NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 38 V 4.0411 8.0549 120.3958 62.6997 32.5323 174.3585 39 Q 4.4080 8.6427 126.3597 53.8150 30.4578 174.2168 40 S 4.6394 8.6380 119.4308 57.8174 65.3746 173.3329 41 S 4.4888 8.2101 115.2502 57.2569 64.9244 173.1979 42 V 4.3785 8.4399 127.3976 60.9917 33.0595 174.3962 43 S 4.9071 8.6065 121.0362 56.1787 64.8898 172.6723 44 W 5.1020 8.4155 134.8398 54.9339 33.6487 172.8619 45 P 3.1402 0.0000 0.0000 61.8528 31.8379 175.4947 46 Q 4.5369 7.5299 117.7389 55.4658 31.2437 175.9471 47 N 4.3685 9.6726 117.8640 54.4341 36.2327 174.6211 48 G 3.8270 8.3083 101.5623 46.3885 0.0000 173.9443 49 S 4.5944 7.6721 112.7828 56.2115 65.0321 173.9060 50 L 4.8513 8.4028 126.0447 54.6939 41.5613 176.5459 51 N 4.5865 7.7783 116.5729 53.0784 38.9504 175.3977 52 S 4.2711 8.8203 118.4774 59.0427 63.4979 174.2582 53 V 4.5516 8.0848 122.8682 59.8131 33.8331 175.1679 54 S 4.4590 8.6002 118.3966 57.9409 64.2446 174.5741 55 A 4.8017 8.1511 126.5050 50.1578 18.6530 173.9456 56 P 4.4400 0.0000 0.0000 61.7586 32.7658 176.9659 57 L 4.2608 8.0969 121.8567 54.5216 43.0671 175.8503 *59 S 4.3305 8.1342 115.9132 58.7009 64.2335 172.1524 60 Y 4.8372 7.5667 117.6002 56.7677 41.7899 173.1185 61 T 5.1123 8.5003 117.2108 61.4207 69.6934 173.5124 62 P 4.6709 0.0000 0.0000 62.0074 32.6304 176.2198 63 I 4.0403 7.7662 119.8008 64.2301 36.9558 176.5946 64 S 5.0038 8.2853 114.7872 56.7197 67.0498 171.9479 65 F 5.3908 9.1515 123.5411 56.4960 42.3151 173.4706 66 D 5.2633 8.6432 124.3299 51.8147 43.1504 174.1141 67 A 4.9776 8.7222 120.5935 50.5890 23.4414 175.2270 68 K 4.9041 9.2116 119.6317 54.6773 35.7826 175.5258 69 I 4.7035 8.7122 125.9711 58.5621 40.4495 173.6303 70 P 4.5108 0.0000 0.0000 62.7890 32.0454 178.1060 71 V 3.6932 8.4817 121.4573 65.3913 31.3904 178.0026 72 A 4.1102 8.1502 120.0733 54.9599 18.1996 179.3034 73 S 4.1390 8.0956 113.9069 61.5992 62.5860 176.8119 74 V 3.7289 7.6063 119.7817 65.1473 31.1615 176.1971 75 D 4.9194 7.5775 116.1706 53.9605 40.9996 176.4700 76 K 4.6618 7.9632 117.5697 56.0711 33.2802 175.7538 77 L 4.8306 7.8548 118.0181 53.8041 42.8588 177.0227 78 R 4.1839 8.8327 121.4190 55.9621 31.5898 176.2592 79 K 3.9131 8.5775 119.9858 57.7762 32.4917 176.7124 80 D 4.4511 8.8331 122.2290 55.1838 38.5183 173.2538 81 Q 4.7745 7.7246 117.1090 54.2250 31.1486 175.1711 82 D 5.0982 8.2534 117.8499 52.1670 42.2874 174.9593 83 L 4.4520 7.9341 121.6407 55.5544 41.9492 177.2582 84 I 3.9065 8.8834 128.7767 63.9289 37.4640 176.8892 85 L 4.8408 7.7739 122.6042 53.9124 45.5111 174.3256 86 G 4.3084 9.4827 112.8408 44.9496 0.0000 172.8417 87 T 5.2212 7.8734 110.6768 60.6777 69.7688 174.6648 88 L 4.8071 7.6243 121.3181 52.0337 45.3020 174.5033 89 P 3.6038 0.0000 0.0000 62.1908 31.7191 176.6686 90 A 4.0461 8.2038 122.6868 54.7340 18.6179 178.9822 91 N 4.7146 8.0105 111.0496 53.3482 37.9069 174.8438 92 S 4.6405 7.3957 113.5658 56.3709 64.8144 173.3050 93 E 4.0147 8.7580 123.2807 58.4160 29.9884 176.2595 94 D 4.3415 8.9108 123.8756 54.4575 39.1208 175.8014 95 A 4.1607 7.9463 121.2744 55.6839 18.6693 180.0155 96 G 3.4407 8.0091 102.5346 46.9263 0.0000 174.6901 97 A 4.5080 7.5685 120.5770 52.8424 19.1961 177.7101 98 R 4.0471 7.6808 114.6057 57.2920 33.1541 176.2132 99 G 3.7927 8.3005 106.4767 43.9567 0.0000 171.1776 100 L 4.9662 7.2902 120.2193 53.0742 45.2535 176.4604 101 F 5.3741 8.8670 123.1833 55.8268 43.6559 173.6143 102 V 4.6416 9.9531 124.0940 61.3934 33.4610 174.4842 103 R 5.3290 9.1889 126.8941 54.3014 33.8657 174.4892 104 A 5.3659 9.0559 124.4814 49.9144 21.9233 173.8268 105 N 4.8480 9.0285 122.2819 52.5837 