NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 38 P 4.3417 0.0000 0.0000 62.3360 32.5902 176.0034 39 T 3.8896 8.4909 117.7978 63.5963 68.8281 172.2455 40 R 4.6694 9.7713 126.9256 54.4785 33.4749 175.3991 41 V 4.8086 8.2981 122.6208 61.1210 35.1015 173.8155 42 I 5.0237 9.0163 128.4437 59.5342 40.3376 174.3517 43 L 4.9045 9.0362 127.6749 53.4575 43.5505 175.4460 44 F 5.4190 9.1515 125.5978 56.5773 42.9530 173.2964 45 N 4.6414 8.6688 125.3887 51.8175 39.2406 173.0251 46 K 2.9567 8.3329 128.6145 54.7450 33.6138 174.6947 47 P 4.9565 0.0000 0.0000 61.5914 32.8071 175.3409 48 Y 4.2388 8.6707 122.6977 59.3442 39.2003 175.5103 49 D 4.1387 8.2506 124.2704 54.6077 40.4955 173.1779 50 V 4.5269 7.0230 116.3978 60.3898 33.0583 174.9893 51 L 4.3482 8.6739 128.5431 54.0051 42.5625 176.0359 52 P 4.5830 0.0000 0.0000 61.8313 30.9158 175.3389 53 Q 4.5595 7.1592 115.4459 55.5127 32.1210 175.8340 54 F 4.3547 8.6425 116.4631 58.5087 39.8623 176.6029 55 T 4.0752 7.8859 118.1416 62.9919 68.5517 174.0918 56 D 4.5434 8.5364 126.5606 55.0721 41.8342 175.8978 57 E 4.5421 8.2957 120.0497 54.8232 32.6223 174.5088 58 A 4.2000 8.5624 129.6954 53.4046 18.9833 178.0743 59 G 4.0412 8.8467 109.0928 45.5916 0.0000 173.6252 60 R 4.7198 7.5248 117.6399 54.2409 32.8846 175.3576 61 K 5.2009 8.7530 123.0456 54.6760 34.5798 175.2203 62 T 5.0556 8.1992 115.8389 59.5735 72.4351 174.4903 63 L 3.8346 8.4344 120.3690 57.2945 41.4770 179.7864 64 K 4.0087 7.5403 118.8132 58.9518 32.4044 177.0015 65 E 4.3192 8.2304 116.7430 56.5249 29.8858 177.2883 66 F 4.4222 7.9678 116.2356 58.0470 41.3792 175.0538 67 I 3.6139 7.8420 122.2736 58.6956 38.5371 174.6634 68 P 4.5522 0.0000 0.0000 61.9295 30.6100 176.5968 69 V 4.1358 7.1196 118.7632 62.2987 34.4561 175.0233 *70 Q 4.4464 8.3588 125.0803 54.7206 29.6264 172.4980 71 G 3.7342 8.0797 106.2687 46.3389 0.0000 173.5813 72 V 4.4891 6.6829 111.2463 59.4478 33.9146 174.9100 73 Y 4.9967 8.9904 120.5882 55.7405 42.2997 174.7868 74 A 4.4459 9.0232 124.3342 52.4785 19.0980 178.1768 75 A 4.3266 9.1238 126.7134 48.7027 17.8779 175.6539 76 G 3.9566 8.8105 105.9549 45.4029 0.0000 171.1813 77 R 3.9011 8.3351 124.1103 56.2302 30.6169 176.4395 78 L 4.6826 8.2234 122.4936 52.9728 44.2854 175.9052 79 D 4.6445 8.6043 126.0676 53.8423 41.7318 177.5775 80 R 4.3402 8.8419 116.5782 58.7135 29.2511 177.7685 81 D 4.3859 7.9844 114.8463 53.3026 39.8414 175.7439 82 S 5.0472 7.8623 116.0683 57.2951 65.3413 172.5956 83 E 5.0193 9.3378 120.4894 55.1230 34.0348 175.1167 84 G 4.2989 8.6370 104.4364 43.6340 0.0000 172.8049 85 L 4.4661 8.3917 126.3087 54.9626 42.7165 177.2146 86 L 4.7453 8.9915 129.0694 53.2331 45.0865 174.8820 87 V 4.5873 8.3950 126.0027 61.3974 33.6457 174.0727 88 L 5.3231 8.8118 128.0075 53.4172 44.6445 175.4335 89 T 5.3609 9.4039 116.7889 61.3075 71.2718 173.2156 90 N 4.9075 8.8048 121.5853 52.6437 38.6722 174.0598 91 N 4.7178 8.3041 120.1621 52.1954 39.1034 175.5488 92 G 3.6200 8.7172 113.9251 47.7696 0.0000 174.0332 93 A 4.0025 8.0496 122.6006 54.8738 18.4848 179.3762 94 L 3.9243 8.4429 118.9599 58.1355 42.3296 178.6954 95 Q 3.9918 8.3040 119.4575 59.3094 29.0623 178.4766 96 A 3.9954 8.2537 121.7367 55.1675 18.2277 179.4384 97 R 3.8685 7.9971 116.1952 59.7733 30.2076 178.4021 98 L 4.2556 