NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 100 Y 4.8794 8.1293 118.3543 57.2025 39.3310 174.6592 101 P 4.5049 0.0000 0.0000 62.1087 32.3795 174.4897 102 L 4.5903 9.1116 122.1134 55.1318 43.2201 177.7585 103 V 4.3911 8.6218 113.7488 58.8520 35.1599 175.3145 104 L 2.9902 7.7272 123.2047 56.4836 41.9625 177.1563 105 K 3.9250 8.9976 123.7915 56.7179 30.7611 175.8780 106 Q 4.3724 7.7687 121.5598 56.2090 30.1568 174.8856 107 T 5.0003 8.2996 113.7486 59.9295 72.2273 173.0310 108 I 4.7528 8.3581 123.9366 58.7312 40.9687 173.7973 109 P 4.6978 0.0000 0.0000 62.6947 32.4411 176.3098 110 N 4.7526 8.4018 118.5076 51.9457 37.3048 172.8776 111 L 4.7092 7.3518 119.0182 53.2150 46.8651 176.0549 112 S 4.1920 8.3669 114.3565 57.8848 63.9133 174.7865 113 E 2.5400 7.4582 123.1190 58.9338 28.9699 177.8055 114 Y 5.2503 7.1937 112.3791 57.3776 38.3777 175.6123 115 T 4.2164 7.4102 111.1190 61.1955 69.5420 175.5464 116 N 4.3380 8.8216 120.6287 56.6249 38.6950 177.7740 117 S 4.0364 8.1070 110.1518 60.1252 64.8126 174.0143 118 A 4.6767 7.1451 121.6405 52.6755 17.0907 179.5609 119 S 4.3916 7.7519 123.0674 59.6989 63.8136 175.1472 120 G 4.0962 8.3106 108.8779 43.9631 0.0000 171.0589 121 P 4.7758 0.0000 0.0000 61.3552 32.3201 176.0822 122 L 4.0452 7.7712 118.7032 55.6512 41.8490 177.1486 123 E 4.5761 8.9877 119.0736 55.8385 30.7007 176.9401 124 G 4.0104 8.3072 105.4169 45.1919 0.0000 174.0183 125 V 3.8847 8.2291 121.7261 63.1636 32.3614 175.1257 126 I 4.6105 8.8077 128.5788 59.9833 38.8022 175.2359 127 R 5.0605 9.1703 126.0832 53.9929 33.3064 177.4351 128 R 2.5100 8.7656 119.1055 59.0006 30.2500 178.2133 129 D 4.3800 7.9936 116.6741 56.8703 41.7748 176.8231 130 S 4.4478 7.7372 112.9817 57.3552 63.5049 173.3876 131 P 4.4219 0.0000 0.0000 64.9600 31.5302 178.2171 132 K 4.5977 7.9524 117.9494 56.5999 31.9238 178.2991 133 F 4.0647 8.0980 122.0866 61.0532 39.0795 176.7358 134 K 3.7911 7.4450 117.9295 58.9834 32.0875 178.1525 135 D 4.4303 7.7947 119.4646 55.9043 40.7346 176.5132 136 L 4.1638 6.7481 119.3918 55.0509 42.1582 177.4198 137 V 4.2093 8.5407 117.6299 58.9303 33.9851 173.8037 138 P 4.5509 0.0000 0.0000 62.3349 32.1719 175.2010 139 N 4.5712 8.3699 122.8781 52.4104 39.5964 174.1768 140 Y 4.9189 8.3729 122.7254 57.5989 38.3480 175.0441 141 N 4.3585 8.2456 120.0551 53.8972 39.1842 175.4870 142 R 3.9675 8.8539 126.4783 59.4579 30.3264 176.6208 143 D 4.7202 8.4759 114.9706 54.3902 41.0538 175.6632 144 I 4.5469 7.3324 120.5905 59.3938 39.3102 175.0481 145 L 4.5549 8.7160 127.6768 53.7301 43.2989 175.5670 146 F 5.0956 8.8696 123.0286 55.5570 39.8887 176.1857 147 R 3.8846 8.6492 121.9291 59.0126 29.2082 177.5089 *155 D 4.8193 8.1585 118.1760 54.3667 42.9209 176.2431 156 R 3.3742 7.5828 116.2505 57.5918 31.3689 176.6586 157 L 4.6043 7.8927 120.4042 54.7757 43.2643 176.0643 158 M 4.8669 8.4964 119.6406 54.5934 35.0200 173.8679 159 S 4.6226 8.7818 113.9536 57.8382 64.6920 175.9404 160 K 3.8935 8.7739 119.5879 59.6623 31.7919 179.6617 161 R 3.8053 7.9498 119.0330 59.2728 29.9506 178.0205 162 C 4.0171 8.3615 118.9194 62.3154 31.5169 175.2426 163 K 3.8483 8.2619 121.4179 59.6049 31.6660 177.7906 164 E 3.8618 8.1980 119.5150 59.7246 29.5944 179.2818 165 K 3.7476 7.7939 117.9690 58.9973 31.9955 179.2325 166 L 4.2892 7.9625 120.7373 57.9686 41.9720 178.8400 167 N 4.2704 8.4560 117.1492 56.1772 38.3755 177.4458 168 V 3.7959 7.5788 119.4909 65.9721 31.5694 177.8817 169 L 4.0362 8.2564 120.8373 57.2449 41.5880 178.3811 170 A 3.8352 7.8706 120.9778 