NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -4 G 3.9300 8.3549 109.7340 44.5531 0.0000 173.2760 -3 P 4.2306 0.0000 0.0000 61.7427 31.7737 175.0163 -2 L 4.1856 8.4359 121.4048 54.7495 43.4563 177.6191 -1 G 4.0808 8.2598 112.0367 44.6646 0.0000 172.8129 0 S 4.7551 8.2055 113.2359 56.9494 65.1270 175.0406 1 M 4.0630 8.5122 121.7404 58.6129 31.7304 179.0779 2 S 4.1159 7.9791 113.0556 61.3240 62.7247 176.0577 3 Q 4.0216 8.1241 121.1524 58.9931 28.6252 178.8529 4 S 4.2096 7.8415 114.5906 61.1587 63.1202 176.3061 5 N 4.3186 8.2011 120.4573 56.2232 38.2485 177.3492 6 R 3.8935 7.8280 119.0249 59.3578 30.2013 178.7479 7 E 3.9022 8.0827 118.8159 59.0265 29.6278 178.5775 8 L 3.9122 7.7592 120.0207 58.0566 42.1443 179.1941 9 V 3.5363 7.5675 118.0793 66.0884 31.4884 178.2210 10 V 2.8415 7.9775 118.3910 65.4775 31.0348 177.4650 11 D 4.1448 7.9538 117.9003 57.1826 41.0973 178.0585 12 F 4.0485 8.1843 121.0139 61.3458 39.3915 177.0330 13 L 4.0444 7.9639 118.6339 57.7921 41.3982 179.3664 14 S 4.2258 7.9399 115.2555 61.9874 62.8338 176.2553 15 Y 4.1769 7.6505 121.4663 60.8265 37.0249 178.2958 16 K 3.8737 7.5609 120.5560 58.6828 32.1007 179.3129 17 L 4.1759 8.3072 119.8699 57.9959 41.6513 179.8605 18 S 4.9698 8.1053 115.2621 61.0202 62.6369 176.3543 19 Q 3.9668 8.0012 121.2896 57.5334 28.0469 177.5846 20 K 4.2233 6.9350 116.0924 55.7027 32.3766 176.9050 21 G 3.6937 7.8931 106.6428 45.9340 0.0000 173.1559 22 Y 5.0649 7.6659 117.4355 55.9806 40.4332 174.8171 23 S 5.0222 8.2557 114.3325 56.2143 66.0316 174.1449 24 W 4.2361 9.1638 133.3814 60.4984 30.9056 175.3439 25 S 4.4736 7.5821 110.3626 57.3703 64.9488 175.7529 26 Q 3.8251 8.4812 121.1937 59.3369 29.2435 177.4655 *83 M 4.1891 8.0742 116.0342 55.4637 34.0951 176.9585 84 A 4.0562 8.1148 119.9793 55.1276 18.4773 179.4012 85 A 3.9840 8.0873 119.3173 55.2728 18.3662 180.1127 86 V 3.8048 8.1427 116.8585 66.1568 31.5901 178.1206 87 K 3.8180 8.3565 118.7368 59.7393 31.9383 179.0302 88 Q 3.9663 8.3756 119.3105 59.1943 29.0535 178.0387 89 A 4.0231 8.1197 121.9025 55.0632 18.3290 179.4265 90 L 4.1605 8.5613 119.2079 58.2549 42.1141 179.1177 91 R 3.9456 8.3032 118.4426 59.5968 30.0691 178.9214 92 E 3.9997 8.3082 117.8421 59.2101 29.4853 179.1353 93 A 4.3011 8.8039 121.3560 55.2219 18.4500 179.9038 94 G 3.6557 8.5697 104.5162 48.1132 0.0000 175.3632 95 D 4.4263 8.3096 121.9733 57.0761 40.8042 178.7580 96 E 3.9181 8.2906 119.4122 59.3008 29.6866 178.3272 97 F 4.1776 8.9765 120.9893 61.7611 39.2326 177.0252 98 E 4.0366 8.4744 116.7828 59.0883 29.2479 178.9350 99 L 4.0555 7.7846 119.6530 58.2324 42.3242 178.8739 100 R 3.8098 7.7660 116.7626 58.3946 30.3856 177.8202 101 Y 4.9192 7.4931 116.2237 57.4296 38.8542 178.4089 102 R 4.1878 8.2053 121.3777 59.4121 30.1461 178.2418 103 R 3.9253 8.1327 117.9925 59.2346 29.9827 178.0840 104 A 3.9526 8.1234 120.1338 55.3040 18.3706 179.5206 105 F 4.0147 8.2388 115.6318 60.6350 38.8063 177.5033 106 S 4.1877 8.3271 112.0386 61.8387 62.2350 175.8317 107 D 4.5104 8.2858 121.1532 57.3286 40.1414 178.5445 108 L 3.9542 7.5664 120.7171 58.5205 42.0767 178.5036 109 T 4.2644 7.9273 112.7701 64.7576 68.7620 176.5866 110 S 4.3265 7.9010 117.6682 60.5625 63.2951 176.4106 111 Q 3.7049 7.7094 123.9718 57.0856 28.8916 179.2922 112 L 4.2287 8.3567 120.2462 56.0278 43.7027 176.3127 113 H 4.0990 8.0312 112.4986 56.5410 25.4880 175.0174 114 I 3.9595 7.5037 112.5260 61.1064 38.7278 176.2298 115 T 4.8082 8.4584 112.7160 59.0385 72.0062 172.9075 116 P 4.1541 0.0000 0.0000 65.7719 31.3654 178.2715 117 G 3.8465 8.1327 105.2357 47.1331 0.0000 