NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 D 4.5818 8.2233 120.1912 53.8897 41.8966 175.6994 4 L 3.7406 8.2811 127.7881 57.3067 41.6595 177.5382 5 K 3.8368 8.2135 117.7438 59.8468 32.3240 178.5712 6 R 4.7530 7.6552 118.7538 58.9265 30.2792 177.9207 7 L 4.5077 7.9600 119.7392 58.6463 41.7951 179.2086 8 R 3.9446 8.0796 116.9255 59.3834 30.3346 178.7853 9 Q 4.2332 8.6094 118.0537 57.8874 29.8230 176.3951 10 E 5.1448 8.3402 118.6499 53.5753 29.9909 174.5188 11 P 4.6436 0.0000 0.0000 64.3572 31.9126 177.5096 12 E 4.3759 8.0148 117.4604 58.1074 30.3658 178.2757 13 V 3.4775 7.5234 118.2639 66.0924 31.6345 178.2219 14 F 4.1752 8.0516 117.0254 60.8571 38.7119 177.2562 15 H 4.2032 7.9803 115.9706 58.8658 28.4759 177.8537 16 R 3.9575 8.1865 120.4321 59.1722 29.9351 178.3962 17 A 4.0269 7.8938 120.4253 54.9759 18.3596 179.7727 18 I 3.6861 7.8777 118.3671 64.7802 37.3935 178.9747 19 R 3.9961 7.8390 118.7407 59.1477 29.6031 178.9740 20 E 4.0066 8.1375 117.8055 59.1176 29.6113 178.7507 21 K 4.3449 8.0550 115.4055 55.8375 32.4442 177.3138 22 G 3.8499 7.6507 106.9947 46.3937 0.0000 173.8982 23 V 4.0204 7.5630 118.0332 61.0761 32.7260 175.7526 24 A 4.5112 8.2718 128.4290 50.4412 18.7172 175.8603 25 L 4.3357 7.9362 122.5322 53.4345 44.1824 176.0232 26 D 4.5369 8.6416 126.3190 53.5067 41.3672 176.0866 27 L 4.0055 8.3303 129.7269 57.5584 42.0971 178.4987 28 E 3.9327 8.1249 118.6376 59.2783 29.4226 178.8255 29 A 3.9532 7.9286 120.3083 55.0424 18.5090 179.1042 30 L 3.8487 7.5253 117.8732 58.4088 41.9241 179.2446 31 L 3.9461 7.4857 116.8829 57.7306 41.8081 178.9639 32 A 4.1238 8.2397 120.9420 55.2360 18.3084 179.9044 33 V 3.8264 7.9629 118.1688 65.4989 31.6676 177.8054 34 D 4.1138 8.1249 117.8414 57.1890 40.9076 177.4676 *3260 E 4.2912 7.8987 117.4850 56.2333 31.0621 176.9061 3261 Q 4.1025 8.5037 119.6794 59.0085 29.0230 177.8206 3262 L 4.3313 8.3290 123.1254 58.0232 41.6358 178.6868 3263 H 4.1674 8.2164 115.8388 58.4974 28.4260 178.0773 3264 K 4.0071 7.9299 120.4439 59.6449 31.9290 179.3290 3265 Q 3.9827 8.0906 117.7153 59.2015 28.6085 178.9801 3266 Q 4.0158 8.1934 119.0177 58.5264 28.5725 178.5978 3267 E 3.9236 7.8315 119.2234 59.5349 29.2024 179.0669 3268 V 3.5205 7.9455 118.4470 66.3544 31.3444 177.9473 3269 I 3.8928 7.8330 118.7790 63.4790 37.1888 177.7823 3270 A 3.9830 7.9300 121.7494 55.4773 18.2144 179.2471 3271 D 4.2496 8.3095 117.2430 57.6820 40.7178 179.2516 3272 K 4.0368 7.7703 117.9209 59.6310 32.0730 179.4426 3273 Q 4.0108 8.1508 118.3117 59.1534 28.5796 178.9497 3274 M 3.9959 7.9431 119.6443 58.5593 31.6252 178.6161 3275 S 4.1122 8.5443 113.4981 61.2471 62.3094 176.1302 3276 V 3.5759 7.3890 120.1929 64.9708 31.5177 178.0797 3277 K 3.9948 7.9879 118.4353 59.3377 31.3732 178.9765 3278 E 3.9813 8.1628 118.9133 59.7130 29.1211 179.3034 3279 D 4.3710 7.6514 118.4380 57.1354 40.8396 178.2267 3280 L 4.1454 7.9313 117.8251 56.1989 41.5874 178.5227 3281 D 4.4694 7.9247 118.8369 56.6316 40.9866 178.3911 3282 K 4.1453 7.6942 118.0235 58.6237 31.9849 178.5217 3283 V 4.2271 7.2419 113.5090 63.0654 32.1472 177.3670 3284 E 3.8837 8.0144 119.3642 59.6063 29.6520 176.6715 3285 P 4.2732 0.0000 0.0000 65.5181 31.5302 178.5141 3286 A 4.4602 7.9106 120.5108 54.4911 18.2633 179.7054 3287 V 3.5273 7.3426 116.8165 65.8695 31.5091 178.4475 