NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.5099 8.1933 116.7418 58.3111 65.0930 172.0262 2 K 4.8599 8.5039 122.7837 54.3261 34.9788 173.3977 3 I 4.7884 8.5549 125.3859 59.7141 40.1288 173.9705 4 L 4.9174 8.7608 129.0936 53.4844 43.9407 175.0145 5 V 4.7548 9.2552 127.7648 61.3797 33.9178 174.4413 6 I 4.8579 8.0252 127.5178 59.4911 38.6748 175.6089 7 A 4.4376 8.6115 129.6843 51.5260 19.7786 175.7533 8 E 4.8744 9.3305 119.3084 55.2118 33.3405 174.0943 9 H 5.0946 8.1956 119.3693 54.9684 31.5532 172.4060 10 R 4.7159 9.5159 116.5555 57.8570 33.6253 174.4466 11 R 3.8024 10.0641 122.2783 58.4659 27.8670 175.8909 12 N 4.3887 8.1611 109.8941 54.1901 37.7250 174.4384 13 D 5.0567 8.3949 118.3239 52.3058 42.8792 175.3799 14 L 4.2067 8.3551 124.4661 54.5505 43.0030 176.4602 15 R 4.4495 8.4834 125.2813 54.5635 31.4986 176.0271 16 P 4.3301 0.0000 0.0000 65.2701 31.2698 179.2691 17 V 3.7594 7.7531 117.5123 64.1989 31.2084 178.1416 18 S 4.0980 8.3526 117.0135 61.8761 62.7791 176.4831 19 L 4.1743 7.9424 120.9084 57.5086 41.3682 178.4951 20 E 4.0592 8.3676 118.8474 58.8031 29.4357 179.2799 21 L 3.6854 8.1712 118.5521 57.8388 41.8728 179.9800 22 I 3.7373 7.6831 119.8383 64.3018 37.2180 178.4453 23 G 3.7846 7.9044 105.8534 47.9148 0.0000 175.1878 24 A 3.8349 8.1237 123.2115 54.9403 18.2876 179.7140 25 A 3.9015 8.3426 119.4380 55.2955 18.2111 179.6430 26 N 4.4909 8.3471 115.1837 56.0545 38.3830 177.4336 27 G 3.8472 7.9264 105.2825 46.1877 0.0000 174.6489 28 L 4.4301 7.0935 121.3130 55.7073 43.2949 176.9217 29 K 3.9258 7.3469 116.4570 57.5920 32.6775 176.8237 30 K 4.1318 8.5774 120.5016 57.7605 32.4097 176.9415 31 S 4.8024 8.2331 112.7557 55.7023 64.7916 174.9711 32 G 3.7637 8.7766 116.2586 48.9221 0.0000 175.6830 33 E 4.0766 8.8660 116.2897 59.0216 29.9061 182.1787 34 D 4.7994 7.1878 119.7283 54.6053 42.0757 177.4321 35 K 4.8674 9.0364 123.1761 53.4703 36.2891 176.1096 36 V 4.6832 8.8316 122.2390 61.3132 33.5869 174.5280 37 V 4.6718 8.7282 128.7964 61.4276 33.5031 174.3909 38 V 4.9198 8.5028 127.5308 61.0524 33.9975 174.0256 39 A 5.5074 9.3824 129.5083 50.0668 22.2640 175.2658 40 V 4.8498 8.6647 119.6909 59.9595 35.0147 174.5967 41 I 5.5668 8.9836 123.1250 57.0853 40.3592 175.0410 42 G 4.6370 8.8374 118.6036 44.5601 0.0000 173.4805 43 S 4.2276 8.4005 116.1504 60.3891 62.9345 175.7787 44 Q 4.4753 7.9427 119.3460 55.5539 29.1606 176.7668 45 A 4.3745 8.0862 121.7786 53.9848 18.7908 180.4988 46 D 4.3131 8.2127 116.1942 57.0843 41.2305 178.5489 47 A 3.6480 7.1092 120.8705 55.2030 17.8841 178.1886 48 F 4.7968 7.6317 112.2682 58.1402 39.7116 178.2618 49 V 3.7929 8.5952 116.4954 64.1205 31.7446 176.3835 50 P 4.1771 0.0000 0.0000 65.7154 31.3042 178.1457 51 A 4.2093 7.3623 120.3980 54.9901 18.2916 178.2701 52 L 4.5689 7.9657 113.2502 54.9569 42.5129 178.0635 53 S 4.6194 8.3206 118.8250 57.3048 61.5466 173.5170 54 V 4.8170 6.9966 115.1606 58.6175 35.4167 175.0107 55 N 4.2948 9.2832 121.1274 55.3896 39.1559 175.4316 56 G 4.0241 8.8729 112.2074 44.5060 0.0000 173.7858 57 V 3.8579 7.5232 119.8448 62.8586 32.1524 174.8456 58 D 4.7689 8.8963 126.8358 55.8866 42.5389 176.2969 59 E 4.8627 7.9973 116.0850 54.3011 34.4045 174.4330 60 L 5.1968 8.8800 123.6186 53.3992 45.5078 175.3467 61 V 4.8945 8.7498 125.4698 61.0587 35.3090 174.0097 62 V 4.8958 8.6394 126.9924 61.0626 34.3712 174.1831 63 V 4.7776 8.8798 129.9313 61.7651 34.3958 175.1301 64 K 4.8925 8.7165 132.6376 53.6237 31.4245 173.3906 65 G 3.8719 8.3241 116.4418 44.1764 0.0000 171.7922 66 S 4.2011 8.5730 113.3368 60.2669 63.4020 174.6392 67 S 4.7818 7.6715 114.5603 56.4032 65.1439 175.1164 68 I 3.7610 8.2266 121.4925 63.7345 37.1280 176.3022 69 D 5.0749 7.6707 118.4542 51.7912 43.3705 175.0353 70 F 3.8468 8.6935 121.0542 59.4380 39.5390 174.5963 71 D 4.1256 7.4062 124.9717 50.9177 44.8991 174.5728 72 P 4.0986 0.0000 0.0000 65.7814 31.4864 178.5077 73 D 4.3662 7.9604 118.4301 56.9600 40.9869 178.6501 74 V 3.5401 8.8580 119.3994 65.8764 31.5017 178.1278 75 F 3.6276 8.4314 117.8756 60.3837 38.6703 176.9480 76 E 4.1356 8.0141 118.1359 59.4938 29.4571 178.4762 77 A 3.9790 7.7160 120.3779 55.6448 18.4229 179.8027 78 S 4.0945 7.8936 112.8587 61.5155 63.0286 177.1443 79 V 3.7654 8.4703 121.3184 65.8248 31.0160 178.0986 80 S 4.1823 8.4000 112.7553 61.0182 62.5245 175.7895 81 A 4.1234 8.1004 123.5230 55.2760 18.2699 179.2725 82 L 3.9715 8.4411 117.8324 58.5224 41.8927 180.1263 83 I 3.7811 8.3087 119.3694 63.9285 36.7562 178.0032 84 A 4.2843 7.9628 120.4168 54.0196 18.6378 178.7775 85 A 4.2268 7.9109 117.7931 53.7179 19.0362 177.5615 86 H 4.4770 7.9048 114.3559 56.6178 30.1400 175.2475 87 N 4.1324 7.5974 115.6300 52.6885 34.7685 177.3680 88 P 4.6091 0.0000 0.0000 62.9060 33.0066 177.1128 89 S 4.5026 8.8449 115.5847 60.8621 64.4515 174.3369 90 V 4.8692 7.6587 119.4897 60.6068 35.1504 174.3798 91 V 4.7909 8.9720 127.2439 59.8955 34.1716 174.2492 92 L 4.9804 8.6387 125.2487 53.2442 43.4074 175.7048 93 L 5.0891 8.7079 123.6000 52.1437 45.2130 174.1873 94 P 4.6162 0.0000 0.0000 62.6871 32.3392 176.2344 95 H 4.5823 9.6141 125.7883 55.8770 29.6691 174.1696 96 S 4.5968 8.0193 119.5134 55.4523 66.2273 175.2542 97 V 3.4689 8.1683 119.0314 65.9626 31.2859 177.1902 98 D 3.6123 7.6590 118.3786 57.0929 40.5867 178.7290 99 S 4.1455 7.7034 115.4408 61.3344 62.6930 176.3365 100 L 4.1130 7.8655 120.4105 56.8584 41.5178 179.1088 101 G 4.0376 7.7764 105.7479 46.9542 0.0000 174.1045 102 Y 4.9298 8.9801 115.7014 55.9888 40.9581 177.2339 103 A 3.4220 7.8339 122.8354 54.9120 18.2591 179.1279 104 S 3.6306 7.9274 109.9437 59.9978 63.7149 176.0217 105 S 4.2118 8.7192 118.4367 61.4899 62.0154 175.6336 106 L 3.8075 7.7762 122.4329 58.2828 