174.4713 118 T 4.5004 7.3604 109.4538 61.4119 69.9303 175.8331 119 A 4.1343 8.8396 125.3954 55.9498 18.3324 178.9671 120 Y 3.2998 8.0421 117.1660 60.5002 38.7808 177.7844 121 Q 3.6607 7.9363 120.1180 58.9857 29.2852 178.0577 122 S 4.0526 8.1884 116.2159 61.5641 62.8679 176.1072 123 F 4.3274 8.3564 123.3008 61.6737 39.0955 176.5711 124 E 3.6431 7.9268 118.6061 59.4695 29.1547 178.9847 125 Q 3.8149 7.8267 117.8133 58.7320 28.8008 178.8313 126 V 3.1755 7.4914 119.1458 65.8427 31.3050 178.2200 127 V 3.1909 7.2857 118.0967 65.8350 31.2207 177.5967 128 N 4.2752 7.8978 116.1733 56.4686 38.2037 177.0747 129 E 3.8828 7.5447 118.8484 58.7772 29.7140 178.1712 130 L 3.6974 7.3767 119.9663 56.8643 42.2521 177.8354 131 F 5.0627 7.3356 116.0983 55.8720 39.6606 177.0401 132 R 3.8563 7.6115 119.7920 59.1346 29.8401 177.1050 133 D 4.8040 9.3567 114.0780 51.3751 39.7911 174.7674 134 G 4.1201 6.9300 105.1713 44.0792 0.0000 173.2877 135 V 4.1025 7.3550 121.7445 61.0268 33.2241 175.0721 136 N 3.9333 7.4608 122.0825 50.2838 41.4389 175.4647 137 W 4.5934 8.6746 119.6891 59.8697 29.0933 179.0650 138 G 3.8371 8.5097 105.4948 47.9418 0.0000 175.9486 139 R 3.8709 8.4684 120.4783 58.7792 30.0548 179.1709 140 I 3.9640 7.8919 119.8710 64.4855 37.0696 178.5364 141 V 3.7191 7.9541 118.7729 65.9954 31.3805 177.7233 142 A 3.2739 7.7467 120.4633 54.8920 18.0601 179.0628 143 F 4.1624 8.5531 119.3839 61.7179 39.3265 177.3763 144 F 3.7994 8.3806 116.7451 60.7939 38.8025 177.7937 145 S 4.2973 8.5392 114.9618 61.6286 62.6517 176.6923 146 F 4.6120 9.1423 123.7824 61.4204 39.1721 177.4651 147 G 3.4945 8.3062 105.6960 47.5797 0.0000 175.7018 148 G 3.6686 8.3882 108.2642 47.7002 0.0000 175.6274 149 A 3.9548 7.9876 123.1193 54.6228 18.3972 179.4185 150 L 3.8514 7.6986 118.9122 58.3639 42.0649 179.1799 151 C 4.0019 8.1145 116.6363 62.7055 28.1040 175.8796 152 V 3.5158 7.7862 119.9661 66.2892 31.0364 177.6239 153 E 3.9294 8.6366 119.0459 59.4483 29.3589 178.9755 154 S 4.1323 7.9926 115.2881 61.5320 62.8518 176.8531 155 V 3.5608 7.7955 121.0015 65.7764 31.0305 177.6009 156 D 4.4232 7.9943 118.0080 57.3548 40.7665 178.3025 157 K 4.3714 7.6945 115.6270 55.3527 32.5394 176.5530 158 E 4.0706 7.9285 116.5373 57.4367 28.0030 174.7464 159 M 4.8549 8.3886 113.0446 54.0220 32.7773 177.9028 160 Q 4.0207 8.0037 119.2901 59.2621 28.1436 179.2370 161 V 3.5944 7.8352 112.8027 64.1985 31.4500 177.8437 162 L 4.0823 7.9570 117.8873 56.3535 41.4778 179.4817 163 V 3.4098 7.5654 119.4466 65.9865 31.5586 178.1544 164 S 4.0193 7.8097 113.4501 61.1408 62.7559 176.4676 165 R 3.2681 7.0055 118.6676 58.9283 29.6769 178.9100 166 I 2.7082 6.9534 119.3393 63.8383 36.9759 178.0955 167 A 3.8731 7.6764 121.2499 55.2182 18.0953 179.3678 168 A 3.9151 7.5658 118.9167 55.3729 18.5233 179.9896 169 W 4.4013 7.8777 117.6242 60.0990 28.9320 178.8222 170 M 4.6987 8.6084 119.0256 58.4792 31.3897 178.6448 171 A 4.1532 8.5807 121.3324 55.5461 18.5390 179.6165 172 T 3.9083 8.3879 114.6438 67.2635 68.5350 176.1978 173 Y 4.0260 8.3557 121.0655 60.3666 38.8043 177.6725 174 L 3.8278 8.5957 121.8599 58.0405 42.0563 178.3971 175 N 4.2967 8.3742 116.0740 56.8977 39.0291 176.0142 176 D 4.4452 8.1568 118.5798 55.8777 41.0175 177.4675 177 H 4.4378 7.8047 115.3229 56.5636 30.6294 176.2184 178 L 3.5478 7.1077 119.8253 57.5064 41.7917 178.8176 179 E 3.8577 8.6399 119.4715 58.6434 29.3084 176.8896 180 P 4.3295 0.0000 0.0000 65.1791 31.6472 177.8407 181 W 4.0699 7.5754 126.6965 60.5443 30.5370 177.8231 182 I 3.2432 7.7018 119.5522 64.6349 36.3112 178.2802 183 Q 3.8771 7.9649 117.5292 