NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 64 E 4.2607 8.4444 121.4714 56.0822 31.0455 176.1086 65 I 3.9190 8.2413 128.0501 60.8401 37.4868 176.0300 66 K 4.4102 7.6378 121.4227 54.2783 33.0993 173.9162 67 I 4.3063 7.9505 122.8089 60.8414 38.6459 174.9628 68 V 4.4580 8.6247 123.1786 59.8847 33.6758 175.4921 69 K 4.2542 8.0997 122.0257 55.4128 34.9090 176.9752 70 Y 3.5999 7.9461 120.1664 60.3704 39.5016 175.7652 71 P 3.6338 0.0000 0.0000 63.2259 31.7520 176.4309 72 D 3.9341 7.3837 120.2924 53.4777 41.5238 175.2655 73 P 4.2903 0.0000 0.0000 64.6527 31.9527 178.2868 74 I 3.6885 7.8217 118.7721 63.7759 38.2038 177.5254 75 L 4.2044 7.7763 119.4440 56.5714 41.4893 177.9210 76 R 4.6199 7.6945 116.0250 56.0403 31.2306 176.5676 77 R 4.3092 7.8049 118.8275 55.6552 31.7568 175.4040 78 R 4.5210 8.1952 120.1994 54.8463 31.4707 175.7669 79 S 4.9136 8.4774 122.6888 57.9685 64.3164 173.4594 80 E 4.5139 8.8781 123.1404 54.8721 31.5784 175.8847 81 V 4.0460 8.1683 122.5118 63.1171 32.2446 176.0681 82 T 3.9406 9.1843 125.5974 63.9797 69.0155 173.3482 83 N 4.2952 8.3581 122.5091 54.8013 39.8541 176.0238 84 F 4.6533 7.0138 121.2734 56.7480 38.0018 175.3233 85 D 4.6850 8.2134 126.9801 51.2528 39.3037 175.5708 86 D 4.6982 8.4402 125.4047 55.2687 43.8889 177.0892 87 N 4.4544 9.0166 118.1958 54.0429 36.0753 174.4202 88 L 4.8683 7.2993 117.9337 54.2468 42.7195 177.9656 89 K 4.2001 8.0250 116.9743 57.3190 32.4553 178.3530 90 R 3.9945 7.7962 119.5524 59.1435 29.9302 178.6415 91 V 3.5811 7.1813 116.9432 65.9843 31.5702 177.9136 92 V 3.7717 7.6021 116.3343 65.3021 31.7139 177.8103 93 R 4.3370 7.9161 118.3277 58.7481 30.2738 178.4876 94 K 4.6323 8.4045 119.5485 56.5035 31.7995 179.2280 *96 F 4.5965 7.9552 118.7527 57.8481 41.2391 176.7647 97 D 4.6894 8.5794 120.5371 57.8517 41.0192 179.0787 98 I 3.8072 8.0287 117.4607 63.0169 37.2994 177.4021 *100 Y 4.9150 7.9257 120.3318 58.2428 39.4992 177.1024 101 E 4.1373 8.5953 119.0777 58.3442 29.8440 177.3376 102 S 4.6515 7.8682 112.5231 57.3763 63.7412 174.2625 103 K 4.1153 7.8260 117.5522 58.0227 29.6110 174.5484 104 G 3.8893 7.5141 104.7839 43.7311 0.0000 171.7299 105 I 4.0802 7.4969 118.3266 60.8101 39.2538 174.8071 106 G 4.5272 7.3865 106.4795 45.7996 0.0000 171.3722 107 L 4.6618 8.2287 119.6677 54.2556 46.2386 173.4172 108 S 5.0486 8.1407 116.5080 56.3123 66.5992 174.8356 109 A 3.9695 8.6975 124.2484 55.0080 18.5436 178.5416 110 P 4.4148 0.0000 0.0000 65.1366 31.6470 178.4206 111 Q 4.1585 7.9747 116.1499 57.8478 28.6274 177.7827 112 V 5.2557 7.3561 110.4653 60.1366 32.2567 174.7772 113 N 4.1418 8.4417 115.8843 54.9050 37.5896 174.5207 114 I 4.4272 7.4139 116.9380 59.4870 40.7716 175.9583 115 S 4.7514 8.4092 124.6802 57.2663 60.1730 172.7554 116 K 5.0084 7.4934 119.6220 53.6440 36.4787 178.6304 117 R 4.3810 8.4282 122.6819 56.3922 27.8635 176.0774 118 I 5.0097 7.4420 120.3690 59.5607 41.5246 176.5282 119 I 5.1485 8.7128 126.0392 59.9722 41.6885 174.7187 120 V 5.1609 8.8122 119.1432 59.8719 36.5331 174.1544 121 W 5.4108 8.8319 118.2593 56.9147 32.0126 172.7923 122 N 5.0704 8.9770 116.5833 53.3545 40.4921 174.5693 123 A 4.4184 9.5124 130.0925 53.9899 19.5622 177.2198 124 L 4.8460 8.5807 116.7647 53.2952 41.3847 176.4687 125 Y 4.7741 8.2172 114.5862 57.4744 38.9714 176.8409 126 E 4.2106 7.6224 119.1980 56.6011 29.9911 177.1057 127 K 4.3361 7.3234 117.8325 55.2343 33.2373 173.8827 128 R 3.7323 8.0898 123.9978 57.1575 29.5100 175.9110 129 K 4.4872 