NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 S 4.4979 8.3349 116.8022 58.5759 64.3048 172.6844 13 S 4.7423 8.4066 121.7147 56.0408 66.2230 171.1342 14 N 4.6730 8.7050 119.8967 53.1780 40.9908 175.3162 *16 E 4.3899 8.3794 119.3110 55.7669 31.7182 177.2693 17 V 3.9159 8.5943 118.4801 66.3340 31.4610 177.6202 18 E 3.9899 7.9390 116.6521 59.4740 29.4669 178.3491 19 H 4.1748 8.3128 117.8266 59.0822 29.7871 178.0839 20 W 4.1972 7.6730 118.6374 57.1479 29.0718 178.6265 *22 T 4.1827 7.8801 116.5148 63.8559 70.0810 176.6420 23 S 4.1725 7.9283 117.4137 61.5979 62.5727 177.0107 24 L 4.1785 8.3207 121.8124 57.6966 41.4577 179.2214 25 K 3.8432 8.1552 117.9957 59.7554 31.9625 178.8532 26 E 3.9600 8.6426 118.8132 59.5568 29.4843 179.4169 27 V 3.6692 7.8293 118.1609 66.1328 31.3518 177.7215 28 E 3.9042 8.4036 118.9778 59.1176 29.4031 178.4644 29 K 3.7118 8.0885 119.7577 59.5471 32.1423 178.7554 30 V 3.5566 7.8355 118.2394 66.1159 31.5626 177.8810 31 L 4.0767 7.9917 118.5980 58.1484 41.3211 179.2692 32 D 4.4832 8.8136 117.6624 56.4500 40.6223 178.0888 33 S 4.3334 7.7473 114.0145 60.6149 62.6052 175.9046 34 V 3.7721 7.8495 120.6671 64.9690 31.4748 177.4213 35 E 3.9227 8.2453 119.6627 58.9380 29.2538 177.1973 36 P 4.2998 0.0000 0.0000 65.6946 31.3858 178.0959 37 K 4.0979 7.5227 115.0928 59.2958 32.1268 179.1200 38 L 4.0277 8.4926 119.4424 58.3620 41.3671 179.9113 39 T 4.0396 7.7810 114.1330 65.7409 68.7162 175.8936 40 S 4.7932 7.9119 116.1349 57.5711 63.5521 176.0166 41 S 4.3180 8.0890 119.9757 62.0105 62.5680 176.6898 42 G 4.0021 8.2698 108.5126 47.3239 0.0000 175.6838 43 T 3.9601 7.7988 117.9256 66.6275 68.0593 176.6637 44 K 3.9244 7.7468 119.1867 59.3310 31.9677 179.4910 45 W 3.6326 8.1286 118.7274 59.1054 28.8867 178.1306 46 R 2.9361 7.4360 119.0870 59.3973 29.3096 178.2898 47 V 3.4738 7.2124 116.8277 66.1254 31.3575 178.1437 48 V 3.4381 7.0672 116.9640 65.8651 31.4189 177.5199 49 A 4.3239 8.1687 120.7478 55.6976 18.2225 179.4684 50 Q 4.0523 8.2304 117.8385 59.4343 29.1714 178.0034 51 H 4.1674 8.4302 119.7281 59.2013 29.9121 177.4328 52 I 3.6685 7.9546 121.7015 64.2768 37.0928 178.2712 53 K 3.9533 8.5751 120.8567 59.5223 31.6722 178.6627 54 D 4.3138 7.8602 118.4567 57.2916 41.1554 178.3498 55 I 3.7962 7.4388 119.7151 64.6459 37.1366 177.8923 56 C 4.0520 8.0756 117.5604 63.0774 27.8201 175.8712 57 S 4.4065 7.5618 111.5135 59.1190 62.7608 174.9168 58 D 4.5913 7.9123 123.9856 56.7708 41.1272 177.7004 59 L 4.2282 7.7399 117.6299 56.7680 42.1012 176.8902 60 N 4.9321 8.0218 115.6863 53.6422 40.3453 174.7547 61 Q 3.9319 8.4883 118.6969 58.3013 27.0762 177.1336 62 I 4.1277 8.9424 115.6190 62.2118 38.4780 177.7489 63 F 4.7159 7.6979 125.5403 57.7626 37.5950 174.2496 64 N 4.2817 8.1679 122.4837 54.0605 39.5741 177.2826 65 K 3.8770 8.2907 116.3747 57.2073 32.2041 176.7541 66 E 3.8145 7.9594 117.1305 56.7134 28.0481 174.2111 67 D 4.5445 7.5569 117.5288 54.0912 41.4355 175.8800 68 P 4.5230 0.0000 0.0000 65.6935 31.4984 177.9270 69 R 4.2822 8.2705 114.8905 56.8198 30.6048 177.6385 70 Y 3.2394 8.3653 120.2796 59.9218 38.5217 177.3334 71 E 3.6526 7.5571 119.6900 59.1784 29.5700 179.0503 72 V 2.6297 6.9403 117.6470 65.8573 31.4218 178.2243 73 V 3.4635 7.4245 116.9967 65.8840 31.4456 177.3733 74 Q 3.5872 7.6117 119.1726 59.2716 28.8889 178.4509 75 A 4.0647 8.3600 121.7843 54.6164 18.2769 179.9699 76 G 3.3889 7.8667 104.4371 48.1071 0.0000 176.0048 77 A 4.0703 8.1552 124.1844 54.3562 18.2710 179.5936 78 S 4.0167 8.4314 112.1603 61.6717 62.4138 176.3557 79 A 4.0542 7.9863 122.6953 54.5361 18.0425 179.5590 80 A 4.0326 7.9802 119.9747 55.4037 18.5600 179.1213 81 H 4.0722 8.4794 116.9103 59.5195 29.9186 176.5409 82 D 4.3317 8.2656 120.0305 57.5849 40.9262 178.5471 83 F 4.2949 8.1216 120.2716 