NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.4608 8.2549 119.0779 55.9712 31.4065 174.2677 5 K 4.7743 8.3359 117.7883 54.2702 37.0446 173.7138 6 R 4.8903 9.9679 123.6760 55.3898 32.0006 175.3178 7 I 4.9681 8.7870 125.4128 59.3235 40.6671 174.2708 8 L 4.8873 8.7641 129.2471 53.7384 44.1660 175.1568 9 I 4.9977 8.6988 127.4681 59.6168 39.7680 174.9190 10 T 4.3263 8.6877 118.8154 61.8749 70.5241 175.6254 11 G 3.8962 9.0538 111.7639 46.4645 0.0000 175.6937 12 G 3.6597 8.1345 108.2150 47.0901 0.0000 174.6585 13 A 4.5317 8.2211 122.3891 52.2087 19.5695 177.6391 14 G 4.4420 7.6878 105.0154 44.2526 0.0000 173.5574 15 F 4.3434 8.8245 120.4926 61.6413 39.3106 177.8490 16 V 2.8754 7.3063 116.9108 65.6998 31.5364 178.3841 17 G 3.6307 7.9891 105.2697 47.8117 0.0000 175.5970 18 S 4.2399 7.9815 116.1687 61.6300 63.0395 176.4069 19 H 4.1967 7.6654 119.5641 58.3170 28.4029 177.5279 20 L 3.8069 7.8600 122.3051 58.2170 41.6597 178.9041 21 T 3.7219 7.7199 114.7731 66.8425 68.5179 175.6331 22 D 4.8574 7.7466 118.7447 57.4716 41.0095 178.6343 23 K 4.1915 7.5612 117.8990 58.8622 33.6267 178.7109 24 L 4.2386 7.4276 121.3667 54.3546 38.3689 177.2192 *27 D 4.4769 8.0065 118.9302 53.3231 43.0377 176.6402 28 G 3.8702 8.2755 107.1108 45.3086 0.0000 173.1816 29 H 4.6254 7.3943 116.0486 55.0739 30.3319 175.0063 30 E 4.5482 8.8742 119.9481 55.5034 30.6035 175.5285 31 V 4.7098 8.5958 125.9143 61.3360 33.9768 174.3579 32 T 4.7239 8.7513 125.0468 61.8002 70.9064 173.3973 33 V 4.6345 8.3371 127.2158 61.2380 33.8199 174.4149 34 V 4.8494 8.2408 127.7316 61.2174 33.9318 173.7275 35 D 4.8359 8.6185 125.8903 53.2556 44.7395 175.1447 36 N 4.6272 8.5983 120.1384 51.9096 38.1174 174.7644 37 F 4.1209 8.1680 116.7171 58.7955 37.1990 176.4929 38 F 4.5953 8.7334 124.7366 61.0823 39.1780 176.0225 39 T 4.2801 7.9301 106.1745 60.7647 70.2134 173.5602 40 G 4.1965 7.8781 110.8331 44.7004 0.0000 172.4823 41 R 4.8291 8.3116 112.6390 54.6838 32.5160 175.9680 42 K 4.0337 8.5904 121.2566 59.6169 32.3893 178.7698 43 R 4.1497 8.0784 117.8367 59.3462 30.0075 177.1576 44 N 4.5755 8.1692 114.3549 55.4216 38.8438 176.0382 45 V 4.3770 7.8914 109.7128 60.5305 33.1102 177.1933 46 E 4.0612 8.2190 120.7779 59.3068 29.4814 178.7474 47 H 4.0792 7.8895 113.9188 57.3463 28.8354 175.9223 48 W 4.5466 7.4207 119.1849 56.8780 29.4819 176.1901 49 I 4.3112 7.2478 120.6245 62.8233 36.6702 175.9749 50 G 4.1369 9.2542 114.1160 45.6858 0.0000 173.3521 51 H 4.4228 8.4974 120.4529 55.6366 30.4278 175.9926 52 E 4.0591 8.7891 123.9997 59.0896 29.6344 177.3485 53 N 4.8343 8.5537 114.9725 52.7052 39.0189 173.3491 54 F 5.3764 8.1555 120.9086 56.3526 42.1712 174.0551 55 E 4.4126 8.0468 125.2667 54.2073 33.2900 173.3803 56 L 4.8689 8.3187 128.0837 53.3608 44.2266 175.1522 57 I 4.4723 8.7019 127.4109 59.3044 40.1091 174.4161 58 N 4.7676 9.0365 126.4470 54.1671 38.8364 173.3794 59 H 4.7503 8.7330 125.2017 55.0364 33.7502 172.1938 60 D 4.6325 8.3250 125.0812 52.7754 41.9383 177.4502 61 V 3.7317 8.3248 120.0623 63.9364 31.7677 178.4159 62 V 3.6888 7.9259 112.4232 62.9812 31.6117 175.9437 63 E 4.5454 7.8613 119.9769 53.7494 30.6689 174.3516 64 P 4.2610 0.0000 0.0000 62.7643 31.9958 175.5625 65 L 4.5791 8.0084 122.7758 53.4729 44.3302 175.5811 66 Y 4.4310 8.6464 124.0683 55.8637 38.3740 174.4537 67 I 4.6524 7.7596 116.4826 58.8245 41.1203 174.9602 68 E 4.5427 8.5815 119.9970 54.8247 30.2425 176.0825 69 V 4.5608 7.8700 115.8300 59.9134 36.2419 174.8898 70 D 4.6992 9.0273 120.9834 56.0767 42.4052 176.8642 71 Q 4.8878 7.7879 115.4911 54.1864 33.8593 174.1982 72 I 4.8553 8.5832 122.7637 59.8725 40.4093 174.2536 73 Y 4.5770 9.1271 126.6218 57.2350 39.1683 174.6987 74 H 5.1032 9.2282 127.1023 54.2310 29.7451 174.7978 75 L 4.6548 8.4120 122.3949 53.8644 43.0651 176.5606 76 A 4.0180 7.9681 122.5466 52.8937 18.0601 176.8762 77 S 4.6572 8.0231 113.7953 57.4385 65.0367 174.6161 78 P 4.5744 0.0000 0.0000 63.0885 31.6434 175.8413 79 A 4.6278 8.5212 121.0995 52.0209 21.4369 176.9983 80 S 4.3765 7.8287 110.5299 56.7191 64.0285 172.5526 81 P 2.9700 0.0000 0.0000 64.9499 31.1878 176.6960 82 P 4.2860 0.0000 0.0000 65.4698 31.2767 177.9129 83 N 4.5956 7.2352 113.9071 55.0518 38.8526 174.8170 84 Y 4.6241 7.8883 118.6107 57.6901 38.7345 176.3681 *86 Y 4.7017 8.0376 121.8449 