NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4055 8.2649 123.5947 52.1388 19.9771 175.6167 2 N 4.8660 8.4523 116.1154 51.1216 41.3016 172.3865 3 A 4.6895 8.2316 122.8029 50.2117 23.5143 174.8782 4 F 4.0980 8.7815 120.8234 59.3744 39.4439 170.6947 5 L 3.3142 7.8857 135.0000 54.0665 41.6340 175.2772 *8 L 4.2290 8.4481 122.2260 54.6251 43.6294 177.9545 9 R 4.0626 7.0691 117.4316 54.9888 30.4958 174.6941 10 P 4.3926 0.0000 0.0000 62.1719 32.0437 176.3687 11 G 3.7035 8.1264 108.4077 45.6267 0.0000 173.4839 12 S 4.3532 8.0059 115.3750 56.3467 65.2867 174.6801 13 L 3.8191 8.2699 127.5077 55.8445 41.0848 177.4965 *15 R 3.9434 7.9512 114.3852 55.9114 31.1603 176.5295 *17 C 4.9736 8.0985 114.4753 56.6935 42.0042 173.8893 18 K 4.3963 7.8546 118.3099 56.6920 32.0643 176.4496 *21 Q 4.3349 7.9850 118.8179 55.9759 29.9583 172.7184 22 C 5.1490 8.9347 119.0445 53.2660 43.8753 174.2762 23 S 4.7567 8.6377 118.1298 57.7223 64.0301 175.2516 24 F 3.0180 8.1206 121.5973 57.8882 36.5318 174.5776 *27 A 4.1174 8.0514 127.3864 51.6626 20.6897 180.9868 28 R 3.9889 7.3995 117.2462 55.3746 29.2034 178.6245 *30 I 3.7913 7.8933 118.2029 60.7450 38.8843 177.2055 31 F 4.2837 7.6798 116.5101 57.1410 38.8121 174.9198 32 K 4.0472 7.7675 121.3005 57.2543 31.4029 175.2199 33 D 4.3317 7.6534 116.0050 54.2749 42.0274 177.3041 34 A 3.8101 8.8351 127.7021 54.1378 18.9490 178.9215 *36 R 4.1808 7.9727 117.8838 57.3213 31.9055 178.2346 37 T 3.7585 7.9362 114.4772 66.3764 68.3486 176.9246 38 K 4.2593 8.3786 120.5529 59.6606 31.9656 178.8701 39 L 3.9383 8.0453 118.5613 58.3793 42.0436 178.5053 40 F 4.2780 7.8798 120.3470 60.9524 39.3372 177.1548 41 W 4.2522 8.8772 128.7229 60.2291 30.2324 177.7189 42 I 3.6529 7.7969 112.4601 64.2902 37.1309 178.2462 43 S 4.1033 7.7636 116.7058 61.1454 62.7280 175.5778 44 Y 3.6174 7.2044 121.3362 60.1035 38.3240 177.1763 45 S 4.0178 7.2305 110.9915 57.7807 63.6776 174.5512 46 D 4.1472 7.5505 121.8709 55.9698 41.1298 175.8927 47 G 3.7928 7.8314 107.7047 45.4301 0.0000 172.3361 48 D 4.6663 8.3211 122.3283 54.1142 40.6413 176.5914 49 Q 4.2408 8.8677 126.1277 57.6793 28.8997 176.7647 50 C 4.3594 8.6195 115.5566 57.0241 40.9504 175.3256 51 A 3.8585 7.8370 123.6698 55.3161 17.8725 178.9704 52 S 4.1646 7.9219 106.6847 58.6775 63.8593 173.8305 53 S 3.6140 8.0160 117.7536 59.2204 60.5146 172.1878 54 P 4.0334 0.0000 0.0000 65.5217 31.7131 178.0003 55 C 4.3594 7.2513 114.8574 56.7840 34.9210 173.3525 56 Q 4.3927 8.9904 124.3109 54.6575 30.3339 174.7449 57 N 4.0204 9.3697 113.1467 54.4830 35.8145 175.7370 58 G 3.8268 8.3749 102.9588 45.3815 0.0000 174.2909 59 G 3.9464 7.4482 106.2960 46.1915 0.0000 173.4776 60 S 4.9201 9.4196 116.6655 56.6413 65.5452 172.7130 61 C 5.1431 8.8268 125.1117 55.3923 39.1168 172.3226 62 K 4.6326 8.9791 127.5723 54.3129 34.1562 174.6920 63 D 4.7191 8.8886 127.7276 54.9085 42.0153 175.4182 64 Q 4.5684 8.2673 122.6192 54.4957 32.2371 174.5323 65 L 4.3806 8.4752 120.1535 55.1470 41.1403 176.5189 66 Q 3.5713 9.5269 125.8868 56.5183 26.9536 173.5809 67 S 4.4829 7.6652 110.5587 58.8267 65.2801 173.6134 68 Y 5.3775 7.4126 117.5186 56.5384 40.9266 173.8700 69 I 4.7103 8.7220 118.8457 59.8720 41.3013 174.0415 70 C 5.4904 8.9781 123.5919 55.4101 40.8683 173.1237 71 F 4.6510 9.3444 122.1490 56.1383 40.7230 174.9298 72 C 4.9668 8.7767 121.4226 55.5274 42.7199 173.4595 73 L 4.5809 8.6054 119.3884 53.7650 42.4083 176.7895 74 P 4.0837 0.0000 0.0000 65.9958 31.1235 177.1244 75 A 4.2115 7.8597 119.1114 51.9001 18.2628 176.1882 76 F 5.0066 7.9287 116.6874 57.5665 43.3201 173.1165 77 E 4.6032 8.8554 118.7326 55.8965 32.5054 175.1608 78 G 4.2325 9.0430 105.6012 44.9117 0.0000 174.6267 79 R 3.8258 8.3904 121.4403 59.0079 30.2834 177.2263 80 N 5.0177 8.6082 113.5932 52.7660 39.1460 173.9212 