55.8641 18.1951 179.3186 171 Y 4.3232 7.3173 113.1656 60.6763 37.7865 178.3980 172 S 4.2042 8.0377 115.6426 60.9481 63.1589 176.6911 173 V 3.8015 7.9701 122.0132 66.4290 31.1415 177.9206 174 M 4.1677 7.6006 116.5149 58.4966 31.8646 178.0336 175 N 4.4166 8.2571 116.3958 56.2196 39.1100 176.0445 176 E 3.8498 7.5981 119.4242 56.5696 30.3500 176.4455 177 W 5.1281 7.7790 116.8633 53.9834 33.1652 173.2979 178 P 4.4947 0.0000 0.0000 63.5550 31.7798 177.3947 179 G 3.9907 8.9699 107.8848 45.7140 0.0000 172.8243 180 I 4.7327 7.2649 110.6830 58.9751 40.8390 174.4330 181 R 4.7962 8.2458 117.8942 53.9342 35.0164 174.6105 182 L 4.1642 8.5122 122.8509 55.4960 43.3581 175.2441 183 L 4.9347 8.8515 128.0903 53.1488 45.0780 174.8537 184 V 4.5278 8.2884 126.8271 61.5873 32.6121 175.9304 185 T 4.3461 8.9166 119.1050 63.0046 70.1689 174.7944 186 E 4.6875 7.7522 123.1034 55.7640 33.6234 172.3060 187 S 4.9732 8.9983 118.0482 57.3773 64.1317 176.1544 188 W 4.8608 6.3830 123.3776 57.1237 31.2858 173.8070 189 D 4.6243 8.6040 126.4961 52.4328 42.8465 175.8605 190 E 3.7193 8.2327 124.5032 56.2130 31.4211 175.8567 191 D 4.5148 7.6420 116.2489 53.4385 41.3791 176.0322 192 Y 3.3203 6.7750 114.8079 59.6105 34.6609 169.9764 193 H 4.9224 9.3406 113.2072 56.2132 29.8290 175.8446 194 H 4.9402 8.2656 116.8707 55.2528 29.7907 174.5052 195 G 4.0110 8.2627 109.3746 45.4154 0.0000 173.2961 196 Q 4.3473 8.8705 116.5845 57.7712 29.2220 176.2566 197 E 4.8777 7.8140 116.0715 54.5210 32.5825 175.1549 198 S 4.5038 7.9632 114.4758 57.1575 65.2873 175.8565 199 L 4.1868 8.5524 126.8108 57.9176 42.0429 178.8503 200 H 4.1332 8.0403 115.8180 59.3415 28.8379 176.6631 201 Y 4.8088 7.9721 114.6955 59.2930 37.1442 176.6256 202 E 5.1170 8.5712 118.8365 55.7821 30.4767 176.2640 203 G 4.0372 8.9522 105.1567 47.8748 0.0000 175.2788 204 R 4.8923 7.6569 112.5087 55.4581 31.9277 175.4556 205 A 5.0356 7.7989 120.4510 50.3372 23.0312 175.7417 206 V 5.4874 8.8580 112.8068 58.7385 36.7061 174.4840 207 T 5.0846 8.4406 113.2948 59.9704 71.2471 173.2048 208 I 4.9994 8.6100 117.8940 59.3519 41.6993 173.7371 209 A 4.0917 8.5140 124.3060 50.6109 23.3910 175.4163 210 T 4.4915 8.2420 108.8245 61.1246 70.0344 176.4982 211 S 4.1754 8.7421 118.0123 60.8230 63.1728 174.8465 212 D 4.5035 7.9874 118.5626 52.8591 39.6117 176.2166 213 R 4.1920 7.6493 116.9829 56.4800 28.3434 176.9805 214 D 4.3942 8.1083 118.6748 53.1617 40.6701 175.6419 215 Q 2.5200 8.1066 126.7257 58.0930 28.5424 178.5607 216 S 4.2066 7.5970 113.4747 60.3720 63.3299 175.8309 217 K 4.2634 7.7986 121.7584 58.2337 32.0292 178.3232 218 Y 4.3401 7.7651 117.3656 60.2867 37.6421 177.8985 219 G 3.9348 8.2909 106.8276 48.3249 0.0000 175.2063 220 M 4.1305 8.1735 120.6120 58.0163 32.3996 177.4536 221 L 4.0465 8.4753 120.5670 58.4916 42.1422 178.9480 222 A 3.8370 8.2030 120.5922 55.0385 18.2409 179.5513 223 R 3.8429 7.9450 116.6785 59.6160 30.2762 178.4049 224 L 3.9740 8.6518 118.9055 57.9110 41.5958 179.4386 225 A 4.1988 8.4115 120.9979 55.0474 18.1228 179.8269 226 V 3.5770 7.9113 116.7185 66.3949 31.4399 178.2111 227 E 3.9859 8.4163 117.0582 59.3118 29.3294 178.9256 228 A 4.2034 8.4619 120.5776 53.8062 18.3781 178.2791 229 G 4.1216 7.6525 105.2618 45.4897 0.0000 173.9963 230 F 4.1393 7.7600 117.6999 57.5788 39.3745 175.4705 231 D 4.7122 8.8736 123.9986 56.6160 41.7200 176.7494 232 W 5.4242 8.7499 128.2421 55.7216 34.5765 174.1010 233 V 4.5918 8.4274 126.5019 60.9860 34.3922 173.9589 234 S 4.4816 8.7501 122.1707 56.2193 65.3699 173.2443 235 