NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 E 4.3368 8.4293 120.2267 55.4726 30.9486 175.0667 8 P 4.2952 0.0000 0.0000 60.9812 32.3043 174.4392 9 K 3.9304 8.7231 122.3279 56.5079 33.4148 178.4460 10 V 4.1979 8.0942 126.4802 61.1136 32.2588 175.6803 11 V 3.7537 8.1858 126.3828 65.5162 31.3898 177.5778 12 G 3.7160 8.1301 104.3632 47.2488 0.0000 175.0756 13 V 3.9211 7.5307 119.7271 65.4293 31.9696 177.4853 14 E 4.1240 8.1864 118.6090 59.5915 29.1198 179.5020 15 I 3.7880 7.6211 111.7292 63.6753 37.7282 177.9913 16 L 4.1744 7.8105 121.0994 57.5970 41.5893 178.9755 17 E 3.9997 8.1035 118.0648 59.3503 29.2209 179.3052 18 K 3.9733 7.9360 117.6616 59.4033 32.1818 178.6957 19 S 4.4266 7.6598 112.5570 58.4480 62.8647 174.7511 20 G 3.8369 7.8844 109.8672 45.9953 0.0000 173.3559 21 L 4.0451 7.7615 121.2037 54.1056 42.8429 176.5019 22 D 4.5573 8.5546 125.2985 53.8188 41.5149 176.6982 23 I 3.8302 8.1833 129.4390 63.9514 37.3976 178.1234 24 K 3.9063 8.0420 120.1477 59.4230 32.1111 178.6376 25 K 3.9496 8.1159 119.7284 59.1660 31.9990 178.6295 26 L 3.8991 7.8566 120.7256 58.2400 42.0244 179.0649 27 V 3.5455 8.1466 118.6338 66.0211 31.4568 177.3791 28 D 4.2719 8.0490 117.7100 57.2869 40.9822 178.4929 29 K 3.9271 7.9983 118.8859 59.3536 32.0432 179.2433 30 L 3.9816 8.1709 119.6002 57.9085 41.4833 179.8364 31 V 3.6243 8.0291 118.2610 65.9573 31.3818 178.2948 32 K 4.1440 8.1597 118.9099 58.8265 31.3521 179.3043 33 A 3.5855 8.0021 121.2633 55.2763 18.1001 179.8967 34 T 4.2678 8.5241 114.5844 66.6933 68.5588 176.8867 35 A 4.1791 8.4938 122.8929 55.2237 18.3684 179.5698 36 A 4.1769 7.9381 120.1104 54.6707 18.6285 179.5682 37 E 4.0789 8.0957 116.4549 59.4644 29.3265 179.3217 38 F 3.8206 8.3274 120.7236 61.3214 38.9307 177.4568 39 T 3.8763 8.1256 109.5353 64.9259 68.5868 176.5096 40 T 3.7547 8.0778 118.6851 66.7327 68.2530 175.5351 41 Y 4.2014 7.4355 119.2825 60.8913 38.6136 177.5722 42 Y 3.6629 7.2586 120.0111 60.8228 38.9649 177.3123 43 Y 4.1647 8.3185 118.0120 61.2820 37.9304 177.9330 44 Y 4.2067 8.7966 118.0380 60.9424 37.6208 178.5862 45 T 3.7639 7.1413 115.0768 66.8218 68.6379 176.2024 46 I 3.7252 7.2680 119.4012 64.3139 37.2699 178.0604 47 L 4.0936 7.7279 118.7905 57.4205 41.6231 180.1612 48 R 4.0800 8.0940 118.7120 56.6312 29.9655 177.3198 *50 H 4.4866 8.0862 112.4470 54.7374 30.7243 174.7715 51 L 4.3839 7.5691 121.4407 53.8293 39.5816 175.6115 52 T 4.5820 7.8083 113.1467 60.4487 73.1881 177.7391 53 G 3.8828 8.1773 113.9046 46.9315 0.0000 174.9947 *55 E 4.1728 9.2812 120.7705 56.1081 30.9883 177.3925 56 G 3.8782 7.6707 103.1306 45.3196 0.0000 175.1731 57 E 4.0698 7.7892 122.3136 59.3601 29.5755 178.8645 58 G 3.7521 7.9585 103.2152 47.0641 0.0000 175.0921 59 L 4.2290 7.6214 121.4632 57.1821 41.5674 179.1633 60 K 3.9064 7.6642 118.0460 59.6469 32.0111 179.0447 61 E 3.9762 8.1154 116.9950 59.2456 29.6588 179.1178 62 I 3.4629 7.6646 120.3545 64.1244 37.3198 178.0003 63 A 4.3633 8.2064 121.7321 54.9841 18.1565 179.4065 64 E 3.9743 8.4592 118.2674 59.5766 29.7717 178.6519 65 D 4.4550 8.3850 118.8448 57.4068 40.8520 178.7318 66 A 3.9219 8.2775 120.6921 55.1097 18.4566 179.4700 67 R 3.9861 8.3882 117.2168 59.9498 30.1416 178.8101 68 L 4.0926 8.2136 118.5786 57.7951 41.5810 179.3930 69 E 4.0088 8.3550 118.7216 59.3969 29.4285 179.0912 70 D 4.4061 8.4110 119.2220 57.0936 40.8328 178.6911 71 R 3.8268 7.9874 119.4640 59.4352 30.0238 178.6384 72 L 4.1072 7.7922 118.3217 57.7367 41.3159 179.1467 73 H 4.2011 7.8353 115.9577 58.6231 28.6776 177.1039 74 F 4.4818 8.0808 121.3327 61.5847 39.2297 176.6486 75 