81 C 4.4429 8.4629 113.7600 58.1019 38.2512 174.0680 82 E 4.0263 8.2356 116.4009 57.2405 30.4613 176.0087 83 T 4.2788 8.0997 118.4889 62.9666 69.3363 173.6854 84 H 4.8459 8.7892 124.4114 54.1530 28.0811 175.7910 85 K 3.9816 7.9143 125.1071 59.3142 32.0648 178.4766 86 D 4.5203 7.8976 116.5285 56.0234 41.1190 176.1470 87 D 4.9219 8.2086 119.0064 54.6861 40.9648 176.5758 88 Q 4.6167 7.8586 116.5064 55.7440 30.1567 176.4458 89 L 4.3533 7.9602 118.3522 54.1962 41.1982 175.3741 90 I 4.6104 6.9820 114.1623 58.8244 41.2333 177.7960 91 C 4.1874 9.2028 119.7829 60.5497 40.0985 176.9011 92 V 3.4532 7.7527 110.2401 63.0220 31.5339 175.9158 93 N 4.5665 8.0834 119.8745 52.5888 37.8795 174.2440 94 E 4.1068 8.8145 128.7410 58.0225 27.2030 174.4419 95 N 4.6706 8.3091 109.6889 53.5543 37.7810 173.7283 96 G 4.0962 8.7007 100.1446 45.9207 0.0000 175.7170 97 G 3.9179 8.3688 105.8719 45.4813 0.0000 174.4856 98 C 4.5007 8.0604 117.7472 56.5946 40.9161 173.6562 99 E 4.0259 8.9661 124.9894 58.5266 30.1891 176.8318 100 Q 4.2240 7.9434 112.6615 55.8914 31.0405 176.2381 101 Y 4.9452 5.7091 119.5843 57.7571 41.0047 174.7266 102 C 5.4327 8.7486 121.2661 55.0025 45.7116 173.1685 103 S 4.7275 8.9549 121.4433 56.6185 65.5531 173.7535 104 D 4.8032 8.6866 124.5473 54.8688 41.9313 176.1793 105 H 4.7755 8.4578 117.5091 54.7137 32.1139 173.8171 106 T 3.6475 8.6993 114.3884 63.5808 68.1004 172.3700 107 G 4.0131 8.4467 122.5941 45.1833 0.0000 178.2564 108 T 4.1892 7.5883 114.0328 60.6778 69.0638 173.5963 109 K 4.8031 7.4655 118.8645 55.2695 35.0797 176.6995 110 R 4.4960 8.5739 117.9217 56.4325 30.4163 175.7445 111 S 4.9369 8.8418 115.2886 56.9715 65.9997 172.2203 112 C 5.3578 8.7250 118.6288 55.8831 40.5564 172.8047 113 R 4.8105 8.9220 119.9742 55.0899 34.8600 172.8582 114 C 4.9906 8.4877 115.8528 55.5352 39.8068 173.7235 115 H 4.6671 9.0047 120.0030 54.8939 30.3754 174.1924 116 E 3.9681 8.5029 124.7614 58.2266 29.9342 177.4374 117 G 3.9143 9.9189 111.9805 45.4136 0.0000 171.9476 118 Y 5.3024 7.5840 115.4375 56.5868 42.6208 174.5471 119 S 4.8205 8.8258 115.6689 56.5823 67.7388 173.2583 120 L 4.6134 8.4805 124.8059 54.7665 42.8608 177.0438 121 L 4.3206 8.6705 126.7788 53.9589 42.7973 177.6263 122 A 4.0688 8.4302 121.7401 55.4134 18.2803 178.5553 123 D 4.3816 8.1125 113.6281 54.0781 39.6367 176.9735 124 G 4.0059 8.1268 107.3868 46.4672 0.0000 174.6781 125 V 4.5153 8.8112 111.2972 60.3659 35.5637 175.2639 126 S 5.2245 8.3781 116.0503 57.0001 66.0829 173.6033 127 C 6.0192 9.2568 118.0468 54.5466 39.8524 173.7712 128 T 4.9352 8.4188 116.2355 59.3561 70.6257 171.2053 129 P 4.2831 0.0000 0.0000 62.7956 31.9830 176.0916 130 T 4.5847 8.5183 112.5606 61.4134 69.6156 173.6448 131 V 4.4455 7.1981 113.7333 60.0134 35.9535 174.6643 132 E 3.7891 8.6319 121.4738 58.8419 29.8708 176.5065 133 Y 4.7551 7.2793 114.3877 55.2446 38.1713 173.1821 134 P 4.3356 0.0000 0.0000 62.0189 32.3491 177.1685 135 C 4.2180 8.5065 114.6732 59.5068 30.0675 174.4070 136 G 4.2166 8.8500 107.8258 45.8774 0.0000 173.4620 137 K 4.5563 7.5839 117.8010 54.3213 35.1213 176.1578 138 I 4.3047 8.0753 123.7784 59.0507 37.6008 174.4617 139 P 4.2789 0.0000 0.0000 65.7735 31.2267 178.8255 140 I 4.1193 7.7968 105.7689 61.7884 37.0796 176.0627 141 L 4.7330 7.8856 119.3550 54.5626 43.8245 176.4018 142 E 4.1790 7.9208 122.1406 56.5206 29.4041 176.3110 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 A 8.26 4.41 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 2 N 8.45 4.87 0.00 2.79 2.72 0.00 0.00 6.60 6.46 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 3 A 8.23 4.69 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 4 F 8.78 4.10 0.00 2.95 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 L 7.89 3.31 0.00 1.53 1.39 0.67 