41.8928 178.8497 107 A 3.8782 7.2765 119.1027 54.9630 18.1571 179.4574 108 S 4.2147 7.6666 115.2854 61.6103 62.9591 176.4485 109 K 4.1009 7.4402 121.4502 56.1389 31.9550 181.1960 110 T 4.1846 7.3126 107.5352 60.1284 70.7262 175.5129 111 G 3.8608 7.7372 112.1485 44.1535 0.0000 172.2544 112 Y 5.0601 7.3370 118.9668 56.0926 41.3738 176.4705 113 G 3.8366 8.5622 109.4271 46.7087 0.0000 172.4886 114 F 6.2063 8.9719 123.8441 56.3719 42.4468 173.2198 115 A 4.6253 8.3800 126.3044 50.4686 22.9856 174.3813 116 T 4.9403 7.6862 108.1242 58.7837 71.8733 173.0253 117 D 4.1854 8.9937 121.4155 55.2940 40.0533 173.8918 118 V 4.3932 7.3852 119.2471 62.1987 33.3711 175.9043 119 Y 4.9886 8.3020 123.6498 56.5213 39.6113 175.1881 120 I 4.8065 7.3306 121.1878 59.8862 41.3027 174.3808 121 V 5.0761 8.5110 126.0841 60.1147 34.3029 174.3044 122 E 4.7211 8.6519 120.4407 55.9531 33.5182 173.0813 123 Y 4.8182 8.5195 117.8032 56.6983 39.6405 176.8096 124 Q 4.4810 9.3930 125.0904 54.6592 29.6291 178.6993 125 G 3.9423 8.7587 116.0984 46.7590 0.0000 171.8323 126 D 4.7823 9.4631 118.6757 53.5057 42.1755 174.8187 127 E 4.6576 7.9390 121.9023 53.8050 30.5996 174.7285 128 L 4.0413 8.6845 129.2417 55.1297 43.3246 175.3864 129 V 4.7561 8.7527 126.4827 61.0048 34.0776 174.1221 130 A 5.1530 9.0604 129.1436 50.4490 22.6583 174.9343 131 T 4.9986 8.8321 116.1609 61.7246 72.5393 173.5448 132 R 4.5809 8.3462 120.5635 54.4274 33.8617 174.3489 133 G 4.7385 8.9979 107.1210 45.7351 0.0000 172.5945 134 G 4.1546 8.2984 105.5807 43.8998 0.0000 171.8371 135 Y 3.6620 8.3067 115.0191 59.7232 35.6051 171.6250 136 N 4.1667 8.5892 113.6672 55.0647 37.7534 173.7316 137 Q 3.6904 7.8978 110.7485 56.9563 27.2121 175.5253 138 K 4.2970 8.0026 117.5216 57.8600 32.8307 176.9185 139 V 4.6855 7.3686 111.0695 59.8093 36.4404 174.0470 140 N 5.1832 8.7028 119.0595 52.4688 40.7155 174.9545 141 V 4.3995 8.5872 120.2266 61.2064 34.8266 173.6532 142 E 5.0691 8.8024 128.3150 54.6178 31.8865 175.2167 143 V 4.4785 8.5604 118.6485 59.9697 36.6803 173.5695 144 D 4.7064 7.9199 122.2017 49.9781 42.4779 175.5407 145 F 4.9048 7.8801 112.6013 55.1292 39.5250 172.6033 146 P 4.3065 0.0000 0.0000 64.2867 31.7282 177.2663 147 G 3.8412 8.9886 112.6541 46.6949 0.0000 173.0339 148 K 4.7109 7.6437 116.3290 54.3509 35.2433 177.3914 149 S 4.3950 8.8582 119.2213 60.5000 63.6805 174.4280 150 T 4.7862 7.7569 116.3026 61.4303 71.9678 173.2260 151 V 4.5172 8.2298 124.7180 60.9319 34.9381 174.0631 152 V 4.7403 8.8106 127.9935 61.2359 33.4664 174.3138 153 L 5.2405 9.0684 127.9201 53.0398 45.7014 175.5705 154 T 4.8669 8.4064 112.9554 60.1654 70.6148 173.6503 155 I 4.5977 8.6336 128.9437 60.2644 38.6121 175.6933 156 R 4.3372 8.5700 127.8890 56.0803 30.2970 174.7293 157 P 4.4251 0.0000 0.0000 64.3431 31.9189 176.5040 158 S 4.2759 10.4254 118.3112 58.7810 61.0008 169.6121 159 V 4.0085 7.7620 119.7167 64.1345 32.7471 176.0893 160 F 4.3618 8.1696 119.4671 57.1002 39.7359 175.7200 161 K 4.4386 8.5488 126.9298 52.5883 32.5738 173.1086 162 P 4.6171 0.0000 0.0000 61.7057 32.0008 176.2094 163 L 4.3439 8.2964 122.5486 54.7113 42.7604 176.6738 164 E 4.2582 8.5480 116.6382 56.0790 30.4058 177.9790 165 G 3.9643 8.7224 109.4606 43.6377 0.0000 172.2826 166 A 4.0478 8.1345 121.1127 51.9849 18.8532 176.8001 167 G 4.2740 8.8915 109.1034 44.2040 0.0000 172.9696 168 S 4.6928 8.1643 110.1377 55.8401 62.5040 172.0709 169 P 4.5570 0.0000 0.0000 63.0918 32.6562 178.1627 170 V 3.6546 8.0556 121.5339 63.8679 32.3193 175.2067 171 V 4.9153 8.3396 127.1588 61.9235 33.6210 174.9179 172 S 4.7344 8.4186 118.4503 57.0126 66.4169 173.4287 173 N 5.1761 8.7761 120.0872 53.6864 39.6525 174.6094 174 V 4.5620 8.5255 112.6423 60.4828 36.6310 173.3509 175 D 5.2284 8.5698 122.2342 52.8070 42.8713 176.2137 176 A 4.3750 8.3481 122.8798 50.4376 20.1994 175.5191 177 P 4.3068 0.0000 0.0000 63.2374 32.1029 177.3821 178 S 4.4657 8.2279 114.4820 57.6093 61.2262 174.8740 179 V 4.1087 7.4831 115.4421 60.3185 32.6835 176.8159 180 Q 4.3397 8.5063 124.2314 53.8448 28.9826 171.7685 181 S 4.6873 8.3828 117.6588 56.4068 63.8524 173.6163 182 R 4.4618 8.3810 123.5107 55.8832 29.8921 175.9094 183 S 4.7274 7.5108 111.7729 56.8042 66.2885 173.1194 184 Q 4.3469 8.1159 120.3630 54.7511 31.4683 173.2354 185 N 4.6395 8.6653 123.4084 52.8187 40.1322 174.2597 186 K 4.5989 7.9456 127.3727 56.4420 30.7823 178.2451 187 D 4.6299 8.4177 127.5017 54.5632 41.7189 175.3477 188 Y 4.5366 8.1274 119.3854 57.5023 38.9094 175.3263 189 V 4.4861 8.2754 122.0573 60.9594 34.4728 174.1617 190 E 4.6108 8.6247 125.9848 54.6752 31.2152 176.4349 191 V 4.0323 8.0905 128.2094 61.6334 30.7394 174.6719 *196 D 4.4352 7.8137 123.3744 53.2510 40.8925 175.8911 197 I 3.2328 7.2895 108.2049 64.6209 36.2696 170.5888 198 D 4.7318 7.6534 120.2477 52.3332 44.3246 175.3565 199 I 4.1485 8.3641 118.8347 59.8972 38.4528 175.9924 200 T 4.1451 8.4737 114.7861 62.8017 68.9285 176.4025 201 T 4.1576 7.7436 121.7339 63.2684 67.6404 173.8315 202 V 4.1691 7.9302 122.2137 62.2661 33.8101 174.0917 203 D 5.2576 8.5423 117.9625 54.5138 43.4442 176.4054 204 F 5.5366 8.0652 120.4676 56.8279 42.4063 173.4106 205 I 4.6255 9.4882 127.9323 59.5432 40.4237 174.6804 206 M 4.8552 7.7439 124.5319 53.4530 35.1611 174.7120 207 S 4.9116 8.5760 117.6586 56.2200 66.3159 172.3792 208 I 4.6125 9.2506 120.7184 59.0897 40.2305 174.6622 209 G 4.2889 8.2539 111.0965 43.8454 0.0000 173.3907 210 R 4.0503 8.8350 119.1860 59.1537 30.1907 178.1772 211 G 3.8707 8.1536 106.7908 48.6496 0.0000 174.7107 212 I 3.8163 7.2902 112.7817 62.0391 37.5299 176.5799 213 G 4.4464 9.9401 114.2425 45.3905 0.0000 173.3641 214 E 4.3555 7.4156 117.6323 53.0324 33.7696 175.8544 215 E 2.5400 7.6541 