NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2088 7.8827 121.4414 61.1758 38.7962 173.7634 17 V 4.3776 8.0607 125.1253 61.0643 32.7434 174.5392 18 G 3.7076 9.0423 114.7201 46.2383 0.0000 173.3153 19 G 4.1672 7.6861 109.8030 44.1510 0.0000 172.6917 20 Y 4.9697 7.7355 116.3171 55.0738 42.0961 175.0100 21 T 4.0819 8.5925 117.2290 64.2042 68.4309 175.2267 22 C 4.2189 8.8999 125.2719 59.2408 35.6035 175.4791 23 G 4.0079 8.3952 105.5511 44.9784 0.0000 172.6223 24 A 4.0727 8.4153 125.8981 53.4511 18.8020 176.8084 25 N 4.2768 8.9397 118.6805 54.3783 36.2931 175.6597 26 T 4.0761 7.6305 109.2967 63.3537 69.6001 175.0724 27 V 4.0243 7.0978 122.5230 59.9690 31.1808 173.6514 28 P 4.4727 0.0000 0.0000 64.3413 32.0773 178.2475 29 Y 4.9669 6.8196 115.7938 56.8031 38.8022 174.6143 30 Q 4.6773 7.4976 123.7210 56.3475 29.4968 175.5383 31 V 4.8269 8.9809 119.6032 59.7028 35.6819 174.2747 32 S 4.7555 8.5116 117.7036 56.8983 64.2716 172.7781 33 L 4.4864 8.6335 127.6480 53.5057 43.2179 175.1797 34 N 5.7948 8.9674 122.0641 49.9470 42.5467 174.7687 *37 S 4.2391 8.4512 119.0906 58.3070 64.1942 174.5630 38 G 3.9330 9.7765 108.4574 45.8263 0.0000 172.7666 39 Y 4.4556 6.5835 115.7506 56.5041 39.7696 172.1227 40 H 4.7042 8.8642 121.1240 55.9084 30.5165 174.7222 41 F 5.0879 7.8320 118.7131 56.6713 39.7161 173.7816 42 C 4.8627 6.9633 115.2816 55.9698 44.7537 174.0652 43 G 4.2026 8.5983 109.7540 46.2311 0.0000 172.2421 44 G 4.4844 7.4956 105.8804 46.7707 0.0000 172.5970 45 S 5.4424 8.3457 114.9393 56.5324 67.3471 173.9191 46 L 4.6576 9.0615 126.9474 54.7734 42.2702 177.0206 47 I 4.4958 8.2582 119.0692 60.6607 39.0733 174.4991 48 N 4.5796 7.6836 117.4022 52.0762 39.2935 175.2649 49 S 4.2177 8.5629 113.0257 60.6372 63.0152 175.2532 50 Q 4.5214 8.2369 119.7359 55.2697 30.0885 173.9892 51 W 5.6977 8.5510 116.6118 55.6910 33.5891 174.1731 52 V 4.9014 9.2291 123.6699 61.1552 34.2495 174.1531 53 V 4.8760 9.0769 127.3423 61.7087 33.8178 174.4814 54 S 4.9900 9.3010 122.0011 57.6018 66.1550 171.6616 55 A 5.0991 8.8029 119.2696 49.6863 20.8274 178.3323 56 A 3.8125 8.3292 124.5674 55.2254 18.5701 179.5009 57 H 4.3511 8.1973 114.9505 59.2521 29.9682 175.3891 58 C 4.6892 8.0751 114.6754 57.4184 40.2705 173.1673 59 Y 4.2410 7.7180 122.5527 57.4747 38.8202 174.9994 60 K 3.8855 6.9880 123.9158 55.6208 34.9661 175.0805 61 S 4.1831 8.0092 115.1574 58.5546 64.0894 173.3785 62 G 3.7128 8.3917 106.0645 46.6699 0.0000 173.3726 63 I 4.3637 7.5817 120.3351 59.9779 38.9534 174.6526 64 Q 4.7675 9.0945 128.8333 54.1971 31.5450 174.1952 65 V 4.2921 8.7400 127.1903 62.0055 33.4071 174.6432 66 R 4.9953 8.8234 127.6533 54.7724 31.8522 175.2087 67 L 4.7378 9.1292 125.0949 52.9233 44.4222 178.0094 *69 G 4.0906 8.4613 109.0881 45.0769 0.0000 173.0099 70 E 4.2239 8.1356 118.8992 56.2115 29.6771 174.4738 71 D 4.8645 8.0106 118.4026 55.3456 44.2465 174.3934 72 N 5.0991 9.2278 122.1726 52.7816 38.8783 176.2885 73 I 3.8852 8.4095 120.3523 62.5762 37.8854 176.4407 74 N 4.7471 8.7374 117.7103 53.0007 39.2897 174.8324 75 V 4.3565 7.4837 117.8022 60.5719 34.2003 174.9789 76 V 4.1097 8.4248 126.6043 62.8447 31.3466 175.2447 77 E 4.5019 9.6578 126.0060 55.5779 30.8853 177.3845 78 G 3.9281 7.8387 104.7135 47.1341 0.0000 174.0215 79 N 4.6024 8.6320 116.4787 52.9309 36.9707 174.9394 80 E 5.0991 7.7448 117.1399 56.0285 30.6001 176.2877 81 Q 4.5269 8.6438 121.4332 54.1631 32.4559 174.1081 82 F 5.5375 8.8759 123.0236 56.1030 40.6806 175.2144 83 I 4.6663 8.8371 125.2176 59.2743 40.5955 175.7574 84 S 4.6134 8.6687 122.0882 58.1702 64.3039 173.2593 85 A 4.3251 8.4117 125.4855 52.4424 18.2178 177.6519 86 S 4.2695 9.1028 119.0510 60.6645 63.1080 174.6362 87 K 4.7458 7.6652 117.5648 54.9459 36.6283 174.9600 88 S 5.1925 8.8978 119.7138 56.9867 65.7363 173.9565 89 I 4.4682 9.0139 126.4025 59.1706 38.5785 174.2624 90 V 4.0693 8.2093 126.7543 62.3774 32.4565 174.8341 91 H 3.8910 8.7226 126.8788 56.4366 30.0063 174.1070 92 P 4.4768 0.0000 0.0000 64.7353 31.3925 177.0355 93 S 4.7250 7.9597 113.0875 58.0254 