NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 G 3.7765 8.3549 109.6619 45.3624 0.0000 173.1700 7 Y 4.6100 8.3135 120.1029 55.0272 41.4995 173.7720 8 D 4.9039 9.3399 124.8652 52.1371 45.4692 176.5408 9 N 4.4489 8.7163 122.2146 56.1170 38.6546 177.4736 10 R 4.5169 7.8480 121.1931 58.6751 29.9682 177.8866 11 E 3.9314 8.1811 118.6632 59.1874 29.6558 178.5940 12 I 4.3769 7.8149 120.8004 63.3841 37.2041 178.4284 13 V 4.1240 7.9087 118.4201 66.1911 31.4612 177.5680 14 M 4.2074 8.2701 117.4540 57.1085 32.3924 177.9126 15 K 4.4078 7.8024 116.8273 58.0157 32.7334 177.6858 16 Y 4.5348 8.6465 118.6109 59.1531 38.7908 175.5070 17 I 4.5184 7.8999 119.4400 62.6464 38.1282 176.8272 18 H 4.8623 7.9771 117.7690 58.2522 29.0895 175.8621 19 Y 3.6568 7.2593 121.6617 59.7688 38.4379 177.3317 20 K 3.9249 7.8997 118.0315 57.8722 32.5195 177.8882 21 L 4.3275 7.4539 117.9375 56.2317 42.9215 178.1000 22 S 4.1194 8.5598 112.6880 61.6791 62.2793 175.0414 23 Q 3.9269 7.1309 121.2514 58.5544 28.8313 177.3262 24 R 4.1391 9.2078 115.7809 56.2180 31.1912 173.3922 25 G 3.1271 7.1220 106.3497 44.9841 0.0000 171.3817 26 Y 4.5482 7.2840 128.4493 57.0008 41.4262 171.2770 27 E 4.4235 7.1820 117.4729 55.6891 32.9488 175.3997 28 W 4.0339 9.0857 117.7938 57.1085 28.2360 172.9042 29 D 3.8854 8.1106 114.9391 54.0578 42.6586 174.7464 *48 E 4.9661 8.1774 124.9088 56.3264 30.7035 176.4479 *89 V 4.4641 8.0502 119.3083 61.8682 33.2448 177.4619 90 V 4.0392 7.6912 111.4056 61.7997 31.6154 177.3160 91 H 4.3487 8.3837 116.1418 58.7849 28.1058 176.9092 92 L 3.3343 8.0751 121.4450 58.3893 41.2902 178.6890 93 T 4.0668 8.0008 109.7782 63.9155 68.9632 176.6770 94 L 3.6195 7.5266 121.9155 57.4124 41.6198 178.9575 95 R 4.0227 8.8887 119.7014 58.9328 29.4011 177.8746 96 Q 3.6577 8.0082 117.5354 59.5712 29.1459 179.2917 97 A 4.1240 8.1592 121.6037 54.4951 18.3914 179.9349 98 G 3.7487 8.3323 104.8621 47.8634 0.0000 175.3772 99 D 4.4329 8.9453 121.8073 57.4454 41.1746 178.2939 100 D 4.4345 7.8545 118.1464 57.1808 40.6477 178.6341 101 F 4.3095 7.9194 120.1525 61.3557 39.6037 177.0097 102 S 3.5476 8.3277 114.0339 61.5793 62.2004 176.6561 103 R 3.7485 7.5161 120.3911 59.1123 30.0174 178.0717 104 R 3.8661 7.9159 117.1447 58.9429 31.3142 177.8723 105 Y 4.3532 8.3170 117.3350 57.2604 35.8266 177.3022 106 R 4.2394 7.2901 124.1949 58.8889 30.9135 177.4333 107 R 3.9149 7.8076 117.3011 59.5652 29.8653 178.4847 108 D 4.5726 8.2267 118.1433 57.3501 40.7473 178.8044 109 F 4.2598 8.2279 120.7716 61.3206 39.5040 177.1397 110 A 3.9601 8.4272 120.6517 55.3264 17.8495 179.4045 111 E 3.9210 8.6991 117.4051 59.9308 29.0038 179.5718 112 M 4.0966 7.7111 118.1442 58.0751 31.8634 178.8215 113 S 4.1861 8.0030 113.6245 61.4303 62.5564 176.0852 114 S 4.1057 8.2062 115.9614 61.2550 61.9407 175.6930 115 Q 3.9502 7.7895 122.0252 59.5011 28.5778 178.7043 116 L 4.1216 7.4713 117.3917 58.0399 41.6794 178.7466 117 H 4.4795 7.8167 117.7966 58.8920 29.8244 176.7861 118 L 4.0293 7.7255 122.1362 57.1052 42.3035 177.6378 119 T 3.8298 6.9266 107.8879 60.9253 69.0674 172.5689 120 P 4.2872 0.0000 0.0000 64.2352 31.9071 176.3184 121 F 4.4874 7.2978 117.9408 58.4358 39.4084 174.6136 122 T 4.6041 8.2266 111.9777 60.0658 71.9024 174.6774 123 A 4.1369 8.6697 121.4951 55.8679 18.1812 179.7663 124 R 2.7216 8.1699 116.3891 59.0215 30.1895 178.3822 125 G 3.5638 8.0494 105.0382 48.0250 0.0000 175.0919 126 R 4.1249 8.2612 122.7869 58.2551 30.2193 178.7072 127 F 4.3037 8.0358 119.4003 61.5563 38.7784 177.0470 128 A 3.9809 7.9731 120.0939 55.0094 17.9311 179.6043 129 T 3.9027 7.8061 114.7281 66.2046 68.8287 177.6383 130 V 3.3656 8.0172 121.8873 64.3072 31.5141 178.8325 131 V 3.2574 7.2659 119.7837 63.9592 31.0708 178.1810 132 E 3.7658 7.2927 118.5695 59.0110 29.5829 178.0779 133 E 3.9338 7.5106 117.7142 59.0704 29.7562 177.9747 134 L 3.7051 7.0729 118.7742 57.4444 43.2247 178.0055 135 F 4.9290 6.9436 116.7566 55.7851 38.0653 175.8327 136 R 4.2960 7.6077 121.6146 57.6918 31.4263 176.3520 137 D 4.7778 7.5901 115.5868 54.6920 41.6559 174.9262 138 G 3.5364 8.1116 105.9014 44.2387 