Y 4.7714 8.4050 131.2571 56.8100 36.0240 176.3542 236 V 3.7295 7.8885 114.8311 63.6447 33.0743 176.6335 237 S 4.6829 7.7531 112.0403 56.6646 65.4180 175.0517 238 R 4.3122 8.6414 123.8490 59.3285 29.9928 178.5425 239 R 4.3442 7.9744 116.2515 58.6649 30.7092 175.8156 240 H 4.5533 7.6485 110.2116 54.7990 32.2275 172.9164 241 I 4.3568 7.8964 120.7464 60.1663 39.2149 174.0297 242 Y 4.9557 8.7158 127.8140 56.3605 40.7828 174.0472 243 C 5.1261 8.4119 123.9733 57.7981 32.2625 173.2403 244 S 5.2017 9.3271 117.0194 56.7572 66.5809 173.0198 245 V 5.1068 8.4368 112.9627 59.1382 35.1125 176.0933 246 K 5.0713 10.0090 122.2891 55.8551 32.5127 177.6325 247 S 4.4004 8.2743 115.4441 58.1301 63.9109 174.0783 248 D 4.4944 8.5040 120.5022 54.8317 40.6200 176.4298 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 100 Y 8.13 4.88 0.00 3.03 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 0.00 101 P 0.00 4.50 0.00 2.27 2.17 0.00 4.04 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.19 0.00 102 L 9.11 4.59 0.00 1.82 1.89 0.90 1.24 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 0.00 103 V 8.62 4.39 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 0.64 0.00 0.00 0.92 0.00 0.00 104 L 7.73 2.99 0.00 1.03 1.29 0.75 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 105 K 9.00 3.92 0.00 1.85 1.91 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.27 1.46 7.81 106 Q 7.77 4.37 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 107 T 8.30 5.00 3.62 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 1.10 0.00 0.00 108 I 8.36 4.75 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 1.29 0.76 0.93 0.00 0.00 109 P 0.00 4.70 0.00 2.29 2.15 0.00 4.11 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 2.25 2.09 0.00 110 N 8.40 4.75 0.00 2.73 2.85 0.00 0.00 6.79 7.78 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 0.00 111 L 7.35 4.71 0.00 1.71 1.56 0.98 1.02 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 0.00 112 S 8.37 4.19 0.00 3.82 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 E 7.46 2.54 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 1.47 1.72 0.00 114 Y 7.19 5.25 0.00 2.94 2.85 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 0.00 115 T 7.41 4.22 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 1.24 0.00 0.00 116 N 8.82 4.34 0.00 2.79 2.92 0.00 0.00 6.63 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.11 4.04 0.00 4.01 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 0.00 118 A 7.15 4.68 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 S 7.75 4.39 0.00 4.04 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 0.00 120 G 8.31 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 0.00 121 P 0.00 4.78 0.00 2.14 2.05 0.00 3.82 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 122 L 7.77 4.05 0.00 1.47 1.58 0.66 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.99 4.58 0.00 2.20 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 124 G 8.31 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 0.00 125 V 8.23 3.88 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 0.81 0.00 0.00 1.08 0.00 0.00 126 I 8.81 4.61 2.11 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.89 1.03 0.00 0.00 127 R 9.17 5.06 0.00 1.74 1.84 0.00 3.22 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 128 R 8.77 2.51 0.00 1.58 1.58 0.00 3.18 0.00 0.00 3.02 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 1.68 0.00 129 D 7.99 4.38 0.00 2.61 