NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 Y 4.8778 8.0033 121.6967 57.8419 41.2207 177.1314 12 N 4.0635 8.3117 116.9680 56.2882 38.7525 176.4246 13 R 3.8472 8.5496 122.6688 61.5379 29.7101 180.2110 14 F 5.0174 7.5236 117.0883 60.3963 39.0599 178.0338 15 V 3.2407 8.0450 118.1436 65.6292 31.0684 177.9901 16 A 3.9982 7.7628 120.4275 55.0151 17.9462 179.3695 17 D 4.2335 7.5558 116.2085 57.2464 40.9173 178.2472 18 L 3.9362 7.1536 119.3647 58.4194 42.1584 178.7329 19 F 4.8193 7.9991 116.5268 60.0580 40.4528 177.2365 20 G 4.2314 8.4455 107.4849 44.4054 0.0000 173.4120 *23 A 4.5261 7.5951 125.7919 52.6820 21.3939 178.9042 24 Y 4.1744 8.2249 116.5208 60.6301 38.7577 178.2226 25 G 3.5816 8.1247 106.2885 47.8518 0.0000 175.4006 26 E 4.1775 8.1105 120.6206 58.9205 29.6358 178.8789 27 L 3.7652 7.9699 120.4393 58.3228 42.0091 179.2612 28 S 4.0365 7.5813 114.6946 61.3385 62.6185 176.4147 29 A 3.2597 7.8676 123.4542 54.9051 18.0579 179.2696 30 F 4.1373 8.2009 118.9719 61.7010 39.5641 177.2267 31 E 3.4644 8.1292 117.9382 59.2185 29.1262 179.7021 32 R 3.8335 7.8914 118.2956 59.2474 30.1913 179.1551 33 F 4.5490 8.0817 118.2568 60.4971 38.6801 177.8382 34 S 4.0727 7.7501 112.7571 61.5584 62.6797 176.1710 35 A 4.1380 7.7595 124.1241 54.8902 17.9889 179.3833 36 D 4.6450 8.5937 117.4583 57.3019 40.9501 178.6084 37 A 4.2739 8.2422 121.5927 55.5159 18.1163 179.5896 38 R 3.8187 7.3263 115.4702 59.2678 30.0524 177.0835 39 Y 4.5308 7.5062 114.1715 57.7070 37.9682 175.9258 40 S 2.7900 7.3882 114.6906 56.9754 63.3926 172.8817 41 P 4.1944 0.0000 0.0000 65.0223 31.4688 176.1461 42 T 4.5942 6.5577 107.1376 58.4534 72.2578 174.1591 43 L 3.9617 8.4052 123.3740 58.4812 41.7897 178.3136 44 H 4.0905 8.1787 116.8251 59.5527 29.9135 176.0886 45 D 4.5170 7.8734 118.1690 55.1537 40.7016 178.4887 46 R 3.8621 7.5963 119.6316 59.3832 30.1334 178.5390 47 A 4.1070 7.9255 118.9440 54.0177 18.2828 179.3746 48 V 3.5695 7.5756 117.6584 66.4347 31.6241 178.1048 49 L 4.2607 8.1470 117.9115 57.0815 41.6325 179.4183 50 G 3.6947 7.7775 105.5752 47.8307 0.0000 175.9613 51 R 3.9951 8.2822 120.6443 59.1695 30.1728 179.2570 52 I 3.7793 7.5023 117.9391 64.1812 37.0451 178.1698 53 A 4.3248 8.3977 121.8361 55.5266 18.2474 179.9088 54 V 3.7491 8.1876 116.6618 66.1820 31.6317 178.3060 55 V 3.6200 7.9490 118.0524 66.0133 31.2680 177.8080 56 E 4.0355 8.4562 118.2653 59.5396 29.3594 179.0891 57 F 3.9361 8.3913 120.6322 61.2603 39.4268 177.0900 58 R 3.8906 8.2131 118.3890 59.5844 29.7589 178.2933 59 H 4.1902 8.2988 116.0296 59.0445 28.7138 176.8339 60 Y 4.3364 7.9733 122.7371 60.2609 38.4845 178.3490 61 E 3.3707 7.9166 119.1676 58.8934 29.4575 179.1584 62 L 3.7663 7.5858 120.2739 57.9977 42.0912 179.2756 63 V 3.0525 7.7586 118.5136 65.8629 31.5387 177.9849 64 S 3.8473 7.8362 115.0763 61.5656 62.4723 176.7661 65 A 3.8359 7.6880 123.2149 54.9626 17.9020 179.4911 66 R 3.6775 7.4214 116.1244 59.4690 30.2922 178.2689 67 L 4.1711 7.9392 118.9147 58.1170 41.7974 179.4320 68 E 4.1914 8.2614 119.1561 58.4610 29.2755 180.2326 69 A 4.2305 8.0318 121.8791 51.4855 18.3745 178.2037 *71 G 3.8095 7.8747 107.5222 46.5059 0.0000 173.1855 72 I 4.3233 7.7001 120.7495 58.9902 39.1191 174.7199 73 D 4.7840 8.7585 123.3543 52.8377 41.2798 176.2102 74 A 4.0106 8.6929 130.9229 55.5992 18.5233 178.4398 75 E 4.2071 8.2945 113.1755 59.7222 29.7764 178.4218 76 D 4.4309 8.1592 117.0397 57.3784 40.9759 177.5471 77 A 4.2853 7.9991 120.8256 52.6932 18.1316 179.2540 *79 L 4.1334 8.0898 120.9315 55.9835 43.4124 177.7670 80 P 4.0277 0.0000 0.0000 64.2668 31.3708 176.8262 81 F 4.7238 7.5136 115.3674 57.3623 40.4256 177.2573 82 Q 3.2369 7.7751 122.3053 58.8960 28.6200 178.0449 83 A 4.0134 7.8847 120.8773 55.1749 18.5234 179.2815 84 A 