61.5305 39.6138 176.2354 84 D 4.2527 8.1606 117.7194 57.5390 40.7800 178.7917 85 V 3.5550 7.7079 118.5708 66.0212 31.8014 178.2824 86 R 3.9234 7.7802 114.9540 58.6499 28.8012 178.1655 87 Y 3.9742 8.0748 121.4333 60.7205 38.8504 177.3067 88 L 3.3848 7.7238 120.9568 57.9824 42.0149 178.3745 89 D 4.2711 8.1888 118.2856 57.2459 40.9628 177.8287 90 I 3.8042 7.1348 109.5623 61.4058 37.5623 175.1346 91 H 4.6481 7.2307 119.2416 58.1763 31.2274 175.6142 92 K 4.0430 8.2734 116.8608 58.2655 32.0386 177.3007 93 H 4.7218 7.9185 113.4008 54.9224 30.4352 174.2602 94 G 3.6408 7.8717 109.5391 45.5406 0.0000 174.1774 95 R 4.1699 8.8277 123.6617 59.3839 30.8949 179.3387 96 E 3.8313 7.6645 117.9494 59.2358 29.6499 179.7582 97 I 3.6780 7.7616 119.1166 64.3080 37.2979 177.8171 98 A 3.9560 8.0096 121.1940 55.7091 18.0763 179.2647 99 R 3.8744 7.9836 115.9973 59.6259 30.1075 178.8406 100 L 3.9600 7.9176 119.1473 58.2829 42.0722 178.9425 101 L 4.0003 8.3793 119.1792 58.0716 41.5191 179.5344 102 E 4.1034 7.9513 118.2059 59.5150 29.4787 179.3977 103 K 3.9107 8.1539 118.4409 59.6795 32.0055 179.4839 104 I 3.8912 8.2285 120.2565 64.5835 37.1034 178.3976 105 Q 4.0584 8.2841 119.0687 58.9203 28.5084 179.3289 106 K 3.9902 8.4070 119.6449 59.7528 31.9826 178.9441 107 Y 4.3540 7.9710 118.2859 60.3271 38.8873 177.7837 108 R 3.8056 8.4169 120.4859 59.4569 30.2197 178.0878 109 Q 4.0959 8.0410 119.3010 59.2494 28.7211 177.9522 110 E 4.3919 8.4242 120.4232 57.3244 29.8863 177.4884 111 I 4.2398 7.8610 112.1195 61.7603 38.4144 177.4302 112 E 4.0461 7.9059 120.9892 59.1921 29.2889 178.5403 113 E 4.0456 8.0205 117.9803 59.3666 29.4965 179.2029 114 I 3.8542 7.6198 120.0619 63.5469 37.2406 178.3102 115 K 4.0832 7.7575 119.7684 59.5330 31.7883 179.5190 116 K 4.1386 7.9726 118.4911 59.2683 31.7215 179.2849 117 E 4.0416 8.0799 118.1773 58.9928 29.4101 178.3467 118 Y 4.3417 7.7740 120.1261 60.6728 38.9671 177.8235 119 K 3.8135 8.1980 119.2462 59.0686 32.1389 179.2273 120 E 4.1458 7.9694 119.3572 59.6258 29.2995 179.3124 121 T 3.9311 7.6443 115.8510 66.6333 68.4318 176.0372 122 D 4.4873 7.7816 118.4503 57.0098 41.1597 178.4192 123 K 3.9786 8.0310 118.9315 59.7139 31.8356 178.6281 124 Y 4.1519 8.3828 116.3960 60.2959 37.8646 177.8525 125 R 3.6958 8.1215 119.5301 58.8126 30.3507 177.8903 126 E 4.0606 8.2868 118.4289 58.8238 29.3043 179.5112 127 R 3.8398 7.4682 117.9461 59.5537 30.2107 178.4018 128 Y 4.0200 7.7930 119.0350 60.2827 38.5492 177.1119 129 D 4.4918 8.2034 118.8481 55.6782 41.4067 178.2483 130 H 3.9430 8.1026 119.4088 59.5039 29.9803 176.7402 131 Y 4.5275 7.9235 117.7114 59.9700 37.7796 177.9823 132 K 3.8974 7.7783 121.0311 59.1897 32.3006 178.8980 133 V 3.5527 7.3396 118.2571 65.7707 31.3412 178.2890 134 K 3.9194 7.8931 117.6979 59.6452 31.5540 179.3648 135 L 3.7711 7.9127 119.0851 57.7833 41.3736 179.5934 136 D 4.2703 7.8332 118.4514 57.5898 40.9652 178.5395 137 N 4.3672 8.0672 116.8780 56.2668 38.2863 177.6419 138 L 4.0542 8.5048 120.3216 57.6734 41.7732 178.9873 139 E 4.1191 7.6837 116.8300 58.9549 29.4614 178.7409 140 K 4.0518 7.7922 119.2514 58.9643 33.7353 178.2045 141 K 4.2425 7.6635 119.4303 55.4148 29.9013 177.0610 142 N 4.4756 7.8258 116.5841 54.0468 37.9481 173.2314 143 K 4.2823 8.3160 120.8254 57.0688 35.0032 176.9631 144 D 4.7026 7.6783 124.8905 52.2122 40.9546 176.2834 145 Q 4.0282 8.4722 128.8278 58.3820 29.4140 177.6451 146 E 4.1557 8.1266 115.5800 57.7710 30.6610 178.1968 147 R 4.0346 7.6982 119.5710 59.3611 30.1331 178.4029 148 I 3.7951 7.8404 112.3096 63.4419 37.2534 177.6149 149 E 4.6116 7.5602 121.7560 58.5091 29.4294 178.9387 150 R 4.0870 8.0863 118.2265 58.9083 30.1497 178.5740 151 N 4.3580 8.0804 115.9452 55.8866 38.5223 177.0246 152 Q 4.1328 7.8736 119.5358 59.1675 28.6760 