NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 C 4.5798 8.2033 118.3121 59.6351 29.7480 172.2786 11 Q 4.5824 8.5179 123.4660 54.8969 29.7387 173.9396 12 A 4.7840 9.6912 124.8485 50.4812 23.9217 174.2135 13 Q 5.0607 8.5920 117.4588 54.1129 31.3913 175.5823 14 V 4.5241 8.8602 123.2229 61.1992 34.6001 174.3824 15 S 5.4371 8.8146 122.5036 56.7653 66.5985 173.2709 16 R 4.6788 8.9858 122.6062 54.5640 33.3030 173.6797 17 R 5.2795 8.7538 126.1681 54.6901 32.1636 174.7169 18 I 5.0072 8.8857 118.7383 59.3282 41.7548 173.8116 19 S 5.4497 8.6870 116.2141 56.6851 66.2221 173.0074 20 F 5.2552 8.7351 114.5449 55.6671 41.8084 173.1868 21 S 5.3313 9.2103 116.2818 57.3419 64.7453 173.2334 22 A 5.2769 8.9746 124.9520 50.8765 22.5960 175.1297 23 S 5.2638 8.6862 114.7289 57.4228 66.5021 172.5603 24 H 4.7668 8.7304 115.6325 55.3531 32.2600 172.1442 25 R 4.7805 9.2671 118.7581 54.7225 32.8201 174.0697 26 L 4.2834 8.5081 126.7916 53.8686 42.8006 175.5704 27 Y 4.8666 7.9246 119.3813 56.1277 40.6551 173.3388 28 S 4.4683 9.7586 120.2994 56.7246 64.0982 175.7841 29 K 3.9901 8.6006 131.6008 58.4170 31.5225 175.7275 *30 F 4.3888 7.7091 114.8567 57.5723 38.0685 177.2840 31 L 4.9898 7.3383 118.5315 52.8403 45.2517 177.0475 32 S 4.4178 8.4424 117.4379 58.9119 64.8864 175.4053 33 D 4.5336 8.9139 128.3870 59.7807 39.3921 179.8859 34 E 4.2496 8.4078 121.6938 61.8959 29.7245 181.3038 35 E 4.1466 8.5858 118.9832 60.9759 29.7479 181.4742 36 N 4.7156 8.9229 118.8359 57.0702 38.6500 178.1664 37 L 4.1534 8.3513 126.3828 60.0915 40.8320 181.8782 38 K 4.1576 8.0389 123.9861 59.4972 31.7016 180.3578 39 L 4.1543 7.6319 120.5129 56.9509 42.2486 177.9805 40 F 4.9199 8.3360 116.0613 56.0314 40.1406 177.3222 41 G 3.8122 9.0035 110.7211 46.9862 0.0000 178.1904 42 K 4.0190 8.6409 124.8647 57.1750 31.8937 177.5882 43 C 4.1959 7.9840 114.7428 62.3352 28.0607 174.3622 44 N 4.8347 8.1395 116.6411 52.2588 38.8353 174.0434 45 N 4.1381 8.0217 116.5515 54.2899 39.2549 173.2099 46 P 4.1099 0.0000 0.0000 65.7879 31.4697 176.8609 47 N 4.4983 8.0768 111.8277 52.9434 38.7108 175.2610 48 G 3.8762 9.6231 106.3534 45.1208 0.0000 170.9939 49 H 4.7806 8.4851 112.1962 55.4662 31.8693 172.1217 50 G 4.5036 8.2778 104.2694 46.4581 0.0000 171.9096 51 H 4.8060 8.8778 115.3071 54.3892 33.6361 173.6459 52 N 4.8809 8.5285 119.5979 52.3817 38.0882 174.1320 53 Y 4.1995 8.4658 122.1373 57.5822 39.4705 174.9301 54 K 5.1141 8.8818 122.3719 54.5988 35.5565 175.2622 55 V 5.0426 9.1810 124.1513 61.1637 34.7423 174.1133 56 V 4.8302 9.1927 128.4328 61.3636 33.6446 174.1803 57 V 4.7490 8.7703 128.8815 61.6831 33.4887 174.3597 58 T 5.1702 9.0556 124.9535 61.9897 71.1142 173.9099 59 V 5.0293 8.9766 119.7798 59.9818 35.1615 174.2509 60 H 5.6900 9.2735 117.1685 52.9099 32.2269 173.2303 61 G 3.9189 7.9814 105.8633 45.3743 0.0000 170.9167 62 E 4.6125 7.8480 118.6525 56.0197 30.7782 176.8310 63 I 4.1937 8.1572 125.5766 61.0362 37.8384 175.4354 64 D 4.5104 9.0847 128.9240 53.5820 41.3815 175.3763 65 P 3.7952 0.0000 0.0000 64.9418 31.6730 177.3291 66 A 4.2418 8.0527 121.9232 54.1927 18.8732 178.1867 67 T 4.2770 7.8270 102.8264 60.7393 70.1183 175.5045 68 G 3.9233 9.0524 110.8341 46.0603 0.0000 173.1194 69 M 4.8077 7.3926 118.4300 53.0676 34.9773 177.2349 70 V 3.7808 8.6532 120.9193 65.2826 32.0885 176.1048 71 M 4.7357 7.4811 113.4286 52.3610 33.8268 174.1960 72 N 4.3566 8.8892 121.0037 54.8456 40.0798 176.4140 73 L 4.0034 8.5512 131.0261 59.4710 41.2594 175.4788 74 A 4.1506 8.1574 121.5397 55.3558 18.0657 179.4239 75 D 3.8266 7.9662 117.0962 57.3256 40.9141 178.7557 76 L 4.1859 7.7459 120.7691 57.9227 41.9909 179.0379 77 K 3.9201 8.3842 120.1265 59.3011 32.2273 178.5301 78 K 3.7828 8.0456 120.1558 59.9595 31.9300 178.2747 79 Y 4.3138 7.8678 116.8636 61.4251 37.7634 178.3643 80 M 4.1038 8.3558 119.7611 58.1081 31.9917 178.3242 81 E 3.9746 8.7686 122.4991 60.1363 29.6095 179.5190 82 E 4.2466 8.4215 118.0424 60.1195 29.9198 180.0034 83 A 4.4579 8.1074 119.6629 53.3941 19.2305 177.0566 84 