NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 E 4.3459 8.2876 120.2282 56.4819 31.9080 177.5894 18 V 3.4193 8.1253 117.5380 64.3339 31.3043 175.4132 19 Q 4.5459 7.8469 118.0067 54.7720 29.8493 178.6718 20 K 3.8764 7.7916 119.1830 59.4787 32.5103 177.5038 21 N 4.7013 7.8649 114.1109 52.7311 38.8165 174.6527 22 Q 4.0212 7.8817 119.3343 55.8189 28.9375 176.1909 23 V 4.2194 8.1054 122.1378 60.9243 32.6798 174.4859 24 L 4.5934 9.1138 127.5144 54.1433 43.0395 177.5224 25 T 4.7078 8.5460 112.0913 60.2907 72.0910 176.0255 26 L 4.3135 8.5007 121.9690 58.1592 41.6984 179.6956 27 E 4.0661 8.2658 118.1625 59.3528 29.4741 178.8983 28 E 3.9406 8.2585 118.6469 59.3018 29.2879 179.5128 29 W 4.3422 8.0841 118.3354 60.0497 29.1790 178.6107 30 Q 4.3338 8.7836 118.3260 59.2194 28.0902 178.6065 31 D 4.4728 8.8313 120.3323 57.2511 40.7760 178.7732 32 K 3.8806 8.1513 118.9949 59.4077 32.2035 179.2956 33 W 4.0947 8.1062 118.6685 59.8826 28.8324 178.5807 34 V 3.7307 7.9081 116.7188 66.0943 31.0355 177.0077 35 N 4.7144 8.5399 113.4683 52.8842 38.7182 175.9481 36 G 3.8417 7.6476 108.2127 46.1143 0.0000 175.4055 37 K 4.2724 7.7742 121.4137 54.8252 30.6341 176.8183 38 T 3.4485 6.8737 113.5893 60.4189 69.3746 176.7852 39 A 3.9003 7.7531 125.6866 55.2842 18.7623 179.5488 40 F 4.4032 7.4166 110.2129 59.4459 38.1540 175.3759 41 H 4.3948 7.4509 121.9974 55.9673 30.1995 174.5608 42 Q 4.4533 8.2074 125.7858 53.9089 28.9102 175.7959 43 E 4.0196 8.7017 123.6567 59.2168 29.6492 178.6188 44 Q 4.2490 8.0990 114.6901 55.6862 29.3595 176.6156 45 G 4.0107 7.9523 103.4894 45.4447 0.0000 173.2137 46 H 4.5342 8.9274 118.8934 56.1687 30.7472 176.1044 47 Q 4.1995 8.7147 127.5798 58.6761 28.8882 178.4265 48 L 4.2243 8.1051 120.0698 57.5875 41.8321 178.9285 49 L 4.2192 8.4091 119.9974 57.9671 41.8607 178.5765 50 K 3.6881 8.2636 118.6416 59.4329 32.1775 178.0778 51 K 3.9352 7.8889 118.3333 59.5707 32.3859 177.5377 52 H 4.3268 7.9107 113.4546 55.2640 28.9739 176.5659 53 L 4.0211 7.5776 124.0335 58.5347 42.0104 178.6002 54 D 4.3669 7.9166 118.0331 57.5707 40.5372 178.7990 55 T 3.8453 7.5688 114.6957 66.8058 68.6450 176.1825 56 F 4.7813 7.8389 118.2909 60.2091 39.2201 176.7840 57 L 4.6870 7.9843 116.2974 53.1242 41.7569 176.2348 58 K 3.9413 7.2889 121.2023 58.0930 32.2483 176.8925 59 G 3.9904 9.0202 113.8053 45.5415 0.0000 172.7052 60 K 4.6453 8.0580 119.1201 54.6498 33.7873 176.0032 61 S 4.5690 8.2107 116.4542 57.7170 65.5462 173.8246 62 G 4.0799 8.8334 115.9559 46.3466 0.0000 173.1480 63 L 4.5514 8.0141 117.2060 54.5444 44.0392 177.3243 64 R 5.0675 9.4535 120.6390 54.9005 32.1601 175.6541 65 V 4.7599 9.2314 124.2500 60.9942 34.5816 173.7334 66 F 4.9517 8.5182 129.4655 56.4757 42.0516 174.1752 67 F 4.8462 8.3768 124.9650 53.5009 40.2639 172.6245 68 P 3.7738 0.0000 0.0000 62.5655 31.9256 176.4095 69 L 3.4880 7.9359 120.6867 56.0996 39.1074 175.0376 70 C 4.2900 8.1979 113.1592 58.6989 31.5916 175.7680 71 G 3.9073 7.6705 109.8208 47.0413 0.0000 174.6346 72 K 4.4465 8.9155 117.8677 55.1741 32.5944 176.0249 73 A 4.0827 8.0547 123.0793 54.0018 18.2851 180.0048 74 V 3.4533 8.5105 116.6258 64.4439 32.4873 177.3940 75 E 2.7235 6.9820 121.4685 55.2791 27.7124 177.9211 *77 K 4.3995 7.7724 120.9891 56.2960 35.0066 177.3538 78 W 4.3622 7.7552 118.7091 59.8761 28.9080 178.4595 79 F 4.4093 8.3272 117.3851 60.5254 38.4595 177.6527 80 A 4.6479 8.2043 121.3153 54.9691 18.0403 179.2851 81 D 4.4943 8.5979 116.5109 56.7705 40.8800 178.1243 82 R 4.5269 7.4124 115.9284 55.6940 30.0668 177.0649 83 G 3.9345 8.2046 107.9683 45.4234 0.0000 172.9483 84 H 5.1049 8.1298 116.9256 54.4181 31.3261 174.1051 85 S 5.1421 8.9827 116.1308 57.0682 65.3265 173.0417 86 V 5.0151 9.0835 123.6680 61.0993 34.2354 174.2405 87 V 5.1060 9.1077 127.1346 61.1705 34.7340 174.4347 88 G 4.3927 9.1408 113.8791 44.1534 0.0000 171.6681 89 V 5.0943 7.8583 118.9816 59.6550 34.7243 174.4611 90 E 4.6455 