NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3756 8.3344 115.2907 57.6693 63.8935 173.4915 3 L 3.9726 7.8647 119.8797 53.6166 42.5383 175.1540 4 K 4.3587 8.2374 124.0469 55.6064 33.8209 174.7582 5 P 4.5899 0.0000 0.0000 63.0836 32.6499 177.6442 6 V 4.7052 8.3358 121.8999 62.3678 34.1963 174.1519 *8 I 4.4039 8.2676 118.8350 61.6254 38.7564 174.7624 9 I 4.3204 8.6459 129.2661 60.0695 37.6598 175.1678 10 Q 4.4831 8.5319 128.6965 54.2965 31.4304 175.8489 11 F 4.7290 8.6975 121.7405 57.4066 40.8437 175.0167 12 S 4.5642 7.5093 112.9193 56.9609 65.3373 174.4131 13 A 4.1240 8.5290 123.9862 54.8815 18.1966 178.9164 14 S 4.5284 7.9456 108.3226 59.4114 64.2065 174.6243 15 E 4.7444 7.6978 121.6102 54.8095 26.9317 175.5096 16 G 4.1382 7.7780 111.9145 43.2695 0.0000 170.1992 17 P 4.3883 0.0000 0.0000 63.3263 32.4791 178.0624 18 G 3.7228 7.5282 106.7020 46.5594 0.0000 175.8244 19 H 4.1276 9.3586 119.8086 59.0250 29.6553 177.1386 20 F 3.6581 8.1401 122.6446 60.9830 39.1432 177.2647 21 G 3.0118 7.8194 104.6550 47.8394 0.0000 175.1874 22 D 4.3404 7.7792 121.3235 56.7448 40.7383 178.7392 23 F 3.9812 8.1967 121.3329 61.2761 39.3970 177.2354 24 L 3.6655 7.6496 118.4263 57.5006 41.3251 179.3311 25 A 4.0597 8.1113 120.9281 55.2092 18.1343 180.0050 26 G 3.4466 7.8612 102.8709 47.1748 0.0000 174.8008 27 E 4.1568 7.4290 118.2798 55.4750 30.0421 175.6903 28 H 3.9179 7.5005 115.2453 56.7624 27.0322 174.7511 29 I 4.4756 7.6393 119.8259 59.0920 38.1929 175.0692 30 P 4.6433 0.0000 0.0000 62.8734 32.5788 175.2660 31 F 5.5236 8.1374 115.2955 55.5945 41.3171 173.5786 32 Q 4.5341 9.1788 119.2995 54.2358 31.4745 175.1703 33 V 4.3764 8.5659 124.3777 62.1216 32.9809 174.9117 34 L 4.8368 8.7583 127.0254 53.1633 44.9526 176.6642 35 R 5.0640 9.3556 123.3113 53.9824 32.6059 176.6931 *37 D 4.6969 8.5820 117.6714 53.3060 40.9540 176.2656 38 R 4.4258 7.7864 116.9892 55.4695 30.5003 175.8231 39 S 3.8901 8.1107 112.2131 59.4582 60.2156 171.7244 40 D 4.4598 7.8050 119.9424 53.6775 41.0763 175.1049 41 P 4.4447 0.0000 0.0000 62.3645 32.0943 176.2239 42 L 4.4043 8.2030 122.1471 53.0712 42.7371 175.1057 43 P 4.4012 0.0000 0.0000 62.5378 31.9831 176.6780 44 A 3.9989 8.6502 123.9741 54.1124 18.8479 176.8972 45 E 4.5219 7.8865 116.9802 54.1220 30.7114 175.9711 46 I 3.7298 8.4292 127.8363 64.2052 38.1574 177.5546 47 R 4.1943 8.4315 117.5286 57.8033 29.8290 177.1456 48 D 4.5696 8.1955 117.9768 55.6404 41.0197 175.8225 49 C 5.1528 7.9259 113.8891 56.0488 32.3961 174.2463 50 S 4.3741 8.9215 115.9283 60.9062 63.6703 173.8308 51 G 4.4874 7.6637 105.1390 45.4640 0.0000 171.9655 52 L 5.2705 9.4169 122.9726 53.1912 45.0262 175.3647 53 A 5.6037 8.0090 127.1452 49.0318 22.9672 174.4862 *56 G 3.8272 7.9101 106.0781 46.2484 0.0000 171.6824 57 G 4.1759 7.8173 106.5210 44.0911 0.0000 172.4038 58 P 4.3182 0.0000 0.0000 60.9855 30.1665 175.4377 *60 S 4.1400 7.5505 116.0718 58.3189 63.7133 174.1856 61 A 3.9906 8.6384 128.7056 54.9231 18.1712 178.0947 62 N 4.6490 7.9993 111.3042 53.6123 39.1046 175.4556 63 D 4.4283 7.7722 118.9473 54.2152 41.3880 176.4025 64 D 4.4828 8.1781 122.3077 52.6578 38.7949 175.1317 65 L 4.5496 7.1890 123.8625 51.1664 44.4030 176.1542 66 P 4.4007 0.0000 0.0000 65.0616 32.0446 177.3917 67 W 4.5993 6.6130 119.1166 54.4186 27.0815 174.6654 *69 P 4.3471 0.0000 0.0000 63.6084 33.6752 179.6814 70 T 3.9496 7.9406 114.3597 66.5384 68.2845 176.4236 71 L 4.0985 8.5208 122.6003 58.0996 42.2125 178.8714 72 L 4.0264 8.1020 118.3220 57.8363 41.5315 179.1921 73 A 4.0352 8.1975 120.6581 55.0657 18.2331 179.4112 74 L 3.9332 8.1575 118.8576 58.2769 42.1695 179.2889 75 I 3.7255 8.1304 120.0100 64.5052 37.0059 178.4237 76 R 3.9518 8.0408 118.8081 59.5990 29.8370 178.8615 77 D 4.3422 8.4506 118.5677 57.1144 40.7276 178.6068 78 A 4.0143 8.2783 