NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 S 4.4844 8.3349 117.0955 57.7193 64.0656 173.4241 9 T 3.5757 8.3010 121.7032 61.9405 68.9459 170.1937 10 E 4.2522 9.0729 128.2102 55.1537 32.1541 174.3174 11 W 5.2776 8.6913 126.3171 55.1582 32.0655 175.2887 12 V 4.8376 9.0688 116.9646 59.3179 35.1459 174.8457 13 D 4.8635 8.4395 123.3232 54.5782 41.4864 175.7878 14 I 4.7890 8.9868 124.3704 59.6630 39.7796 175.1662 15 V 5.0710 8.5599 119.5897 59.4936 35.2181 175.7843 16 N 4.7620 8.8910 121.0378 51.7662 39.0759 175.3278 17 E 3.9444 8.7456 117.9062 59.5953 29.6060 177.4233 18 E 4.2212 8.1755 115.4092 55.6559 29.5430 175.4775 19 N 3.9628 7.8613 116.1783 54.6115 37.8636 173.5470 20 E 4.5284 7.7040 114.7978 53.9436 31.7596 175.8924 21 V 4.1715 8.3293 123.3918 63.0441 31.5889 175.3345 22 I 4.6237 8.4708 119.7735 60.6630 38.9160 174.7669 23 A 4.7091 7.6348 123.4060 51.2620 22.9029 174.6357 24 Q 5.0435 8.5414 119.1151 54.5885 32.1818 173.9302 25 A 5.1987 9.1414 126.7853 49.8349 23.1973 175.4763 26 S 4.1315 8.8568 113.7508 58.1441 63.4211 174.2888 27 R 3.8734 8.3343 122.4318 59.9010 29.9517 177.5650 28 E 4.0416 8.2716 119.1560 59.5029 29.8608 179.8900 29 Q 4.2580 8.0281 115.7844 56.3995 27.7281 178.6102 *31 R 4.1920 8.1550 119.1936 56.2738 32.1111 177.9256 32 A 4.0234 8.5501 120.2355 54.7867 18.3618 178.1062 33 Q 4.3454 8.2448 111.7630 55.0357 29.6817 174.9215 34 C 4.0297 7.3829 116.4066 60.2736 30.3080 173.0813 35 L 4.3276 7.5925 117.7915 54.2582 42.7954 177.2388 36 R 4.5906 8.5048 122.9453 56.8208 31.4410 175.0040 37 H 5.4485 8.9121 120.5294 54.7906 32.8853 171.8474 38 R 5.3372 8.6846 115.6782 54.9222 33.0061 175.4341 39 A 5.1791 8.8057 122.1399 50.9488 23.3442 175.2998 40 T 5.2364 8.5044 109.6477 60.5769 72.0518 173.4069 41 Y 4.9148 9.1831 119.9016 56.5556 42.1114 174.2717 42 I 4.9371 8.8460 125.7900 59.3557 40.5009 175.0313 43 V 3.8907 8.6408 128.5709 62.0409 32.4414 175.0126 44 V 4.6101 8.1270 129.5965 61.9047 32.7599 174.1953 45 H 5.8318 9.2963 123.8973 53.9175 32.0230 173.9048 46 D 4.3884 9.0046 117.9287 52.7716 39.9078 176.1862 47 G 3.6274 7.8780 107.0151 46.9793 0.0000 174.5905 *49 G 4.0263 7.7642 104.1205 45.2376 0.0000 173.1450 50 K 5.1109 8.7013 120.0049 54.5699 35.9081 175.0342 51 I 5.0936 9.0928 123.4289 59.4383 40.2741 174.7567 52 L 3.7826 8.8974 129.8087 54.5250 42.1822 176.0003 53 V 4.4878 8.6568 127.5580 61.5286 34.0122 174.5432 54 Q 4.8848 8.6616 125.2448 53.9779 32.2695 174.4638 55 R 4.2861 8.8943 125.8553 55.7331 31.7594 175.6662 56 R 4.7090 8.4169 125.5749 55.8317 31.7098 176.3599 57 T 4.3035 9.2788 115.0014 61.9341 70.0708 174.3456 58 E 4.3210 8.6742 119.5051 56.7375 29.6653 177.3058 59 T 4.3021 7.5599 109.1729 62.0145 70.0769 175.3879 60 K 3.8170 7.1101 118.1778 57.0718 32.5608 176.2430 61 D 4.3766 8.7682 123.7099 57.2958 41.0382 176.4682 62 F 4.4389 8.1768 121.7286 58.1825 40.1321 175.5955 63 L 3.3582 8.1839 130.1129 54.6198 38.8063 173.2275 64 P 4.2020 0.0000 0.0000 64.2667 32.5816 176.4907 65 G 3.7507 8.0743 107.3899 45.7328 0.0000 173.7655 *67 L 3.9289 7.2735 117.0639 54.4026 43.4477 176.2547 68 D 5.1009 8.9476 122.5534 52.7664 42.3787 177.1288 69 A 4.5705 8.8397 126.2267 52.9597 19.1014 177.1255 70 T 4.6581 7.4024 104.4693 59.5200 72.0699 173.6819 71 A 4.2732 