58.7299 28.5920 178.2975 184 E 4.2513 7.6932 117.1662 56.4452 30.0947 176.2713 185 N 4.5648 7.2058 116.4394 53.1617 39.2731 175.1341 186 G 4.0466 8.2214 106.9207 45.4189 0.0000 175.7802 187 G 4.0376 8.4812 105.6140 45.0062 0.0000 174.3381 188 W 4.6348 8.6382 117.6640 60.0281 28.7162 178.5662 189 D 4.5547 8.3555 118.4662 57.4871 40.0130 178.6684 190 T 3.8643 7.9585 116.1384 66.2499 68.4227 176.4914 191 F 3.3749 7.8967 122.1131 61.0739 39.3561 177.0091 192 V 3.4276 7.8614 117.7001 66.2583 31.1161 177.8974 193 E 3.9473 8.1257 116.5211 58.7046 29.2623 178.6791 194 L 4.0490 7.2410 118.2334 56.1261 42.1760 176.9857 195 Y 4.3787 7.6043 112.9914 57.2876 40.1688 176.2606 196 G 4.0180 7.9186 110.8653 46.6029 0.0000 173.6960 197 N 3.8451 8.5744 117.7074 53.8203 36.6611 174.2770 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 -4 G 8.35 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 -3 P 0.00 4.23 0.00 2.13 1.99 0.00 3.67 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 2.02 2.16 0.00 -2 L 8.44 4.19 0.00 1.63 1.59 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 -1 G 8.26 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 0.00 0.00 0.00 0 S 8.21 4.76 0.00 4.00 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 1 M 8.51 4.06 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.54 0.00 2 S 7.98 4.12 0.00 3.88 3.85 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 0.00 0.00 0.00 3 Q 8.12 4.02 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 4 S 7.84 4.21 0.00 4.04 4.11 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 5 N 8.20 4.32 0.00 2.90 2.89 0.00 0.00 6.88 7.75 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 6 R 7.83 3.89 0.00 1.98 1.99 0.00 3.14 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.90 0.00 7 E 8.08 3.90 0.00 2.14 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 2.26 2.28 0.00 8 L 7.76 3.91 0.00 1.93 1.61 0.88 0.69 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 9 V 7.57 3.54 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 0.90 0.00 0.00 0.91 0.00 0.00 10 V 7.98 2.84 1.76 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 -0.19 0.00 0.00 0.70 0.00 0.00 11 D 7.95 4.14 0.00 2.84 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 12 F 8.18 4.05 0.00 3.10 3.01 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 13 L 7.96 4.04 0.00 1.56 1.79 1.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.94 4.23 0.00 4.04 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 15 Y 7.65 4.18 0.00 2.78 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 16 K 7.56 3.87 0.00 1.83 1.74 0.00 1.52 0.00 0.00 1.16 0.00 0.00 2.54 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.62 1.32 7.81 17 L 8.31 4.18 0.00 1.95 1.90 1.19 0.84 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 18 S 8.11 4.97 0.00 4.06 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 0.00 19 Q 8.00 3.97 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.80 0.00 0.00 0.00 0.00 0.00 2.00 1.89 0.00 20 K 6.94 4.22 0.00 1.56 1.32 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.26 1.45 7.81 21 G 7.89 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 22 Y 7.67 5.06 0.00 3.18 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 23 S 8.26 5.02 0.00 4.18 3.85 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 0.00 0.00 0.00 24 W 9.16 4.24 0.00 3.45 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 25 S 7.58 4.47 0.00 3.99 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 26 Q 8.48 3.83 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.26 