121.5171 55.2838 18.3301 179.8324 79 V 3.4989 7.8695 116.4005 66.1656 31.3720 178.0458 80 A 4.0603 8.1219 119.5489 54.8298 18.3200 178.6690 81 Q 4.3048 8.0880 113.5903 54.9810 29.2719 175.9314 82 R 3.8361 7.6288 117.8227 57.1516 28.1799 176.2327 83 V 4.2315 7.9131 118.8822 60.9400 32.0809 173.9715 84 P 4.6457 0.0000 0.0000 63.1044 32.7334 175.2240 85 V 5.3215 9.1026 120.9134 61.3428 35.0649 173.7872 86 I 4.8358 8.7883 127.1955 58.9798 41.0209 174.0875 87 G 4.3824 8.7631 115.6395 44.6643 0.0000 170.9516 88 H 5.1059 8.8707 121.3784 54.4244 31.0574 174.4868 89 C 4.0663 9.3069 125.1966 59.1096 32.1717 174.1161 90 L 4.2797 8.7136 119.9880 57.5359 41.2844 177.3491 91 G 3.8689 8.2529 104.9264 47.8583 0.0000 175.6509 92 G 3.6211 8.0334 107.5490 47.6986 0.0000 175.6552 93 Q 4.3089 8.4817 120.4977 58.8021 28.6589 178.9260 94 L 4.1535 8.4758 120.5459 57.4205 41.4741 178.9697 95 L 3.9315 7.8808 119.2771 58.2502 42.2267 178.7127 96 A 3.8312 7.7566 119.9397 54.9304 18.0752 179.5100 97 K 4.4277 8.3421 118.2426 58.9350 32.3304 179.6814 98 A 4.1217 8.0027 118.8673 52.4999 18.7790 178.3868 *100 G 3.7271 8.0883 108.2363 46.3223 0.0000 173.9026 101 G 4.0329 8.2154 108.8819 45.6995 0.0000 172.3478 102 E 5.1538 9.1143 117.1389 54.2533 33.2805 175.0638 103 V 5.0427 8.3955 120.3368 61.4832 33.8873 174.5525 104 T 4.8345 8.7789 117.0343 59.4852 72.8261 172.7966 105 D 4.7579 8.5861 122.2187 54.3187 41.3579 176.9107 106 S 4.3261 8.8519 120.4556 57.6203 63.6272 172.6581 107 P 4.3233 0.0000 0.0000 65.3741 31.2841 176.7179 108 H 4.8105 7.6928 112.3821 53.5068 32.2149 172.9789 109 A 4.2099 8.6519 125.6336 51.8722 19.6208 176.5345 110 E 4.4046 8.2969 117.9540 54.5987 32.9489 175.7095 111 I 4.1931 8.2246 124.7953 62.1122 40.7164 172.5815 112 G 3.5032 7.6896 115.7546 43.6281 0.0000 171.2161 113 W 5.1957 8.8742 122.3122 55.9104 30.1919 176.7838 114 V 4.5989 8.9363 118.0132 59.2394 35.0799 175.3778 115 R 4.2610 8.5850 123.1138 56.2418 30.6068 175.8043 116 A 4.4723 8.0079 123.7560 49.9853 23.5830 174.7934 117 W 5.0185 9.0496 118.8485 53.9865 32.7776 173.6669 118 P 4.7594 0.0000 0.0000 62.7884 31.5331 176.3822 119 Q 3.8485 8.2886 121.9961 55.8609 29.3188 177.1062 120 H 2.5800 7.7716 120.5567 53.8721 27.5613 175.1060 121 V 4.7180 6.6244 114.3186 57.8988 36.0580 175.5566 122 P 4.5909 0.0000 0.0000 66.2183 31.1098 178.8680 123 Q 4.2629 8.3623 117.3777 58.8043 28.5471 178.3829 124 A 4.1801 8.2412 121.7114 54.9690 18.4551 179.3971 125 L 4.0004 8.3654 118.4660 58.2813 42.0450 178.5962 126 E 3.9330 8.2654 117.8265 59.2582 29.7247 178.3647 127 W 4.4078 8.4515 117.1199 58.5981 29.5708 177.4201 128 L 4.6026 8.5885 117.3167 54.7957 42.0052 177.7419 129 G 3.7718 9.5189 106.5412 45.1208 0.0000 172.7120 130 T 4.1964 7.0817 110.9256 61.8046 69.7799 172.4404 131 W 4.9460 8.5718 122.8288 56.4867 29.7385 176.5532 132 D 4.6463 8.1634 119.3023 53.6260 40.8633 175.6499 133 E 3.9151 8.6905 121.8844 57.1250 30.1021 176.0459 134 L 4.6050 8.4149 125.3921 52.7594 45.5851 174.6449 135 E 5.0755 8.6450 121.7535 54.7049 31.2726 174.9205 136 L 5.1754 9.1144 126.8834 53.0858 45.1658 175.0282 137 F 4.4734 8.8283 124.4720 56.9728 40.4945 174.2215 138 E 4.8503 7.6728 125.2394 54.6430 33.3095 175.3883 139 W 5.3425 8.5621 130.2543 56.6732 31.9759 172.4974 140 H 5.0945 9.1487 118.7711 54.1839 31.8033 174.0580 141 Y 4.6657 8.9987 115.5575 57.9713 40.5132 174.7979 142 Q 5.2873 8.2024 116.3977 54.2610 33.0580 174.3137 143 T 4.8663 8.9752 113.4577 59.9017 71.0574 172.6659 144 F 5.2792 7.7645 122.8083 56.0017 39.3831 175.5957 145 S 4.4873 8.9241 116.5558 57.9902 64.1035 174.0111 146 I 3.6733 8.1872 122.6789 60.3958 37.4419 174.7247 147 P 4.2929 0.0000 0.0000 61.1976 31.9807 173.9554 148 P 4.3730 0.0000 0.0000 64.6067 31.2961 176.8950 149 G 3.8643 8.9589 109.5795 45.1504 