NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2823 7.8827 121.4520 61.2442 38.5572 173.9300 17 V 3.9016 8.7707 126.6075 62.1623 32.4818 174.9698 18 G 3.9039 9.0786 114.3216 45.8638 0.0000 173.7928 19 G 4.1326 7.6311 110.3350 44.9853 0.0000 172.3802 20 Y 4.9133 7.8637 117.8918 55.2187 42.2138 174.4492 21 N 4.7184 8.8622 117.7486 53.7015 38.9126 175.8862 22 C 4.2427 8.6431 122.2375 57.2457 41.1183 174.1342 23 E 4.2530 8.7564 121.7536 55.6828 29.8559 176.3766 24 E 3.9811 8.4404 117.4337 57.5223 30.2567 176.8575 25 N 4.2497 8.6913 116.6165 54.2014 36.4026 175.2447 26 S 4.3805 7.6431 113.5199 59.5392 64.4945 174.5917 27 V 3.8296 7.1282 119.8325 60.7767 31.2248 174.1968 28 P 4.5271 0.0000 0.0000 64.2118 32.2594 177.7748 29 Y 5.0473 6.7830 115.8843 56.6285 38.8011 174.6580 30 Q 4.5331 7.3620 123.7016 56.3282 29.6524 175.4953 31 V 4.9376 8.9969 119.2964 59.5283 36.1678 174.4501 32 S 5.1250 8.6713 116.5909 56.6707 65.9853 172.8418 33 L 4.7075 8.2114 122.7294 53.2586 43.8797 175.3106 34 N 5.7566 8.5517 119.5310 50.0897 42.7411 174.8264 *37 S 4.4521 8.3719 117.6344 57.5504 63.8907 171.8582 38 G 4.3366 9.3651 110.3217 46.2811 0.0000 171.3522 39 Y 4.8489 7.9695 115.0239 55.0140 41.1198 173.9911 40 H 4.5523 8.7406 120.7175 55.9747 28.6774 174.2597 41 F 4.4886 7.6475 122.5583 57.8760 39.0273 175.1145 42 C 4.8755 6.7287 116.5535 55.5896 45.1771 173.5248 43 G 4.0287 8.4295 108.7753 45.9209 0.0000 172.3070 44 G 4.3416 7.7774 105.2463 46.5687 0.0000 172.6385 45 S 5.3889 8.6795 115.6368 56.3698 66.8931 173.8038 46 L 4.7721 9.0254 127.1346 54.8903 42.2912 176.9754 47 I 4.5938 8.5155 119.6294 60.7795 38.9439 174.8804 48 N 4.9472 7.8420 118.6255 52.1685 41.7868 174.4298 49 E 4.0426 8.9929 121.0818 59.1714 29.6030 177.8963 50 Q 4.7031 8.5546 118.2971 55.1231 31.1998 174.3621 51 W 5.6141 8.5452 116.9035 54.9446 33.9304 174.0302 52 V 5.0074 9.0247 123.5664 61.1811 34.1683 174.3141 53 V 4.7807 8.7746 127.4605 62.2250 33.3877 174.9456 54 S 4.6287 8.8579 120.0434 57.6731 66.0921 171.6766 55 A 4.6237 8.5768 120.8666 50.6345 20.3681 178.8016 56 G 3.3005 8.6212 111.4749 48.6955 0.0000 174.7662 57 H 4.5105 8.5879 113.1614 56.9386 28.5893 174.9731 58 C 4.7598 8.1495 117.8905 56.9858 40.1631 173.0294 59 Y 4.0544 7.8622 122.3463 57.7399 38.6432 175.5420 60 K 4.4247 7.3429 125.0281 54.2384 36.2590 176.4325 61 S 4.1785 8.3598 114.6923 60.0984 63.5105 174.7359 62 R 4.5849 7.6931 119.1243 54.1394 32.7204 174.4757 63 I 4.9132 8.1235 122.5582 59.5343 41.7108 173.7646 64 Q 4.8179 9.2672 128.1934 54.4338 31.1031 174.1718 65 V 4.5376 8.7046 127.1461 61.6691 33.6858 174.5133 66 R 4.7859 8.4894 126.3328 54.3032 32.8263 174.9079 67 L 4.7369 8.4008 123.3839 52.7390 44.9246 177.5804 *69 G 3.8051 8.5038 109.3353 45.0818 0.0000 172.4975 70 E 4.3099 8.0490 119.0464 55.9675 30.5609 174.1878 71 H 4.9859 8.6636 120.7216 57.6490 31.1497 172.6859 72 N 5.1270 7.9993 118.6610 52.7982 39.4904 174.6954 73 I 3.4322 9.0209 127.4455 62.5451 37.8308 176.2277 74 E 4.2856 8.5352 120.1640 57.4084 30.6221 176.3455 75 V 4.3211 7.0981 116.0439 60.3905 33.0749 175.2064 76 L 4.3795 8.5525 127.6160 55.2174 41.9589 176.7464 77 E 4.5466 9.5032 121.3527 55.3830 30.7690 176.4247 78 G 4.0936 8.2271 107.3446 45.6062 0.0000 174.5796 79 N 4.9059 8.0426 114.7684 53.0552 39.2921 175.2189 80 E 4.4259 8.1610 118.7354 56.4459 30.7542 176.1813 81 Q 4.7007 8.7069 121.3328 54.1990 32.3920 174.3078 82 F 5.0207 9.1784 122.7405 55.9611 40.6813 175.3853 83 I 4.6763 8.7201 124.7333 59.5485 41.2736 174.7355 84 N 5.0330 8.8321 123.9578 52.4721 40.1287 174.4167 85 A 4.3024 8.6458 125.0566 52.6622 18.3837 177.4842 86 A 4.2242 9.2616 126.1111 53.9536 19.6183 178.0671 87 K 4.6496 7.6305 112.8474 54.7131 36.9647 175.9789 88 I 4.8018 8.5364 123.3783 59.9371 39.9675 175.3368 89 I 4.5317 9.4481 130.3969 59.5830 38.5866 175.7964 90 R 4.6583 8.5963 126.0295 55.3847 31.4042 176.4257 91 H 3.6057 8.5808 122.0442 55.5340 30.1807 174.5696 92 P 4.4722 0.0000 0.0000 64.4066 