63.2887 173.2972 94 Y 4.3161 7.8391 122.2041 58.0245 38.9489 175.0863 95 N 4.5425 8.3506 125.3597 51.3927 40.6893 175.2332 96 S 3.7155 7.9397 120.1593 60.2350 63.7576 175.1581 97 N 4.3426 8.3822 119.3973 55.6596 38.4541 176.1672 98 T 3.8729 7.6971 105.4700 60.8346 69.7557 174.7731 99 L 3.6363 7.6248 120.8013 55.4955 39.9135 173.8075 100 N 4.4117 7.7334 117.3870 54.5030 39.7355 174.5179 101 N 4.9509 8.6608 120.9356 54.1857 35.7341 175.9328 102 D 4.7584 7.5453 119.0221 53.0997 40.5197 174.5750 103 I 4.8733 7.1918 120.8956 59.1426 42.4823 173.0721 104 M 5.3809 9.1209 127.1521 54.1840 36.2867 173.1683 105 L 5.3459 9.1167 125.4303 53.3525 44.2568 175.3532 106 I 5.0097 9.1333 124.9239 59.3706 40.3899 174.4334 107 K 3.8284 8.5603 128.8900 54.7434 33.2633 175.6957 108 L 4.3636 8.4037 127.8232 54.2287 42.3022 178.0861 109 K 4.1226 8.7388 124.6678 59.1387 32.6319 176.8508 110 S 4.5647 7.4549 112.4076 56.0648 65.6390 173.0194 111 A 4.5308 8.3379 126.7131 51.7851 18.9158 177.2958 112 A 4.2904 8.7281 123.1753 51.6759 19.8315 177.6843 113 S 4.4384 8.4833 116.2921 57.7455 63.4118 174.3766 114 L 4.5499 8.5313 125.7822 54.4596 42.6783 176.6857 115 N 4.6939 8.4179 117.9542 53.0345 40.0184 175.0574 116 S 4.0558 8.8269 112.6892 61.9665 63.1650 175.5569 117 R 4.1092 8.5103 118.4419 57.1040 30.4726 176.3986 118 V 4.4105 7.7364 116.7317 60.8457 32.9288 173.6842 119 A 5.2469 8.6249 128.5715 50.1435 22.8881 174.8149 120 S 5.1358 8.7272 113.7799 57.4057 65.1346 173.1312 121 I 4.3694 8.1860 121.8453 59.1369 39.4017 175.5939 122 S 4.3325 8.4227 124.4367 58.6144 63.8910 173.9082 123 L 4.3498 8.3785 123.5874 53.4424 42.4357 175.2433 124 P 4.5360 0.0000 0.0000 62.9862 32.3217 176.1500 125 T 4.2444 8.2250 108.2824 62.1374 70.3311 174.4479 *127 S 5.0001 7.5831 114.6916 58.1265 64.0174 174.0480 128 C 4.4485 8.4296 118.0729 56.6985 40.7692 173.3384 129 A 4.5269 8.0036 124.4842 51.0630 20.1039 177.3406 130 S 4.3427 8.0375 114.1113 56.9933 64.9016 173.2313 *132 A 4.2184 8.1661 123.2093 53.3601 19.2202 177.1164 133 G 3.9967 9.0289 110.2281 45.5229 0.0000 174.4593 134 T 3.9125 7.5998 117.4279 63.8638 69.2373 173.6745 135 Q 4.7458 8.5978 127.5408 56.0964 30.3442 175.2796 136 C 5.2339 9.4070 121.5171 55.3421 43.0617 172.3334 137 L 5.3297 9.0501 122.8495 53.4895 44.3317 175.0921 138 I 5.6077 9.0501 126.7969 58.8914 40.1911 174.7515 139 S 4.8510 8.5980 119.1848 56.4263 66.6935 172.9627 140 G 3.7657 7.1278 108.1041 46.2719 0.0000 173.0180 141 W 4.7694 8.5396 116.7036 56.2294 29.3685 176.9220 142 G 4.1225 8.3049 109.2941 44.4219 0.0000 173.2292 143 N 3.5523 8.3502 118.1683 54.2402 38.9857 174.7569 144 T 5.0308 8.3364 112.7145 60.7562 70.1054 174.1988 145 K 4.5929 7.8655 121.7993 54.5752 34.2457 176.4023 146 S 4.2779 8.7001 117.6329 60.2744 63.6014 174.6257 147 S 4.6295 8.1116 116.6479 57.5026 64.7973 174.7772 148 G 3.8592 9.8691 113.4462 44.7282 0.0000 171.5305 149 T 4.8570 8.0125 112.9299 60.9015 70.8039 174.8851 150 S 4.5565 9.2671 122.7206 57.7799 66.2548 172.2475 151 Y 4.7530 8.7693 125.5539 55.5283 39.3716 174.2638 152 P 4.6517 0.0000 0.0000 62.4626 32.8624 175.9832 153 D 4.5852 8.7481 118.6613 56.3866 41.3092 177.0294 154 V 5.4997 7.3915 109.7546 58.3153 34.7703 175.6156 155 L 3.1834 8.2426 124.4074 54.9803 42.8481 175.9679 156 K 4.7538 8.0620 125.2368 55.2094 34.5361 174.9073 157 C 5.1785 8.5029 120.0681 55.1979 43.2519 172.9621 158 L 4.9084 8.3385 122.4063 53.9722 45.6372 174.2920 159 K 5.0888 8.9969 125.6967 55.4497 33.4222 175.8925 160 A 5.1185 9.5980 126.1636 49.3819 23.1712 173.0931 161 P 5.1127 0.0000 0.0000 61.3497 34.0685 175.1185 162 I 4.2926 8.2870 123.0057 61.6709 38.1290 175.8923 163 L 4.8632 8.4174 126.8038 53.1367 43.6160 176.6556 164 S 4.4054 8.3816 114.3687 57.9648 64.0844 174.9291 165 D 4.4260 8.8193 122.0209 57.7676 40.3960 179.4940 166 S 4.1764 7.9766 114.2034 61.6460 63.2945 176.6411 167 S 4.1077 8.0289 118.5194 61.0604 62.5094 175.8554 168 C 4.3007 8.4726 121.4196 59.8657 37.8268 175.9041 169 K 3.9771 8.5747 120.6708 59.3372 31.3611 179.4340 