NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 32 D 4.5643 8.2185 120.5264 54.6415 43.0566 178.3262 33 A 4.0748 7.6662 119.3436 52.2146 17.8297 177.5253 *35 L 4.1392 8.2646 121.2111 56.3172 44.8555 177.4740 36 L 3.9524 8.3271 119.9069 58.3638 42.0235 178.9904 37 A 4.0247 8.1508 120.7402 55.0442 18.2688 179.5113 38 S 4.2230 7.7830 112.3883 60.8257 62.8966 176.3149 39 L 4.6643 7.7468 121.9877 56.0263 41.9764 177.5336 40 V 3.7789 7.4385 118.6718 61.7549 30.1225 174.9797 41 A 4.5803 7.9177 130.7432 49.5587 17.9255 174.6041 42 D 4.6005 7.7447 118.3010 52.7403 44.3975 174.4678 43 D 4.8074 8.8202 125.1027 54.1366 41.2456 176.2087 44 R 4.5094 7.7261 118.3404 53.9523 32.1488 175.8704 45 A 4.4299 8.5655 121.8949 52.0130 18.8109 176.7192 46 C 4.7521 8.6307 116.1997 56.9729 34.1039 172.7504 47 R 5.2567 8.9879 118.1721 54.6796 32.4278 175.2054 48 I 5.2400 9.2825 124.4061 59.4510 40.8954 174.1664 49 A 4.7864 8.5940 128.1705 50.0051 21.5777 174.8614 50 D 5.1737 8.9604 122.6934 52.6332 42.6795 176.5137 51 L 3.9977 8.7495 126.2613 55.2161 42.2072 176.6988 52 G 3.7192 8.4568 104.5887 44.0995 0.0000 173.1137 53 A 4.5136 8.5325 121.8946 51.3829 19.8113 177.4126 54 G 3.6971 7.9379 104.1682 44.8089 0.0000 174.6999 55 A 4.9383 8.6255 125.0220 52.2237 19.5371 178.1150 56 G 3.9406 7.7517 106.5800 47.0428 0.0000 175.4181 57 A 4.0785 8.0452 123.6143 55.0155 18.8722 179.8345 58 A 4.2065 8.2036 118.4763 55.5310 18.7695 181.5151 59 G 3.8353 8.3961 103.8738 45.8718 0.0000 175.3043 *61 A 3.9790 8.1379 124.6425 51.7518 20.7149 180.1927 62 V 3.4403 7.9618 114.8272 66.1829 31.3601 178.1213 63 A 3.9123 7.7544 118.8411 55.1033 18.2396 179.0846 64 A 3.7187 7.1458 117.8614 54.9384 18.4477 179.2210 65 R 4.2684 7.4721 115.8417 57.4551 30.9043 176.6707 66 L 4.5318 7.9324 121.4103 52.5244 42.4139 176.8987 67 E 4.0677 8.7129 122.8141 58.4356 29.5238 178.0043 68 K 4.5233 7.9274 117.3489 56.1005 33.4774 175.9656 69 A 4.4073 7.9593 123.4486 51.7418 19.3900 176.8258 70 E 4.5694 9.3977 123.7459 54.5367 31.7882 174.6728 71 V 4.9398 8.8340 127.5003 61.4025 34.6031 174.1801 72 T 4.8609 9.0259 124.4515 61.7674 71.2696 172.9760 73 L 4.8112 8.8280 127.6386 53.6205 43.2941 175.1637 74 Y 5.0307 8.6007 122.8174 56.6169 39.4267 175.2752 75 E 4.6841 9.0079 122.8048 54.6036 33.0894 177.2224 76 R 4.0469 9.1814 123.6504 58.2566 30.5803 176.7775 77 S 4.7889 7.6059 110.2990 56.2995 65.2910 173.6963 78 Q 4.1552 8.6454 123.1832 59.4960 29.1711 178.1765 79 E 3.8730 8.2559 114.0885 57.6877 29.7295 177.5829 *81 A 4.3310 8.0468 121.3907 52.3607 20.5782 179.4519 82 E 3.9773 8.7119 115.7862 59.3581 29.4395 179.2930 83 F 3.9970 8.4465 120.5088 61.2751 39.4725 177.0158 84 A 4.0496 8.1924 119.8094 55.2233 18.0288 179.5269 85 R 3.8263 8.0225 115.6670 59.6699 30.6213 179.2802 86 R 4.2527 8.1181 119.2875 58.4699 29.8202 179.0041 87 S 3.8954 7.7720 113.0316 61.3529 62.2418 175.8265 88 L 4.2337 7.5378 118.3891 55.6271 41.5812 177.7684 89 E 4.3401 7.6651 117.3121 55.2404 30.3028 175.6828 90 L 4.1710 7.1383 122.1632 54.0111 42.5442 176.0928 91 P 4.2425 0.0000 0.0000 65.7110 31.5145 177.7568 92 D 4.3238 8.1443 116.3135 56.8668 41.2151 176.6424 93 N 4.4326 8.3061 114.3323 52.5298 37.9897 176.4170 94 A 3.8191 7.8278 124.0433 54.8098 18.6793 180.3806 95 A 4.1998 7.9226 118.3700 54.4682 18.7168 177.9385 96 F 4.9719 6.9305 105.2349 56.1841 39.6204 177.2468 97 S 3.9496 7.4451 116.3628 61.2296 62.7645 176.4610 98 A 4.0179 7.9102 122.5902 54.5364 18.3382 177.9016 99 R 4.4624 8.2723 113.9626 56.2252 30.4375 175.4712 100 I 5.0710 7.6307 119.3124 59.3853 39.9274 174.6678 101 E 4.6769 9.0989 126.7785 54.3089 33.0273 174.3000 102 V 4.6918 8.3520 125.7489 61.2823 33.2427 174.6067 103 L 4.8023 