NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 63 P 4.5248 0.0000 0.0000 62.7836 31.4818 175.2014 64 Q 4.3750 8.0549 120.9421 54.1753 31.5799 172.9953 65 I 4.2275 8.9094 122.1800 59.5715 39.0627 175.6321 66 P 4.4529 0.0000 0.0000 62.7725 31.7596 176.7089 67 K 4.0638 8.4775 119.9327 58.3760 32.6237 176.8148 68 D 4.5760 7.9489 118.7293 53.0679 40.3414 176.5997 69 K 4.2048 8.6837 126.3762 58.1820 32.1215 177.8332 70 S 4.5598 8.1830 113.0481 58.7091 62.9832 174.0639 71 K 4.5055 7.9784 119.6869 55.0593 33.0727 176.5897 72 V 3.1048 8.1128 122.0093 62.7807 32.0555 175.5874 73 A 4.3637 8.4077 128.8563 53.6872 20.1215 177.3232 74 G 4.1784 7.3480 100.6251 46.9883 0.0000 171.9533 75 Y 5.5453 8.2882 118.1243 55.8258 42.2111 174.1076 76 I 4.9629 8.6132 120.2451 59.2418 42.0096 173.6073 77 E 4.9429 9.2243 128.7106 54.7620 33.3034 174.3287 78 I 4.7782 9.2149 127.3146 58.4767 38.7575 173.9043 79 P 4.2522 0.0000 0.0000 65.7092 31.4982 178.7273 80 D 4.4115 8.2353 114.9900 56.3328 40.7693 176.8202 81 A 4.5154 7.8439 119.7734 50.9993 19.9348 175.7445 82 D 4.4241 7.8299 114.4486 55.5064 38.7978 173.7577 83 I 4.4268 7.6276 119.3059 59.5644 39.6306 175.3434 84 K 4.6653 8.6657 128.0032 54.7697 34.1714 174.4734 85 E 4.8264 9.3874 128.3374 53.5669 33.3532 172.8866 86 P 4.8880 0.0000 0.0000 62.4847 32.6106 175.6352 87 V 4.4455 8.9101 123.7506 61.4947 33.7567 174.6554 88 Y 4.7479 9.0681 125.7064 56.1393 40.5121 174.6690 89 P 4.9843 0.0000 0.0000 63.5999 33.0599 176.6533 90 G 3.9262 8.8191 109.2714 45.7287 0.0000 171.0613 91 P 4.6196 0.0000 0.0000 62.3775 32.0514 177.6275 92 A 4.3676 8.4165 125.7121 51.6012 16.6638 177.7563 93 T 4.5195 7.4940 114.1961 59.0623 72.7335 173.9942 94 P 4.3855 0.0000 0.0000 65.8428 30.9423 178.5232 95 E 3.8779 7.9006 116.3787 59.3346 29.9358 178.4932 96 Q 4.0544 7.7462 117.9769 59.0473 27.3807 178.7505 97 L 4.5473 8.2754 121.0371 56.5876 41.3187 178.7574 98 N 4.6478 7.7389 116.1802 55.9045 38.9270 176.7489 99 R 3.9805 8.2183 119.5504 56.4891 30.7549 176.5623 100 G 3.8854 6.7356 103.7894 44.8601 0.0000 171.0085 101 V 3.5082 7.4867 118.2095 63.9577 32.1906 175.3289 102 S 5.0804 8.5696 121.7915 56.3866 67.7671 173.3388 103 F 4.6029 8.4625 120.3686 57.6902 38.9249 175.6904 104 A 4.2347 9.4510 125.8998 54.7874 19.1019 177.5585 105 E 5.0081 7.8387 111.7965 54.6294 32.0512 175.6016 106 E 4.3139 8.4786 119.2417 58.1855 30.1585 177.1503 107 N 4.3536 8.1623 113.6987 53.6283 39.0506 174.5291 108 E 3.7707 7.1255 118.7830 56.4124 30.2940 176.2096 109 S 4.5704 8.2386 118.3213 56.3492 65.3002 174.3777 110 L 4.3526 8.6202 126.1495 56.4394 41.5199 177.0823 111 D 4.8265 7.7618 117.5086 54.0925 41.8867 176.4048 112 D 4.6763 7.6312 119.0594 53.7527 41.8476 176.3281 113 Q 4.2511 8.8111 119.6957 58.6640 29.6769 176.3692 114 N 5.4975 8.1169 115.3807 51.6724 42.0491 173.4962 115 I 4.8360 8.4239 125.9122 59.6453 40.6263 174.4463 116 S 5.2809 9.3672 122.7307 56.8821 65.5338 173.2713 117 I 5.0302 8.9802 124.7456 59.5190 40.8496 174.4635 118 A 5.2759 8.9619 128.5372 50.5872 22.4244 175.1358 119 G 3.4752 8.1263 104.2077 45.0586 0.0000 172.9786 120 H 4.6935 8.8969 118.2638 55.4968 30.2904 175.1623 121 T 4.6851 8.3701 115.9903 62.1732 71.4918 174.2327 122 F 5.0953 9.7574 130.4715 56.0938 40.3950 174.4676 123 I 3.7563 8.5656 121.6166 63.7462 37.2886 177.5506 124 D 4.1768 7.1983 119.3988 56.3492 40.8446 176.6925 125 R 4.4458 7.3353 118.4003 52.5983 30.4075 173.9121 126 P 4.2004 0.0000 0.0000 65.1927 31.7633 177.3421 127 N 4.9543 7.9725 112.7485 52.9806 39.2105 173.5633 