0.0000 173.7645 139 V 4.2225 6.7155 110.2547 59.0992 35.7293 174.4912 140 N 3.8416 8.0284 116.6641 51.2022 42.6341 175.1462 141 W 4.1925 7.4042 122.9363 59.8637 27.5073 178.7290 142 G 3.5833 7.9917 105.7831 47.9454 0.0000 175.6641 143 R 3.8830 7.9456 120.9411 58.7639 30.2209 179.0780 144 I 4.1166 8.1884 119.6341 64.6533 37.1038 178.6379 145 V 3.6460 8.0311 118.7261 65.7159 31.2372 177.8089 146 A 3.5086 7.5032 120.6850 54.2293 18.4735 179.1252 147 F 4.0752 8.4905 119.5056 61.8150 39.5856 177.5232 148 F 4.1190 8.7746 116.7992 60.2293 38.7015 177.3508 149 E 4.0997 8.0176 118.7581 59.3317 29.4521 178.5778 150 F 4.3987 8.7716 120.8152 61.3369 39.3150 176.9460 151 G 3.9566 8.2367 105.4747 47.9876 0.0000 175.6366 152 G 3.7521 8.1719 108.2339 47.4942 0.0000 175.7133 153 V 3.5586 7.7230 121.0705 65.9003 31.3686 177.4700 154 M 3.9511 8.3035 118.0964 59.1385 31.9421 178.0913 155 C 4.0975 7.7581 116.6410 62.6220 28.2068 175.9952 156 V 3.4473 7.6279 119.9064 65.9862 30.9838 177.7902 157 E 3.8782 8.1670 118.9688 59.4761 29.4262 178.4442 158 S 4.0862 7.7926 115.5543 61.7568 62.6961 176.9092 159 V 3.5449 7.6849 121.8769 65.1688 30.9890 177.5810 160 N 4.4683 7.7111 116.6100 55.3104 38.8864 175.5063 161 R 4.4542 8.1931 119.5147 55.9983 32.4402 175.5699 162 E 3.8452 8.3820 111.7563 57.0628 27.2455 174.6829 163 M 4.8625 8.2446 112.4188 53.4564 33.5097 176.7798 164 S 4.1462 8.6889 115.5062 61.5185 63.2163 174.0984 165 P 4.0118 0.0000 0.0000 65.9255 30.9412 178.1213 166 L 3.9057 8.0123 118.8252 57.9802 41.8759 178.8898 167 V 3.5373 8.4807 119.1256 66.3577 31.3730 177.5535 168 D 4.3571 8.1361 117.4522 57.0369 40.9614 177.7855 169 N 3.5951 7.9320 117.6674 56.4588 38.9444 176.7876 170 I 3.4156 7.1698 120.3228 64.4182 37.1759 178.1299 171 A 4.0292 7.8255 121.3518 54.8281 18.1287 179.5833 172 L 3.9205 7.3643 118.4424 58.0173 42.2053 178.9589 173 W 4.5425 7.7497 118.9425 60.5173 28.9724 178.2621 174 M 4.7899 8.2481 118.3184 59.2086 31.3525 179.1917 175 T 4.0757 7.7169 114.4194 66.5599 68.5891 176.6649 176 E 3.9607 8.3574 120.4924 59.6284 29.5923 178.6289 177 Y 4.3905 8.3165 116.5824 61.6719 37.8967 179.2734 178 L 4.0922 7.8542 117.9495 56.7904 41.6725 178.0116 179 N 4.9514 7.8103 115.9624 52.5817 40.0026 174.8656 180 R 4.5139 7.6365 115.1383 55.2677 31.6616 174.0859 181 H 4.5397 8.3491 117.7327 56.2971 35.6803 175.2953 182 L 4.6164 7.5172 116.9931 55.0814 42.0950 177.9952 183 H 4.3195 8.1131 121.3523 58.8595 29.8919 177.3466 184 T 3.8887 7.7318 111.3416 64.3272 68.9751 176.6727 185 W 4.0345 7.9468 121.6693 59.4431 29.0924 177.8410 186 I 3.8034 7.6373 119.4533 65.1124 36.4554 178.0386 187 Q 3.8877 7.4932 117.9749 59.3943 28.8301 177.9463 188 D 4.4253 7.7500 117.8698 56.1790 42.1282 176.8065 189 N 4.9453 8.3111 118.2128 52.6259 37.6323 175.4664 190 G 3.8878 8.1656 104.9590 45.2705 0.0000 174.8707 191 G 4.0389 8.2428 108.9530 45.6974 0.0000 173.9138 192 W 4.5587 8.8053 116.2112 60.1147 28.7428 177.3508 193 D 4.4062 8.2014 117.2112 57.7391 40.4624 178.4334 194 A 4.0093 8.1799 120.8102 54.6653 18.4124 179.1816 195 F 4.0778 7.8562 119.4830 61.7088 39.4685 177.5884 196 V 3.5818 8.0258 117.6385 65.5924 31.0954 177.6106 197 E 3.9200 7.6400 118.7224 59.5303 29.4564 177.9891 198 L 3.7902 7.6959 118.9028 54.9841 43.0198 177.2092 199 Y 4.6480 7.3996 119.2621 56.4993 37.2093 175.6124 200 G 4.5553 7.3275 108.6174 41.8580 0.0000 170.0673 201 P 4.3782 0.0000 0.0000 62.8531 31.3107 176.4659 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 6 G 8.35 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 7 Y 8.31 4.61 0.00 2.92 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 D 9.34 4.90 0.00 2.66 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 9 N 8.72 4.45 0.00 2.82 2.91 0.00 0.00 6.64 7.43 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 10 R 7.85 4.52 0.00 1.90 1.92 0.00 3.20 0.00 0.00 3.21 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.52 0.00 11 E 8.18 3.93 0.00 2.09 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 0.00 2.39 2.39 0.00 12 I 7.81 4.38 2.23 0.00 0.00 