3288 I 3.8386 7.6270 119.1793 64.4074 36.9010 177.7937 3289 E 3.9134 8.0835 119.2114 59.7278 29.3340 179.5265 3290 A 4.0236 7.8945 119.9382 55.4336 18.5885 179.5479 3291 Q 4.0389 8.4567 116.6153 59.4223 28.8425 179.1005 3292 N 4.4066 8.7254 117.6028 55.8700 38.3755 177.3072 3293 A 3.9889 8.4403 121.9151 55.3223 18.6668 179.6174 3294 V 3.6615 8.0008 116.7672 66.0310 31.3825 178.2180 3295 K 3.9102 7.7060 116.7902 58.9491 31.9085 178.3137 3296 S 4.7495 7.3276 111.8271 56.8809 63.3618 174.2459 3297 I 3.7751 6.9475 124.2260 61.2071 37.4620 176.3751 3298 K 4.0375 8.7819 124.6600 56.7541 32.3939 177.6003 3299 K 4.2277 8.4489 119.0536 57.4963 32.4225 178.2238 3300 Q 4.4563 7.3882 117.8138 56.9363 30.2110 177.0974 3301 H 4.5456 7.7137 117.6372 57.2538 28.6772 177.4421 3302 L 3.9901 7.7792 121.3153 57.7709 41.7614 179.0818 3303 V 3.5799 7.6947 117.8229 65.8745 31.4634 177.4946 3304 E 3.9435 8.3288 117.4814 59.5345 29.0047 179.1872 3305 V 3.9975 7.3264 116.6183 64.2525 31.9493 177.1134 3306 R 4.4418 7.7422 113.4255 56.1470 29.8125 176.6898 3307 S 4.6431 7.8412 113.2513 58.5398 65.0008 174.4415 3308 M 4.0404 7.5462 119.3736 56.0156 32.5075 175.3536 3309 A 4.3243 8.6481 128.4453 53.7958 19.8856 176.8826 3310 N 4.6255 7.8401 115.7652 51.0218 40.2414 172.3611 3311 P 4.5044 0.0000 0.0000 61.1179 33.9310 174.2388 3312 P 4.5190 0.0000 0.0000 62.4603 33.8464 176.5896 3313 A 3.9960 8.3610 120.2021 54.8656 18.3100 180.0363 3314 A 4.0631 7.8958 119.4347 55.2899 18.5811 180.0895 3315 V 3.6764 7.6954 110.5344 64.3302 31.6851 178.4758 3316 K 4.2768 7.8902 118.3208 59.7864 31.9945 179.0155 3317 L 4.2445 8.0919 118.6455 57.9580 41.7170 179.4281 3318 A 4.2679 8.3844 120.4053 55.5665 18.4807 179.7930 3319 L 4.1978 8.4137 117.3882 57.6712 41.7102 179.0462 3320 E 4.0076 8.9059 120.2213 59.6911 29.4724 179.2629 3321 S 3.3200 7.8581 113.7713 61.2224 62.8485 176.5824 3322 I 3.8054 7.4880 121.8190 63.9711 36.8799 177.9876 3323 A 3.9123 7.8772 121.5726 55.1690 18.1342 179.1035 3324 L 3.8438 7.8875 118.6026 58.4622 41.9435 178.9776 3325 L 3.9045 7.9756 118.5675 57.7582 41.7256 178.8724 3326 L 4.2506 7.5976 115.6179 54.4279 41.7774 177.6533 3327 G 3.9845 8.0459 107.7055 45.4030 0.0000 174.3690 3328 E 4.6355 7.8424 117.2993 54.0336 28.9488 174.8541 3329 S 4.4098 7.9187 118.3299 58.8216 64.5029 174.5926 3330 T 4.7328 8.1700 113.0914 61.0049 71.2808 172.9620 3331 T 4.6178 8.3445 110.3881 61.5408 69.4161 173.5760 3332 D 4.8959 7.9806 122.1859 52.9596 42.5754 175.9449 3333 W 4.2348 9.0734 135.0000 60.5158 30.2988 177.7635 3334 K 3.9585 8.0809 118.0666 59.4276 30.9611 178.7290 3335 Q 3.9829 8.0420 117.5566 59.2505 28.6961 179.0468 3336 I 3.5415 7.7186 120.4555 64.4334 36.8781 178.0199 3337 R 3.3587 8.6249 117.4133 59.6879 30.0709 177.8149 3338 S 4.2179 9.9759 114.1322 61.7932 62.9185 176.9892 3339 I 3.7350 9.0500 115.7537 64.1097 37.1878 178.1408 3340 I 3.9370 8.1288 113.7180 63.1951 37.1962 177.4194 3341 M 4.0782 7.5928 119.6173 56.4504 32.5327 177.0779 3342 R 3.8699 7.6892 118.0284 56.6013 30.9783 176.5794 3343 E 3.8555 9.1780 124.0745 59.5930 29.5491 177.8309 3344 N 4.5846 8.1513 112.7545 53.5802 37.5860 176.1539 3345 F 3.9153 8.6421 122.6150 61.8082 39.3738 176.9740 3346 I 3.8365 7.8942 118.4326 64.1612 36.9009 176.3784 3347 P 4.2231 0.0000 0.0000 65.8806 