128 Y 4.6285 8.2923 120.6301 58.2003 40.8943 175.6449 129 Q 2.8097 8.0725 125.6905 57.3605 28.9417 174.5302 130 F 5.0711 7.2921 124.5927 58.6348 39.0064 177.7915 131 T 3.9181 8.1697 121.1546 66.2929 68.3989 174.9071 132 N 4.7870 7.9811 117.5381 53.0387 39.2110 175.8716 133 L 3.6691 7.5975 121.5155 57.5936 42.0702 179.2458 134 K 4.2034 7.9916 116.3532 59.3134 32.5080 177.6119 135 A 4.0661 8.0653 121.6947 53.4916 18.5069 177.0407 136 A 4.3017 7.8902 120.4622 50.9534 19.4373 177.3430 137 K 4.5246 8.2385 121.9858 54.2514 35.0986 175.5867 138 K 4.1005 8.3607 120.3914 58.4299 32.2093 176.6656 139 G 4.1006 8.9075 114.2415 45.4664 0.0000 176.4961 140 S 4.3519 7.9817 116.6759 57.8065 62.4981 173.4501 *142 V 3.9404 8.2474 124.1042 64.0604 32.9708 174.4811 143 Y 5.2498 9.1129 125.8709 56.2150 40.8530 174.4336 144 F 5.5445 9.8808 126.7434 56.5374 42.5678 173.5449 145 K 5.3395 8.9875 125.7398 52.9100 34.9346 174.6541 146 V 4.2946 7.9981 117.1329 60.8818 30.9893 177.5376 147 G 3.6881 8.0881 114.4774 49.4917 0.0000 173.8938 148 N 4.8195 7.5922 115.9497 51.9872 38.2776 174.1451 149 E 4.8037 8.1621 117.1881 55.8308 33.1298 175.1297 150 T 4.9364 8.0057 117.1492 61.2845 67.8014 173.6404 151 R 4.0127 8.5767 122.5871 56.7638 31.9275 176.2375 152 K 5.0630 8.3174 121.4894 54.8929 35.5776 174.7178 153 Y 5.2068 9.0402 121.0192 55.2356 42.4839 176.7854 154 K 5.0301 9.5164 122.4631 56.2944 35.3013 177.8495 *156 T 4.5836 8.4295 109.6149 61.2367 69.3195 173.0583 157 S 4.2183 8.4682 113.9280 59.9686 63.6456 174.4271 158 I 4.0520 7.6776 123.6802 60.4748 35.7157 174.5823 159 R 4.2392 7.8526 119.9462 55.5386 32.2371 174.5746 160 D 3.6385 6.0500 117.8865 55.5950 40.2299 173.8395 161 V 4.4016 6.6674 110.0298 58.9497 35.4466 176.2690 162 K 4.3872 8.2701 122.3006 55.6410 33.0712 176.2841 163 P 4.2614 0.0000 0.0000 66.0854 31.3425 178.9749 164 T 4.0108 7.8360 106.0272 63.8677 68.9119 174.4550 165 D 4.6201 7.7744 121.1767 53.9854 40.8886 176.1828 166 V 3.8742 7.5332 120.7460 61.4581 31.6967 176.3257 167 G 3.8166 9.5481 117.9214 45.3078 0.0000 174.4201 168 V 3.7038 8.3293 120.4196 63.3836 31.5652 176.6743 169 L 4.6621 7.7487 120.5956 54.8956 42.3576 176.2449 170 D 4.4990 8.0256 119.1403 55.7237 41.2866 176.6001 171 E 4.4173 7.9419 117.8259 55.6199 31.5739 175.1935 172 Q 3.2806 8.7819 120.3298 56.6033 25.4431 173.4046 173 K 4.0175 7.5891 117.8820 58.9328 34.3204 179.3922 174 G 4.1979 7.2230 107.2020 45.7592 0.0000 174.3590 175 K 4.2917 8.8993 126.5639 56.1610 32.5542 175.7618 176 D 4.4983 7.8817 118.5759 54.5510 41.5383 176.2293 177 K 4.4428 8.5155 122.5842 56.9215 33.6921 175.4506 178 Q 5.1474 9.6136 122.2983 54.4921 33.3710 173.3064 179 L 4.8345 8.6641 125.0464 53.4252 45.2268 175.0531 180 T 4.8874 9.0605 123.4904 61.9643 70.7975 173.1667 181 L 5.0822 8.9185 127.6781 53.1354 44.1795 175.8417 182 I 5.2256 8.7713 124.0030 59.7103 40.9606 174.4578 183 T 5.0085 8.8175 117.5270 60.6543 70.3653 173.4853 184 A 4.9988 8.6789 127.4525 50.1899 21.8028 174.6185 185 D 4.6189 9.2168 120.0421 53.1173 45.6858 173.9956 186 D 4.7475 8.7311 118.9123 55.5493 38.2175 173.3075 187 Y 4.0675 7.5949 120.6651 57.1464 40.1044 173.6195 188 N 4.4779 7.3422 125.9639 51.2283 39.1791 174.8522 189 E 4.0921 8.3324 124.7901 58.8562 30.0715 178.9239 190 K 4.0123 8.0981 119.2562 59.2983 32.0050 177.9889 191 T 4.2252 7.7052 104.9247 60.5136 69.7901 174.1467 192 G 3.9316 8.1604 110.5243 45.7919 0.0000 173.8009 193 V 4.3858 6.7179 117.8892 60.1686 35.1667 174.1761 194 W 4.2832 9.1061 127.7432 56.8302 28.5768 175.9394 195 