8.6409 127.9235 52.8718 44.9478 175.4147 104 E 4.9319 8.8276 122.7290 55.8255 30.1140 175.7776 105 A 4.5428 8.9559 125.3253 50.8876 23.6626 174.9136 106 D 4.5829 8.6325 121.8145 53.5112 41.0120 177.1439 107 V 3.5740 8.0367 119.7823 62.5178 31.5610 177.0108 108 T 4.3227 7.9381 109.7542 61.5453 69.3749 175.2502 109 L 4.1705 7.5367 122.5585 55.1229 42.4555 176.3521 110 R 4.6677 8.1988 118.1643 54.9470 34.3056 178.6539 111 A 3.5444 8.1582 123.1465 52.8181 18.2870 179.9156 112 K 3.9564 8.8297 116.5444 61.9215 31.7054 178.2709 113 A 4.1985 7.8710 121.8781 54.4808 18.3405 179.4569 114 R 3.7280 7.9141 117.1347 59.5825 30.2208 178.8987 115 V 3.7911 7.6413 119.2507 65.6731 31.2356 177.8276 116 E 3.9843 8.5260 118.2406 59.1119 29.0652 178.4821 117 A 4.4132 7.7435 118.6017 52.6146 18.7095 177.9656 118 G 4.0052 8.1699 105.7975 45.3955 0.0000 174.5259 119 L 4.6439 7.7684 122.1777 51.8316 41.3570 174.2668 120 P 4.5748 0.0000 0.0000 61.7385 32.5264 176.4892 121 D 4.7202 8.4661 119.9334 55.9059 41.7892 176.3990 122 E 3.8188 8.5833 121.9368 58.3655 27.5538 174.2818 123 H 4.4948 7.8485 116.3108 56.7635 32.6972 173.3186 124 F 4.7816 8.2928 117.0984 56.5335 40.3806 175.6172 125 H 4.6401 9.0286 121.2805 58.1373 30.0635 175.0687 126 H 5.5051 8.3310 114.2781 53.9649 33.3882 172.5670 127 V 4.8507 8.8533 121.9113 61.0915 34.5133 174.5349 128 I 5.5141 8.6172 120.7571 58.2683 41.3548 174.3245 *130 N 5.2144 8.3633 119.9439 52.9897 38.7769 171.7035 131 P 4.0477 0.0000 0.0000 60.6376 32.4040 175.4959 132 P 3.9586 0.0000 0.0000 62.5936 31.8759 176.0600 133 Y 4.3410 7.7705 117.9774 57.2944 37.1516 175.3716 *155 G 4.2306 8.0947 112.6490 45.6447 0.0000 171.8125 156 L 4.2632 7.5924 116.7247 54.9927 41.8056 179.0232 157 F 4.0635 7.9239 118.6104 60.3274 38.9245 176.5424 158 E 4.0275 8.3743 118.4214 59.6449 29.4357 178.5194 159 D 4.4697 8.1519 118.0647 57.4115 40.9881 178.8099 160 W 4.2368 8.7659 119.7211 59.7766 28.9941 178.8419 161 I 4.0540 8.5754 120.3568 63.9875 36.5715 178.3229 162 R 3.9675 8.2832 119.8294 59.8584 29.9541 178.6773 163 T 3.8289 8.0509 115.1468 66.5877 68.2221 176.3472 164 A 4.0803 8.2699 121.8348 55.3002 18.4786 179.2785 165 S 4.0748 8.5199 110.4795 61.5805 62.7282 175.9634 166 A 4.1374 8.0791 123.6463 54.2903 19.2364 178.0244 167 I 5.1233 7.7296 112.3207 59.2548 37.0821 175.4333 *169 V 4.0388 7.1241 114.3788 61.2515 33.1901 175.6770 170 S 4.1141 8.5539 116.2109 60.2451 62.3291 174.8293 171 G 3.9271 9.0259 114.6706 45.4939 0.0000 173.4132 172 G 3.9181 8.1255 107.7088 46.1158 0.0000 172.3982 173 Q 5.1858 8.6246 121.5138 54.0762 31.2949 174.1432 174 L 4.7204 8.6645 129.2728 54.6078 43.6511 175.4653 175 S 5.3474 9.0728 121.9625 56.7721 66.7616 173.0047 176 L 4.9511 8.9274 122.8908 54.6178 44.0877 174.1622 177 I 4.9792 8.3103 119.7697 59.6912 40.7550 174.2437 178 S 4.8863 8.2100 120.7921 57.6051 66.6846 173.2515 179 R 4.1203 8.4833 117.9300 55.2085 30.8413 176.2417 180 P 4.2686 0.0000 0.0000 65.8361 31.4664 178.4494 181 Q 4.1883 7.8725 114.7402 57.6146 28.8177 177.2383 182 S 4.4825 7.9551 114.5599 58.6268 62.9423 176.1030 183 V 3.4701 7.5546 123.4698 64.7973 30.9881 178.2393 184 A 3.9234 7.8600 120.9646 54.7087 18.2994 178.9734 185 E 3.8516 8.0328 117.3313 59.4375 29.7524 178.9981 186 I 3.3411 7.5303 119.7129 64.3211 36.9073 178.4603 187 I 3.6358 7.5657 119.0576 64.3307 37.2321 178.0077 188 A 4.1298 8.2018 121.4217 55.2223 18.0021 179.5875 189 A 4.2582 8.0456 118.2204 55.4321 18.6588 179.2680 190 C 4.6074 8.3913 114.9687 60.7285 27.2633 174.1751 191 G 3.9422 7.4065 109.9204 47.4648 0.0000 173.6828 192 S 4.0160 8.9446 118.6877 59.5173 60.8115 172.6882 193 R 4.3565 7.7340 118.0667 57.1122 33.5089 175.1220 194 F 5.2569 8.5753 