30.9379 178.1654 3348 T 4.1400 7.6689 107.8335 63.5078 68.9258 177.1034 3349 I 3.4107 6.8289 114.2869 63.5834 37.6909 178.1164 3350 V 3.6504 7.5199 118.9458 64.7792 31.4222 176.6609 3351 N 4.7796 7.4045 113.5165 52.1173 39.5768 174.9978 3352 F 4.4043 7.5544 123.6284 57.8628 40.3014 174.2400 3353 S 4.4842 7.6131 120.7147 55.8402 65.0866 174.9214 3354 A 3.4901 7.9960 127.0911 55.2608 18.3207 179.3889 3355 E 4.0406 7.6226 113.8350 59.4457 29.5576 178.3416 3356 E 4.0749 8.5159 118.1914 58.0437 29.7726 177.1149 3357 I 4.0639 7.4816 121.2059 60.9131 37.7414 176.6934 3358 S 4.6446 8.4128 120.5290 56.9026 66.0141 174.7877 3359 D 4.3425 8.5625 120.7172 57.8302 40.4283 179.0338 3360 A 3.9955 8.0478 120.3179 55.3151 18.3048 179.6711 3361 I 3.6932 7.4682 116.8442 64.4500 37.0441 178.6194 3362 R 3.8929 8.1117 118.9453 59.4401 29.8816 178.5087 3363 E 4.0127 8.2948 118.2361 59.6474 29.5786 179.5408 3364 K 3.9338 8.3406 119.3256 59.8978 32.5071 178.4122 3365 M 4.5406 8.6797 117.9357 56.8354 31.9183 178.0020 3366 K 4.2018 7.5325 118.8376 58.4069 33.1086 178.7573 3367 K 4.0541 8.1321 117.4887 59.1891 31.9870 178.6177 3368 N 4.3894 8.4450 115.7185 54.9678 39.1164 175.7009 3369 Y 4.2380 7.4676 115.8616 58.8987 40.4505 177.8370 3370 M 4.1932 7.8577 118.3798 58.0678 32.2102 177.7000 3371 S 4.2445 7.4720 111.6509 60.4044 62.6071 174.0292 3372 N 4.5769 7.6420 119.2780 52.6851 39.1814 173.6655 3373 P 4.5779 0.0000 0.0000 64.4555 32.1057 176.9174 3374 S 4.4756 9.1308 114.5742 59.4436 63.3996 174.5353 3375 Y 4.5572 7.3040 122.3043 56.1347 36.9886 173.6612 3376 N 4.9514 7.6110 119.6840 50.5825 43.5103 172.3390 3377 Y 4.2692 8.7668 128.3940 61.4588 37.2556 178.3211 3378 E 3.5026 7.9869 118.3388 59.4071 29.4715 179.2415 3379 I 3.9308 7.7078 116.9249 63.2695 38.4575 177.1098 3380 V 4.3006 7.9490 111.7658 61.3008 32.9882 176.7618 3381 N 4.6397 9.6181 115.3023 55.1742 38.6311 175.9491 3382 R 4.1856 7.0487 117.2328 59.1406 30.8937 178.0982 3383 A 4.2172 7.7829 118.9283 53.4266 18.8877 177.7177 3384 S 4.4972 7.6515 111.3367 55.8719 65.0635 174.3814 3385 L 4.3934 8.6561 126.6546 56.1578 40.3824 177.9974 3386 A 4.3874 7.8286 120.6308 53.8279 19.6567 178.6606 3387 A 4.4353 8.1590 118.8209 53.9614 18.6917 179.7687 3388 G 3.9085 7.9260 104.6888 48.0258 0.0000 174.2724 3389 P 4.2228 0.0000 0.0000 64.9787 31.3085 178.6729 3390 M 4.1703 7.6661 115.7936 58.3538 31.7394 178.9088 3391 V 3.7777 7.8232 111.9784 63.4776 31.7898 178.4490 3392 K 3.7922 7.7041 119.7847 59.1394 31.9513 178.6651 3393 W 4.0388 8.5116 128.5414 60.2787 30.5316 177.7223 3394 A 3.5719 8.4580 120.8120 55.2106 17.9129 179.3556 3395 I 3.6341 8.0756 118.2501 64.6061 37.2391 178.1196 3396 A 3.9651 8.0194 121.3515 55.8036 18.1961 179.8587 3397 Q 3.8232 7.8272 115.7963 58.3731 28.5280 178.6722 3398 L 4.0315 7.4362 121.7605 57.9163 42.1805 178.4958 3399 N 4.3510 8.2363 116.4861 56.2441 38.3402 176.8736 3400 Y 3.8996 8.0977 120.7690 60.7359 38.7770 177.5612 3401 A 3.9867 7.9027 120.2380 55.6083 18.5090 179.0712 3402 D 4.4061 8.2513 117.2382 57.4135 40.8540 178.6903 3403 M 3.9456 8.1407 119.0230 58.7682 32.1008 178.0274 3404 L 3.7888 7.4824 117.7754 57.9341 41.8654 179.3920 3405 K 4.0571 7.6286 119.2912 59.4395 31.9428 179.0714 3406 R 4.0190 7.7357 116.6787 58.6271 30.6357 178.3328 3407 V 3.7129 