NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4726 8.1633 120.6028 55.4844 33.9076 173.4621 2 K 4.6577 8.4731 126.2644 54.2102 34.6920 173.7870 3 I 5.1366 9.4414 128.4846 59.3896 40.5940 174.3417 4 A 4.9828 8.7751 127.7769 49.9841 22.1114 174.7861 5 I 4.9644 9.0648 122.5009 59.4923 40.2246 174.5804 6 F 5.1783 10.8784 129.3426 55.2609 42.7359 174.4799 7 G 3.8390 7.4461 114.8191 44.4953 0.0000 171.3639 8 T 3.5549 6.7587 114.5896 60.7231 68.1410 173.3252 9 V 3.7668 8.1859 124.0038 64.0575 32.0963 175.7829 10 G 3.7086 8.8884 113.8971 46.1269 0.0000 174.8526 11 A 3.9971 7.4398 122.8013 52.9396 18.9642 179.6565 12 G 4.0404 8.3503 104.1486 45.5693 0.0000 175.3330 13 K 3.9001 8.3555 121.6413 59.2837 31.8187 179.1713 14 S 4.1774 8.2012 115.3143 61.3235 63.3448 176.4688 15 T 3.8197 7.8882 113.7766 64.1134 68.2490 176.2705 16 I 3.8338 8.0154 122.9190 64.2130 37.3286 178.4930 17 S 4.1241 8.2776 115.0279 61.4023 62.6604 176.1556 18 A 4.1817 8.1416 123.0162 53.9056 18.3919 179.1360 19 E 4.0735 7.6216 116.8745 59.4177 29.8806 178.8586 20 I 3.6580 7.9260 119.8324 64.6765 37.1575 178.4851 21 S 4.0847 8.2395 113.8572 61.1322 62.0466 175.7278 22 K 4.2180 7.6237 117.1338 57.2976 31.6365 177.5395 23 K 4.4197 7.6149 117.8543 56.5950 34.7182 176.8962 24 L 4.1352 7.8085 116.6901 53.7279 42.7601 176.8844 25 G 3.8240 7.7933 105.9933 46.6134 0.0000 172.6932 26 Y 4.8772 7.6678 116.3258 56.2175 39.7569 175.4161 27 E 4.0041 8.7929 124.8383 56.4266 30.8080 175.7264 28 I 4.5227 8.1199 127.4822 60.6753 38.8620 175.2885 29 F 4.5127 8.7546 124.4378 55.7960 40.8918 174.6821 30 K 4.6780 8.4410 123.1909 54.5348 33.9658 176.7794 31 E 4.2303 8.6598 122.3647 55.3056 30.2474 175.2930 32 P 4.3934 0.0000 0.0000 63.0493 31.8937 176.4906 33 V 3.9501 8.1371 120.0246 63.9988 33.9868 176.5599 34 E 3.9982 8.0978 118.7089 59.6093 29.4422 178.3611 35 E 3.9920 7.9670 114.3786 57.0491 30.2857 176.3130 36 N 4.1212 7.6513 119.8064 52.3653 38.6352 173.4658 37 P 4.3617 0.0000 0.0000 63.9948 32.1648 176.2229 38 Y 4.6876 7.6314 116.6336 58.2705 38.5574 177.3517 39 F 4.1464 8.0362 122.3924 61.2593 39.1982 176.5926 40 E 4.1122 8.3543 118.5013 59.6294 29.5797 178.7069 41 Q 3.8898 8.1549 117.5445 58.7756 28.2996 177.7242 42 Y 3.9799 8.0880 120.8402 60.9511 38.5993 177.6763 43 Y 3.8595 7.1401 115.5009 59.8096 38.1644 177.5941 44 K 4.3810 7.4532 118.8381 58.0296 33.3695 176.8044 45 D 4.4476 7.9679 118.7007 52.7310 42.4934 175.2086 46 L 3.6466 8.0777 124.2208 56.6322 42.1565 179.7460 47 K 4.0388 8.1721 116.2873 59.7402 32.0249 178.5766 48 K 4.1507 8.7818 116.6407 58.8378 32.2576 178.7017 49 T 4.3533 7.3414 113.8414 64.2160 69.5157 176.7991 50 V 3.7697 8.2847 121.1520 66.2601 31.4489 177.9239 51 F 3.6993 8.1903 119.3165 61.1807 39.4362 176.8389 52 K 3.7224 8.0997 117.6887 59.6969 31.7299 178.5500 53 M 3.9994 7.9867 118.2655 58.8119 32.0586 178.2754 54 Q 3.9846 7.8780 117.9087 59.1347 28.9273 178.7840 55 I 3.7820 7.7338 120.7713 64.6799 37.1272 177.9088 56 Y 4.1617 8.3353 120.2934 60.9516 38.6117 177.9243 57 M 4.0457 8.4136 119.7229 58.4202 32.2401 178.7038 58 L 4.1035 8.2474 119.2052 58.0514 41.7274 179.8480 59 T 3.8372 7.8057 115.0778 66.4085 68.5084 176.5167 60 A 3.8305 7.5604 122.6039 55.3116 18.3384 179.9078 61 R 3.9618 8.3140 116.9198 59.4535 29.6893 179.1776 62 S 4.0498 7.9702 112.5179 61.3629 61.8066 176.3875 63 K 3.9617 8.0122 121.1081 59.6882 31.9046 179.3826 64 Q 3.9156 7.9575 117.7101 58.4886 28.3762 178.3243 65 L 3.8704 7.9259 121.3350 57.7595 42.1279 179.0815 66 K 4.0665 7.6871 118.2696 59.4790 31.9859 179.3638 