31.5499 176.6409 93 Q 4.5917 7.7306 117.4774 55.6350 29.2870 174.6969 94 Y 4.2649 8.3026 120.5295 57.8264 39.2882 174.9597 95 D 4.4160 8.3262 127.5272 52.1296 41.4239 176.7632 96 R 3.7776 7.9428 126.8217 59.0132 30.4357 179.0065 97 K 3.9618 7.9102 117.0911 59.4611 32.1024 178.4622 98 T 3.8444 7.7684 105.7738 61.4165 69.3592 174.4417 99 L 3.5178 7.7792 121.2868 55.3701 39.9992 174.0426 100 N 4.4922 7.5496 116.2732 54.4769 39.6265 174.3584 101 N 4.9658 8.6848 119.8595 54.1311 35.9361 175.5277 102 D 5.0430 8.0516 117.6381 53.1507 39.7310 174.6902 103 I 4.8245 7.3888 121.1092 59.6515 42.3316 172.5925 104 M 5.3550 8.7860 125.4064 54.4572 36.2379 173.1163 105 L 5.4022 9.7409 125.5227 53.1106 45.0488 175.3473 106 I 4.8365 8.9970 124.1406 59.3488 40.3634 174.3527 107 K 3.2737 8.2896 129.2682 54.6282 33.2457 176.0628 108 L 4.4173 8.3071 128.2982 54.5754 42.4014 178.2897 109 S 4.2939 8.6915 116.9033 60.3690 63.5336 174.2577 110 S 4.6855 7.3372 111.0987 56.1422 65.9749 173.6779 111 R 4.3350 8.3827 120.4493 55.8922 30.4686 176.5847 112 A 4.2305 9.0150 126.1300 51.9830 19.3507 177.4031 113 V 3.8564 8.5180 122.0153 62.2927 32.0257 175.8436 114 I 4.3839 8.3551 130.0950 60.7245 37.8496 175.1022 115 N 4.7647 8.7793 123.0572 52.0691 39.2251 174.6865 116 A 4.1827 8.7654 119.0008 54.8733 18.4916 178.6966 117 R 4.3654 9.1596 114.0740 55.9808 31.8802 175.6991 118 V 4.4003 7.6596 117.7339 61.0499 32.7600 173.9481 119 S 5.2562 8.5115 122.6273 56.7951 67.5812 173.6183 120 T 5.0474 8.4478 111.4622 60.9543 70.6287 173.6642 121 I 4.4791 8.0347 121.8639 58.8006 40.4780 175.1223 122 S 4.3212 8.4930 123.2416 58.3598 63.5577 173.3765 123 L 4.4830 8.3612 125.5077 53.4992 42.7732 174.6617 124 P 4.7494 0.0000 0.0000 62.1459 32.2287 176.3951 125 T 4.2074 8.5497 110.2557 62.2904 69.6359 174.0627 *127 A 3.7621 7.8370 124.0239 51.1315 19.5147 174.4872 128 P 3.9474 0.0000 0.0000 60.7119 32.2165 174.0807 129 P 3.8768 0.0000 0.0000 63.0777 30.9436 175.5851 130 A 4.1378 8.3265 127.2869 50.9007 19.4413 175.9496 *132 T 4.3088 8.3087 112.9526 62.9521 69.9141 173.2043 133 G 4.1027 8.9288 112.5470 45.9791 0.0000 174.5498 134 T 4.0033 7.6382 116.7865 63.2884 69.4200 174.0888 135 K 4.5784 8.6557 127.9587 56.6338 33.1138 176.3858 136 C 5.2736 9.7735 124.1768 54.9917 46.2482 172.7172 137 L 5.0923 8.7621 121.6714 53.6612 44.1296 175.2431 138 I 5.1300 8.8307 128.0790 59.7896 38.9877 175.3646 139 S 4.8905 8.2908 118.5745 56.6165 66.4241 173.0428 140 G 3.7329 7.4994 108.4623 46.0930 0.0000 172.8186 141 W 4.9418 8.5582 117.6867 56.2116 29.6268 177.0301 142 G 3.9850 7.8667 107.7397 43.8294 0.0000 173.8625 143 N 4.3279 8.6788 118.4326 54.6719 38.8981 174.5777 144 T 4.5991 9.2778 114.1099 60.7307 69.6993 174.1322 145 A 4.6278 7.9367 126.2254 50.3611 20.3088 176.5224 146 S 4.2560 8.9676 118.5725 61.4209 63.0779 174.7779 147 S 4.5883 7.9884 116.7579 57.3499 64.4860 175.2712 148 G 3.8377 9.3699 112.3599 45.2153 0.0000 173.0664 149 A 4.8169 8.3348 124.7230 50.6920 21.8397 175.2976 150 D 4.7891 9.8600 121.8559 52.3375 45.5949 172.2352 *152 P 4.4065 0.0000 0.0000 63.0382 32.2895 176.4386 153 D 4.5613 8.6715 120.3061 57.4864 41.8743 176.6308 154 E 4.6822 8.0854 116.2077 55.2726 30.7978 176.4655 155 L 3.2311 8.2835 125.1792 55.4390 43.2951 175.7093 156 Q 4.7901 8.3219 124.8935 54.6978 30.9414 174.0632 157 C 5.1966 8.7243 120.5791 55.1401 45.2950 173.1589 158 L 4.8211 8.2575 123.0600 54.1462 45.2511 174.2495 159 D 5.2819 9.1637 127.0243 54.1183 41.5421 175.7405 160 A 4.8476 9.2108 124.9115 49.7622 23.3229 172.9284 161 P 5.1504 0.0000 0.0000 60.8597 34.5541 174.7796 162 V 4.0542 8.6150 122.4306 63.0692 32.2643 175.2327 163 L 4.7223 8.4806 128.8974 53.6272 42.7745 177.3331 164 S 4.2532 8.6806 116.7745 58.6081 63.6064 175.5003 165 Q 4.0344 8.8224 121.2927 58.9268 28.4125 178.9566 166 A 4.0348 8.0302 121.4588 55.4318 18.4860 179.7947 167 K 4.0190 7.8465 116.8809 59.3519 31.9080 179.0526 168 C 4.2992 8.3250 119.0487 59.8843 37.8350 175.4057 169 E 