9.0959 125.4209 54.8161 32.4799 175.8039 91 I 3.6266 8.5215 127.5579 63.3904 38.7203 175.9801 92 S 4.3603 8.3811 116.0765 56.9892 62.7262 174.0346 93 E 3.6405 8.6509 130.7259 59.0570 29.3473 178.2873 94 L 3.9542 7.7803 120.1330 57.9734 42.1673 179.0300 95 G 2.2547 7.3555 105.5859 47.2764 0.0000 175.5643 96 I 3.3151 6.9428 122.3201 64.1322 36.9865 178.5563 97 Q 3.9377 7.8340 118.7262 58.9821 28.4480 178.7157 98 E 3.9612 8.4405 120.0254 59.1276 29.4031 179.0093 99 F 3.9558 8.2111 120.8836 61.4865 39.3189 177.3135 100 F 4.0350 7.7624 116.6789 60.6700 38.6121 177.8620 101 T 3.9288 8.2278 115.5354 66.9002 68.0972 176.6532 102 E 4.0338 8.2752 119.3964 58.9135 29.5689 178.4249 103 Q 4.0822 7.7308 115.4468 54.5878 29.8843 174.9584 104 N 4.1465 7.5742 117.6689 55.0266 37.8052 173.8672 105 L 5.0323 8.1496 116.8108 52.8216 44.7834 178.7353 106 S 4.5810 8.7717 118.4689 58.7910 64.7109 172.3367 107 Y 5.2728 7.5264 118.3160 56.2748 41.1619 172.8465 108 S 4.6352 9.0302 113.5746 57.0845 67.1794 172.3875 109 E 4.9753 8.5229 118.0310 54.6423 32.6295 175.4593 110 E 4.8150 8.5715 120.4202 53.7498 34.4455 173.3163 111 P 4.6750 0.0000 0.0000 63.0414 32.8013 176.5751 112 I 4.1749 8.3283 123.6156 60.1777 36.7284 176.7388 113 T 3.9195 8.4882 118.4938 64.3680 68.8717 175.9810 114 E 4.1564 8.1421 120.3207 58.1722 29.8540 176.8344 115 I 4.4937 7.6240 119.7771 57.6558 37.6581 172.0223 116 P 4.1943 0.0000 0.0000 64.2694 31.7808 177.1258 117 G 3.9882 9.1732 110.5717 45.0805 0.0000 172.7442 118 T 4.8243 7.5274 109.6617 59.8487 72.2307 173.3417 119 K 5.1202 8.3833 120.0063 54.6877 37.1135 175.4159 120 V 4.6292 8.4361 122.7412 60.1473 34.0244 174.5410 121 F 4.9896 9.4628 123.5490 55.8712 41.1063 174.7124 122 K 5.2287 8.9783 124.5447 54.1035 34.6306 176.0959 123 S 4.6735 9.4596 121.0845 58.7426 63.3979 176.0366 124 S 4.2051 9.1022 119.8430 61.6529 62.7869 176.2484 125 S 4.1476 8.0837 113.8321 59.7112 62.7491 175.3694 126 G 4.0096 8.2682 108.6106 45.3815 0.0000 173.2773 127 N 4.9869 8.0938 116.1059 53.2439 40.9815 174.6062 128 I 5.2330 8.1163 119.7577 59.6268 41.4695 174.4226 129 S 5.3348 9.2506 122.7309 56.7342 66.4701 172.9375 130 L 5.1773 9.3998 125.3766 53.1314 44.0190 175.3485 131 Y 4.4495 9.5087 123.7031 57.8949 39.0102 175.2200 132 C 5.5085 9.1446 127.4864 56.8218 30.0398 171.6379 133 C 4.7342 7.6387 116.2243 57.0884 32.5370 173.8810 134 S 4.3785 9.0697 113.2840 57.6711 62.9122 174.9637 135 I 3.5726 8.1073 125.5601 64.0751 37.7414 177.5869 136 F 4.6342 7.4554 116.8520 59.1249 39.2866 176.1361 137 D 4.6157 8.1700 121.0318 56.4461 41.2145 178.6741 138 L 3.9990 7.8827 119.6170 57.1390 41.6689 177.5737 139 P 4.2073 0.0000 0.0000 64.9771 31.2955 177.0350 140 R 4.3022 7.7891 115.3198 56.3183 30.2599 175.9753 141 T 4.5983 7.6790 108.9142 60.3609 71.0014 173.8237 142 N 4.9635 8.2386 116.9305 52.8009 39.0358 176.6926 143 I 3.7446 7.3896 120.3551 62.2319 38.8490 177.0573 144 G 3.6984 7.9711 106.8595 44.7034 0.0000 172.1732 145 K 4.7799 7.9405 118.8942 54.5809 35.0921 175.2467 146 F 4.8979 8.8428 119.5708 55.8526 43.0186 175.5956 147 D 4.6365 9.0859 120.3278 56.1433 41.9051 176.1326 *149 I 4.0972 7.5739 119.6839 60.6499 38.6233 174.1124 150 W 4.6707 8.1791 135.0000 55.6014 32.6284 174.0042 151 D 4.3858 7.9394 127.6885 52.2800 41.7887 174.1654 152 R 4.2862 7.3781 125.5872 54.8981 33.7753 174.9302 153 G 3.7802 8.9104 113.6525 46.6032 0.0000 173.1964 154 A 4.3010 6.4962 116.0347 52.2682 22.0356 178.9245 155 L 3.1600 8.9680 115.7558 57.7316 42.6199 180.3630 156 V 3.6215 7.6642 109.7884 62.9466 31.8631 177.3348 157 A 4.0649 7.7613 122.1462 53.1993 19.4820 178.0108 158 I 3.8758 6.8791 116.5377 61.0320 37.7416 175.8552 159 N 3.9851 8.9763 121.1902 53.3838 39.3005 173.9112 160 P 4.0829 0.0000 0.0000 65.8844 31.1513 179.0113 161 G 3.6183 7.8225 102.3582 47.3070 0.0000 174.3979 162 D 4.5339 8.1575 119.8312 55.1874 41.0624 178.5516 163 R 3.9903 