NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 S 4.3157 8.3301 117.1002 57.8624 64.2861 173.4590 16 A 4.1990 8.3248 127.1371 52.1607 19.2658 175.6616 17 T 5.0931 8.1277 103.5086 60.0890 72.9446 171.8278 18 F 4.9799 9.0888 120.8511 54.9964 43.0800 172.5984 19 P 5.0222 0.0000 0.0000 62.9541 32.4313 175.2530 20 M 4.8559 9.4478 124.6652 54.0958 36.0915 174.7887 21 Q 4.4784 8.8861 125.0424 55.6898 28.7303 175.0147 22 C 3.9052 9.3092 127.0211 62.6488 31.6907 176.9127 23 S 4.1456 8.0440 113.5268 60.3383 62.0424 176.2527 24 A 4.4949 7.8180 119.7358 52.6778 18.6620 177.3315 25 L 4.4113 7.4653 119.3926 55.1743 42.6609 177.0272 26 R 4.6767 8.0597 120.2033 54.8785 33.7721 176.6725 27 K 4.1405 8.4358 121.2653 57.2818 32.1799 179.9744 28 N 4.4055 8.8369 116.5549 52.7237 37.2875 175.8979 29 G 3.9886 7.1973 103.0274 46.3825 0.0000 172.5813 30 F 5.7086 8.4902 116.8881 56.1126 43.1253 174.7839 31 V 4.6294 8.7610 119.3835 60.8581 35.1594 172.8873 32 V 4.5163 8.8821 123.2044 62.0532 32.1180 175.2716 33 L 4.5687 8.5623 131.2153 54.4928 43.6372 177.7103 34 K 3.8705 9.7677 125.2804 55.5134 28.9969 172.6559 35 G 3.9778 8.4495 106.0280 46.0511 0.0000 174.1207 36 R 4.6208 7.4212 118.9396 53.1854 32.8510 173.1585 37 P 4.8638 0.0000 0.0000 62.9219 32.7944 174.8672 38 C 5.5190 9.0694 121.2847 57.6649 32.7094 172.9276 39 K 4.3488 8.9025 123.6507 55.6163 33.5417 175.7033 40 I 3.9468 8.5592 128.9994 61.5436 37.5621 175.3296 41 V 3.9958 9.3231 132.1662 64.1184 31.0389 178.0312 42 E 4.4317 7.8262 118.2767 55.3575 31.6402 176.2540 43 M 5.1570 7.8815 116.9760 57.9183 34.8874 173.4528 44 S 4.2641 7.9591 117.9699 59.4201 65.7776 172.5690 *56 V 4.0071 8.0617 128.6954 62.0918 33.6459 178.2497 *57 H 4.4901 8.7988 128.3217 54.7192 29.5727 171.7743 58 L 5.0342 8.8616 124.7692 52.3122 44.3117 173.5211 59 V 4.8022 8.5144 124.1811 60.1433 33.9991 174.5470 60 G 4.5882 9.2157 114.0693 44.6012 0.0000 170.9946 61 I 4.8988 8.6541 122.7881 58.7755 39.9170 174.6290 62 D 5.0193 9.1001 127.5280 54.9699 41.7099 177.1972 63 I 4.0898 8.7811 118.7943 62.1142 37.9195 175.6285 64 F 4.8417 9.5081 118.9018 59.5137 40.9764 176.7683 65 T 4.1855 8.3607 109.0310 62.6343 69.3479 175.7342 66 G 4.0416 8.1751 112.1231 45.3109 0.0000 174.6214 67 K 4.0430 7.9473 126.1385 56.0755 32.8583 182.0807 68 K 4.8815 8.2598 127.1435 53.7702 33.0195 174.5072 69 Y 4.9342 9.1249 122.6769 55.3543 41.5491 174.6216 70 E 5.3606 8.6462 119.8032 55.1643 33.8290 174.7455 71 D 4.6390 8.7675 121.6610 54.1675 45.3240 176.0519 72 I 4.6762 8.3176 125.7015 60.3588 37.3182 172.5311 73 C 4.6959 7.9489 111.1356 58.8709 31.3552 172.3286 74 P 4.5659 0.0000 0.0000 62.6796 32.0389 177.5771 75 S 4.3018 8.7564 119.7386 61.5433 62.6830 176.6961 76 T 4.6832 7.6285 112.1674 60.9221 68.8427 176.5811 77 H 4.9955 7.8638 122.3232 54.9476 33.7387 171.7858 78 N 5.1517 8.5629 122.9723 53.0181 39.8756 174.4311 79 M 4.5833 8.9242 124.0054 54.1876 34.8923 174.9780 80 D 5.1208 8.5016 120.5180 53.8072 42.8775 175.4632 81 V 4.7755 9.0819 123.8550 60.4077 33.7034 172.9941 82 P 4.7248 0.0000 0.0000 62.4877 32.4297 175.3882 83 N 4.5989 8.9684 122.7156 53.6890 39.4303 174.1465 84 I 4.4369 8.4339 130.2490 60.2694 38.9947 175.7898 85 K 4.6121 8.8387 131.5875 53.3743 34.1728 171.8432 86 R 5.1468 8.6087 124.0603 53.5559 32.7497 174.9912 87 N 5.0202 9.2678 120.3649 51.5575 43.2180 172.9344 88 D 5.4765 8.2426 121.1702 52.7277 43.7662 175.3371 89 F 4.9637 9.2525 121.0934 55.5318 43.7203 174.2247 90 Q 4.6536 8.5995 121.8300 55.3797 29.6337 175.1251 91 L 4.2880 8.3650 129.7729 56.3933 42.2024 176.9836 92 I 4.5368 9.7935 126.8808 59.2897 36.4925 172.6443 93 G 4.7042 7.0771 115.9005 48.8512 0.0000 173.0838 94 I 4.9065 7.7041 122.6283 