3.9258 9.0105 120.4615 59.2965 28.7423 179.1553 170 A 3.9873 7.7819 119.9582 55.5549 18.6278 179.6190 171 S 4.1518 7.8256 111.6767 60.6152 64.3850 174.7406 172 Y 4.6933 7.7759 118.4412 54.7849 37.9629 172.5577 173 P 4.7557 0.0000 0.0000 64.2813 31.6040 177.6913 174 G 4.0252 9.1458 111.9757 45.1580 0.0000 173.2995 175 K 4.2378 8.2188 118.3861 57.5389 32.9478 176.8820 176 I 4.1931 7.8426 119.8831 60.6069 37.0404 175.7235 177 T 4.4750 8.3202 116.6582 60.0348 70.3946 175.6455 178 S 4.2497 8.5048 115.1620 60.6042 63.2982 174.5199 179 N 4.8935 8.2909 118.5018 53.5687 38.5346 173.9358 180 M 5.8028 8.1181 117.6741 53.9594 36.3714 174.1165 181 F 5.0732 9.0290 114.8298 56.4045 42.4864 171.9717 182 C 5.5969 8.8635 114.9984 54.1256 41.9311 173.5661 183 V 4.6890 9.3248 121.9520 60.1683 34.1103 173.5016 184A G 3.7842 6.8185 115.6180 44.6485 0.0000 172.9771 184 F 4.7968 8.2492 121.7467 55.6399 42.7622 175.7317 185 L 4.1760 8.7002 125.2431 57.4864 41.9032 179.2141 186 E 3.7143 8.2623 117.6390 57.4795 29.6682 177.2529 187 G 3.7809 7.3843 104.0114 44.3196 0.0000 170.7618 188A G 4.2784 8.9770 107.5395 44.8564 0.0000 174.2608 188 K 4.8434 7.1507 117.3978 54.3909 35.1129 175.2734 189 D 4.6256 8.4480 122.7000 53.6269 45.6177 175.3272 190 S 4.8682 8.8527 117.4621 58.6624 64.7960 172.9112 191 C 4.7136 9.3298 119.0449 55.1569 46.1793 172.1332 192 Q 4.2271 8.6922 120.9471 58.2423 28.4998 177.5538 193 G 4.1358 9.2028 113.5005 45.1611 0.0000 173.7817 194 D 4.5973 8.2164 118.8674 55.6809 41.5475 176.7953 195 S 4.4805 8.0252 115.7480 60.5240 63.2709 175.3649 196 G 3.9945 9.0436 112.7978 46.3715 0.0000 173.7357 197 G 4.2011 7.8929 107.5366 45.0681 0.0000 170.9278 198 P 5.0961 0.0000 0.0000 61.8317 33.7450 175.3883 199 V 4.5193 8.6114 121.6912 61.3938 34.0472 174.0724 200 V 4.8194 8.6492 128.7975 61.2577 34.1075 173.6951 201 C 5.0054 8.9849 124.9415 55.6074 43.8940 174.1449 202 N 4.3584 9.6589 121.1044 54.5199 35.4315 174.7078 203 G 3.9044 8.5540 102.9598 46.2950 0.0000 174.1199 204 Q 4.6971 7.4637 116.2179 52.4766 32.3948 174.3381 *209 L 4.1169 8.2697 122.6120 55.5356 42.0896 175.8160 210 Q 4.2868 8.6140 125.7144 57.6489 30.4012 175.9895 211 G 5.2556 8.7189 104.5283 43.5439 0.0000 171.7959 212 V 5.1021 8.3822 119.6782 60.3878 34.7790 174.7227 213 V 3.8157 8.7677 128.0045 64.4755 31.8066 174.1228 214 S 4.9359 8.2805 120.2772 58.1197 64.3606 173.5098 215 W 4.6533 7.6094 113.5243 56.3024 31.9100 172.1155 216 G 3.8562 8.3603 106.3493 46.1899 0.0000 172.5793 217 D 4.9009 9.4066 120.4567 52.4066 41.4556 176.1219 *219 G 3.8014 8.1361 111.6533 45.4566 0.0000 171.3184 220 C 4.7441 8.5109 118.0154 56.4897 42.7356 174.0260 221A A 3.7134 8.7294 124.5895 52.9164 16.5146 176.5415 221 Q 4.2389 7.6219 119.0945 56.3397 29.7447 175.6462 222 K 3.7773 8.7693 124.2238 58.4441 32.2520 176.7947 223 N 4.3142 9.4651 121.5267 53.7736 38.6130 174.6935 224 K 4.2002 7.4074 116.9424 54.6673 31.4376 173.9294 225 P 4.6491 0.0000 0.0000 61.2423 33.0535 176.8812 226 G 3.4753 8.0724 106.5052 46.1789 0.0000 172.8994 227 V 4.1418 7.7393 124.6749 61.1879 33.5358 174.2364 228 Y 4.8736 8.1080 123.7152 56.0421 42.4538 174.8744 229 T 4.5346 8.7800 120.1735 63.5736 69.7908 174.1271 230 K 4.3545 9.3638 128.2648 55.8521 31.8840 177.3255 231 V 3.9458 8.8500 127.5920 65.8063 31.3885 176.7065 232 Y 4.2047 8.2682 119.1739 61.0368 38.3182 177.7644 233 N 4.2246 7.9393 114.9524 54.9627 38.7983 175.7175 234 Y 4.7165 7.9092 117.6226 57.4996 38.8426 177.2824 235 V 3.6063 7.5242 121.5273 65.9932 31.5211 177.9664 236 K 3.8782 7.8823 118.6530 59.1870 32.1476 178.2590 237 W 4.1949 8.2958 128.1833 60.6340 30.4844 177.5512 238 I 3.0234 8.2969 119.8522 64.2912 36.5320 178.4043 239 K 3.6759 7.7466 119.8052 59.4056 31.9198 178.6733 240 N 4.2093 8.0797 116.9615 56.4324 38.2135 177.5901 241 T 3.5989 7.3407 116.4579 66.3705 68.6839 176.6186 242 I 2.4776 7.1937 121.6892 63.8349 36.7673 178.3419 243 A 3.8968 7.7246 120.3892 55.0025 18.3307 179.0573 244 A 4.2254 8.0742 