58.2447 40.7572 175.1296 87 N 4.7696 7.9479 121.2800 50.1389 40.6889 172.1963 88 P 4.3811 0.0000 0.0000 65.6331 31.4586 178.4412 89 I 3.6949 7.7950 119.1067 64.1395 37.1246 178.2038 90 K 3.8623 7.9885 119.2937 59.7401 31.9230 179.4548 91 T 3.9129 7.7917 115.3406 66.6703 68.5506 176.6687 92 L 3.9645 7.9556 120.6976 57.7841 41.6905 179.7382 93 K 3.9479 8.1453 118.3824 59.7078 31.8269 179.4583 94 T 3.8292 7.8666 115.9062 66.9221 68.2111 176.4578 95 N 4.3602 7.8822 116.4406 56.0218 38.8224 176.4223 96 T 4.2054 7.7783 110.9220 63.8319 69.5111 177.0089 97 I 3.7706 7.9277 122.4168 63.2637 37.1470 178.7994 98 G 3.8580 7.8463 106.3249 47.3149 0.0000 175.3925 99 T 3.8736 7.7197 116.6534 66.0486 68.8198 176.3034 100 L 4.0034 7.8588 120.9296 57.7171 41.6245 180.0418 101 N 4.3750 7.8717 113.2493 53.9055 38.1849 176.8916 *103 L 3.9182 8.0058 123.0705 54.6196 43.9883 179.5104 104 G 3.5411 7.8452 105.2414 47.5374 0.0000 175.4066 105 L 3.7454 7.7349 122.5930 57.8183 42.1107 178.8130 106 A 3.8834 7.7902 120.1034 54.9905 18.0395 179.2364 107 K 3.8197 7.8833 116.9870 59.7091 32.3855 178.6749 108 R 4.0324 7.6828 117.2523 59.0999 30.2025 178.0499 109 V 4.1851 7.6236 108.8008 60.3219 32.2510 176.1669 110 G 3.7180 8.0488 106.5592 46.3535 0.0000 173.6219 111 A 4.5943 7.7772 119.8678 50.6679 20.4171 177.7702 112 R 4.3371 8.2976 120.7056 55.4790 31.7574 174.8987 113 L 4.9691 8.5518 128.2062 53.0719 44.9275 174.3829 114 L 4.9881 8.6421 128.4021 53.1821 44.6004 174.4385 115 L 4.6594 8.6454 128.5704 53.7665 43.7895 175.6651 116 A 4.7722 8.3246 129.4374 51.4882 17.3684 177.0499 117 S 4.4410 8.5460 117.1843 57.6975 65.7727 171.9717 118 T 5.0826 7.9617 112.2601 59.4550 70.4523 175.5936 119 S 3.7954 8.5949 122.5406 61.3329 62.6165 176.6163 120 E 4.1007 8.3478 122.1105 58.8884 28.8798 179.3202 121 V 3.5377 7.2076 111.8703 64.1297 31.6306 177.3519 122 Y 4.4699 7.9701 115.8571 58.8559 38.0975 176.7446 123 G 3.7627 8.2482 108.4551 46.9037 0.0000 176.0871 124 D 4.7308 8.9098 124.3541 51.9696 39.9807 174.2368 125 P 4.7792 0.0000 0.0000 62.6004 32.0495 176.5042 126 E 4.6265 8.9691 119.9628 56.0975 30.0282 176.1933 127 V 4.4252 6.8863 110.9888 59.8926 35.5380 174.3000 128 H 4.7034 8.1681 119.9939 53.8765 32.6469 171.6977 129 P 4.2222 0.0000 0.0000 62.9212 32.7521 174.8079 130 Q 4.3012 8.6821 119.3300 54.6991 29.9984 176.1464 131 S 4.9179 8.2313 119.1579 56.6135 65.5903 175.0907 132 E 4.6798 9.1872 118.6106 58.1503 29.3376 177.9658 133 D 4.6981 7.6988 116.0739 54.5058 40.0775 176.0948 134 Y 4.5421 8.0229 122.5515 57.4241 39.1741 175.4766 135 W 4.3496 8.6236 126.5365 57.6278 29.7143 177.6517 136 G 3.7666 6.5800 101.9498 45.6678 0.0000 172.9195 137 H 4.7920 8.8186 118.0007 53.7701 30.3845 171.2647 138 V 4.5334 7.8903 123.4631 60.1996 34.0296 174.5390 139 N 4.5068 8.7418 126.1536 52.5752 38.7267 172.9452 140 P 4.4526 0.0000 0.0000 64.4100 31.8213 176.7834 141 I 4.4564 7.8570 110.4874 60.2149 38.4761 175.5768 142 G 3.9830 7.8041 111.4703 44.1243 0.0000 172.9974 143 P 4.3459 0.0000 0.0000 65.2991 31.4579 177.5272 144 R 4.5342 8.0217 116.1488 56.8167 30.8311 177.9713 145 A 4.0772 8.0685 121.1280 54.9121 17.9242 179.0726 146 C 3.9076 8.2886 112.9501 61.7302 29.2777 175.5247 147 Y 3.7910 7.6821 120.8251 60.0631 38.6180 176.8922 148 D 4.1505 7.9570 119.6478 57.5702 41.0094 178.8251 149 E 4.0328 8.3989 119.2492 59.0082 29.5228 179.4992 150 G 3.5622 7.4409 105.8289 47.8659 0.0000 175.9331 151 K 3.8223 7.8112 120.9763 58.8268 32.0105 179.7242 152 R 3.8058 7.7221 118.6575 59.2888 29.8174 179.5789 153 V 3.7164 7.8093 118.4618 63.8925 31.4458 177.8723 154 A 4.0416 7.5843 120.7426 54.9879 18.5358 179.0327 155 E 4.0319 7.9369 116.5431 59.7465 29.6381 180.5888 156 T 4.0833 7.4769 112.5944 64.5844 68.3123 175.8551 *158 C 4.4155 8.2470 120.8289 60.1114 30.1812 176.0590 159 Y 3.9873 7.4463 116.1985 60.7015 38.0704 178.1850 160 A 4.1341 8.3977 123.1162 55.5752 18.7287 180.0054 161 Y 4.1140 7.6007 112.9770 58.2297 37.2897 178.4895 *163 K 4.2292 8.1856 120.6597 56.4345 34.0642 177.1765 164 Q 4.1603 8.0331 118.0256 57.5040 29.2312 175.8460 165 E 4.4858 7.9414 113.6432 55.0918 30.9793 176.3007 166 G 3.8788 8.3231 106.1956 45.9977 0.0000 173.9575 167 V 3.6696 7.6591 119.0560 62.3189 32.2863 175.2797 168 E 4.2813 8.6880 126.7846 