121.3435 58.9801 29.2530 179.0010 216 T 3.7516 7.5734 109.3701 64.9596 67.9960 175.1408 217 N 4.7102 8.4929 117.8118 54.2604 38.7916 176.9240 218 V 3.5818 7.6132 120.6170 66.2617 31.5357 177.0062 219 E 3.9161 7.8398 118.2563 59.5452 29.4536 178.8037 220 Q 3.9390 7.5795 117.0267 59.8620 28.3606 179.2763 221 F 4.2526 8.9954 119.9540 59.6873 38.8032 177.6230 222 R 4.0460 8.2306 118.7559 59.2425 29.5061 178.1937 223 E 4.0344 8.0082 118.7321 59.1245 29.8085 177.7723 224 L 3.8591 7.8800 119.9835 58.4590 42.0174 178.6913 225 A 4.0092 8.5163 120.4491 55.5661 18.1306 178.7852 226 D 4.3927 8.1894 118.2621 59.1697 41.0355 179.3953 227 E 3.8648 10.2984 115.9100 62.4680 29.7035 181.0939 228 A 4.4918 9.0695 123.9003 53.5338 18.7188 178.5130 229 G 4.1279 8.3732 105.3725 45.2272 0.0000 172.8397 230 A 4.7306 7.2999 120.0007 48.9632 20.4558 177.8529 231 T 3.7896 8.1587 118.0974 63.7100 69.5703 173.2828 232 L 4.4048 8.4604 129.4359 55.3036 43.0416 175.4543 233 C 5.2328 8.5579 124.2174 58.8852 32.4491 172.0263 234 C 5.2126 8.6183 112.8121 58.2552 33.1400 173.3850 235 S 5.0458 8.5271 115.0366 56.9376 65.0068 175.3564 236 R 3.9467 8.5492 119.1112 59.0720 29.5011 176.4073 237 P 4.4157 0.0000 0.0000 64.9980 31.5804 178.1733 238 I 3.4861 7.4653 119.3942 63.6247 37.1026 177.6460 239 A 4.2442 7.7433 122.0558 54.7694 18.0340 179.0135 240 D 4.4107 8.1015 112.0493 55.2205 40.5911 176.7020 241 A 4.3033 7.1116 120.1612 50.4785 20.1473 176.4736 242 G 3.9572 7.6397 104.0225 47.2688 0.0000 174.7345 243 W 4.9590 7.6495 114.6564 55.2965 29.8153 176.2920 244 L 4.4875 7.6274 115.9144 53.4269 44.5205 171.8026 245 P 4.2068 0.0000 0.0000 63.0839 31.7018 177.4330 246 K 3.7265 9.1024 124.7733 60.0876 32.1334 179.0382 247 S 4.4629 8.0663 112.7688 59.6537 62.3389 179.4605 248 R 4.7848 8.4608 118.9607 56.8325 32.3417 174.1168 249 Q 4.9860 7.9358 121.6741 54.5220 30.7536 174.4831 250 V 4.3360 8.6199 127.7900 61.7214 32.5266 175.5573 251 G 3.8353 7.7749 113.8196 46.4018 0.0000 172.4087 252 Q 4.2000 8.4547 121.1253 58.1951 29.0070 176.9241 253 S 4.8667 7.8405 111.7580 57.2137 63.9887 173.6330 254 G 3.9620 7.5608 109.0501 46.8967 0.0000 173.0492 255 K 4.4713 8.6965 120.2885 55.6515 34.3173 177.0062 256 V 3.9384 8.1590 123.3948 61.4864 31.8225 175.8292 257 V 3.9626 8.1685 122.3351 61.7858 29.3823 177.5318 258 G 3.7653 8.2914 111.8977 47.2555 0.0000 172.1049 259 S 4.7087 7.8797 114.5783 58.0294 64.1696 172.8463 260 C 4.7157 8.2213 124.1165 60.1594 30.2063 173.9144 261 K 4.7094 9.3043 129.1168 55.0323 34.9367 172.6350 262 L 5.0811 7.9025 120.4247 54.7210 45.5751 173.6723 263 Y 5.0771 9.2580 127.5480 55.7575 42.2062 174.0650 264 V 4.8658 8.6017 126.5408 61.2007 34.2046 173.8130 265 A 4.8617 9.4438 131.4251 51.1196 20.5701 175.5421 266 M 4.8496 8.4974 122.3681 54.0565 35.4111 176.9092 267 G 3.4714 8.5988 110.1392 46.0614 0.0000 173.0829 268 I 4.4889 6.5903 121.0387 59.7643 38.0435 177.6627 269 S 3.6289 7.8530 120.8245 60.4446 64.2552 174.0016 270 G 3.7107 7.2770 103.7021 45.9019 0.0000 173.1521 271 S 4.2566 7.2341 114.3138 58.2863 65.2884 175.4812 272 I 3.6009 8.0599 122.2564 64.5571 36.7678 178.3906 273 Q 3.9256 8.0605 118.3630 59.5441 28.5271 178.6662 274 H 4.0870 8.7053 119.1435 59.5935 29.7951 177.1751 275 M 3.9712 8.1110 120.2858 58.1849 31.5264 178.2832 276 A 3.8664 8.3787 121.7593 54.7701 18.6905 178.4504 277 G 3.8814 8.2943 104.2315 46.5441 0.0000 174.9819 278 M 4.5612 7.4250 114.1137 54.1127 32.8085 176.8319 279 K 3.7552 7.9768 119.3725 58.9074 32.6722 176.5037 280 H 4.7632 7.4730 112.9057 55.0589 29.7947 174.3990 281 V 3.6333 7.5632 121.9886 62.2379 31.6936 174.3395 282 P 4.3225 0.0000 0.0000 65.1339 31.7546 176.0154 283 T 4.6043 7.6206 113.7292 61.8639 71.4494 172.5441 284 I 5.2099 8.3676 127.2347 59.4697 40.2049 174.7701 285 I 5.2820 8.9117 126.8283 59.4943 40.2427 174.3418 286 A 5.2058 9.3276 128.5186 50.1114 22.2303 175.4154 287 V 5.4617 8.5932 120.5822 60.2383 34.5118 173.8215 288 N 5.2408 8.7511 126.2399 51.9346 42.4035 174.8321 289 T 4.0827 8.8231 113.8040 62.4263 69.3098 173.3806 290 D 4.8866 8.6162 123.5235 52.1862 42.0452 174.8284 291 P 4.4543 0.0000 0.0000 64.8240 31.6524 177.1587 292 G 4.0938 7.9849 106.1732 45.4205 0.0000 173.4917 293 A 4.2456 8.1559 123.3698 51.2232 19.1515 180.1507 294 S 4.1116 8.6369 118.8027 61.3129 62.8755 176.7088 295 I 3.5156 7.6792 121.6299 64.0070 37.6882 177.7372 296 F 4.5284 8.1116 118.8776 60.0540 38.5549 176.9284 297 T 4.3549 8.0394 108.3978 62.6661 69.0692 174.9980 298 I 4.3018 7.4659 113.1971 60.3667 38.9429 175.8353 299 A 4.2499 7.3812 123.2172 52.0397 18.8133 177.4806 300 K 4.1113 8.5645 121.3394 59.1814 33.0581 176.6324 301 Y 4.9073 8.3753 115.9392 56.6238 42.7551 174.4689 302 G 4.8095 8.7376 107.8596 44.9124 0.0000 171.8693 303 I 4.6045 9.2214 122.8629 59.4147 40.7355 175.2279 304 V 5.4058 8.8499 127.7355 61.0567 30.2132 174.4114 305 A 4.8845 8.0423 125.8049 49.1822 23.1078 175.0081 306 D 4.4412 8.6233 118.8710 54.0604 42.1903 177.6081 307 I 3.8598 8.0108 119.4027 63.7813 37.7263 178.1839 308 F 4.3738 7.7165 119.1895 60.7957 38.3455 176.7251 309 D 4.4500 8.5041 118.0569 57.9833 40.6767 179.5251 310 I 3.8231 7.7869 119.6769 64.1074 37.0258 178.0460 311 E 3.8638 8.4669 120.9336 59.0900 29.4966 178.5305 312 E 3.8215 8.3087 117.5803 59.6803 29.6583 178.3766 313 E 3.8728 7.7747 120.0084 58.8369 29.3127 178.6509 314 L 4.1372 8.0290 121.7420 58.0004 42.4810 179.5108 315 K 4.1384 8.2361 123.7207 60.2743 31.7150 182.1417 316 A 3.6340 8.1141 115.1387 55.0180 18.4807 178.6336 317 Q 3.9753 7.1164 121.9908 57.8192 29.6390 178.0164 318 L 4.3661 7.5735 123.4395 54.8384 41.9994 176.2974 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 