7.8004 116.5620 64.4913 30.1660 176.9181 3408 E 3.8899 7.8549 119.2784 59.9839 29.3158 176.7380 3409 P 4.4325 0.0000 0.0000 65.2651 31.0621 178.4946 3410 L 4.0083 7.3014 116.6340 57.9414 41.2510 179.2465 3411 R 4.1020 8.3656 117.0765 57.8956 28.4041 178.1255 3412 N 4.2470 7.6403 116.7500 55.9167 39.2156 176.3989 3413 E 4.1867 7.9105 120.9376 58.9781 29.7083 178.5978 3414 L 3.9328 7.9086 118.6576 57.9797 41.6296 178.7954 3415 Q 3.9514 7.5012 118.9000 59.4256 28.7953 179.0928 3416 K 3.9244 7.5508 118.4518 59.5541 32.2544 179.0701 3417 L 3.9420 7.9807 119.2083 58.4362 41.5179 179.7749 3418 E 4.0535 8.7788 118.3485 59.2305 29.3347 179.1172 3419 D 4.3415 7.8525 119.1324 57.4018 40.4038 178.5056 3420 D 4.3474 8.6015 119.5321 56.8799 40.8183 178.8066 3421 A 3.9897 7.9630 121.6788 55.1604 18.4893 179.8749 3422 K 3.9638 8.3489 117.3543 59.4250 31.9534 179.1835 3423 D 4.3855 8.2456 119.4386 57.7841 40.5938 178.8716 3424 N 4.3564 7.6499 114.3403 55.9917 38.5377 177.2119 3425 Q 4.0983 7.7358 118.7542 59.2151 28.9356 178.3920 3426 Q 4.1089 7.8477 117.4743 59.3271 28.9912 178.0914 3427 K 4.1897 8.1599 122.3856 56.9303 32.3173 176.6936 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 3 D 8.22 4.58 0.00 2.82 2.70 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 4 L 8.28 3.74 0.00 1.80 1.65 1.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.21 3.84 0.00 1.80 1.87 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.52 7.81 6 R 7.66 4.75 0.00 1.98 2.13 0.00 3.17 0.00 0.00 3.05 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.58 0.00 7 L 7.96 4.51 0.00 1.58 1.67 -2.80 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.08 3.94 0.00 1.93 1.99 0.00 3.22 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 9 Q 8.61 4.23 0.00 2.36 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.93 0.00 0.00 0.00 0.00 0.00 2.41 2.68 0.00 10 E 8.34 5.14 0.00 2.05 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 11 P 0.00 4.64 0.00 2.22 2.18 0.00 3.64 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.31 0.00 12 E 8.01 4.38 0.00 2.02 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 2.34 2.37 0.00 13 V 7.52 3.48 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.95 0.00 0.00 14 F 8.05 4.18 0.00 3.10 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 H 7.98 4.20 0.00 3.41 3.38 0.00 5.61 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 16 R 8.19 3.96 0.00 1.99 2.06 0.00 3.09 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 17 A 7.89 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 18 I 7.88 3.69 1.90 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 1.52 1.20 0.96 0.00 0.00 19 R 7.84 4.00 0.00 1.83 1.99 0.00 3.15 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 20 E 8.14 4.01 0.00 2.05 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 2.35 2.49 0.00 21 K 8.06 4.34 0.00 1.84 1.85 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.56 7.81 22 G 7.65 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 0.00 0.00 0.00 23 V 7.56 4.02 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 0.80 0.00 0.00 0.99 0.00 0.00 24 A 8.27 4.51 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 25 L 7.94 4.34 0.00 1.53 1.51 0.90 1.23 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 26 D 8.64 4.54 