115.2081 55.6114 42.2993 174.9778 195 G 4.4457 8.0190 111.6618 44.4077 0.0000 171.9907 196 G 4.2086 8.5867 105.0405 46.1017 0.0000 174.0409 197 L 4.2975 7.8400 117.9634 54.7688 43.2314 176.6373 198 E 4.9332 9.3045 122.9282 54.6571 32.5937 174.8404 199 I 4.6550 8.5107 126.2598 59.7319 39.5995 174.8583 200 T 4.9338 8.9416 124.5465 61.5508 70.3899 174.2074 201 L 4.4203 8.7057 126.9831 54.6874 43.5226 176.2225 202 I 4.8960 8.7898 123.3980 60.0258 39.6899 174.2462 203 H 5.1544 9.1432 124.7471 53.3388 31.0180 173.9036 204 P 4.5232 0.0000 0.0000 65.6425 32.0638 176.4644 205 R 4.7859 7.6502 112.2283 55.2105 31.6011 171.9439 206 P 4.3499 0.0000 0.0000 64.4902 31.5739 177.0287 207 G 4.0001 9.0344 111.0721 45.2126 0.0000 173.3035 208 E 4.5137 7.3844 117.8157 54.8104 30.8872 175.9782 209 D 4.5464 8.3863 120.5803 53.9647 41.5817 176.4729 210 A 3.9929 8.3008 124.4030 52.5211 18.8830 178.0425 211 V 4.3505 8.5160 114.3923 61.7317 34.2671 176.0556 212 R 4.7440 7.1192 118.0656 54.4167 34.5220 173.6262 *214 L 4.5830 8.4762 119.3820 55.7649 43.7654 176.2988 215 V 4.9930 8.7779 121.9128 61.4379 35.0072 174.2176 216 T 5.2152 8.6975 116.8489 60.2922 72.3287 172.4609 217 A 4.8704 8.5960 122.9060 51.2885 23.7745 175.0185 218 I 4.9810 8.7846 119.9645 59.0356 40.1779 175.5878 219 K 3.9242 9.2531 129.5982 58.0430 32.5482 177.8528 220 G 3.9206 8.7543 116.2101 45.2728 0.0000 173.6950 221 S 4.2288 7.7239 114.6948 58.5444 62.9259 174.4730 222 R 4.3663 8.3750 123.8910 56.4597 30.9052 176.7493 223 A 4.2945 7.8094 121.6861 51.7070 19.4184 177.6615 224 R 4.5619 8.5097 118.1327 55.5836 30.6740 176.2117 225 L 4.5901 8.3585 120.1427 56.1048 41.5350 176.3221 226 T 4.7757 8.7202 109.8215 60.1289 72.6030 172.7260 227 F 4.9489 8.9045 122.6222 56.1163 39.8257 176.1014 228 R 4.3590 8.7157 123.2730 55.4090 30.9509 176.8385 229 A 4.0863 8.6900 123.7108 52.1540 18.8002 176.0240 230 P 4.7406 0.0000 0.0000 62.8341 32.8288 175.4184 231 L 4.5754 8.7670 121.1258 53.8891 43.3624 176.4335 232 I 5.0483 7.9776 124.8423 59.1130 40.2987 174.4548 *234 H 4.5272 8.4651 117.8008 56.0744 29.9422 173.1730 235 E 4.1905 8.3444 121.1083 55.9658 30.1590 176.6944 236 T 3.9609 8.3607 117.7557 65.5407 68.7684 174.7651 237 G 3.8636 8.9520 113.1204 45.6761 0.0000 172.6735 238 S 4.6495 7.6731 113.4776 56.3835 64.5159 173.9780 239 H 4.3110 8.6762 124.1483 58.2687 28.9645 176.0198 240 A 4.1347 7.1615 120.7290 51.5250 18.8217 177.1189 241 F 4.3086 8.2279 118.5339 56.9254 40.0119 176.6678 242 T 4.0778 8.4361 113.8981 61.2216 70.4887 173.2258 243 P 4.2486 0.0000 0.0000 66.0999 31.4624 178.6856 244 F 4.3860 8.2137 118.4028 61.4480 39.4198 177.0600 245 V 3.2319 7.2450 117.2754 65.8389 31.3379 177.3355 246 D 4.2199 8.6231 118.0354 57.5097 40.9935 177.9721 247 D 4.3388 8.0949 119.2090 57.3310 40.7273 178.8382 248 L 3.7686 7.5622 119.2969 57.8478 41.4022 179.2085 249 N 4.2152 8.1009 115.7556 55.7942 38.7823 175.5772 250 N 4.8200 7.6631 115.4823 52.1498 38.9237 175.3168 251 G 3.8643 7.4931 107.2923 46.5428 0.0000 175.2281 252 R 4.2419 8.1706 117.5990 56.5104 30.5934 176.1512 253 A 4.5769 7.4723 118.6340 50.9700 21.9832 174.9035 254 A 4.8821 8.3840 121.0504 50.4976 22.0505 175.9948 255 Y 5.0195 8.8783 121.0125 56.1163 39.9203 175.2215 256 A 4.4634 8.4208 128.3596 50.5709 20.5500 176.8339 257 R 4.4276 8.0952 117.7526 55.1288 31.0142 177.0019 258 N 4.4090 9.5577 117.5637 55.8956 38.7117 175.8783 259 V 3.9778 7.4384 120.8127 62.9376 31.9754 174.6892 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 32 D 8.22 4.56 0.00 2.80 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 33 A 7.67 4.07 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *35 L 8.26 4.14 0.00 1.82 1.71 0.83 