56.2960 30.1910 176.0587 169 V 4.9732 8.3588 117.1797 59.5392 36.0765 174.8666 170 R 4.7323 8.7165 121.1360 54.4474 34.7153 174.5057 171 V 4.5185 8.3677 121.5426 61.1218 34.8380 173.5981 172 A 5.0723 8.6626 130.4558 50.5606 21.2441 175.7950 173 R 4.4789 8.8531 122.9520 54.9714 31.3457 175.4356 174 I 4.8319 8.2393 126.1757 60.5812 38.5246 175.8805 175 F 4.9500 9.0297 125.8407 55.6450 41.3056 175.3323 176 N 4.3120 8.7409 116.7114 54.4408 39.1318 174.0664 177 T 5.6132 8.8778 119.6776 61.8567 72.4456 173.0943 178 F 4.9695 9.6694 119.2675 54.6856 42.2478 174.1691 179 G 4.2819 8.2454 104.1039 45.6541 0.0000 170.3084 180 P 3.4663 0.0000 0.0000 63.6388 31.6655 176.0309 181 R 3.7915 5.8400 118.9814 58.1370 27.1154 176.5333 *183 H 4.6560 7.8714 124.9770 56.0500 30.2876 174.4501 *185 N 4.5457 8.6640 116.1523 52.7627 40.0225 174.7832 186 D 4.2804 8.1330 120.5594 56.7542 41.1638 177.9196 187 G 3.9080 8.1792 104.7996 45.2314 0.0000 173.9676 188 R 4.1704 7.7820 119.1223 55.3661 32.1437 177.8086 189 V 3.0421 7.9030 120.0411 64.6440 31.4246 178.7764 190 V 3.1483 7.2870 118.6070 65.5138 31.4903 178.0114 191 S 3.7069 7.7649 113.5197 61.3158 62.7983 175.8215 192 N 4.1482 7.7886 120.2522 56.0772 38.3248 177.4188 193 F 4.3844 8.0452 118.9978 60.5969 38.9206 177.8385 194 I 3.6792 7.6949 119.4070 64.4876 36.8211 178.5795 195 L 3.8665 7.6403 119.7019 57.6025 41.3952 179.5964 196 Q 3.9021 8.2706 117.9927 58.8809 28.5704 178.6347 197 A 3.9967 7.9066 122.9950 54.7114 18.2182 179.6923 198 L 3.9506 7.9039 116.1613 57.3702 41.7524 178.7975 199 Q 4.4475 7.7106 115.0197 54.8781 29.1417 176.4259 200 G 3.8591 7.5454 108.1616 45.9645 0.0000 173.6808 201 E 4.4567 7.6977 118.3750 54.2835 30.9049 174.7608 202 P 4.4764 0.0000 0.0000 62.9318 32.2624 176.1931 203 L 4.7920 9.0940 125.0917 54.3477 42.6455 176.4001 204 T 4.5379 8.7699 115.5554 60.3367 68.9737 173.5981 205 V 3.9718 8.4547 129.3637 62.9919 33.0497 174.2296 206 Y 5.0286 8.7488 126.2332 58.7988 38.1227 175.9764 207 G 3.9964 8.9979 115.6340 44.9734 0.0000 172.8739 208 S 4.1459 8.7014 113.3549 59.3400 63.7712 175.5733 209 G 4.1546 8.2746 108.6141 45.6773 0.0000 175.0643 210 S 4.3543 7.9238 113.8244 59.7071 63.7479 174.8145 211 Q 4.5839 8.1088 120.3684 56.6864 29.7980 175.3500 212 T 5.3545 8.7021 110.7567 60.5138 72.3446 172.9793 213 R 4.9569 9.1305 120.0504 54.9097 35.4568 173.8224 214 A 5.3602 8.2459 121.4903 49.3650 21.2347 175.4286 215 F 5.2810 9.2444 121.2434 56.0352 41.3890 175.1440 216 Q 4.9240 9.2056 123.3407 54.3340 32.2523 174.2066 217 Y 3.8136 8.6476 126.6619 56.7565 39.9705 176.5565 218 V 3.3485 6.6297 126.4316 65.0200 31.1101 178.9730 219 S 4.1156 7.5569 114.1307 61.1931 62.8468 176.1344 220 D 4.5438 8.0811 122.4550 57.1022 40.5327 178.3483 221 L 3.9471 7.9600 120.3548 58.2054 42.2927 178.9419 222 V 3.4764 7.7784 118.0535 66.1799 31.4295 177.6958 223 N 4.5290 8.3435 116.2857 56.2627 38.3685 177.6704 224 G 2.6582 8.1149 107.1414 47.3594 0.0000 175.7333 225 L 3.9516 7.6899 120.6502 57.5672 41.7200 179.5718 226 V 3.9600 7.7806 117.8408 65.2799 31.5473 177.5465 227 A 4.2125 7.7622 119.7138 54.9255 18.6122 180.2642 228 L 4.0737 7.8199 117.5893 55.4495 41.9807 177.8588 *230 N 4.6325 8.0262 112.5365 52.0631 40.1843 174.6118 231 S 4.5604 7.6952 113.6159 57.8154 64.5143 173.5238 232 N 4.7412 8.4878 114.5996 53.0149 38.4129 175.1500 233 V 4.1378 7.6306 119.7777 61.6494 31.5088 175.6639 234 S 4.8030 8.7827 121.8044 58.3515 64.0775 174.8985 235 S 4.5553 7.7451 114.4161 56.3779 63.7122 171.9498 236 P 4.7550 0.0000 0.0000 63.0410 32.1679 176.0565 237 V 4.6010 8.5572 122.2606 60.9623 34.5385 174.4208 238 N 5.1957 9.8410 126.8510 53.5205 39.3532 174.6385 239 L 4.5424 8.7871 123.9421 53.6201 44.1901 175.7519 240 G 4.3330 8.7320 109.4231 45.7376 0.0000 170.7940 241 N 4.9333 8.7932 119.0565 51.2469 39.6732 173.0278 242 P 4.2561 0.0000 0.0000 63.8648 31.5550 175.8397 243 E 4.1228 8.5373 121.9615 56.3478 29.9044 174.6053 244 E 4.9180 8.5580 128.3281 55.3968 31.2568 174.6106 245 H 5.1128 9.1797 122.3876 54.0656 34.0249 173.1660 246 T 4.7130 8.8797 110.2369 61.4293 69.6703 176.0008 247 I 4.2165 8.8166 124.2620 64.5429 37.0374 178.6824 248 L 4.0518 8.3753 121.4808 58.2195 41.9338 178.8258 249 E 4.0971 8.3538 118.5343 59.4948 29.3191 179.4089 250 F 4.2969 