59.2780 38.7568 176.2160 95 Q 4.4682 8.7795 129.4773 53.9014 30.6629 173.8173 96 D 4.7984 10.0333 123.9668 53.2981 37.3623 171.0397 97 G 3.8449 8.3569 107.7052 45.7113 0.0000 172.7293 98 Y 4.9778 7.5968 116.5914 55.8146 40.9370 174.6964 99 L 4.6275 8.6695 122.9670 54.4329 43.5609 176.3890 100 S 4.9484 8.9867 119.8403 57.0606 64.4473 172.3724 101 L 5.2827 8.3901 125.4856 52.7993 43.7040 175.5913 102 L 4.5211 9.3097 127.8032 53.6464 43.3582 176.0012 103 Q 4.2882 9.4805 130.1077 56.4955 29.1317 178.0932 104 D 4.6708 8.8291 122.3598 56.0829 39.8316 174.3223 105 S 4.6034 8.0641 110.3827 58.5570 63.1488 173.5975 106 G 3.9187 8.1765 115.8113 47.0763 0.0000 175.4827 107 E 4.3945 8.0786 119.2476 55.4939 31.6000 177.6780 108 V 5.1208 8.2412 120.8754 61.5755 34.3258 175.1101 109 R 4.3847 7.9496 115.0783 55.6008 31.8452 175.1281 110 E 5.3732 9.1027 121.5577 55.2716 30.2968 176.5766 111 D 4.3300 7.8346 119.5782 55.5375 40.0594 176.4076 112 L 4.4230 7.8204 123.3205 54.6522 42.8375 177.3476 113 R 4.4878 8.5904 124.1717 55.7906 30.7956 172.9065 114 L 4.0226 8.0489 123.8784 54.6311 42.6465 175.5781 115 P 4.3981 0.0000 0.0000 62.4128 32.0191 176.0113 116 E 4.5726 8.4735 120.5700 56.0662 31.0020 177.2329 117 G 3.9470 8.3974 107.1843 45.8963 0.0000 173.7825 118 D 4.3642 8.4911 116.9174 57.0112 40.6167 178.3732 119 L 4.0798 7.9230 121.1103 57.8663 42.1200 178.9744 120 G 3.9400 8.0616 109.0382 47.9686 0.0000 176.1912 121 K 3.9752 7.7723 126.6561 59.5659 31.6203 180.6114 122 E 4.5858 8.0419 120.4171 58.1972 29.4987 179.3177 123 I 3.7279 7.9724 120.3081 64.3120 37.2068 177.8650 124 E 4.0323 8.4434 119.8040 59.8440 28.8488 179.6237 125 Q 4.0099 8.0583 117.4501 59.1663 28.7734 179.2788 126 K 4.0886 8.1239 119.4095 59.2665 32.0009 179.0224 127 Y 4.0070 8.2523 120.0418 60.9348 38.6460 177.6718 128 D 4.3701 8.6009 118.4131 57.0367 40.9600 177.6874 129 C 4.4251 7.7100 114.8212 59.1146 28.4002 174.1076 130 G 3.6550 7.9165 108.9628 45.9683 0.0000 173.1833 131 E 4.0944 8.4155 124.1859 55.9199 30.0404 176.8834 132 E 4.2936 8.9188 125.9809 57.0121 29.7656 172.4379 133 I 4.9896 8.3524 118.0301 58.3426 41.9788 173.9984 134 L 5.3078 8.8967 122.2018 53.0780 45.3604 175.5367 135 I 4.9716 8.9546 122.6105 59.9215 40.2490 174.8463 136 T 4.9697 8.6375 124.3470 62.2384 69.8566 173.9209 137 V 4.6945 9.5220 128.4478 61.4542 33.3715 174.1466 138 L 5.0634 9.2401 131.0672 53.8769 43.8428 175.1903 139 S 5.5024 9.2711 121.9313 56.9405 66.6924 172.9809 140 A 4.6820 9.7957 123.5541 51.3860 22.9604 175.9167 141 M 2.8608 8.9230 121.3782 57.3070 31.0201 177.7770 142 T 4.4751 8.6808 117.2091 62.2866 69.0734 173.6214 143 E 4.7341 8.2284 121.3923 54.9679 33.2665 174.7570 144 E 5.4643 8.4481 120.4616 54.9554 33.7790 174.8103 145 A 4.7365 9.1721 123.6106 50.4622 23.4217 175.3786 146 A 4.5809 8.7789 123.7609 52.4264 18.2422 177.2522 147 V 4.3771 8.9504 121.9707 63.6861 33.8638 174.7416 148 A 4.6462 7.6084 120.0888 51.5363 22.8922 174.5554 149 I 5.1151 8.1725 118.3581 59.5611 41.0688 174.2758 150 K 4.7243 9.4137 128.3560 54.4225 35.5149 176.3992 151 A 4.2195 8.5894 125.7778 52.4499 18.7671 177.0926 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 15 S 8.33 4.32 0.00 3.65 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 16 A 8.32 4.20 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 17 T 8.13 5.09 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 1.18 0.00 0.00 18 F 9.09 4.98 0.00 2.96 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 19 P 0.00 5.02 0.00 2.10 2.06 0.00 3.85 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.99 0.00 20 M 9.45 4.86 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.49 0.00 21 Q 8.89 4.48 0.00 1.78 