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 *8 L 8.45 4.23 0.00 1.70 1.71 0.80 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 9 R 7.07 4.06 0.00 1.79 1.82 0.00 3.14 0.00 0.00 3.19 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 10 P 0.00 4.39 0.00 1.98 1.95 0.00 3.63 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 1.99 2.04 0.00 11 G 8.13 3.70 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 0.00 0.00 0.00 12 S 8.01 4.35 0.00 3.71 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.27 3.82 0.00 1.36 1.43 0.64 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 *15 R 7.95 3.94 0.00 1.82 1.92 0.00 3.31 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 *17 C 8.10 4.97 0.00 3.18 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 18 K 7.85 4.40 0.00 1.94 1.88 0.00 1.83 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.50 7.81 *21 Q 7.98 4.33 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.67 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 22 C 8.93 5.15 0.00 3.19 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.64 4.76 0.00 4.12 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 24 F 8.12 3.02 0.00 1.93 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 *27 A 8.05 4.12 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 28 R 7.40 3.99 0.00 1.24 1.67 0.00 3.33 0.00 0.00 3.29 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.67 0.00 *30 I 7.89 3.79 1.36 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 1.14 0.41 0.05 0.00 0.00 31 F 7.68 4.28 0.00 2.96 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 32 K 7.77 4.05 0.00 1.91 1.85 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.30 7.81 33 D 7.65 4.33 0.00 2.77 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 34 A 8.84 3.81 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 *36 R 7.97 4.18 0.00 2.11 1.98 0.00 3.19 0.00 0.00 3.43 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 37 T 7.94 3.76 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 0.64 0.00 0.00 38 K 8.38 4.26 0.00 1.88 1.97 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.62 1.76 7.81 39 L 8.05 3.94 0.00 1.61 1.84 0.93 0.68 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 40 F 7.88 4.28 0.00 2.37 2.85 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 41 W 8.88 4.25 0.00 3.85 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 42 I 7.80 3.65 1.86 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.83 0.95 0.00 0.00 43 S 7.76 4.10 0.00 3.76 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 44 Y 7.20 3.62 0.00 1.74 2.28 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 45 S 7.23 4.02 0.00 3.33 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 7.55 4.15 0.00 2.79 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 47 G 7.83 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 0.00 0.00 0.00 48 D 8.32 4.67 0.00 2.71 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 49 Q 8.87 4.24 0.00 2.46 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.61 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 50 C 8.62 4.36 0.00 3.36 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 51 A 7.84 3.86 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 52 S 7.92 4.16 0.00 3.89 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 S 8.02 3.61 0.00 3.96 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 54 P 0.00 4.03 0.00 1.66 1.77 0.00 3.48 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.70 0.00 55 C 7.25 4.36 0.00 3.02 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 56 Q 8.99 4.39 0.00 2.23 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 6.27 0.00 0.00 0.00 0.00 0.00 2.24 2.46 0.00 57 N 9.37 4.02 0.00 1.79 1.42 0.00 0.00 7.02 