117.1648 53.5767 18.4998 177.3990 245 N 5.1540 7.9673 114.5452 53.0981 40.2792 174.7764 246 S 4.5361 8.3631 119.7655 58.7911 63.3677 174.2241 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 4.28 1.80 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 1.55 0.79 0.86 0.00 0.00 17 V 8.77 3.90 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 1.04 0.00 0.00 0.96 0.00 0.00 18 G 9.08 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 0.00 0.00 0.00 19 G 7.63 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 0.00 0.00 0.00 20 Y 7.86 4.91 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 21 N 8.86 4.72 0.00 2.71 2.97 0.00 0.00 6.94 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 22 C 8.64 4.24 0.00 2.75 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 23 E 8.76 4.25 0.00 1.97 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 2.34 2.40 0.00 24 E 8.44 3.98 0.00 2.09 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 2.34 2.31 0.00 25 N 8.69 4.25 0.00 2.86 2.94 0.00 0.00 6.97 7.57 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 26 S 7.64 4.38 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.13 3.83 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 0.35 0.00 0.00 0.74 0.00 0.00 28 P 0.00 4.53 0.00 2.37 2.27 0.00 3.87 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.96 0.00 29 Y 6.78 5.05 0.00 3.22 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 30 Q 7.36 4.53 0.00 1.73 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.73 0.00 0.00 0.00 0.00 0.00 1.72 2.34 0.00 31 V 9.00 4.94 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.95 0.00 0.00 32 S 8.67 5.12 0.00 3.74 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 33 L 8.21 4.71 0.00 0.41 1.01 0.82 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.55 5.76 0.00 2.56 2.69 0.00 0.00 6.60 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *37 S 8.37 4.45 0.00 4.08 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 38 G 9.37 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 0.00 0.00 0.00 0.00 39 Y 7.97 4.85 0.00 3.14 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 40 H 8.74 4.55 0.00 2.96 3.20 0.00 5.71 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 41 F 7.65 4.49 0.00 2.90 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 0.00 0.00 0.00 0.00 42 C 6.73 4.88 0.00 2.53 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 43 G 8.43 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 7.78 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 0.00 0.00 0.00 0.00 45 S 8.68 5.39 0.00 3.79 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 46 L 9.03 4.77 0.00 1.85 1.66 1.06 0.81 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 47 I 8.52 4.59 1.89 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 1.28 0.92 0.95 0.00 0.00 48 N 7.84 4.95 0.00 2.76 2.88 0.00 0.00 6.90 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 49 E 8.99 4.04 0.00 2.22 2.27 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 2.43 2.40 0.00 50 Q 8.55 4.70 0.00 2.18 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.79 0.00 0.00 0.00 0.00 0.00 2.08 2.26 0.00 51 W 8.55 5.61 0.00 3.27 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 52 V 9.02 5.01 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 1.14 0.00 0.00 0.94 0.00 0.00 53 V 8.77 4.78 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 1.06 0.00 0.00 1.05 0.00 0.00 54 S 8.86 4.63 0.00 3.89 3.69 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 55 A 8.58 4.62 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 G 8.62 3.30 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 57 H 8.59 4.51 0.00 3.37 3.65 0.00 5.55 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 8.15 4.76 0.00 3.15 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 59 Y 7.86 4.05 0.00 3.05 2.90 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 60 K 7.34 4.42 0.00 1.54 1.61 0.00 1.23 0.00 0.00 0.61 0.00 0.00 