NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 I 4.0372 8.0093 114.2433 60.4348 39.6914 175.1753 4 Y 4.3673 7.5204 119.8099 54.3169 38.3187 173.5080 5 T 4.0855 9.4483 117.0200 62.0702 71.0063 177.3197 6 K 4.4915 8.1724 118.9616 57.0540 29.6422 177.5944 7 N 4.4301 8.0098 116.3058 55.3542 38.6160 175.9205 8 G 4.4324 7.8914 105.6143 45.0069 0.0000 175.0734 9 D 4.3459 7.8484 120.2951 57.1653 40.9508 178.0407 10 K 4.4211 8.0821 116.0517 56.1973 32.2978 177.0184 11 G 3.9107 8.7019 107.5417 45.7708 0.0000 173.1281 12 Q 4.9874 7.2414 117.5779 54.2323 32.8442 173.8216 13 T 4.4803 8.1809 112.4665 61.8088 71.3400 172.4581 14 R 4.7070 8.5883 124.4251 55.4679 31.8200 176.2424 15 I 4.4976 7.6387 114.1540 59.3526 39.8894 174.4915 16 I 3.7195 7.6197 123.0065 63.9755 36.6675 175.4540 17 G 3.9059 9.9410 116.9669 45.3412 0.0000 172.8871 *18 K 3.5560 7.7844 123.9977 54.2701 27.9238 176.9594 *20 I 4.1856 7.7600 122.1371 60.7447 38.4085 174.6799 21 L 4.9548 8.7341 126.4472 52.7499 46.1351 175.7012 22 Y 4.6113 8.5617 117.7143 57.5873 38.7562 177.3909 23 K 4.0524 8.7373 122.3179 59.1320 32.2900 177.9675 24 N 4.6194 8.1791 114.0036 52.9696 38.2037 175.2196 25 D 4.4114 8.0643 119.2877 54.6252 42.8450 175.0806 26 P 4.2739 0.0000 0.0000 65.9904 31.3402 178.8142 27 R 3.8748 8.4787 117.1602 59.4069 30.1362 178.3372 28 V 3.6851 7.9983 117.3076 66.3553 31.3792 177.7465 29 A 4.0173 8.2199 119.8072 55.0486 18.3513 179.4306 30 A 3.9384 8.2872 119.4944 55.5519 18.6079 179.2625 31 Y 4.1653 8.6110 118.6377 60.8467 38.7833 178.5024 32 G 3.4872 8.7319 107.1230 47.5243 0.0000 175.3501 33 E 3.9014 8.6973 122.0787 59.0227 29.5692 179.1286 34 V 3.5696 7.6341 118.0314 66.0417 31.6118 177.4447 35 D 4.2615 7.7080 117.5400 57.2992 41.0553 177.8168 36 E 3.9618 8.4437 120.1168 59.0496 29.5350 178.6170 37 L 4.0034 8.0883 120.3438 58.1527 42.2130 178.0905 38 N 4.3514 8.5175 117.4558 57.2727 38.8392 176.6266 39 S 4.1972 8.1453 116.1690 61.6707 62.8411 176.7253 40 W 4.2338 8.2777 130.6750 60.1902 30.4148 178.3674 41 V 3.6509 8.3512 118.7652 65.7800 31.0696 178.0679 42 G 3.6764 8.2685 105.5722 48.1554 0.0000 174.8501 43 Y 3.8760 7.6139 120.9020 60.5357 39.0632 178.0661 44 T 3.5339 7.9318 117.2301 66.2985 68.3715 176.6380 45 K 3.9841 8.6148 122.1228 59.2200 31.9819 178.7417 46 S 4.1293 7.5643 113.1603 60.2469 63.0546 175.4364 47 L 4.1074 7.1190 120.6559 54.3569 42.0756 177.0376 48 I 3.7366 6.8377 121.1740 61.4189 37.7974 174.8969 49 N 5.2120 8.4124 121.7337 50.7158 40.0139 174.9620 50 S 4.1672 8.6077 111.4448 61.8824 63.1697 175.3174 51 H 4.2232 8.2943 117.7852 57.9625 28.6768 176.1731 52 T 4.4844 7.8480 107.6897 61.1084 69.1416 175.5392 53 Q 3.9583 8.1075 125.5739 59.6376 29.1141 178.6876 54 V 3.6836 7.8962 109.8825 63.8784 31.7370 176.7121 55 L 4.5540 7.9937 118.6224 55.6428 42.6572 178.6330 56 S 4.1718 8.4626 114.2673 61.5311 62.2839 175.5818 57 N 4.3946 8.2415 119.3246 56.7333 38.7452 176.4874 58 E 4.4816 8.3727 118.5317 59.4405 29.8221 178.9506 59 L 4.2074 8.0250 120.3519 57.5516 41.6636 179.1351 60 E 4.0164 8.2972 118.6306 59.3362 29.3581 178.8358 61 E 3.8454 8.3389 119.1910 59.4946 29.6693 178.6423 62 I 3.9174 8.1659 119.8992 64.8517 37.2519 178.1412 63 Q 4.1302 8.3755 118.5021 59.2373 28.6050 179.1644 64 Q 4.0343 8.0314 118.7504 59.0953 28.7224 178.9954 65 L 4.0384 8.2885 120.1931 57.8761 41.6415 179.5884 66 L 4.0426 8.8308 119.2548 57.6468 41.4346 179.3901 67 F 4.0203 8.3339 120.6845 61.3036 39.3440 176.9048 68 D 4.3793 8.0879 117.9816 57.5955 40.6779 178.2674 69 C 3.7363 7.9364 117.4867 62.7883 28.2598 176.3930 70 G 3.6656 8.3206 107.2589 48.2118 0.0000 174.6478 71 H 3.9769 7.9311 120.0714 59.3102 29.9784 176.6895 72 D 4.7574 8.4210 120.0854 57.2519 40.3682 178.7411 73 L 4.1478 7.7788 118.8290 57.1776 41.9991 