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 1.67 0.97 1.22 0.00 0.00 13 V 7.91 4.12 2.41 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 0.99 0.00 0.00 1.21 0.00 0.00 14 M 8.27 4.21 0.00 1.69 2.19 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.37 0.00 15 K 7.80 4.41 0.00 2.13 2.04 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.82 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.28 1.86 7.81 16 Y 8.65 4.53 0.00 3.23 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 17 I 7.90 4.52 2.22 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.02 1.03 0.00 0.00 18 H 7.98 4.86 0.00 3.93 3.91 0.00 5.46 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 7.26 3.66 0.00 2.60 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 20 K 7.90 3.92 0.00 1.74 1.80 0.00 2.00 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.50 7.81 21 L 7.45 4.33 0.00 1.63 1.20 0.45 0.50 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 22 S 8.56 4.12 0.00 3.93 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 23 Q 7.13 3.93 0.00 1.69 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.46 0.00 0.00 0.00 0.00 0.00 2.25 2.20 0.00 24 R 9.21 4.14 0.00 1.69 1.89 0.00 3.30 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 1.46 1.61 0.00 25 G 7.12 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 0.00 0.00 0.00 26 Y 7.28 4.55 0.00 2.78 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 27 E 7.18 4.42 0.00 1.22 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 2.06 2.15 0.00 28 W 9.09 4.03 0.00 3.69 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 D 8.11 3.89 0.00 2.48 2.43 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 *48 E 8.18 4.97 0.00 2.31 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 2.47 2.60 0.00 *89 V 8.05 4.46 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.97 0.00 0.00 90 V 7.69 4.04 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 1.03 0.00 0.00 1.07 0.00 0.00 91 H 8.38 4.35 0.00 3.52 3.69 0.00 5.49 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 92 L 8.08 3.33 0.00 1.66 1.72 0.91 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 93 T 8.00 4.07 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 1.16 0.00 0.00 94 L 7.53 3.62 0.00 1.73 1.31 0.58 -0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 95 R 8.89 4.02 0.00 1.67 1.71 0.00 3.10 0.00 0.00 3.01 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.24 0.00 96 Q 8.01 3.66 0.00 2.34 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.60 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 97 A 8.16 4.12 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 98 G 8.33 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 D 8.95 4.43 0.00 2.90 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 0.00 100 D 7.85 4.43 0.00 2.97 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 0.00 101 F 7.92 4.31 0.00 3.26 3.32 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.33 3.55 0.00 3.84 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 0.00 103 R 7.52 3.75 0.00 1.96 1.96 0.00 3.25 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 104 R 7.92 3.87 0.00 2.13 1.96 0.00 3.35 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 105 Y 8.32 4.35 0.00 2.38 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 0.00 106 R 7.29 4.24 0.00 2.06 1.88 0.00 3.18 0.00 0.00 3.27 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 107 R 7.81 3.91 0.00 1.88 1.97 0.00 3.18 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.71 0.00 108 D 8.23 4.57 0.00 2.96 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 0.00 109 F 8.23 4.26 0.00 3.15 3.23 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 0.00 110 A 8.43 3.96 1.43 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 0.00 0.00 111 E 8.70 3.92 0.00 2.18 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 2.34 2.37 0.00 112 M 7.71 4.10 0.00 2.02 2.27 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.67 0.00 113 S 8.00 4.19 0.00 3.30 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 S 8.21 4.11 0.00 