NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.2302 8.1749 115.2408 61.7988 68.4914 172.9442 3 I 4.2122 8.2776 129.3336 60.1259 37.8099 174.2130 4 R 4.3306 9.7151 124.4566 55.9061 33.0190 175.1198 5 H 4.6591 10.1945 115.9274 54.3671 29.8981 173.2224 6 H 4.9274 8.3319 121.4338 53.4922 31.2227 174.3639 7 V 3.8340 8.0607 120.4512 62.1792 32.0703 176.4151 8 S 4.2777 8.5302 121.9244 58.6756 64.6071 174.8807 9 D 4.2849 8.7298 121.9532 57.7013 41.0729 178.6692 10 A 4.0180 7.9058 120.7684 54.9651 18.3564 179.4902 11 L 3.9729 7.8172 117.5512 57.7721 41.7042 179.6073 12 L 4.0308 8.1559 119.1276 58.1989 41.5867 179.6669 13 T 3.9649 8.3648 115.8311 66.6472 68.2628 176.5759 14 A 4.0744 7.9519 122.3966 54.9451 18.2812 179.1976 15 Y 3.9208 8.3928 118.3809 60.9865 38.7934 177.8748 16 A 4.0026 8.5017 120.3985 55.1243 18.4712 179.0021 17 A 4.1884 7.9866 118.3712 52.8748 18.6646 178.2309 18 G 3.6576 8.0861 105.2546 46.5472 0.0000 174.1898 19 T 4.3850 7.8465 108.2011 60.8877 69.5204 174.7366 20 L 4.3041 7.7277 123.5170 54.2943 42.5718 177.5638 21 S 4.3207 8.8406 118.3885 58.0693 65.0607 174.7945 22 E 3.8669 8.8397 124.2631 59.9553 29.3793 178.8918 23 A 3.7868 7.9696 119.6884 55.5394 18.2576 179.2289 24 F 4.4039 7.5921 114.5655 60.9858 39.0422 177.9778 25 S 4.3710 8.4355 114.6540 61.5437 62.6381 176.4670 26 L 3.8696 8.1784 123.3508 58.1823 41.8024 179.2579 27 V 3.5256 7.6326 117.4593 65.9997 31.5312 177.7656 28 V 3.5415 8.0196 117.8277 66.3177 31.3529 177.9346 29 A 3.7959 8.2704 120.3394 55.4754 18.0157 179.8044 30 T 3.9125 7.7640 113.2341 66.5921 68.7184 176.3406 31 H 4.3195 8.2370 120.5763 59.2348 29.5742 177.0790 32 L 4.0037 8.0214 121.1930 57.7269 41.2302 178.8631 33 S 4.4061 7.7568 110.7419 59.0369 63.3728 174.4370 34 L 4.4532 8.1269 122.1036 54.7782 43.8699 175.6894 35 C 4.6142 7.2942 118.0193 56.8435 32.3392 173.9201 36 D 4.4844 8.5034 128.0348 56.4023 40.4553 178.2343 37 E 3.8353 7.9800 120.1591 59.6474 29.8171 178.3994 38 C 4.1796 7.9271 116.1550 62.5213 28.1208 175.9040 39 R 3.8398 7.9226 120.2911 59.3496 29.7584 178.4012 40 A 4.0915 7.8884 120.2876 54.7477 18.3316 179.9599 41 R 3.8504 7.8285 116.2950 59.2842 30.1329 178.7600 42 A 4.1191 8.4063 121.1870 55.3621 18.3351 179.8870 43 G 3.8574 7.9932 103.5408 47.3550 0.0000 175.7825 44 A 4.0572 7.6654 121.8635 54.7817 18.6071 179.4900 45 L 4.0995 8.1020 117.7015 58.1556 41.8873 179.2806 46 D 4.3721 8.8914 119.0115 57.5031 40.8446 178.8080 47 A 4.0439 7.9807 121.1375 55.1850 18.2898 179.8513 48 V 3.7280 8.0741 117.1018 65.7703 31.3100 178.6348 49 G 3.6657 7.9370 104.8459 47.6621 0.0000 175.6065 50 G 3.7804 8.2511 107.4990 47.4386 0.0000 175.5874 51 S 4.4319 7.9233 117.0393 61.0351 61.5353 177.2472 52 L 4.2354 7.6831 119.4896 55.1962 41.0520 178.5538 *54 E 4.2398 8.1680 121.0790 55.7831 31.2044 175.6699 55 E 4.5003 7.8682 117.2499 56.0891 29.6149 174.8174 56 T 4.2785 7.1100 114.1336 61.2019 69.4723 174.0128 57 A 3.9347 8.7337 129.6647 51.6588 18.3720 175.2892 58 P 4.2712 0.0000 0.0000 63.6140 31.6696 176.3438 59 V 4.1642 8.0218 118.6711 60.6081 32.9934 175.0310 60 A 3.9814 8.6285 129.9613 52.9200 18.5859 176.7345 61 L 4.5732 8.1051 121.2233 52.7944 43.8053 176.8349 62 S 4.2342 8.2911 114.7245 58.1430 63.4494 173.8617 63 E 4.0540 8.5980 122.3739 58.3025 29.9024 177.9614 64 G 4.0148 8.8574 109.0101 46.1852 0.0000 175.6866 65 S 4.0737 7.9016 116.0793 61.6946 62.6002 176.2818 66 L 3.9177 7.8640 120.5671 58.2165 41.9655 178.3968 67 A 4.1201 7.8743 118.9462 54.9785 18.4338 179.0836 68 S 4.2058 8.3325 111.1483 61.3463 62.5567 178.8368 69 V 3.7839 8.2625 122.2082 62.6656 30.9532 177.4845 *71 A 4.3426 8.0075 121.4950 51.8237 20.3860 177.6034 72 Q 4.5151 7.5850 112.5054 56.3987 29.2632 175.5636 73 L 4.8018 7.8785 119.2039 53.7751 45.5882 175.4030 74 D 4.3973 8.8782 