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 0.00 130 S 7.74 4.45 0.00 4.15 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 0.00 131 P 0.00 4.42 0.00 2.22 2.15 0.00 3.62 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 132 K 7.95 4.60 0.00 1.89 1.84 0.00 1.87 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.43 7.81 133 F 8.10 4.06 0.00 3.30 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 0.00 134 K 7.45 3.79 0.00 1.62 1.78 0.00 1.85 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.43 7.81 135 D 7.79 4.43 0.00 2.90 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 0.00 136 L 6.75 4.16 0.00 0.99 1.16 -0.04 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.54 4.21 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 0.67 0.00 0.00 0.89 0.00 0.00 138 P 0.00 4.55 0.00 0.87 1.42 0.00 3.39 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.78 0.00 139 N 8.37 4.57 0.00 2.74 2.73 0.00 0.00 7.06 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 0.00 140 Y 8.37 4.92 0.00 3.00 2.82 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 0.00 141 N 8.25 4.36 0.00 2.91 2.83 0.00 0.00 6.75 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 0.00 142 R 8.85 3.97 0.00 1.87 2.02 0.00 3.32 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 143 D 8.48 4.72 0.00 2.79 2.65 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 0.00 144 I 7.33 4.55 1.95 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.50 0.45 0.00 0.00 145 L 8.72 4.55 0.00 1.53 1.60 0.92 1.16 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 0.00 146 F 8.87 5.10 0.00 2.91 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 R 8.65 3.88 0.00 1.86 2.08 0.00 3.09 0.00 0.00 3.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.62 0.00 *155 D 8.16 4.82 0.00 2.78 2.88 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 0.00 156 R 7.58 3.37 0.00 1.52 1.49 0.00 3.07 0.00 0.00 3.29 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.01 0.00 157 L 7.89 4.60 0.00 1.66 1.32 0.59 0.45 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 0.00 158 M 8.50 4.87 0.00 2.16 2.32 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.60 0.00 159 S 8.78 4.62 0.00 3.91 4.15 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 0.00 160 K 8.77 3.89 0.00 1.85 1.86 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.54 7.81 161 R 7.95 3.81 0.00 1.84 1.97 0.00 3.08 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 162 C 8.36 4.02 0.00 3.10 3.18 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 0.00 163 K 8.26 3.85 0.00 1.86 2.00 0.00 1.66 0.00 0.00 1.54 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.61 7.81 164 E 8.20 3.86 0.00 2.12 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 0.00 2.25 2.35 0.00 165 K 7.79 3.75 0.00 1.32 0.74 0.00 1.40 0.00 0.00 1.49 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.93 0.98 7.81 166 L 7.96 4.29 0.00 2.15 1.89 1.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 167 N 8.46 4.27 0.00 2.99 2.91 0.00 0.00 6.53 8.24 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 0.00 168 V 7.58 3.80 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 1.02 0.00 0.00 1.00 0.00 0.00 169 L 8.26 4.04 0.00 2.14 1.94 0.99 0.64 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 0.00 170 A 7.87 3.84 0.96 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 0.00 0.00 171 Y 7.32 4.32 0.00 3.21 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 0.00 172 S 8.04 4.20 0.00 3.99 4.15 