170 S 4.2437 8.2637 113.8179 60.9495 63.1806 176.0685 171 A 3.9930 7.7972 123.6933 53.8591 19.6085 177.1830 172 Y 4.8949 7.9428 114.3661 55.6367 38.6642 173.4984 173 P 4.9613 0.0000 0.0000 63.7622 32.1525 177.7139 174 G 4.0489 9.0777 110.6072 45.6458 0.0000 173.7557 175 Q 4.3902 8.1156 116.4009 55.7034 29.4286 175.2813 176 I 4.4147 7.7702 119.9440 59.8246 38.1417 175.5165 177 T 4.4831 8.2070 116.4901 59.8608 70.6175 175.4299 178 S 4.3394 8.5461 114.8991 60.3394 63.0656 174.3361 179 N 4.9873 8.1597 118.4806 53.3636 38.5082 173.8046 180 M 5.9933 8.0432 117.0616 52.9101 36.4099 174.1577 181 F 5.0445 8.1658 113.9346 56.2307 42.3306 173.5015 182 C 6.0690 9.4293 115.9401 54.7906 40.6354 173.2815 183 A 5.0836 8.9988 125.4821 49.8945 21.8599 175.3389 184A G 4.2315 9.4536 103.7122 44.3676 0.0000 177.1916 184 Y 4.7621 8.3358 119.8260 56.8187 39.5275 175.0970 185 L 4.2685 8.3725 125.0324 56.2095 42.3137 179.3147 186 E 4.0198 8.1990 116.4211 57.0547 30.0228 177.4599 187 G 3.8292 7.5193 105.7859 45.1133 0.0000 171.5691 188A G 4.1412 9.1953 106.4513 44.5257 0.0000 174.0284 188 K 4.7691 7.2590 117.5373 54.8146 34.8649 175.3212 189 D 4.7160 8.7602 123.3948 53.4985 45.4629 174.7646 190 S 4.8509 8.7289 117.2305 58.2553 65.1301 173.0912 191 C 4.7461 9.2272 118.3448 55.4626 44.8459 172.2260 192 Q 4.3222 8.7254 117.8668 58.2270 28.4751 178.1809 193 G 4.2800 9.2852 111.1579 45.5442 0.0000 173.7993 194 D 4.6677 8.1285 119.2501 55.8664 41.6233 177.1228 195 S 4.6718 7.8866 113.5704 58.7400 64.1313 174.2345 196 G 3.9292 9.2282 109.8698 45.4262 0.0000 174.2108 197 G 4.5085 7.8607 107.1182 44.8327 0.0000 171.0544 198 P 5.2465 0.0000 0.0000 61.9936 33.7762 175.5851 199 V 4.3652 8.5592 121.1750 61.4466 34.2579 174.0170 200 V 4.8045 8.9797 129.2681 61.2914 33.8645 173.7213 201 C 5.1220 8.8208 124.7872 55.5668 43.7126 174.6336 202 S 3.5890 9.7504 120.9116 59.7288 60.0811 173.2121 203 G 3.9063 8.3431 103.7376 45.7179 0.0000 173.4777 204 K 4.6213 7.7587 118.7827 53.1640 34.4522 175.2766 *209 L 4.3130 8.3092 124.2325 55.3600 41.9578 175.5635 210 Q 4.4735 9.2572 126.1724 56.7889 30.5850 175.8004 211 G 5.2668 8.0339 104.6567 45.7903 0.0000 171.3872 212 I 5.1779 8.1871 119.9180 58.8375 40.8554 175.3913 213 V 3.9674 9.0521 127.6258 63.9375 31.8201 174.1834 214 S 4.7366 8.4322 120.6044 58.5820 64.3670 173.7159 215 W 4.9504 7.4383 114.0693 55.5952 32.1053 172.1865 216 G 3.6819 8.2243 106.1766 46.4788 0.0000 172.7927 217 S 4.6865 8.3029 114.7951 56.7461 62.5964 172.4009 *219 G 4.3078 8.0407 119.0442 45.7366 0.0000 171.2845 220 C 4.8972 8.7720 116.5395 57.1423 41.8334 173.2770 221A A 3.8417 9.0048 123.6669 52.8836 16.7867 176.5021 221 Q 4.4097 7.5377 118.3050 56.4961 29.7607 175.5466 222 K 4.1187 8.5924 126.1610 58.0778 32.6961 175.5240 223 N 4.2345 9.0323 121.2765 53.9737 36.9936 175.2343 224 K 4.2194 7.6294 118.0019 53.4856 32.1681 174.1022 225 P 4.5901 0.0000 0.0000 61.7711 32.7513 177.1495 226 G 3.5769 8.2389 105.6645 46.1245 0.0000 172.7295 227 V 4.3975 7.6992 123.7190 60.8464 33.7601 174.1285 228 Y 4.9938 8.0565 124.3139 55.8948 42.0030 175.1141 229 T 4.3379 8.5788 120.0967 63.7993 69.9202 173.6999 230 K 4.8034 9.2833 128.7401 55.6227 32.1783 177.4403 231 V 3.9719 9.1347 129.2285 65.8711 31.2847 175.2677 232 C 4.5949 8.3350 113.0116 58.3043 41.5885 174.9479 233 N 4.2075 7.8735 117.4991 54.6967 38.3651 175.0577 234 Y 4.8131 8.2232 117.5208 57.5531 39.2645 177.7064 235 V 3.6831 7.9825 121.5510 66.2955 31.5960 178.0923 236 S 4.1318 8.1104 114.4815 61.2236 62.6136 176.3970 237 W 4.1102 8.2648 130.6258 60.4852 30.5442 177.9412 238 I 3.1797 8.4027 120.1742 64.3063 36.4836 178.6763 239 K 3.8184 8.1703 119.3893 59.4206 31.7321 179.5652 240 Q 3.8777 8.1867 118.6036 59.1607 28.3655 178.9441 241 T 3.5943 7.4065 116.2257 66.3946 68.4856 176.6750 242 I 2.9509 7.4077 121.9020 63.9385 36.7975 178.3309 243 A 4.0366 7.9999 120.7287 53.8731 18.2439 178.6386 244 S 4.6232 7.4748 110.4090 58.2487 63.6963 174.0289 245 N 4.6859 7.9197 125.6662 53.7393 38.9106 174.0863 