178.3029 74 A 4.2608 7.9097 118.4436 51.7988 18.2610 176.4691 75 T 4.5891 6.9774 115.2525 60.8825 68.2946 173.2083 76 P 4.4243 0.0000 0.0000 62.1792 32.0466 177.5860 77 A 3.8478 8.5957 126.1917 55.2734 19.1455 178.6420 *78 D 4.7202 7.0961 113.3208 52.1775 40.5656 179.9833 *82 H 4.5895 8.0321 120.5509 55.0767 31.2187 175.1573 *83 S 4.4438 7.9306 114.4439 58.0160 61.7294 173.5513 84 F 4.9132 8.3255 125.5171 57.7492 38.9520 176.3122 85 K 4.2854 9.3881 127.7524 55.4708 32.2333 173.1047 86 F 4.6505 9.0506 122.6688 57.6836 40.1906 175.5570 *87 K 4.6717 7.4822 128.8013 52.2990 34.8577 173.7006 88 Q 3.9424 8.6153 124.7658 58.1858 28.8578 178.3306 89 E 3.9635 8.2814 122.5206 62.3002 29.5630 184.1427 90 Q 4.1458 7.7930 119.9850 59.5923 28.5406 178.6545 91 P 4.4350 0.0000 0.0000 66.0290 31.3096 178.8327 92 T 4.2485 8.6613 116.9308 67.2483 68.3193 177.6610 *93 V 3.6315 7.8213 121.5737 66.1241 31.3463 179.8732 94 W 4.5579 8.3998 129.1289 60.4035 30.3789 178.0870 95 L 3.7136 8.1199 118.6073 57.6871 41.0968 179.2624 96 E 3.9171 8.5323 118.9947 59.4086 29.3857 179.2434 97 E 3.8866 8.3794 118.9229 59.3359 29.4213 179.6103 98 K 3.3692 7.3174 117.1008 58.9251 32.0084 179.3877 99 I 3.6050 7.7249 120.4147 64.4760 37.0052 178.0952 100 D 4.2591 7.9353 119.4543 57.4026 40.7414 178.3486 101 N 4.1958 7.9520 116.6790 56.7508 38.6750 177.0516 102 Y 4.0568 7.8537 118.2057 61.4766 37.6810 178.9972 103 T 4.0417 7.8563 115.8295 66.5395 68.6267 176.4211 104 Q 4.1252 7.8512 118.5317 58.7710 28.9447 178.1183 105 V 3.6323 7.4137 118.9605 64.1199 31.7449 176.4803 106 V 3.8474 6.2890 109.6799 59.0374 32.7798 174.0396 107 P 4.3385 0.0000 0.0000 62.2176 31.7489 176.6631 108 A 4.1554 8.5054 125.6795 52.2909 18.9547 177.2709 109 V 4.5613 8.4394 117.3955 61.2829 36.3550 175.5381 110 K 4.2017 8.8440 123.7422 54.0558 27.9823 180.4191 111 K 4.7393 8.5161 122.8227 53.5834 34.3149 175.6932 *112 F 4.3716 8.4319 114.3122 59.3611 39.4656 175.0805 113 I 4.6475 8.4824 124.4150 60.7910 37.9242 175.4369 114 L 4.7243 9.2498 128.3565 52.6779 43.3253 174.7852 115 P 3.7878 0.0000 0.0000 61.2032 32.0178 176.4061 116 G 4.3358 9.1461 109.3583 43.4952 0.0000 171.3579 117 G 4.0231 7.9113 109.5938 44.2379 0.0000 176.6644 118 T 4.0824 9.5697 118.8821 61.0036 70.6178 174.5375 119 Q 3.9773 8.6146 121.9999 59.5841 28.8712 178.5500 120 L 3.9615 7.8366 120.4173 57.7806 42.2460 178.4555 121 A 3.9553 8.0344 120.8349 55.2413 17.9554 179.5861 122 S 4.1398 8.1968 113.3702 61.9999 63.0071 176.9939 123 A 4.5416 8.0778 122.9469 55.3425 18.0082 179.7041 124 L 4.1696 8.1252 117.6338 58.1400 41.5374 179.3726 125 H 4.2193 8.4593 116.4469 58.6438 28.5747 178.0484 126 V 3.4613 8.3843 121.3894 65.1308 31.2443 177.6489 127 A 3.7898 8.4684 121.0185 55.2407 17.9051 179.2516 128 R 4.0696 8.0226 117.5033 60.1643 29.6042 178.7085 129 T 3.9829 7.5520 109.1404 64.7996 69.0121 176.9038 130 I 3.6723 8.0757 123.0286 64.1251 36.9199 178.4843 131 T 3.9366 8.2883 117.2438 66.7241 68.2311 176.7575 132 K 4.0252 7.8786 120.1287 59.1266 31.9336 179.5249 133 R 3.8410 8.2916 119.2287 59.3185 29.9509 178.4280 134 A 3.9937 8.2217 120.7352 54.9632 18.2809 179.2810 135 E 3.8597 8.3775 118.1562 59.5024 29.7804 179.0246 136 R 3.9090 8.1934 118.3787 59.6120 30.2815 178.7865 137 Q 4.0514 7.9186 119.0446 58.8108 28.9555 177.9845 138 I 3.7233 8.0027 121.3327 64.3089 37.1527 178.4737 139 V 3.5714 7.9788 119.0826 66.0461 31.1545 177.6643 140 Q 3.9824 7.9287 118.1464 59.1888 29.0014 178.0906 141 L 4.0901 7.9111 120.9155 58.3461 41.7376 178.1939 142 M 4.0764 8.3188 118.5724 59.0986 31.8664 177.7918 143 R 4.1123 7.9252 114.6459 57.3003 30.4295 176.7829 144 E 4.5866 8.5546 119.9960 56.9987 32.0651 176.2939 145 E 4.7987 7.6047 112.2303 53.8181 33.9534 178.4475 146 Q 4.3772 8.6313 117.0184 56.1048 