NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 3.9252 8.1076 123.4758 54.8307 19.3761 177.7608 3 D 3.7778 7.7154 117.2739 54.2384 42.1973 171.4286 4 V 3.9547 8.8567 125.7746 60.9213 30.9063 177.2036 5 L 4.4700 8.1148 125.4506 57.3361 41.9888 179.2069 6 T 4.3563 7.8043 110.9212 63.5025 67.4133 174.6096 7 E 4.1965 8.0531 119.1185 58.2644 29.9708 176.9548 8 L 3.9865 7.9203 121.3624 53.1551 42.0551 174.7278 9 P 4.3019 0.0000 0.0000 64.4763 31.3415 176.6653 10 G 3.8120 9.1183 111.3588 44.8229 0.0000 172.9725 11 V 4.1003 7.9773 120.3424 61.3779 31.9438 174.8285 12 G 4.4427 8.0955 117.1086 43.0450 0.0000 170.3097 13 P 4.2617 0.0000 0.0000 65.8880 31.4661 178.0960 14 S 4.0467 8.0402 112.4006 61.5543 62.3081 176.0690 15 T 3.9039 7.8789 117.3758 66.7536 68.2105 176.1221 16 A 4.0643 8.2443 122.6956 55.4347 17.9652 179.5573 17 D 4.2766 7.7478 115.9739 57.6154 40.7607 178.5065 18 K 4.2086 7.5929 117.8917 59.5969 31.9107 179.2873 19 L 4.0494 7.7874 118.8678 57.9240 41.4645 179.4884 20 I 4.6097 7.2795 112.8113 63.3850 37.3589 177.7817 21 E 4.2635 8.0192 119.6850 59.3215 29.5543 179.5281 22 G 3.8590 7.7833 103.6970 46.4825 0.0000 175.1850 23 G 3.8838 8.6188 109.0821 45.1626 0.0000 173.9120 24 Y 4.2212 7.5331 118.3000 57.9005 38.0513 176.8493 25 L 4.7256 8.2768 123.1386 56.1232 41.2767 174.0782 26 D 4.6313 7.9181 117.6930 52.0455 44.6551 175.9763 27 F 4.7121 8.6953 124.4879 61.2264 38.9962 177.7993 28 M 4.1251 8.0102 116.9077 58.3650 31.5153 178.7357 29 K 4.0075 7.6480 117.4914 59.3099 32.4942 178.3386 30 I 4.1773 7.8035 119.1480 63.3775 37.2676 177.8134 31 A 4.0533 8.2233 122.3315 54.5510 18.3732 178.1199 32 T 4.3749 7.8194 103.9153 61.3806 68.9425 174.4657 33 A 4.7389 7.4819 125.3419 51.9505 20.1603 177.6578 34 T 4.6656 8.1438 109.6402 60.0299 72.4551 175.7951 35 I 3.8604 8.2394 122.6335 64.3057 37.2402 178.9086 36 G 3.6193 8.0442 106.4126 47.8483 0.0000 175.3859 37 E 4.5534 7.7693 119.5796 57.5780 29.9500 178.3523 38 L 4.1373 7.5201 119.2968 57.1743 41.9955 178.5595 39 T 4.7119 7.6340 109.1666 63.2443 69.0314 175.6979 40 D 4.4963 7.7573 120.7682 55.0266 41.2214 175.5199 41 I 4.3245 7.9980 121.4424 60.7010 40.1971 175.6711 42 E 3.1538 7.9184 117.6239 55.5921 32.5257 178.5221 43 G 3.9832 9.0777 102.1999 44.9543 0.0000 175.1675 44 I 4.2255 7.4488 120.6966 59.2134 37.7688 177.0884 45 S 4.7544 8.1767 122.8624 58.1626 65.4001 173.6440 46 E 4.0956 8.5596 119.4911 59.3527 29.6349 178.7450 47 K 4.0274 7.9567 118.1802 59.7946 32.5404 178.9964 48 A 3.8933 7.8116 121.8026 54.8923 18.5276 179.3545 49 A 3.8594 7.6166 118.4131 55.3335 18.5013 179.7785 50 A 3.9239 8.5583 119.5345 55.1176 18.4148 179.8432 51 K 3.9011 8.4099 118.8790 59.7767 