7.7524 119.6885 58.9926 29.9674 178.7359 164 K 3.8595 7.9094 118.9517 59.5921 32.2582 178.1842 165 C 4.0940 8.0651 118.5028 62.6379 31.2652 174.5971 166 Y 4.1516 8.5077 120.1325 60.7593 38.4612 177.7176 167 A 4.0584 8.3409 120.5938 55.4062 18.8383 179.0109 168 D 4.7371 8.4958 117.7294 57.6922 40.9397 179.7300 169 T 3.8264 7.8958 114.4510 64.0393 68.2146 176.2499 *171 F 4.9157 8.1194 122.3995 57.6169 40.8945 177.5762 172 S 4.2357 7.9050 113.7756 60.3980 63.1090 174.6826 173 L 4.4136 7.3617 118.7167 54.7878 42.6553 176.0653 174 L 4.8232 7.3433 119.6936 53.1419 42.9003 177.0257 175 G 3.8857 8.5522 110.8981 45.7580 0.0000 173.8123 176 K 4.3252 8.8958 118.9653 58.4491 32.2014 178.0316 177 K 4.7526 7.8533 116.7371 54.4574 34.3615 175.0140 178 F 5.2299 8.3562 116.5988 56.0695 41.7994 173.0324 179 Q 4.7980 8.9840 118.9767 54.5257 31.2983 174.6410 180 Y 4.5740 9.6062 127.2756 56.0668 40.6177 174.2019 181 L 4.9946 8.9713 128.5056 53.3663 43.8381 175.6850 182 L 4.8872 8.7983 125.6848 53.3776 45.3223 174.5283 183 C 5.2849 8.5527 124.4893 58.2835 29.8134 173.6584 184 V 4.6871 8.8485 115.9739 59.5446 35.8611 174.2807 185 L 5.3685 8.6032 121.1271 53.2163 45.0156 175.4406 186 S 5.4106 9.6012 118.5924 57.0289 64.5034 172.3871 187 Y 5.0405 7.8765 123.8184 56.0378 41.3600 173.6372 188 D 4.2939 8.8673 119.5481 52.8341 41.0221 174.7807 189 P 4.5529 0.0000 0.0000 64.4925 31.5958 177.1417 190 T 4.2408 8.1217 108.8122 62.8458 69.2761 175.5652 191 K 4.3825 8.0694 121.0331 57.5335 33.0811 176.3699 192 H 4.9030 8.0580 117.4969 53.8388 32.4481 170.9490 193 P 4.3910 0.0000 0.0000 62.8745 31.7281 176.9982 194 G 3.2702 7.0374 105.1627 44.0316 0.0000 171.1849 195 P 3.3809 0.0000 0.0000 60.4635 32.1351 174.4194 196 P 4.2345 0.0000 0.0000 62.7115 31.9361 175.7659 197 F 4.7889 8.8745 119.8322 57.1045 40.5239 174.6409 198 Y 4.4054 9.1951 122.9059 57.0125 39.1776 175.3702 199 V 4.0783 7.4999 129.6500 60.2584 32.3012 173.4790 200 P 4.2315 0.0000 0.0000 61.4705 32.7148 177.0939 201 H 3.9274 9.0097 117.9255 59.7391 29.4242 176.8308 202 A 3.9311 8.0720 121.6789 55.2137 18.0989 179.1172 203 E 3.7627 8.0493 117.7854 59.2851 29.6155 178.9302 204 I 3.7321 7.5230 119.3861 64.5325 37.1512 178.0235 205 E 3.9129 8.2311 119.4783 59.2594 29.0437 179.2636 206 R 3.8252 7.8358 117.7371 59.6513 30.2219 178.2630 207 L 3.9454 7.6726 117.0501 56.5719 41.9170 177.8061 208 F 5.2915 8.3447 115.4148 57.2454 41.2038 177.5992 209 G 3.7108 8.2899 109.5190 48.3419 0.0000 175.3137 210 K 4.1266 8.1565 118.5566 58.7459 32.4534 177.6483 211 I 4.2890 7.7725 118.1519 61.6883 39.1905 175.5567 212 C 5.4166 8.2424 118.6488 57.5757 31.0832 173.6766 213 N 4.5674 9.1446 122.2282 53.6790 39.8506 173.5663 214 I 4.7886 8.4669 126.6256 59.6813 39.5218 175.0022 215 R 4.6429 8.9230 126.2346 54.4380 33.3442 174.4194 216 C 4.2670 8.6633 124.5438 57.9324 31.4133 172.9209 217 L 4.3611 8.7523 128.2551 57.0132 42.2697 177.5344 218 E 4.8252 7.8219 116.3713 54.7148 34.4117 174.6181 219 K 5.0570 8.5962 123.3542 55.2768 34.9865 175.5831 220 V 4.7510 9.1946 120.5836 59.1622 36.3639 174.6465 221 D 3.8609 8.7774 123.0470 54.3821 41.2620 175.5832 222 A 4.6710 8.5927 126.7061 51.3982 20.3555 175.7118 223 F 3.9806 8.5558 120.0712 58.2773 39.8498 174.5594 224 E 4.6362 8.1306 124.2592 53.5625 33.4008 176.2773 225 E 3.7578 8.6224 120.2761 59.6918 29.2866 179.0356 226 R 3.7214 7.6523 115.1314 59.4161 29.1496 177.9919 227 H 3.0580 7.3060 116.4034 57.2552 28.4829 177.3371 228 K 3.9926 7.4444 120.8505 59.4476 31.6273 178.7761 229 S 4.3296 7.4895 112.8638 60.0712 63.0708 175.4801 230 W 4.6649 7.9451 121.4773 56.3919 29.1382 176.9721 231 G 3.9679 7.9346 107.3137 45.7183 0.0000 173.3783 232 I 4.6180 7.6783 112.0066 59.0658 39.7604 174.9127 233 D 4.6173 8.5462 117.6100 52.7846 40.4999 175.2920 234 C 4.6261 7.7955 116.3689 58.1863 32.3202 172.9954 235 L 5.1136 8.3084 123.9630 54.0638 45.3820 174.2459 236 F 