0.0000 172.9653 150 A 4.6733 7.4959 120.9197 50.9222 20.8109 176.9282 151 V 4.2497 8.5617 120.2822 61.1358 33.4310 174.6830 152 H 4.9916 9.0255 129.1595 56.5607 30.1311 174.6031 153 I 4.5454 8.8461 117.4113 60.3475 39.6571 174.6403 154 L 5.0167 7.4107 124.0946 54.2182 45.4275 173.6971 155 R 5.6365 9.2820 121.4600 53.6313 33.3933 173.7849 156 S 5.2585 8.7266 114.5077 56.3316 65.9448 173.8064 157 E 4.0563 9.3223 120.4060 59.5168 29.2596 177.1539 158 H 4.6967 8.0461 111.6641 55.8177 29.4521 175.0339 159 C 4.4121 7.9307 121.2025 57.9835 32.5972 173.8413 160 A 4.0245 8.6413 131.1169 54.7685 18.6597 177.3547 161 N 4.8394 7.6030 114.3918 52.4303 37.4225 174.6273 162 Q 4.3447 8.7842 120.8375 58.5892 30.6930 176.8413 163 A 5.4319 8.1504 117.8273 51.8871 22.7066 174.8264 164 Y 5.1992 7.1094 116.4768 55.6402 42.1710 174.0321 165 V 4.6210 8.6709 112.9159 59.3183 35.7330 174.4731 166 L 4.8282 8.5517 126.0751 53.8011 44.8784 176.1867 167 D 4.4736 9.5388 124.8005 55.4108 38.3176 173.3816 168 D 4.7877 8.6259 114.2500 55.0524 39.8318 173.3066 169 L 4.8040 8.3827 117.9695 55.8733 45.1004 176.2435 170 H 5.4759 8.0320 114.7389 54.0577 31.8681 173.6297 171 I 4.4141 8.6475 121.6354 59.0034 41.6003 173.9605 172 G 3.8685 7.2911 115.5041 44.0536 0.0000 171.6863 173 F 5.4650 8.9162 121.8870 55.6423 42.1090 176.0644 174 Q 4.2494 9.7589 124.3582 58.8062 30.1317 176.1514 175 C 4.6120 8.1417 112.1188 57.2235 30.9483 172.5823 176 H 4.9851 9.0777 117.5103 53.6319 27.7902 175.1425 177 I 3.5642 7.9416 117.3683 60.7961 38.0604 176.1920 178 E 4.2525 7.7936 120.7888 55.3344 28.9592 175.3250 *180 Q 3.9347 8.1930 122.2073 55.2151 30.3295 175.7101 181 A 4.0830 8.4147 122.8464 55.7211 18.6600 180.5671 182 H 4.3637 7.9125 111.1891 55.6602 28.3246 177.7338 *184 V 3.4756 8.0238 120.5888 63.9763 33.2715 177.2897 185 R 3.9870 7.8865 118.5520 59.3283 29.7589 178.7987 186 E 4.0161 8.2938 118.3736 59.4076 29.5152 179.5917 187 W 4.2860 8.1150 118.2953 60.1222 28.9910 178.1880 188 C 4.5770 8.3829 115.5530 63.2253 27.6403 176.1377 189 S 4.4073 8.0409 115.9082 61.3585 62.4980 176.4587 190 I 4.0000 8.0741 122.4117 63.1848 37.9596 176.5409 191 S 4.8185 8.2135 112.8596 56.1039 62.3739 172.6350 192 P 4.5009 0.0000 0.0000 65.4573 32.2127 179.0538 193 E 4.2196 8.2235 117.7780 58.2889 29.6845 178.0522 194 E 4.2633 7.8742 116.6818 57.7896 30.1305 176.9893 195 L 4.1809 7.5678 119.0785 52.8651 42.8072 176.0107 196 K 4.0068 8.1193 122.2862 58.2993 32.2971 177.1065 197 G 3.9803 9.0171 114.7404 45.2987 0.0000 173.7984 198 G 3.8368 8.2281 108.9241 44.7366 0.0000 174.6893 199 A 4.0979 9.1272 123.3620 54.5158 18.4234 178.8736 200 E 4.3304 8.0866 113.4705 57.0410 30.4182 176.6550 201 A 4.1116 7.3685 121.1842 51.6329 19.1535 176.5490 202 D 4.5498 8.5998 122.1485 52.9324 41.3539 175.3523 203 P 4.2388 0.0000 0.0000 65.1659 31.4607 177.4082 204 A 4.1405 8.3553 119.9197 53.4129 18.5901 177.6781 205 Q 4.0295 7.9390 116.3156 55.6681 28.8130 174.7623 206 P 4.3129 0.0000 0.0000 63.1596 31.3485 176.0208 *208 V 3.7288 7.6946 118.2425 63.7541 32.0334 174.8258 209 Q 4.6842 8.5695 127.6873 54.7640 30.9513 175.7765 210 S 4.6681 8.9053 115.8183 57.7602 64.5815 175.1973 211 A 4.0048 8.7615 122.2111 55.4357 17.8875 180.0434 212 V 3.5681 7.8069 116.0525 66.3869 31.4098 177.9665 213 E 4.0555 8.1092 116.8742 59.5503 29.3589 179.1579 214 I 4.2779 7.9473 119.1459 64.1610 37.3095 177.7593 215 L 4.4788 8.1009 117.5359 54.4954 41.9829 177.1267 216 R 3.9548 7.2635 120.8674 57.3143 30.5591 175.6012 217 D 4.3858 8.8895 124.6973 55.0506 38.9067 175.9244 218 L 3.9114 8.1196 120.5457 58.5833 42.2079 177.5448 219 D 4.3051 7.9631 118.1597 57.3675 40.8405 178.8484 220 V 3.5677 7.6312 118.5209 65.9018 31.6537 178.0950 221 R 3.8143 7.9388 115.7523 58.8827 29.2307 178.9033 222 I 3.7103 8.0115 