I 4.2391 7.6365 115.6443 63.3430 39.9045 177.8006 85 M 3.9537 7.9842 118.7688 58.7813 31.9740 178.7500 86 Q 4.0106 8.4213 118.0012 58.5509 28.9723 177.6920 87 P 4.4149 0.0000 0.0000 64.4259 31.8691 176.7355 88 L 4.3761 7.4917 117.2411 54.8825 43.3921 176.4347 89 D 4.5844 8.1411 118.7845 55.3643 41.8359 175.5161 90 H 4.1209 9.1033 123.5141 57.3061 27.0814 174.4894 91 K 4.6428 7.6590 115.8866 54.4832 36.2025 175.4226 92 N 5.2417 9.5322 119.7279 51.4225 39.3343 175.8718 93 L 3.9373 9.0040 127.4762 58.1209 41.8129 179.5992 94 D 4.5771 7.8581 116.2070 56.4013 41.0061 177.0934 95 M 4.5419 8.2138 116.5983 55.5360 33.8051 176.2709 96 D 4.5875 8.7003 117.1158 54.2420 42.3444 176.3332 97 V 4.2268 7.4220 119.5691 60.2905 31.7255 173.9236 98 P 4.2529 0.0000 0.0000 65.8791 31.4752 178.0752 99 Y 3.9086 8.1764 117.4545 60.6735 38.4459 176.7588 100 F 4.5873 8.0584 115.2979 57.2961 39.1465 176.4725 101 A 4.1918 8.2129 126.5923 54.8830 18.1537 179.0269 102 D 4.8642 7.8447 111.9466 53.6301 41.9115 175.5515 103 V 4.2691 7.2549 118.0682 60.4286 34.1598 175.3957 104 V 3.6225 8.3675 127.1246 63.1203 32.0545 176.0167 105 S 4.3437 8.3248 123.6325 58.4021 63.3722 174.8689 106 T 4.1677 7.6164 110.9003 62.9281 70.9069 174.1236 107 T 3.9702 8.4927 118.4964 66.7296 68.4621 176.4867 108 E 3.9725 8.3194 120.1246 59.9073 29.5538 179.2085 109 N 4.5446 8.2153 115.5501 55.8829 38.5667 177.8509 110 V 3.8684 8.0734 120.0220 65.9263 31.5353 177.8918 111 A 4.1128 8.2909 120.7007 55.1319 18.1273 179.8667 112 V 3.0719 7.7144 116.7655 66.0545 31.5527 177.4243 113 Y 3.7296 8.1347 119.3328 60.8172 38.5099 178.4118 114 I 3.5132 8.1060 120.5267 63.9535 37.2601 177.9399 115 W 4.1423 8.5240 129.5214 60.9175 30.2921 177.7555 116 D 4.4584 8.3407 117.4127 57.4781 40.6768 178.2083 117 N 4.2138 7.9464 117.0345 56.1464 38.3818 177.3733 118 L 3.9806 7.6237 120.2958 57.3400 41.5639 179.0975 119 Q 3.8276 7.5948 116.6665 57.8851 28.6296 178.2533 120 K 4.0600 7.3562 118.4743 58.5192 32.1022 178.0529 121 V 4.0475 7.2407 110.4959 62.2543 33.2908 176.5787 122 L 3.7212 7.2661 118.6639 53.2184 42.1366 175.0958 123 P 4.3384 0.0000 0.0000 61.9595 32.1794 175.9102 124 V 3.4077 8.1828 119.7382 64.9928 31.5799 176.5041 125 G 3.9924 8.8525 113.5527 45.8147 0.0000 174.1432 126 V 4.1079 7.5097 119.8462 64.5363 32.2118 176.0378 127 L 4.0764 7.6271 120.5759 55.5678 42.2785 174.8669 128 Y 4.7384 8.6159 126.7734 58.8599 40.8333 175.6979 129 K 4.8442 7.8034 117.8747 55.2417 36.0651 174.3685 130 V 4.9236 9.1886 126.6175 61.0276 34.5580 173.8329 131 K 5.0629 9.2854 129.4612 54.5753 34.9736 174.5990 132 V 4.9759 9.0114 127.4066 61.4401 34.5702 173.6891 133 Y 4.8044 9.5194 126.8531 56.7854 38.3400 176.3763 134 E 3.5041 8.8908 127.2938 58.4758 29.6325 176.1522 135 T 4.6742 7.3212 106.5638 59.6144 72.1390 173.7889 136 D 4.4693 8.7889 120.2726 56.9635 40.6905 177.4082 137 N 4.8607 8.2767 113.5355 52.8330 39.8412 173.9959 138 N 5.0130 8.0821 115.7847 51.4911 41.7428 173.5002 139 I 4.8989 8.3504 123.7798 59.2717 41.1977 175.1376 140 V 4.4723 8.7341 125.1866 61.0128 34.6800 174.2516 141 V 4.9095 8.4220 126.2100 61.2126 34.0287 173.7400 142 Y 4.7679 9.1535 128.6629 55.3712 41.7424 175.7425 143 K 4.2460 7.1648 124.3938 55.8756 33.3388 177.7825 144 G 2.6585 5.3800 105.0076 45.1418 0.0000 174.2941 145 E 3.9910 6.4456 124.2343 56.2902 29.5073 176.1163 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 10 C 8.20 4.58 0.00 2.89 2.96 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 11 Q 8.52 4.58 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.79 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 12 A 9.69 4.78 1.17 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 0.00 0.00 13 Q 8.59 5.06 0.00 1.90 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.62 0.00 0.00 0.00 0.00 0.00 1.96 2.14 0.00 14 V 8.86 4.52 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 1.05 0.00 0.00 0.94 0.00 0.00 15 S 8.81 5.44 0.00 3.80 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 