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.59 0.00 0.00 0.00 0.00 0.00 2.37 1.80 0.00 22 C 9.31 3.91 0.00 3.26 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.04 4.15 0.00 3.67 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 24 A 7.82 4.49 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 25 L 7.47 4.41 0.00 1.72 1.61 0.99 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.06 4.68 0.00 1.77 1.62 0.00 3.27 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.19 0.00 27 K 8.44 4.14 0.00 1.67 1.72 0.00 1.84 0.00 0.00 1.85 0.00 0.00 2.87 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.44 1.01 7.81 28 N 8.84 4.41 0.00 2.90 2.89 0.00 0.00 6.96 7.84 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 29 G 7.20 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 30 F 8.49 5.71 0.00 2.89 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 31 V 8.76 4.63 2.13 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 0.65 0.00 0.00 1.00 0.00 0.00 32 V 8.88 4.52 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 0.74 0.00 0.00 0.97 0.00 0.00 33 L 8.56 4.57 0.00 1.63 1.52 1.01 0.83 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 34 K 9.77 3.87 0.00 1.89 1.72 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.27 0.98 7.81 35 G 8.45 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 36 R 7.42 4.62 0.00 1.47 1.86 0.00 3.28 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 37 P 0.00 4.86 0.00 2.17 2.25 0.00 3.75 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 2.30 2.23 0.00 38 C 9.07 5.52 0.00 3.11 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 39 K 8.90 4.35 0.00 1.87 1.61 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.70 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.10 0.61 7.81 40 I 8.56 3.95 1.88 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 1.10 0.50 0.91 0.00 0.00 41 V 9.32 4.00 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 0.68 0.00 0.00 0.91 0.00 0.00 42 E 7.83 4.43 0.00 2.02 1.74 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 2.19 1.85 0.00 43 M 7.88 5.16 0.00 1.91 1.93 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.48 0.00 44 S 7.96 4.26 0.00 3.60 3.46 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 0.00 *56 V 8.06 4.01 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 0.84 0.00 0.00 0.93 0.00 0.00 *57 H 8.80 4.49 0.00 2.60 2.97 0.00 7.09 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 L 8.86 5.03 0.00 1.29 1.53 0.92 0.55 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 59 V 8.51 4.80 2.17 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 0.94 0.00 0.00 0.94 0.00 0.00 60 G 9.22 4.59 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 0.00 0.00 0.00 61 I 8.65 4.90 1.89 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 1.12 0.69 0.97 0.00 0.00 62 D 9.10 5.02 0.00 3.23 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 63 I 8.78 4.09 1.73 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 1.44 0.05 1.15 0.00 0.00 64 F 9.51 4.84 0.00 3.21 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 65 T 8.36 4.19 4.32 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 1.31 0.00 0.00 66 G 8.18 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 K 7.95 4.04 0.00 1.41 1.71 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.38 1.28 7.81 68 K 8.26 4.88 0.00 1.53 1.62 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.30 1.03 7.81 69 Y 9.12 4.93 0.00 2.86 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 70 E 8.65 5.36 0.00 1.84 1.84 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 2.22 2.28 0.00 71 D 8.77 4.64 0.00 2.82 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 