29.4639 175.7481 147 I 4.3300 8.0290 116.2568 58.8156 40.1713 175.5379 148 N 3.8025 7.7244 117.9935 52.5722 37.6971 174.8370 149 Q 4.0363 8.4103 127.7812 58.5358 28.8720 178.3225 150 D 4.5007 8.1398 119.9847 57.1010 40.7774 178.7165 151 V 3.6173 8.0810 119.0142 66.0520 31.5107 177.8620 152 L 4.1137 7.9557 119.4847 58.0869 41.8350 178.9444 153 I 3.7490 7.5757 118.7156 64.3063 37.0884 178.1061 154 F 4.3611 8.4559 121.4696 61.6522 39.1006 177.3069 155 I 3.6839 8.1993 118.4298 63.9010 36.8107 177.8465 156 N 4.4333 8.3769 118.3611 56.7758 38.9103 177.0653 157 R 3.7236 8.3497 120.4143 59.0803 30.1043 178.0755 158 L 3.7065 8.0597 121.1575 58.0851 42.1244 179.1755 159 S 4.5164 7.7833 113.6754 61.3573 62.8897 176.2773 160 D 4.3830 8.0969 122.4321 57.2721 40.6726 177.4472 161 Y 4.0238 7.9231 120.1321 61.0697 38.6918 178.6020 162 F 4.2850 8.0383 118.2384 60.1973 38.9562 177.4231 163 F 3.9279 8.3444 119.9471 61.2016 39.2848 176.7842 164 A 4.0760 8.5040 120.1806 55.5026 18.1786 179.5824 165 A 3.8572 8.3559 119.1093 54.7372 18.4300 179.4875 166 A 3.8442 8.2616 119.8973 55.7232 18.3983 180.1743 167 R 4.0936 7.6203 117.5566 58.9285 29.9563 178.7514 168 Y 4.1693 8.0481 119.2887 60.5359 37.6414 177.8734 169 A 3.7728 8.1867 121.9977 54.9425 18.4227 179.3829 170 N 4.1900 7.9708 114.5321 56.6303 38.5589 176.6430 171 Y 4.0998 7.8607 120.8831 61.0175 38.6135 178.3422 172 L 3.8523 7.8058 117.7357 56.4349 41.5589 177.5311 173 E 4.4489 6.6334 114.0723 55.4662 30.6752 175.4279 174 Q 3.3598 7.5498 115.5660 57.0141 26.8098 173.2055 175 Q 4.5557 7.8416 118.1750 53.4634 30.7770 173.4279 176 P 4.4928 0.0000 0.0000 62.1467 31.8939 176.1048 177 D 4.4435 8.5470 123.6411 55.0386 41.6109 176.0997 178 M 4.6021 8.4910 122.2090 55.1435 32.2465 176.2149 179 L 5.0219 8.4589 124.0610 52.2723 44.5886 175.4680 180 Y 4.3901 9.0021 125.9431 57.5849 39.4825 176.3963 181 R 4.0500 7.9108 123.9881 56.1686 29.8743 172.4220 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 I 8.01 4.04 1.92 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 1.55 1.26 0.93 0.00 0.00 4 Y 7.52 4.37 0.00 3.15 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 9.45 4.09 4.25 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 1.21 0.00 0.00 6 K 8.17 4.49 0.00 2.00 2.36 0.00 2.03 0.00 0.00 1.84 0.00 0.00 3.00 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.47 1.55 7.81 7 N 8.01 4.43 0.00 2.74 2.88 0.00 0.00 6.80 7.76 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 8 G 7.89 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 0.00 0.00 0.00 0.00 9 D 7.85 4.35 0.00 2.95 2.76 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 10 K 8.08 4.42 0.00 1.99 1.83 0.00 1.90 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 0.99 7.81 11 G 8.70 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 12 Q 7.24 4.99 0.00 1.80 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.74 0.00 0.00 0.00 0.00 0.00 1.57 1.74 0.00 13 T 8.18 4.48 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 1.22 0.00 0.00 14 R 8.59 4.71 0.00 1.69 1.79 0.00 3.18 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 15 I 7.64 4.50 1.98 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 1.36 0.58 0.83 0.00 0.00 16 I 7.62 3.72 1.75 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.56 0.83 0.00 0.00 17 G 9.94 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 *18 K 7.78 3.56 0.00 1.95 1.73 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.26 1.01 7.81 *20 I 7.76 4.19 1.81 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 1.46 1.18 0.78 0.00 0.00 21 L 8.73 4.95 0.00 1.54 1.56 1.04 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 8.56 4.61 0.00 2.92 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 23 K 8.74 4.05 0.00 1.84 1.93 0.00 1.73 