4.2441 7.9347 120.1301 54.7849 18.5971 179.9148 85 V 3.6451 8.2083 116.7539 66.3873 31.7476 177.8545 86 D 4.5877 8.7754 119.0965 57.7208 40.6801 178.3602 87 Y 4.0757 8.4650 121.4417 60.1162 38.6393 177.4736 88 F 4.1308 8.2296 120.4660 62.0000 39.7415 176.5948 89 H 4.3376 8.5225 116.6626 58.0064 28.6012 177.9272 90 S 4.1462 8.2748 116.0681 60.7826 62.5824 175.7610 91 R 4.3432 7.2707 119.4463 55.9962 31.0577 176.1250 92 T 4.6238 7.3914 109.2979 60.6171 68.6907 174.9524 93 R 4.2943 7.9669 120.4603 55.7772 30.5834 175.5084 94 P 3.8408 0.0000 0.0000 62.3127 32.0090 176.6006 95 A 3.9678 8.6853 124.5506 54.5195 18.9424 176.5406 96 D 4.4868 7.0630 113.3824 51.1840 42.0992 175.6552 97 W 4.0498 8.7191 127.3782 60.8048 30.2157 177.4859 98 Y 3.9581 7.7677 115.6812 61.0582 37.4524 177.8788 99 E 3.8916 8.0765 118.4703 59.1895 29.6558 179.3020 100 S 4.3574 7.7151 115.1991 61.4060 62.9070 176.6058 101 L 3.3909 7.4306 119.6802 56.1232 41.6250 178.1396 *103 K 4.2548 7.9677 119.5963 56.2899 34.1958 177.6323 104 A 3.7816 8.1040 120.4400 55.1592 18.0855 178.9620 105 Y 4.0536 8.0283 117.9842 60.7839 38.9083 178.3609 106 V 3.3576 7.8274 118.5302 66.2476 31.7495 177.8998 107 I 3.7272 8.0672 119.6297 64.3713 36.7488 177.9938 108 D 4.4240 8.2763 119.3304 57.1938 41.0673 178.3323 109 T 3.8966 7.6888 110.4040 64.4620 68.9884 177.1977 110 V 3.5403 7.7145 121.4325 65.4770 31.5019 178.0872 111 S 3.7664 7.7999 113.4301 61.3768 62.7247 176.3338 112 A 4.1455 7.7413 124.6701 54.8286 18.1379 179.2675 113 D 4.2940 8.1821 117.3303 57.5409 40.8562 178.7145 114 F 4.1169 8.3865 121.2908 61.6456 39.3442 176.7686 115 Y 4.2908 8.0868 116.2953 61.2853 37.4554 178.8029 116 R 3.9773 7.9781 117.7655 58.9369 30.2706 178.8319 117 A 4.1148 7.9135 120.8957 55.1781 18.6688 179.5733 118 I 3.9407 7.7179 111.0034 62.9269 37.6073 178.0470 119 S 4.2062 7.6396 115.3847 61.2688 62.7010 176.2009 120 R 3.9454 7.2086 120.8681 58.5432 29.9383 176.8407 121 Y 4.4516 7.5632 113.5173 58.3304 38.4405 175.5144 122 V 4.6438 7.3568 112.9075 59.1302 34.4221 175.4225 123 D 4.6271 8.8706 121.7184 53.1897 41.2666 177.3590 124 A 4.1954 8.5634 121.6756 55.0825 18.2382 180.2880 125 G 3.5771 8.1537 104.1533 48.2363 0.0000 176.1010 126 T 4.1079 9.3066 119.1657 66.4476 68.5469 176.9165 127 R 3.9335 8.4824 121.0772 59.3158 29.7035 178.1320 128 D 4.2787 8.0385 118.0272 57.3941 41.1448 178.4369 129 V 3.5472 7.6650 118.4169 65.9628 31.5721 178.0951 130 I 3.4766 7.6454 119.6479 64.1670 36.7302 178.1317 131 E 4.0772 8.0368 118.2808 58.9276 29.3245 178.9795 132 Q 4.1242 7.5065 117.7297 58.8011 28.8883 178.1051 133 I 3.6924 7.1793 119.7849 62.2597 37.3029 176.4600 134 Q 4.0347 7.1848 121.0011 55.5385 29.1745 175.6714 135 A 4.0709 8.9692 131.1529 53.0213 18.8841 178.4838 136 S 4.4759 8.8095 125.2039 60.9406 64.5737 172.4171 137 D 4.7124 8.7630 127.0516 59.7023 39.5344 180.5956 138 E 4.3201 8.1595 119.0971 61.0140 29.5697 181.5001 139 T 4.1439 7.8711 115.2545 67.2791 68.7266 176.8194 140 T 3.9154 7.7402 117.7434 66.6669 68.3626 176.3204 141 E 4.0927 8.2923 120.7620 58.7151 29.7307 179.0480 142 V 3.5979 7.5901 118.9498 65.9186 31.5202 178.0368 143 L 3.9564 7.5415 118.3945 57.6413 41.4141 179.2489 144 R 3.1974 7.8642 118.6512 59.4182 29.9869 178.2319 145 E 3.8960 8.4276 119.2206 59.0947 29.5761 178.7414 146 R 3.9786 7.9381 118.6603 59.1679 30.0591 178.5052 147 L 3.9577 8.0886 119.1182 57.7185 41.6594 179.1784 148 R 3.8231 8.0986 118.9370 59.6945 30.0318 178.1980 149 S 4.0887 8.1821 112.4092 61.4822 62.3232 176.1070 150 A 4.0108 8.0448 123.2588 55.2243 17.9485 179.6665 151 L 3.8960 8.0169 116.4594 57.7888 41.7291 179.2437 152 A 4.1182 8.3808 120.2943 55.1176 18.3255 179.1984 153 D 4.5437 7.7016 116.1552 55.5376 41.1198 176.3186 154 