8.3467 117.5396 60.4435 38.9992 177.5129 251 A 3.6771 8.4255 120.4806 55.2520 18.1161 179.6870 252 Q 3.8812 8.1240 116.4960 58.9228 28.6781 178.9186 253 L 3.9139 8.0741 121.3196 58.1603 42.1297 179.0487 254 I 3.6627 7.9132 119.8102 64.2686 37.0724 178.1210 255 K 3.7841 8.0034 120.3760 59.7192 31.9362 178.5038 256 N 4.3136 8.1211 116.4813 56.4431 38.2904 177.5442 257 L 4.1316 7.9456 119.3058 57.6161 41.7441 179.3660 258 V 3.8050 7.9300 117.8626 63.3649 31.9394 175.8118 259 G 3.6730 7.7688 104.1549 46.5606 0.0000 173.0189 260 S 4.6833 7.8741 112.4960 56.4601 64.3292 173.4729 261 G 4.0034 8.3568 113.4667 45.3471 0.0000 173.9322 262 S 4.1843 7.8847 116.8531 58.6222 63.9528 173.8513 263 E 4.0758 8.7497 124.3375 56.3015 31.0661 175.0981 264 I 4.5211 8.0707 125.7225 59.9246 38.5768 175.0456 265 Q 4.6070 8.6257 125.9155 53.9023 32.4445 174.7044 266 F 5.1567 8.7477 120.0000 56.2154 41.3302 174.8202 267 L 4.8873 8.9241 125.3622 52.6942 44.9807 176.0983 268 S 4.6080 8.6125 115.0811 59.0065 63.2560 175.0653 269 E 4.2178 8.7621 121.8474 56.2528 29.9774 176.7616 270 A 4.1542 8.4073 124.4683 51.4880 19.3633 177.0730 271 Q 4.0307 8.5559 123.8528 57.3489 29.5912 175.4259 272 D 4.4651 8.9608 123.2122 55.1005 38.5366 173.0779 273 D 4.4447 7.7503 119.1068 53.5159 41.4413 174.4270 274 P 4.5290 0.0000 0.0000 63.7084 32.0002 176.2094 275 Q 4.5729 9.4441 121.2397 57.2914 29.9920 175.4795 276 K 5.3665 7.7546 115.7812 56.6208 35.6672 175.4358 277 R 4.8026 8.0738 116.7649 55.6420 33.8646 174.3253 278 K 4.5055 9.6030 128.6077 54.8052 35.4685 172.9242 279 P 4.1496 0.0000 0.0000 62.4860 32.2105 175.3721 280 D 4.5901 8.4158 123.5964 53.2092 41.8078 176.3672 281 I 4.5150 8.0824 119.8750 60.7489 38.4097 177.0338 282 K 3.8568 8.2995 124.4070 60.2395 31.6579 178.4085 283 K 3.9362 8.0518 117.9614 59.5515 32.4067 178.1096 284 A 4.2438 8.1000 120.5241 55.0850 18.2527 179.5606 285 K 4.3097 8.1266 118.3202 59.0873 31.9262 178.8465 286 L 4.4574 7.6757 115.8581 55.4629 41.5533 177.8997 *288 L 4.2491 7.8850 119.9140 53.2890 43.4531 177.6371 289 G 3.9510 7.9737 105.5485 45.9376 0.0000 172.8958 290 W 4.8256 7.8580 129.5525 55.3460 32.2681 174.8783 291 E 3.4070 7.2612 120.7448 53.6101 31.8215 173.0380 292 P 4.2290 0.0000 0.0000 62.7863 31.8002 176.9742 293 V 4.1617 8.7664 113.6946 60.7939 33.2925 175.8737 294 V 4.0507 7.9310 120.7346 60.6872 31.7806 174.4862 295 P 4.4829 0.0000 0.0000 62.1107 33.1551 176.8974 296 L 4.2073 8.6377 122.2682 58.7763 42.0753 179.4617 297 E 4.0052 8.2137 117.8337 59.2513 29.5868 178.6951 298 E 3.9974 8.2663 119.0416 59.2123 29.7430 178.9201 299 G 3.3641 8.1648 105.5917 47.8783 0.0000 175.5798 300 L 4.2703 8.5247 122.2345 57.6077 41.5873 179.4473 301 N 4.4022 8.4490 116.4495 56.2245 38.5671 177.5779 302 K 4.0338 8.0542 119.2797 59.4455 32.1278 179.2842 303 A 4.2096 8.4087 121.1016 55.2687 18.3211 179.7192 304 I 3.8518 8.3152 118.7336 64.7448 37.2616 177.9835 305 H 4.1378 8.3371 119.0987 59.4768 29.1576 176.4095 306 Y 3.9170 7.8805 120.6413 61.0076 38.6167 178.4012 307 F 4.1913 8.1519 118.3861 60.1576 38.5244 177.7920 308 R 3.9082 8.2775 118.7992 59.3197 29.8368 178.6801 309 K 3.8737 7.7692 118.0632 59.4409 31.7535 179.1532 310 E 3.7743 7.6837 118.7555 59.4233 29.4118 179.5067 311 L 4.0116 8.0075 118.6906 57.4476 41.3294 179.5429 312 E 3.9693 7.5157 117.7256 59.4869 29.6104 178.4820 *313 Y 4.1309 7.8993 117.3300 60.5163 37.5432 178.4684 314 Q 4.3025 7.3332 120.8330 58.9572 29.1054 180.9077 315 A 4.3490 7.8833 127.1669 52.2561 18.3906 177.1884 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 R 8.25 4.46 0.00 1.85 1.79 0.00 3.17 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.23 0.00 5 K 8.34 4.77 0.00 1.65 1.64 0.00 1.62 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.56 7.81 6 R 9.97 4.89 0.00 1.73 1.84 0.00 3.05 0.00 0.00 3.16 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 7 I 8.79 4.97 1.88 0.00 0.00 0.79 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 0.83 1.08 0.00 0.00 8 L 8.76 4.89 0.00 1.72 1.48 0.93 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 9 I 8.70 5.00 1.85 0.00 0.00 0.72 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 0.54 0.87 0.00 0.00 10 T 8.69 4.33 4.26 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 1.21 0.00 0.00 11 