6.53 0.00 0.00 0.00 0.00 0.00 2.50 2.60 0.00 *83 M 8.07 4.19 0.00 2.19 2.02 0.00 0.00 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.60 0.00 84 A 8.11 4.06 1.51 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 0.00 0.00 85 A 8.09 3.98 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 86 V 8.14 3.80 2.10 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 0.98 0.00 0.00 1.16 0.00 0.00 87 K 8.36 3.82 0.00 2.01 1.86 0.00 1.72 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.61 7.81 88 Q 8.38 3.97 0.00 2.43 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 89 A 8.12 4.02 1.31 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 0.00 0.00 0.00 90 L 8.56 4.16 0.00 1.93 1.88 0.63 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.30 3.95 0.00 2.08 2.00 0.00 3.18 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 1.65 1.86 0.00 92 E 8.31 4.00 0.00 2.21 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 2.65 0.00 93 A 8.80 4.30 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 94 G 8.57 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 95 D 8.31 4.43 0.00 2.89 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 96 E 8.29 3.92 0.00 2.12 2.31 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 2.41 2.34 0.00 97 F 8.98 4.18 0.00 3.39 3.38 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 98 E 8.47 4.04 0.00 2.18 1.87 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 1.80 2.38 0.00 99 L 7.78 4.06 0.00 1.70 1.90 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 100 R 7.77 3.81 0.00 1.07 0.66 0.00 3.06 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.44 0.00 101 Y 7.49 4.92 0.00 2.78 2.68 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 0.00 102 R 8.21 4.19 0.00 1.85 2.04 0.00 3.35 0.00 0.00 3.43 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.64 0.00 103 R 8.13 3.93 0.00 1.91 1.96 0.00 3.21 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 104 A 8.12 3.95 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 0.00 105 F 8.24 4.01 0.00 3.42 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 0.00 106 S 8.33 4.19 0.00 3.90 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 0.00 107 D 8.29 4.51 0.00 2.85 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 0.00 108 L 7.57 3.95 0.00 1.74 1.83 0.85 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 109 T 7.93 4.26 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 1.27 0.00 0.00 110 S 7.90 4.33 0.00 3.99 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 0.00 111 Q 7.71 3.70 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.87 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 112 L 8.36 4.23 0.00 1.60 1.76 0.95 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 113 H 8.03 4.10 0.00 3.34 3.35 0.00 5.70 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 I 7.50 3.96 1.95 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 1.51 0.57 0.98 0.00 0.00 115 T 8.46 4.81 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 0.00 116 P 0.00 4.15 0.00 2.10 2.22 0.00 3.71 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 2.06 2.13 0.00 117 G 8.13 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 118 T 7.36 4.50 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 1.25 0.00 0.00 119 A 8.84 4.13 1.65 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 0.00 0.00 0.00 0.00 0.00 0.00 120 Y 8.04 3.30 0.00 2.21 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 0.00 121 Q 7.94 3.66 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 