121.0496 64.1322 37.1633 178.0988 223 A 3.9669 8.0319 121.6385 55.3579 18.1652 179.7419 224 T 3.8286 7.8537 114.2363 66.7252 68.4807 176.5256 225 L 3.9068 7.9682 122.0590 58.2240 42.0543 178.5483 226 N 3.9640 8.3396 116.7626 56.3902 38.2990 177.6126 227 R 3.9342 7.8450 119.2155 59.0137 30.2748 179.0628 228 W 4.3487 7.8316 114.6254 58.9061 28.2751 178.2913 229 A 3.1770 7.2382 122.1447 54.9249 17.5712 179.4253 230 E 3.7210 8.2106 117.1223 59.5091 29.4725 179.0482 231 H 4.0909 7.9404 118.5687 59.1945 29.8821 177.3737 232 V 3.9736 7.8743 119.9099 66.5562 31.4071 177.6412 233 Y 4.4893 7.9092 116.4408 61.0485 37.3343 178.3169 234 A 4.3142 8.0274 121.2096 55.2019 18.8125 179.4178 235 R 3.7621 8.0411 117.1915 59.2305 30.1373 178.5020 236 W 4.5005 8.7218 128.7693 60.5501 30.8021 177.6738 237 I 3.7489 8.4347 112.1806 62.9024 36.9131 178.0580 238 K 4.0611 7.7798 119.8973 59.0503 31.9064 178.2675 239 G 3.6930 7.5921 103.5151 44.1129 0.0000 173.8910 240 L 4.0799 6.8120 121.3467 55.0909 42.3317 177.3030 241 Q 4.2281 8.7639 122.7333 56.0615 29.4258 175.9911 242 R 4.6523 8.4495 123.9915 54.6483 33.7348 175.7049 243 E 4.0151 8.9558 120.5449 55.5941 30.2218 173.9627 244 G 3.7747 8.4523 113.9642 44.3890 0.0000 173.0080 245 H 4.2603 8.6490 121.2710 56.1190 29.3018 175.1573 246 H 4.7680 8.2781 119.1515 55.9501 29.5420 173.8752 247 H 4.5668 7.3912 113.2432 55.0819 30.4136 172.7046 248 H 4.7364 8.4541 116.7633 54.9655 30.3027 174.3707 249 H 5.0168 8.0719 112.7506 54.8329 28.2353 172.9861 250 H 4.5396 8.3303 118.8414 56.6507 28.6839 175.1218 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 2 S 8.33 4.38 0.00 3.84 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 3 L 7.86 3.97 0.00 1.71 1.56 0.94 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.24 4.36 0.00 1.70 1.92 0.00 1.87 0.00 0.00 1.85 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.45 7.81 5 P 0.00 4.59 0.00 2.18 2.20 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.98 0.00 6 V 8.34 4.71 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 1.55 0.00 0.00 1.17 0.00 0.00 *8 I 8.27 4.40 1.97 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.68 0.93 0.00 0.00 9 I 8.65 4.32 1.63 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.70 0.03 0.00 0.00 10 Q 8.53 4.48 0.00 1.97 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.61 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 11 F 8.70 4.73 0.00 3.20 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 12 S 7.51 4.56 0.00 3.90 3.80 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 13 A 8.53 4.12 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 14 S 7.95 4.53 0.00 4.07 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 15 E 7.70 4.74 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 1.74 1.84 0.00 16 G 7.78 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 17 P 0.00 4.39 0.00 2.12 2.05 0.00 3.80 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.12 0.00 18 G 7.53 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 0.00 0.00 0.00 19 H 9.36 4.13 0.00 3.37 3.50 0.00 5.79 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.14 3.66 0.00 2.72 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 21 G 7.82 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 0.00 0.00 0.00 22 D 7.78 4.34 0.00 2.80 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 23 F 8.20 3.98 0.00 3.18 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 24 L 7.65 3.67 0.00 1.42 1.76 0.29 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.11 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 G 7.86 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 0.00 0.00 0.00 27 E 7.43 4.16 0.00 1.78 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 28 H 7.50 3.92 0.00 3.24 3.36 