1 S 8.19 4.51 0.00 3.96 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 2 K 8.50 4.86 0.00 1.76 1.67 0.00 1.81 0.00 0.00 1.87 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.54 7.81 3 I 8.55 4.79 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 1.13 0.80 0.93 0.00 0.00 4 L 8.76 4.92 0.00 1.69 1.47 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 5 V 9.26 4.75 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 0.89 0.00 0.00 0.89 0.00 0.00 6 I 8.03 4.86 1.99 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 1.22 1.18 1.09 0.00 0.00 7 A 8.61 4.44 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 E 9.33 4.87 0.00 1.95 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 2.13 2.16 0.00 9 H 8.20 5.09 0.00 2.93 2.54 0.00 5.81 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 R 9.52 4.72 0.00 1.74 1.71 0.00 3.17 0.00 0.00 3.04 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.52 0.00 11 R 10.06 3.80 0.00 1.78 1.92 0.00 3.36 0.00 0.00 2.95 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.78 0.00 12 N 8.16 4.39 0.00 2.90 2.94 0.00 0.00 7.13 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 13 D 8.39 5.06 0.00 2.67 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.36 4.21 0.00 1.53 1.57 0.75 0.92 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 15 R 8.48 4.45 0.00 1.86 1.78 0.00 3.13 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 16 P 0.00 4.33 0.00 2.14 2.10 0.00 3.57 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 17 V 7.75 3.76 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 0.81 0.00 0.00 0.94 0.00 0.00 18 S 8.35 4.10 0.00 3.88 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 19 L 7.94 4.17 0.00 1.89 1.72 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.37 4.06 0.00 2.28 2.03 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 2.80 2.44 0.00 21 L 8.17 3.69 0.00 1.86 1.65 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.68 3.74 2.04 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.70 0.91 0.00 0.00 23 G 7.90 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 24 A 8.12 3.83 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.34 3.90 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 26 N 8.35 4.49 0.00 2.78 2.89 0.00 0.00 6.88 8.14 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 27 G 7.93 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 0.00 0.00 0.00 28 L 7.09 4.43 0.00 1.85 1.86 0.86 0.53 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 29 K 7.35 3.93 0.00 1.93 1.86 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.58 1.58 7.81 30 K 8.58 4.13 0.00 1.63 1.80 0.00 1.41 0.00 0.00 1.33 0.00 0.00 2.66 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.88 0.89 7.81 31 S 8.23 4.80 0.00 3.79 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 32 G 8.78 3.76 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 0.00 0.00 0.00 33 E 8.87 4.08 0.00 1.96 1.87 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 2.26 2.15 0.00 34 D 7.19 4.80 0.00 2.67 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 35 K 9.04 4.87 0.00 1.39 1.62 0.00 1.77 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.25 1.21 7.81 36 V 8.83 4.68 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 0.85 0.00 0.00 0.97 0.00 0.00 37 V 8.73 4.67 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 0.67 0.00 0.00 0.88 0.00 0.00 38 V 8.50 4.92 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 0.90 0.00 0.00 0.92 0.00 0.00 39 A 9.38 5.51 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.66 4.85 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 0.81 0.00 0.00 1.01 0.00 0.00 41 I 8.98 5.57 1.03 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.31 0.46 0.00 0.00 42 G 8.84 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.40 4.23 0.00 4.03 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 Q 7.94 4.48 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.00 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 45 A 8.09 4.37 1.50 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 46 D 8.21 4.31 0.00 2.65 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 47 A 7.11 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 F 7.63 4.80 0.00 3.32 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 49 V 8.60 3.79 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.94 0.00 0.00 50 P 0.00 4.18 0.00 2.20 2.13 0.00 3.74 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 2.12 2.11 0.00 51 A 7.36 4.21 1.50 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 52 L 7.97 4.57 0.00 1.81 1.72 0.95 0.93 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 53 S 8.32 4.62 0.00 3.91 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 54 V 7.00 4.82 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 0.91 0.00 0.00 0.94 0.00 0.00 55 N 9.28 4.29 0.00 2.53 2.89 0.00 0.00 7.25 7.86 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 56 G 8.87 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 0.00 0.00 0.00 57 V 7.52 3.86 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 0.81 0.00 0.00 1.04 0.00 0.00 58 D 8.90 4.77 0.00 2.91 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 59 E 8.00 4.86 0.00 1.85 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 60 L 8.88 5.20 0.00 1.67 1.47 0.98 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.75 4.89 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 0.90 0.00 0.00 0.91 0.00 0.00 62 V 8.64 4.90 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.95 0.00 0.00 63 V 8.88 4.78 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 0.80 0.00 0.00 0.89 0.00 0.00 64 K 8.72 