67 Q 3.9365 7.5144 114.9786 58.5540 28.9193 177.7409 68 A 4.1101 7.7052 123.2414 54.9004 18.2755 179.4966 69 K 3.7944 7.3346 115.7362 59.7047 32.1086 178.3796 70 N 4.4544 8.1118 115.4595 55.4118 38.8486 175.1651 71 L 4.5649 7.6163 117.7538 53.3146 43.0709 176.4148 72 E 3.9701 8.8016 123.8327 58.1904 29.9541 175.8907 73 N 5.1103 8.1219 116.1022 50.3777 40.3953 174.3869 74 I 4.9809 8.0546 116.9076 59.2190 41.6480 173.9963 75 I 5.0076 8.6465 125.7731 59.9675 39.3355 174.3778 76 F 4.8883 9.7463 126.8308 55.8266 41.2998 174.5220 77 D 4.9658 8.5016 124.3186 53.4098 41.4657 172.3788 78 R 4.3039 9.0013 134.3088 56.0146 32.1962 176.2241 79 T 4.7392 9.2759 115.5188 60.9261 71.1535 173.6079 80 L 4.5846 8.6121 118.5190 56.0515 42.9466 177.0595 81 L 5.3504 8.0708 116.0855 54.1094 41.8884 176.6687 82 E 4.4100 8.0752 117.8948 56.5876 30.9375 177.7447 83 D 4.6619 8.3300 119.8299 56.9331 41.0084 176.2973 84 P 4.4755 0.0000 0.0000 64.8581 31.2338 178.5970 85 I 3.5912 7.5044 119.1699 64.4366 36.9680 178.3462 86 F 4.1689 8.1522 118.1590 60.3507 38.6675 177.5347 87 M 3.9932 7.8871 117.8762 58.3684 32.1507 178.0064 88 K 4.1921 8.3465 119.9168 59.2571 32.4533 179.0641 89 V 3.4770 7.8843 118.7725 66.1271 31.4272 177.8938 90 N 4.4382 8.0651 115.7376 56.3234 38.1327 176.7982 91 Y 4.0700 8.1375 121.1638 60.5084 38.6062 177.3413 92 D 4.1328 7.9920 119.3076 56.6238 40.9811 177.6355 93 L 4.2416 7.4748 116.4191 53.5469 42.4683 176.1752 94 N 4.0222 7.2825 115.2991 54.6009 36.2737 174.5060 95 N 4.7441 8.7825 113.9040 53.3677 39.9426 176.1336 96 V 4.5104 7.4044 117.5792 60.0441 34.8476 175.0769 97 D 4.8215 8.6564 126.8845 52.6587 41.7925 177.0985 98 Q 4.1584 8.7625 119.6694 59.9146 28.9812 177.9804 99 T 3.9198 8.0872 116.0455 67.0277 68.5941 175.9018 100 D 4.5351 9.1241 120.9044 57.7647 40.9164 178.5850 101 Y 4.0797 8.1259 119.5659 60.7950 38.7749 177.6789 102 N 4.2804 8.4489 117.9543 56.7672 38.9877 176.9455 103 T 3.9119 8.1590 117.2681 66.7876 68.5628 175.6032 104 Y 4.1596 8.2952 121.2831 61.1915 38.7390 178.6279 105 I 3.5713 7.6340 120.3894 64.3168 37.1592 178.0004 106 D 4.3382 8.3321 119.0362 56.9573 40.9012 178.2164 107 F 4.0778 8.2469 121.4115 61.4991 39.4468 176.4919 108 Y 3.4281 8.1521 119.4608 60.5465 38.1624 178.0886 109 N 4.3110 8.0152 116.4663 56.5493 38.9524 177.0501 110 N 4.4566 7.8592 115.7035 55.4844 38.9559 175.4078 111 V 3.9305 7.5660 117.9060 63.8377 33.1768 177.3262 112 V 3.1781 6.5566 119.0866 65.9838 31.7076 178.2052 113 L 4.0198 7.4777 116.4765 55.8987 42.7734 177.9052 114 E 4.2470 7.4113 120.8654 54.8675 28.2759 176.4563 115 N 4.9186 7.5659 120.2069 51.0360 37.3091 176.9822 116 L 4.3719 7.1069 116.9578 53.7126 43.7580 176.8081 *123 L 4.0871 8.2013 121.9078 53.8041 43.6659 177.5072 124 S 4.4702 7.3970 112.1674 56.8318 64.7928 173.4510 125 F 4.7481 8.2098 120.4319 56.4183 40.5886 175.6745 126 D 4.7218 8.6976 122.5139 56.2894 41.6889 176.9331 127 I 4.7440 7.6689 117.6991 59.4689 42.0167 173.8517 128 V 4.4983 8.8188 128.5533 61.1293 33.9840 174.4586 129 I 4.8598 9.3875 131.4022 60.8230 38.3714 174.9562 130 Y 5.4727 9.1378 130.5980 56.8455 39.6330 174.6501 131 L 4.8624 8.9011 128.9171 53.6236 41.1686 175.9374 132 R 3.6944 7.8076 124.1938 55.9498 31.1405 175.3869 133 V 4.8962 7.9844 117.9432 59.5426 36.0791 174.9667 134 S 4.3360 9.6068 118.3923 58.3306 63.8078 175.5834 135 T 3.9169 8.5912 118.8639 66.9831 67.9194 177.0496 136 K 4.0300 7.9984 119.8608 59.5329 32.0670 179.5086 137 T 3.8782 7.9083 115.7188 66.3795 68.3896 176.6165 138 A 4.6855 7.7297 123.9932 54.7921 18.5267 179.5700 