7.9378 117.7440 57.5724 41.7648 179.0822 99 T 4.1414 7.7187 109.1333 63.5102 69.4088 175.5272 100 Q 4.2738 7.3253 118.2273 54.4012 29.6268 174.0729 101 P 4.5256 0.0000 0.0000 62.9803 32.0021 176.0345 102 G 4.1229 7.8622 109.5069 45.6107 0.0000 173.3963 103 K 4.2798 8.7349 119.1344 56.8954 32.7745 177.4970 104 R 4.6117 7.9697 116.6396 56.4707 32.5307 175.8384 105 T 4.6445 7.7324 114.0115 61.8617 68.1599 174.1578 106 G 3.4856 7.8643 110.5494 46.1813 0.0000 171.7340 107 K 4.9218 8.8647 123.8273 54.4620 34.8164 175.1562 108 I 4.8159 8.3625 126.1030 59.7985 39.5118 174.2895 109 Y 5.3263 9.2393 124.8295 56.4216 41.5139 174.1279 110 Y 5.1712 9.6442 121.1658 56.4256 40.6458 174.8735 111 V 4.8310 9.2754 124.3181 61.1254 34.8925 173.7448 112 Q 3.8194 8.3029 129.4652 54.6160 30.3141 174.7517 113 V 4.8935 8.3832 119.0994 59.2323 36.1854 174.5383 114 E 4.2812 8.7384 122.9464 57.4251 29.8918 177.8868 115 G 3.9852 9.3355 111.3887 45.1084 0.0000 172.3679 116 I 4.3296 7.7669 118.0962 57.5291 38.0966 174.2448 117 P 2.9700 0.0000 0.0000 62.3298 31.7057 177.4774 118 T 4.2028 7.9253 112.5764 61.2391 71.0604 175.7017 119 Q 3.9429 8.5421 120.4439 59.1636 28.6728 178.7580 120 D 4.2942 8.1046 118.3521 57.2407 41.2757 178.0393 121 A 4.0695 8.1549 121.2259 55.2153 18.4362 179.5873 122 L 3.9081 8.0781 117.6279 58.0060 41.7000 179.6117 123 E 3.9755 8.5384 118.5565 59.2328 29.3137 179.2790 124 A 4.0084 8.1420 120.7253 55.2793 18.2938 179.5561 125 L 3.9472 7.9040 116.2468 58.1913 41.8811 179.8303 126 R 4.6586 8.0260 119.2327 58.6570 29.8430 178.5057 127 N 4.4581 8.2034 114.9953 53.2893 39.2518 174.8884 128 G 4.0748 7.0316 107.4227 43.9569 0.0000 173.6368 129 V 4.4453 8.6919 116.2099 59.5252 35.1990 175.0229 130 T 4.5268 8.2381 118.6361 62.3537 69.1117 174.9948 131 L 4.5355 8.2747 127.9191 52.6770 43.8027 177.2094 132 N 4.3366 8.7036 116.3872 55.8057 36.9703 175.3774 133 D 4.5506 8.1818 115.5753 52.3783 40.2205 174.6657 134 G 3.9107 7.6520 106.5785 42.7087 0.0000 171.5719 135 P 4.9964 0.0000 0.0000 63.0613 31.9616 175.9785 136 T 4.7328 8.2654 111.3398 60.2436 70.7785 174.4913 137 L 4.4021 9.0682 123.3630 53.6455 42.7265 175.2386 138 P 4.6743 0.0000 0.0000 63.6110 32.1585 175.4859 139 A 5.0530 9.1028 123.8883 50.3618 23.5038 175.0579 140 G 4.3246 9.1319 106.4828 45.6982 0.0000 173.2487 141 A 5.2223 8.2897 124.0319 50.7621 22.3105 175.4631 142 E 4.6741 8.9982 121.3114 54.6290 34.6808 174.1837 143 L 4.7566 8.4996 125.6895 54.5431 42.8023 175.9831 144 V 4.6716 8.4995 118.8939 59.1826 35.4870 175.4689 145 D 4.4462 8.5433 121.4917 53.6706 41.3378 176.2768 146 E 2.5400 8.4669 121.9220 55.5918 29.9822 175.3211 147 P 3.4439 0.0000 0.0000 62.0414 31.5645 177.3136 148 A 3.8099 7.7281 124.7009 53.9097 18.5461 178.1744 149 W 4.6642 6.6744 111.1454 55.9838 28.7338 176.3211 150 L 3.4082 6.8047 121.9023 54.7732 41.8730 176.1609 151 W 4.9556 7.1603 122.2736 53.7628 30.4598 174.0519 152 P 4.4747 0.0000 0.0000 62.7310 31.6156 175.4878 153 R 4.5711 8.3189 119.7558 54.6837 31.6355 175.1691 154 N 4.8236 8.6897 123.2277 51.1698 39.5153 172.4348 155 P 4.6420 0.0000 0.0000 60.8808 32.6939 174.0798 156 P 4.4265 0.0000 0.0000 62.0781 31.8801 176.0280 157 I 3.7409 7.8885 112.5513 61.4903 38.0125 177.4709 158 R 4.2040 8.1706 124.9698 