4.89 0.00 1.60 1.63 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.33 1.26 7.81 65 G 8.32 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 66 S 8.57 4.20 0.00 3.97 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 67 S 7.67 4.78 0.00 3.99 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 68 I 8.23 3.76 1.94 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 1.45 1.55 1.00 0.00 0.00 69 D 7.67 5.07 0.00 2.82 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 70 F 8.69 3.85 0.00 2.64 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 71 D 7.41 4.13 0.00 2.47 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 72 P 0.00 4.10 0.00 2.38 2.49 0.00 3.50 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 73 D 7.96 4.37 0.00 2.85 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.86 3.54 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 0.96 0.00 0.00 0.94 0.00 0.00 75 F 8.43 3.63 0.00 2.78 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 0.00 0.00 0.00 76 E 8.01 4.14 0.00 2.29 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 2.39 2.48 0.00 77 A 7.72 3.98 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 78 S 7.89 4.09 0.00 3.71 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 79 V 8.47 3.77 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 1.20 0.00 0.00 1.15 0.00 0.00 80 S 8.40 4.18 0.00 3.95 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.10 4.12 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 L 8.44 3.97 0.00 1.79 1.77 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.31 3.78 2.04 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.91 0.92 0.00 0.00 84 A 7.96 4.28 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 85 A 7.91 4.23 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 86 H 7.90 4.48 0.00 3.13 3.29 0.00 5.70 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 N 7.60 4.13 0.00 2.90 2.93 0.00 0.00 6.95 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 P 0.00 4.61 0.00 2.11 2.05 0.00 3.89 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.90 0.00 89 S 8.84 4.50 0.00 3.95 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 7.66 4.87 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 1.03 0.00 0.00 0.96 0.00 0.00 91 V 8.97 4.79 2.03 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 0.73 0.00 0.00 0.91 0.00 0.00 92 L 8.64 4.98 0.00 1.56 1.53 0.79 0.14 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 93 L 8.71 5.09 0.00 1.70 1.52 0.97 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 4.62 0.00 1.91 1.96 0.00 3.68 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.08 0.00 95 H 9.61 4.58 0.00 3.17 3.26 0.00 5.92 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 S 8.02 4.60 0.00 3.88 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 97 V 8.17 3.47 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.87 0.00 0.00 98 D 7.66 3.61 0.00 2.53 1.75 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 99 S 7.70 4.15 0.00 3.83 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 0.00 100 L 7.87 4.11 0.00 1.54 1.72 0.87 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 101 G 7.78 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 8.98 4.93 0.00 3.24 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 0.00 103 A 7.83 3.42 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 0.00 104 S 7.93 3.63 0.00 4.08 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 0.00 105 S 8.72 4.21 0.00 3.91 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 0.00 106 L 7.78 3.81 0.00 1.89 1.79 1.07 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 107 A 7.28 3.88 0.33 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 0.00 108 S 7.67 4.21 0.00 4.00 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 0.00 109 K 7.44 4.10 0.00 1.82 1.71 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 1.24 7.81 110 T 7.31 4.18 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 0.88 0.00 0.00 111 G 7.74 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 0.00 112 Y 7.34 5.06 0.00 2.77 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 0.00 113 G 8.56 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 0.00 114 F 8.97 6.21 0.00 2.86 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 0.00 115 A 8.38 4.63 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 0.00 116 T 7.69 4.94 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 0.79 0.00 0.00 117 D 8.99 4.19 0.00 2.11 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 0.00 118 V 7.39 4.39 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 0.99 0.00 0.00 0.88 0.00 0.00 119 Y 8.30 4.99 0.00 2.86 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 I 7.33 4.81 1.74 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.27 0.88 0.00 0.00 121 V 8.51 5.08 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 0.72 0.00 0.00 0.90 0.00 0.00 122 E 8.65 4.72 0.00 2.00 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 2.17 2.25 0.00 123 Y 8.52 4.82 0.00 2.90 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 0.00 124 Q 9.39 4.48 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.73 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 125 G 8.76 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 0.00 0.00 0.00 126 D 9.46 4.78 0.00 2.66 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 0.00 127 E 7.94 4.66 0.00 2.06 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 2.22 2.28 0.00 128 L 8.68 4.04 0.00 1.61 1.64 0.25 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 129 V 8.75 4.76 2.02 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 0.85 0.00 0.00 