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 R 7.79 4.43 0.00 1.77 1.96 0.00 3.33 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 39 S 8.11 3.89 0.00 4.06 4.02 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 40 D 7.80 4.46 0.00 2.67 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 41 P 0.00 4.44 0.00 2.04 1.99 0.00 3.66 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 2.03 2.11 0.00 42 L 8.20 4.40 0.00 1.67 1.61 1.01 0.99 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 43 P 0.00 4.40 0.00 2.19 2.06 0.00 3.78 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 2.01 1.98 0.00 44 A 8.65 4.00 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 45 E 7.89 4.52 0.00 2.04 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.49 0.00 46 I 8.43 3.73 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.11 1.00 0.00 0.00 47 R 8.43 4.19 0.00 1.90 1.99 0.00 3.40 0.00 0.00 3.43 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 48 D 8.20 4.57 0.00 2.78 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 C 7.93 5.15 0.00 3.31 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 50 S 8.92 4.37 0.00 4.02 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 7.66 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 9.42 5.27 0.00 1.84 1.66 0.98 0.96 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 53 A 8.01 5.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *56 G 7.91 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 57 G 7.82 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 0.00 0.00 0.00 0.00 58 P 0.00 4.32 0.00 2.12 1.95 0.00 3.83 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 1.95 1.88 0.00 *60 S 7.55 4.14 0.00 3.89 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 61 A 8.64 3.99 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 62 N 8.00 4.65 0.00 2.70 2.84 0.00 0.00 7.01 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 63 D 7.77 4.43 0.00 2.67 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.18 4.48 0.00 2.53 2.51 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 65 L 7.19 4.55 0.00 0.52 0.39 0.75 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 4.40 0.00 2.23 2.18 0.00 3.49 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 67 W 6.61 4.60 0.00 3.75 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *69 P 0.00 4.35 0.00 2.24 2.18 0.00 3.57 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 1.99 2.08 0.00 70 T 7.94 3.95 4.52 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 1.28 0.00 0.00 71 L 8.52 4.10 0.00 2.10 2.02 0.98 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.10 4.03 0.00 1.77 1.74 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 73 A 8.20 4.04 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 74 L 8.16 3.93 0.00 1.96 1.91 1.01 0.91 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 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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 0.00 0.00 0.00 110 E 8.30 4.40 0.00 1.74 1.69 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 2.15 2.14 0.00 111 I 8.22 4.19 1.31 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.22 -0.51 0.00 0.00 112 G 7.69 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 W 8.87 5.20 0.00 3.20 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 0.00 114 V 8.94 4.60 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 0.75 0.00 0.00 0.93 0.00 0.00 115 R 8.58 4.26 0.00 1.51 1.17 0.00 3.23 0.00 0.00 3.38 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 116 A 8.01 4.47 1.09 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 0.00 117 W 9.05 5.02 0.00 3.32 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 0.00 118 P 0.00 4.76 0.00 1.95 2.03 0.00 3.92 