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 16 I 7.88 4.21 1.77 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.51 0.89 0.00 0.00 17 V 8.06 4.38 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 1.29 0.00 0.00 0.90 0.00 0.00 18 G 9.04 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 0.00 0.00 0.00 19 G 7.69 4.17 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 0.00 20 Y 7.74 4.97 0.00 2.93 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 21 T 8.59 4.08 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 1.22 0.00 0.00 22 C 8.90 4.22 0.00 2.70 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 G 8.40 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 0.00 0.00 0.00 24 A 8.42 4.07 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 25 N 8.94 4.28 0.00 2.88 2.91 0.00 0.00 7.11 7.54 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 26 T 7.63 4.08 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 1.26 0.00 0.00 27 V 7.10 4.02 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 0.38 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.47 0.00 2.38 2.39 0.00 3.55 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 2.20 2.01 0.00 29 Y 6.82 4.97 0.00 3.28 3.45 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 0.00 30 Q 7.50 4.68 0.00 1.82 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.72 0.00 0.00 0.00 0.00 0.00 1.91 2.47 0.00 31 V 8.98 4.83 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 0.87 0.00 0.00 0.93 0.00 0.00 32 S 8.51 4.76 0.00 2.98 3.29 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 33 L 8.63 4.49 0.00 0.30 0.86 0.76 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.97 5.79 0.00 2.38 2.44 0.00 0.00 6.78 8.34 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 *37 S 8.45 4.24 0.00 3.80 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 38 G 9.78 3.93 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 0.00 0.00 0.00 39 Y 6.58 4.46 0.00 3.06 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 H 8.86 4.70 0.00 2.90 3.18 0.00 5.87 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.83 5.09 0.00 3.01 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 42 C 6.96 4.86 0.00 2.19 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 43 G 8.60 4.20 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 0.00 44 G 7.50 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 0.00 0.00 0.00 0.00 45 S 8.35 5.44 0.00 3.83 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 46 L 9.06 4.66 0.00 1.84 1.67 1.09 0.71 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 47 I 8.26 4.50 1.89 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 1.52 0.91 0.95 0.00 0.00 48 N 7.68 4.58 0.00 2.94 2.97 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 49 S 8.56 4.22 0.00 4.05 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 50 Q 8.24 4.52 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.90 0.00 0.00 0.00 0.00 0.00 1.98 2.19 0.00 51 W 8.55 5.70 0.00 3.21 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 52 V 9.23 4.90 2.16 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 1.12 0.00 0.00 0.99 0.00 0.00 53 V 9.08 4.88 2.16 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 0.96 0.00 0.00 1.02 0.00 0.00 54 S 9.30 4.99 0.00 3.87 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 55 A 8.80 5.10 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 56 A 8.33 3.81 0.46 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 0.00 0.00 57 H 8.20 4.35 0.00 3.27 3.39 0.00 5.77 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 8.08 4.69 0.00 3.24 3.29 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 59 Y 7.72 4.24 0.00 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 60 K 6.99 3.89 0.00 1.53 1.35 0.00 1.15 0.00 0.00 1.37 0.00 0.00 2.17 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.87 1.07 7.81 61 S 8.01 4.18 0.00 3.94 3.86 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 0.00 0.00 0.00 62 G 8.39 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 