5.2691 9.5814 124.3966 55.6274 42.9336 173.6142 237 E 5.3208 9.5108 122.7307 54.4715 32.6143 174.7016 238 K 5.1901 9.2008 125.2040 54.5171 35.8991 174.6286 239 L 5.1926 8.6174 126.2010 53.7089 44.2021 174.6195 240 Y 5.1279 9.3292 124.2440 56.1171 41.3795 174.4920 241 L 4.9951 9.0889 124.7469 53.4188 44.8979 174.8655 242 L 5.4311 9.1445 127.3273 53.2906 44.1643 175.8985 243 T 4.8401 8.8112 112.7129 57.9037 72.9665 172.8763 244 E 4.1402 7.5021 119.8082 56.0276 30.2158 177.1214 245 K 4.1087 8.2283 120.4512 57.1553 31.8729 176.6080 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 17 E 8.29 4.35 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 18 V 8.13 3.42 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 0.75 0.00 0.00 1.01 0.00 0.00 19 Q 7.85 4.55 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.92 0.00 0.00 0.00 0.00 0.00 2.63 2.44 0.00 20 K 7.79 3.88 0.00 1.82 1.96 0.00 1.55 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.66 1.38 7.81 21 N 7.86 4.70 0.00 2.71 2.85 0.00 0.00 6.94 7.69 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 22 Q 7.88 4.02 0.00 1.90 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.86 0.00 0.00 0.00 0.00 0.00 2.59 2.90 0.00 23 V 8.11 4.22 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 0.85 0.00 0.00 0.95 0.00 0.00 24 L 9.11 4.59 0.00 1.96 1.48 0.90 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.55 4.71 4.46 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 1.24 0.00 0.00 26 L 8.50 4.31 0.00 1.83 1.90 1.02 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.27 4.07 0.00 2.11 2.05 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 2.45 2.52 0.00 28 E 8.26 3.94 0.00 2.10 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 2.27 2.34 0.00 29 W 8.08 4.34 0.00 3.71 3.35 0.00 0.00 0.00 0.00 0.00 0.00 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 8.78 4.33 0.00 2.35 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.70 0.00 31 D 8.83 4.47 0.00 2.88 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.15 3.88 0.00 2.17 2.02 0.00 1.33 0.00 0.00 1.60 0.00 0.00 2.68 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.39 1.53 7.81 33 W 8.11 4.09 0.00 3.67 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 34 V 7.91 3.73 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 0.89 0.00 0.00 1.03 0.00 0.00 35 N 8.54 4.71 0.00 2.77 2.83 0.00 0.00 7.10 7.20 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 36 G 7.65 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 0.00 0.00 0.00 37 K 7.77 4.27 0.00 1.67 1.70 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.32 7.81 38 T 6.87 3.45 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 -0.02 0.00 0.00 39 A 7.75 3.90 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 40 F 7.42 4.40 0.00 3.21 3.35 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.45 4.39 0.00 3.00 3.19 0.00 5.91 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 Q 8.21 4.45 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.65 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 43 E 8.70 4.02 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 44 Q 8.10 4.25 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.65 0.00 0.00 0.00 0.00 0.00 2.35 2.32 0.00 45 G 7.95 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 46 H 8.93 4.53 0.00 3.53 3.27 0.00 5.59 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 Q 8.71 4.20 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.69 0.00 0.00 0.00 0.00 0.00 2.51 2.43 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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 0.00 0.00 0.00 0.00 0.00 57 L 7.98 4.69 0.00 1.87 1.81 1.03 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 58 K 7.29 3.94 0.00 1.99 1.80 0.00 1.87 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.43 7.81 59 G 9.02 3.99 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 