8.2457 122.4962 54.1164 34.5239 176.9462 130 E 3.7930 8.9708 124.0833 59.7357 29.4339 179.2869 131 E 3.6954 8.0793 115.1732 58.4375 29.5398 177.5265 132 N 4.6561 7.7305 115.1973 54.0526 39.2331 175.2424 133 E 4.5870 8.7333 120.3176 56.0096 30.4209 176.5765 134 R 4.2490 9.4784 120.5014 54.3759 32.1988 174.1039 135 I 4.6617 7.9294 124.6255 59.5919 39.2594 175.3053 136 F 4.5671 9.2972 124.9670 55.9744 42.8004 173.6252 137 I 4.8719 8.9101 124.8200 60.1271 39.9478 175.3386 138 N 4.3881 8.6645 121.7145 53.9590 36.2880 171.9830 139 P 5.1193 0.0000 0.0000 62.9620 33.4010 176.5905 140 S 4.9110 8.9933 114.2399 57.3804 67.7420 173.6020 141 I 4.1084 8.2290 125.4443 60.8168 36.7524 176.1420 142 V 3.9924 8.6837 122.1855 63.5811 32.3770 176.7796 143 E 4.8624 7.7102 116.8842 55.3257 33.6906 174.6708 144 Q 5.1596 8.7045 120.9018 54.3123 31.9804 174.6614 145 S 4.5382 8.1784 114.6288 57.2977 64.5120 174.6950 146 L 4.0448 8.4887 121.6080 57.9150 42.4286 177.5201 147 V 3.6638 7.6792 118.2500 63.1877 31.8952 174.4805 148 K 5.3080 8.1056 124.2943 55.0607 36.5054 174.8379 149 L 4.3764 8.2864 120.5566 54.4615 45.9000 174.2039 150 K 4.7677 8.7353 126.3584 55.3347 33.1153 175.8854 151 L 4.9283 8.4322 124.4450 52.5307 45.9532 176.6032 152 I 4.3380 8.3172 122.0477 61.8598 38.1026 175.3000 153 E 4.5694 9.1890 123.3828 55.2932 34.3825 174.8469 154 G 4.3852 7.6104 108.4637 46.0886 0.0000 170.7910 155 C 4.6099 8.0512 115.1419 58.2488 34.2238 175.4057 156 L 4.2621 8.6455 126.6008 57.9217 41.7007 178.3250 157 S 4.4437 8.1326 112.6756 59.4083 63.1948 173.6926 158 F 4.9627 8.9285 121.4976 56.4056 42.0610 175.7206 159 G 3.9717 9.0317 112.9879 46.1189 0.0000 172.5554 160 I 4.5086 7.8702 120.8735 59.6151 39.4207 174.4366 161 E 4.9788 7.8610 120.9270 54.9521 32.7483 174.1139 162 G 4.0212 8.5412 111.8196 46.2977 0.0000 172.0435 163 K 5.2154 8.4976 119.1245 55.5755 33.6064 177.2460 164 V 4.4244 8.0111 119.7090 61.9360 35.0520 171.7451 165 E 5.1582 8.6871 127.9763 54.9467 31.0744 175.0323 166 R 4.7902 8.5792 124.1426 54.1189 35.2658 173.0438 167 P 4.6455 0.0000 0.0000 62.4363 30.9147 176.8673 168 S 4.2208 8.7458 116.9684 60.9117 62.8934 173.9587 169 I 4.9220 7.4904 120.2665 59.4203 40.2716 175.0892 170 V 4.7474 8.5670 118.7228 59.5494 35.5782 174.3448 171 S 4.8659 9.4731 120.0234 56.9584 63.9405 173.0372 172 I 5.1563 8.6110 126.8997 59.7648 41.8434 174.3639 173 S 4.9035 8.7829 117.3775 57.6800 66.6963 172.8616 174 Y 5.5250 7.6460 119.7400 57.8581 41.9017 172.1987 175 Y 5.3596 9.9004 117.2410 56.2373 41.7321 176.1223 176 D 4.9017 9.1632 122.7502 51.9280 41.0333 177.1043 177 I 3.2834 8.3275 118.9660 63.4588 37.7243 175.6078 178 N 4.8767 8.6058 114.6264 53.1141 39.2557 175.1322 179 G 3.8895 9.1048 107.9367 45.2217 0.0000 173.1629 180 Y 4.5372 8.2289 118.4620 56.8961 38.7571 174.5795 181 K 4.1449 8.7122 126.2888 56.4391 32.9478 175.4334 182 H 4.9489 8.4293 123.0214 53.8707 33.5021 172.0653 183 L 4.8230 8.2382 118.8357 53.0612 44.3217 176.3607 184 K 4.7230 8.6542 121.3093 55.1140 37.3370 175.1347 185 I 4.6451 8.3555 123.7061 60.0068 38.5363 174.9703 186 L 4.8629 8.6609 128.3426 53.0935 43.5483 176.0291 187 K 4.7475 8.6011 121.4025 55.4489 35.7148 176.0365 188 G 4.0524 8.3781 107.5568 44.6485 0.0000 176.8783 189 I 3.5914 8.4394 122.8601 63.8707 37.6806 176.7810 190 H 4.3200 8.0015 116.4447 58.0952 28.7874 177.3390 191 S 4.1011 7.9834 114.6321 60.7567 62.2371 176.0909 192 R 3.8307 7.5554 121.6057 59.3450 29.8365 