.87 0.70 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.78 4.38 0.00 2.81 2.66 0.00 0.00 7.24 6.63 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 0.00 101 N 8.72 4.96 0.00 2.95 2.64 0.00 0.00 7.23 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 7.89 4.64 0.00 3.08 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.06 4.77 1.43 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 1.38 1.24 0.01 0.00 0.00 104 M 9.24 5.51 0.00 2.13 1.83 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.65 0.00 105 L 9.27 5.41 0.00 1.72 1.87 -0.08 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.15 5.01 1.93 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 1.21 0.96 0.94 0.00 0.00 107 K 8.61 3.82 0.00 0.79 1.04 0.00 1.17 0.00 0.00 1.33 0.00 0.00 2.64 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.71 0.21 7.81 108 L 8.23 4.43 0.00 1.44 1.57 0.96 0.87 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 8.84 4.20 0.00 1.64 1.83 0.00 1.61 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.52 7.81 110 S 7.72 4.61 0.00 3.88 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 0.00 111 A 8.39 4.40 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 8.83 4.23 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 0.00 113 S 9.14 4.36 0.00 3.87 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 0.00 114 L 8.51 4.68 0.00 1.69 1.60 0.96 1.06 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 0.00 115 N 8.95 4.90 0.00 2.87 2.91 0.00 0.00 6.47 7.19 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 0.00 116 S 8.76 4.41 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 0.00 117 R 7.53 4.23 0.00 2.00 2.02 0.00 3.19 0.00 0.00 3.30 7.36 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.55 4.53 0.00 4.00 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 0.00 128 C 8.42 4.53 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 0.00 129 A 8.15 4.40 1.06 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 0.00 0.00 130 S 8.13 4.28 0.00 3.84 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 *132 A 8.21 4.36 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 0.00 133 G 9.08 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 0.00 134 T 7.67 3.97 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 1.15 0.00 0.00 135 Q 8.59 4.54 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 136 C 9.25 5.26 0.00 2.86 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 0.00 137 L 9.16 5.21 0.00 1.75 1.57 1.00 1.13 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 0.00 138 I 9.14 5.30 1.87 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.64 1.01 0.00 0.00 139 S 8.50 4.86 0.00 3.55 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.55 3.77 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 0.00 0.00 0.00 141 W 8.61 4.59 0.00 3.17 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 0.00 142 G 8.58 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.53 3.63 0.00 2.21 2.59 0.00 0.00 7.14 7.27 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 0.00 144 T 8.26 5.04 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 145 K 7.84 4.62 0.00 1.83 1.70 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.28 1.29 7.81 146 S 8.55 4.39 0.00 4.10 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 8.05 4.37 0.00 3.82 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 0.00 148 G 9.78 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 0.00 149 T 7.94 4.75 4.31 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 1.42 0.00 0.00 150 S 9.28 4.50 0.00 3.83 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 0.00 151 Y 8.71 4.93 0.00 2.93 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 0.00 152 P 0.00 4.66 0.00 2.45 2.09 0.00 4.12 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.02 0.00 153 D 8.75 4.61 0.00 2.80 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 V 7.42 5.18 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 1.07 0.00 0.00 0.96 0.00 0.00 155 L 8.46 3.16 0.00 1.21 1.22 -0.75 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.16 4.89 0.00 1.65 1.50 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.46 7.81 157 C 8.45 5.21 0.00 1.48 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 0.00 0.00 0.00 0.00 158 L 8.68 5.04 0.00 1.71 1.47 1.04 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.08 5.09 0.00 1.81 1.82 0.00 1.81 0.00 0.00 1.75 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.68 7.81 160 A 9.23 4.89 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 5.01 0.00 2.02 2.09 0.00 3.03 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.75 0.00 162 I 8.44 4.28 1.91 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.60 0.85 0.00 0.00 163 L 8.75 4.93 0.00 1.54 1.60 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.50 4.27 0.00 4.01 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 8.89 4.38 0.00 2.84 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 0.00 166 S 8.08 4.15 0.00 4.10 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 8.11 4.09 0.00 4.10 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 0.00 168 C 8.47 4.28 0.00 3.21 3.38 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 0.00 169 K 8.48 4.02 0.00 1.93 1.90 0.00 1.87 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.54 1.67 7.81 170 S 8.25 4.21 0.00 3.98 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 0.00 171 A 8.03 4.03 1.08 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 0.00 0.00 172 Y 7.87 4.90 0.00 3.12 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 0.00 173 P 0.00 4.58 0.00 2.22 2.11 0.00 3.58 0.00 0.00 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.97 0.00 174 G 9.05 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 0.00 175 Q 8.11 4.49 0.00 2.48 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.71 0.00 0.00 0.00 0.00 0.00 2.18 2.45 0.00 176 I 7.92 4.34 1.99 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.05 