2.69 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.05 1.23 7.81 61 S 8.36 4.18 0.00 4.00 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 62 R 7.69 4.58 0.00 1.76 1.85 0.00 3.31 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.55 0.00 63 I 8.12 4.91 1.84 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 1.40 0.81 0.86 0.00 0.00 64 Q 9.27 4.82 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.84 0.00 0.00 0.00 0.00 0.00 2.31 2.51 0.00 65 V 8.70 4.54 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 0.92 0.00 0.00 0.85 0.00 0.00 66 R 8.49 4.79 0.00 1.56 1.29 0.00 3.01 0.00 0.00 2.95 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.26 0.00 67 L 8.40 4.74 0.00 1.57 1.52 0.90 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.50 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.05 4.31 0.00 1.92 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 71 H 8.66 4.99 0.00 3.29 3.52 0.00 5.85 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.00 5.13 0.00 2.95 2.88 0.00 0.00 6.66 7.82 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 73 I 9.02 3.43 0.56 0.00 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.28 0.71 0.00 0.00 74 E 8.54 4.29 0.00 2.13 1.95 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 2.20 2.46 0.00 75 V 7.10 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 0.81 0.00 0.00 0.93 0.00 0.00 76 L 8.55 4.38 0.00 1.71 1.64 0.97 1.19 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 77 E 9.50 4.55 0.00 1.92 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 2.26 2.44 0.00 78 G 8.23 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 0.00 0.00 0.00 79 N 8.04 4.91 0.00 2.60 2.85 0.00 0.00 6.96 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 8.16 4.43 0.00 1.96 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 2.20 2.31 0.00 81 Q 8.71 4.70 0.00 1.93 1.97 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 2.28 2.30 0.00 82 F 9.18 5.02 0.00 2.82 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 83 I 8.72 4.68 1.83 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 1.24 0.82 0.92 0.00 0.00 84 N 8.83 5.03 0.00 2.63 2.71 0.00 0.00 7.02 7.09 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 85 A 8.65 4.30 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 9.26 4.22 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 87 K 7.63 4.65 0.00 1.54 1.68 0.00 1.69 0.00 0.00 1.96 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.40 7.81 88 I 8.54 4.80 2.03 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.60 1.01 0.00 0.00 89 I 9.45 4.53 2.12 0.00 0.00 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 1.39 1.17 1.17 0.00 0.00 90 R 8.60 4.66 0.00 1.62 1.79 0.00 2.53 0.00 0.00 2.44 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.60 0.00 91 H 8.58 3.61 0.00 2.77 3.08 0.00 5.58 0.00 0.00 0.00 0.00 6.70 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 4.47 0.00 2.20 2.18 0.00 2.68 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.97 0.00 93 Q 7.73 4.59 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.95 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 94 Y 8.30 4.26 0.00 2.95 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 95 D 8.33 4.42 0.00 2.48 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 R 7.94 3.78 0.00 1.70 1.91 0.00 3.30 0.00 0.00 3.32 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.67 0.00 97 K 7.91 3.96 0.00 1.85 1.73 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.27 7.81 98 T 7.77 3.84 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 99 L 7.78 3.52 0.00 1.19 1.73 0.75 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.55 4.49 0.00 2.65 2.59 0.00 0.00 7.27 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 0.00 101 N 8.68 4.97 0.00 3.05 2.75 0.00 0.00 7.24 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.05 5.04 0.00 3.11 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 0.00 103 I 7.39 4.82 1.44 