139 I 3.3828 7.9463 118.7311 64.6369 36.9747 178.7972 140 S 4.2180 7.7890 114.2541 60.9626 62.8904 176.6170 141 R 4.0485 7.9695 122.2381 58.9098 29.6055 178.7964 142 I 3.5769 7.8939 120.1772 64.2171 36.8808 178.3873 143 K 4.0916 7.7719 116.9648 58.0118 31.8592 178.3476 144 K 4.4578 7.1702 117.7568 57.2468 33.6139 177.1222 145 R 4.6173 8.0371 112.8035 55.4249 32.8139 176.0672 146 G 4.0691 7.5212 109.6680 45.0546 0.0000 173.5809 147 R 4.5525 8.5234 119.8858 54.7605 31.3400 177.9095 148 S 4.2456 8.5410 115.2101 61.1685 63.6597 176.4139 149 E 4.0791 8.2640 120.6228 59.0384 29.4484 178.3391 150 E 3.3095 7.5036 116.1555 57.9187 29.4861 177.7392 151 L 4.3208 7.2513 116.8412 56.1594 41.9868 177.8039 152 L 4.1825 7.6492 117.6704 55.7250 41.9519 176.5532 153 I 4.3250 7.3430 118.2032 58.4889 39.9439 174.9747 154 G 3.9261 8.0831 114.3218 45.0150 0.0000 174.4467 155 E 4.2641 8.6565 118.0943 59.0729 29.3613 179.3717 156 E 4.0144 8.2301 118.6029 59.3473 29.4772 178.5534 157 Y 3.7576 7.5800 119.2080 60.5827 38.8007 178.2169 158 W 4.6644 7.8783 119.3937 59.7851 29.1984 178.0685 159 E 4.0505 8.4387 119.4796 59.4214 29.1495 178.9733 160 T 3.9091 7.9884 116.0972 66.1820 68.4129 176.6133 161 L 3.8053 7.7176 122.4145 58.1482 42.1706 178.5562 162 N 4.4349 8.5850 117.3630 56.5503 38.9284 176.7504 163 K 4.0444 8.0177 120.8514 59.5422 32.2792 178.5973 164 N 4.4316 8.0989 116.7040 56.1933 38.4350 177.0941 165 Y 3.8054 8.2025 118.3405 60.9163 37.9633 178.1689 166 E 4.2215 8.2674 119.8255 59.4856 29.7623 178.5076 167 E 4.0430 8.3000 119.2519 59.0171 29.6726 178.2641 168 F 3.9242 8.8161 121.2216 61.5440 39.2206 176.1560 169 Y 3.8470 8.4416 117.8416 60.9714 38.5995 178.2066 170 K 3.7682 8.3453 118.0158 59.1832 32.1592 179.0260 171 Q 3.7834 8.1851 119.4485 58.4918 30.4949 175.8350 172 N 3.7172 8.2380 116.6897 54.1332 37.7018 174.5349 173 V 3.1585 6.6810 119.2198 65.7615 32.0988 175.8790 174 Y 4.4638 6.9352 114.1226 56.7775 38.1809 174.9854 175 D 4.2728 7.3383 117.8949 55.2437 40.0803 173.9120 176 F 4.7296 7.7871 116.4118 57.2094 40.2958 175.1965 177 P 4.7704 0.0000 0.0000 61.9063 29.6092 174.8595 178 F 5.2070 8.1998 123.5285 58.5023 40.5939 175.0964 179 F 4.9867 9.6273 124.5750 56.6622 42.2402 173.8085 180 V 4.3052 8.0039 126.1075 62.1933 32.9357 175.2806 181 V 4.1619 8.0707 125.4007 60.9477 34.9038 173.4940 182 D 4.4174 8.7300 127.3854 54.3829 41.7526 175.4198 183 A 4.6346 8.4049 127.6859 52.0271 18.9193 177.8030 184 E 4.0316 8.5625 117.6337 58.9784 29.8851 177.8009 185 L 4.2051 7.1479 117.3824 53.8805 42.2344 176.9191 186 D 4.5895 8.3137 121.2505 52.9916 41.3489 177.7473 187 V 3.5792 8.1811 118.6966 66.1753 31.5281 177.7282 188 K 3.8397 8.1490 117.6671 60.0504 31.8644 179.0986 189 T 3.8604 7.7052 114.1321 66.7154 68.3794 176.6480 190 Q 4.0194 7.7587 119.7236 59.1884 28.7495 178.9993 191 I 3.7429 8.0047 120.8795 64.5697 37.1069 178.4107 192 E 4.0034 8.2938 119.3895 59.3670 29.1414 179.3968 193 L 4.1648 8.2067 119.0882 57.5115 41.5166 179.7383 194 I 3.8073 7.8874 119.9813 64.6213 37.1996 178.0042 195 M 3.9891 8.1047 119.4991 58.7021 31.6100 178.3324 196 N 4.2359 7.8801 115.0567 56.4846 39.0300 177.0523 197 K 3.9173 7.4189 120.1124 59.4195 32.0275 178.9188 198 L 3.9758 7.8319 118.3246 57.8301 41.6433 178.9427 199 N 4.5650 8.2503 115.0973 54.9640 38.4772 175.2629 200 S 4.2254 7.7606 120.0527 58.3547 63.3320 173.6689 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.16 4.47 0.00 2.25 2.11 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.94 0.00 2 K 8.47 4.66 0.00 1.82 1.73 0.00 1.66 0.00 