NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 L 4.3831 8.1849 122.7360 54.8111 43.3298 175.6656 4 K 4.2909 8.6281 124.9708 53.8364 35.7307 173.5012 5 K 5.3288 8.9120 123.7348 54.6627 35.9376 174.4120 6 A 5.5243 9.7777 126.5943 50.3305 21.8268 174.8392 7 L 5.1285 9.3083 123.6596 53.3033 44.1247 175.7237 8 F 5.0026 9.6827 124.0787 55.8908 40.4891 175.1199 9 L 4.9955 9.2963 128.6647 54.3099 42.2182 175.8910 10 I 4.6247 8.2677 120.2058 59.0714 39.9857 175.0076 11 L 4.5492 8.1604 123.8846 52.1288 44.6009 175.4637 12 D 4.3640 8.2848 118.8539 55.8667 42.0664 175.5270 13 Q 3.4475 9.0804 122.4010 57.0312 26.6013 173.1400 14 Y 4.8048 7.1187 115.1344 55.5491 40.2356 174.9876 15 A 3.6370 8.3779 125.1351 51.7272 18.3313 178.2614 16 D 4.4521 8.5195 123.9073 57.5383 41.0131 179.0713 17 W 4.3447 7.8104 113.2592 58.2572 29.1682 177.2691 18 E 4.0133 7.3039 118.7150 58.9307 29.0724 178.5182 19 G 4.3827 7.8439 104.8729 45.4726 0.0000 175.4273 20 V 3.4742 7.6660 115.6115 64.2751 31.4779 177.9568 21 Y 4.1992 7.6897 116.1636 60.6545 37.8376 177.6792 22 L 3.8290 7.9823 120.7087 57.9230 42.2861 178.5653 23 A 3.7773 8.2250 121.1182 55.1284 18.3418 179.8273 24 S 3.9628 7.8151 112.2866 61.3754 62.9214 176.3498 25 A 3.9524 7.5555 123.2989 54.9141 18.2961 179.3958 26 L 3.9267 7.7778 117.3254 58.0027 41.5581 179.1870 27 N 4.3174 8.1940 116.1842 56.9808 38.8782 176.5858 28 Q 4.1597 7.8621 117.7137 57.3257 28.9075 177.0058 29 R 4.2697 7.8804 120.1502 55.8611 30.8318 177.4108 30 E 4.0722 8.8148 122.3090 58.8869 30.1285 177.1438 31 D 4.6802 8.1201 116.1420 53.1401 40.1127 175.2481 32 W 5.4994 7.8610 118.3067 55.2857 32.9415 174.9122 33 S 4.8810 9.5838 118.9011 56.7697 66.3021 173.0178 34 V 4.9981 8.4434 123.4587 61.5928 33.2762 174.5246 35 H 5.2506 9.4020 123.9074 54.3661 33.5293 172.3559 36 T 5.2235 9.1284 111.5066 60.3016 71.6414 173.8328 37 V 5.3420 8.5063 121.7979 59.7711 35.3296 174.2068 38 S 4.7115 8.1247 115.9126 58.0369 65.4109 174.2438 39 L 4.1197 8.4689 119.4901 55.6572 40.7830 176.8280 40 D 5.0624 7.5439 117.8348 51.4221 43.9800 174.9205 41 P 4.4988 0.0000 0.0000 65.1380 32.7348 175.8875 42 I 5.1266 7.2752 118.8623 60.0018 40.8026 174.9841 43 V 4.7112 8.6556 120.1431 59.6338 35.4997 174.9962 44 S 5.3078 8.9820 120.1263 57.3759 65.0139 174.1754 45 S 3.6903 8.7594 118.8443 56.8383 64.3442 175.3789 46 I 3.6820 8.2355 122.1857 64.3817 36.8840 178.1631 47 G 3.7902 8.3261 107.6422 46.1423 0.0000 174.3588 48 G 4.0876 8.1411 107.9738 44.9365 0.0000 173.6337 49 F 4.4718 8.5630 118.9491 56.6605 40.7504 174.7648 50 K 5.0323 8.5566 121.2658 55.1546 34.1765 175.5373 51 T 4.5282 9.1536 122.8092 61.9975 70.7388 174.0972 52 S 4.4513 8.6395 121.8062 56.9474 62.4122 173.6066 53 V 3.6306 8.2295 128.0724 63.3589 31.4831 175.8414 54 D 4.2777 8.6065 128.1020 57.0829 41.2937 176.3420 55 Y 4.8830 7.9934 115.7825 56.1194 41.3737 174.9108 56 I 4.6618 8.2603 123.9815 59.8863 39.4195 175.2142 57 I 3.6940 8.1214 127.5807 63.0369 36.8740 176.3310 58 G 4.0751 9.7395 115.1945 45.5188 0.0000 173.9956 59 L 4.6908 8.0784 117.7256 53.9646 43.1875 176.3097 60 E 3.6016 7.6937 117.0190 53.6918 30.9770 174.3335 61 P 4.1611 0.0000 0.0000 62.6884 31.7467 176.2900 62 A 4.2637 8.8077 124.7162 54.5825 18.5509 177.6628 63 N 4.9762 7.9917 111.3012 50.9904 40.0391 173.3185 64 F 5.0230 7.6728 115.0746 55.8170 41.2186 173.4341 65 N 4.7666 8.9984 117.0018 54.2742 39.5595 175.8535 66 L 4.8754 8.2547 