56.5787 32.1382 176.3153 *160 R 4.1293 8.5586 121.7222 57.5094 30.8941 172.8868 *161 K 4.7627 8.0711 121.5918 52.5224 32.6017 174.7148 162 S 4.6870 7.6416 112.6307 59.2173 68.7333 173.8475 163 I 4.0705 7.5879 120.4372 59.3623 38.6098 173.3289 164 P 4.7709 0.0000 0.0000 62.7859 33.0859 174.6814 165 T 5.0809 8.2399 109.4890 60.2842 71.7527 172.8905 166 S 4.7699 8.5507 117.0819 57.1634 68.3540 172.8072 167 W 4.9767 8.7742 119.9267 55.0460 32.0617 175.0421 168 L 5.2450 9.2176 123.3224 52.8274 45.2920 175.2519 169 K 4.5192 8.9180 123.9486 54.8154 34.1661 174.8663 170 I 4.9717 8.8878 128.7901 59.7805 40.4045 174.6129 171 T 5.0022 8.8798 123.9740 61.9139 70.8210 173.3970 172 L 4.8243 8.9240 127.0257 52.9976 44.8391 176.5037 173 Y 4.9191 8.2625 117.7408 57.4416 39.8274 174.8936 174 E 4.8477 8.0927 116.8167 56.5105 32.6265 175.2647 175 G 4.2541 8.0255 104.5010 44.6274 0.0000 173.1952 176 R 4.1040 7.6574 118.3306 55.2479 31.3762 176.3945 177 N 4.4257 8.7342 118.1102 55.5686 39.2187 174.6585 178 R 3.7843 8.8417 124.4370 56.7641 28.4175 178.4385 179 Q 3.9048 7.9838 118.8664 59.4553 29.0241 177.4406 180 V 3.4438 7.4592 118.6271 65.9714 31.6669 177.9710 181 R 3.8854 7.8241 117.3418 59.4049 29.9582 179.1381 182 R 4.0023 8.0922 117.8332 59.2007 29.9116 179.0709 183 M 4.0678 8.2975 119.1145 58.6605 31.9405 178.9523 184 T 3.9594 8.2452 110.0278 64.7021 69.0168 176.4688 185 A 3.9373 8.0093 123.4999 55.1612 18.1427 179.0319 186 H 4.0743 8.1183 115.9870 59.1011 30.0604 177.0501 187 V 4.1527 7.3566 111.3665 61.0831 31.7569 176.6407 188 G 3.8157 8.0532 107.5051 45.2837 0.0000 174.8479 189 F 4.7769 7.9818 118.5403 53.8768 39.8001 172.1493 190 P 4.3883 0.0000 0.0000 62.9984 32.7746 175.4539 191 T 4.3706 8.4560 120.1613 63.8522 68.4841 174.2897 192 L 4.4601 8.9992 126.4030 55.9715 43.5584 177.1353 193 R 4.6685 7.4069 117.3066 54.6638 33.9875 173.6421 194 L 5.2720 8.6845 126.3907 53.4963 45.6766 174.7074 195 I 5.2720 9.2979 127.2119 59.6168 40.6781 174.5163 196 R 4.4582 9.2775 128.7162 56.0831 30.6906 176.0169 197 Y 4.4466 9.4986 128.3955 59.4799 40.5111 175.0028 198 A 5.0690 7.6128 118.9434 50.5351 23.3043 175.3172 199 M 4.9710 8.8665 117.5978 54.7461 35.2859 174.8418 200 G 3.6050 7.6584 111.7140 47.4744 0.0000 173.7426 201 D 4.6166 8.3406 124.5666 53.8785 41.0115 175.2404 202 Y 4.8668 7.5806 117.8863 56.4154 40.1899 174.9988 203 S 4.6128 7.9787 115.9213 57.0867 66.1146 173.7898 204 L 4.0712 7.6229 117.9473 54.8984 41.2134 176.8692 205 D 4.4092 7.4851 119.7118 56.1661 40.9121 176.2483 206 N 4.1639 8.9584 120.2896 53.9744 35.8804 173.8791 207 L 4.4207 7.8885 120.0565 52.8392 43.4026 176.0600 208 A 4.0859 8.1143 129.1617 51.1797 19.1852 175.9659 209 N 3.7766 7.8251 118.8025 54.8165 39.1076 176.1130 210 G 4.1881 8.8733 114.9413 45.0060 0.0000 172.7495 211 E 5.0336 8.0218 119.4516 54.5823 32.1877 174.9151 212 W 5.8659 8.1627 117.7354 55.2024 32.1331 174.1977 213 R 4.6153 9.2116 119.9222 54.9258 33.4060 173.5531 214 E 4.8399 8.8832 125.7121 56.4894 30.4468 176.2290 215 V 4.5961 8.6658 117.7225 60.2615 35.7587 174.2014 216 T 4.6688 8.6383 114.0828 60.9073 70.4046 173.7678 217 D 4.6757 8.5952 122.3754 54.3245 41.3812 175.7266 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 P 0.00 4.34 0.00 2.20 