0.00 2.83 2.56 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 27 L 8.33 4.01 0.00 1.67 1.49 0.73 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.12 3.93 0.00 2.27 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 2.35 2.39 0.00 29 A 7.93 3.95 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 30 L 7.53 3.85 0.00 1.76 1.63 0.88 0.53 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 31 L 7.49 3.95 0.00 1.78 1.70 0.93 1.20 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 32 A 8.24 4.12 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 33 V 7.96 3.83 2.22 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 0.99 0.00 0.00 0.95 0.00 0.00 34 D 8.12 4.11 0.00 2.83 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 *3260 E 7.90 4.29 0.00 1.99 2.07 0.00 0.00 0.00 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1.85 1.85 0.00 1.79 0.00 0.00 1.85 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.63 1.78 7.81 3335 Q 8.04 3.98 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.87 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 3336 I 7.72 3.54 1.17 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.46 0.17 0.00 0.00 3337 R 8.62 3.36 0.00 1.56 1.99 0.00 3.41 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.89 0.00 3338 S 9.98 4.22 0.00 4.00 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 3339 I 9.05 3.73 1.92 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.76 1.05 0.00 0.00 3340 I 8.13 3.94 1.37 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.01 0.73 0.00 0.00 3341 M 7.59 4.08 0.00 1.95 2.29 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.46 0.00 3342 R 7.69 3.87 0.00 1.98 1.98 0.00 3.33 0.00 0.00 3.10 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.84 0.00 3343 E 9.18 3.86 0.00 1.92 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 2.31 2.35 0.00 3344 N 8.15 4.58 0.00 2.98 3.04 0.00 0.00 5.82 8.12 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 3345 F 8.64 3.92 0.00 3.16 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 3346 I 7.89 3.84 1.90 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.66 0.89 0.00 0.00 3347 P 0.00 4.22 0.00 2.13 2.12 0.00 3.63 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 2.12 2.17 0.00 3348 T 7.67 4.14 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 1.13 0.00 0.00 3349 I 6.83 3.41 0.56 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 -0.36 0.27 0.00 0.00 3350 V 7.52 3.65 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 0.84 0.00 0.00 0.89 0.00 0.00 3351 N 7.40 4.78 0.00 2.80 2.84 0.00 0.00 6.94 7.16 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 3352 F 7.55 4.40 0.00 3.25 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3353 S 7.61 4.48 0.00 3.88 3.71 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 3354 A 8.00 3.49 1.66 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 3355 E 7.62 4.04 0.00 1.93 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 2.39 2.44 0.00 3356 E 8.52 4.07 0.00 1.42 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 2.30 2.15 0.00 3357 I 7.48 4.06 2.07 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.93 0.96 0.00 0.00 3358 S 8.41 4.64 0.00 4.06 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 3359 D 8.56 4.34 0.00 