122 S 8.19 4.05 0.00 4.26 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 0.00 123 F 8.36 4.33 0.00 3.44 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 0.00 124 E 7.93 3.64 0.00 1.27 1.70 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 2.12 2.28 0.00 125 Q 7.83 3.81 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.59 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 126 V 7.49 3.18 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 -0.20 0.00 0.00 0.74 0.00 0.00 127 V 7.29 3.19 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 0.08 0.00 0.00 0.20 0.00 0.00 128 N 7.90 4.28 0.00 2.76 2.78 0.00 0.00 6.70 7.24 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 0.00 129 E 7.54 3.88 0.00 1.86 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 2.20 2.21 0.00 130 L 7.38 3.70 0.00 1.25 1.31 0.45 0.19 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 0.00 131 F 7.34 5.06 0.00 3.05 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 0.00 132 R 7.61 3.86 0.00 1.90 1.91 0.00 3.20 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 133 D 9.36 4.80 0.00 2.78 2.68 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 0.00 134 G 6.93 4.12 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 0.00 135 V 7.35 4.10 0.67 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 -0.36 0.00 0.00 0.45 0.00 0.00 136 N 7.46 3.93 0.00 2.95 2.73 0.00 0.00 6.21 8.88 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 0.00 137 W 8.67 4.59 0.00 3.83 3.59 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 0.00 138 G 8.51 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 0.00 139 R 8.47 3.87 0.00 2.00 1.63 0.00 3.06 0.00 0.00 3.12 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.73 0.00 140 I 7.89 3.96 2.19 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 1.24 1.01 1.15 0.00 0.00 141 V 7.95 3.72 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 1.05 0.00 0.00 0.94 0.00 0.00 142 A 7.75 3.27 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 0.00 143 F 8.55 4.16 0.00 3.31 3.49 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 0.00 144 F 8.38 3.80 0.00 3.43 3.13 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 0.00 145 S 8.54 4.30 0.00 4.15 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 0.00 146 F 9.14 4.61 0.00 3.14 3.29 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 0.00 147 G 8.31 3.49 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 0.00 148 G 8.39 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 0.00 149 A 7.99 3.95 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 L 7.70 3.85 0.00 1.44 1.63 0.87 0.78 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 0.00 151 C 8.11 4.00 0.00 3.09 2.89 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 0.00 152 V 7.79 3.52 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 0.97 0.00 0.00 0.91 0.00 0.00 153 E 8.64 3.93 0.00 2.12 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 0.00 2.33 2.41 0.00 154 S 7.99 4.13 0.00 4.02 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 0.00 155 V 7.80 3.56 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 1.01 0.00 0.00 0.94 0.00 0.00 156 D 7.99 4.42 0.00 2.85 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 0.00 157 K 7.69 4.37 0.00 1.76 1.83 0.00 1.89 0.00 0.00 1.73 0.00 0.00 3.19 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.72 7.81 158 E 7.93 4.07 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 159 M 8.39 4.85 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.47 0.00 160 