2.13 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.00 0.00 39 T 8.49 3.89 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 40 R 9.77 4.67 0.00 1.64 1.81 0.00 3.23 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 41 V 8.30 4.81 2.19 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 0.82 0.00 0.00 0.96 0.00 0.00 42 I 9.02 5.02 1.82 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.64 0.95 0.00 0.00 43 L 9.04 4.90 0.00 1.57 1.53 0.92 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 44 F 9.15 5.42 0.00 2.92 2.92 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 45 N 8.67 4.64 0.00 2.52 2.45 0.00 0.00 6.56 5.55 0.00 0.00 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 K 8.33 2.96 0.00 1.43 1.44 0.00 1.79 0.00 0.00 1.62 0.00 0.00 3.10 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.24 1.29 7.81 47 P 0.00 4.96 0.00 2.16 2.02 0.00 3.40 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.86 0.00 48 Y 8.67 4.24 0.00 2.98 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 49 D 8.25 4.14 0.00 2.41 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 50 V 7.02 4.53 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.04 0.00 0.00 51 L 8.67 4.35 0.00 1.62 1.56 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 52 P 0.00 4.58 0.00 2.17 2.19 0.00 3.70 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.18 0.00 53 Q 7.16 4.56 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.76 6.81 0.00 0.00 0.00 0.00 0.00 2.26 2.45 0.00 54 F 8.64 4.35 0.00 2.98 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 55 T 7.89 4.08 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 1.24 0.00 0.00 56 D 8.54 4.54 0.00 2.67 2.63 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 57 E 8.30 4.54 0.00 1.96 1.74 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 2.29 2.30 0.00 58 A 8.56 4.20 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 G 8.85 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 0.00 0.00 0.00 60 R 7.52 4.72 0.00 1.91 1.83 0.00 3.17 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 61 K 8.75 5.20 0.00 1.90 1.77 0.00 1.75 0.00 0.00 1.97 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.69 1.74 7.81 62 T 8.20 5.06 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 63 L 8.43 3.83 0.00 0.52 0.67 0.12 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.54 4.01 0.00 1.93 1.87 0.00 1.90 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.44 7.81 65 E 8.23 4.32 0.00 2.09 1.58 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 2.20 2.23 0.00 66 F 7.97 4.42 0.00 2.61 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 67 I 7.84 3.61 1.54 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.32 0.18 0.00 0.00 68 P 0.00 4.55 0.00 2.15 2.08 0.00 3.43 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.02 0.00 69 V 7.12 4.14 1.76 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 0.64 0.00 0.00 0.66 0.00 0.00 *70 Q 8.36 4.45 0.00 2.11 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.27 0.00 0.00 0.00 0.00 0.00 2.22 1.91 0.00 71 G 8.08 3.73 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 0.00 0.00 0.00 72 V 6.68 4.49 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 0.60 0.00 0.00 0.69 0.00 0.00 