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 58 G 8.37 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 G 7.45 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 60 S 9.42 4.92 0.00 3.74 3.70 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 61 C 8.83 5.14 0.00 2.93 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.98 4.63 0.00 1.97 1.85 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.54 7.81 63 D 8.89 4.72 0.00 2.87 2.56 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 0.00 0.00 0.00 64 Q 8.27 4.57 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.70 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 65 L 8.48 4.38 0.00 1.61 1.62 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 9.53 3.57 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.78 0.00 0.00 0.00 0.00 0.00 2.63 2.40 0.00 67 S 7.67 4.48 0.00 3.76 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 68 Y 7.41 5.38 0.00 2.99 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 69 I 8.72 4.71 2.04 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.73 0.71 0.00 0.00 70 C 8.98 5.49 0.00 3.00 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 71 F 9.34 4.65 0.00 2.98 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 C 8.78 4.97 0.00 2.95 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 73 L 8.61 4.58 0.00 2.08 1.75 1.05 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.08 0.00 2.03 2.13 0.00 3.73 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.17 0.00 75 A 7.86 4.21 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 F 7.93 5.01 0.00 3.00 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 77 E 8.86 4.60 0.00 2.06 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 2.17 2.22 0.00 78 G 9.04 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 0.00 0.00 0.00 0.00 79 R 8.39 3.83 0.00 1.77 2.04 0.00 3.21 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 80 N 8.61 5.02 0.00 2.99 2.97 0.00 0.00 7.12 7.05 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 81 C 8.46 4.44 0.00 3.18 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.24 4.03 0.00 2.09 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 0.00 2.26 2.29 0.00 83 T 8.10 4.28 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 84 H 8.79 4.85 0.00 3.30 3.32 0.00 5.64 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 7.91 3.98 0.00 1.60 1.83 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.62 1.45 7.81 86 D 7.90 4.52 0.00 2.64 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 87 D 8.21 4.92 0.00 2.77 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 7.86 4.62 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.62 0.00 0.00 0.00 0.00 0.00 2.50 2.24 0.00 89 L 7.96 4.35 0.00 1.58 1.61 0.92 1.03 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 90 I 6.98 4.61 1.87 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 1.41 0.88 0.91 0.00 0.00 91 C 9.20 4.19 0.00 3.20 3.19 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 92 V 7.75 3.45 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 0.66 0.00 0.00 0.93 0.00 0.00 93 N 8.08 4.57 0.00 2.81 2.95 0.00 0.00 7.07 7.77 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 94 E 8.81 4.11 0.00 2.18 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 2.30 2.21 0.00 95 N 8.31 4.67 0.00 2.92 2.80 0.00 0.00 7.65 7.91 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 96 G 8.70 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 97 G 8.37 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 C 8.06 4.50 0.00 3.07 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 99 E 8.97 4.03 0.00 1.95 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 2.20 2.21 0.00 100 Q 7.94 4.22 0.00 1.72 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.65 