120.2486 53.4520 46.1672 174.0149 67 L 5.2511 8.7961 128.1086 53.7436 44.4428 175.3686 68 V 5.0038 8.3525 127.3488 60.0842 34.7469 173.7453 *70 I 4.0969 8.1743 120.2232 60.6826 39.0669 175.8234 71 G 3.9509 8.6973 114.5173 45.8834 0.0000 172.6404 72 G 4.5021 8.1173 106.2567 45.6030 0.0000 172.3417 73 D 4.9589 8.2356 120.4433 54.4142 40.6770 177.3349 74 S 4.7318 7.8581 113.1023 58.2455 63.4745 174.9641 75 W 4.4368 8.3176 119.4885 58.2006 29.4354 177.5471 76 S 4.6516 7.9250 116.5020 57.0976 60.7440 171.8523 77 N 5.0027 8.1418 118.5262 51.8689 41.2206 173.6479 78 D 4.6199 8.7700 124.1587 54.2450 41.7076 176.1482 79 N 4.1984 8.2521 118.8128 54.1832 39.6637 175.2301 80 K 4.1508 8.7764 128.2082 59.7991 32.7861 179.3288 81 K 4.0325 8.0263 119.4499 59.1660 32.1071 178.6403 82 L 4.0577 7.9966 120.0893 58.1842 42.0638 178.4701 83 L 4.3115 8.1425 120.1289 58.6183 41.9791 178.2486 84 H 4.1557 8.4851 118.0504 59.3221 29.6547 176.5533 85 F 4.3554 8.5971 122.4559 61.7021 39.2154 177.5817 86 V 3.3549 8.0614 111.5494 64.3482 31.4841 178.4437 87 K 3.9705 8.6234 119.7433 60.0229 31.8828 178.8711 88 T 4.1358 8.5360 117.3955 65.9386 68.3934 176.4668 89 A 3.7767 7.6022 122.7523 55.0669 18.2407 179.7410 90 F 3.8027 8.1901 116.1952 60.7144 38.7391 177.8546 91 Q 4.0450 8.2037 117.6598 58.9536 28.3936 178.6221 92 K 4.1949 8.0304 116.2710 56.1892 32.2738 176.3045 93 N 4.1592 8.0071 117.3433 54.2551 37.9376 173.8010 94 I 4.0717 7.1442 108.6536 59.0402 39.2713 173.9854 95 P 4.3756 0.0000 0.0000 63.6134 32.3706 175.1879 96 I 4.9654 8.8756 124.0461 59.3375 41.1790 174.2237 97 A 5.1400 8.9926 127.0866 50.1087 22.0611 174.7069 98 A 4.8027 9.7658 124.5269 50.1233 22.6419 174.7711 99 I 4.6539 7.4595 120.0915 58.8753 42.1879 175.6723 100 C 4.0740 8.3403 126.9444 58.9743 32.1771 176.4898 101 G 3.9233 8.9250 104.3071 47.6977 0.0000 174.5746 102 A 2.0000 7.2950 121.6164 54.4410 18.0304 180.1396 103 V 3.5101 7.4019 116.8903 64.9008 31.2862 178.3002 104 D 4.3057 7.9608 119.3445 57.0932 40.5557 178.5447 105 F 4.0498 7.8966 120.6542 61.1792 39.4461 176.9612 106 L 3.8116 7.6991 118.2368 57.6491 41.2957 179.3137 107 A 3.6346 7.6374 120.8867 55.0467 17.8917 179.7274 108 K 3.4014 7.4173 116.3840 58.3702 32.0497 177.5510 109 N 4.8887 7.2264 115.3380 52.3304 39.5547 174.9828 110 G 4.2763 7.2577 106.3748 46.3653 0.0000 175.1002 111 L 3.9423 7.7952 117.2954 54.5911 41.6735 177.3534 112 L 4.6163 7.3959 117.9475 54.4941 42.5931 177.5546 113 N 4.3953 7.9294 116.9803 55.1610 38.7063 175.7636 114 N 4.9377 7.7191 114.5560 52.7734 39.9188 173.6418 115 H 5.1328 7.9873 113.5975 54.0571 32.8620 173.4388 116 S 4.6529 9.8287 119.7478 59.3788 63.7960 172.9151 117 H 4.6158 8.1601 116.0654 56.0872 31.4905 171.5213 118 T 3.3689 8.4547 112.9781 61.4196 70.8222 171.9074 119 G 4.3289 7.6521 109.0357 45.8020 0.0000 172.4174 120 N 3.9722 8.5172 115.7937 55.3420 39.0544 175.2321 121 F 4.6425 7.2560 118.0900 54.8682 42.4409 175.9310 122 V 2.0000 7.2753 126.8515 64.1814 30.7607 177.7837 123 Y 3.6448 7.5111 116.6859 60.4187 37.4026 177.9088 124 L 4.0065 7.2753 119.7368 56.6778 42.4767 177.7307 125 W 3.0953 7.4036 117.8765 55.6613 29.2225 177.6316 126 K 3.9503 7.1419 119.1053 59.5772 31.7763 177.2291 127 D 4.8567 7.8432 115.7079 53.8682 41.6334 175.4790 128 Y 4.5208 8.4601 120.1265 57.7351 37.6779 177.1502 129 K 4.1333 8.8610 125.2305 59.2149 33.1701 177.6323 130 Q 4.3747 8.0735 117.1470 55.9035 29.1670 174.5385 