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.33 3.95 0.00 1.79 1.87 0.95 1.17 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 37 A 8.15 4.02 1.36 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 38 S 7.78 4.22 0.00 3.98 4.07 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 39 L 7.75 4.66 0.00 1.78 1.79 0.97 1.12 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 40 V 7.44 3.78 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 0.47 0.00 0.00 0.86 0.00 0.00 41 A 7.92 4.58 1.24 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 0.00 0.00 0.00 42 D 7.74 4.60 0.00 2.64 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 D 8.82 4.81 0.00 2.69 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 44 R 7.73 4.51 0.00 1.90 1.81 0.00 3.15 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 45 A 8.57 4.43 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 46 C 8.63 4.75 0.00 3.03 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 47 R 8.99 5.26 0.00 1.80 1.99 0.00 2.80 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 48 I 9.28 5.24 1.92 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.82 0.91 0.00 0.00 49 A 8.59 4.79 0.23 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 50 D 8.96 5.17 0.00 2.64 2.51 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 51 L 8.75 4.00 0.00 1.36 0.93 0.70 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.46 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.53 4.51 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 54 G 7.94 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.63 4.94 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 0.00 0.00 0.00 0.00 0.00 56 G 7.75 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 0.00 0.00 0.00 57 A 8.05 4.08 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 58 A 8.20 4.21 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 59 G 8.40 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *61 A 8.14 3.98 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 62 V 7.96 3.44 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 0.89 0.00 0.00 63 A 7.75 3.91 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 64 A 7.15 3.72 0.81 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 0.00 0.00 65 R 7.47 4.27 0.00 1.72 2.00 0.00 3.21 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 1.59 1.63 0.00 66 L 7.93 4.53 0.00 1.74 1.58 0.94 0.81 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 67 E 8.71 4.07 0.00 2.09 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 0.00 2.28 2.35 0.00 68 K 7.93 4.52 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 A 8.08 4.14 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 0.00 167 I 7.73 5.12 2.29 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 1.71 2.22 1.06 0.00 0.00 *169 V 7.12 4.04 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 0.60 0.00 0.00 1.00 0.00 0.00 170 S 8.55 4.11 0.00 3.81 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 G 9.03 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 0.00 172 G 8.13 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 0.00 0.00 0.00 173 Q 8.62 5.19 0.00 2.15 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.91 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 174 L 8.66 4.72 0.00 0.58 0.80 0.76 0.40 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 0.00 175 S 9.07 5.35 0.00 3.76 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 L 8.93 4.95 0.00 1.86 1.79 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 177 I 8.31 4.98 1.91 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 1.46 0.99 1.00 0.00 0.00 178 S 8.21 4.89 0.00 4.10 4.17 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 0.00 179 R 8.48 4.12 0.00 1.60 1.76 0.00 2.62 0.00 0.00 2.