121.9791 53.5909 37.8688 176.0382 *88 P 4.4935 0.0000 0.0000 62.8717 33.4973 177.8281 89 R 4.4253 8.0768 112.4512 55.8362 30.5014 176.0448 90 A 4.7628 7.6070 120.7317 50.1628 18.6762 173.8821 91 P 4.5181 0.0000 0.0000 61.8973 34.0207 179.1673 92 A 3.4479 8.4729 121.4475 52.6080 17.4284 177.8940 93 P 4.6134 0.0000 0.0000 66.3022 31.9149 178.1210 94 L 3.8715 7.5753 116.9111 58.5729 41.3214 179.0012 95 A 4.0812 8.0179 120.0650 55.2208 18.0807 179.1651 96 D 4.3921 8.9667 117.4807 56.7384 40.7282 177.4185 97 Y 4.3271 8.1531 115.2330 56.2771 38.7212 175.8869 98 V 4.2573 7.4827 116.2328 62.1983 31.3525 178.3149 99 G 3.9026 8.6426 110.5350 46.8012 0.0000 175.3504 100 R 4.3012 8.9743 122.1445 58.0249 30.3675 175.3650 101 R 4.5826 7.9354 114.1842 55.7489 30.7235 181.3196 102 L 3.6656 7.6830 126.1638 57.2573 44.2026 178.0629 103 E 4.5262 8.6417 115.3290 58.4603 29.5344 177.5774 104 D 4.5621 7.5508 118.1385 56.1944 41.3658 177.6472 105 V 3.5779 7.3173 111.3376 60.7285 32.1269 175.7844 106 R 3.9794 8.2080 121.1757 56.8124 30.0499 176.0606 107 W 4.5541 8.4435 123.5024 56.2248 30.3842 176.5120 108 R 4.5115 8.9801 122.7880 54.4194 31.7342 174.3928 109 T 4.1720 8.5222 122.6823 64.3924 68.7005 173.6633 110 L 4.2116 8.6985 122.2360 56.5676 42.6244 175.0102 111 G 4.1473 8.6938 110.6492 45.0199 0.0000 171.3395 112 G 4.0131 7.4644 106.6971 44.6314 0.0000 176.5843 113 G 3.9366 8.7196 109.6917 44.4517 0.0000 172.9613 114 V 5.1893 7.2260 114.2776 62.5636 32.8306 175.7341 115 R 4.2873 7.6603 117.2092 53.5424 32.0066 175.1503 116 Q 5.3383 9.0953 118.1100 55.0189 32.3821 173.5586 117 A 5.1804 9.4542 124.0369 49.3328 22.4676 174.9074 118 I 4.7786 8.1582 119.2149 59.4428 40.1510 175.2662 119 L 4.8025 8.4100 125.9897 52.0364 43.4289 174.7589 120 P 4.4126 0.0000 0.0000 62.9739 33.0190 174.8938 121 T 4.1095 9.1470 115.1747 61.0575 67.4397 176.6741 122 G 4.1027 9.1149 108.1107 45.4301 0.0000 172.6677 123 G 3.8601 8.3215 109.2661 45.3752 0.0000 173.1401 124 E 4.0836 8.5803 116.0916 58.5861 29.8792 177.8680 125 A 4.2726 7.6423 118.8457 51.6204 19.2352 176.9715 126 I 4.4959 8.1269 120.0167 59.3787 40.3875 174.5530 127 A 5.3375 8.2115 126.6295 50.4277 22.4292 175.0846 128 R 4.8252 9.0744 115.3874 55.2488 33.6512 173.9749 129 L 5.1270 8.6635 121.4385 53.7127 43.4099 175.3724 130 L 5.3384 8.6729 124.5668 52.8818 44.1970 175.4081 131 W 4.7344 10.1132 134.9277 55.7641 32.7248 174.7119 132 I 4.4466 7.7590 128.2360 59.0060 39.4814 173.5391 133 P 5.8500 0.0000 0.0000 61.9604 31.8476 177.0092 134 G 3.5811 9.0744 107.5904 48.7487 0.0000 175.0108 135 G 3.6897 7.6891 105.7093 47.5911 0.0000 172.9927 136 Q 3.4368 7.0390 118.7483 53.7086 30.2041 176.3464 137 A 4.6527 8.2463 127.9525 50.4925 21.0530 176.6229 138 V 3.9234 7.9067 119.8790 61.0284 32.5213 174.2169 139 P 4.2636 0.0000 0.0000 63.8161 31.4044 175.8172 140 D 4.6946 8.1826 120.0429 53.0710 40.5180 176.2656 *141 H 4.4769 7.9323 120.0214 53.4431 31.4883 169.0020 142 G 4.1372 8.4233 105.2191 45.3732 0.0000 171.9752 143 H 4.7899 8.3592 117.8507 54.4840 31.7146 176.4786 144 R 4.2976 8.5568 126.1136 53.7725 27.4978 171.9305 145 G 4.0903 7.2431 107.7321 44.3071 0.0000 169.8392 146 L 4.1835 7.9689 122.0921 54.7880 43.2665 175.7568 147 E 5.1282 8.6659 126.3392 54.4228 32.5202 174.3660 148 L 4.8431 8.9380 127.0240 53.3662 44.3550 175.5743 149 T 4.6611 8.5425 120.4137 61.8407 71.4584 172.7708 150 L 5.0158 8.6006 129.0578 53.3474 44.6545 175.4041 151 V 4.6541 8.3449 124.1656 61.8006 33.2807 176.0506 152 L 4.7331 8.9445 123.9112 54.9858 44.6060 176.8993 153 Q 4.3040 8.0783 119.2567 55.5799 32.3474 173.3074 154 G 3.9794 9.8866 112.3472 44.5562 0.0000 171.9194 155 A 5.3786 8.3498 124.4845 52.5415 22.4860 174.8456 156 F 5.0304 7.6618 113.8359 56.8743 40.9498 174.3562 157 R 5.0271 8.6755 124.4242 55.9466 31.5859 