131 Y 4.8591 7.6505 120.9795 56.0622 37.4532 174.3655 132 K 4.3858 8.6635 124.6313 52.9077 32.6434 174.3720 133 P 4.5136 0.0000 0.0000 62.4324 32.4506 177.4711 134 I 4.0195 8.2035 113.9343 62.2409 38.4502 176.3182 135 S 4.7022 7.7292 116.4406 56.3378 64.2641 173.9803 136 S 4.3977 8.4238 119.4312 57.5935 62.9729 173.1777 137 F 4.1833 8.7530 126.8025 58.0074 39.6782 174.4669 138 V 4.2327 8.0763 128.4496 61.3684 32.7429 176.4256 139 E 4.4409 8.4782 128.0103 54.8592 27.8995 175.2377 140 K 4.7039 7.3680 119.8580 54.3750 37.2828 176.7105 141 Q 4.1220 8.8377 118.8077 58.9198 28.7424 176.7803 142 A 5.1432 7.4800 115.7003 50.5608 22.5303 175.4252 143 V 4.5083 8.9616 118.9396 61.1346 35.5227 174.1904 144 R 5.0157 8.5821 125.8956 54.6693 33.3420 174.4776 145 D 4.5216 8.9229 125.1854 53.4075 43.9262 176.1290 146 K 3.8132 8.2184 129.3125 58.1309 31.0590 176.3140 147 N 4.8426 8.8046 123.6632 53.9311 38.8711 173.2269 148 L 5.0934 7.9245 120.1629 53.3296 45.4236 174.9785 149 V 5.0172 8.8340 126.7787 61.3005 34.0326 174.4272 150 T 5.8449 8.8735 116.9275 59.4328 72.5427 172.4163 151 A 4.9018 8.0156 121.3128 51.3823 22.7163 175.3905 152 N 4.8704 8.4454 117.6803 51.4693 39.2770 176.6639 153 G 4.1770 8.8318 108.3246 47.7636 0.0000 174.2392 154 T 4.4359 8.7144 109.1668 61.4346 69.6202 174.9415 155 A 5.4340 7.9611 124.8093 49.9721 19.4791 176.7050 156 P 4.4623 0.0000 0.0000 66.8732 31.4955 177.9423 157 I 3.7007 7.8070 119.2142 63.9487 37.2539 178.1089 158 E 3.9771 8.1855 118.9629 59.2478 29.4767 178.8291 159 F 4.3048 8.7566 121.0780 61.9135 39.4463 177.3541 160 T 3.6555 8.3689 115.5079 66.3750 68.2372 176.0413 161 N 4.2160 8.4217 119.2680 56.9445 38.8159 176.9343 162 L 4.0042 7.7007 118.6897 57.7247 41.6945 179.4614 163 I 3.6828 7.1411 118.6816 64.2936 37.2349 178.1756 164 L 4.0671 7.8618 119.7813 57.4729 41.2705 179.3513 165 E 4.3349 7.9185 116.2636 56.8185 28.9121 178.0504 *167 I 4.1437 7.4756 110.3083 59.5751 39.5683 175.2056 168 D 4.4152 8.1402 119.0109 55.8902 38.6789 173.9992 169 F 4.3226 8.7975 122.3231 61.2490 40.0429 173.6141 170 D 4.4078 7.4790 116.6097 53.5081 43.9870 174.4222 171 T 4.1446 9.4366 111.2042 60.7870 69.4445 173.6984 172 P 4.2840 0.0000 0.0000 65.8973 31.8340 177.2363 173 E 4.5994 7.8853 116.9831 55.5025 29.7385 175.4765 174 N 5.0860 7.8059 117.4158 55.1798 45.7800 176.1547 175 I 3.9031 7.8920 118.1634 64.2188 37.4760 176.9790 176 E 4.1598 8.5434 120.8461 59.3104 29.7085 178.2847 177 K 4.2816 7.2274 117.5927 56.8364 29.3312 176.0652 *180 Y 4.5555 7.6688 120.1240 57.4727 40.6702 176.2665 *182 N 4.4430 8.2775 116.3811 52.7311 40.4503 175.9458 183 R 3.7322 7.7295 116.1787 58.6270 30.2785 176.4545 184 Y 4.4231 7.9402 113.2723 57.4597 39.1534 177.0105 185 G 4.1363 8.1572 104.3514 45.2935 0.0000 173.9194 186 F 4.1003 8.9559 120.3685 61.7971 38.9750 177.0108 187 Y 3.9447 7.8224 115.3753 61.4928 37.8481 178.3119 188 H 4.4893 8.3595 116.6974 58.5950 29.0315 177.4518 189 F 4.5116 8.6887 122.6244 61.8965 39.3404 176.8015 190 C 4.2524 8.7136 118.4087 62.4119 27.5532 175.9385 191 D 4.3292 7.5949 119.7935 57.1905 40.6229 178.0105 192 K 3.8570 7.6564 117.2572 57.6554 32.2393 176.6445 193 Y 4.4701 7.4645 111.8832 57.4694 42.7140 175.9447 194 G 4.1439 8.4719 113.6268 45.9980 0.0000 173.3283 195 N 4.5632 8.0072 122.0329 52.7818 39.0044 173.7098 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 3 L 8.18 4.38 0.00 1.62 1.59 0.95 