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 0.00 173 V 7.97 3.80 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 1.24 0.00 0.00 1.11 0.00 0.00 174 M 7.60 4.17 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.75 0.00 175 N 8.26 4.42 0.00 2.99 2.96 0.00 0.00 7.16 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 0.00 176 E 7.60 3.85 0.00 1.77 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 1.47 1.47 0.00 177 W 7.78 5.13 0.00 3.41 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 0.00 178 P 0.00 4.49 0.00 2.27 2.22 0.00 3.98 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 2.15 2.03 0.00 179 G 8.97 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 I 7.26 4.73 1.83 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 1.42 0.89 0.88 0.00 0.00 181 R 8.25 4.80 0.00 1.71 1.92 0.00 3.47 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 182 L 8.51 4.16 0.00 1.71 1.43 0.85 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 183 L 8.85 4.93 0.00 1.66 1.42 0.92 0.60 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 0.00 184 V 8.29 4.53 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 0.93 0.00 0.00 0.48 0.00 0.00 185 T 8.92 4.35 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 1.15 0.00 0.00 186 E 7.75 4.69 0.00 2.17 1.75 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 1.83 2.24 0.00 187 S 9.00 4.97 0.00 4.12 3.52 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 0.00 188 W 6.38 4.86 0.00 3.57 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 0.00 189 D 8.60 4.62 0.00 2.82 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 E 8.23 3.72 0.00 1.16 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.04 0.00 191 D 7.64 4.51 0.00 2.28 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 6.78 3.32 0.00 3.00 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 0.00 193 H 9.34 4.92 0.00 3.11 3.13 0.00 5.62 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 0.00 194 H 8.27 4.94 0.00 2.89 3.19 0.00 5.76 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 0.00 195 G 8.26 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 0.00 196 Q 8.87 4.35 0.00 2.13 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.62 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 197 E 7.81 4.88 0.00 1.94 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 2.24 2.30 0.00 198 S 7.96 4.50 0.00 3.61 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 L 8.55 4.19 0.00 1.89 1.80 1.09 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 200 H 8.04 4.13 0.00 2.92 3.30 0.00 5.62 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 Y 7.97 4.81 0.00 3.16 2.86 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 0.00 202 E 8.57 5.12 0.00 2.19 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 2.47 2.33 0.00 203 G 8.95 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 0.00 204 R 7.66 4.89 0.00 2.02 2.00 0.00 3.33 0.00 0.00 3.22 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 205 A 7.80 5.04 0.85 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 0.00 206 V 8.86 5.49 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 0.53 0.00 0.00 0.59 0.00 0.00 207 T 8.44 5.08 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 1.32 0.00 0.00 208 I 8.61 5.00 1.67 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.55 0.65 0.00 0.00 209 A 8.51 4.09 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 T 8.24 4.49 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 0.90 0.00 0.00 211 S 