16 R 8.99 4.68 0.00 1.87 1.76 0.00 3.07 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 17 R 8.75 5.28 0.00 1.88 1.80 0.00 3.11 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.75 0.00 18 I 8.89 5.01 1.97 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 1.39 1.17 0.97 0.00 0.00 19 S 8.69 5.45 0.00 3.84 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 20 F 8.74 5.26 0.00 3.21 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 21 S 9.21 5.33 0.00 3.58 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 22 A 8.97 5.28 1.50 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 23 S 8.69 5.26 0.00 3.99 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 24 H 8.73 4.77 0.00 3.26 3.31 0.00 5.24 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 R 9.27 4.78 0.00 1.66 1.73 0.00 3.18 0.00 0.00 2.72 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.66 0.00 26 L 8.51 4.28 0.00 1.10 0.13 0.87 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 7.92 4.87 0.00 3.07 2.78 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 28 S 9.76 4.47 0.00 3.90 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 29 K 8.60 3.99 0.00 1.81 1.72 0.00 1.86 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 1.01 7.81 *30 F 7.71 4.39 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 7.34 4.99 0.00 1.67 1.58 0.91 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 32 S 8.44 4.42 0.00 4.06 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 33 D 8.91 4.53 0.00 2.70 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.41 4.25 0.00 1.96 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 2.32 1.95 0.00 35 E 8.59 4.15 0.00 1.96 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 2.25 2.24 0.00 36 N 8.92 4.72 0.00 3.06 3.11 0.00 0.00 7.01 6.78 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 37 L 8.35 4.15 0.00 1.64 1.67 0.92 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 38 K 8.04 4.16 0.00 1.84 1.76 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.32 7.81 39 L 7.63 4.15 0.00 1.70 1.25 0.92 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 40 F 8.34 4.92 0.00 3.32 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 41 G 9.00 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 42 K 8.64 4.02 0.00 1.70 1.84 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.03 7.81 43 C 7.98 4.20 0.00 3.23 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.14 4.83 0.00 2.86 3.08 0.00 0.00 7.05 8.32 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 45 N 8.02 4.14 0.00 2.95 2.73 0.00 0.00 7.14 7.86 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 46 P 0.00 4.11 0.00 2.04 2.06 0.00 3.70 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 2.01 2.10 0.00 47 N 8.08 4.50 0.00 2.68 2.82 0.00 0.00 7.12 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 48 G 9.62 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 H 8.49 4.78 0.00 3.12 3.36 0.00 5.29 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.28 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 51 H 8.88 4.81 0.00 2.02 2.60 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 N 8.53 4.88 0.00 2.50 2.71 0.00 0.00 7.00 7.46 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 53 Y 8.47 4.20 0.00 1.43 2.30 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 54 K 8.88 5.11 0.00 1.62 1.60 0.00 1.22 0.00 0.00 1.38 0.00 0.00 2.61 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.27 1.22 7.81 55 V 9.18 5.04 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 1.16 0.00 0.00 1.29 0.00 0.00 56 V 9.19 4.83 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 1.07 0.00 0.00 1.13 0.00 0.00 57 V 8.77 4.75 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 0.92 0.00 0.00 1.00 0.00 0.00 58 T 9.06 5.17 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 1.39 0.00 0.00 59 V 8.98 5.03 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 0.75 0.00 0.00 0.96 0.00 0.00 60 H 9.27 5.69 0.00 2.97 3.02 0.00 5.74 