E 4.1271 9.4265 126.8221 58.3671 29.9719 177.4505 196 K 4.5967 8.6541 119.6853 54.8407 33.7902 175.8595 197 R 5.8078 8.5159 123.0420 53.2195 34.1692 175.3434 198 K 4.8013 8.3718 120.2100 54.8429 36.6498 175.2719 199 I 4.9108 8.7604 124.9952 59.7535 40.0113 174.7902 200 F 4.9929 9.1687 124.0531 55.7765 42.6503 173.7414 201 V 4.8464 8.8908 124.3505 60.9021 33.5642 174.5087 202 A 4.9292 8.9068 129.6564 50.4446 21.7875 175.0011 203 T 4.6914 8.7626 120.0160 62.2667 70.2998 174.2683 204 E 4.1623 8.9636 127.6587 56.6755 30.1277 176.4288 205 V 4.6173 8.2992 119.7833 58.9895 35.4332 175.9734 206 K 4.0820 8.5070 121.1989 57.2367 32.7162 176.8288 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 63 P 0.00 4.52 0.00 2.20 2.18 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.10 0.00 64 Q 8.05 4.37 0.00 2.20 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.84 0.00 0.00 0.00 0.00 0.00 2.22 2.45 0.00 65 I 8.91 4.23 1.81 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.43 1.00 0.00 0.00 66 P 0.00 4.45 0.00 2.10 2.02 0.00 3.77 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 67 K 8.48 4.06 0.00 1.77 1.89 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.43 7.81 68 D 7.95 4.58 0.00 2.71 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.68 4.20 0.00 1.83 2.06 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.48 7.81 70 S 8.18 4.56 0.00 3.89 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 71 K 7.98 4.51 0.00 1.81 1.74 0.00 1.81 0.00 0.00 1.69 0.00 0.00 3.21 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.54 7.81 72 V 8.11 3.10 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 0.61 0.00 0.00 0.47 0.00 0.00 73 A 8.41 4.36 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 74 G 7.35 4.18 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 0.00 75 Y 8.29 5.55 0.00 3.13 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 76 I 8.61 4.96 1.94 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.13 0.99 0.00 0.00 77 E 9.22 4.94 0.00 1.60 1.62 0.00 0.00 0.00 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 2.45 0.00 78 I 9.21 4.78 1.77 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.34 0.83 0.00 0.00 79 P 0.00 4.25 0.00 2.27 2.20 0.00 3.76 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.26 0.00 80 D 8.24 4.41 0.00 2.66 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 81 A 7.84 4.52 1.23 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 82 D 7.83 4.42 0.00 2.87 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 83 I 7.63 4.43 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.16 0.97 0.00 0.00 84 K 8.67 4.67 0.00 1.75 1.74 0.00 1.90 0.00 0.00 1.93 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.67 7.81 85 E 9.39 4.83 0.00 2.03 1.69 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 2.04 2.26 0.00 86 P 0.00 4.89 0.00 2.01 1.88 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 87 V 8.91 4.45 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 0.26 0.00 0.00 0.94 0.00 0.00 88 Y 9.07 4.75 0.00 2.92 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 89 P 0.00 4.98 0.00 2.18 2.30 0.00 4.24 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.23 0.00 90 G 8.82 3.93 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 0.00 0.00 0.00 91 P 0.00 4.62 0.00 2.13 2.07 0.00 3.74 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 2.08 2.14 0.00 92 A 8.42 4.37 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 93 T 7.49 4.52 4.13 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 