8.3659 126.6025 50.7703 20.1360 174.8759 72 G 4.0132 7.9103 104.1602 45.4413 0.0000 172.3856 73 G 3.8512 7.4183 102.8149 46.0261 0.0000 172.6538 74 V 4.2782 8.3709 120.0424 62.8532 32.3352 176.4248 75 V 3.9793 8.6427 128.2449 62.2838 32.4856 175.6388 76 Q 4.6725 9.3372 127.1093 54.6613 30.5992 175.4168 77 A 4.3166 8.4524 123.9221 54.5008 18.5773 177.8448 78 D 4.5395 9.0018 121.1145 54.7376 39.4682 174.0517 79 E 4.3882 8.0929 120.0585 56.0617 30.3772 176.8175 80 Q 4.4067 9.7770 123.0824 55.2169 30.9412 177.8732 81 L 4.0945 8.3372 121.4004 58.0273 41.7973 179.5654 82 L 3.6929 8.0279 120.0513 58.0562 42.1162 178.6169 83 E 3.8519 8.1120 117.1540 59.3154 29.2698 178.9488 84 S 4.2272 8.4078 115.1238 60.5648 62.4429 175.7694 85 A 4.0338 7.9993 123.6287 55.4492 18.0290 179.7712 86 R 3.6081 7.9448 116.5097 59.2262 29.9758 179.3467 87 R 3.8201 8.1103 118.4794 59.3816 30.1218 178.3453 88 E 3.8996 8.3752 118.2831 59.4644 29.4760 179.1132 89 A 4.0463 8.2581 120.8904 55.2378 18.5267 179.2949 90 E 4.2431 8.1010 118.9710 59.0608 29.5271 178.9810 91 E 3.9713 8.1762 117.5054 59.4232 29.7597 178.7362 92 E 4.3626 8.7271 118.7560 57.9414 29.7721 177.9223 93 L 4.6802 8.0704 115.8638 53.1777 43.7467 177.7341 94 G 4.1565 8.1196 106.4141 45.9915 0.0000 173.3808 95 I 4.4374 7.5151 112.2271 59.1070 39.5006 174.5089 96 A 4.4951 8.3260 124.2037 52.3846 21.8532 176.6002 97 G 3.8291 8.8545 110.3149 45.6103 0.0000 173.2488 98 V 4.0143 7.4100 118.8441 60.7597 32.4091 174.1029 99 P 4.3934 0.0000 0.0000 63.3627 31.7198 175.3040 100 F 5.4489 8.9254 120.7026 55.8395 41.3838 174.7623 101 A 4.7669 9.3859 125.7218 50.9054 20.9273 175.5925 102 E 4.6707 8.6832 120.5166 54.7055 31.3659 175.9031 103 H 4.8246 8.5303 122.7722 55.8183 29.8887 175.4739 104 G 3.8595 8.3430 108.5448 45.0713 0.0000 172.7678 105 Q 5.3694 8.4582 117.1744 54.5519 33.2741 174.3122 106 F 5.1915 8.9817 114.3740 56.0235 41.8421 172.3202 107 Y 4.3742 8.4389 120.5148 55.5185 40.7311 174.4703 108 F 4.8185 7.8434 127.8816 56.2560 43.0862 173.1558 109 E 4.7595 7.3923 121.8984 54.9753 32.3212 174.4245 110 D 4.5190 8.4062 120.0858 52.3433 41.9429 175.8175 111 K 4.1300 8.8614 116.6550 59.2400 32.1504 177.2537 112 N 5.0257 8.6929 114.2805 53.0918 40.1987 173.7570 113 C 4.7087 7.8687 111.1022 57.1400 32.9836 173.0144 114 R 4.9284 8.2841 118.7103 54.5662 33.7740 174.7074 115 V 4.7439 8.1512 123.7373 59.9704 35.4310 173.8758 116 W 4.7653 9.4096 125.4470 55.7763 30.3043 175.5077 117 G 3.8393 9.0335 113.7054 44.4647 0.0000 171.8018 118 A 5.2235 9.1680 125.7108 49.8598 21.6007 175.0778 119 L 5.2727 8.9750 125.9196 54.1078 43.9458 175.5155 120 F 5.6654 9.6258 124.2342 55.9947 43.9848 173.6203 121 S 5.2058 9.1486 113.7506 57.4067 66.7310 172.6133 122 C 5.0124 8.9503 114.8308 57.1547 33.4727 172.7264 123 V 5.1768 8.2862 119.9249 60.8242 32.2795 174.8815 124 S 4.6639 8.6796 121.8548 57.1554 65.4021 173.0932 125 H 4.8879 9.0588 122.2293 55.4344 29.2514 176.3033 126 G 2.6887 7.5073 108.0706 43.2446 0.0000 171.8521 127 P 4.1255 0.0000 0.0000 62.6053 32.0788 175.1444 128 F 5.2298 8.1794 117.5014 55.8092 41.3203 174.9582 129 A 4.7140 8.8007 124.9998 50.4724 20.2255 176.1278 130 L 5.0662 8.4721 121.6506 53.1004 44.8555 176.4298 131 Q 4.6062 8.2772 119.4535 54.2054 29.7373 176.7622 