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 7.98 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 62 E 7.85 4.61 0.00 2.02 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 2.40 1.91 0.00 63 I 8.16 4.19 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 1.11 0.58 0.94 0.00 0.00 64 D 9.08 4.51 0.00 2.80 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 65 P 0.00 3.80 0.00 2.21 2.17 0.00 3.80 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 66 A 8.05 4.24 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 67 T 7.83 4.28 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 68 G 9.05 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 69 M 7.39 4.81 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.43 0.00 70 V 8.65 3.78 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 0.94 0.00 0.00 1.02 0.00 0.00 71 M 7.48 4.74 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.56 0.00 72 N 8.89 4.36 0.00 2.78 2.89 0.00 0.00 7.10 6.66 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 73 L 8.55 4.00 0.00 1.69 1.65 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 74 A 8.16 4.15 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 75 D 7.97 3.83 0.00 2.81 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 76 L 7.75 4.19 0.00 1.87 1.86 1.02 0.62 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 77 K 8.38 3.92 0.00 1.83 1.90 0.00 1.70 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.44 7.81 78 K 8.05 3.78 0.00 1.74 1.69 0.00 1.49 0.00 0.00 1.25 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.39 7.81 79 Y 7.87 4.31 0.00 3.16 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 80 M 8.36 4.10 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.59 0.00 81 E 8.77 3.97 0.00 2.11 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 0.00 2.30 2.37 0.00 82 E 8.42 4.25 0.00 2.12 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 2.26 2.05 0.00 83 A 8.11 4.46 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 84 I 7.64 4.24 2.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.64 0.79 0.00 0.00 85 M 7.98 3.95 0.00 2.07 2.33 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.54 0.00 86 Q 8.42 4.01 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 87 P 0.00 4.41 0.00 2.30 2.24 0.00 3.61 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.99 0.00 88 L 7.49 4.38 0.00 0.87 0.96 0.55 0.93 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 89 D 8.14 4.58 0.00 2.70 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 90 H 9.10 4.12 0.00 3.30 3.40 0.00 5.84 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 7.66 4.64 0.00 1.87 1.66 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.58 1.54 7.81 92 N 9.53 5.24 0.00 2.69 2.84 0.00 0.00 7.12 7.31 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 93 L 9.00 3.94 0.00 1.52 1.21 0.50 0.63 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 94 D 7.86 4.58 0.00 2.75 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 95 M 8.21 4.54 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.54 0.00 96 D 8.70 4.59 0.00 2.74 2.73 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 97 V 7.42 4.23 2.43 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 0.92 0.00 0.00 1.00 0.00 0.00 98 P 0.00 4.25 0.00 2.26 2.14 0.00 3.74 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.13 0.00 99 Y 8.18 3.91 0.00 2.80 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 0.00 100 F 8.06 4.59 0.00 3.30 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 0.00 101 A 8.21 4.19 1.35 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 0.00 0.00 102 D 7.84 4.86 0.00 2.77 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 7.25 4.27 1.75 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 0.80 0.00 0.00 0.41 0.00 0.00 104 V 8.37 3.62 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 0.73 0.00 0.00 0.96 0.00 0.00 105 S 8.32 4.34 0.00 3.56 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 0.00 