32.2772 179.0232 52 M 4.0647 8.4697 117.7431 58.1206 31.1809 178.7182 53 I 3.6463 7.5937 120.7263 64.4961 37.2868 178.0062 54 M 4.0120 7.9973 118.7188 58.4245 31.9409 178.1815 55 A 3.8815 8.1473 120.8970 54.9296 18.5732 179.3273 56 A 3.7996 8.4187 119.6370 55.3865 18.4593 179.9109 57 R 3.8096 7.9528 116.4114 59.4626 30.1376 178.6823 58 D 4.2380 7.9349 117.5437 57.2643 41.0002 177.7764 59 L 3.8416 8.1381 119.9250 58.5559 42.1749 178.3340 60 C 4.3973 8.4135 112.8755 58.9902 29.3127 173.3308 61 D 4.3420 7.6075 118.6905 55.0949 39.0736 173.3031 62 L 4.6557 8.2251 121.0504 52.2421 41.8713 176.7889 63 G 3.9793 7.4795 110.9863 44.0672 0.0000 169.1187 64 F 4.3086 8.7914 119.7363 57.2502 39.5721 174.8819 65 K 4.9043 8.5011 124.4143 54.8441 35.1115 175.3544 66 S 4.6320 8.6810 115.3502 58.1596 67.1195 176.9927 67 G 3.7689 8.3887 109.8757 46.8144 0.0000 177.2616 68 V 3.6237 8.4445 121.8376 65.8410 31.2914 177.2753 69 E 4.0383 8.2510 117.9110 59.3595 29.0173 179.1320 70 L 4.0615 7.6409 118.4380 57.5883 41.4549 179.0473 71 L 4.2124 7.9360 119.0480 57.2394 41.5489 179.5274 72 K 4.1973 7.9664 118.1972 59.5459 31.7578 178.7439 73 Q 3.9480 7.9884 119.6333 59.3268 28.4727 178.2082 74 R 4.1039 7.7575 117.1612 58.1229 30.0311 177.4318 75 Q 4.3608 8.0256 116.5025 57.3144 29.0805 176.4617 76 S 4.6405 7.5565 113.0575 58.3054 63.7656 174.1417 77 V 4.0970 7.3883 121.8666 62.1284 31.7210 175.2900 78 W 5.1798 8.7645 125.4959 55.1257 31.2865 175.1789 79 R 5.6374 9.3242 119.0580 53.3642 33.8437 174.1126 80 L 5.0924 8.2236 123.6850 53.2091 44.5708 175.5199 81 S 4.9942 8.6920 121.6126 58.7479 62.8011 174.0904 82 T 4.1010 9.5900 115.5546 61.7894 69.3220 175.8615 83 G 3.9141 8.3625 111.5965 45.1257 0.0000 172.7752 84 S 4.7305 7.5205 114.1907 56.3966 64.8377 174.4432 85 T 3.8796 8.3712 125.9520 66.8924 68.5209 176.5382 86 E 4.0166 8.1547 120.0160 59.3119 29.5802 179.0585 87 L 4.0686 7.9486 120.2171 58.2651 42.0906 178.7173 88 D 4.3987 8.3421 119.0470 57.6408 40.7923 178.6858 89 T 3.7788 8.1792 113.6687 64.8652 67.0844 176.6795 90 V 3.7197 7.5449 119.5681 65.6405 31.7040 177.2158 91 L 4.2437 8.0693 115.5806 53.9951 42.3412 176.2565 92 A 3.7251 8.4446 120.9522 52.7176 16.4899 176.7590 93 G 3.5278 8.9270 116.1807 44.7283 0.0000 174.7450 94 G 3.9393 7.1265 105.7995 45.2748 0.0000 170.6214 95 I 3.7818 7.7000 121.6227 61.0498 37.9982 175.8820 96 E 4.4628 8.2437 126.9910 55.9715 30.2482 176.7935 97 S 3.8704 7.7886 118.1653 58.2242 64.4853 173.9433 98 Q 4.0022 8.8111 117.0878 56.7426 26.4636 173.3905 99 S 4.7405 7.4592 112.6473 57.2669 68.3535 172.7275 100 V 4.6530 8.3691 120.8922 61.5816 33.5563 174.0027 101 T 5.1642 8.6338 122.7492 60.2163 70.2065 172.0095 