39.3015 176.5292 106 D 4.6379 8.7342 114.9804 55.6734 41.4942 176.8277 107 D 4.5390 8.5030 118.8784 54.6060 42.3050 175.4771 108 G 4.2167 7.4495 103.4544 43.9250 0.0000 172.8255 109 L 5.1990 9.3731 125.4107 53.3296 44.5309 175.7594 110 Q 5.1793 9.3697 125.1835 54.1569 32.5611 174.4149 111 I 5.0869 9.0304 124.3128 59.7562 40.8627 174.4561 112 T 5.1103 8.7796 120.4413 60.3766 71.1036 172.4151 113 S 4.8471 9.2672 122.3488 57.3658 65.8976 173.3838 114 H 4.2596 9.7516 127.7506 57.2456 28.5608 175.3877 115 G 4.0738 8.2845 106.3871 44.8100 0.0000 173.1981 116 E 4.2493 7.9359 121.6175 54.5827 30.4048 175.0171 117 L 4.4429 8.5301 128.3826 55.5169 42.3122 176.1028 118 V 4.2138 8.6107 126.7310 64.0067 33.1136 175.6725 119 L 4.4788 7.5434 119.8257 54.0962 45.5219 173.5803 120 D 5.0754 8.7130 125.3241 53.2518 43.6807 173.7713 121 L 5.0419 8.9843 127.6974 52.6552 44.1305 177.3222 122 S 4.8458 9.7157 118.6053 56.9341 63.9984 175.2093 123 K 3.8987 8.5356 121.3163 59.3899 31.5200 178.9040 124 R 3.8512 7.8338 118.0221 59.3523 30.5373 177.7100 125 E 4.1143 8.1207 118.3424 59.5510 29.4453 179.1842 126 L 3.9639 8.1947 118.8998 57.9359 41.5571 179.4862 127 A 4.1397 7.6998 119.2723 54.2335 18.4939 177.9375 128 Q 4.3870 7.7945 113.1589 55.8655 29.2873 175.9155 129 L 4.4489 7.3471 118.4174 52.8789 42.9215 175.1170 130 P 4.3783 0.0000 0.0000 62.2732 31.9842 177.4494 131 A 3.9887 8.7048 124.4063 54.8259 18.3271 178.1970 132 D 4.8698 7.7985 113.1861 52.8561 40.2015 176.3579 133 A 4.2745 7.9159 121.5776 53.6606 19.8501 177.5291 134 T 4.9772 8.2250 114.7122 61.8022 72.9837 173.1855 135 I 4.6082 8.9222 127.1993 60.6686 38.8963 174.5324 136 A 5.1360 9.0013 129.4762 50.2586 21.6295 175.3911 137 I 4.9991 8.7432 122.6096 59.4648 41.0960 174.4815 138 S 5.0716 9.1225 121.4415 56.5222 65.2304 172.3668 139 A 5.0570 9.4689 130.4649 50.0427 20.6372 175.4561 140 T 4.8034 8.6815 116.4617 60.1389 71.2012 174.5276 141 E 4.1434 8.9049 124.2141 59.2613 29.9174 177.7040 142 D 4.4891 8.2177 117.9796 56.8316 41.3830 175.7152 143 E 5.1215 7.1395 113.8546 56.2182 33.3399 175.7274 144 T 5.1886 8.3230 117.5793 62.2669 71.3562 173.3160 145 T 4.9159 8.6963 117.0236 60.1650 71.7763 173.4140 146 A 5.1346 8.4603 123.4769 50.4163 23.4251 175.5041 147 G 4.2587 7.8841 106.6821 46.1053 0.0000 171.8038 148 I 4.4975 7.9257 121.5533 60.4328 38.0944 176.1462 149 E 3.9286 9.5084 129.7744 57.4865 29.8830 176.5861 150 G 3.8880 9.0211 113.4773 46.4657 0.0000 173.5699 151 D 4.6081 7.7588 120.1221 51.8593 42.0802 175.3129 152 D 4.5627 8.6995 125.4195 56.0268 41.2747 178.9769 153 S 4.3346 8.0448 112.7146 60.3042 63.3883 174.9399 154 T 4.2529 7.5851 110.1857 62.6499 69.7685 175.3512 155 T 4.1275 7.5178 119.6740 63.9566 69.0078 172.6075 156 E 5.0583 9.1661 126.5615 54.6642 32.8652 175.3206 157 T 5.0250 8.2539 112.5280 60.1043 71.9428 173.1226 158 V 4.0281 8.7182 126.7264 61.3980 32.9768 175.8842 159 E 4.5208 8.6679 128.5362 56.7865 30.0873 176.0046 160 R 4.6015 7.5845 115.5464 53.8078 34.0137 175.0191 161 D 4.4873 8.6449 118.8902 55.3031 40.3627 176.4679 162 V 4.4591 7.8635 122.9877 60.6292 32.6804 176.8055 163 R 4.0777 8.0183 118.9084 55.4803 30.5403 175.5059 164 P 4.5648 0.0000 0.0000 62.4486 32.3405 175.9351 165 I 4.1225 8.3752 121.5832 61.5007 38.3898 175.3466 166 I 4.2910 8.5565 126.7889 59.4445 41.5720 174.5516 *168 G 4.0251 8.0636 107.7245 46.2809 0.0000 170.8538 169 I 4.9352 7.7067 120.6114 59.7499 39.8874 174.8175 170 Y 4.8941 8.9278 124.8983 56.7228 41.3714 174.7690 171 T 4.8190 8.4145 114.5934 60.9355 70.6987 172.6623 172 E 4.8214 9.0546 125.5791 56.0197 31.3524 175.9427 173 L 4.4054 