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 1.35 1.27 0.24 0.00 0.00 104 M 8.79 5.36 0.00 2.11 1.84 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.66 0.00 105 L 9.74 5.40 0.00 1.88 1.92 0.06 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.00 4.84 1.86 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 1.13 0.92 0.82 0.00 0.00 107 K 8.29 3.27 0.00 0.79 0.99 0.00 1.52 0.00 0.00 1.41 0.00 0.00 2.73 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.78 0.21 7.81 108 L 8.31 4.42 0.00 1.52 1.54 0.88 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.69 4.29 0.00 3.84 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 0.00 110 S 7.34 4.69 0.00 3.99 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 0.00 111 R 8.38 4.34 0.00 1.72 1.92 0.00 3.22 0.00 0.00 3.39 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.64 0.00 112 A 9.01 4.23 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 0.00 113 V 8.52 3.86 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 0.78 0.00 0.00 0.94 0.00 0.00 114 I 8.36 4.38 1.89 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 1.49 0.96 0.98 0.00 0.00 115 N 8.78 4.76 0.00 2.90 2.91 0.00 0.00 6.46 7.04 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 0.00 116 A 8.77 4.18 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 0.00 117 R 9.16 4.37 0.00 1.93 1.95 0.00 3.17 0.00 0.00 3.12 7.36 0.00 0.00 0.00 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1.23 0.00 0.00 *127 A 7.84 3.76 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 P 0.00 3.95 0.00 1.86 1.48 0.00 3.32 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.56 0.00 129 P 0.00 3.88 0.00 1.95 1.76 0.00 3.36 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.44 0.00 130 A 8.33 4.14 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 *132 T 8.31 4.31 4.33 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 1.26 0.00 0.00 133 G 8.93 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.64 4.00 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 135 K 8.66 4.58 0.00 1.78 1.71 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.51 7.81 136 C 9.77 5.27 0.00 2.74 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 0.00 137 L 8.76 5.09 0.00 1.76 1.55 1.07 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 138 I 8.83 5.13 1.83 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 0.64 1.46 0.92 0.00 0.00 139 S 8.29 4.89 0.00 3.48 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 0.00 140 G 7.50 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.56 4.94 0.00 3.19 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 0.00 142 G 7.87 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 0.00 143 N 8.68 4.33 0.00 2.79 2.82 0.00 0.00 7.14 7.80 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 0.00 144 T 9.28 4.60 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 145 A 7.94 4.63 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 0.00 146 S 8.97 4.26 0.00 4.01 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 7.99 4.59 0.00 3.89 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 0.00 148 G 9.37 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 0.00 149 A 8.33 4.82 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 0.00 150 D 9.86 4.79 0.00 2.72 2.47 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 *152 P 0.00 4.41 0.00 2.38 2.11 0.00 4.02 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 153 D 8.67 4.56 0.00 2.65 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 0.00 154 E 8.09 4.68 0.00 1.97 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 0.00 2.28 2.33 0.00 155 L 8.28 3.23 0.00 1.30 1.27 -1.08 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 156 Q 8.32 4.79 0.00 2.02 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.47 0.00 0.00 0.00 0.00 0.00 2.22 2.41 0.00 157 C 8.72 5.20 0.00 1.65 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.26 4.82 0.00 1.71 1.45 1.06 1.51 