0.00 0.00 0.00 63 I 7.58 4.36 1.84 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 1.48 0.69 0.88 0.00 0.00 64 Q 9.09 4.77 0.00 1.97 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.89 0.00 0.00 0.00 0.00 0.00 2.05 2.20 0.00 65 V 8.74 4.29 2.18 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 0.93 0.00 0.00 0.89 0.00 0.00 66 R 8.82 5.00 0.00 1.59 1.77 0.00 2.62 0.00 0.00 2.51 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.13 0.00 67 L 9.13 4.74 0.00 1.77 1.64 1.02 0.70 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 *69 G 8.46 4.09 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 0.00 0.00 0.00 70 E 8.14 4.22 0.00 2.10 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 2.33 1.98 0.00 71 D 8.01 4.86 0.00 2.79 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 72 N 9.23 5.10 0.00 2.82 2.81 0.00 0.00 7.16 7.54 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 73 I 8.41 3.89 1.47 0.00 0.00 0.66 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 0.60 -0.35 0.00 0.00 74 N 8.74 4.75 0.00 2.82 2.89 0.00 0.00 6.65 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 75 V 7.48 4.36 2.11 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.42 4.11 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 0.79 0.00 0.00 0.96 0.00 0.00 77 E 9.66 4.50 0.00 1.97 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 2.24 2.41 0.00 78 G 7.84 3.93 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 0.00 0.00 0.00 79 N 8.63 4.60 0.00 2.93 3.09 0.00 0.00 6.99 7.66 0.00 0.00 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 E 7.74 5.10 0.00 1.64 1.92 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 2.67 2.33 0.00 81 Q 8.64 4.53 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.87 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 82 F 8.88 5.54 0.00 2.78 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 83 I 8.84 4.67 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 1.25 0.83 0.94 0.00 0.00 84 S 8.67 4.61 0.00 3.75 3.74 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 85 A 8.41 4.33 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 86 S 9.10 4.27 0.00 3.72 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 87 K 7.67 4.75 0.00 1.60 1.64 0.00 1.55 0.00 0.00 1.83 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.40 7.81 88 S 8.90 5.19 0.00 4.12 4.06 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 89 I 9.01 4.47 2.07 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.08 1.04 0.00 0.00 90 V 8.21 4.07 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 0.65 0.00 0.00 0.76 0.00 0.00 91 H 8.72 3.89 0.00 2.80 3.01 0.00 5.64 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.48 0.00 2.11 2.14 0.00 3.38 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 93 S 7.96 4.72 0.00 4.04 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 94 Y 7.84 4.32 0.00 2.89 2.90 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 0.00 0.00 0.00 95 N 8.35 4.54 0.00 2.55 2.39 0.00 0.00 6.65 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 96 S 7.94 3.72 0.00 3.93 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 97 N 8.38 4.34 0.00 2.68 2.77 0.00 0.00 6.91 7.72 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 98 T 7.70 3.87 4.06 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 1.07 0.00 0.00 99 L 7.62 3.64 0.00 1.43 1.78 0.82 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.73 4.41 0.00 2.75 2.62 0.00 0.00 7.26 6.07 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 0.00 101 N 8.66 4.95 0.00 2.90 2.58 0.00 0.00 7.23 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 0.00 102 D 7.55 4.76 0.00 3.17 2.61 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 0.00 103 I 7.19 4.87 1.31 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 1.30 1.25 0.12 0.00 0.00 104 M 9.12 5.38 0.00 2.15 1.87 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.66 0.00 105 L 9.12 5.35 0.00 2.01 1.96 1.01 -0.17 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 