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.63 4.29 0.00 0.79 0.74 0.00 1.12 0.00 0.00 1.36 0.00 0.00 2.13 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.91 0.94 7.81 5 K 8.91 5.33 0.00 1.88 1.91 0.00 1.70 0.00 0.00 2.00 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.48 7.81 6 A 9.78 5.52 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 7 L 9.31 5.13 0.00 1.25 1.52 0.75 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 8 F 9.68 5.00 0.00 2.84 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 9 L 9.30 5.00 0.00 1.85 1.93 1.01 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.27 4.62 1.30 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.69 0.53 0.00 0.00 11 L 8.16 4.55 0.00 1.14 1.26 -0.67 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.28 4.36 0.00 2.58 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 9.08 3.45 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.64 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 14 Y 7.12 4.80 0.00 3.28 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 15 A 8.38 3.64 0.16 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 0.00 0.00 16 D 8.52 4.45 0.00 2.87 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 17 W 7.81 4.34 0.00 3.42 3.36 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 18 E 7.30 4.01 0.00 1.83 1.79 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 1.94 1.47 0.00 19 G 7.84 4.38 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 0.00 20 V 7.67 3.47 1.77 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 1.00 0.00 0.00 0.49 0.00 0.00 21 Y 7.69 4.20 0.00 3.07 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 22 L 7.98 3.83 0.00 1.73 1.80 0.59 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.22 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 S 7.82 3.96 0.00 4.01 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 25 A 7.56 3.95 1.10 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 26 L 7.78 3.93 0.00 1.62 1.56 0.55 -0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.19 4.32 0.00 2.72 2.83 0.00 0.00 7.40 7.75 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 28 Q 7.86 4.16 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.65 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 29 R 7.88 4.27 0.00 2.44 2.34 0.00 3.54 0.00 0.00 3.14 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.08 0.00 30 E 8.81 4.07 0.00 1.94 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 2.30 2.37 0.00 31 D 8.12 4.68 0.00 2.72 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 32 W 7.86 5.50 0.00 3.46 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 S 9.58 4.88 0.00 3.86 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 34 V 8.44 5.00 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 0.33 0.00 0.00 0.96 0.00 0.00 35 H 9.40 5.25 0.00 3.34 3.14 0.00 5.84 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 9.13 5.22 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 37 V 8.51 5.34 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 0.66 0.00 0.00 0.58 0.00 0.00 38 S 8.12 4.71 0.00 3.85 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 39 L 8.47 4.12 0.00 1.58 1.64 0.82 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 40 D 7.54 5.06 0.00 2.63 2.49 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 0.00 41 P 0.00 4.50 0.00 2.08 2.27 0.00 3.63 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 