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.64 0.00 180 P 0.00 4.27 0.00 2.14 2.10 0.00 3.52 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 181 Q 7.87 4.19 0.00 1.94 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.05 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 182 S 7.96 4.48 0.00 3.85 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 V 7.55 3.47 2.16 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 0.80 0.00 0.00 0.94 0.00 0.00 184 A 7.86 3.92 1.32 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 0.00 0.00 185 E 8.03 3.85 0.00 2.04 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 2.50 2.48 0.00 186 I 7.53 3.34 1.68 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 -0.36 0.69 0.00 0.00 187 I 7.57 3.64 1.84 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 1.39 0.50 0.91 0.00 0.00 188 A 8.20 4.13 1.37 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 0.00 0.00 0.00 0.00 0.00 189 A 8.05 4.26 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 0.00 0.00 0.00 0.00 0.00 190 C 8.39 4.61 0.00 3.19 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 0.00 191 G 7.41 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 0.00 0.00 0.00 192 S 8.94 4.02 0.00 4.03 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 0.00 193 R 7.73 4.36 0.00 2.18 1.58 0.00 3.36 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.70 0.00 194 F 8.58 5.26 0.00 3.00 2.90 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 0.00 195 G 8.02 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 0.00 0.00 0.00 0.00 196 G 8.59 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 0.00 0.00 0.00 0.00 197 L 7.84 4.30 0.00 1.59 1.49 0.94 0.77 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 0.00 198 E 9.30 4.93 0.00 1.79 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 199 I 8.51 4.66 0.88 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.56 0.70 0.00 0.00 200 T 8.94 4.93 4.40 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 1.29 0.00 0.00 201 L 8.71 4.42 0.00 1.76 1.59 1.06 0.81 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 0.00 202 I 8.79 4.90 1.97 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 1.19 0.79 0.91 0.00 0.00 203 H 9.14 5.15 0.00 3.03 3.19 0.00 5.62 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 P 0.00 4.52 0.00 2.12 2.18 0.00 3.77 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 2.17 2.13 0.00 205 R 7.65 4.79 0.00 1.95 2.03 0.00 3.30 0.00 0.00 3.30 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 206 P 0.00 4.35 0.00 2.06 2.05 0.00 3.69 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 207 G 9.03 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 E 7.38 4.51 0.00 2.18 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 2.31 2.28 0.00 209 D 8.39 4.55 0.00 2.67 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 0.00 210 A 8.30 3.99 1.07 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 0.00 0.00 211 V 8.52 4.35 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 0.79 0.00 0.00 1.00 0.00 0.00 212 R 7.12 4.74 0.00 1.67 1.78 0.00 3.72 0.00 0.00 3.45 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.47 0.00 *214 L 8.48 4.58 0.00 1.73 1.72 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 215 V 8.78 4.99 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 0.95 0.00 0.00 0.82 0.00 0.00 216 T 8.70 5.22 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 1.19 0.00 0.00 217 A 8.60 4.87 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 0.00 218 I 8.78 4.98 1.93 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 