0.00 1.55 0.00 0.00 2.78 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.37 1.48 7.81 3 I 9.44 5.14 2.07 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.90 1.01 0.00 0.00 4 A 8.78 4.98 -0.03 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 5 I 9.06 4.96 1.96 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.91 1.00 0.00 0.00 6 F 10.88 5.18 0.00 3.22 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 7.45 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 0.00 0.00 0.00 8 T 6.76 3.55 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 1.21 0.00 0.00 9 V 8.19 3.77 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 0.80 0.00 0.00 1.49 0.00 0.00 10 G 8.89 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 0.00 0.00 0.00 11 A 7.44 4.00 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 12 G 8.35 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 13 K 8.36 3.90 0.00 1.83 2.15 0.00 1.88 0.00 0.00 1.79 0.00 0.00 3.32 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.49 7.81 14 S 8.20 4.18 0.00 4.03 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 15 T 7.89 3.82 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 1.19 0.00 0.00 16 I 8.02 3.83 2.03 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 1.60 0.46 0.95 0.00 0.00 17 S 8.28 4.12 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 18 A 8.14 4.18 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 E 7.62 4.07 0.00 2.33 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 2.48 2.48 0.00 20 I 7.93 3.66 1.88 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 1.41 1.16 0.87 0.00 0.00 21 S 8.24 4.08 0.00 4.02 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 22 K 7.62 4.22 0.00 1.92 1.80 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.45 7.81 23 K 7.61 4.42 0.00 1.73 1.72 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.28 1.54 7.81 24 L 7.81 4.14 0.00 0.98 0.20 0.63 0.53 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 25 G 7.79 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 26 Y 7.67 4.88 0.00 2.84 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.79 4.00 0.00 2.04 1.68 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 2.01 1.99 0.00 28 I 8.12 4.52 1.74 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.61 0.91 0.00 0.00 29 F 8.75 4.51 0.00 1.67 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.44 4.68 0.00 1.60 1.71 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.40 7.81 31 E 8.66 4.23 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 2.42 2.40 0.00 32 P 0.00 4.39 0.00 2.28 2.13 0.00 3.66 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 33 V 8.14 3.95 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.00 0.00 0.78 0.00 0.00 34 E 8.10 4.00 0.00 2.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.23 0.00 35 E 7.97 3.99 0.00 2.03 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 2.33 2.30 0.00 36 N 7.65 4.12 0.00 2.81 2.85 0.00 0.00 6.87 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 37 P 0.00 4.36 0.00 1.68 1.83 0.00 2.51 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.45 0.00 38 Y 7.63 4.69 0.00 3.14 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 39 F 8.04 4.15 0.00 3.25 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 E 8.35 4.11 0.00 2.20 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 41 Q 8.15 3.89 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.67 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 42 Y 8.09 3.98 0.00 3.03 2.75 