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.06 0.00 119 Q 8.29 3.85 0.00 1.77 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 7.44 0.00 0.00 0.00 0.00 0.00 2.11 2.26 0.00 120 H 7.77 2.58 0.00 2.62 2.22 0.00 5.66 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 6.62 4.72 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.97 0.00 0.00 122 P 0.00 4.59 0.00 2.38 2.44 0.00 3.84 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.17 0.00 123 Q 8.36 4.26 0.00 2.29 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.95 0.00 0.00 0.00 0.00 0.00 2.56 2.66 0.00 124 A 8.24 4.18 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.37 4.00 0.00 1.77 1.99 0.78 0.72 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 0.00 126 E 8.27 3.93 0.00 2.09 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.23 0.00 127 W 8.45 4.41 0.00 3.54 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 8.59 4.60 0.00 1.83 1.70 0.95 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 129 G 9.52 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 0.00 130 T 7.08 4.20 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 131 W 8.57 4.95 0.00 3.28 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 0.00 132 D 8.16 4.65 0.00 2.63 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 E 8.69 3.92 0.00 2.03 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.64 0.00 134 L 8.41 4.60 0.00 1.16 0.92 -0.03 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.64 5.08 0.00 1.96 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 2.60 2.56 0.00 136 L 9.11 5.18 0.00 1.69 1.70 1.05 0.91 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 0.00 137 F 8.83 4.47 0.00 2.67 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 0.00 138 E 7.67 4.85 0.00 1.69 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 2.12 2.30 0.00 139 W 8.56 5.34 0.00 3.38 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 0.00 140 H 9.15 5.09 0.00 3.29 3.36 0.00 5.46 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Y 9.00 4.67 0.00 2.89 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 0.00 142 Q 8.20 5.29 0.00 1.95 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.72 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 143 T 8.98 4.87 4.16 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 1.22 0.00 0.00 144 F 7.76 5.28 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 0.00 145 S 8.92 4.49 0.00 3.86 3.92 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 0.00 146 I 8.19 3.67 1.82 0.00 0.00 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 1.44 0.75 0.84 0.00 0.00 147 P 0.00 4.29 0.00 1.97 2.06 0.00 2.63 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.10 0.00 148 P 0.00 4.37 0.00 2.16 2.08 0.00 3.69 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 149 G 8.96 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 0.00 150 A 7.50 4.67 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 0.00 151 V 8.56 4.25 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 0.96 0.00 0.00 0.97 0.00 0.00 152 H 9.03 4.99 0.00 3.19 3.23 0.00 5.74 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 I 8.85 4.55 1.89 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 1.08 0.65 0.96 0.00 0.00 154 L 7.41 5.02 0.00 1.77 1.52 0.88 0.99 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 0.00 155 R 9.28 5.64 0.00 1.99 2.16 0.00 3.07 0.00 0.00 3.31 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.62 0.00 156 S 8.73 5.26 0.00 3.99 3.90 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 0.00 157 E 9.32 4.06 0.00 2.05 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 0.00 1.97 2.25 0.00 158 H 8.05 4.70 0.00 3.21 3.33 0.00 5.76 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 C 7.93 4.41 0.00 2.90 2.89 