106 T 7.62 4.17 4.48 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 1.29 0.00 0.00 107 T 8.49 3.97 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 108 E 8.32 3.97 0.00 2.08 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 2.42 2.50 0.00 109 N 8.22 4.54 0.00 3.19 3.22 0.00 0.00 6.73 7.10 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 0.00 110 V 8.07 3.87 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.74 0.00 0.00 111 A 8.29 4.11 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 0.00 112 V 7.71 3.07 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 0.92 0.00 0.00 0.04 0.00 0.00 113 Y 8.13 3.73 0.00 2.75 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 0.00 114 I 8.11 3.51 2.13 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.72 0.97 0.00 0.00 115 W 8.52 4.14 0.00 3.78 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 0.00 116 D 8.34 4.46 0.00 2.66 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 0.00 117 N 7.95 4.21 0.00 2.62 2.61 0.00 0.00 7.05 6.25 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 0.00 118 L 7.62 3.98 0.00 1.56 1.40 0.85 0.99 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 0.00 119 Q 7.59 3.83 0.00 1.90 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.00 0.00 0.00 0.00 0.00 0.00 1.83 2.33 0.00 120 K 7.36 4.06 0.00 1.87 1.79 0.00 1.55 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.51 7.81 121 V 7.24 4.05 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 0.72 0.00 0.00 0.72 0.00 0.00 122 L 7.27 3.72 0.00 1.37 1.32 0.68 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 123 P 0.00 4.34 0.00 2.18 2.13 0.00 3.56 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.93 0.00 124 V 8.18 3.41 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 0.79 0.00 0.00 0.91 0.00 0.00 125 G 8.85 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 0.00 126 V 7.51 4.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 1.02 0.00 0.00 127 L 7.63 4.08 0.00 1.21 1.12 0.73 -0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 128 Y 8.62 4.74 0.00 2.64 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 0.00 129 K 7.80 4.84 0.00 1.43 1.64 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.77 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.43 1.28 7.81 130 V 9.19 4.92 2.46 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 1.16 0.00 0.00 1.18 0.00 0.00 131 K 9.29 5.06 0.00 1.88 1.83 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.59 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.12 1.21 7.81 132 V 9.01 4.98 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 1.26 0.00 0.00 1.09 0.00 0.00 133 Y 9.52 4.80 0.00 2.84 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 0.00 134 E 8.89 3.50 0.00 1.91 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 1.62 1.71 0.00 135 T 7.32 4.67 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 136 D 8.79 4.47 0.00 2.70 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 N 8.28 4.86 0.00 2.69 2.84 0.00 0.00 6.79 7.61 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 0.00 138 N 8.08 5.01 0.00 2.60 2.68 0.00 0.00 6.68 7.25 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 0.00 139 I 8.35 4.90 1.68 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.47 0.38 0.00 0.00 140 V 8.73 4.47 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 0.96 0.00 0.00 0.98 0.00 0.00 141 V 8.42 4.91 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 0.80 0.00 0.00 0.89 0.00 0.00 142 Y 9.15 4.77 0.00 2.94 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 0.00 143 K 7.16 4.25 0.00 1.37 1.28 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.52 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.01 1.11 7.81 144 G 5.38 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 0.00 0.00 0.00 145 E 6.45 3.99 0.00 1.65 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 0.00 2.19 2.06 0.00 * Residues marked with a * may have inaccurate shift predictions.