132 E 4.9253 8.7867 122.6278 58.2278 30.0516 177.9656 133 D 4.5000 8.0308 118.2633 56.0055 41.6046 176.4052 134 E 4.4529 8.2937 117.4879 57.0820 31.5184 175.8746 135 V 4.8311 8.1006 118.7527 59.8175 33.2785 175.9055 136 S 4.6925 8.2214 117.0939 58.4131 64.4246 173.6666 137 E 4.7324 7.4678 118.9644 55.5597 32.5507 174.3821 138 V 5.0218 8.1994 118.4962 60.0686 35.8227 174.3182 139 C 4.6201 8.3639 115.8511 57.0684 33.3459 172.8102 140 W 5.1795 8.7359 120.6796 56.3857 29.5199 175.8476 141 L 5.2881 9.1073 124.9486 52.7721 45.2057 176.7987 142 T 4.6459 8.8382 112.3379 60.3043 69.7080 173.5809 143 P 4.1930 0.0000 0.0000 66.0869 31.2445 178.7668 144 E 3.9462 8.1601 116.6881 59.5798 29.2403 179.1211 145 E 4.0471 8.0537 117.3631 59.2403 29.6693 179.3657 146 I 3.7669 7.8605 120.2675 64.6156 37.0066 178.5489 147 T 3.7245 7.7780 109.0600 64.7696 68.4895 175.8566 148 A 4.2213 8.0449 122.2988 53.8235 18.4706 178.0390 149 R 4.7209 7.9650 116.6306 55.9954 31.4543 177.5206 150 C 4.3914 8.2461 115.6601 60.6931 29.7795 175.0827 151 D 4.5304 8.1236 119.0504 55.5442 39.1255 176.8068 152 E 4.1734 8.5728 118.7881 57.1749 29.9714 176.3201 153 F 4.7660 7.7584 117.6872 55.4087 40.8231 175.8844 154 T 3.9314 8.5807 115.1108 61.3165 69.0936 173.7467 155 P 4.3043 0.0000 0.0000 65.3702 31.3682 178.5925 156 D 3.3914 7.4930 117.9644 56.1572 39.2570 178.7010 157 S 4.2862 7.7288 115.2752 60.8811 62.9260 176.1908 158 L 3.7942 7.9758 124.0085 57.6258 41.8281 178.8394 159 K 3.6494 8.0813 119.6241 59.2425 32.0888 178.4849 160 A 3.1905 7.1790 120.8586 54.8866 18.0619 179.3068 161 L 3.9232 7.7499 117.2484 58.2447 42.2191 178.6660 162 A 4.1026 7.8718 119.7235 55.2140 18.4986 179.2464 163 L 4.0696 7.7949 117.4472 57.4360 41.3804 180.3037 164 W 4.0369 8.1729 126.2482 57.6026 30.3774 177.4360 *166 K 4.1093 8.0269 116.7191 55.7990 33.9892 176.2189 167 R 4.0967 7.3057 116.0933 57.6420 31.3307 175.8931 168 N 3.1400 8.8897 117.8483 52.7101 39.0479 173.7025 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 8 S 8.33 4.48 0.00 3.65 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 9 T 8.30 3.58 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 0.03 0.00 0.00 10 E 9.07 4.25 0.00 1.94 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 0.00 2.29 2.30 0.00 11 W 8.69 5.28 0.00 3.35 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 V 9.07 4.84 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 0.78 0.00 0.00 1.00 0.00 0.00 13 D 8.44 4.86 0.00 2.68 2.67 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 14 I 8.99 4.79 1.93 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 1.45 1.03 1.00 0.00 0.00 15 V 8.56 5.07 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 0.81 0.00 0.00 1.21 0.00 0.00 16 N 8.89 4.76 0.00 2.90 3.01 0.00 0.00 6.82 7.29 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 17 E 8.75 3.94 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.27 0.00 18 E 8.18 4.22 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 2.27 2.33 0.00 19 N 7.86 3.96 0.00 1.44 2.17 0.00 0.00 6.98 7.27 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 20 E 7.70 4.53 0.00 2.21 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 2.25 2.18 0.00 21 V 8.33 4.17 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 