2.79 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 3360 A 8.05 4.00 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 3361 I 7.47 3.69 2.03 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 1.55 0.83 0.92 0.00 0.00 3362 R 8.11 3.89 0.00 2.02 1.99 0.00 3.28 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.93 0.00 3363 E 8.29 4.01 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 2.52 0.00 3364 K 8.34 3.93 0.00 1.99 1.97 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.52 7.81 3365 M 8.68 4.54 0.00 2.02 2.25 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.65 0.00 3366 K 7.53 4.20 0.00 2.04 1.84 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.47 7.81 3367 K 8.13 4.05 0.00 1.67 1.85 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.77 7.81 3368 N 8.45 4.39 0.00 2.71 2.19 0.00 0.00 6.86 7.47 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 3369 Y 7.47 4.24 0.00 2.76 1.66 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 3370 M 7.86 4.19 0.00 2.12 2.31 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.92 0.00 3371 S 7.47 4.24 0.00 4.16 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 3372 N 7.64 4.58 0.00 2.83 2.75 0.00 0.00 6.79 7.59 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 3373 P 0.00 4.58 0.00 2.24 2.18 0.00 3.83 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 1.99 2.00 0.00 3374 S 9.13 4.48 0.00 3.99 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3375 Y 7.30 4.56 0.00 3.00 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 3376 N 7.61 4.95 0.00 2.83 2.57 0.00 0.00 6.67 7.56 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 3377 Y 8.77 4.27 0.00 2.98 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 3378 E 7.99 3.50 0.00 2.00 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 2.34 2.22 0.00 3379 I 7.71 3.93 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 1.63 1.02 0.96 0.00 0.00 3380 V 7.95 4.30 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 0.96 0.00 0.00 1.00 0.00 0.00 3381 N 9.62 4.64 0.00 2.10 2.21 0.00 0.00 7.14 7.53 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 3382 R 7.05 4.19 0.00 1.80 1.91 0.00 3.15 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 1.53 1.70 0.00 3383 A 7.78 4.22 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 3384 S 7.65 4.50 0.00 3.85 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 0.00 3385 L 8.66 4.39 0.00 1.39 1.39 0.84 0.91 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 3386 A 7.83 4.39 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 3387 A 8.16 4.44 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 3388 G 7.93 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 3389 P 0.00 4.22 0.00 2.19 2.11 0.00 3.77 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.25 0.00 3390 M 7.67 4.17 0.00 2.15 2.40 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.60 0.00 3391 V 7.82 3.78 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 0.85 0.00 0.00 0.78 0.00 0.00 3392 K 7.70 3.79 0.00 1.37 1.76 0.00 1.23 0.00 0.00 0.61 0.00 0.00 2.35 0.00 0.00 2.16 0.00 0.00 0.00 0.00 1.25 1.23 7.81 3393 W 8.51 4.04 0.00 3.46 3.39 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 3394 A 8.46 3.57 1.50 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 