179.3884 153 Q 4.0126 7.6463 117.3358 59.0167 28.8738 178.6249 154 K 3.7700 7.9208 119.4199 59.2393 31.9260 179.1598 155 F 4.1146 8.6155 121.1157 61.4169 39.2942 177.4729 156 K 4.0897 7.9974 117.5318 59.0385 31.7504 179.2145 157 D 4.3473 8.3726 120.0170 57.0612 40.7265 178.4798 158 A 4.1277 8.1261 121.6168 55.2289 18.4295 179.5846 159 E 3.8854 8.2687 116.0305 59.3823 29.5398 179.1764 160 A 3.9550 7.8406 121.6667 54.7909 18.3571 179.5578 161 A 3.9427 8.1837 119.2251 55.3831 18.6435 179.0326 162 Y 3.9254 8.3654 118.4274 61.1399 38.9198 178.4678 163 S 4.0326 8.3308 113.9150 61.1769 62.3449 176.1527 164 S 3.9487 7.6878 115.8764 61.5648 62.3520 176.6869 165 V 3.4607 7.7912 114.9456 63.9846 31.0657 178.3837 166 C 3.8542 7.6868 116.8855 62.5716 27.9197 175.4336 167 A 3.9377 7.7691 122.0713 55.5548 17.6049 179.5396 168 D 4.1484 7.8565 116.2419 57.4677 41.2529 178.4856 169 L 4.0011 7.6502 120.5757 58.0057 41.8903 178.5512 170 I 3.3256 7.8388 119.0922 64.6906 37.2090 177.6367 171 Q 3.9211 7.6036 119.7495 58.7569 28.7609 177.5852 172 K 4.0733 7.6289 118.6169 56.9204 32.3081 178.7244 *174 E 3.4892 8.3468 120.1930 56.3112 30.9051 177.7181 175 T 3.9758 7.3169 110.8989 64.5287 67.5057 176.0273 176 V 3.9263 7.7182 120.1660 65.6794 31.2211 177.3969 177 W 4.5158 8.6099 127.6720 60.9149 30.5391 177.5835 178 K 3.9258 8.4560 118.1217 59.6261 31.5990 179.3025 179 K 3.8323 8.0069 118.8096 59.3937 31.7872 178.6460 180 H 3.5379 7.3495 114.6369 58.7172 27.9087 177.2980 181 V 3.2302 6.2923 119.1871 65.8203 31.2595 177.9830 182 S 4.0265 7.6400 112.4534 61.2585 62.1727 176.0034 183 I 3.8746 7.3514 115.1385 63.4293 37.7539 177.9889 184 F 4.3347 9.0846 120.3737 60.5229 38.7840 177.2361 185 A 4.0450 8.0842 120.3395 55.1681 18.1099 179.1759 186 E 3.8437 8.3792 117.4719 59.5747 29.7261 178.3740 187 A 4.0081 8.2561 120.3920 55.4438 18.3797 178.9785 188 A 4.0172 8.0095 117.8355 55.7837 18.4667 179.6915 189 S 4.1149 8.2427 112.5162 62.0170 63.0716 177.0720 190 A 4.0373 8.7490 123.4113 55.1732 18.1058 179.6465 191 V 3.4893 8.3424 117.0372 65.9824 31.5617 178.1908 192 W 4.0184 8.3499 118.3351 60.0025 29.0424 178.3007 193 S 4.2985 8.6147 113.5533 61.9489 61.7975 176.6404 194 T 3.6114 7.9381 117.8758 66.6899 68.3045 176.7747 195 Q 4.0435 8.5366 120.1929 58.8687 28.6624 178.6329 196 L 4.0483 8.7937 122.2551 58.6076 42.2545 178.9457 197 Q 3.8884 7.9360 117.6569 59.3063 28.5651 178.9042 198 Y 3.9839 7.5118 117.3172 60.6998 37.6758 178.1618 199 A 4.2369 7.7752 121.5899 55.3407 18.6076 179.5291 200 K 3.8497 8.3537 116.9959 59.9320 32.1353 179.3327 201 A 4.1354 7.9837 120.4827 54.9741 18.1059 179.4360 202 L 3.5974 8.0430 117.9788 58.2624 42.3264 178.7704 203 E 4.1083 8.3826 118.2600 59.3852 29.2967 179.1899 204 A 4.0163 8.2097 120.5438 55.2343 18.2552 179.5945 205 A 4.6543 8.3822 119.1894 54.6289 18.7025 179.2905 206 A 4.1169 7.8491 118.7925 54.1279 17.9430 179.1117 207 N 4.1907 7.8427 116.0685 56.4141 38.4519 175.1755 208 P 4.0915 0.0000 0.0000 65.5549 31.6698 177.8480 209 I 4.4188 8.2591 118.0370 62.8525 37.5175 178.3306 210 V 3.5409 7.2531 119.7558 65.5330 31.0099 175.9625 211 P 4.1550 0.0000 0.0000 66.5355 30.9161 177.8286 212 Y 3.9964 8.4136 116.5812 60.5146 37.6318 178.2035 213 L 4.2292 7.9463 119.5671 57.5244 40.0726 179.3346 214 Q 4.5239 7.5906 119.1680 58.0743 28.3917 178.1098 215 Q 4.0126 7.6464 116.7747 57.5895 29.0003 177.2545 216 E 4.4147 7.8121 119.6271 58.1837 30.5323 177.8211 217 E 3.9889 8.2456 117.8605 59.3533 29.8813 179.3444 218 Q 4.0898 7.4497 115.7673 57.9464 29.3434 176.7751 219 E 4.0579 7.8035 116.9043 57.0301 29.9350 175.1599 220 E 4.6298 8.6299 123.0566 57.3789 35.6643 174.5144 221 E 4.1374 8.2191 121.1400 56.8932 29.7394 174.5118 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 