178.4040 193 I 3.3039 7.0029 119.0407 64.1595 36.4552 177.7899 194 F 3.7612 7.0817 121.2090 61.6194 39.2182 176.9891 195 Q 4.3807 7.9369 117.2803 59.7214 28.3415 178.2790 196 H 3.9911 8.0379 117.7590 59.5017 30.0807 176.6109 197 E 4.1411 9.1139 120.6066 59.2919 29.3705 178.9976 198 F 3.9239 8.9880 121.1908 61.7167 39.2985 176.7271 199 D 4.2694 7.9502 117.7442 58.0245 40.4741 178.6467 200 H 4.1581 7.7997 115.8928 58.9793 28.8299 177.0587 201 L 4.3627 8.0140 120.3876 55.1955 41.3818 177.6330 202 N 4.8386 8.0824 115.8033 52.1161 39.4044 175.1145 203 G 4.1017 7.6898 108.4602 45.8740 0.0000 173.2324 204 T 4.6115 7.6446 115.2224 61.3905 70.5965 174.0617 205 L 4.8398 9.3679 126.3174 52.5038 44.5817 177.7067 206 F 4.3050 8.6174 115.4123 59.1043 38.2269 177.6485 207 I 3.0573 6.9392 114.4121 63.3127 37.6397 176.8647 208 D 4.3613 7.6270 120.1221 56.5201 41.0361 177.3510 209 K 4.2542 7.1376 119.4605 54.9110 31.0046 175.9045 *211 T 4.0576 7.3917 116.8639 62.9338 71.4548 174.0100 212 Q 3.8627 8.6736 125.0991 59.5161 28.8497 179.6446 213 V 3.6185 7.6149 118.5108 66.1278 31.8050 177.6908 214 D 4.2619 7.8290 118.1294 57.0306 40.6005 178.1201 215 K 3.6379 7.9228 119.5015 59.6016 32.2264 178.1693 216 K 4.0194 7.5559 118.2994 59.4518 32.0745 178.4987 217 K 4.1392 7.8531 117.7982 57.8545 31.7610 177.2017 218 V 4.3618 7.2474 117.3694 61.7904 32.1036 177.3678 219 R 3.8791 8.2755 122.1849 59.7019 29.7083 176.4966 220 P 4.2757 0.0000 0.0000 65.7762 31.4132 178.7315 221 K 4.5495 7.9610 117.8387 58.9451 31.9888 179.2590 222 L 4.2123 7.7174 118.4601 58.1150 41.6322 179.4218 223 N 4.5226 8.4053 116.2086 56.1180 38.3919 177.4269 224 E 4.0700 8.5575 120.7851 59.2257 29.5192 179.3143 225 L 4.0911 8.0515 119.2249 57.7871 41.8824 179.3990 226 I 3.6565 7.8402 119.8160 64.4156 36.7670 178.4791 227 R 3.9253 7.7764 117.7898 59.5179 30.0525 178.3212 228 D 4.5296 8.5454 117.8088 57.8056 41.1999 178.2001 229 Y 4.2209 8.6463 120.1523 60.4360 38.5154 177.8881 230 K 3.9386 7.7005 114.1141 57.3392 32.0855 177.7688 231 A 4.0203 7.9102 125.5517 55.1351 18.5723 178.9729 232 T 3.8073 7.3442 112.3102 65.3425 68.6252 173.9164 233 H 4.1134 8.7586 121.1922 56.4186 26.9831 174.7846 234 S 4.7486 7.6637 112.8325 57.4212 62.4074 173.6504 235 E 4.1669 7.9794 123.8795 56.7028 29.3533 177.0990 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 64 E 8.44 4.26 0.00 1.95 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 0.00 2.19 2.31 0.00 65 I 8.24 3.92 1.89 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 1.43 0.81 0.93 0.00 0.00 66 K 7.64 4.41 0.00 1.79 1.71 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.32 7.81 67 I 7.95 4.31 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.60 0.91 0.00 0.00 68 V 8.62 4.46 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 0.84 0.00 0.00 0.97 0.00 0.00 69 K 8.10 4.25 0.00 1.73 1.64 0.00 1.58 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.41 7.81 70 Y 7.95 3.60 0.00 1.43 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 71 P 0.00 3.63 0.00 1.06 1.41 0.00 3.39 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.13 0.00 72 D 7.38 3.93 0.00 2.67 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 73 P 0.00 4.29 0.00 2.20 2.04 0.00 3.64 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.97 0.00 74 I 7.82 3.69 1.86 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 1.28 1.34 0.96 0.00 0.00 75 L 7.78 4.20 0.00 1.99 1.73 0.90 0.71 