0.00 0.00 0.00 60 K 8.06 4.65 0.00 1.96 1.84 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.75 1.60 7.81 61 S 8.21 4.57 0.00 3.81 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 62 G 8.83 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 0.00 0.00 0.00 63 L 8.01 4.55 0.00 1.71 1.68 0.98 0.98 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 64 R 9.45 5.07 0.00 1.68 1.85 0.00 2.86 0.00 0.00 2.83 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 65 V 9.23 4.76 2.01 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 0.51 0.00 0.00 0.77 0.00 0.00 66 F 8.52 4.95 0.00 1.51 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 0.00 0.00 0.00 67 F 8.38 4.85 0.00 2.55 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 68 P 0.00 3.77 0.00 2.04 1.90 0.00 3.61 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 69 L 7.94 3.49 0.00 1.54 1.42 0.79 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 70 C 8.20 4.29 0.00 2.95 3.26 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 71 G 7.67 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 72 K 8.92 4.45 0.00 2.00 2.06 0.00 1.80 0.00 0.00 2.14 0.00 0.00 3.07 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.63 1.40 7.81 73 A 8.05 4.08 1.57 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 0.00 0.00 74 V 8.51 3.45 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 0.97 0.00 0.00 0.78 0.00 0.00 75 E 6.98 2.72 0.00 1.80 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 1.47 1.47 0.00 *77 K 7.77 4.40 0.00 1.97 2.12 0.00 1.72 0.00 0.00 1.84 0.00 0.00 3.09 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.48 1.93 7.81 78 W 7.76 4.36 0.00 3.32 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 79 F 8.33 4.41 0.00 3.20 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 80 A 8.20 4.65 1.45 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 0.00 0.00 81 D 8.60 4.49 0.00 2.92 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 82 R 7.41 4.53 0.00 2.18 2.06 0.00 3.27 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 83 G 8.20 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 84 H 8.13 5.10 0.00 3.50 3.54 0.00 5.60 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 S 8.98 5.14 0.00 3.99 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 86 V 9.08 5.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 1.05 0.00 0.00 87 V 9.11 5.11 2.46 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 1.23 0.00 0.00 1.30 0.00 0.00 88 G 9.14 4.39 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 0.00 89 V 7.86 5.09 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 0.69 0.00 0.00 1.02 0.00 0.00 90 E 9.10 4.65 0.00 1.84 1.57 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 1.79 2.17 0.00 91 I 8.52 3.63 1.86 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.86 0.97 0.00 0.00 92 S 8.38 4.36 0.00 3.82 3.05 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 93 E 8.65 3.64 0.00 2.07 1.91 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 2.29 2.31 0.00 94 L 7.78 3.95 0.00 1.81 1.67 0.97 1.22 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 95 G 7.36 2.25 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 96 I 6.94 3.32 1.37 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.67 0.30 0.00 0.00 97 Q 7.83 3.94 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.22 0.00 98 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 2.40 2.54 0.00 99 F 8.21 3.96 0.00 2.83 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 0.00 100 F 7.76 4.04 0.00 3.09 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 T 8.23 3.93 4.40 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 1.25 0.00 0.00 102 E 8.28 4.03 0.00 1.85 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 2.34 2.50 0.00 103 Q 7.73 4.08 0.00 1.47 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.69 0.00 