102 E 5.1915 9.2788 129.5099 54.4167 32.7306 174.4883 103 F 5.0895 9.3302 124.9568 55.9646 41.6343 174.1693 104 A 5.9400 9.3034 125.9542 48.8492 22.1623 175.4830 105 G 4.5125 8.4299 108.6274 46.2659 0.0000 171.9924 106 M 4.5657 7.8725 120.6602 54.1624 32.8780 176.0038 107 F 4.3472 8.7121 114.9242 58.4182 37.9164 175.6045 108 G 3.8676 8.9918 110.0143 46.2566 0.0000 174.9538 109 S 3.9572 7.6949 112.9016 59.0566 63.5098 175.1055 110 G 4.0834 7.9297 110.3711 45.7390 0.0000 175.5745 111 K 3.8687 8.3675 120.3136 59.8909 32.0896 179.2866 112 T 4.0602 7.9400 115.2493 66.5918 68.3753 176.6277 113 Q 3.9958 8.0883 119.6270 59.1488 28.8049 178.8688 114 I 3.5147 7.6216 120.6724 64.3941 36.7713 178.3910 115 M 4.0236 7.4853 118.6210 58.8066 31.9757 178.2113 116 H 4.4013 8.5552 116.2872 58.8503 28.8793 177.6341 117 Q 3.9927 8.3130 121.6765 59.4782 28.9542 178.5099 118 T 4.0930 7.9643 110.6456 64.9475 68.3633 176.1942 119 C 4.2181 7.6819 119.1164 62.5460 28.4236 175.9482 120 V 3.7270 7.5880 119.3196 66.2313 31.3660 177.6864 121 N 4.3191 8.6251 116.5775 56.2252 38.0690 176.9966 122 L 4.0277 7.8090 121.0618 58.0313 42.1344 177.5931 123 Q 4.2579 7.6993 115.2211 56.0310 28.6941 175.5762 124 M 4.5506 7.9251 118.9255 53.1396 33.9137 176.0235 125 R 3.9787 8.6085 125.5808 59.2769 30.3004 178.4444 126 E 4.0809 8.0201 115.8884 58.7271 29.7557 177.8309 127 K 3.9192 8.4384 117.7245 57.3180 32.5726 175.9915 128 I 4.4043 6.8188 120.0638 59.5129 38.6608 175.3678 129 F 5.0878 9.3108 126.1952 55.8766 40.7757 174.2147 130 A 5.1933 8.5923 124.6927 49.8902 22.4697 174.6138 131 D 4.6381 8.6706 120.0885 52.9792 41.8719 177.4792 132 L 4.2643 8.6434 127.1717 57.7811 41.9380 178.5228 133 E 4.1204 9.2210 118.3187 58.4872 29.1683 177.8704 134 G 4.0773 8.3286 105.0140 44.7834 0.0000 172.4249 135 V 4.2941 7.4849 119.2636 61.0211 33.5294 174.6178 136 V 3.8088 8.2409 127.6912 62.3788 32.3785 176.5101 137 E 3.9168 8.7755 126.6986 59.1600 29.6524 178.1797 138 E 4.1592 8.0397 114.1452 57.4875 29.8066 176.7595 139 E 4.1954 7.8827 120.0958 57.2322 30.0466 176.3457 140 L 4.2097 7.4318 116.4826 54.2956 42.5188 176.3288 141 E 3.7586 7.8300 120.4267 57.2640 30.5206 176.2748 142 A 3.7347 8.5449 128.7552 52.6607 16.0220 175.1059 143 P 4.7022 0.0000 0.0000 62.5793 32.9098 177.7659 144 K 4.9628 9.2518 120.7530 54.7465 36.6066 175.0950 145 A 5.2893 8.7790 123.9301 50.3525 22.6421 175.7913 146 V 4.8088 8.8474 119.1545 61.3295 34.7480 173.7774 147 Y 4.6482 9.5123 130.8647 56.0739 40.8013 174.7761 148 I 4.4687 8.9024 130.2635 60.0547 37.8254 174.1797 149 D 5.1816 8.8388 128.0369 54.4813 41.5958 176.4073 150 T 4.7776 9.1360 122.3424 62.9094 69.7147 175.1706 151 E 4.5266 8.9013 118.1858 