2.05 1.97 0.00 42 I 7.28 5.13 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 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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 1.18 0.00 0.00 52 S 8.64 4.45 0.00 3.86 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.23 3.63 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 0.82 0.00 0.00 0.94 0.00 0.00 54 D 8.61 4.28 0.00 2.38 1.85 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 55 Y 7.99 4.88 0.00 2.74 2.62 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 56 I 8.26 4.66 1.85 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 0.97 0.91 0.00 0.00 57 I 8.12 3.69 1.76 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.41 0.83 0.00 0.00 58 G 9.74 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 8.08 4.69 0.00 1.74 1.69 0.93 0.76 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 68 V 8.35 5.00 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 0.00 0.00 0.70 0.00 0.00 0.27 0.00 0.00 *70 I 8.17 4.10 1.91 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 1.38 0.93 1.03 0.00 0.00 71 G 8.70 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.12 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.24 4.96 0.00 2.73 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 74 S 7.86 4.73 0.00 3.55 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 W 8.32 4.44 0.00 3.42 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 76 S 7.93 4.65 0.00 3.96 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 77 N 8.14 5.00 0.00 2.79 2.79 0.00 0.00 7.30 8.47 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 78 D 8.77 4.62 0.00 2.74 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 79 N 8.25 4.20 0.00 3.19 2.81 0.00 0.00 6.90 5.75 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 80 K 8.78 4.15 0.00 2.11 2.09 0.00 1.50 0.00 0.00 1.84 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.63 7.81 81 K 8.03 4.03 0.00 1.82 1.93 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.90 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.55 1.45 7.81 82 L 8.00 4.06 0.00 1.77 2.02 0.87 0.25 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 83 L 8.14 4.31 0.00 2.03 1.94 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 84 H 8.49 4.16 0.00 3.43 3.59 0.00 5.85 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.60 4.36 0.00 3.18 3.37 0.00 0.00 0.00 0.00 0.00 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2.00 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 0.00 0.00 0.00 0.00 0.00 0.00 103 V 7.40 3.51 2.08 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 1.22 0.00 0.00 1.10 0.00 0.00 104 D 7.96 4.31 0.00 3.10 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 0.00 105 F 7.90 4.05 0.00 3.27 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 0.00 106 L 7.70 3.81 0.00 1.77 1.58 1.03 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 107 A 7.64 3.63 -0.18 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 0.00 108 K 7.42 3.40 0.00 0.79 1.25 0.00 1.13 0.00 0.00 1.35 0.00 0.00 2.78 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.94 0.43 7.81 109 N 7.23 4.89 0.00 2.21 2.49 0.00 0.00 6.98 8.99 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 0.00 110 G 7.26 4.28 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 119 G 7.65 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 0.00 0.00 0.00 