0.88 0.00 0.00 130 A 9.06 5.15 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 T 8.83 5.00 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 0.98 0.00 0.00 132 R 8.35 4.58 0.00 1.97 1.91 0.00 2.69 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.54 0.00 133 G 9.00 4.74 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 0.00 0.00 0.00 134 G 8.30 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 Y 8.31 3.66 0.00 3.24 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 0.00 136 N 8.59 4.17 0.00 2.79 2.85 0.00 0.00 7.33 7.08 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 0.00 137 Q 7.90 3.69 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.70 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 138 K 8.00 4.30 0.00 2.01 1.90 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.64 7.81 139 V 7.37 4.69 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 0.95 0.00 0.00 1.09 0.00 0.00 140 N 8.70 5.18 0.00 2.59 2.69 0.00 0.00 6.61 7.68 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 0.00 141 V 8.59 4.40 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.94 0.00 0.00 142 E 8.80 5.07 0.00 1.92 1.71 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 2.19 2.21 0.00 143 V 8.56 4.48 1.73 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 0.49 0.00 0.00 0.72 0.00 0.00 144 D 7.92 4.71 0.00 2.52 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 0.00 145 F 7.88 4.90 0.00 3.16 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 0.00 146 P 0.00 4.31 0.00 2.20 2.10 0.00 3.89 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.98 0.00 147 G 8.99 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 0.00 148 K 7.64 4.71 0.00 1.84 1.93 0.00 1.99 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.69 1.68 7.81 149 S 8.86 4.39 0.00 3.88 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 0.00 150 T 7.76 4.79 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 151 V 8.23 4.52 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 -0.43 0.00 0.00 0.62 0.00 0.00 152 V 8.81 4.74 2.32 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 1.02 0.00 0.00 0.84 0.00 0.00 153 L 9.07 5.24 0.00 1.46 1.43 0.84 0.46 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 0.00 154 T 8.41 4.87 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 0.00 155 I 8.63 4.60 1.86 0.00 0.00 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 1.16 1.02 0.98 0.00 0.00 156 R 8.57 4.34 0.00 2.03 1.96 0.00 3.14 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 157 P 0.00 4.43 0.00 2.08 1.97 0.00 3.77 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 158 S 10.43 4.28 0.00 3.85 4.11 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 0.00 0.00 0.00 0.00 159 V 7.76 4.01 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 0.19 0.00 0.00 0.86 0.00 0.00 160 F 8.17 4.36 0.00 3.09 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 0.00 161 K 8.55 4.44 0.00 1.77 1.60 0.00 1.81 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.32 0.99 7.81 162 P 0.00 4.62 0.00 2.19 2.11 0.00 3.75 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 163 L 8.30 4.34 0.00 1.67 1.65 0.94 0.88 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 0.00 164 E 8.55 4.26 0.00 1.98 1.73 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 2.19 1.87 0.00 165 G 8.72 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 A 8.13 4.05 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 0.00 167 G 8.89 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 0.00 0.00 0.00 0.00 168 S 8.16 4.69 0.00 3.93 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 0.00 169 P 0.00 4.56 0.00 2.10 2.18 0.00 3.86 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 2.00 1.98 0.00 170 V 8.06 3.65 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.93 0.00 0.00 171 V 8.34 4.92 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 0.88 0.00 0.00 0.98 0.00 0.00 172 S 8.42 4.73 0.00 3.91 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 0.00 173 N 8.78 5.18 0.00 2.63 2.78 0.00 0.00 6.80 7.68 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 0.00 174 V 8.53 4.56 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 0.67 0.00 0.00 0.92 0.00 0.00 175 D 8.57 5.23 0.00 2.53 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 0.00 176 A 8.35 4.38 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 P 0.00 4.31 0.00 2.03 2.05 0.00 3.63 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.11 0.00 178 S 8.23 4.47 0.00 3.84 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 0.00 179 V 7.48 4.11 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 0.66 0.00 0.00 0.90 0.00 0.00 180 Q 8.51 4.34 0.00 2.07 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.86 0.00 0.00 0.00 0.00 0.00 2.24 1.90 0.00 181 S 8.38 4.69 0.00 3.77 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 0.00 182 R 8.38 4.46 0.00 1.86 1.91 0.00 3.15 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.53 0.00 183 S 7.51 4.73 0.00 3.89 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 0.00 184 Q 8.12 4.35 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.98 0.00 0.00 0.00 0.00 0.00 2.21 2.40 0.00 185 N 8.67 4.64 0.00 2.66 2.58 0.00 0.00 7.10 7.61 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 0.00 186 K 7.95 4.60 0.00 1.68 1.18 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.36 7.81 187 D 8.42 4.63 0.00 2.64 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 0.00 188 Y 8.13 4.54 0.00 2.92 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 0.00 189 V 8.28 4.49 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 0.83 0.00 0.00 0.96 0.00 0.00 190 E 