55.4857 31.6469 176.3710 152 G 3.8928 9.2057 107.3420 46.2616 0.0000 174.2621 153 T 4.3398 8.0557 108.1511 60.9419 69.7398 174.6247 154 F 3.8721 9.0900 126.1642 58.4874 39.8591 174.5929 155 R 4.2189 7.3165 125.4447 53.0033 32.0209 173.8554 156 P 4.0608 0.0000 0.0000 65.5288 31.2198 178.3736 157 E 3.8620 7.9283 116.7007 59.5680 29.3953 179.3157 158 R 3.8965 7.6014 118.1476 59.1965 30.0734 178.7284 159 V 3.5524 7.4868 117.7933 65.7838 31.5300 178.0589 160 V 3.5348 7.7122 118.0273 65.9693 31.3297 177.6999 161 Q 3.9179 8.3900 119.6721 59.6795 29.0532 178.3322 162 M 4.7875 8.6566 120.9779 57.6367 31.7962 178.7569 163 A 3.9649 7.9576 121.1653 55.1311 18.3823 179.4035 164 E 3.9822 8.2524 116.2233 59.6957 29.6859 179.6813 165 G 3.7562 8.2376 104.1839 47.3755 0.0000 174.7083 166 A 4.4442 7.6584 121.1649 52.2382 19.2823 178.1538 167 G 3.9208 8.2675 105.4558 45.5837 0.0000 173.1583 168 I 4.3366 7.2846 120.1192 59.2894 39.7746 174.4114 169 D 4.7931 8.2923 119.9084 53.3417 42.5091 177.0419 170 G 3.6197 8.6529 113.8096 48.0447 0.0000 175.3246 171 Q 3.9988 8.0694 121.2965 59.0061 28.8570 178.1986 172 T 3.8009 7.7273 116.2139 66.6876 68.7308 176.1957 173 V 3.7117 7.4655 120.0296 66.2073 31.3158 178.0997 174 L 4.0198 7.9429 118.5407 57.7705 41.2005 179.0848 175 D 4.3572 8.0939 117.7853 56.1081 40.9468 176.6925 176 N 4.8060 7.5297 116.2720 52.8919 40.1865 174.1109 177 T 4.9217 7.2975 115.6774 61.8282 71.3347 173.5334 178 F 4.5863 9.2985 126.2168 56.2476 41.0176 175.2095 179 V 4.7245 8.2423 121.7282 60.8976 34.3657 174.1883 180 A 4.2210 8.6615 129.5156 49.7794 21.4040 174.8631 181 R 4.3136 8.5434 123.7971 55.7730 30.3891 175.2301 182 A 4.9527 8.9381 129.8552 50.8399 20.6097 176.8280 183 Y 4.3426 8.9357 119.8281 58.7620 39.0065 175.2095 184 N 4.9885 7.6210 116.9664 50.5154 41.5443 175.0709 185 S 3.7142 9.7097 116.8219 61.4588 62.5341 176.4611 186 D 4.2795 7.8773 121.8851 57.5507 40.5995 178.4767 187 M 3.7409 7.8677 118.6384 58.0927 31.8575 178.3082 188 Q 4.1364 8.3081 119.9659 59.7733 29.3188 178.5380 189 M 4.1577 8.4373 119.9919 58.2775 31.9777 178.6093 190 L 4.1359 8.1713 120.8012 58.0770 42.0058 178.9475 191 F 4.4425 8.1246 116.9836 60.5584 38.9862 177.1491 192 A 4.2332 8.0378 120.4005 55.3727 18.0378 179.5842 193 E 4.0219 8.0954 115.5510 58.7538 29.8560 178.7418 194 K 4.2834 8.1017 117.1852 57.1149 32.4194 178.6480 195 I 3.7015 7.5176 121.3055 64.1423 36.8208 177.9620 196 E 3.7642 8.0600 119.3493 59.3615 29.3610 178.7630 197 D 4.2871 8.0038 118.6455 56.7407 40.7479 178.8301 198 L 3.7951 7.4115 119.6659 57.6874 41.4478 179.3768 199 I 4.4802 7.2842 119.4436 63.5285 37.3781 177.9339 200 K 4.1811 8.1493 121.2025 59.1583 31.7277 178.4149 