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 76 R 7.69 4.62 0.00 1.83 1.94 0.00 3.34 0.00 0.00 3.36 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 77 R 7.80 4.31 0.00 1.80 1.87 0.00 3.12 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 78 R 8.20 4.52 0.00 1.76 1.77 0.00 3.20 0.00 0.00 3.19 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 79 S 8.48 4.91 0.00 3.81 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 80 E 8.88 4.51 0.00 1.88 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.22 0.00 81 V 8.17 4.05 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 0.73 0.00 0.00 0.94 0.00 0.00 82 T 9.18 3.94 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 1.16 0.00 0.00 83 N 8.36 4.30 0.00 1.72 1.97 0.00 0.00 7.04 7.45 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 84 F 7.01 4.65 0.00 3.10 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 85 D 8.21 4.68 0.00 2.60 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 86 D 8.44 4.70 0.00 2.84 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 87 N 9.02 4.45 0.00 2.88 2.92 0.00 0.00 6.77 7.85 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 88 L 7.30 4.87 0.00 1.75 1.63 1.01 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 89 K 8.03 4.20 0.00 1.83 1.87 0.00 1.69 0.00 0.00 1.85 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.55 7.81 90 R 7.80 3.99 0.00 1.88 2.00 0.00 3.15 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 91 V 7.18 3.58 2.28 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 0.79 0.00 0.00 0.95 0.00 0.00 92 V 7.60 3.77 2.28 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 1.02 0.00 0.00 0.94 0.00 0.00 93 R 7.92 4.34 0.00 2.27 2.03 0.00 3.39 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 94 K 8.40 4.63 0.00 1.77 1.84 0.00 1.73 0.00 0.00 1.67 0.00 0.00 3.11 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.74 1.64 7.81 *96 F 7.96 4.60 0.00 3.38 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 D 8.58 4.69 0.00 2.94 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 98 I 8.03 3.81 1.94 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.20 0.90 0.00 0.00 *100 Y 7.93 4.92 0.00 3.16 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 E 8.60 4.14 0.00 2.01 2.34 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 2.37 2.33 0.00 102 S 7.87 4.65 0.00 3.90 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 0.00 103 K 7.83 4.12 0.00 2.05 2.08 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.46 7.81 104 G 7.51 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 0.00 105 I 7.50 4.08 1.56 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.68 0.59 0.00 0.00 106 G 7.39 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 0.00 0.00 0.00 0.00 107 L 8.23 4.66 0.00 1.63 1.30 0.89 0.83 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 0.00 108 S 8.14 5.05 0.00 3.71 3.92 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 0.00 0.00 0.00 109 A 8.70 3.97 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.41 0.00 2.15 2.09 0.00 3.77 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 111 Q 7.97 4.16 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.86 0.00 0.00 0.00 0.00 0.00 2.12 2.26 0.00 112 V 7.36 5.26 2.21 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 0.77 0.00 0.00 0.94 0.00 0.00 113 N 8.44 4.14 0.00 2.81 2.89 0.00 0.00 6.81 7.63 0.00 0.00 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130 E 8.97 3.79 0.00 