E 3.9199 8.3124 118.0950 59.1942 28.7652 178.8134 76 L 4.1113 7.7925 116.4242 56.7376 41.5513 178.2098 *78 T 4.0511 7.7125 115.3090 63.8796 70.6034 175.7094 79 Q 4.0114 7.6567 120.4445 59.4461 28.9703 178.6634 80 R 3.9336 7.5824 119.1968 59.3341 30.0352 178.3367 81 I 3.6443 7.8035 119.2557 64.8071 37.1286 177.8254 82 Y 4.3062 7.7619 118.6559 60.3612 37.4861 177.9286 83 E 4.0721 8.1350 118.9018 59.1475 29.6443 178.4818 84 L 4.3995 7.7151 116.2062 54.6721 41.9623 177.6587 85 G 3.8429 8.1256 107.7788 45.3030 0.0000 173.8677 86 G 3.8542 7.8993 110.0534 44.3067 0.0000 172.9845 87 G 3.3876 7.5071 105.9675 43.8496 0.0000 172.9737 88 L 4.2522 8.0297 120.2645 53.1804 42.3613 175.8193 89 P 4.3278 0.0000 0.0000 62.6442 31.8906 176.7435 90 R 3.9817 8.7661 122.6105 58.8179 30.2847 176.6097 91 D 4.9260 8.0092 116.0672 52.3843 44.2352 176.9603 92 I 3.6594 8.1770 125.1454 64.0071 38.1217 178.4995 93 R 3.9744 8.9500 119.7078 59.0075 29.8711 178.6925 94 Q 3.9738 8.0746 117.5162 58.9706 28.5348 178.5151 95 L 3.9269 7.4275 119.6594 58.2066 41.9320 178.5457 96 A 4.2089 7.8385 120.0451 55.4867 18.1269 179.4353 97 D 4.4042 7.9782 116.3768 56.7452 40.9326 177.9839 98 I 4.2018 7.7080 111.6901 59.6903 38.0319 175.4372 99 S 4.2667 7.2244 115.1875 58.7375 62.5929 174.3254 100 A 4.0574 8.7034 130.6414 54.4015 18.3708 177.2475 101 C 4.8712 7.3203 111.9303 57.4744 31.0228 173.9650 102 S 4.1987 8.2765 116.2000 57.9342 62.6497 173.7469 103 D 3.8293 8.1676 125.5238 54.3169 41.1824 177.7365 104 A 4.1172 7.1928 129.6827 51.0138 17.1600 176.6065 105 Y 4.2837 6.7359 119.3078 56.6157 39.1944 176.5877 106 L 3.9542 8.4982 125.2468 54.4969 42.4734 175.3339 107 P 4.6080 0.0000 0.0000 62.2121 32.3915 176.2148 108 E 4.0705 8.7959 119.3756 59.1980 30.4245 177.2910 109 N 4.6504 7.8045 118.1779 52.3534 38.2641 175.9737 110 W 4.3518 7.7703 116.0018 59.1561 28.9430 178.0638 111 K 3.5560 6.9276 117.6805 58.4724 31.7902 176.2244 112 D 4.5193 7.8400 119.5415 52.4971 40.8879 175.0602 113 P 4.3992 0.0000 0.0000 65.6329 31.2845 178.4232 114 K 3.9088 8.0466 118.7288 59.2517 31.7024 178.9936 115 E 3.9636 8.1300 119.0174 59.4374 29.3779 179.4185 116 I 3.6868 7.6834 119.2966 64.3811 37.2070 178.2980 117 L 3.7454 8.0487 119.9080 57.5625 41.3443 179.7261 118 K 3.9320 8.0848 118.4647 59.4111 31.9831 179.5473 119 V 3.5195 7.4361 118.5231 65.9028 31.4571 177.9797 120 L 3.5463 7.6200 118.7113 57.5246 41.2810 179.3163 121 L 4.1087 8.0027 120.5034 58.3308 42.0764 178.8448 122 E 4.0040 8.4088 118.3729 59.3248 29.3489 179.2371 123 A 4.0565 8.0835 120.8401 55.3031 18.4603 179.6047 124 E 4.1233 8.4305 117.1576 59.7119 29.6899 179.5970 125 Q 4.0462 8.3935 118.2167 58.9785 28.6492 178.4195 126 C 4.0959 8.2066 119.5592 62.4750 31.6008 175.4592 127 A 3.9693 8.0934 122.3833 55.0952 17.8989 179.6600 128 I 3.7257 8.0386 118.3569 64.7785 37.3394 178.7619 129 R 3.9389 7.8383 118.2891 59.5656 29.5097 179.3206 130 T 3.6683 8.0856 115.6012 66.5550 68.4582 176.8232 131 W 4.4303 8.2037 120.6364 59.1667 29.1041 178.6918 132 K 3.9986 8.3736 120.1450 59.3449 31.3785 178.3815 133 E 3.9419 7.9189 118.6286 59.3123 29.6324 178.6643 134 V 3.8065 7.3460 116.6936 66.2050 31.9131 177.3696 135 C 4.5583 8.3916 116.5000 62.9893 27.7306 176.4797 136 D 4.3501 7.9263 115.8317 55.3743 40.0650 177.5606 *138 T 4.3086 7.8868 110.8791 61.1796 70.6846 172.8229 139 Y 3.8173 8.0219 124.1337 59.2124 38.7506 175.9824 140 G 3.5025 8.6578 114.6618 45.6621 0.0000 173.1652 141 K 4.3609 7.8159 116.5673 57.1994 35.9235 176.3969 142 D 4.7807 8.1667 120.6516 50.5738 41.4531 173.6710 143 P 4.3043 0.0000 