0.00 0.00 0.00 0.00 1.64 1.16 0.00 104 N 7.57 4.15 0.00 2.76 2.81 0.00 0.00 6.90 9.06 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 0.00 105 L 8.15 5.03 0.00 1.86 1.81 1.03 1.21 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 0.00 106 S 8.77 4.58 0.00 3.80 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 0.00 107 Y 7.53 5.27 0.00 2.52 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 S 9.10 4.21 0.00 3.86 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 0.00 125 S 8.08 4.15 0.00 4.04 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 0.00 126 G 8.27 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 0.00 127 N 8.09 4.99 0.00 2.75 2.95 0.00 0.00 6.71 8.71 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 0.00 128 I 8.12 5.23 2.14 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 1.31 0.80 0.85 0.00 0.00 129 S 9.25 5.33 0.00 3.96 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 0.00 130 L 9.40 5.18 0.00 1.61 1.48 0.20 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 131 Y 9.51 4.45 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 0.00 132 C 9.14 5.51 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 0.00 133 C 7.64 4.73 0.00 3.28 2.98 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 0.00 134 S 9.07 4.38 0.00 3.98 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 0.00 135 I 8.11 3.57 1.64 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 1.11 0.80 -0.03 0.00 0.00 136 F 7.46 4.63 0.00 3.20 3.07 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 0.00 137 D 8.17 4.62 0.00 2.94 2.77 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 0.00 138 L 7.88 4.00 0.00 1.66 1.51 0.71 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 139 P 0.00 4.21 0.00 2.05 2.11 0.00 3.78 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 140 R 7.79 4.30 0.00 2.01 1.98 0.00 3.16 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 141 T 7.68 4.60 4.40 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 1.33 0.00 0.00 142 N 8.24 4.96 0.00 2.75 2.86 0.00 0.00 6.81 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 0.00 143 I 7.39 3.74 1.61 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.64 0.73 0.00 0.00 144 G 7.97 3.70 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 0.00 0.00 0.00 145 K 7.94 4.78 0.00 1.57 1.62 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.76 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.24 1.30 7.81 146 F 8.84 4.90 0.00 2.80 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 0.00 147 D 9.09 4.64 0.00 2.79 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *149 I 7.57 4.10 1.03 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.37 0.34 0.00 0.00 150 W 8.18 4.67 0.00 2.85 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 0.00 0.00 0.00 151 D 7.94 4.39 0.00 2.63 2.53 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 0.00 152 R 7.38 4.29 0.00 0.89 1.51 0.00 3.80 0.00 0.00 3.43 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 153 G 8.91 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 A 6.50 4.30 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 0.00 155 L 8.97 3.16 0.00 1.88 1.61 0.86 1.06 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 0.00 156 V 7.66 3.62 2.28 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 0.81 0.00 0.00 0.94 0.00 0.00 157 A 7.76 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 I 6.88 3.88 1.75 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 1.07 -0.15 0.92 0.00 0.00 159 N 8.98 3.99 0.00 2.93 2.67 0.00 0.00 7.09 8.03 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 0.00 160 P 0.00 4.08 0.00 1.89 1.90 0.00 3.21 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.36 0.00 161 G 7.82 3.62 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 0.00 0.00 0.00 162 D 8.16 4.53 0.00 2.91 2.81 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 