D 4.8377 7.6390 120.2591 51.4756 42.6630 174.8443 155 P 4.2971 0.0000 0.0000 65.4871 30.3732 177.8325 156 R 4.0555 8.0285 117.3264 58.0123 30.4312 178.4843 157 L 4.1159 7.7364 119.9350 57.6467 41.9068 178.3084 158 A 3.9712 7.9437 120.3526 55.4319 18.1975 179.3097 159 S 4.0253 8.0467 110.9342 61.5357 62.5030 176.2476 160 R 3.9075 7.4895 120.0841 59.5218 29.8754 178.5247 161 L 4.2975 8.3950 118.5556 57.2059 41.5656 179.3703 162 A 4.0518 8.3607 121.6770 54.8612 18.3176 179.3256 163 L 3.8987 7.7877 118.8352 58.0613 42.2535 178.8206 164 W 4.5847 8.3240 128.3147 60.6706 30.7532 177.8255 165 G 3.7479 8.6311 105.9258 48.2417 0.0000 175.8012 166 R 3.9989 8.0525 120.4641 58.6511 29.9371 179.2674 167 R 3.7933 8.0345 118.7049 59.2976 30.1422 178.2985 168 L 3.5858 7.7734 119.1618 57.6554 41.4930 179.3936 169 L 3.8709 7.6917 119.7251 58.0529 42.0985 179.0576 170 G 3.6803 7.9463 105.6230 48.1054 0.0000 175.4539 171 E 4.0831 8.4422 121.1913 58.9141 29.4255 179.3630 172 A 3.9705 8.3091 120.9691 55.0638 18.4281 179.6524 173 L 3.9025 8.2745 117.9144 58.3255 41.7567 179.8657 174 T 3.9061 8.0660 115.5948 66.7594 67.8382 176.5914 175 Q 4.1117 8.1201 119.2556 58.3612 28.9962 178.0942 176 A 3.9512 8.0853 122.0910 55.2803 18.3258 179.5082 177 Q 3.8836 8.1018 117.9472 59.1588 29.1947 178.1360 178 R 3.8544 7.9218 119.7318 59.4296 30.2158 178.7295 179 V 3.7462 8.2786 118.5813 66.0397 31.3422 178.0261 180 S 4.1392 7.9643 114.1944 61.9917 62.2126 175.8901 *181 Y 4.1179 7.8650 123.4116 61.6437 36.8626 180.6271 182 E 4.3456 8.7154 121.5163 58.3214 31.3402 177.1266 183 H 4.7874 7.9118 115.7437 54.1891 29.9668 172.2203 184 A 4.1576 7.7943 124.0706 52.1637 19.3693 177.6814 185 F 4.6341 7.8321 112.7474 55.9486 42.3030 176.7476 186 L 3.6310 7.0427 122.0031 57.7275 41.2220 179.0925 187 G 3.5891 7.7562 103.7373 48.0061 0.0000 175.2682 188 S 4.0638 7.5201 116.4935 61.5670 62.6258 176.5927 189 L 4.2180 7.2890 120.1589 58.5414 41.4413 178.7486 190 I 2.8108 7.6765 119.0699 63.6575 36.9905 177.1379 *196 A 4.2755 7.7362 121.4354 52.4977 21.2190 178.6673 197 A 3.9842 7.9619 116.1945 55.4983 18.3705 179.5967 198 A 3.9098 7.8887 118.3407 55.1719 18.1698 179.7306 199 K 3.9108 7.6427 115.9823 58.9863 32.0166 179.0457 200 E 4.0191 8.1514 122.2695 59.3642 29.3729 179.2763 201 L 4.1308 7.6482 122.9439 59.0947 40.9776 183.5633 202 V 3.7083 7.5265 118.0015 66.0561 31.3815 178.1281 203 S 4.1943 7.8337 114.7702 61.6157 62.7596 176.8697 204 G 3.6234 7.7032 106.9254 47.6152 0.0000 175.5630 205 L 3.9803 7.7470 122.2487 58.1553 42.1926 179.0051 206 I 3.6967 7.8831 119.5710 64.4303 36.9429 178.3229 207 A 4.1144 8.4701 122.0584 54.9227 18.2957 179.8142 208 G 3.6060 7.9794 103.8649 47.9604 0.0000 175.9028 209 L 3.9923 7.9532 121.1159 57.4386 41.6929 179.2823 210 A 3.9852 7.9377 120.7154 55.3206 18.3151 179.2986 211 E 3.9098 8.3877 117.7508 59.4660 29.7679 179.2413 212 K 4.0667 8.0302 118.1007 59.4039 31.8641 178.8713 213 H 4.0810 8.1088 118.0569 59.3172 29.8607 176.9783 214 S 4.2775 8.1349 116.3698 61.8205 62.6030 176.6005 215 K 4.2357 7.9548 126.0869 59.5910 30.9132 182.5383 216 R 4.3728 7.7823 117.9022 56.6884 29.8579 178.9570 *218 T 4.5832 7.8294 116.9607 63.9671 70.3644 176.4708 219 Q 4.0620 7.9410 118.3836 58.1910 28.7691 176.9396 220 L 4.2763 7.5867 115.4400 54.2341 41.8325 176.9588 221 G 3.8745 8.2415 107.1158 46.4298 0.0000 173.7508 222 L 4.6408 7.7258 120.7874 53.5723 43.8790 177.6907 223 T 4.1972 8.3133 111.8870 61.1579 68.5384 175.6779 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 11 Y 8.00 4.88 0.00 3.14 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 12 N 8.31 4.06 0.00 2.87 2.81 0.00 0.00 7.22 6.78 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 13 R 8.55 3.85 0.00 1.81 