4.08 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 0.00 115 Q 7.79 3.95 0.00 2.37 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.56 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 116 L 7.47 4.12 0.00 2.06 1.90 1.06 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.82 4.48 0.00 3.07 3.48 0.00 5.77 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 L 7.73 4.03 0.00 1.81 1.69 0.89 1.01 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 0.00 119 T 6.93 3.83 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 1.17 0.00 0.00 120 P 0.00 4.29 0.00 2.10 2.10 0.00 3.05 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.74 0.00 121 F 7.30 4.49 0.00 3.10 2.97 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 0.00 122 T 8.23 4.60 4.35 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 0.00 0.00 0.00 1.29 0.00 0.00 123 A 8.67 4.14 1.60 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 0.00 0.00 124 R 8.17 2.72 0.00 1.75 1.77 0.00 3.02 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.50 0.00 125 G 8.05 3.56 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 0.00 126 R 8.26 4.12 0.00 2.17 2.22 0.00 3.30 0.00 0.00 3.33 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.90 0.00 127 F 8.04 4.30 0.00 3.17 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 7.97 3.98 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 0.00 129 T 7.81 3.90 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 1.25 0.00 0.00 130 V 8.02 3.37 1.60 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 0.29 0.00 0.00 -0.91 0.00 0.00 131 V 7.27 3.26 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 0.43 0.00 0.00 0.28 0.00 0.00 132 E 7.29 3.77 0.00 2.10 1.88 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 2.25 2.25 0.00 133 E 7.51 3.93 0.00 1.99 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 0.00 2.22 2.26 0.00 134 L 7.07 3.71 0.00 1.36 0.62 0.71 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 0.00 135 F 6.94 4.93 0.00 2.95 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 0.00 136 R 7.61 4.30 0.00 1.87 1.87 0.00 3.17 0.00 0.00 3.18 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.68 0.00 137 D 7.59 4.78 0.00 2.61 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.11 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 6.72 4.22 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 0.02 0.00 0.00 -1.11 0.00 0.00 140 N 8.03 3.84 0.00 2.30 2.20 0.00 0.00 6.22 7.34 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 0.00 141 W 7.40 4.19 0.00 3.45 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 0.00 142 G 7.99 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 7.95 3.88 0.00 2.10 2.17 0.00 3.09 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 144 I 8.19 4.12 2.36 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 1.63 1.14 1.44 0.00 0.00 145 V 8.03 3.65 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 0.68 0.00 0.00 0.89 0.00 0.00 146 A 7.50 3.51 1.05 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 0.00 147 F 8.49 4.08 0.00 3.16 3.56 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 0.00 148 F 8.77 4.12 0.00 3.23 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 E 8.02 4.10 0.00 2.45 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 0.00 2.46 2.31 0.00 150 F 8.77 4.40 0.00 3.40 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 0.00 151 G 8.24 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 0.00 0.00 0.00 152 G 8.17 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 V 7.72 3.56 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 0.87 0.00 0.00 1.22 0.00 0.00 154 M 8.30 3.95 0.00 2.24 2.32 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.87 0.00 155 C 7.76 4.10 0.00 2.99 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 V 7.63 3.45 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 0.90 0.00 0.00 0.90 0.00 0.00 157 E 8.17 3.88 0.00 2.17 1.88 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 2.24 2.27 0.00 158 S 7.79 4.09 0.00 3.88 