0.00 106 I 9.13 5.01 1.92 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 1.20 0.93 0.95 0.00 0.00 107 K 8.56 3.83 0.00 0.79 1.09 0.00 1.28 0.00 0.00 1.32 0.00 0.00 2.73 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.72 0.21 7.81 108 L 8.40 4.36 0.00 1.50 1.64 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.74 4.12 0.00 1.91 1.80 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.40 7.81 110 S 7.45 4.56 0.00 3.94 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 0.00 111 A 8.34 4.53 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 0.00 112 A 8.73 4.29 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 0.00 113 S 8.48 4.44 0.00 3.77 3.84 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 0.00 114 L 8.53 4.55 0.00 1.64 1.62 1.00 1.07 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 0.00 115 N 8.42 4.69 0.00 2.92 2.93 0.00 0.00 6.89 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 0.00 116 S 8.83 4.06 0.00 3.90 3.98 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 0.00 0.00 0.00 117 R 8.51 4.11 0.00 1.94 2.00 0.00 3.16 0.00 0.00 3.33 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.58 5.00 0.00 4.00 3.94 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 0.00 0.00 0.00 128 C 8.43 4.45 0.00 2.94 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 0.00 129 A 8.00 4.53 1.13 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 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.04 4.34 0.00 3.99 3.94 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 0.00 0.00 0.00 *132 A 8.17 4.22 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 0.00 133 G 9.03 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 0.00 0.00 0.00 134 T 7.60 3.91 4.12 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 1.14 0.00 0.00 135 Q 8.60 4.75 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.61 0.00 136 C 9.41 5.23 0.00 2.77 2.96 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 0.00 137 L 9.05 5.33 0.00 1.75 1.55 1.02 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.05 5.61 1.88 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 0.77 1.15 0.98 0.00 0.00 139 S 8.60 4.85 0.00 3.48 3.56 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 0.00 140 G 7.13 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 0.00 0.00 0.00 141 W 8.54 4.77 0.00 3.08 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 0.00 142 G 8.30 4.12 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 0.00 0.00 0.00 143 N 8.35 3.55 0.00 2.25 2.59 0.00 0.00 7.12 7.25 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 0.00 144 T 8.34 5.03 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 1.14 0.00 0.00 145 K 7.87 4.59 0.00 1.80 1.91 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.29 1.31 7.81 146 S 8.70 4.28 0.00 3.98 4.20 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 0.00 147 S 8.11 4.63 0.00 3.85 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 0.00 148 G 9.87 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.01 4.86 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 1.30 0.00 0.00 150 S 9.27 4.56 0.00 3.86 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 0.00 151 Y 8.77 4.75 0.00 2.98 3.03 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 0.00 152 P 0.00 4.65 0.00 2.44 2.07 0.00 4.11 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.00 0.00 153 D 8.75 4.59 0.00 2.80 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 0.00 154 V 7.39 5.50 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 1.11 0.00 0.00 0.96 0.00 0.00 155 L 8.24 3.18 0.00 1.26 1.26 -0.57 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.06 4.75 0.00 1.67 1.50 0.00 1.59 0.00 0.00 1.53 0.00 0.00 2.79 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.46 7.81 157 C 8.50 5.18 0.00 1.55 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 0.00 0.00 0.00 0.00 158 L 8.34 4.91 0.00 1.69 1.44 0.91 0.89 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 0.00 