0.00 0.00 1.79 0.00 0.00 3.06 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.52 1.41 7.81 24 N 8.18 4.62 0.00 2.85 2.97 0.00 0.00 5.94 8.06 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 25 D 8.06 4.41 0.00 3.01 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 26 P 0.00 4.27 0.00 2.22 2.13 0.00 3.68 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.18 0.00 27 R 8.48 3.87 0.00 1.92 2.06 0.00 3.11 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 28 V 8.00 3.69 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.02 0.00 0.00 29 A 8.22 4.02 1.40 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 0.00 0.00 30 A 8.29 3.94 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 Y 8.61 4.17 0.00 3.01 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.73 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.70 3.90 0.00 2.27 1.95 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 2.44 2.35 0.00 34 V 7.63 3.57 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 1.01 0.00 0.00 0.97 0.00 0.00 35 D 7.71 4.26 0.00 2.53 2.62 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 36 E 8.44 3.96 0.00 2.16 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 2.33 2.34 0.00 37 L 8.09 4.00 0.00 1.86 1.89 1.03 0.51 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 38 N 8.52 4.35 0.00 3.04 2.91 0.00 0.00 7.28 7.18 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 39 S 8.15 4.20 0.00 4.17 4.01 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 0.00 0.00 0.00 40 W 8.28 4.23 0.00 3.53 3.24 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 41 V 8.35 3.65 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.26 0.00 0.00 42 G 8.27 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 43 Y 7.61 3.88 0.00 2.75 2.44 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 44 T 7.93 3.53 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 45 K 8.61 3.98 0.00 1.93 1.85 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.49 7.81 46 S 7.56 4.13 0.00 3.95 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.12 4.11 0.00 1.56 1.59 0.60 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 48 I 6.84 3.74 1.96 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 1.34 0.42 0.94 0.00 0.00 49 N 8.41 5.21 0.00 2.91 2.90 0.00 0.00 6.53 7.86 0.00 0.00 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0.50 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 0.00 128 R 8.02 4.07 0.00 2.16 2.24 0.00 3.35 0.00 0.00 3.56 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.14 0.00 129 T 7.55 3.98 4.18 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 1.26 0.00 0.00 130 I 8.08 3.67 1.73 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.38 0.87 0.00 0.00 131 T 8.29 3.94 4.57 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 1.35 0.00 0.00 132 K 7.88 4.03 0.00 1.92 1.86 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.57 7.81 133 R 8.29 3.84 0.00 1.84 2.09 0.00 3.07 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 134 A 8.22 3.99 1.40 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 0.00 0.00 135 E 8.38 3.86 0.00 2.23 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 2.32 2.36 0.00 136 R 8.19 3.91 0.00 2.07 1.98 0.00 3.17 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 137 Q 7.92 4.05 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 138 I 8.00 3.72 2.00 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 1.42 0.77 0.92 0.00 0.00 139 V 7.98 3.57 2.24 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 1.00 0.00 0.00 1.01 0.00 0.00 140 Q 7.93 3.98 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 141 L 7.91 4.09 0.00 1.87 1.86 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 142 M 8.32 4.08 