1.01 0.00 0.00 177 T 8.26 4.50 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 0.00 178 S 8.57 4.36 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 8.34 5.03 0.00 3.08 3.11 0.00 0.00 6.62 7.81 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 0.00 180 M 7.97 5.57 0.00 1.87 2.12 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.63 0.00 181 F 8.86 5.15 0.00 3.10 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 8.96 5.42 0.00 2.99 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 9.42 5.05 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 0.00 184 G 7.46 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 184A Y 8.51 4.55 0.00 3.01 3.07 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 0.00 185 L 8.71 4.11 0.00 1.73 1.73 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.19 4.13 0.00 2.10 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 2.32 2.26 0.00 187 G 7.64 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 0.00 0.00 0.00 188 G 9.73 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 188A K 7.39 5.05 0.00 1.47 1.71 0.00 1.58 0.00 0.00 1.43 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.21 7.81 189 D 8.87 4.72 0.00 2.84 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 4.91 0.00 4.12 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 0.00 191 C 9.25 4.75 0.00 2.95 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 0.00 192 Q 8.63 4.32 0.00 2.33 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.17 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 193 G 9.27 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 0.00 0.00 0.00 0.00 194 D 8.52 4.65 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 7.98 4.38 0.00 4.00 3.87 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 0.00 0.00 0.00 196 G 8.98 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 0.00 197 G 7.92 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 2.35 2.39 0.00 3.77 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 199 V 8.71 4.59 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.51 0.00 0.00 200 V 8.75 4.88 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 0.84 0.00 0.00 0.62 0.00 0.00 201 C 8.86 5.17 0.00 2.79 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 0.00 202 S 9.89 3.61 0.00 3.95 3.90 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 0.00 203 G 8.50 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 7.60 4.74 0.00 1.72 1.64 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.40 7.81 *209 L 8.28 4.32 0.00 1.50 1.64 1.00 0.77 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 8.85 4.49 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.42 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 211 G 8.05 5.30 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 0.00 212 I 8.21 5.29 1.93 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.90 0.98 0.00 0.00 213 V 8.95 3.85 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 1.04 0.00 0.00 1.24 0.00 0.00 214 S 8.42 4.90 0.00 3.91 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 0.00 215 W 7.15 4.85 0.00 3.34 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 0.00 216 G 8.40 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 0.00 217 S 8.44 4.66 0.00 4.24 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 *219 G 8.08 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 0.00 220 C 8.24 4.94 0.00 2.92 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 A 9.38 3.83 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 221A Q 7.74 4.55 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 7.00 0.00 0.00 0.00 0.00 0.00 2.59 2.32 0.00 222 K 8.53 4.16 0.00 1.72 1.73 0.00 1.93 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.61 7.81 223 N 9.28 4.26 0.00 2.80 2.79 0.00 0.00 6.79 7.47 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 0.00 224 K 7.63 4.21 0.00 1.86 1.77 0.00 1.64 0.00 0.00 1.18 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.48 7.81 225 P 0.00 4.64 0.00 2.12 2.10 0.00 3.55 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 226 G 8.41 3.57 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 0.00 227 V 7.63 4.44 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 0.38 0.00 0.00 -0.80 0.00 0.00 228 Y 8.09 4.96 0.00 1.43 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.65 4.32 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 9.40 5.17 0.00 2.13 1.93 0.00 1.79 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.61 7.81 231 V 8.94 3.96 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 1.21 0.00 0.00 1.16 0.00 0.00 232 C 8.34 4.39 0.00 3.16 3.23 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 0.00 233 N 8.10 4.16 0.00 2.27 2.35 0.00 0.00 6.83 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 Y 8.00 4.78 0.00 3.27 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 0.00 235 V 7.81 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 1.17 0.00 0.00 1.03 0.00 0.00 236 S 8.11 4.12 0.00 3.97 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 0.00 237 W 8.33 4.21 0.00 3.47 3.57 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 0.00 238 I 8.33 3.01 1.98 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 1.50 0.89 0.71 0.00 0.00 239 K 8.13 3.77 0.00 1.72 1.77 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.53 7.81 240 Q 7.94 3.97 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.62 0.00 241 T 7.58 3.70 3.46 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 0.70 0.00 0.00 242 I 7.14 2.74 1.53 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 -0.30 -0.36 0.62 0.00 0.00 243 A 7.72 4.04 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 0.00 244 S 7.51 4.69 0.00 3.76 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 N 8.02 4.71 0.00 2.98 3.01 0.00 0.00 6.74 7.43 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 * Residues marked with a * may have inaccurate shift predictions.