G 9.05 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 0.00 0.00 0.00 12 G 8.13 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 13 A 8.22 4.53 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 14 G 7.69 4.44 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 0.00 15 F 8.82 4.34 0.00 3.08 3.06 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 16 V 7.31 2.88 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 0.79 0.00 0.00 0.51 0.00 0.00 17 G 7.99 3.63 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 0.00 0.00 0.00 18 S 7.98 4.24 0.00 4.29 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 19 H 7.67 4.20 0.00 3.05 3.26 0.00 5.62 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.86 3.81 0.00 1.57 1.63 0.44 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 21 T 7.72 3.72 4.45 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 1.16 0.00 0.00 22 D 7.75 4.86 0.00 2.97 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 23 K 7.56 4.19 0.00 1.73 1.91 0.00 1.80 0.00 0.00 1.67 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.49 7.81 24 L 7.43 4.24 0.00 1.62 1.55 0.58 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 *27 D 8.01 4.48 0.00 2.82 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.28 3.87 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 0.00 0.00 0.00 29 H 7.39 4.63 0.00 3.09 3.38 0.00 5.65 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.87 4.55 0.00 1.93 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 2.28 2.25 0.00 31 V 8.60 4.71 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 0.95 0.00 0.00 0.84 0.00 0.00 32 T 8.75 4.72 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 1.09 0.00 0.00 33 V 8.34 4.63 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 0.95 0.00 0.00 1.08 0.00 0.00 34 V 8.24 4.85 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 0.91 0.00 0.00 0.86 0.00 0.00 35 D 8.62 4.84 0.00 2.50 1.54 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 36 N 8.60 4.63 0.00 2.86 2.83 0.00 0.00 6.12 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 37 F 8.17 4.12 0.00 3.31 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 F 8.73 4.60 0.00 3.01 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 39 T 7.93 4.28 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 40 G 7.88 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.31 4.83 0.00 2.04 2.09 0.00 2.85 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 42 K 8.59 4.03 0.00 1.47 1.74 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.50 7.81 43 R 8.08 4.15 0.00 1.82 2.00 0.00 3.30 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 44 N 8.17 4.58 0.00 3.10 2.93 0.00 0.00 6.79 7.70 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 45 V 7.89 4.38 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.22 0.00 0.00 46 E 8.22 4.06 0.00 2.14 2.37 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 0.00 2.54 2.29 0.00 47 H 7.89 4.08 0.00 2.79 3.21 0.00 5.51 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 7.42 4.55 0.00 1.99 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 0.00 0.00 0.00 0.00 49 I 7.25 4.31 2.06 0.00 0.00 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 1.55 0.63 1.02 0.00 0.00 50 G 9.25 4.14 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 0.00 0.00 0.00 51 H 8.50 4.42 0.00 3.52 3.45 0.00 5.60 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.79 4.06 0.00 2.40 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 0.00 2.28 1.91 0.00 53 N 8.55 4.83 0.00 2.80 3.01 0.00 0.00 6.56 8.13 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 54 F 8.16 5.38 0.00 2.90 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 55 E 8.05 4.41 0.00 1.90 1.48 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 2.05 2.15 0.00 56 L 8.32 4.87 0.00 1.78 1.63 1.11 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 57 I 8.70 4.47 1.83 0.00 0.00 0.79 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 0.88 0.91 0.00 0.00 58 N 9.04 4.77 0.00 2.99 2.90 0.00 0.00 6.94 7.89 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 59 H 8.73 4.75 0.00 3.14 3.08 0.00 5.99 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 D 8.33 4.63 0.00 2.64 2.40 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 