73 Y 8.99 5.00 0.00 3.09 2.82 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 74 A 9.02 4.45 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 75 A 9.12 4.33 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 76 G 8.81 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 77 R 8.34 3.90 0.00 1.85 1.94 0.00 3.18 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 78 L 8.22 4.68 0.00 1.58 1.55 1.09 1.31 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 79 D 8.60 4.64 0.00 2.78 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 80 R 8.84 4.34 0.00 1.93 2.15 0.00 2.89 0.00 0.00 3.33 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 81 D 7.98 4.39 0.00 3.04 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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156 P 0.00 4.43 0.00 2.18 2.10 0.00 3.78 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 1.98 1.96 0.00 157 I 7.89 3.74 1.78 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.54 0.78 0.00 0.00 158 R 8.17 4.20 0.00 1.68 1.94 0.00 3.30 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 *160 R 8.56 4.13 0.00 1.62 1.76 0.00 3.20 0.00 0.00 3.26 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.22 0.00 *161 K 8.07 4.76 0.00 1.71 1.61 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.24 0.95 7.81 162 S 7.64 4.69 0.00 3.76 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 0.00 163 I 7.59 4.07 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.96 0.90 0.00 0.00 164 P 0.00 4.77 0.00 2.15 2.17 0.00 3.70 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 165 T 8.24 5.08 4.15 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 0.00 0.00 0.00 1.13 0.00 0.00 166 S 8.55 4.77 0.00 3.67 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 0.00 167 W 8.77 4.98 0.00 3.47 3.16 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 0.00 168 L 9.22 5.25 0.00 1.54 1.51 0.87 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.92 4.52 0.00 1.44 1.52 0.00 1.50 0.00 0.00 1.58 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.11 0.63 7.81 170 I 8.89 4.97 1.92 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.52 0.95 0.00 0.00 171 T 8.88 5.00 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 0.97 0.00 0.00 172 L 8.92 4.82 0.00 1.65 1.69 0.84 0.50 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 0.00 173 Y 8.26 4.92 0.00 2.93 3.14 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 0.00 174 E 8.09 4.85 0.00 2.07 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 2.26 2.34 0.00 175 G 8.03 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 0.00 0.00 0.00 0.00 176 R 7.66 4.10 0.00 1.89 1.87 0.00 3.16 0.00 0.00 3.37 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.63 0.00 177 N 8.73 4.43 0.00 2.67 2.76 0.00 0.00 7.19 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 0.00 178 R 8.84 3.78 0.00 2.01 1.93 0.00 3.31 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 179 Q 7.98 3.90 0.00 2.29 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 180 V 7.46 3.44 1.78 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 0.98 0.00 0.00 0.28 0.00 0.00 181 R 7.82 3.89 0.00 2.01 1.95 0.00 3.18 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 182 R 8.09 4.00 0.00 