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 0.00 160 A 8.64 4.02 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 0.00 161 N 7.60 4.84 0.00 2.54 2.82 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 0.00 162 Q 8.78 4.34 0.00 2.13 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.64 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 163 A 8.15 5.43 0.72 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 0.00 0.00 164 Y 7.11 5.20 0.00 3.06 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 0.00 165 V 8.67 4.62 1.54 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 -0.57 0.00 0.00 0.80 0.00 0.00 166 L 8.55 4.83 0.00 1.79 1.58 0.97 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 167 D 9.54 4.47 0.00 2.95 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 0.00 168 D 8.63 4.79 0.00 2.90 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 0.00 169 L 8.38 4.80 0.00 1.79 1.22 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 170 H 8.03 5.48 0.00 3.14 3.30 0.00 5.61 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 I 8.65 4.41 0.95 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.89 0.93 0.00 0.00 172 G 7.29 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 0.00 0.00 0.00 173 F 8.92 5.47 0.00 2.96 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 0.00 174 Q 9.76 4.25 0.00 1.92 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.83 0.00 0.00 0.00 0.00 0.00 1.88 1.88 0.00 175 C 8.14 4.61 0.00 3.42 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 0.00 176 H 9.08 4.99 0.00 3.44 3.52 0.00 5.61 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 I 7.94 3.56 0.92 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 0.80 0.17 -0.05 0.00 0.00 178 E 7.79 4.25 0.00 2.32 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 0.00 2.31 2.27 0.00 *180 Q 8.19 3.93 0.00 1.90 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.09 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 181 A 8.41 4.08 1.28 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 0.00 182 H 7.91 4.36 0.00 3.29 3.50 0.00 5.49 0.00 0.00 0.00 0.00 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *184 V 8.02 3.48 2.04 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 0.98 0.00 0.00 0.18 0.00 0.00 185 R 7.89 3.99 0.00 2.07 1.99 0.00 3.20 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 186 E 8.29 4.02 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 187 W 8.11 4.29 0.00 3.47 2.89 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 0.00 188 C 8.38 4.58 0.00 3.27 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 0.00 189 S 8.04 4.41 0.00 4.08 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 0.00 190 I 8.07 4.00 1.88 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 1.44 0.67 0.86 0.00 0.00 191 S 8.21 4.82 0.00 3.84 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 0.00 192 P 0.00 4.50 0.00 2.32 2.46 0.00 3.94 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.05 0.00 193 E 8.22 4.22 0.00 2.08 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 202 D 8.60 4.55 0.00 2.71 2.59 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 0.00 0.00 0.00 203 P 0.00 4.24 0.00 2.07 2.11 0.00 3.73 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 204 A 8.36 4.14 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 0.00 205 Q 7.94 4.03 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.57 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 206 P 0.00 4.31 0.00 2.02 2.00 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.44 0.00 *208 V 7.69 3.73 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.74 0.00 0.00 209 Q 8.57 4.68 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.67 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 210 S 8.91 4.67 0.00 3.92 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 0.00 211 A 8.76 4.