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 43 Y 7.14 3.86 0.00 2.87 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 44 K 7.45 4.38 0.00 1.76 1.85 0.00 1.73 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.57 7.81 45 D 7.97 4.45 0.00 2.60 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 8.08 3.65 0.00 1.54 1.54 0.68 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.17 4.04 0.00 1.86 1.91 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.62 1.47 7.81 48 K 8.78 4.15 0.00 1.68 1.87 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.61 7.81 49 T 7.34 4.35 4.34 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 1.30 0.00 0.00 50 V 8.28 3.77 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.08 0.00 0.00 51 F 8.19 3.70 0.00 3.19 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 K 8.10 3.72 0.00 1.35 0.74 0.00 1.47 0.00 0.00 1.55 0.00 0.00 2.85 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.39 7.81 53 M 7.99 4.00 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 1.64 0.00 54 Q 7.88 3.98 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.55 0.00 0.00 0.00 0.00 0.00 2.44 1.94 0.00 55 I 7.73 3.78 2.08 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.08 0.99 0.00 0.00 56 Y 8.34 4.16 0.00 3.44 3.34 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 57 M 8.41 4.05 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.98 0.00 58 L 8.25 4.10 0.00 1.81 1.83 1.29 0.89 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 59 T 7.81 3.84 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 60 A 7.56 3.83 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 61 R 8.31 3.96 0.00 1.85 2.08 0.00 3.60 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.97 0.00 62 S 7.97 4.05 0.00 3.89 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.01 3.96 0.00 2.05 1.83 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.54 7.81 64 Q 7.96 3.92 0.00 2.41 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.57 0.00 65 L 7.93 3.87 0.00 1.65 1.86 0.76 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 66 K 7.69 4.07 0.00 1.99 1.80 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.40 7.81 67 Q 7.51 3.94 0.00 2.29 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.99 0.00 0.00 0.00 0.00 0.00 2.38 2.11 0.00 68 A 7.71 4.11 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 69 K 7.33 3.79 0.00 1.94 1.84 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.50 7.81 70 N 8.11 4.45 0.00 2.85 2.90 0.00 0.00 6.87 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 L 7.62 4.56 0.00 1.76 1.65 1.06 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 72 E 8.80 3.97 0.00 1.89 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 0.00 2.23 2.29 0.00 73 N 8.12 5.11 0.00 2.20 1.42 0.00 0.00 7.03 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 8.05 4.98 2.36 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 1.44 0.85 1.23 0.00 0.00 75 I 8.65 5.01 1.97 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 1.45 1.08 1.01 0.00 0.00 76 F 9.75 4.89 0.00 3.29 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 77 D 8.50 4.97 0.00 2.67 2.64 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 78 R 9.00 4.30 0.00 2.13 2.08 0.00 3.61 0.00 0.00 3.79 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 79 T 9.28 4.74 4.40 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 0.92 0.00 0.00 80 L 8.61 4.58 0.00 1.68 1.79 0.81 0.88 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 81 L 8.07 5.35 0.00 1.90 1.66 0.63 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.08 