1.85 1.97 0.00 3.28 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.86 0.00 183 M 8.30 4.07 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.53 0.00 184 T 8.25 3.96 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 1.26 0.00 0.00 185 A 8.01 3.94 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 0.00 186 H 8.12 4.07 0.00 3.28 3.57 0.00 5.94 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 V 7.36 4.15 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 0.89 0.00 0.00 1.21 0.00 0.00 188 G 8.05 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 0.00 0.00 0.00 189 F 7.98 4.78 0.00 2.97 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 P 0.00 4.39 0.00 2.15 1.95 0.00 3.54 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.07 0.00 191 T 8.46 4.37 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 1.21 0.00 0.00 192 L 9.00 4.46 0.00 1.40 1.57 0.80 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 193 R 7.41 4.67 0.00 1.69 1.43 0.00 3.07 0.00 0.00 3.36 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 194 L 8.68 5.27 0.00 1.82 1.57 1.10 0.88 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 0.00 195 I 9.30 5.27 2.31 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 1.43 0.77 1.40 0.00 0.00 196 R 9.28 4.46 0.00 1.88 1.81 0.00 2.79 0.00 0.00 2.69 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.11 0.00 197 Y 9.50 4.45 0.00 3.22 3.31 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 0.00 198 A 7.61 5.07 1.06 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 0.00 0.00 199 M 8.87 4.97 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 200 G 7.66 3.60 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 0.00 0.00 0.00 201 D 8.34 4.62 0.00 2.23 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 Y 7.58 4.87 0.00 3.17 2.68 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 0.00 203 S 7.98 4.61 0.00 2.92 3.46 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.62 4.07 0.00 1.45 1.54 1.08 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 205 D 7.49 4.41 0.00 2.62 2.64 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 0.00 0.00 0.00 206 N 8.96 4.16 0.00 2.85 2.91 0.00 0.00 6.85 7.85 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 0.00 207 L 7.89 4.42 0.00 1.45 1.52 0.87 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 208 A 8.11 4.09 1.20 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 0.00 0.00 209 N 7.83 3.78 0.00 1.44 2.06 0.00 0.00 7.10 8.30 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 0.00 210 G 8.87 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 0.00 0.00 0.00 0.00 211 E 8.02 5.03 0.00 2.00 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 2.28 2.33 0.00 212 W 8.16 5.87 0.00 3.54 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 0.00 213 R 9.21 4.62 0.00 1.82 1.76 0.00 3.08 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 214 E 8.88 4.84 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.62 0.00 215 V 8.67 4.60 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 0.67 0.00 0.00 0.88 0.00 0.00 216 T 8.64 4.67 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 1.27 0.00 0.00 217 D 8.60 4.68 0.00 2.76 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.