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 V 7.81 3.57 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 1.09 0.00 0.00 0.96 0.00 0.00 213 E 8.11 4.06 0.00 2.18 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 0.00 2.38 2.38 0.00 214 I 7.95 4.28 2.10 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.60 1.15 0.00 0.00 215 L 8.10 4.48 0.00 1.68 1.78 0.98 0.85 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 0.00 216 R 7.26 3.95 0.00 1.94 2.03 0.00 3.42 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 217 D 8.89 4.39 0.00 2.75 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 L 8.12 3.91 0.00 2.02 1.68 1.22 1.28 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 0.00 219 D 7.96 4.31 0.00 2.70 2.67 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 0.00 0.00 0.00 0.00 220 V 7.63 3.57 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.89 0.00 0.00 221 R 7.94 3.81 0.00 1.65 1.76 0.00 2.56 0.00 0.00 2.27 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.50 0.00 222 I 8.01 3.71 2.02 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.88 0.87 0.00 0.00 223 A 8.03 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 T 7.85 3.83 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 1.29 0.00 0.00 225 L 7.97 3.91 0.00 1.88 1.80 0.40 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 226 N 8.34 3.96 0.00 2.79 2.70 0.00 0.00 7.08 7.27 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 0.00 227 R 7.84 3.93 0.00 2.06 2.04 0.00 3.31 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.81 0.00 228 W 7.83 4.35 0.00 3.61 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 0.00 229 A 7.24 3.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 E 8.21 3.72 0.00 2.24 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 2.58 2.54 0.00 231 H 7.94 4.09 0.00 3.25 3.64 0.00 5.59 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 0.00 232 V 7.87 3.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 1.34 0.00 0.00 233 Y 7.91 4.49 0.00 1.96 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 0.00 0.00 0.00 234 A 8.03 4.31 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 R 8.04 3.76 0.00 1.62 1.82 0.00 2.73 0.00 0.00 2.65 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 236 W 8.72 4.50 0.00 3.99 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 0.00 237 I 8.43 3.75 1.98 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.62 1.47 0.00 0.00 238 K 7.78 4.06 0.00 1.80 1.86 0.00 1.58 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.72 7.81 239 G 7.59 3.69 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 0.00 0.00 0.00 240 L 6.81 4.08 0.00 1.48 1.56 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 241 Q 8.76 4.23 0.00 1.92 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 242 R 8.45 4.65 0.00 1.61 1.77 0.00 3.20 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.73 0.00 243 E 8.96 4.02 0.00 1.99 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 0.00 2.23 1.88 0.00 244 G 8.45 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 0.00 245 H 8.65 4.26 0.00 3.05 3.37 0.00 5.88 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 H 8.28 4.77 0.00 3.17 3.36 0.00 5.74 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 247 H 7.39 4.57 0.00 3.11 3.26 0.00 5.71 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 H 8.45 4.74 0.00 3.22 3.38 0.00 5.67 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 249 H 8.07 5.02 0.00 3.22 3.38 0.00 5.71 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 0.00 250 H 8.33 4.54 0.00 3.20 3.29 0.00 5.75 0.00 0.00 0.00 0.00 6.91 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.