4.41 0.00 2.19 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 2.22 2.51 0.00 83 D 8.33 4.66 0.00 2.94 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 84 P 0.00 4.48 0.00 2.10 2.03 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.16 0.00 85 I 7.50 3.59 1.51 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.48 0.14 0.00 0.00 86 F 8.15 4.17 0.00 3.31 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 87 M 7.89 3.99 0.00 1.91 1.40 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 1.58 0.00 88 K 8.35 4.19 0.00 2.21 1.93 0.00 1.88 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.56 7.81 89 V 7.88 3.48 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 0.48 0.00 0.00 0.78 0.00 0.00 90 N 8.07 4.44 0.00 2.99 2.93 0.00 0.00 6.73 8.56 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 91 Y 8.14 4.07 0.00 3.03 2.87 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 92 D 7.99 4.13 0.00 2.76 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 L 7.47 4.24 0.00 1.62 1.65 0.90 0.79 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 94 N 7.28 4.02 0.00 2.73 2.79 0.00 0.00 6.84 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.78 4.74 0.00 2.82 2.85 0.00 0.00 6.50 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 96 V 7.40 4.51 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 1.13 0.00 0.00 1.07 0.00 0.00 97 D 8.66 4.82 0.00 3.03 2.87 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 98 Q 8.76 4.16 0.00 2.29 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.92 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 99 T 8.09 3.92 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 1.24 0.00 0.00 100 D 9.12 4.54 0.00 2.91 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 0.00 101 Y 8.13 4.08 0.00 3.03 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 N 8.45 4.28 0.00 2.88 3.02 0.00 0.00 7.27 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 0.00 103 T 8.16 3.91 4.65 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 1.35 0.00 0.00 104 Y 8.30 4.16 0.00 2.82 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 0.00 105 I 7.63 3.57 1.64 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 -0.03 0.84 0.00 0.00 106 D 8.33 4.34 0.00 2.97 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 0.00 107 F 8.25 4.08 0.00 3.21 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 0.00 108 Y 8.15 3.43 0.00 2.75 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 0.00 109 N 8.02 4.31 0.00 2.77 2.84 0.00 0.00 7.09 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 0.00 110 N 7.86 4.46 0.00 2.79 2.81 0.00 0.00 6.91 7.71 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 0.00 111 V 7.57 3.93 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.80 0.00 0.00 112 V 6.56 3.18 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.41 0.00 0.00 113 L 7.48 4.02 0.00 1.84 1.65 1.15 1.01 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 0.00 114 E 7.41 4.25 0.00 1.97 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.45 0.00 115 N 7.57 4.92 0.00 2.65 2.67 0.00 0.00 6.11 7.79 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 0.00 116 L 7.11 4.37 0.00 1.54 1.56 0.88 1.02 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 *123 L 8.20 4.09 0.00 1.51 1.60 0.84 0.82 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 0.00 124 S 7.40 4.47 0.00 3.93 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 8.21 4.75 0.00 2.84 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.70 4.72 0.00 