0.00 0.00 0.00 0.00 61 V 8.32 3.73 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 0.72 0.00 0.00 0.93 0.00 0.00 62 V 7.93 3.69 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 0.70 0.00 0.00 0.97 0.00 0.00 63 E 7.86 4.55 0.00 1.93 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 2.20 2.34 0.00 64 P 0.00 4.26 0.00 2.24 2.07 0.00 3.66 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 65 L 8.01 4.58 0.00 1.34 1.32 0.66 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 8.65 4.43 0.00 2.92 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 67 I 7.76 4.65 1.84 0.00 0.00 0.79 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 0.88 0.00 0.00 68 E 8.58 4.54 0.00 1.94 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 69 V 7.87 4.56 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 0.69 0.00 0.00 0.87 0.00 0.00 70 D 9.03 4.70 0.00 2.63 2.66 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 71 Q 7.79 4.89 0.00 1.88 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.85 0.00 0.00 0.00 0.00 0.00 2.22 2.31 0.00 72 I 8.58 4.86 1.74 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.65 0.83 0.00 0.00 73 Y 9.13 4.58 0.00 2.77 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 74 H 9.23 5.10 0.00 3.12 3.28 0.00 5.78 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.41 4.65 0.00 1.81 1.64 0.96 0.49 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 76 A 7.97 4.02 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 77 S 8.02 4.66 0.00 3.79 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 78 P 0.00 4.57 0.00 2.50 2.42 0.00 3.91 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 79 A 8.52 4.63 1.38 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 0.00 0.00 80 S 7.83 4.38 0.00 3.96 3.63 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 81 P 0.00 2.97 0.00 1.81 1.73 0.00 3.55 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.98 0.00 82 P 0.00 4.29 0.00 1.94 2.07 0.00 3.40 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.14 0.00 83 N 7.24 4.60 0.00 2.74 2.75 0.00 0.00 7.05 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 84 Y 7.89 4.62 0.00 2.95 3.04 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 *86 Y 8.04 4.70 0.00 3.12 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 87 N 7.95 4.77 0.00 2.77 2.75 0.00 0.00 6.86 7.71 0.00 0.00 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 P 0.00 4.38 0.00 2.33 2.35 0.00 3.73 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.07 0.00 89 I 7.79 3.69 1.97 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 1.63 0.58 0.89 0.00 0.00 90 K 7.99 3.86 0.00 1.82 1.62 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.32 1.41 7.81 91 T 7.79 3.91 4.47 0.00 0.00 0.00 0.00 0.00 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 92 L 7.96 3.96 0.00 1.83 1.69 0.95 0.48 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 93 K 8.15 3.95 0.00 1.76 1.82 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.58 7.81 94 T 7.87 3.83 4.38 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 1.23 0.00 0.00 95 N 7.88 4.36 0.00 2.63 2.93 0.00 0.00 7.06 7.58 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 96 T 7.78 4.21 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 1.16 0.00 0.00 97 I 7.93 3.77 1.93 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 1.43 1.14 0.93 0.00 0.00 98 G 7.85 3.86 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 0.00 0.00 0.00 99 T 7.72 3.87 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 100 L 7.86 4.00 0.00 1.81 1.68 0.92 0.59 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 0.00 101 N 7.87 4.37 0.00 2.79 2.70 0.00 0.00 7.02 6.02 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 *103 L 8.01 3.92 0.00 0.78 0.36 0.54 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 104 G 7.85 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 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4.97 0.00 1.59 1.31 0.71 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.64 4.99 0.00 1.38 1.17 0.86 0.32 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 0.00 115 L 8.65 4.66 0.00 1.68 1.40 0.85 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 116 A 8.32 4.77 1.29 