0.0000 65.1986 31.5769 177.6461 144 R 3.8962 7.9626 116.8175 59.9180 30.1188 178.5166 145 T 3.9077 8.1002 115.0134 66.6479 68.4718 176.0815 146 Y 4.0756 8.2914 122.9412 60.1758 38.8747 177.5678 147 D 4.2774 8.3376 118.9059 57.4058 41.3343 178.3306 148 L 3.8277 7.8365 119.0669 57.6358 41.5810 179.3360 149 A 3.5627 7.9701 120.8349 54.9318 18.2505 179.3589 150 Q 3.6004 8.0623 118.3034 59.2770 28.7432 178.6998 151 R 3.7696 7.7586 118.9106 59.2979 30.0659 179.1384 152 I 3.1541 7.2396 119.1954 64.0840 36.9345 177.9197 153 L 3.8441 7.6874 121.5298 58.5057 41.6334 178.7569 154 Q 3.8521 8.0560 119.1765 59.4014 28.8542 178.3242 155 E 4.0056 7.6460 119.0735 59.0141 29.4296 179.0018 156 E 3.8259 8.1172 118.8812 59.2726 29.5138 179.3248 157 I 3.6240 7.7990 119.9152 64.4459 37.1844 178.2991 158 E 3.6959 7.6236 119.0918 59.5245 29.3045 179.1526 159 H 2.8578 7.5988 116.4284 58.3342 28.6684 177.3978 160 E 4.0668 8.3070 121.1094 59.3478 29.4968 178.6284 161 A 4.0434 7.8836 120.6819 54.9176 18.2821 179.5448 162 W 4.3004 7.8958 117.3197 60.2739 29.0851 178.8662 163 F 4.6662 7.7734 117.0106 60.4278 38.3604 177.8613 164 L 4.3197 8.6184 119.3683 57.9602 41.2152 179.1718 165 E 4.6090 8.1768 119.6254 58.5742 29.6010 178.7353 166 L 4.1969 7.6015 118.1471 57.6788 41.9682 179.0323 167 L 3.9532 8.1167 117.6161 57.4334 41.8912 176.8218 168 Y 4.7034 7.7574 113.8748 56.4349 40.3246 175.3812 169 G 4.0631 8.5226 107.3700 45.9655 0.0000 173.8666 170 R 4.3074 8.0481 121.6276 53.6775 30.3595 173.8690 171 P 4.6841 0.0000 0.0000 63.4404 31.5055 174.3526 172 S 4.8670 7.9114 112.9328 58.5659 70.0800 177.0261 173 G 4.2068 7.8608 113.9464 44.1247 0.0000 171.8676 174 H 4.2553 8.9134 125.5053 56.2015 29.9045 172.4971 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 7 E 8.43 4.34 0.00 1.98 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 2.21 2.31 0.00 8 P 0.00 4.30 0.00 2.26 2.04 0.00 3.77 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 1.98 2.02 0.00 9 K 8.72 3.93 0.00 1.74 1.77 0.00 1.73 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.42 1.60 7.81 10 V 8.09 4.20 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 1.05 0.00 0.00 0.98 0.00 0.00 11 V 8.19 3.75 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 0.99 0.00 0.00 0.93 0.00 0.00 12 G 8.13 3.72 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 0.00 0.00 0.00 13 V 7.53 3.92 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 1.10 0.00 0.00 0.93 0.00 0.00 14 E 8.19 4.12 0.00 2.21 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 2.33 2.52 0.00 15 I 7.62 3.79 1.86 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 1.74 0.52 0.96 0.00 0.00 16 L 7.81 4.17 0.00 2.02 1.75 0.99 0.98 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 17 E 8.10 4.00 0.00 2.15 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 2.40 2.57 0.00 18 K 7.94 3.97 0.00 1.73 1.87 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.59 7.81 19 S 7.66 4.43 0.00 3.91 3.87 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 20 G 7.88 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 21 L 7.76 4.05 0.00 1.60 1.75 0.94 1.25 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 22 D 8.55 4.56 0.00 2.75 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 23 I 8.18 3.83 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 1.53 0.62 0.91 0.00 0.00 24 K 8.04 3.91 0.00 1.81 1.79 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.48 7.81 25 K 8.12 3.95 0.00 1.82 1.93 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.43 7.81 26 L 7.86 3.90 0.00 1.91 1.82 