159 K 9.00 5.09 0.00 1.84 2.01 0.00 1.89 0.00 0.00 1.77 0.00 0.00 2.78 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.59 7.81 160 A 9.60 5.12 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 0.00 161 P 0.00 5.11 0.00 2.00 2.05 0.00 3.13 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.63 0.00 162 I 8.29 4.29 1.73 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.53 0.75 0.00 0.00 163 L 8.42 4.86 0.00 1.60 1.62 0.95 0.67 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 0.00 164 S 8.38 4.41 0.00 4.00 3.98 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 0.00 0.00 0.00 165 D 8.82 4.43 0.00 2.81 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.98 4.18 0.00 4.05 4.13 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 0.00 0.00 0.00 0.00 167 S 8.03 4.11 0.00 4.06 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 0.00 168 C 8.47 4.30 0.00 3.16 3.33 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 0.00 169 K 8.57 3.98 0.00 1.94 1.90 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.54 1.61 7.81 170 S 8.26 4.24 0.00 4.00 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 0.00 171 A 7.80 3.99 1.12 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 0.00 0.00 172 Y 7.94 4.89 0.00 3.08 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 0.00 173 P 0.00 4.96 0.00 2.21 2.11 0.00 3.46 0.00 0.00 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 174 G 9.08 4.05 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 0.00 175 Q 8.12 4.39 0.00 2.50 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.64 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 176 I 7.77 4.41 1.98 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 1.84 0.98 1.00 0.00 0.00 177 T 8.21 4.48 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 1.23 0.00 0.00 178 S 8.55 4.34 0.00 4.00 4.05 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 0.00 179 N 8.16 4.99 0.00 2.90 3.08 0.00 0.00 6.63 7.67 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 0.00 180 M 8.04 5.99 0.00 1.80 2.00 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.43 0.00 181 F 8.17 5.04 0.00 3.06 3.13 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 0.00 0.00 0.00 0.00 182 C 9.43 6.07 0.00 2.99 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 0.00 183 A 9.00 5.08 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 184A G 9.45 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 0.00 184 Y 8.34 4.76 0.00 2.95 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 0.00 185 L 8.37 4.27 0.00 1.72 1.71 0.91 0.84 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 0.00 186 E 8.20 4.02 0.00 2.11 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 0.00 2.42 2.33 0.00 187 G 7.52 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 188A G 9.20 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 0.00 0.00 0.00 188 K 7.26 4.77 0.00 1.29 1.50 0.00 1.26 0.00 0.00 1.35 0.00 0.00 2.17 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.15 1.14 7.81 189 D 8.76 4.72 0.00 2.82 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 0.00 190 S 8.73 4.85 0.00 3.98 3.97 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 0.00 191 C 9.23 4.75 0.00 2.91 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 0.00 192 Q 8.73 4.32 0.00 2.37 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.21 0.00 0.00 0.00 0.00 0.00 2.56 2.47 0.00 193 G 9.29 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 0.00 0.00 0.00 194 D 8.13 4.67 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 0.00 195 S 7.89 4.67 0.00 4.11 4.08 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 0.00 0.00 0.00 0.00 196 G 9.23 3.93 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 0.00 0.00 0.00 197 G 7.86 4.51 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 0.00 198 P 0.00 5.25 0.00 2.30 2.34 0.00 3.70 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 199 V 8.56 4.37 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 0.70 0.00 0.00 0.60 0.00 