12 S 8.33 4.50 0.00 3.94 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 13 S 8.41 4.74 0.00 3.98 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 14 N 8.70 4.67 0.00 2.93 2.81 0.00 0.00 6.52 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *16 E 8.38 4.39 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 17 V 8.59 3.92 2.35 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 1.17 0.00 0.00 0.93 0.00 0.00 18 E 7.94 3.99 0.00 2.06 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 2.57 2.64 0.00 19 H 8.31 4.17 0.00 3.16 3.26 0.00 5.86 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 W 7.67 4.20 0.00 3.50 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *22 T 7.88 4.18 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 1.14 0.00 0.00 23 S 7.93 4.17 0.00 3.54 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 8.32 4.18 0.00 1.73 1.75 1.01 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 25 K 8.16 3.84 0.00 1.89 1.87 0.00 1.62 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.50 7.81 26 E 8.64 3.96 0.00 2.28 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 27 V 7.83 3.67 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.75 0.00 0.00 28 E 8.40 3.90 0.00 2.04 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 2.49 2.27 0.00 29 K 8.09 3.71 0.00 1.89 1.97 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.47 7.81 30 V 7.84 3.56 2.48 0.00 0.00 0.00 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 1.05 0.00 0.00 31 L 7.99 4.08 0.00 1.96 1.77 0.98 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.81 4.48 0.00 2.65 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 33 S 7.75 4.33 0.00 3.99 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 34 V 7.85 3.77 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 0.90 0.00 0.00 0.90 0.00 0.00 35 E 8.25 3.92 0.00 2.33 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 2.33 2.36 0.00 36 P 0.00 4.30 0.00 2.26 2.18 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.06 0.00 37 K 7.52 4.10 0.00 2.09 1.89 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.62 7.81 38 L 8.49 4.03 0.00 1.84 1.74 0.93 0.77 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 39 T 7.78 4.04 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 40 S 7.91 4.79 0.00 4.04 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 41 S 8.09 4.32 0.00 4.20 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 42 G 8.27 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 43 T 7.80 3.96 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 44 K 7.75 3.92 0.00 1.76 1.71 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.76 1.65 7.81 45 W 8.13 3.63 0.00 2.82 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 46 R 7.44 2.94 0.00 1.77 1.93 0.00 3.17 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.87 0.00 47 V 7.21 3.47 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 0.94 0.00 0.00 0.95 0.00 0.00 48 V 7.07 3.44 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.58 0.00 0.00 49 A 8.17 4.32 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.23 4.05 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.54 0.00 51 H 8.43 4.17 0.00 3.31 3.41 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.95 3.67 2.04 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.75 0.89 0.00 0.00 53 K 8.58 3.95 0.00 1.99 1.83 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.55 7.81 54 D 7.86 4.31 0.00 2.90 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 55 I 7.44 3.80 1.79 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.70 0.87 0.00 0.00 56 C 8.08 4.05 0.00 3.12 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 57 S 7.56 4.41 0.00 4.07 