7.6628 120.2385 54.3278 42.4011 177.0030 174 E 3.9561 9.2184 123.1368 56.8706 29.5121 178.5784 175 S 4.3201 9.1855 119.0551 61.6165 63.5570 176.9656 176 N 3.9185 7.8933 118.6733 56.1472 39.6139 175.4487 177 A 4.2978 8.5817 118.0495 52.6054 18.3367 178.9068 178 A 3.8807 7.7454 120.4604 55.2031 18.4453 179.5735 179 A 3.9019 8.0578 118.3330 55.7576 18.1012 179.3077 180 D 4.3092 8.0717 116.1224 57.6969 40.9257 179.1501 181 L 4.0389 8.0982 119.3546 57.6221 41.6329 179.6106 182 L 3.9688 8.4793 119.3854 57.9285 41.4149 179.2044 183 N 4.2576 8.3150 115.0715 55.7853 38.5734 175.6103 184 A 4.3570 7.5532 118.6144 52.0074 19.3382 177.4037 185 G 3.8866 7.9715 104.1118 45.0492 0.0000 173.7504 186 L 4.3227 7.7325 122.1149 55.1801 42.5798 175.7168 187 N 4.9081 9.0837 122.6168 52.7184 42.9244 172.8332 188 A 5.0054 8.4301 125.3177 50.5156 22.8009 174.9351 189 H 4.8805 9.1344 121.1083 54.4307 33.4433 172.2271 190 V 4.8437 8.4411 125.1568 59.9549 33.7412 174.6936 191 E 4.2032 8.8415 125.0225 55.5101 30.2483 176.1885 192 I 3.9779 8.5659 126.3929 62.7350 37.3997 177.3273 193 N 4.7926 7.8707 117.7589 53.2464 40.7559 175.1342 194 S 4.2834 7.9849 118.5750 58.7363 62.9108 173.8810 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 38 V 8.05 4.04 2.10 0.00 0.00 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 0.95 0.00 0.00 39 Q 8.64 4.41 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 40 S 8.64 4.64 0.00 3.88 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 41 S 8.21 4.49 0.00 3.79 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 42 V 8.44 4.38 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 0.92 0.00 0.00 0.96 0.00 0.00 43 S 8.61 4.91 0.00 3.86 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 44 W 8.42 5.10 0.00 3.23 3.01 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 45 P 0.00 3.14 0.00 1.56 1.22 0.00 3.30 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.55 0.00 46 Q 7.53 4.54 0.00 1.84 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.25 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 47 N 9.67 4.37 0.00 2.81 2.85 0.00 0.00 7.02 7.65 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 48 G 8.31 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 7.67 4.59 0.00 3.81 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 50 L 8.40 4.85 0.00 1.72 1.81 0.95 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 51 N 7.78 4.59 0.00 2.81 2.84 0.00 0.00 6.87 7.98 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 52 S 8.82 4.27 0.00 3.88 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.08 4.55 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 0.92 0.00 0.00 1.01 0.00 0.00 54 S 8.60 4.46 0.00 3.90 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 55 A 8.15 4.80 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 56 P 0.00 4.44 0.00 2.23 2.09 0.00 3.79 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 57 L 8.10 4.26 0.00 1.66 1.67 1.06 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 *59 S 8.13 4.33 0.00 3.79 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 60 Y 7.57 4.84 0.00 3.06 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.50 5.11 4.30 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 1.30 0.00 0.00 62 P 0.00 4.67 0.00 2.56 2.28 0.00 3.99 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 2.09 2.12 0.00 63 I 7.77 4.04 1.94 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 1.52 0.79 0.92 0.00 0.00 64 S 8.29 5.00 0.00 3.85 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 65 F 9.15 5.39 0.00 3.15 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 