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 0.00 159 D 9.16 5.28 0.00 2.75 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 A 9.21 4.85 1.09 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 0.00 0.00 161 P 0.00 5.15 0.00 2.00 2.08 0.00 3.09 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 162 V 8.61 4.05 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 1.12 0.00 0.00 1.03 0.00 0.00 163 L 8.48 4.72 0.00 1.72 1.58 0.90 0.69 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 0.00 164 S 8.68 4.25 0.00 4.01 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 0.00 165 Q 8.82 4.03 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.49 2.41 0.00 166 A 8.03 4.03 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 0.00 167 K 7.85 4.02 0.00 1.92 1.89 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.45 7.81 168 C 8.32 4.30 0.00 3.05 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 E 9.01 3.93 0.00 2.09 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 2.40 2.70 0.00 170 A 7.78 3.99 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 0.00 171 S 7.83 4.15 0.00 3.94 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 0.00 172 Y 7.78 4.69 0.00 3.04 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.76 0.00 2.21 2.14 0.00 3.41 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.95 0.00 174 G 9.15 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 K 8.22 4.24 0.00 2.29 2.22 0.00 2.20 0.00 0.00 2.17 0.00 0.00 2.84 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.57 7.81 176 I 7.84 4.19 1.98 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 1.83 0.98 1.04 0.00 0.00 177 T 8.32 4.48 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 8.50 4.25 0.00 4.02 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 8.29 4.89 0.00 2.93 3.11 0.00 0.00 6.59 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 0.00 180 M 8.12 5.80 0.00 1.95 2.06 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.70 0.00 181 F 9.03 5.07 0.00 3.09 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 0.00 182 C 8.86 5.60 0.00 2.87 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 0.00 183 V 9.32 4.69 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 0.83 0.00 0.00 0.51 0.00 0.00 184A G 6.82 3.78 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 0.00 0.00 0.00 184 F 8.25 4.80 0.00 3.07 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 0.00 185 L 8.70 4.18 0.00 1.75 1.74 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.26 3.71 0.00 1.98 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 2.35 2.42 0.00 187 G 7.38 3.78 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 0.00 0.00 0.00 188A G 8.98 4.28 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 0.00 188 K 7.15 4.84 0.00 1.71 1.73 0.00 1.76 0.00 0.00 1.61 0.00 0.00 2.56 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.15 0.73 7.81 189 D 8.45 4.63 0.00 2.87 2.57 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 0.00 190 S 8.85 4.87 0.00 3.98 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 9.33 4.71 0.00 2.96 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 0.00 192 Q 8.69 4.23 0.00 2.23 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.16 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 193 G 9.20 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 0.00 0.00 0.00 194 D 8.22 4.60 0.00 2.98 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 0.00 195 S 8.03 4.48 0.00 3.96 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 0.00 196 G 9.04 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 7.89 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.10 0.00 2.31 2.34 0.00 3.74 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.18 0.00 199 V 8.61 4.52 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 0.63 0.00 0.00 0.50 0.00 0.00 200 V 8.65 4.82 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 0.95 0.00 0.00 0.56 0.00 0.00 201 C 