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 D 7.91 4.59 0.00 2.97 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 59 L 7.74 4.23 0.00 1.80 1.81 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.02 4.93 0.00 2.88 2.85 0.00 0.00 7.22 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 61 Q 8.49 3.93 0.00 2.25 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.85 0.00 0.00 0.00 0.00 0.00 2.64 2.31 0.00 62 I 8.94 4.13 1.88 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 1.32 0.54 0.92 0.00 0.00 63 F 7.70 4.72 0.00 2.98 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 64 N 8.17 4.28 0.00 2.73 2.73 0.00 0.00 6.99 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.29 3.88 0.00 2.00 1.93 0.00 1.84 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.59 1.46 7.81 66 E 7.96 3.81 0.00 2.00 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 2.28 2.34 0.00 67 D 7.56 4.54 0.00 2.97 2.97 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 68 P 0.00 4.52 0.00 2.29 2.18 0.00 3.72 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.19 0.00 69 R 8.27 4.28 0.00 2.14 2.18 0.00 3.21 0.00 0.00 3.17 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 70 Y 8.37 3.24 0.00 2.06 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 71 E 7.56 3.65 0.00 2.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 72 V 6.94 2.63 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 0.75 0.00 0.00 0.71 0.00 0.00 73 V 7.42 3.46 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 1.12 0.00 0.00 1.08 0.00 0.00 74 Q 7.61 3.59 0.00 1.09 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 75 A 8.36 4.06 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 76 G 7.87 3.39 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 0.00 77 A 8.16 4.07 1.33 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 78 S 8.43 4.02 0.00 3.84 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 79 A 7.99 4.05 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 80 A 7.98 4.03 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 H 8.48 4.07 0.00 3.28 3.53 0.00 5.83 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 D 8.27 4.33 0.00 3.02 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 83 F 8.12 4.29 0.00 3.14 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 84 D 8.16 4.25 0.00 2.89 2.83 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 85 V 7.71 3.55 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 1.04 0.00 0.00 0.88 0.00 0.00 86 R 7.78 3.92 0.00 2.07 2.18 0.00 3.26 0.00 0.00 3.48 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.71 0.00 87 Y 8.07 3.97 0.00 2.48 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 88 L 7.72 3.38 0.00 2.01 1.82 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 89 D 8.19 4.27 0.00 2.74 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 90 I 7.13 3.80 1.49 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.43 0.82 0.00 0.00 91 H 7.23 4.65 0.00 2.66 3.08 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 K 8.27 4.04 0.00 1.88 1.68 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.35 7.81 93 H 7.92 4.72 0.00 3.18 3.25 0.00 5.85 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 G 7.87 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 R 8.83 4.17 0.00 1.83 1.94 0.00 3.14 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 96 E 7.66 3.83 0.00 2.03 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 2.38 2.50 0.00 97 I 7.76 3.68 1.86 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 1.58 0.51 0.92 0.00 0.00 98 A 8.01 3.96 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 R 7.98 3.87 0.00 2.10 1.99 0.00 3.13 0.00 0.00 3.08 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 100 L 7.92 3.96 0.00 1.90 1.85 