0.00 163 R 7.75 3.99 0.00 1.89 1.92 0.00 3.17 0.00 0.00 3.00 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 164 K 7.91 3.86 0.00 1.77 1.77 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.44 7.81 165 C 8.07 4.09 0.00 2.98 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 Y 8.51 4.15 0.00 3.21 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 0.00 167 A 8.34 4.06 1.01 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 0.00 168 D 8.50 4.74 0.00 2.85 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 0.00 169 T 7.90 3.83 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 *171 F 8.12 4.92 0.00 3.28 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 0.00 172 S 7.90 4.24 0.00 3.98 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 0.00 173 L 7.36 4.41 0.00 1.37 1.54 0.10 0.27 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 0.00 174 L 7.34 4.82 0.00 1.25 1.21 -0.06 1.06 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 0.00 175 G 8.55 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 0.00 176 K 8.90 4.33 0.00 1.79 1.95 0.00 1.61 0.00 0.00 1.72 0.00 0.00 3.10 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.58 7.81 177 K 7.85 4.75 0.00 1.73 1.67 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.39 7.81 178 F 8.36 5.23 0.00 3.22 3.17 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 0.00 179 Q 8.98 4.80 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 180 Y 9.61 4.57 0.00 2.99 2.85 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 0.00 181 L 8.97 4.99 0.00 1.90 1.75 0.96 -0.57 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 0.00 182 L 8.80 4.89 0.00 1.23 1.14 0.76 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 183 C 8.55 5.28 0.00 2.59 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 0.00 184 V 8.85 4.69 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 0.66 0.00 0.00 1.13 0.00 0.00 185 L 8.60 5.37 0.00 1.95 1.97 1.24 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 186 S 9.60 5.41 0.00 4.07 3.99 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 0.00 187 Y 7.88 5.04 0.00 3.08 3.07 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 0.00 188 D 8.87 4.29 0.00 2.71 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 0.00 189 P 0.00 4.55 0.00 2.24 2.00 0.00 3.56 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.82 0.00 190 T 8.12 4.24 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 1.22 0.00 0.00 191 K 8.07 4.38 0.00 2.01 2.16 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.59 7.81 192 H 8.06 4.90 0.00 3.19 3.08 0.00 5.92 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 P 0.00 4.39 0.00 2.22 2.15 0.00 3.61 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.91 0.00 194 G 7.04 3.27 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 0.00 195 P 0.00 3.38 0.00 2.07 1.61 0.00 3.37 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.41 0.00 196 P 0.00 4.23 0.00 2.32 2.24 0.00 2.29 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.19 0.00 197 F 8.87 4.79 0.00 3.06 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 Y 9.20 4.41 0.00 2.19 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 V 7.50 4.08 1.99 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 0.73 0.00 0.00 0.90 0.00 0.00 200 P 0.00 4.23 0.00 2.12 1.65 0.00 3.43 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.67 0.00 201 H 9.01 3.93 0.00 3.39 3.42 0.00 5.88 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 A 8.07 3.93 1.31 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 0.00 203 E 8.05 3.76 0.00 1.97 1.99 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 2.17 2.27 0.00 204 I 7.52 3.73 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.25 0.53 0.00 0.00 205 E 8.23 3.91 0.00 2.10 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 2.29 2.24 0.00 206 R 7.84 3.83 0.00 1.80 2.05 