Q 8.00 4.02 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.87 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 161 V 7.84 3.59 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 0.88 0.00 0.00 0.92 0.00 0.00 162 L 7.96 4.08 0.00 1.70 1.62 0.98 0.65 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 0.00 163 V 7.57 3.41 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 0.90 0.00 0.00 164 S 7.81 4.02 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 0.00 165 R 7.01 3.27 0.00 1.26 0.97 0.00 3.07 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.64 0.00 166 I 6.95 2.71 1.70 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.29 0.78 0.00 0.00 167 A 7.68 3.87 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 0.00 168 A 7.57 3.92 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 0.00 169 W 7.88 4.40 0.00 2.74 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 0.00 170 M 8.61 4.70 0.00 2.09 2.29 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.56 0.00 171 A 8.58 4.15 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 0.00 172 T 8.39 3.91 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 0.00 173 Y 8.36 4.03 0.00 3.52 3.28 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 0.00 174 L 8.60 3.83 0.00 2.20 1.96 1.31 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 175 N 8.37 4.30 0.00 2.91 3.01 0.00 0.00 7.30 8.01 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 0.00 176 D 8.16 4.45 0.00 2.53 2.36 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 0.00 177 H 7.80 4.44 0.00 1.78 2.66 0.00 5.61 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 L 7.11 3.55 0.00 1.43 1.50 -0.29 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 179 E 8.64 3.86 0.00 2.23 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 0.00 2.40 2.47 0.00 180 P 0.00 4.33 0.00 1.99 2.05 0.00 3.68 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 2.14 2.10 0.00 181 W 7.58 4.07 0.00 3.05 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 0.00 182 I 7.70 3.24 1.58 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.62 0.29 0.00 0.00 183 Q 7.96 3.88 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.84 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 184 E 7.69 4.25 0.00 1.66 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 2.17 2.25 0.00 185 N 7.21 4.56 0.00 1.44 1.65 0.00 0.00 7.17 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 0.00 186 G 8.22 4.05 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 0.00 0.00 0.00 187 G 8.48 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 0.00 188 W 8.64 4.63 0.00 3.51 3.36 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 0.00 189 D 8.36 4.55 0.00 2.78 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 0.00 190 T 7.96 3.86 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 191 F 7.90 3.37 0.00 2.69 3.36 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 0.00 192 V 7.86 3.43 2.27 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 1.07 0.00 0.00 1.11 0.00 0.00 193 E 8.13 3.95 0.00 1.90 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 2.32 2.58 0.00 194 L 7.24 4.05 0.00 1.49 1.15 0.58 0.67 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 0.00 195 Y 7.60 4.38 0.00 1.95 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 0.00 196 G 7.92 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 N 8.57 3.85 0.00 2.84 2.78 0.00 0.00 5.72 7.56 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 * Residues marked with a * may have inaccurate shift predictions.