2.72 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 0.00 127 I 7.67 4.74 1.90 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 1.33 1.62 0.97 0.00 0.00 128 V 8.82 4.50 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 0.66 0.00 0.00 0.32 0.00 0.00 129 I 9.39 4.86 2.04 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 1.41 0.55 1.16 0.00 0.00 130 Y 9.14 5.47 0.00 3.05 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 0.00 131 L 8.90 4.86 0.00 1.60 1.59 0.99 0.75 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 0.00 132 R 7.81 3.69 0.00 0.67 1.27 0.00 2.78 0.00 0.00 3.02 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.36 0.00 133 V 7.98 4.90 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 0.68 0.00 0.00 0.88 0.00 0.00 134 S 9.61 4.34 0.00 3.94 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 0.00 135 T 8.59 3.92 4.34 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 1.34 0.00 0.00 136 K 8.00 4.03 0.00 1.79 1.86 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.54 7.81 137 T 7.91 3.88 4.40 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 1.17 0.00 0.00 138 A 7.73 4.69 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 0.00 139 I 7.95 3.38 1.90 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 1.52 1.16 0.91 0.00 0.00 140 S 7.79 4.22 0.00 4.00 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 0.00 141 R 7.97 4.05 0.00 2.11 1.93 0.00 3.24 0.00 0.00 3.12 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 142 I 7.89 3.58 1.72 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.55 0.74 0.00 0.00 143 K 7.77 4.09 0.00 1.87 1.84 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.52 7.81 144 K 7.17 4.46 0.00 1.66 1.80 0.00 1.74 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.48 7.81 145 R 8.04 4.62 0.00 1.70 1.85 0.00 3.12 0.00 0.00 3.20 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 146 G 7.52 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 0.00 147 R 8.52 4.55 0.00 2.21 2.09 0.00 3.64 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 148 S 8.54 4.25 0.00 4.02 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 E 8.26 4.08 0.00 2.23 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 2.56 2.48 0.00 150 E 7.50 3.31 0.00 2.01 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 2.40 2.18 0.00 151 L 7.25 4.32 0.00 1.75 1.73 0.92 0.93 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 0.00 152 L 7.65 4.18 0.00 1.84 1.70 0.93 0.77 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 0.00 153 I 7.34 4.32 1.71 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 0.62 0.38 0.47 0.00 0.00 154 G 8.08 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 0.00 0.00 0.00 155 E 8.66 4.26 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.41 0.00 156 E 8.23 4.01 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 157 Y 7.58 3.76 0.00 2.78 2.42 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 0.00 158 W 7.88 4.66 0.00 3.49 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 0.00 159 E 8.44 4.05 0.00 2.25 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 160 T 7.99 3.91 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 1.11 0.00 0.00 161 L 7.72 3.81 0.00 1.67 1.97 0.50 1.04 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 0.00 162 N 8.58 4.43 0.00 3.09 2.88 0.00 0.00 6.90 6.84 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 0.00 163 K 8.02 4.04 0.00 1.95 2.04 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.51 7.81 164 N 8.10 4.43 0.00 2.92 2.70 