8.74 4.18 0.00 3.97 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 0.00 212 D 7.99 4.50 0.00 2.74 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 0.00 213 R 7.65 4.19 0.00 1.98 2.07 0.00 3.35 0.00 0.00 3.03 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 214 D 8.11 4.39 0.00 2.64 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 Q 8.11 2.52 0.00 1.87 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.70 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 216 S 7.60 4.21 0.00 4.02 3.90 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 0.00 217 K 7.80 4.26 0.00 1.64 1.26 0.00 0.87 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.98 1.24 7.81 218 Y 7.77 4.34 0.00 2.72 2.48 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 0.00 219 G 8.29 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 0.00 220 M 8.17 4.13 0.00 2.75 2.29 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 221 L 8.48 4.05 0.00 1.89 1.83 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 222 A 8.20 3.84 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 0.00 223 R 7.94 3.84 0.00 1.98 2.18 0.00 3.32 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 224 L 8.65 3.97 0.00 1.88 1.74 0.83 0.86 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 0.00 225 A 8.41 4.20 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 0.00 226 V 7.91 3.58 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 1.05 0.00 0.00 0.98 0.00 0.00 227 E 8.42 3.99 0.00 2.09 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 0.00 2.61 2.46 0.00 228 A 8.46 4.20 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 G 7.65 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 0.00 230 F 7.76 4.14 0.00 3.21 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 0.00 231 D 8.87 4.71 0.00 2.80 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 0.00 232 W 8.75 5.42 0.00 3.35 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 0.00 233 V 8.43 4.59 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.89 0.00 0.00 234 S 8.75 4.48 0.00 2.72 3.41 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 0.00 235 Y 8.40 4.77 0.00 3.00 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 0.00 236 V 7.89 3.73 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 0.72 0.00 0.00 1.06 0.00 0.00 237 S 7.75 4.68 0.00 3.87 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 R 8.64 4.31 0.00 1.88 2.26 0.00 3.42 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 239 R 7.97 4.34 0.00 1.87 2.07 0.00 3.39 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 240 H 7.65 4.55 0.00 3.23 3.28 0.00 5.25 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 I 7.90 4.36 1.56 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.66 0.67 0.00 0.00 242 Y 8.72 4.96 0.00 3.13 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 C 8.41 5.13 0.00 1.74 1.67 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 0.00 244 S 9.33 5.20 0.00 4.01 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 0.00 245 V 8.44 5.11 2.14 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 0.71 0.00 0.00 1.03 0.00 0.00 246 K 10.01 5.07 0.00 1.72 1.77 0.00 1.68 0.00 0.00 1.64 0.00 0.00 3.17 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.71 1.74 7.81 247 S 8.27 4.40 0.00 4.00 3.90 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 0.00 248 D 8.50 4.49 0.00 2.68 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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.