1.95 0.00 3.24 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.30 0.00 14 F 7.52 5.02 0.00 3.15 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 V 8.04 3.24 1.65 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 0.46 0.00 0.00 0.05 0.00 0.00 16 A 7.76 4.00 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 17 D 7.56 4.23 0.00 2.48 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 18 L 7.15 3.94 0.00 1.69 1.65 1.34 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 19 F 8.00 4.82 0.00 2.98 2.88 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 20 G 8.45 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 0.00 0.00 0.00 *23 A 7.60 4.53 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 24 Y 8.22 4.17 0.00 3.25 3.12 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 0.00 0.00 0.00 0.00 25 G 8.12 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.11 4.18 0.00 2.30 2.32 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 2.55 2.47 0.00 27 L 7.97 3.77 0.00 1.24 1.45 0.32 0.79 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 28 S 7.58 4.04 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 29 A 7.87 3.26 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 30 F 8.20 4.14 0.00 3.46 3.37 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 31 E 8.13 3.46 0.00 2.10 1.86 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 2.35 2.68 0.00 32 R 7.89 3.83 0.00 1.39 1.86 0.00 3.11 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.28 0.00 33 F 8.08 4.55 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 34 S 7.75 4.07 0.00 3.79 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 7.76 4.14 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 36 D 8.59 4.64 0.00 3.05 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 37 A 8.24 4.27 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 0.00 0.00 38 R 7.33 3.82 0.00 1.60 1.45 0.00 3.03 0.00 0.00 3.03 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 39 Y 7.51 4.53 0.00 2.99 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 40 S 7.39 2.79 0.00 2.72 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 41 P 0.00 4.19 0.00 2.05 2.05 0.00 2.20 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.35 0.00 42 T 6.56 4.59 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 1.12 0.00 0.00 43 L 8.41 3.96 0.00 1.72 1.66 0.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 44 H 8.18 4.09 0.00 3.13 3.29 0.00 5.78 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 D 7.87 4.52 0.00 2.28 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 0.00 0.00 0.00 46 R 7.60 3.86 0.00 1.88 1.95 0.00 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8.56 4.20 1.34 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 0.00 0.00 0.00 125 G 8.15 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 T 9.31 4.11 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 127 R 8.48 3.93 0.00 1.93 2.15 0.00 3.09 0.00 0.00 3.08 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 128 D 8.04 4.28 0.00 3.04 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 0.00 129 V 7.66 3.55 2.33 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 0.69 0.00 0.00 0.95 0.00 0.00 130 I 7.65 3.48 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 1.27 1.00 0.82 0.00 0.00 131 E 8.04 4.08 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 2.34 2.44 0.00 132 Q 7.51 4.12 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.03 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 133 I 7.18 3.69 1.64 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.27 0.64 0.00 0.00 134 Q 7.18 4.03 0.00 2.26 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 135 A 8.97 4.07 