0.96 0.00 0.00 0.94 0.00 0.00 22 I 8.47 4.62 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.89 0.96 0.00 0.00 23 A 7.63 4.71 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 24 Q 8.54 5.04 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 25 A 9.14 5.20 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 26 S 8.86 4.13 0.00 3.42 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 27 R 8.33 3.87 0.00 1.80 1.86 0.00 3.24 0.00 0.00 3.32 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 28 E 8.27 4.04 0.00 1.95 1.84 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 2.35 2.31 0.00 29 Q 8.03 4.26 0.00 2.30 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.17 6.16 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 *31 R 8.16 4.19 0.00 1.85 2.03 0.00 3.31 0.00 0.00 3.39 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 32 A 8.55 4.02 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 33 Q 8.24 4.35 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.68 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 34 C 7.38 4.03 0.00 3.13 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 35 L 7.59 4.33 0.00 1.73 1.64 0.97 1.05 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 36 R 8.50 4.59 0.00 2.02 2.09 0.00 3.65 0.00 0.00 3.71 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.91 0.00 37 H 8.91 5.45 0.00 3.35 3.41 0.00 5.28 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 R 8.68 5.34 0.00 1.86 1.95 0.00 3.16 0.00 0.00 3.39 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.71 0.00 39 A 8.81 5.18 1.16 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 0.00 0.00 40 T 8.50 5.24 4.43 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 1.37 0.00 0.00 41 Y 9.18 4.91 0.00 3.26 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 42 I 8.85 4.94 1.74 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 0.98 0.77 0.37 0.00 0.00 43 V 8.64 3.89 1.11 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 -0.18 0.00 0.00 0.63 0.00 0.00 44 V 8.13 4.61 1.89 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 1.01 0.00 0.00 0.85 0.00 0.00 45 H 9.30 5.83 0.00 3.44 3.14 0.00 5.50 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 46 D 9.00 4.39 0.00 2.20 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 47 G 7.88 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 *49 G 7.76 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 0.00 0.00 0.00 50 K 8.70 5.11 0.00 1.99 1.99 0.00 1.61 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.39 7.81 51 I 9.09 5.09 1.92 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 1.21 1.02 0.85 0.00 0.00 52 L 8.90 3.78 0.00 0.27 1.02 -0.40 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.66 4.49 2.23 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 0.97 0.00 0.00 1.13 0.00 0.00 54 Q 8.66 4.88 0.00 1.88 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 55 R 8.89 4.29 0.00 1.74 1.69 0.00 3.01 0.00 0.00 3.08 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.48 0.00 56 R 8.42 4.71 0.00 1.79 1.77 0.00 3.45 0.00 0.00 3.42 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.55 0.00 57 T 9.28 4.30 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 1.22 0.00 0.00 58 E 8.67 4.32 0.00 1.94 