0.00 0.00 3395 I 8.08 3.63 1.93 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 1.61 1.09 0.93 0.00 0.00 3396 A 8.02 3.97 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 3397 Q 7.83 3.82 0.00 1.60 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.75 0.00 0.00 0.00 0.00 0.00 1.43 1.16 0.00 3398 L 7.44 4.03 0.00 1.82 1.76 0.95 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 3399 N 8.24 4.35 0.00 2.94 2.87 0.00 0.00 6.68 6.75 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 3400 Y 8.10 3.90 0.00 3.16 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 3401 A 7.90 3.99 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3402 D 8.25 4.41 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 3403 M 8.14 3.95 0.00 1.89 2.04 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.70 0.00 3404 L 7.48 3.79 0.00 1.67 1.64 1.05 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 3405 K 7.63 4.06 0.00 1.83 1.98 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.46 7.81 3406 R 7.74 4.02 0.00 1.77 1.94 0.00 3.28 0.00 0.00 3.31 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.84 0.00 3407 V 7.80 3.71 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 1.00 0.00 0.00 0.91 0.00 0.00 3408 E 7.85 3.89 0.00 2.22 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 0.00 2.29 2.35 0.00 3409 P 0.00 4.43 0.00 2.29 2.28 0.00 3.77 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.03 0.00 3410 L 7.30 4.01 0.00 1.80 1.73 0.90 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 3411 R 8.37 4.10 0.00 1.86 1.95 0.00 3.06 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 1.62 1.67 0.00 3412 N 7.64 4.25 0.00 3.03 2.91 0.00 0.00 6.71 7.53 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 3413 E 7.91 4.19 0.00 2.02 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 0.00 2.30 2.34 0.00 3414 L 7.91 3.93 0.00 1.89 1.87 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 3415 Q 7.50 3.95 0.00 1.98 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 3416 K 7.55 3.92 0.00 2.04 1.82 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.47 7.81 3417 L 7.98 3.94 0.00 1.83 1.75 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 3418 E 8.78 4.05 0.00 2.13 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 2.32 2.46 0.00 3419 D 7.85 4.34 0.00 2.76 2.70 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 3420 D 8.60 4.35 0.00 2.80 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 3421 A 7.96 3.99 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 3422 K 8.35 3.96 0.00 1.79 1.86 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.70 7.81 3423 D 8.25 4.39 0.00 2.98 2.72 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 3424 N 7.65 4.36 0.00 2.71 2.86 0.00 0.00 7.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3425 Q 7.74 4.10 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.85 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 3426 Q 7.85 4.11 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.92 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 3427 K 8.16 4.19 0.00 1.69 1.73 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.17 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.83 1.52 7.81 * Residues marked with a * may have inaccurate shift predictions.