0.00 3.20 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 207 L 7.67 3.95 0.00 0.83 0.68 0.79 0.52 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 0.00 208 F 8.34 5.29 0.00 3.10 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 0.00 209 G 8.29 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 0.00 210 K 8.16 4.13 0.00 1.70 1.84 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.44 7.81 211 I 7.77 4.29 1.61 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.98 0.94 0.00 0.00 212 C 8.24 5.42 0.00 3.16 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 0.00 213 N 9.14 4.57 0.00 2.77 2.68 0.00 0.00 6.97 8.48 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 0.00 214 I 8.47 4.79 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 1.36 0.99 1.09 0.00 0.00 215 R 8.92 4.64 0.00 1.92 1.83 0.00 3.14 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 216 C 8.66 4.27 0.00 2.52 2.66 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 0.00 0.00 0.00 0.00 217 L 8.75 4.36 0.00 1.55 1.70 1.15 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 218 E 7.82 4.83 0.00 1.90 1.85 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 2.36 2.39 0.00 219 K 8.60 5.06 0.00 1.72 1.69 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.13 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.52 1.60 7.81 220 V 9.19 4.75 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 0.70 0.00 0.00 1.06 0.00 0.00 221 D 8.78 3.86 0.00 2.30 2.43 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 0.00 222 A 8.59 4.67 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 0.00 223 F 8.56 3.98 0.00 2.97 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 0.00 224 E 8.13 4.64 0.00 1.66 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.38 0.00 225 E 8.62 3.76 0.00 1.98 1.83 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 2.31 2.35 0.00 226 R 7.65 3.72 0.00 1.79 1.94 0.00 2.77 0.00 0.00 3.12 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.95 0.00 227 H 7.31 3.06 0.00 1.77 2.40 0.00 5.83 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 K 7.44 3.99 0.00 1.86 1.89 0.00 1.86 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.64 1.53 7.81 229 S 7.49 4.33 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 0.00 230 W 7.95 4.66 0.00 3.21 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 0.00 231 G 7.93 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 0.00 0.00 0.00 232 I 7.68 4.62 2.07 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 1.65 0.96 1.09 0.00 0.00 233 D 8.55 4.62 0.00 2.53 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 0.00 234 C 7.80 4.63 0.00 2.99 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 0.00 235 L 8.31 5.11 0.00 1.88 1.54 1.32 0.50 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 0.00 236 F 9.58 5.27 0.00 3.09 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 0.00 237 E 9.51 5.32 0.00 2.09 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.55 0.00 238 K 9.20 5.19 0.00 1.91 1.55 0.00 1.89 0.00 0.00 1.69 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.48 7.81 239 L 8.62 5.19 0.00 1.93 1.59 1.16 1.11 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 0.00 240 Y 9.33 5.13 0.00 2.84 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 0.00 241 L 9.09 5.00 0.00 1.74 1.56 0.82 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 242 L 9.14 5.43 0.00 1.54 1.54 -0.27 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 243 T 8.81 4.84 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 1.16 0.00 0.00 244 E 7.50 4.14 0.00 1.93 1.53 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 2.16 2.20 0.00 245 K 8.23 4.11 0.00 1.65 1.81 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.11 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.68 1.59 7.81 * Residues marked with a * may have inaccurate shift predictions.