72 I 8.32 4.68 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 1.40 0.82 0.91 0.00 0.00 73 C 7.95 4.70 0.00 2.90 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 74 P 0.00 4.57 0.00 2.09 2.00 0.00 3.40 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 1.87 1.98 0.00 75 S 8.76 4.30 0.00 3.63 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 76 T 7.63 4.68 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 77 H 7.86 5.00 0.00 3.14 3.25 0.00 5.63 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 78 N 8.56 5.15 0.00 2.62 2.71 0.00 0.00 7.10 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 79 M 8.92 4.58 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.73 0.00 80 D 8.50 5.12 0.00 2.61 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 81 V 9.08 4.78 2.32 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 1.26 0.00 0.00 1.06 0.00 0.00 82 P 0.00 4.72 0.00 2.12 2.07 0.00 3.90 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 83 N 8.97 4.60 0.00 3.06 2.93 0.00 0.00 7.08 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 84 I 8.43 4.44 1.40 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.47 0.54 0.00 0.00 85 K 8.84 4.61 0.00 1.42 1.67 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.77 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.27 1.26 7.81 86 R 8.61 5.15 0.00 1.62 1.84 0.00 3.08 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 87 N 9.27 5.02 0.00 2.78 2.25 0.00 0.00 6.45 7.67 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 88 D 8.24 5.48 0.00 2.53 2.50 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 89 F 9.25 4.96 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 90 Q 8.60 4.65 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.97 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 91 L 8.37 4.29 0.00 1.57 1.74 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 92 I 9.79 4.54 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 1.16 0.90 0.91 0.00 0.00 93 G 7.08 4.70 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 94 I 7.70 4.91 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 1.20 0.86 0.91 0.00 0.00 95 Q 8.78 4.47 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.18 0.00 0.00 0.00 0.00 0.00 2.17 2.12 0.00 96 D 10.03 4.80 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 97 G 8.36 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 98 Y 7.60 4.98 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 99 L 8.67 4.63 0.00 1.62 1.51 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 100 S 8.99 4.95 0.00 3.82 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 0.00 101 L 8.39 5.28 0.00 1.30 1.44 0.60 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 102 L 9.31 4.52 0.00 1.80 1.75 1.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 103 Q 9.48 4.29 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.49 0.00 0.00 0.00 0.00 0.00 2.86 2.66 0.00 104 D 8.83 4.67 0.00 2.69 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 0.00 105 S 8.06 4.60 0.00 3.98 3.97 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 0.00 106 G 8.18 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 0.00 107 E 8.08 4.39 0.00 1.67 1.83 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 2.30 1.87 0.00 108 V 8.24 5.12 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 0.96 0.00 0.00 0.96 0.00 0.00 109 R 7.95 4.38 0.00 1.98 1.91 0.00 2.90 0.00 0.00 3.