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 0.00 0.00 117 S 8.55 4.44 0.00 3.85 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 0.00 118 T 7.96 5.08 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 119 S 8.59 3.80 0.00 3.23 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 0.00 120 E 8.35 4.10 0.00 2.01 2.20 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 2.47 2.85 0.00 121 V 7.21 3.54 1.81 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 138 V 7.89 4.53 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 0.90 0.00 0.00 0.96 0.00 0.00 139 N 8.74 4.51 0.00 2.72 2.74 0.00 0.00 7.18 7.69 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 0.00 140 P 0.00 4.45 0.00 2.21 2.15 0.00 3.76 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 141 I 7.86 4.46 1.88 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 1.24 0.75 0.91 0.00 0.00 142 G 7.80 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 0.00 0.00 0.00 143 P 0.00 4.35 0.00 2.24 2.23 0.00 3.97 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 2.03 2.20 0.00 144 R 8.02 4.53 0.00 2.02 2.23 0.00 3.37 0.00 0.00 3.44 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.73 0.00 145 A 8.07 4.08 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 0.00 146 C 8.29 3.91 0.00 3.32 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 Y 7.68 3.79 0.00 2.03 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 0.00 0.00 0.00 148 D 7.96 4.15 0.00 2.72 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 0.00 149 E 8.40 4.03 0.00 2.11 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 2.29 2.43 0.00 150 G 7.44 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 0.00 151 K 7.81 3.82 0.00 1.37 1.55 0.00 1.42 0.00 0.00 1.46 0.00 0.00 2.77 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.79 0.61 7.81 152 R 7.72 3.81 0.00 1.76 1.87 0.00 3.03 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 153 V 7.81 3.72 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 0.86 0.00 0.00 0.89 0.00 0.00 154 A 7.58 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 155 E 7.94 4.03 0.00 2.22 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 0.00 2.28 2.44 0.00 156 T 7.48 4.08 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 1.20 0.00 0.00 *158 C 8.25 4.42 0.00 2.67 2.52 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 0.00 159 Y 7.45 3.99 0.00 3.08 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 0.00 160 A 8.40 4.13 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 0.00 161 Y 7.60 4.11 0.00 3.05 2.93 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 *163 K 8.19 4.23 0.00 2.04 1.91 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.01 7.81 164 Q 8.03 4.16 0.00 1.91 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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4.92 0.00 2.39 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 217 Y 8.65 3.81 0.00 2.92 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 0.00 218 V 6.63 3.35 1.78 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 -0.08 0.00 0.00 0.27 0.00 0.00 219 S 7.56 4.12 0.00 4.15 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 D 8.08 4.54 0.00 3.02 3.06 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 0.00 221 L 7.96 3.95 0.00 1.93 1.76 0.88 0.82 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 0.00 222 V 7.78 3.48 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 0.91 0.00 0.00 0.81 0.00 0.00 223 N 8.34 4.53 0.00 3.24 3.10 0.00 0.00 6.95 7.62 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 0.00 224 G 8.11 2.66 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 242 P 0.00 4.26 0.00 2.18 2.23 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.91 0.00 243 E 8.54 4.12 0.00 2.16 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 2.32 2.28 0.00 244 E 8.56 4.92 0.00 2.05 1.83 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 2.30 2.57 0.00 245 H 9.18 5.11 0.00 1.72 2.67 0.00 5.67 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 T 8.88 4.71 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 1.25 0.00 0.00 247 I 8.82 4.22 2.08 0.00 0.00 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 1.81 0.97 1.16 0.00 0.00 248 L 8.38 4.05 0.00 1.94 1.77 1.06 