0.00 0.00 0.00 1.26 0.00 0.00 94 P 0.00 4.39 0.00 1.87 1.88 0.00 3.04 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.44 0.00 95 E 7.90 3.88 0.00 1.91 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 0.00 2.25 2.37 0.00 96 Q 7.75 4.05 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.71 0.00 97 L 8.28 4.55 0.00 1.68 1.56 0.04 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 98 N 7.74 4.65 0.00 2.89 3.01 0.00 0.00 7.20 7.13 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 99 R 8.22 3.98 0.00 1.34 0.66 0.00 3.44 0.00 0.00 2.92 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.61 0.00 100 G 6.74 3.89 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 0.00 0.00 0.00 101 V 7.49 3.51 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 0.47 0.00 0.00 0.17 0.00 0.00 102 S 8.57 5.08 0.00 3.74 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 0.00 103 F 8.46 4.60 0.00 3.02 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 0.00 104 A 9.45 4.23 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 0.00 105 E 7.84 5.01 0.00 1.92 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 2.29 2.38 0.00 106 E 8.48 4.31 0.00 2.04 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 2.36 0.00 107 N 8.16 4.35 0.00 2.74 2.85 0.00 0.00 6.80 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 0.00 108 E 7.13 3.77 0.00 1.90 1.61 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 2.00 2.09 0.00 109 S 8.24 4.57 0.00 3.80 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 0.00 110 L 8.62 4.35 0.00 1.71 1.80 0.98 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 111 D 7.76 4.83 0.00 2.68 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 0.00 112 D 7.63 4.68 0.00 2.65 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 0.00 113 Q 8.81 4.25 0.00 1.99 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.86 0.00 0.00 0.00 0.00 0.00 2.47 2.33 0.00 114 N 8.12 5.50 0.00 2.69 2.65 0.00 0.00 6.76 7.94 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 0.00 115 I 8.42 4.84 1.77 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.61 0.93 0.00 0.00 116 S 9.37 5.28 0.00 3.81 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 0.00 117 I 8.98 5.03 1.81 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.65 0.80 0.00 0.00 118 A 8.96 5.28 1.04 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 0.00 119 G 8.13 3.48 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 0.00 120 H 8.90 4.69 0.00 2.79 3.23 0.00 5.77 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 T 8.37 4.69 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 1.30 0.00 0.00 122 F 9.76 5.10 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 0.00 123 I 8.57 3.76 1.83 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 1.45 0.61 0.95 0.00 0.00 124 D 7.20 4.18 0.00 1.58 2.23 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 0.00 125 R 7.34 4.45 0.00 1.78 1.80 0.00 3.05 0.00 0.00 3.04 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.32 0.00 126 P 0.00 4.20 0.00 2.03 2.13 0.00 3.59 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 2.00 2.24 0.00 127 N 7.97 4.95 0.00 2.73 2.84 0.00 0.00 6.81 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 0.00 128 Y 8.29 4.63 0.00 2.98 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 0.00 129 Q 8.07 2.81 0.00 1.52 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.24 0.00 0.00 0.00 0.00 0.00 1.64 1.16 0.00 130 F 7.29 5.07 0.00 2.93 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 