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.36 0.00 110 E 9.10 5.37 0.00 1.85 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 0.00 2.18 2.17 0.00 111 D 7.83 4.33 0.00 2.72 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 0.00 112 L 7.82 4.42 0.00 1.56 1.60 0.73 1.04 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 0.00 113 R 8.59 4.49 0.00 1.60 1.71 0.00 3.27 0.00 0.00 3.15 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.19 0.00 114 L 8.05 4.02 0.00 1.71 1.52 0.85 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 115 P 0.00 4.40 0.00 2.22 1.97 0.00 3.62 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.23 0.00 116 E 8.47 4.57 0.00 1.96 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 2.28 2.28 0.00 117 G 8.40 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 0.00 118 D 8.49 4.36 0.00 2.71 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 0.00 119 L 7.92 4.08 0.00 1.77 1.67 0.94 1.09 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 0.00 120 G 8.06 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 0.00 0.00 0.00 121 K 7.77 3.98 0.00 1.74 1.84 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.36 7.81 122 E 8.04 4.59 0.00 2.23 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 123 I 7.97 3.73 1.99 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 1.55 0.80 0.92 0.00 0.00 124 E 8.44 4.03 0.00 2.29 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 125 Q 8.06 4.01 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.52 0.00 126 K 8.12 4.09 0.00 1.95 1.90 0.00 1.80 0.00 0.00 1.60 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.68 1.53 7.81 127 Y 8.25 4.01 0.00 3.17 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 0.00 128 D 8.60 4.37 0.00 2.80 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 0.00 129 C 7.71 4.43 0.00 3.20 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 0.00 130 G 7.92 3.66 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 0.00 131 E 8.42 4.09 0.00 2.07 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 2.33 2.27 0.00 132 E 8.92 4.29 0.00 1.79 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 0.00 2.23 1.88 0.00 133 I 8.35 4.99 1.92 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 1.62 0.85 0.98 0.00 0.00 134 L 8.90 5.31 0.00 1.60 1.60 0.91 1.26 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 0.00 135 I 8.95 4.97 1.99 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.17 1.00 0.00 0.00 136 T 8.64 4.97 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 1.25 0.00 0.00 137 V 9.52 4.69 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.93 0.00 0.00 138 L 9.24 5.06 0.00 1.73 1.66 0.75 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 139 S 9.27 5.50 0.00 3.77 3.76 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 0.00 140 A 9.80 4.68 1.24 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 0.00 0.00 141 M 8.92 2.86 0.00 2.17 1.38 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.53 0.00 142 T 8.68 4.48 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 1.19 0.00 0.00 143 E 8.23 4.73 0.00 1.62 1.12 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 1.96 2.11 0.00 144 E 8.45 5.46 0.00 1.77 1.81 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 2.26 2.31 0.00 145 A 9.17 4.74 1.44 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 0.00 0.00 146 A 8.78 4.58 1.26 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 0.00 147 V 8.95 4.38 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 0.79 0.00 0.00 1.02 0.00 0.00 148 A 7.61 4.65 1.24 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 0.00 0.00 149 I 8.17 5.12 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.00 0.94 0.00 0.00 150 K 9.41 4.72 0.00 1.67 1.66 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.37 7.81 151 A 8.59 4.22 1.24 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 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.