1.00 0.54 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 0.00 101 L 8.38 4.00 0.00 1.86 1.74 0.93 0.98 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 0.00 102 E 7.95 4.10 0.00 2.16 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 2.34 2.51 0.00 103 K 8.15 3.91 0.00 2.00 1.89 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.66 7.81 104 I 8.23 3.89 2.10 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.83 0.99 0.00 0.00 105 Q 8.28 4.06 0.00 2.27 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 106 K 8.41 3.99 0.00 1.98 1.91 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.47 7.81 107 Y 7.97 4.35 0.00 2.93 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 0.00 108 R 8.42 3.81 0.00 2.05 2.00 0.00 3.16 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 109 Q 8.04 4.10 0.00 2.30 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.60 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 110 E 8.42 4.39 0.00 2.32 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.23 0.00 111 I 7.86 4.24 1.78 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.65 0.62 0.00 0.00 112 E 7.91 4.05 0.00 2.14 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 2.55 2.30 0.00 113 E 8.02 4.05 0.00 2.16 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 0.00 2.44 2.36 0.00 114 I 7.62 3.85 2.01 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 1.83 1.55 0.93 0.00 0.00 115 K 7.76 4.08 0.00 2.05 1.92 0.00 1.95 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.62 7.81 116 K 7.97 4.14 0.00 1.91 1.88 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.51 7.81 117 E 8.08 4.04 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 118 Y 7.77 4.34 0.00 3.06 3.16 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 0.00 119 K 8.20 3.81 0.00 1.88 1.82 0.00 1.74 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.50 7.81 120 E 7.97 4.15 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 121 T 7.64 3.93 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 122 D 7.78 4.49 0.00 2.74 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 K 8.03 3.98 0.00 2.23 1.76 0.00 1.62 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.51 7.81 124 Y 8.38 4.15 0.00 3.46 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 0.00 125 R 8.12 3.70 0.00 2.06 2.03 0.00 3.32 0.00 0.00 3.55 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.43 0.00 126 E 8.29 4.06 0.00 2.20 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 127 R 7.47 3.84 0.00 2.26 2.14 0.00 3.19 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.72 0.00 128 Y 7.79 4.02 0.00 2.75 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 0.00 129 D 8.20 4.49 0.00 2.83 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 0.00 130 H 8.10 3.94 0.00 3.26 2.82 0.00 5.58 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Y 7.92 4.53 0.00 3.21 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 0.00 132 K 7.78 3.90 0.00 2.13 1.74 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.23 7.81 133 V 7.34 3.55 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.90 0.00 0.00 134 K 7.89 3.92 0.00 1.97 1.91 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.47 7.81 135 L 7.91 3.77 0.00 1.77 1.52 0.71 1.09 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 0.00 136 D 7.83 4.27 0.00 2.97 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 0.00 137 N 8.07 4.37 0.00 2.83 2.84 0.00 0.00 7.15 6.77 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 0.00 138 L 8.50 4.05 0.00 1.65 1.72 0.95 0.98 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 0.00 139 E 7.68 4.12 0.00 2.04 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 2.31 2.34 0.00 140 K 7.79 4.05 0.00 1.83 1.95 