0.00 131 T 8.17 3.92 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 1.36 0.00 0.00 132 N 7.98 4.79 0.00 3.01 2.74 0.00 0.00 6.85 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 0.00 133 L 7.60 3.67 0.00 1.41 0.97 0.26 -0.76 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 0.00 134 K 7.99 4.20 0.00 1.99 2.13 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.48 7.81 135 A 8.07 4.07 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 0.00 136 A 7.89 4.30 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 0.00 137 K 8.24 4.52 0.00 1.99 1.95 0.00 1.42 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.46 7.81 138 K 8.36 4.10 0.00 1.73 1.78 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.45 7.81 139 G 8.91 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 0.00 140 S 7.98 4.35 0.00 3.97 3.68 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 *142 V 8.25 3.94 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 0.91 0.00 0.00 0.82 0.00 0.00 143 Y 9.11 5.25 0.00 3.00 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 0.00 144 F 9.88 5.54 0.00 3.07 3.27 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 0.00 145 K 8.99 5.34 0.00 1.87 1.66 0.00 1.55 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.41 0.00 0.00 0.00 0.00 1.49 1.65 7.81 146 V 8.00 4.29 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 0.34 0.00 0.00 0.83 0.00 0.00 147 G 8.09 3.69 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 0.00 0.00 0.00 148 N 7.59 4.82 0.00 2.76 2.82 0.00 0.00 5.79 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 0.00 149 E 8.16 4.80 0.00 2.00 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 2.28 2.27 0.00 150 T 8.01 4.94 4.31 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 0.00 0.00 0.00 1.42 0.00 0.00 151 R 8.58 4.01 0.00 2.29 2.30 0.00 3.15 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.60 0.00 152 K 8.32 5.06 0.00 1.71 1.50 0.00 1.67 0.00 0.00 2.00 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.55 1.72 7.81 153 Y 9.04 5.21 0.00 2.61 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 0.00 154 K 9.52 5.03 0.00 1.69 0.98 0.00 1.72 0.00 0.00 1.80 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.19 1.31 7.81 *156 T 8.43 4.58 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 1.25 0.00 0.00 157 S 8.47 4.22 0.00 3.97 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 0.00 158 I 7.68 4.05 1.82 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 1.32 0.92 0.83 0.00 0.00 159 R 7.85 4.24 0.00 1.60 1.83 0.00 3.29 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 160 D 6.05 3.64 0.00 2.54 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 0.00 161 V 6.67 4.40 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 0.65 0.00 0.00 0.79 0.00 0.00 162 K 8.27 4.39 0.00 1.95 1.72 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.45 7.81 163 P 0.00 4.26 0.00 2.18 2.12 0.00 3.60 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.10 0.00 164 T 7.84 4.01 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 0.00 165 D 7.77 4.62 0.00 2.78 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 0.00 166 V 7.53 3.87 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 0.72 0.00 0.00 0.97 0.00 0.00 167 G 9.55 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 0.00 0.00 0.00 168 V 8.33 3.70 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 0.71 0.00 0.00 0.93 0.00 0.00 169 L 7.75 4.66 0.00 1.56 1.63 0.