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 2.22 2.25 0.00 59 T 7.56 4.30 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 1.19 0.00 0.00 60 K 7.11 3.82 0.00 1.87 1.84 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.57 7.81 61 D 8.77 4.38 0.00 2.73 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 62 F 8.18 4.44 0.00 2.97 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 63 L 8.18 3.36 0.00 1.16 1.30 0.42 0.82 0.00 0.00 0.00 0.00 0.00 0.00 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3.00 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 0.00 140 W 8.74 5.18 0.00 3.22 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 0.00 141 L 9.11 5.29 0.00 1.65 1.59 1.13 0.64 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 0.00 142 T 8.84 4.65 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 1.26 0.00 0.00 143 P 0.00 4.19 0.00 2.20 2.20 0.00 3.70 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 2.23 2.33 0.00 144 E 8.16 3.95 0.00 2.02 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 2.40 2.42 0.00 145 E 8.05 4.05 0.00 2.25 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 2.38 2.38 0.00 146 I 7.86 3.77 1.80 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.77 -0.15 0.00 0.00 147 T 7.78 3.72 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 148 A 8.04 4.22 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 0.00 149 R 7.96 4.72 0.00 2.18 2.18 0.00 3.20 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.59 0.00 150 C 8.25 4.39 0.00 3.08 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 0.00 151 D 8.12 4.53 0.00 2.83 2.87 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 0.00 152 E 8.57 4.17 0.00 1.98 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 153 F 7.76 4.77 0.00 3.17 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 0.00 154 T 8.58 3.93 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 1.18 0.00 0.00 155 P 0.00 4.30 0.00 2.42 2.29 0.00 3.66 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 2.25 2.21 0.00 156 D 7.49 3.39 0.00 2.43 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 0.00 157 S 7.73 4.29 0.00 4.37 4.33 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 0.00 158 L 7.98 3.79 0.00 1.92 1.77 0.66 0.52 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 0.00 159 K 8.08 3.65 0.00 1.79 1.47 0.00 1.86 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.84 1.26 7.81 160 A 7.18 3.19 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 L 7.75 3.92 0.00 1.56 1.78 0.97 1.23 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 0.00 162 A 7.87 4.10 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 0.00 163 L 7.79 4.07 0.00 1.73 1.69 0.61 0.59 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 0.00 164 W 8.17 4.04 0.00 3.37 3.40 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 *166 K 8.03 4.11 0.00 1.85 1.89 0.00 1.56 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.45 1.47 7.81 167 R 7.31 4.10 0.00 1.60 1.85 0.00 3.35 0.00 0.00 3.33 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.51 0.00 168 N 8.89 3.14 0.00 1.84 1.42 0.00 0.00 6.98 7.44 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 * Residues marked with a * may have inaccurate shift predictions.