0.00 120 N 8.52 3.97 0.00 2.71 2.20 0.00 0.00 6.63 8.13 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 0.00 121 F 7.26 4.64 0.00 2.89 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 0.00 122 V 7.28 2.00 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 0.14 0.00 0.00 0.36 0.00 0.00 123 Y 7.51 3.64 0.00 2.96 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 0.00 124 L 7.28 4.01 0.00 1.61 1.65 1.01 1.37 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 0.00 125 W 7.40 3.10 0.00 2.74 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 K 7.14 3.95 0.00 1.81 1.92 0.00 1.66 0.00 0.00 1.95 0.00 0.00 3.07 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.48 7.81 127 D 7.84 4.86 0.00 2.77 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Y 8.46 4.52 0.00 3.23 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 0.00 129 K 8.86 4.13 0.00 1.88 1.99 0.00 1.56 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.45 7.81 130 Q 8.07 4.37 0.00 2.28 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 7.03 0.00 0.00 0.00 0.00 0.00 2.32 2.26 0.00 131 Y 7.65 4.86 0.00 3.16 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 0.00 132 K 8.66 4.39 0.00 1.64 1.61 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.24 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.32 7.81 133 P 0.00 4.51 0.00 2.46 1.86 0.00 3.25 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.43 0.00 134 I 8.20 4.02 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 1.56 0.64 0.95 0.00 0.00 135 S 7.73 4.70 0.00 4.07 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 0.00 136 S 8.42 4.40 0.00 3.87 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 0.00 137 F 8.75 4.18 0.00 3.17 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 0.00 138 V 8.08 4.23 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 0.78 0.00 0.00 0.87 0.00 0.00 139 E 8.48 4.44 0.00 2.05 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 2.55 2.49 0.00 140 K 7.37 4.70 0.00 1.63 1.64 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.43 7.81 141 Q 8.84 4.12 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.79 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 142 A 7.48 5.14 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 0.00 143 V 8.96 4.51 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 1.03 0.00 0.00 0.85 0.00 0.00 144 R 8.58 5.02 0.00 1.80 1.74 0.00 3.24 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00 145 D 8.92 4.52 0.00 2.79 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 K 8.22 3.81 0.00 2.01 0.93 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.69 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.45 7.81 147 N 8.80 4.84 0.00 2.70 2.70 0.00 0.00 6.21 6.74 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 0.00 148 L 7.92 5.09 0.00 1.57 1.41 0.95 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 149 V 8.83 5.02 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 0.95 0.00 0.00 0.85 0.00 0.00 150 T 8.87 5.84 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 151 A 8.02 4.90 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 N 8.45 4.87 0.00 2.74 3.04 0.00 0.00 7.20 6.97 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 0.00 153 G 8.83 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 T 8.71 4.44 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 1.23 0.00 0.00 155 A 7.96 5.43 