0.00 200 V 8.98 4.80 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 0.70 0.00 0.00 201 C 8.82 5.12 0.00 2.79 2.86 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 0.00 0.00 0.00 202 S 9.75 3.59 0.00 3.94 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 0.00 203 G 8.34 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 0.00 204 K 7.76 4.62 0.00 1.81 1.65 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.40 7.81 *209 L 8.31 4.31 0.00 1.51 1.65 1.05 0.79 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 0.00 210 Q 9.26 4.47 0.00 1.95 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.39 0.00 0.00 0.00 0.00 0.00 2.49 2.36 0.00 211 G 8.03 5.27 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 0.00 212 I 8.19 5.18 1.92 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 1.30 1.04 0.96 0.00 0.00 213 V 9.05 3.97 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 0.94 0.00 0.00 1.17 0.00 0.00 214 S 8.43 4.74 0.00 3.89 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 0.00 215 W 7.44 4.95 0.00 3.37 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 0.00 216 G 8.22 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 0.00 217 S 8.30 4.69 0.00 4.27 3.93 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 *219 G 8.04 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 0.00 220 C 8.77 4.90 0.00 2.97 2.94 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 0.00 0.00 0.00 221A A 9.00 3.84 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 0.00 221 Q 7.54 4.41 0.00 2.22 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.92 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 222 K 8.59 4.12 0.00 1.76 1.70 0.00 1.98 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.64 7.81 223 N 9.03 4.23 0.00 2.78 2.79 0.00 0.00 6.78 7.34 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 0.00 224 K 7.63 4.22 0.00 1.86 1.78 0.00 1.63 0.00 0.00 1.31 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.48 7.81 225 P 0.00 4.59 0.00 2.26 2.11 0.00 3.57 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.98 0.00 226 G 8.24 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 0.00 227 V 7.70 4.40 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 0.00 0.00 0.54 0.00 0.00 -0.84 0.00 0.00 228 Y 8.06 4.99 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.58 4.34 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 1.14 0.00 0.00 230 K 9.28 4.80 0.00 2.15 1.94 0.00 1.83 0.00 0.00 1.79 0.00 0.00 2.80 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.53 1.60 7.81 231 V 9.13 3.97 2.41 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 1.13 0.00 0.00 1.10 0.00 0.00 232 C 8.33 4.59 0.00 3.17 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 0.00 233 N 7.87 4.21 0.00 2.43 2.34 0.00 0.00 6.81 7.34 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 0.00 234 Y 8.22 4.81 0.00 3.20 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 0.00 235 V 7.98 3.68 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 1.16 0.00 0.00 1.09 0.00 0.00 236 S 8.11 4.13 0.00 3.98 3.94 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 0.00 0.00 0.00 237 W 8.26 4.11 0.00 3.45 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.40 3.18 2.04 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.04 0.74 0.00 0.00 239 K 8.17 3.82 0.00 1.73 1.77 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.52 7.81 240 Q 8.19 3.88 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.54 0.00 241 T 7.41 3.59 3.28 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 0.72 0.00 0.00 242 I 7.41 2.95 1.48 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.34 0.47 0.00 0.00 243 A 8.00 4.04 1.24 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 0.00 0.00 244 S 7.47 4.62 0.00 3.97 3.93 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 0.00 245 N 7.92 4.69 0.00 3.09 3.03 0.00 0.00 6.76 7.45 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 * Residues marked with a * may have inaccurate shift predictions.