8.62 4.61 0.00 1.94 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 191 V 8.09 4.03 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 0.94 0.00 0.00 *196 D 7.81 4.44 0.00 2.76 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 0.00 197 I 7.29 3.23 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.08 0.91 0.00 0.00 198 D 7.65 4.73 0.00 2.57 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 0.00 199 I 8.36 4.15 1.87 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 1.48 0.66 0.91 0.00 0.00 200 T 8.47 4.15 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 201 T 7.74 4.16 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 202 V 7.93 4.17 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 0.80 0.00 0.00 0.99 0.00 0.00 203 D 8.54 5.26 0.00 2.78 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 0.00 204 F 8.07 5.54 0.00 2.93 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 I 9.49 4.63 1.46 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 1.19 0.74 0.59 0.00 0.00 206 M 7.74 4.86 0.00 1.73 1.72 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.42 0.00 207 S 8.58 4.91 0.00 3.33 3.32 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 0.00 208 I 9.25 4.61 1.65 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.84 0.18 0.00 0.00 209 G 8.25 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 0.00 0.00 0.00 0.00 210 R 8.83 4.05 0.00 1.83 1.96 0.00 3.24 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 211 G 8.15 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 0.00 212 I 7.29 3.82 2.05 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 0.77 0.47 0.00 0.00 213 G 9.94 4.45 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 0.00 214 E 7.42 4.36 0.00 1.83 1.61 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 2.28 2.37 0.00 215 E 7.65 2.54 0.00 1.16 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 1.99 1.67 0.00 216 T 7.57 3.75 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 1.11 0.00 0.00 217 N 8.49 4.71 0.00 2.95 3.25 0.00 0.00 6.54 7.58 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 0.00 218 V 7.61 3.58 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 1.08 0.00 0.00 1.03 0.00 0.00 219 E 7.84 3.92 0.00 2.25 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 2.31 2.39 0.00 220 Q 7.58 3.94 0.00 2.09 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.59 1.88 0.00 221 F 9.00 4.25 0.00 3.19 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 R 8.23 4.05 0.00 1.93 2.02 0.00 3.10 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 223 E 8.01 4.03 0.00 2.27 1.95 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 2.35 2.35 0.00 224 L 7.88 3.86 0.00 1.88 1.89 1.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 225 A 8.52 4.01 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 0.00 226 D 8.19 4.39 0.00 2.91 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 0.00 227 E 10.30 3.86 0.00 2.07 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.24 0.00 228 A 9.07 4.49 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 0.00 0.00 0.00 0.00 0.00 229 G 8.37 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 0.00 0.00 0.00 230 A 7.30 4.73 -0.40 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 0.00 0.00 0.00 231 T 8.16 3.79 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 1.17 0.00 0.00 232 L 8.46 4.40 0.00 1.60 1.54 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 233 C 8.56 5.23 0.00 2.76 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 0.00 234 C 8.62 5.21 0.00 3.11 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 0.00 235 S 8.53 5.05 0.00 3.95 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 0.00 236 R 8.55 3.95 0.00 1.87 1.93 0.00 3.14 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 237 P 0.00 4.42 0.00 1.95 2.00 0.00 3.63 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.10 0.00 238 I 7.47 3.49 2.03 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 1.57 1.11 1.00 0.00 0.00 239 A 7.74 4.24 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 D 8.10 4.41 0.00 2.57 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 0.00 241 A 7.11 4.30 0.28 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 0.00 242 G 7.64 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 W 7.65 4.96 0.00 3.36 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 0.00 244 L 7.63 4.49 0.00 1.70 1.53 0.95 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 245 P 0.00 4.21 0.00 2.17 2.03 0.00 3.66 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.16 0.00 246 K 9.10 3.73 0.00 1.80 1.89 0.00 1.64 0.00 0.00 1.84 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.45 7.81 247 S 8.07 4.46 0.00 3.63 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 0.00 248 R 8.46 4.78 0.00 1.74 1.87 0.00 3.42 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 249 Q 7.94 4.99 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.95 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 250 V 8.62 4.34 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 0.67 0.00 0.00 1.11 0.00 0.00 251 G 7.77 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 0.00 0.00 0.00 252 Q 8.45 4.20 0.00 1.94 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 7.38 0.00 0.00 0.00 0.00 0.00 2.34 2.26 0.00 253 S 7.84 4.87 0.00 3.96 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 0.00 254 G 7.56 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 255 K 8.70 4.47 0.00 1.69 1.72 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.52 7.81 256 V 8.16 3.94 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 0.77 0.00 0.00 0.94 0.00 0.00 