175.1626 *161 D 4.3248 8.2455 118.5926 53.0879 41.4081 174.2907 162 R 4.4495 7.6027 114.9155 56.0896 32.9471 175.7728 163 F 4.4526 8.5739 123.0591 56.1112 42.3487 173.8241 164 G 4.7450 8.1959 113.6353 43.4609 0.0000 170.1931 165 A 4.1825 8.6291 122.8012 54.4577 18.2789 178.0254 166 G 4.0929 8.5365 112.2583 45.5215 0.0000 173.4841 167 D 4.6867 7.9702 119.7638 54.2468 42.0768 175.3053 168 I 5.0974 8.2152 122.0020 58.3738 41.0037 173.5531 169 E 4.3185 8.8600 130.4763 54.2519 36.2748 176.8770 170 I 4.8240 7.3064 117.7154 60.9300 40.3037 170.9583 *179 P 4.5676 0.0000 0.0000 62.8077 32.2626 176.5410 180 V 4.3901 9.2295 116.5368 60.5198 34.4559 175.0168 181 A 4.5524 8.9109 132.1250 52.6013 18.6109 177.4335 182 E 4.1005 8.5454 122.1933 57.9083 30.2308 175.2647 183 R 4.9087 8.0485 122.0417 55.2659 30.0283 172.2106 184 G 4.0119 8.1027 109.1358 45.7090 0.0000 174.6253 185 L 4.8567 7.7656 120.8936 51.8416 45.4624 178.7381 186 D 4.2762 8.5808 122.0724 53.8428 41.9660 175.4949 187 C 5.2289 8.4684 124.0339 58.3059 32.1968 171.7563 188 I 4.4189 7.9282 127.6506 60.1250 38.8315 174.9500 189 C 5.3259 8.9473 123.5691 57.7466 32.9503 172.4941 190 L 5.1518 9.1426 121.6472 53.5035 44.1708 174.9427 191 A 5.7899 9.4959 127.8981 49.3446 22.7562 174.6341 192 A 5.0677 8.3995 120.5416 50.7650 22.4905 175.2711 193 T 5.1376 8.9191 121.6353 63.1382 72.4805 175.0929 194 D 4.9128 9.4340 122.7962 53.9633 40.4207 173.5791 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 2 T 8.17 4.23 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 1.19 0.00 0.00 3 I 8.28 4.21 1.93 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 0.82 1.02 0.00 0.00 4 R 9.72 4.33 0.00 1.46 1.77 0.00 3.03 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.52 0.00 5 H 10.19 4.66 0.00 3.40 3.48 0.00 5.78 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 H 8.33 4.93 0.00 3.15 3.26 0.00 5.69 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.06 3.83 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 0.78 0.00 0.00 0.89 0.00 0.00 8 S 8.53 4.28 0.00 4.07 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 9 D 8.73 4.28 0.00 2.81 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 10 A 7.91 4.02 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 11 L 7.82 3.97 0.00 1.86 1.70 0.81 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.16 4.03 0.00 1.98 1.74 0.88 0.67 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 13 T 8.36 3.96 4.26 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 1.23 0.00 0.00 14 A 7.95 4.07 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 15 Y 8.39 3.92 0.00 3.10 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 16 A 8.50 4.00 1.46 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 0.00 0.00 17 A 7.99 4.19 1.37 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 0.00 0.00 18 G 8.09 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 19 T 7.85 4.38 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 1.21 0.00 0.00 20 L 7.73 4.30 0.00 1.77 1.81 1.15 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.84 4.32 0.00 4.04 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 22 E 8.84 3.87 0.00 2.07 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 2.43 2.50 0.00 23 A 7.97 3.79 0.99 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 24 F 7.59 4.40 0.00 3.27 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 25 S 8.44 4.37 0.00 4.15 4.09 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 26 L 8.18 3.87 0.00 1.59 1.76 0.59 -0.07 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 V 7.63 3.53 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 0.96 0.00 0.00 0.94 0.00 0.00 28 V 8.02 3.54 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 0.78 0.00 0.00 1.02 0.00 0.00 29 A 8.27 3.80 