0.97 1.00 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 27 V 8.15 3.55 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 0.95 0.00 0.00 0.96 0.00 0.00 28 D 8.05 4.27 0.00 2.95 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 29 K 8.00 3.93 0.00 1.98 1.77 0.00 1.79 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.57 1.60 7.81 30 L 8.17 3.98 0.00 1.99 1.76 1.05 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.03 3.62 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.98 0.00 0.00 32 K 8.16 4.14 0.00 1.90 1.80 0.00 1.69 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.65 1.40 7.81 33 A 8.00 3.59 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.52 4.27 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 1.39 0.00 0.00 35 A 8.49 4.18 1.52 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 0.00 0.00 36 A 7.94 4.18 1.38 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 37 E 8.10 4.08 0.00 2.60 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 2.97 2.93 0.00 38 F 8.33 3.82 0.00 2.69 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 39 T 8.13 3.88 4.55 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 1.38 0.00 0.00 40 T 8.08 3.75 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 0.28 0.00 0.00 41 Y 7.44 4.20 0.00 2.71 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 42 Y 7.26 3.66 0.00 2.63 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 43 Y 8.32 4.16 0.00 3.18 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 44 Y 8.80 4.21 0.00 3.06 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 45 T 7.14 3.76 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 1.01 0.00 0.00 46 I 7.27 3.73 1.88 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.01 0.78 0.00 0.00 47 L 7.73 4.09 0.00 1.47 1.56 0.75 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 48 R 8.09 4.08 0.00 1.99 2.01 0.00 3.14 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 *50 H 8.09 4.49 0.00 2.96 3.00 0.00 5.75 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 51 L 7.57 4.38 0.00 1.76 1.84 0.91 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 52 T 7.81 4.58 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 53 G 8.18 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 *55 E 9.28 4.17 0.00 2.00 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 2.20 2.31 0.00 56 G 7.67 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 57 E 7.79 4.07 0.00 2.38 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 2.30 2.37 0.00 58 G 7.96 3.75 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 0.00 59 L 7.62 4.23 0.00 1.80 1.77 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 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0.87 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 *78 T 7.71 4.05 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 79 Q 7.66 4.01 0.00 2.12 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.48 2.37 0.00 80 R 7.58 3.93 0.00 1.81 1.92 0.00 3.23 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 81 I 7.80 3.64 1.95 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 1.60 0.42 0.59 0.00 0.00 82 Y 7.76 4.31 0.00 3.17 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 83 E 8.14 4.07 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 84 L 7.72 4.40 0.00 1.76 1.69 0.93 1.00 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 85 G 8.13 3.84 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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3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 