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 0.00 156 P 0.00 4.46 0.00 2.60 2.72 0.00 3.95 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 157 I 7.81 3.70 1.82 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.62 0.80 0.00 0.00 158 E 8.19 3.98 0.00 2.12 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 2.43 2.45 0.00 159 F 8.76 4.30 0.00 3.08 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 0.00 160 T 8.37 3.66 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 1.16 0.00 0.00 161 N 8.42 4.22 0.00 2.79 2.98 0.00 0.00 7.24 6.53 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 0.00 162 L 7.70 4.00 0.00 1.61 1.68 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 163 I 7.14 3.68 1.63 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.04 0.59 0.00 0.00 164 L 7.86 4.07 0.00 1.75 1.72 0.70 -0.04 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 0.00 165 E 7.92 4.33 0.00 2.28 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 2.35 2.33 0.00 *167 I 7.48 4.14 2.16 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.79 0.99 0.00 0.00 168 D 8.14 4.42 0.00 2.86 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 0.00 169 F 8.80 4.32 0.00 2.92 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 0.00 170 D 7.48 4.41 0.00 2.55 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 0.00 171 T 9.44 4.14 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 1.22 0.00 0.00 172 P 0.00 4.28 0.00 2.22 2.18 0.00 3.61 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 173 E 7.89 4.60 0.00 1.97 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 2.32 2.38 0.00 174 N 7.81 5.09 0.00 2.71 2.88 0.00 0.00 7.07 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 0.00 175 I 7.89 3.90 1.93 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 1.35 0.92 0.94 0.00 0.00 176 E 8.54 4.16 0.00 2.10 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 2.49 2.41 0.00 177 K 7.23 4.28 0.00 2.10 1.81 0.00 1.74 0.00 0.00 1.40 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.84 1.32 7.81 *180 Y 7.67 4.56 0.00 3.55 3.55 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 *182 N 8.28 4.44 0.00 2.37 1.91 0.00 0.00 7.06 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 0.00 183 R 7.73 3.73 0.00 1.37 1.23 0.00 2.44 0.00 0.00 2.73 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.18 0.00 184 Y 7.94 4.42 0.00 2.66 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 0.00 185 G 8.16 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 0.00 186 F 8.96 4.10 0.00 2.93 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 0.00 187 Y 7.82 3.94 0.00 3.14 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 0.00 188 H 8.36 4.49 0.00 3.49 3.43 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 F 8.69 4.51 0.00 3.50 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 0.00 190 C 8.71 4.25 0.00 2.86 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 0.00 191 D 7.59 4.33 0.00 2.81 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 0.00 192 K 7.66 3.86 0.00 1.42 1.12 0.00 1.18 0.00 0.00 0.61 0.00 0.00 2.40 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.30 0.86 7.81 193 Y 7.46 4.47 0.00 2.33 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 0.00 194 G 8.47 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 0.00 195 N 8.01 4.56 0.00 3.16 3.33 0.00 0.00 6.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.