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 0.00 136 S 8.81 4.48 0.00 3.75 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 D 8.76 4.71 0.00 2.68 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 0.00 138 E 8.16 4.32 0.00 1.97 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 2.31 1.97 0.00 139 T 7.87 4.14 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 1.27 0.00 0.00 140 T 7.74 3.92 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 1.38 0.00 0.00 141 E 8.29 4.09 0.00 2.35 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 2.30 2.18 0.00 142 V 7.59 3.60 2.29 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 1.01 0.00 0.00 1.02 0.00 0.00 143 L 7.54 3.96 0.00 2.06 1.68 0.95 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 0.00 144 R 7.86 3.20 0.00 1.86 2.02 0.00 3.12 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.44 0.00 145 E 8.43 3.90 0.00 2.14 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 2.32 2.37 0.00 146 R 7.94 3.98 0.00 2.17 2.08 0.00 3.35 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.96 0.00 147 L 8.09 3.96 0.00 1.65 1.60 0.67 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 148 R 8.10 3.82 0.00 1.91 2.05 0.00 3.10 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 149 S 8.18 4.09 0.00 4.01 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 0.00 150 A 8.04 4.01 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 0.00 0.00 0.00 0.00 0.00 151 L 8.02 3.90 0.00 1.75 1.72 0.94 1.07 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 0.00 152 A 8.38 4.12 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 0.00 153 D 7.70 4.54 0.00 2.86 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 0.00 154 D 7.64 4.84 0.00 2.63 2.35 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 0.00 155 P 0.00 4.30 0.00 2.20 2.15 0.00 3.79 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 156 R 8.03 4.06 0.00 2.03 1.99 0.00 3.10 0.00 0.00 3.07 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 157 L 7.74 4.12 0.00 1.60 1.68 0.77 0.69 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 0.00 158 A 7.94 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 0.00 159 S 8.05 4.03 0.00 3.91 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 0.00 160 R 7.49 3.91 0.00 1.91 2.03 0.00 3.16 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 1.57 1.65 0.00 161 L 8.40 4.30 0.00 1.78 1.83 0.97 1.14 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 0.00 162 A 8.36 4.05 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 0.00 163 L 7.79 3.90 0.00 1.78 1.95 0.97 1.31 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 0.00 164 W 8.32 4.58 0.00 3.54 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 0.00 165 G 8.63 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 R 8.05 4.00 0.00 2.12 2.00 0.00 3.15 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 167 R 8.03 3.79 0.00 1.90 1.86 0.00 3.27 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.65 0.00 168 L 7.77 3.59 0.00 1.56 1.52 0.48 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 169 L 7.69 3.87 0.00 1.54 1.74 0.78 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 170 G 7.95 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 E 8.44 4.08 0.00 1.91 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 2.42 2.27 0.00 172 A 8.31 3.97 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 0.00 173 L 8.27 3.90 0.00 1.88 1.72 0.90 0.60 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 0.00 174 T 8.07 3.91 4.48 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 0.00 0.00 1.26 0.00 0.00 175 Q 8.12 4.11 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.78 2.89 0.00 176 A 8.09 3.95 