66 D 8.64 5.26 0.00 2.67 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 A 8.72 4.98 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 68 K 9.21 4.90 0.00 1.67 1.72 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 1.50 7.81 69 I 8.71 4.70 1.90 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.84 0.94 0.00 0.00 70 P 0.00 4.51 0.00 2.18 1.99 0.00 3.61 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 2.28 2.22 0.00 71 V 8.48 3.69 2.20 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 1.02 0.00 0.00 0.94 0.00 0.00 72 A 8.15 4.11 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 73 S 8.10 4.14 0.00 3.99 3.95 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 74 V 7.61 3.73 2.26 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 0.84 0.00 0.00 0.98 0.00 0.00 75 D 7.58 4.92 0.00 2.69 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 7.96 4.66 0.00 1.78 1.74 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.52 7.81 77 L 7.85 4.83 0.00 1.54 1.60 0.99 1.03 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 78 R 8.83 4.18 0.00 1.82 1.87 0.00 3.15 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 79 K 8.58 3.91 0.00 1.64 1.76 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.43 7.81 80 D 8.83 4.45 0.00 2.82 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 7.72 4.77 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.71 0.00 0.00 0.00 0.00 0.00 2.54 2.41 0.00 82 D 8.25 5.10 0.00 2.78 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 83 L 7.93 4.45 0.00 1.83 1.68 1.14 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 84 I 8.88 3.91 2.03 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 1.14 0.68 0.95 0.00 0.00 85 L 7.77 4.84 0.00 1.75 1.53 1.05 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 86 G 9.48 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.87 5.22 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 0.71 0.00 0.00 88 L 7.62 4.81 0.00 1.77 1.56 0.99 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 3.60 0.00 1.81 1.63 0.00 3.49 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.54 0.00 90 A 8.20 4.05 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 N 8.01 4.71 0.00 2.80 2.89 0.00 0.00 5.98 7.64 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 92 S 7.40 4.64 0.00 4.03 3.95 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 93 E 8.76 4.01 0.00 1.91 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 2.40 0.00 94 D 8.91 4.34 0.00 2.82 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 95 A 7.95 4.16 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 G 8.01 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 0.00 0.00 0.00 97 A 7.57 4.51 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 98 R 7.68 4.05 0.00 1.93 1.83 0.00 3.10 0.00 0.00 3.55 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 99 G 8.30 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 L 7.29 4.97 0.00 1.23 0.82 0.70 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 101 F 8.87 5.37 0.00 2.97 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 9.95 4.64 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 1.11 0.00 0.00 1.00 0.00 0.00 103 R 9.19 5.33 0.00 1.77 1.77 0.00 3.09 0.00 0.00 3.45 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 104 A 9.06 5.37 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 N 9.03 4.85 0.00 2.90 2.72 0.00 0.00 6.67 7.62 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 0.00 106 D 8.73 4.64 0.00 2.69 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 0.00 107 D 8.50 4.54 