1.48 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 0.00 0.00 0.00 30 T 7.76 3.91 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 1.25 0.00 0.00 31 H 8.24 4.32 0.00 3.26 3.48 0.00 5.80 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 32 L 8.02 4.00 0.00 1.77 1.63 0.42 0.69 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 33 S 7.76 4.41 0.00 4.06 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 34 L 8.13 4.45 0.00 1.66 1.70 0.94 0.79 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 35 C 7.29 4.61 0.00 2.78 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 36 D 8.50 4.48 0.00 2.71 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 E 7.98 3.84 0.00 2.02 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 2.18 2.26 0.00 38 C 7.93 4.18 0.00 2.99 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 39 R 7.92 3.84 0.00 2.15 2.00 0.00 3.22 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 40 A 7.89 4.09 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 41 R 7.83 3.85 0.00 2.00 1.98 0.00 3.12 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.86 0.00 42 A 8.41 4.12 1.37 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 0.00 0.00 43 G 7.99 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 0.00 0.00 0.00 44 A 7.67 4.06 1.37 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 0.00 0.00 45 L 8.10 4.10 0.00 2.06 1.77 0.94 1.05 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 46 D 8.89 4.37 0.00 2.81 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 47 A 7.98 4.04 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 48 V 8.07 3.73 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 1.01 0.00 0.00 0.94 0.00 0.00 49 G 7.94 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 0.00 0.00 0.00 50 G 8.25 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 0.00 0.00 0.00 51 S 7.92 4.43 0.00 4.05 3.91 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2.07 0.00 3.95 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 92 A 8.47 3.45 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 93 P 0.00 4.61 0.00 2.25 2.26 0.00 3.96 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.12 0.00 94 L 7.58 3.87 0.00 1.64 1.90 0.97 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.02 4.08 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 0.00 0.00 0.00 0.00 0.00 96 D 8.97 4.39 0.00 2.65 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 97 Y 8.15 4.33 0.00 2.98 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 98 V 7.48 4.26 2.12 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 0.77 0.00 0.00 1.03 0.00 0.00 99 G 8.64 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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9.10 5.34 0.00 2.28 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.68 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 117 A 9.45 5.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 8.16 4.78 1.85 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 1.34 0.70 0.90 0.00 0.00 119 L 8.41 4.80 0.00 1.54 1.62 0.79 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.41 0.00 2.19 2.10 0.00 3.88 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 2.08 1.96 0.00 121 T 9.15 4.11 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 0.00 122 G 9.11 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 0.00 123 G 8.32 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 0.00 0.00 0.00 124 E 8.58 4.08 0.00 1.95 2.01 0.00 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0.00 0.00 0.00 0.00 0.00 *141 H 7.93 4.48 0.00 2.86 2.83 0.00 7.11 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.42 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 0.00 143 H 8.36 4.79 0.00 3.24 3.24 0.00 5.90 0.00 0.00 0.00 0.00 