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.46 7.81 141 K 7.66 4.24 0.00 1.82 1.76 0.00 1.87 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.36 7.81 142 N 7.83 4.48 0.00 2.76 2.77 0.00 0.00 7.07 6.68 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 0.00 143 K 8.32 4.28 0.00 1.79 1.75 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.38 7.81 144 D 7.68 4.70 0.00 2.68 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 0.00 145 Q 8.47 4.03 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.44 6.57 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 146 E 8.13 4.16 0.00 1.97 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 2.26 2.34 0.00 147 R 7.70 4.03 0.00 2.16 2.05 0.00 3.11 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 148 I 7.84 3.80 1.85 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 1.66 0.65 0.95 0.00 0.00 149 E 7.56 4.61 0.00 2.27 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.35 0.00 150 R 8.09 4.09 0.00 2.01 1.95 0.00 3.11 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 151 N 8.08 4.36 0.00 2.81 2.89 0.00 0.00 7.15 7.74 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 0.00 152 Q 7.87 4.13 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 153 Q 7.65 4.01 0.00 2.28 2.09 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 2.37 2.53 0.00 154 K 7.92 3.77 0.00 1.39 0.74 0.00 1.44 0.00 0.00 1.48 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.93 1.00 7.81 155 F 8.62 4.11 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 0.00 156 K 8.00 4.09 0.00 2.11 1.89 0.00 1.79 0.00 0.00 1.89 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.68 1.78 7.81 157 D 8.37 4.35 0.00 2.78 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 A 8.13 4.13 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 E 8.27 3.89 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 2.20 2.32 0.00 160 A 7.84 3.95 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 A 8.18 3.94 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 Y 8.37 3.93 0.00 3.22 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 0.00 163 S 8.33 4.03 0.00 4.00 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 0.00 164 S 7.69 3.95 0.00 3.93 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 0.00 165 V 7.79 3.46 1.65 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 0.43 0.00 0.00 0.40 0.00 0.00 166 C 7.69 3.85 0.00 2.91 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 0.00 167 A 7.77 3.94 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 0.00 168 D 7.86 4.15 0.00 2.76 2.63 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 0.00 169 L 7.65 4.00 0.00 1.65 1.68 0.94 1.06 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 0.00 170 I 7.84 3.33 1.76 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.60 0.54 0.00 0.00 171 Q 7.60 3.92 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.14 0.00 0.00 0.00 0.00 0.00 2.24 2.46 0.00 172 K 7.63 4.07 0.00 1.95 1.75 0.00 1.70 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.31 7.81 *174 E 8.35 3.49 0.00 1.16 1.78 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 2.22 2.04 0.00 175 T 7.32 3.98 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 176 V 7.72 3.93 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 1.11 0.00 0.00 1.07 0.00 0.00 177 W 8.61 4.52 0.00 3.82 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 0.00 178 K 8.46 3.93 0.00 2.16 1.87 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.62 1.93 7.81 179 K 8.01 3.83 0.00 1.32 1.29 0.00 1.69 0.00 0.00 1.58 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.35 1.57 7.81 180 H 7.35 3.54 0.00 2.61 3.34 0.00 5.28 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 V 6.29 3.23 1.90 