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 0.00 159 V 7.68 3.54 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 0.54 0.00 0.00 0.89 0.00 0.00 160 N 7.71 4.47 0.00 2.79 2.97 0.00 0.00 7.05 8.30 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 0.00 161 R 8.19 4.45 0.00 2.01 1.88 0.00 3.45 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 162 E 8.38 3.85 0.00 2.12 1.97 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 2.23 2.27 0.00 163 M 8.24 4.86 0.00 2.03 1.93 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 2.51 2.57 0.00 164 S 8.69 4.15 0.00 3.94 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 P 0.00 4.01 0.00 2.15 2.15 0.00 3.51 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 2.13 2.19 0.00 166 L 8.01 3.91 0.00 1.90 1.68 0.98 0.71 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 0.00 167 V 8.48 3.54 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 1.11 0.00 0.00 0.90 0.00 0.00 168 D 8.14 4.36 0.00 2.94 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 N 7.93 3.60 0.00 2.49 1.60 0.00 0.00 7.09 7.37 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 0.00 170 I 7.17 3.42 1.76 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 1.67 0.58 0.77 0.00 0.00 171 A 7.83 4.03 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 0.00 172 L 7.36 3.92 0.00 1.77 1.42 0.88 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 173 W 7.75 4.54 0.00 3.37 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 0.00 174 M 8.25 4.79 0.00 2.29 2.25 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.67 0.00 175 T 7.72 4.08 4.50 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 1.25 0.00 0.00 176 E 8.36 3.96 0.00 2.25 2.01 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 2.36 2.40 0.00 177 Y 8.32 4.39 0.00 3.43 2.97 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 0.00 178 L 7.85 4.09 0.00 1.89 1.81 1.19 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 179 N 7.81 4.95 0.00 2.73 2.76 0.00 0.00 6.93 8.35 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 0.00 180 R 7.64 4.51 0.00 1.91 1.86 0.00 3.33 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 181 H 8.35 4.54 0.00 3.50 3.22 0.00 5.93 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 L 7.52 4.62 0.00 1.61 1.59 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 183 H 8.11 4.32 0.00 3.38 3.29 0.00 5.86 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 0.00 184 T 7.73 3.89 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 185 W 7.95 4.03 0.00 3.31 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 I 7.64 3.80 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 1.86 0.94 0.99 0.00 0.00 187 Q 7.49 3.89 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.96 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 188 D 7.75 4.43 0.00 2.82 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 0.00 189 N 8.31 4.95 0.00 2.81 2.94 0.00 0.00 6.88 7.74 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 0.00 190 G 8.17 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 0.00 191 G 8.24 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 0.00 192 W 8.81 4.56 0.00 2.61 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 D 8.20 4.41 0.00 2.84 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 0.00 194 A 8.18 4.01 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 0.00 0.00 0.00 0.00 0.00 195 F 7.86 4.08 0.00 2.83 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.03 3.58 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 0.91 0.00 0.00 0.92 0.00 0.00 197 E 7.64 3.92 0.00 2.14 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 2.27 2.32 0.00 198 L 7.70 3.79 0.00 1.17 0.22 0.23 -0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 199 Y 7.40 4.65 0.00 2.88 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 G 7.33 4.56 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 0.00 201 P 0.00 4.38 0.00 2.03 1.98 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 2.00 2.05 0.00 * Residues marked with a * may have inaccurate shift predictions.