257 V 8.17 3.96 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.10 0.00 0.00 258 G 8.29 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 0.00 259 S 7.88 4.71 0.00 4.01 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 0.00 260 C 8.22 4.72 0.00 3.20 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 0.00 261 K 9.30 4.71 0.00 1.39 1.74 0.00 1.85 0.00 0.00 1.57 0.00 0.00 2.70 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.25 1.21 7.81 262 L 7.90 5.08 0.00 1.74 1.55 1.07 0.32 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 0.00 263 Y 9.26 5.08 0.00 3.19 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 0.00 264 V 8.60 4.87 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 0.95 0.00 0.00 1.09 0.00 0.00 265 A 9.44 4.86 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 266 M 8.50 4.85 0.00 1.82 1.77 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 2.51 2.48 0.00 267 G 8.60 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 268 I 6.59 4.49 1.76 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 1.18 1.45 0.68 0.00 0.00 269 S 7.85 3.63 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 0.00 270 G 7.28 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 0.00 271 S 7.23 4.26 0.00 4.05 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 0.00 272 I 8.06 3.60 1.82 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 1.56 0.77 0.83 0.00 0.00 273 Q 8.06 3.93 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 274 H 8.71 4.09 0.00 3.17 3.25 0.00 5.79 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 0.00 275 M 8.11 3.97 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.48 0.00 276 A 8.38 3.87 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 0.00 277 G 8.29 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 0.00 0.00 0.00 278 M 7.42 4.56 0.00 1.46 1.33 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.87 0.00 279 K 7.98 3.76 0.00 1.79 2.07 0.00 1.49 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.38 7.81 280 H 7.47 4.76 0.00 3.25 3.39 0.00 5.53 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 0.00 281 V 7.56 3.63 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 0.90 0.00 0.00 0.73 0.00 0.00 282 P 0.00 4.32 0.00 2.24 2.19 0.00 3.89 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 283 T 7.62 4.60 4.44 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 1.38 0.00 0.00 284 I 8.37 5.21 2.00 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 1.37 1.23 0.98 0.00 0.00 285 I 8.91 5.28 1.98 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 1.31 0.94 1.00 0.00 0.00 286 A 9.33 5.21 1.16 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 0.00 0.00 287 V 8.59 5.46 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 0.85 0.00 0.00 1.00 0.00 0.00 288 N 8.75 5.24 0.00 2.53 2.47 0.00 0.00 6.89 7.22 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 0.00 289 T 8.82 4.08 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 290 D 8.62 4.89 0.00 2.69 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 291 P 0.00 4.45 0.00 2.08 2.04 0.00 3.78 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 292 G 7.98 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 0.00 0.00 0.00 293 A 8.16 4.25 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 0.00 294 S 8.64 4.11 0.00 4.00 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 0.00 295 I 7.68 3.52 1.85 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 1.35 1.10 0.27 0.00 0.00 296 F 8.11 4.53 0.00 3.36 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 0.00 297 T 8.04 4.35 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 298 I 7.47 4.30 1.82 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.87 0.87 0.00 0.00 299 A 7.38 4.25 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 0.00 300 K 8.56 4.11 0.00 1.79 2.10 0.00 1.99 0.00 0.00 1.89 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.78 1.23 7.81 301 Y 8.38 4.91 0.00 3.07 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 0.00 302 G 8.74 4.81 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 0.00 0.00 0.00 303 I 9.22 4.60 1.97 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 1.15 0.68 nan 0.00 0.00 304 V 8.85 5.41 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 0.79 0.00 0.00 305 A 8.04 4.88 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 306 D 8.62 4.44 0.00 2.74 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 307 I 8.01 3.86 1.90 0.00 0.00 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 1.33 0.20 0.86 0.00 0.00 308 F 7.72 4.37 0.00 3.40 3.09 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 0.00 309 D 8.50 4.45 0.00 2.76 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 0.00 310 I 7.79 3.82 1.91 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 1.52 0.92 0.94 0.00 0.00 311 E 8.47 3.86 0.00 1.59 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 2.09 1.86 0.00 312 E 8.31 3.82 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.32 0.00 313 E 7.77 3.87 0.00 2.16 2.31 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 2.32 2.39 0.00 314 L 8.03 4.14 0.00 2.10 1.78 0.93 0.74 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 0.00 315 K 8.24 4.14 0.00 1.83 1.79 0.00 1.90 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.32 7.81 316 A 8.11 3.63 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 0.00 317 Q 7.12 3.98 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.83 0.00 0.00 0.00 0.00 0.00 2.41 2.83 0.00 318 L 7.57 4.37 0.00 1.89 1.58 0.97 0.82 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 * Residues marked with a * may have inaccurate shift predictions.