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 0.86 0.00 0.00 0.39 0.00 0.00 182 S 7.64 4.03 0.00 3.86 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 0.00 183 I 7.35 3.87 1.86 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.70 0.68 0.00 0.00 184 F 9.08 4.33 0.00 3.19 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 0.00 185 A 8.08 4.05 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.38 3.84 0.00 2.06 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 0.00 2.33 2.34 0.00 187 A 8.26 4.01 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 A 8.01 4.02 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 0.00 189 S 8.24 4.11 0.00 4.06 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 0.00 190 A 8.75 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 0.00 191 V 8.34 3.49 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 0.81 0.00 0.00 0.96 0.00 0.00 192 W 8.35 4.02 0.00 3.63 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 0.00 193 S 8.61 4.30 0.00 4.00 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 0.00 194 T 7.94 3.61 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 1.05 0.00 0.00 195 Q 8.54 4.04 0.00 1.86 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.77 0.00 0.00 0.00 0.00 0.00 2.53 2.23 0.00 196 L 8.79 4.05 0.00 2.00 1.99 1.05 0.99 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 0.00 197 Q 7.94 3.89 0.00 2.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.59 0.00 0.00 0.00 0.00 0.00 2.28 2.54 0.00 198 Y 7.51 3.98 0.00 1.72 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 A 7.78 4.24 1.55 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 0.00 0.00 200 K 8.35 3.85 0.00 2.02 1.92 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.67 7.81 201 A 7.98 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 202 L 8.04 3.60 0.00 1.60 1.86 -0.21 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 203 E 8.38 4.11 0.00 2.26 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 204 A 8.21 4.02 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 A 8.38 4.65 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 0.00 206 A 7.85 4.12 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 0.00 207 N 7.84 4.19 0.00 2.83 2.94 0.00 0.00 6.81 7.97 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 0.00 208 P 0.00 4.09 0.00 2.05 2.18 0.00 3.88 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 2.07 2.23 0.00 209 I 8.26 4.42 1.92 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 0.61 0.98 0.00 0.00 210 V 7.25 3.54 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 1.05 0.00 0.00 0.98 0.00 0.00 211 P 0.00 4.16 0.00 1.81 2.13 0.00 3.82 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 1.98 1.96 0.00 212 Y 8.41 4.00 0.00 3.18 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 0.00 213 L 7.95 4.23 0.00 1.80 1.85 0.98 1.27 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 0.00 214 Q 7.59 4.52 0.00 1.92 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.26 0.00 215 Q 7.65 4.01 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.76 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 216 E 7.81 4.41 0.00 2.14 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 2.27 2.39 0.00 217 E 8.25 3.99 0.00 2.03 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 2.42 2.49 0.00 218 Q 7.45 4.09 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 219 E 7.80 4.06 0.00 2.12 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 2.47 2.43 0.00 220 E 8.63 4.63 0.00 1.87 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 2.33 0.00 221 E 8.22 4.14 0.00 2.13 1.89 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 2.22 2.28 0.00 * Residues marked with a * may have inaccurate shift predictions.