0.00 3.03 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 0.00 108 G 7.45 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 0.00 0.00 0.00 0.00 109 L 9.37 5.20 0.00 1.64 1.53 0.95 0.88 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 0.00 110 Q 9.37 5.18 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.53 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 111 I 9.03 5.09 1.90 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 1.16 0.79 0.99 0.00 0.00 112 T 8.78 5.11 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 113 S 9.27 4.85 0.00 3.77 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 0.00 114 H 9.75 4.26 0.00 3.48 3.24 0.00 5.85 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 0.00 115 G 8.28 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 E 7.94 4.25 0.00 2.18 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 2.28 2.29 0.00 117 L 8.53 4.44 0.00 1.64 1.60 1.03 0.95 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 0.00 118 V 8.61 4.21 2.10 0.00 0.00 0.00 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 1.00 0.00 0.00 119 L 7.54 4.48 0.00 1.75 1.45 0.94 1.13 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 0.00 120 D 8.71 5.08 0.00 2.66 2.52 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 0.00 121 L 8.98 5.04 0.00 1.60 1.55 0.93 0.58 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 0.00 122 S 9.72 4.85 0.00 3.96 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 K 8.54 3.90 0.00 1.89 1.85 0.00 1.61 0.00 0.00 1.83 0.00 0.00 3.17 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.56 7.81 124 R 7.83 3.85 0.00 1.85 1.94 0.00 3.31 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 125 E 8.12 4.11 0.00 2.30 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 2.37 0.00 126 L 8.19 3.96 0.00 1.83 1.74 0.96 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.70 4.14 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 7.79 4.39 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.56 2.46 0.00 129 L 7.35 4.45 0.00 1.87 1.59 0.93 1.47 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 0.00 130 P 0.00 4.38 0.00 2.18 1.97 0.00 3.61 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 131 A 8.70 3.99 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 0.00 132 D 7.80 4.87 0.00 2.78 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 A 7.92 4.27 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 0.00 134 T 8.22 4.98 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 0.00 135 I 8.92 4.61 1.90 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 1.18 0.92 0.94 0.00 0.00 136 A 9.00 5.14 1.22 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 0.00 0.00 137 I 8.74 5.00 2.03 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.84 1.06 0.00 0.00 138 S 9.12 5.07 0.00 3.87 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 0.00 139 A 9.47 5.06 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 0.00 140 T 8.68 4.80 4.27 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 0.00 0.00 0.00 1.34 0.00 0.00 141 E 8.90 4.14 0.00 1.98 1.97 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 2.30 2.49 0.00 142 D 8.22 4.49 0.00 2.72 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 0.00 143 E 7.14 5.12 0.00 2.24 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 2.07 2.16 0.00 144 T 8.32 5.19 4.26 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 1.24 0.00 0.00 145 T 8.70 4.92 4.26 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 1.22 0.00 0.00 146 A 8.46 5.13 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 0.00 