1.15 1.22 0.99 0.00 0.00 219 K 9.25 3.92 0.00 1.75 1.68 0.00 1.54 0.00 0.00 1.71 0.00 0.00 2.75 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.24 1.01 7.81 220 G 8.75 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 0.00 0.00 0.00 221 S 7.72 4.23 0.00 3.89 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 0.00 222 R 8.38 4.37 0.00 1.84 1.95 0.00 3.27 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 223 A 7.81 4.29 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 0.00 224 R 8.51 4.56 0.00 1.85 1.98 0.00 3.07 0.00 0.00 3.30 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 225 L 8.36 4.59 0.00 1.54 1.67 0.93 0.51 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 T 8.72 4.78 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 1.23 0.00 0.00 227 F 8.90 4.95 0.00 2.93 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 0.00 228 R 8.72 4.36 0.00 1.88 2.05 0.00 3.39 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.85 0.00 229 A 8.69 4.09 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 0.00 230 P 0.00 4.74 0.00 2.17 2.16 0.00 3.79 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 1.99 1.98 0.00 231 L 8.77 4.58 0.00 1.57 1.57 0.56 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 232 I 7.98 5.05 1.91 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.86 1.00 0.00 0.00 *234 H 8.47 4.53 0.00 3.28 3.37 0.00 5.62 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 E 8.34 4.19 0.00 2.00 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 2.42 2.29 0.00 236 T 8.36 3.96 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 1.20 0.00 0.00 237 G 8.95 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 0.00 238 S 7.67 4.65 0.00 3.80 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 0.00 239 H 8.68 4.31 0.00 3.13 3.20 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 0.00 240 A 7.16 4.13 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 F 8.23 4.31 0.00 3.08 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 0.00 242 T 8.44 4.08 4.31 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 1.28 0.00 0.00 243 P 0.00 4.25 0.00 2.25 2.24 0.00 3.66 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.22 0.00 244 F 8.21 4.39 0.00 3.05 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 0.00 245 V 7.25 3.23 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 0.77 0.00 0.00 0.86 0.00 0.00 246 D 8.62 4.22 0.00 3.01 2.84 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 0.00 247 D 8.09 4.34 0.00 2.90 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 0.00 248 L 7.56 3.77 0.00 1.52 1.45 0.24 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 249 N 8.10 4.22 0.00 2.37 2.57 0.00 0.00 7.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 N 7.66 4.82 0.00 2.80 2.78 0.00 0.00 7.00 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 0.00 251 G 7.49 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 0.00 252 R 8.17 4.24 0.00 1.90 1.99 0.00 3.20 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 253 A 7.47 4.58 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 0.00 254 A 8.38 4.88 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 255 Y 8.88 5.02 0.00 2.88 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 0.00 256 A 8.42 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 257 R 8.10 4.43 0.00 1.75 1.95 0.00 3.24 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.51 0.00 258 N 9.56 4.41 0.00 2.74 2.88 0.00 0.00 6.67 7.61 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 0.00 259 V 7.44 3.98 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 0.79 0.00 0.00 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.