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 R 8.56 4.30 0.00 1.83 1.76 0.00 3.34 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.19 0.00 145 G 7.24 4.09 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 0.00 0.00 0.00 146 L 7.97 4.18 0.00 1.69 1.43 0.79 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.67 5.13 0.00 1.86 1.58 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 2.11 2.28 0.00 148 L 8.94 4.84 0.00 1.79 1.60 0.99 0.18 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 0.00 149 T 8.54 4.66 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 1.20 0.00 0.00 150 L 8.60 5.02 0.00 1.78 1.51 1.06 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 151 V 8.34 4.65 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 0.96 0.00 0.00 1.13 0.00 0.00 152 L 8.94 4.73 0.00 1.64 1.86 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 8.08 4.30 0.00 2.05 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 5.35 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 154 G 9.89 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 0.00 155 A 8.35 5.38 1.18 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 0.00 156 F 7.66 5.03 0.00 3.13 3.16 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 0.00 157 R 8.68 5.03 0.00 1.48 1.83 0.00 3.28 0.00 0.00 3.30 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.29 0.00 *161 D 8.25 4.32 0.00 2.62 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 0.00 162 R 7.60 4.45 0.00 1.58 1.55 0.00 3.05 0.00 0.00 3.13 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.41 0.00 163 F 8.57 4.45 0.00 1.81 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.20 4.75 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 0.00 165 A 8.63 4.18 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 0.00 166 G 8.54 4.09 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 0.00 0.00 0.00 167 D 7.97 4.69 0.00 2.90 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 0.00 168 I 8.22 5.10 1.73 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.88 0.75 0.00 0.00 169 E 8.86 4.32 0.00 1.16 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 1.87 1.66 0.00 170 I 7.31 4.82 1.84 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 1.37 0.21 0.92 0.00 0.00 *179 P 0.00 4.57 0.00 2.55 3.33 0.00 3.72 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.18 0.00 180 V 9.23 4.39 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 0.99 0.00 0.00 0.95 0.00 0.00 181 A 8.91 4.55 1.29 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 0.00 0.00 0.00 182 E 8.55 4.10 0.00 1.81 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 2.26 2.15 0.00 183 R 8.05 4.91 0.00 1.82 1.76 0.00 3.11 0.00 0.00 3.89 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.17 0.00 184 G 8.10 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 0.00 185 L 7.77 4.86 0.00 1.39 1.39 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 186 D 8.58 4.28 0.00 2.23 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 0.00 0.00 0.00 187 C 8.47 5.23 0.00 3.22 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 0.00 188 I 7.93 4.42 1.81 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.16 1.11 0.00 0.00 189 C 8.95 5.33 0.00 2.88 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 0.00 190 L 9.14 5.15 0.00 1.71 1.51 0.94 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 191 A 9.50 5.79 1.21 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 0.00 192 A 8.40 5.07 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 0.00 0.00 0.00 0.00 0.00 193 T 8.92 5.14 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 1.31 0.00 0.00 194 D 9.43 4.91 0.00 2.81 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 * Residues marked with a * may have inaccurate shift predictions.