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 170 D 8.03 4.50 0.00 2.82 2.67 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 0.00 171 E 7.94 4.42 0.00 1.90 1.82 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 2.22 2.53 0.00 172 Q 8.78 3.28 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 173 K 7.59 4.02 0.00 1.74 1.81 0.00 1.82 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.40 7.81 174 G 7.22 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 0.00 0.00 0.00 0.00 175 K 8.90 4.29 0.00 1.71 1.83 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.51 7.81 176 D 7.88 4.50 0.00 2.72 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 0.00 177 K 8.52 4.44 0.00 2.00 1.87 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.58 1.48 7.81 178 Q 9.61 5.15 0.00 2.06 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.76 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 179 L 8.66 4.83 0.00 0.53 0.87 0.23 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 180 T 9.06 4.89 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 1.21 0.00 0.00 181 L 8.92 5.08 0.00 1.28 0.94 0.42 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 182 I 8.77 5.23 1.88 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 1.32 1.07 0.97 0.00 0.00 183 T 8.82 5.01 4.31 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 0.00 0.00 0.00 1.37 0.00 0.00 184 A 8.68 5.00 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 D 9.22 4.62 0.00 2.88 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 0.00 186 D 8.73 4.75 0.00 3.17 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 0.00 187 Y 7.59 4.07 0.00 1.52 2.38 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 0.00 188 N 7.34 4.48 0.00 2.64 2.49 0.00 0.00 6.68 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 0.00 189 E 8.33 4.09 0.00 2.12 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 0.00 2.20 2.28 0.00 190 K 8.10 4.01 0.00 1.78 1.84 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.44 7.81 191 T 7.71 4.23 4.16 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 1.13 0.00 0.00 192 G 8.16 3.93 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 0.00 0.00 0.00 193 V 6.72 4.39 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 1.09 0.00 0.00 0.93 0.00 0.00 194 W 9.11 4.28 0.00 3.28 3.43 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 0.00 195 E 9.43 4.13 0.00 1.97 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 2.51 2.41 0.00 196 K 8.65 4.60 0.00 1.93 1.81 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.61 7.81 197 R 8.52 5.81 0.00 1.69 1.83 0.00 3.28 0.00 0.00 4.01 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 198 K 8.37 4.80 0.00 1.83 1.66 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.69 7.81 199 I 8.76 4.91 1.79 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 1.21 1.47 0.88 0.00 0.00 200 F 9.17 4.99 0.00 2.91 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 0.00 201 V 8.89 4.85 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 0.73 0.00 0.00 0.90 0.00 0.00 202 A 8.91 4.93 1.15 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 0.00 0.00 203 T 8.76 4.69 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 0.00 204 E 8.96 4.16 0.00 2.04 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 2.12 1.88 0.00 205 V 8.30 4.62 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 0.78 0.00 0.00 0.87 0.00 0.00 206 K 8.51 4.08 0.00 1.84 1.76 0.00 1.59 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.41 7.81 * Residues marked with a * may have inaccurate shift predictions.