1.96 1.95 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 2.28 2.27 0.00 131 E 8.08 3.70 0.00 1.94 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 2.29 2.26 0.00 132 N 7.73 4.66 0.00 2.97 3.10 0.00 0.00 6.99 7.68 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 0.00 133 E 8.73 4.59 0.00 1.68 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.34 0.00 134 R 9.48 4.25 0.00 0.95 1.51 0.00 2.60 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.59 0.00 135 I 7.93 4.66 1.73 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.72 0.89 0.00 0.00 136 F 9.30 4.57 0.00 2.87 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 0.00 137 I 8.91 4.87 2.18 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.09 0.97 0.00 0.00 138 N 8.66 4.39 0.00 3.17 2.97 0.00 0.00 6.66 7.32 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 0.00 139 P 0.00 5.12 0.00 2.57 2.43 0.00 3.95 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 2.38 2.17 0.00 140 S 8.99 4.91 0.00 3.97 3.83 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 0.00 141 I 8.23 4.11 1.80 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 -0.36 0.83 0.00 0.00 142 V 8.68 3.99 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 0.70 0.00 0.00 0.90 0.00 0.00 143 E 7.71 4.86 0.00 1.80 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 2.25 2.19 0.00 144 Q 8.70 5.16 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.93 0.00 0.00 0.00 0.00 0.00 2.20 2.31 0.00 145 S 8.18 4.54 0.00 3.92 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 0.00 146 L 8.49 4.04 0.00 1.60 1.72 0.92 0.90 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.61 5.16 1.93 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 0.82 -0.10 0.88 0.00 0.00 173 S 8.78 4.90 0.00 3.77 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 0.00 174 Y 7.65 5.52 0.00 3.37 3.35 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 0.00 175 Y 9.90 5.36 0.00 2.97 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 0.00 176 D 9.16 4.90 0.00 2.92 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 0.00 177 I 8.33 3.28 1.90 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 1.45 0.72 0.95 0.00 0.00 178 N 8.61 4.88 0.00 2.77 2.80 0.00 0.00 7.24 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 0.00 179 G 9.10 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 1.33 1.39 7.81 188 G 8.38 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 0.00 189 I 8.44 3.59 1.80 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.61 0.00 0.00 190 H 8.00 4.32 0.00 3.43 3.95 0.00 5.67 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 S 7.98 4.10 0.00 4.00 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 0.00 192 R 7.56 3.83 0.00 1.86 1.87 0.00 3.15 0.00 0.00 3.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 193 I 7.00 3.30 0.56 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.44 0.10 0.00 0.00 194 F 7.08 3.76 0.00 3.03 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 0.00 195 Q 7.94 4.38 0.00 2.37 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.55 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 196 H 8.04 3.99 0.00 2.99 3.34 0.00 5.96 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 E 9.11 4.14 0.00 1.87 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 0.00 2.39 2.44 0.00 198 F 8.99 3.92 0.00 2.36 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 0.00 199 D 7.95 4.27 0.00 2.98 