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 249 E 8.35 4.10 0.00 2.06 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 2.27 2.33 0.00 250 F 8.35 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0.00 2.28 2.21 0.00 275 Q 9.44 4.57 0.00 2.02 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.61 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 276 K 7.75 5.37 0.00 1.74 1.75 0.00 1.01 0.00 0.00 2.24 0.00 0.00 3.06 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.35 1.33 7.81 277 R 8.07 4.80 0.00 1.98 1.91 0.00 3.47 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.81 0.00 278 K 9.60 4.51 0.00 1.83 1.40 0.00 1.81 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.23 1.49 7.81 279 P 0.00 4.15 0.00 1.51 0.49 0.00 3.66 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 1.70 1.47 0.00 280 D 8.42 4.59 0.00 2.66 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 281 I 8.08 4.51 2.09 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 1.52 0.62 1.09 0.00 0.00 282 K 8.30 3.86 0.00 1.95 1.88 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.48 7.81 283 K 8.05 3.94 0.00 1.84 2.02 0.00 1.89 0.00 0.00 1.87 0.00 0.00 3.09 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.55 7.81 284 A 8.10 4.24 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 0.00 285 K 8.13 4.31 0.00 2.05 1.90 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.57 7.81 286 L 7.68 4.46 0.00 1.66 1.71 0.94 0.88 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 *288 L 7.88 4.25 0.00 1.96 1.87 0.86 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 289 G 7.97 3.95 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 0.00 290 W 7.86 4.83 0.00 3.32 3.05 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 0.00 291 E 7.26 3.41 0.00 1.67 1.57 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 0.00 1.94 2.05 0.00 292 P 0.00 4.23 0.00 1.96 2.07 0.00 3.19 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.03 0.00 293 V 8.77 4.16 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 0.56 0.00 0.00 0.97 0.00 0.00 294 V 7.93 4.05 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 0.56 0.00 0.00 0.99 0.00 0.00 295 P 0.00 4.48 0.00 2.22 1.98 0.00 3.79 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 296 L 8.64 4.21 0.00 1.96 1.82 1.18 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 297 E 8.21 4.01 0.00 2.08 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 2.43 2.41 0.00 298 E 8.27 4.00 0.00 2.01 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 2.23 2.31 0.00 299 G 8.16 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 0.00 0.00 0.00 300 L 8.52 4.27 0.00 1.88 1.76 0.90 0.28 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 0.00 301 N 8.45 4.40 0.00 2.90 2.89 0.00 0.00 7.01 6.58 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 0.00 302 K 8.05 4.03 0.00 1.99 1.99 0.00 0.91 0.00 0.00 1.51 0.00 0.00 2.78 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.43 1.48 7.81 303 A 8.41 4.21 1.73 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 0.00 0.00 304 I 8.32 3.85 1.97 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 1.49 0.78 0.98 0.00 0.00 305 H 8.34 4.14 0.00 3.31 3.59 0.00 5.80 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 306 Y 7.88 3.92 0.00 3.01 2.95 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 0.00 307 F 8.15 4.19 0.00 3.28 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 0.00 308 R 8.28 3.91 0.00 2.06 1.90 0.00 3.11 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 309 K 7.77 3.87 0.00 1.79 1.67 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.65 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.33 1.38 7.81 310 E 7.68 3.77 0.00 2.03 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 1.47 1.79 0.00 311 L 8.01 4.01 0.00 1.68 1.70 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 312 E 7.52 3.97 0.00 2.13 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 2.32 2.47 0.00 *313 Y 7.90 4.13 0.00 2.64 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 0.00 0.00 0.00 314 Q 7.33 4.30 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.25 2.23 0.00 315 A 7.88 4.35 1.29 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 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.