D 7.93 4.35 0.00 2.87 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 *138 T 7.89 4.31 4.58 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 1.36 0.00 0.00 139 Y 8.02 3.82 0.00 2.99 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 8.66 3.50 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 0.00 141 K 7.82 4.36 0.00 1.67 1.76 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.76 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.27 1.47 7.81 142 D 8.17 4.78 0.00 2.64 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 0.00 143 P 0.00 4.30 0.00 2.21 2.11 0.00 3.66 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 144 R 7.96 3.90 0.00 1.93 1.94 0.00 3.24 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.80 0.00 145 T 8.10 3.91 4.36 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 1.29 0.00 0.00 146 Y 8.29 4.08 0.00 3.20 3.07 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 0.00 147 D 8.34 4.28 0.00 3.02 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 0.00 148 L 7.84 3.83 0.00 1.66 1.55 0.89 0.75 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 0.00 149 A 7.97 3.56 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 8.06 3.60 0.00 1.23 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.72 0.00 0.00 0.00 0.00 0.00 2.21 2.44 0.00 151 R 7.76 3.77 0.00 1.97 1.82 0.00 3.10 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 152 I 7.24 3.15 0.88 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.17 -0.36 0.00 0.00 153 L 7.69 3.84 0.00 1.82 1.74 0.91 0.68 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 0.00 154 Q 8.06 3.85 0.00 2.30 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.60 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 155 E 7.65 4.01 0.00 2.05 1.78 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 2.42 2.40 0.00 156 E 8.12 3.83 0.00 2.08 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 2.38 2.73 0.00 157 I 7.80 3.62 1.95 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.97 0.86 0.00 0.00 158 E 7.62 3.70 0.00 1.69 1.49 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 2.27 2.39 0.00 159 H 7.60 2.86 0.00 3.23 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 E 8.31 4.07 0.00 2.14 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 2.41 2.43 0.00 161 A 7.88 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 W 7.90 4.30 0.00 2.88 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 0.00 163 F 7.77 4.67 0.00 3.22 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 0.00 164 L 8.62 4.32 0.00 1.99 1.87 1.03 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 165 E 8.18 4.61 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 166 L 7.60 4.20 0.00 1.91 1.77 1.11 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 167 L 8.12 3.95 0.00 1.67 0.79 0.89 0.61 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 0.00 168 Y 7.76 4.70 0.00 3.13 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 0.00 169 G 8.52 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 0.00 0.00 0.00 170 R 8.05 4.31 0.00 1.92 1.93 0.00 3.18 0.00 0.00 3.42 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 171 P 0.00 4.68 0.00 2.24 2.08 0.00 3.87 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 172 S 7.91 4.87 0.00 4.09 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 0.00 173 G 7.86 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 0.00 0.00 0.00 0.00 174 H 8.91 4.26 0.00 3.08 3.06 0.00 5.77 0.00 0.00 0.00 0.00 6.91 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.