147 G 7.88 4.26 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 0.00 148 I 7.93 4.50 1.88 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 1.12 1.41 0.92 0.00 0.00 149 E 9.51 3.93 0.00 1.96 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 2.32 2.26 0.00 150 G 9.02 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 D 7.76 4.61 0.00 2.57 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 0.00 152 D 8.70 4.56 0.00 2.83 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 0.00 153 S 8.04 4.33 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 T 7.59 4.25 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 1.30 0.00 0.00 155 T 7.52 4.13 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 1.27 0.00 0.00 156 E 9.17 5.06 0.00 1.97 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 2.42 2.37 0.00 157 T 8.25 5.02 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 1.22 0.00 0.00 158 V 8.72 4.03 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 0.97 0.00 0.00 0.94 0.00 0.00 159 E 8.67 4.52 0.00 2.00 1.94 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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 I 7.71 4.94 1.77 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 1.31 1.01 0.93 0.00 0.00 170 Y 8.93 4.89 0.00 2.93 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 0.00 171 T 8.41 4.82 4.29 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 1.25 0.00 0.00 172 E 9.05 4.82 0.00 1.90 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 2.25 2.50 0.00 173 L 7.66 4.41 0.00 1.63 1.62 0.95 0.91 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 0.00 174 E 9.22 3.96 0.00 1.99 1.93 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 2.35 2.36 0.00 175 S 9.19 4.32 0.00 4.01 4.14 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 0.00 176 N 7.89 3.92 0.00 2.70 2.86 0.00 0.00 6.95 7.96 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 0.00 177 A 8.58 4.30 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 0.00 178 A 7.75 3.88 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 0.00 179 A 8.06 3.90 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 0.00 180 D 8.07 4.31 0.00 2.73 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.10 4.04 0.00 1.93 1.72 0.93 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 182 L 8.48 3.97 0.00 1.70 1.70 0.95 0.72 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 0.00 183 N 8.31 4.26 0.00 2.89 2.90 0.00 0.00 6.99 8.01 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 0.00 184 A 7.55 4.36 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 0.00 185 G 7.97 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 L 7.73 4.32 0.00 1.74 1.64 1.00 0.92 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 0.00 187 N 9.08 4.91 0.00 2.72 2.53 0.00 0.00 6.45 9.28 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 0.00 188 A 8.43 5.01 1.17 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 0.00 0.00 189 H 9.13 4.88 0.00 3.14 3.06 0.00 5.55 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 V 8.44 4.84 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 0.97 0.00 0.00 1.10 0.00 0.00 191 E 8.84 4.20 0.00 1.88 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 2.08 2.37 0.00 192 I 8.57 3.98 1.69 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.82 0.30 0.00 0.00 193 N 7.87 4.79 0.00 2.59 2.77 0.00 0.00 6.92 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 0.00 194 S 7.98 4.28 0.00 3.84 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 0.00 * Residues marked with a * may have inaccurate shift predictions.