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 0.00 177 Q 8.10 3.88 0.00 2.32 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 178 R 7.92 3.85 0.00 1.99 2.06 0.00 3.06 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 179 V 8.28 3.75 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 1.28 0.00 0.00 1.14 0.00 0.00 180 S 7.96 4.14 0.00 4.05 3.81 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 *181 Y 7.86 4.12 0.00 2.46 2.14 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 0.00 182 E 8.72 4.35 0.00 2.11 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 2.30 2.29 0.00 183 H 7.91 4.79 0.00 3.02 3.11 0.00 6.01 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 0.00 184 A 7.79 4.16 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 0.00 185 F 7.83 4.63 0.00 3.26 3.44 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 0.00 186 L 7.04 3.63 0.00 1.26 1.46 0.70 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 187 G 7.76 3.59 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 0.00 0.00 0.00 188 S 7.52 4.06 0.00 2.96 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 0.00 189 L 7.29 4.22 0.00 1.69 1.82 1.06 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 190 I 7.68 2.81 1.58 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.44 0.35 0.00 0.00 *196 A 7.74 4.28 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 0.00 197 A 7.96 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 0.00 198 A 7.89 3.91 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 0.00 199 K 7.64 3.91 0.00 2.03 1.80 0.00 1.61 0.00 0.00 1.50 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.36 7.81 200 E 8.15 4.02 0.00 2.16 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 2.28 2.29 0.00 201 L 7.65 4.13 0.00 1.64 1.65 0.92 0.72 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 0.00 202 V 7.53 3.71 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.76 0.00 0.00 203 S 7.83 4.19 0.00 4.01 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 0.00 204 G 7.70 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 L 7.75 3.98 0.00 1.69 1.85 0.90 1.60 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 0.00 206 I 7.88 3.70 1.98 0.00 0.00 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 1.43 0.52 0.88 0.00 0.00 207 A 8.47 4.11 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 0.00 208 G 7.98 3.61 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 0.00 0.00 0.00 209 L 7.95 3.99 0.00 1.87 1.72 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 210 A 7.94 3.99 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 0.00 211 E 8.39 3.91 0.00 2.28 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 2.31 2.40 0.00 212 K 8.03 4.07 0.00 1.94 1.84 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.64 7.81 213 H 8.11 4.08 0.00 3.10 3.57 0.00 5.95 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 S 8.13 4.28 0.00 4.06 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 K 7.95 4.24 0.00 1.81 1.80 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.35 7.81 216 R 7.78 4.37 0.00 2.04 2.08 0.00 3.10 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 *218 T 7.83 4.58 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 1.22 0.00 0.00 219 Q 7.94 4.06 0.00 2.28 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.93 0.00 0.00 0.00 0.00 0.00 2.41 2.52 0.00 220 L 7.59 4.28 0.00 1.69 1.69 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 221 G 8.24 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 0.00 222 L 7.73 4.64 0.00 1.73 1.60 0.98 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 223 T 8.31 4.20 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 1.21 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.