8.98 5.01 0.00 2.79 2.90 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 0.00 202 N 9.66 4.36 0.00 2.85 2.90 0.00 0.00 7.17 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 0.00 203 G 8.55 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 0.00 0.00 0.00 204 Q 7.46 4.70 0.00 2.18 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.51 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 *209 L 8.27 4.12 0.00 1.56 1.65 0.97 0.79 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 0.00 210 Q 8.61 4.29 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.55 0.00 0.00 0.00 0.00 0.00 2.41 2.27 0.00 211 G 8.72 5.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 V 8.38 5.10 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 1.08 0.00 0.00 1.02 0.00 0.00 213 V 8.77 3.82 2.37 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 0.88 0.00 0.00 1.22 0.00 0.00 214 S 8.28 4.94 0.00 3.97 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 7.61 4.65 0.00 3.40 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 0.00 216 G 8.36 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 D 9.41 4.90 0.00 2.96 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 *219 G 8.14 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.51 4.74 0.00 3.03 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 221A A 8.73 3.71 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 0.00 221 Q 7.62 4.24 0.00 2.21 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.74 0.00 0.00 0.00 0.00 0.00 2.48 2.35 0.00 222 K 8.77 3.78 0.00 1.94 2.01 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.40 7.81 223 N 9.47 4.31 0.00 2.80 2.92 0.00 0.00 7.11 7.03 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 0.00 224 K 7.41 4.20 0.00 1.75 1.77 0.00 1.67 0.00 0.00 1.53 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.93 1.17 7.81 225 P 0.00 4.65 0.00 2.19 2.10 0.00 3.93 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 226 G 8.07 3.48 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 0.00 0.00 0.00 227 V 7.74 4.14 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 0.52 0.00 0.00 -0.88 0.00 0.00 228 Y 8.11 4.87 0.00 1.89 2.59 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 0.00 229 T 8.78 4.53 4.37 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 1.24 0.00 0.00 230 K 9.36 4.35 0.00 2.04 1.90 0.00 1.79 0.00 0.00 1.49 0.00 0.00 2.67 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.44 1.01 7.81 231 V 8.85 3.95 2.47 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 1.20 0.00 0.00 1.07 0.00 0.00 232 Y 8.27 4.20 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 0.00 233 N 7.94 4.22 0.00 2.03 2.34 0.00 0.00 6.94 8.10 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 0.00 234 Y 7.91 4.72 0.00 3.24 3.35 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 0.00 235 V 7.52 3.61 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.00 0.00 0.00 236 K 7.88 3.88 0.00 1.86 1.80 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.49 1.53 7.81 237 W 8.30 4.19 0.00 3.53 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 0.00 238 I 8.30 3.02 1.98 0.00 0.00 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 1.40 1.00 0.73 0.00 0.00 239 K 7.75 3.68 0.00 1.74 1.69 0.00 1.56 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.34 7.81 240 N 8.08 4.21 0.00 2.88 2.74 0.00 0.00 6.97 6.64 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 0.00 241 T 7.34 3.60 3.44 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 0.89 0.00 0.00 242 I 7.19 2.48 1.43 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 -0.30 -0.32 0.34 0.00 0.00 243 A 7.72 3.90 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 0.00 244 A 8.07 4.23 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 0.00 245 N 7.97 5.15 0.00 3.10 3.13 0.00 0.00 6.79 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 0.00 246 S 8.36 4.54 0.00 3.86 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.