0.00 0.00 6.99 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 0.00 165 Y 8.20 3.81 0.00 3.04 2.87 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 0.00 166 E 8.27 4.22 0.00 2.29 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 2.44 2.55 0.00 167 E 8.30 4.04 0.00 2.20 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 2.32 2.36 0.00 168 F 8.82 3.92 0.00 3.24 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 0.00 169 Y 8.44 3.85 0.00 2.51 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 0.00 170 K 8.35 3.77 0.00 1.71 1.80 0.00 1.80 0.00 0.00 1.58 0.00 0.00 3.46 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.77 1.67 7.81 171 Q 8.19 3.78 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.50 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 172 N 8.24 3.72 0.00 2.94 2.56 0.00 0.00 6.92 7.58 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 0.00 173 V 6.68 3.16 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 0.43 0.00 0.00 174 Y 6.94 4.46 0.00 2.17 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 0.00 175 D 7.34 4.27 0.00 2.65 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 0.00 176 F 7.79 4.73 0.00 2.45 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 0.00 0.00 0.00 0.00 177 P 0.00 4.77 0.00 2.18 2.27 0.00 3.64 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.19 0.00 178 F 8.20 5.21 0.00 3.24 3.32 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 0.00 179 F 9.63 4.99 0.00 3.19 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 0.00 180 V 8.00 4.31 1.80 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 0.34 0.00 0.00 0.74 0.00 0.00 181 V 8.07 4.16 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 0.85 0.00 0.00 0.93 0.00 0.00 182 D 8.73 4.42 0.00 2.66 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 0.00 0.00 0.00 0.00 183 A 8.40 4.63 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 E 8.56 4.03 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 185 L 7.15 4.21 0.00 1.66 1.58 0.89 0.99 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 0.00 186 D 8.31 4.59 0.00 2.93 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 0.00 187 V 8.18 3.58 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.92 0.00 0.00 188 K 8.15 3.84 0.00 1.83 1.86 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.55 7.81 189 T 7.71 3.86 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 190 Q 7.76 4.02 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 191 I 8.00 3.74 2.00 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 1.70 0.85 0.91 0.00 0.00 192 E 8.29 4.00 0.00 2.18 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 2.33 2.35 0.00 193 L 8.21 4.16 0.00 1.96 1.89 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 194 I 7.89 3.81 2.05 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.92 0.95 0.00 0.00 195 M 8.10 3.99 0.00 2.01 2.18 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.90 0.00 196 N 7.88 4.24 0.00 2.93 2.92 0.00 0.00 7.06 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 0.00 197 K 7.42 3.92 0.00 1.37 1.46 0.00 1.29 0.00 0.00 1.22 0.00 0.00 2.88 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 1.00 7.81 198 L 7.83 3.98 0.00 1.62 1.73 0.93 1.26 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 0.00 199 N 8.25 4.56 0.00 2.86 2.87 0.00 0.00 6.81 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 0.00 200 S 7.76 4.23 0.00 3.93 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 * Residues marked with a * may have inaccurate shift predictions.