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 0.00 200 H 7.80 4.16 0.00 3.36 3.32 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 0.00 201 L 8.01 4.36 0.00 1.40 1.55 0.87 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 202 N 8.08 4.84 0.00 2.58 2.70 0.00 0.00 7.01 7.35 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 0.00 203 G 7.69 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 0.00 204 T 7.64 4.61 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 1.30 0.00 0.00 205 L 9.37 4.84 0.00 1.85 1.62 1.05 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 206 F 8.62 4.31 0.00 3.15 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 0.00 207 I 6.94 3.06 1.46 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.35 -0.04 0.00 0.00 208 D 7.63 4.36 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 0.00 209 K 7.14 4.25 0.00 1.63 1.72 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.34 7.81 *211 T 7.39 4.06 4.19 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 1.18 0.00 0.00 212 Q 8.67 3.86 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.92 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 213 V 7.61 3.62 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 0.99 0.00 0.00 0.91 0.00 0.00 214 D 7.83 4.26 0.00 2.68 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 0.00 215 K 7.92 3.64 0.00 1.79 1.80 0.00 1.72 0.00 0.00 1.44 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.52 7.81 216 K 7.56 4.02 0.00 2.11 1.91 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.43 7.81 217 K 7.85 4.14 0.00 1.87 1.95 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.44 1.58 7.81 218 V 7.25 4.36 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 0.66 0.00 0.00 0.90 0.00 0.00 219 R 8.28 3.88 0.00 2.09 1.98 0.00 3.16 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 220 P 0.00 4.28 0.00 2.21 2.11 0.00 3.66 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 221 K 7.96 4.55 0.00 1.86 1.93 0.00 2.00 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.42 7.81 222 L 7.72 4.21 0.00 2.05 1.89 0.95 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 223 N 8.41 4.52 0.00 2.93 2.90 0.00 0.00 7.08 7.03 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 0.00 224 E 8.56 4.07 0.00 2.28 2.04 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 2.36 2.55 0.00 225 L 8.05 4.09 0.00 2.15 1.81 1.06 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 226 I 7.84 3.66 2.03 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.26 0.88 0.00 0.00 227 R 7.78 3.93 0.00 2.00 2.01 0.00 3.20 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 228 D 8.55 4.53 0.00 2.81 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 0.00 229 Y 8.65 4.22 0.00 2.84 2.92 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 0.00 0.00 0.00 230 K 7.70 3.94 0.00 1.98 1.82 0.00 1.81 0.00 0.00 1.83 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.74 1.64 7.81 231 A 7.91 4.02 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 0.00 232 T 7.34 3.81 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 0.85 0.00 0.00 233 H 8.76 4.11 0.00 3.28 3.37 0.00 5.64 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 0.00 234 S 7.66 4.75 0.00 3.84 3.77 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 0.00 235 E 7.98 4.17 0.00 1.97 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.24 0.00 * Residues marked with a * may have inaccurate shift predictions.