0.00 0.00 0.00 0.00 0.00 1.90 2.03 0.00 101 Y 5.71 4.95 0.00 2.89 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 0.00 102 C 8.75 5.43 0.00 3.04 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 S 8.95 4.73 0.00 3.74 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.69 4.80 0.00 2.51 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 0.00 105 H 8.46 4.78 0.00 3.13 3.17 0.00 5.73 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 T 8.70 3.65 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 1.22 0.00 0.00 107 G 8.45 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 T 7.59 4.19 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 1.20 0.00 0.00 109 K 7.47 4.80 0.00 1.82 1.83 0.00 1.61 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.37 7.81 110 R 8.57 4.50 0.00 1.95 1.99 0.00 3.05 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 111 S 8.84 4.94 0.00 3.96 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 0.00 112 C 8.72 5.36 0.00 3.00 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 0.00 113 R 8.92 4.81 0.00 1.87 1.94 0.00 3.14 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 114 C 8.49 4.99 0.00 2.78 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 0.00 115 H 9.00 4.67 0.00 2.78 3.01 0.00 5.61 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.50 3.97 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 117 G 9.92 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 Y 7.58 5.30 0.00 2.75 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 0.00 119 S 8.83 4.82 0.00 3.77 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 0.00 120 L 8.48 4.61 0.00 1.65 1.59 0.96 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 121 L 8.67 4.32 0.00 1.76 1.62 0.93 0.78 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 0.00 122 A 8.43 4.07 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 0.00 123 D 8.11 4.38 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 0.00 124 G 8.13 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 V 8.81 4.52 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.02 0.00 0.00 126 S 8.38 5.22 0.00 3.80 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 C 9.26 6.02 0.00 2.60 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 0.00 128 T 8.42 4.94 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 1.23 0.00 0.00 129 P 0.00 4.28 0.00 1.81 1.60 0.00 3.67 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.04 0.00 130 T 8.52 4.58 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 131 V 7.20 4.45 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 0.64 0.00 0.00 0.81 0.00 0.00 132 E 8.63 3.79 0.00 1.73 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 1.47 1.60 0.00 133 Y 7.28 4.76 0.00 2.97 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 4.34 0.00 1.52 1.43 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.65 0.00 135 C 8.51 4.22 0.00 3.15 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 0.00 136 G 8.85 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 0.00 0.00 0.00 0.00 137 K 7.58 4.56 0.00 1.75 1.74 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.16 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.60 7.81 138 I 8.08 4.30 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 1.44 1.00 0.93 0.00 0.00 139 P 0.00 4.28 0.00 2.27 2.36 0.00 3.65 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 140 I 7.80 4.12 1.88 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 1.43 0.54 0.93 0.00 0.00 141 L 7.89 4.73 0.00 1.75 1.70 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 142 E 7.92 4.18 0.00 1.97 1.86 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 2.56 2.42 0.00 * Residues marked with a * may have inaccurate shift predictions.