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.63 0.00 143 R 7.93 4.11 0.00 2.00 1.97 0.00 3.16 0.00 0.00 3.23 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.91 0.00 144 E 8.55 4.59 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.21 0.00 145 E 7.60 4.80 0.00 1.75 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.10 0.00 146 Q 8.63 4.38 0.00 2.25 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 147 I 8.03 4.33 1.85 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 1.30 0.63 0.95 0.00 0.00 148 N 7.72 3.80 0.00 1.44 2.19 0.00 0.00 6.89 7.30 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 0.00 149 Q 8.41 4.04 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 150 D 8.14 4.50 0.00 3.04 2.79 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 0.00 151 V 8.08 3.62 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.82 0.00 0.00 152 L 7.96 4.11 0.00 1.81 1.83 0.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 153 I 7.58 3.75 2.14 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 1.45 0.56 1.00 0.00 0.00 154 F 8.46 4.36 0.00 3.46 3.41 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 0.00 155 I 8.20 3.68 1.97 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 1.67 0.95 0.93 0.00 0.00 156 N 8.38 4.43 0.00 3.03 3.03 0.00 0.00 6.72 7.21 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 0.00 157 R 8.35 3.72 0.00 2.07 1.89 0.00 3.24 0.00 0.00 3.10 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 158 L 8.06 3.71 0.00 1.36 1.66 0.44 0.68 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 0.00 159 S 7.78 4.52 0.00 4.33 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 0.00 160 D 8.10 4.38 0.00 2.97 2.76 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 0.00 161 Y 7.92 4.02 0.00 2.91 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 0.00 162 F 8.04 4.28 0.00 3.38 3.25 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 0.00 163 F 8.34 3.93 0.00 3.28 3.23 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 0.00 164 A 8.50 4.08 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 0.00 165 A 8.36 3.86 0.92 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 0.00 166 A 8.26 3.84 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 R 7.62 4.09 0.00 1.95 1.93 0.00 2.85 0.00 0.00 3.17 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.07 0.00 168 Y 8.05 4.17 0.00 2.62 2.69 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 0.00 169 A 8.19 3.77 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 0.00 170 N 7.97 4.19 0.00 2.99 3.13 0.00 0.00 6.61 6.92 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 0.00 171 Y 7.86 4.10 0.00 3.08 3.18 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 0.00 172 L 7.81 3.85 0.00 1.54 1.49 0.68 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 173 E 6.63 4.45 0.00 1.76 1.72 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 2.00 2.09 0.00 174 Q 7.55 3.36 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.60 0.00 0.00 0.00 0.00 0.00 2.21 2.18 0.00 175 Q 7.84 4.56 0.00 1.91 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.61 6.88 0.00 0.00 0.00 0.00 0.00 2.40 2.31 0.00 176 P 0.00 4.49 0.00 2.08 1.97 0.00 3.72 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 177 D 8.55 4.44 0.00 2.71 2.57 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 0.00 178 M 8.49 4.60 0.00 1.71 1.96 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.14 0.00 179 L 8.46 5.02 0.00 1.54 1.66 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 180 Y 9.00 4.39 0.00 2.95 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 0.00 181 R 7.91 4.05 0.00 1.86 1.66 0.00 3.35 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.16 0.00 * Residues marked with a * may have inaccurate shift predictions.