201 G 3.9985 7.5167 103.2318 44.8570 0.0000 174.5069 202 G 3.9313 7.8124 107.5480 44.9901 0.0000 173.8044 203 N 4.6540 7.9470 118.4359 52.6346 39.5215 174.3283 204 N 5.1530 8.3834 122.9191 52.2984 38.1853 171.6865 205 I 4.4301 7.8720 121.2103 61.1394 37.5910 175.4659 206 K 4.8210 9.3740 126.3869 56.0001 34.8696 175.8436 207 L 5.1638 7.9190 122.3016 53.2700 45.5362 174.7864 208 V 4.8405 9.0870 126.4226 61.1396 34.5024 174.0462 209 I 4.9667 8.9566 128.5647 59.5220 40.7532 174.7303 210 I 4.7627 8.9026 127.3624 59.5724 39.8644 174.0276 211 D 4.7735 8.8724 127.6888 52.4935 43.3585 174.4881 212 S 5.4940 8.5934 120.4322 56.0841 63.7503 173.8162 213 L 4.4697 9.0241 127.6284 57.5252 42.3448 177.6065 214 T 4.9179 8.1998 106.5037 60.3598 70.3037 175.7427 215 S 4.2577 8.4628 118.6362 61.9754 62.7513 176.4006 216 T 3.8678 7.9945 112.7818 64.5930 68.5780 176.2789 217 F 4.4379 8.3849 120.8792 60.2125 38.8703 177.7124 218 R 4.1573 8.2701 114.2416 59.2069 29.1673 177.9439 219 N 4.6376 7.9488 115.8094 54.9119 38.9657 176.5847 220 E 4.1078 8.0565 118.9996 56.8386 31.1231 176.6803 221 F 4.8806 7.9497 116.7131 55.9404 39.2888 174.7775 222 T 4.0651 8.1147 114.2188 64.4330 69.2853 176.6504 223 G 3.8408 8.1339 111.7368 45.7446 0.0000 173.7942 224 R 4.2727 8.6922 121.0528 56.9912 30.4774 177.0257 225 G 4.1311 7.9224 106.4611 45.2317 0.0000 174.0957 226 K 4.6804 7.8053 117.8763 55.0658 33.5447 178.1097 227 L 3.9974 8.2482 121.2465 57.6271 42.1790 178.3415 228 A 3.9627 7.9687 120.2580 54.8804 18.1614 179.3199 229 E 3.8381 8.0723 116.8188 59.5351 29.6844 179.0672 230 R 2.9263 7.5487 118.2704 59.4993 30.0817 178.4505 231 Q 3.8711 8.1404 117.8527 58.9321 28.5864 178.8450 232 Q 3.8809 7.8439 120.1566 59.0580 29.2079 178.2545 233 K 4.0117 7.6963 120.8026 59.4066 32.2003 178.6313 234 L 3.6390 7.8422 120.7977 57.5770 41.9106 179.1806 235 G 3.5177 8.0710 106.1843 47.7059 0.0000 176.0388 236 R 3.9764 7.8741 120.1535 59.0350 30.0522 178.4929 237 H 4.2388 8.1788 117.9016 59.7854 29.8541 177.0905 238 M 3.9456 8.2459 120.3078 58.4378 31.6876 178.7367 239 A 3.9615 7.9502 120.5992 55.4665 18.5861 179.8158 240 T 3.8272 8.0692 114.2879 66.6588 68.3910 176.9925 241 L 3.9719 7.9643 120.9395 57.9066 41.5631 179.2622 242 N 4.3290 8.4027 116.7642 56.0088 38.3843 177.4310 243 K 3.8984 8.2691 121.4106 59.4419 32.5412 178.9343 244 L 4.0379 7.9666 119.4037 58.3797 40.3873 179.0491 245 A 4.1687 7.8503 122.0726 55.0193 18.3460 179.3504 246 D 4.1999 7.8563 117.4645 57.3257 40.8403 178.3672 247 L 3.6471 7.5108 119.8814 58.1646 41.8902 177.8452 248 Y 4.6514 7.2359 112.2202 57.3881 38.3560 175.7513 249 N 4.2332 7.5386 116.5448 55.0725 38.0116 172.5454 250 C 5.4997 7.6739 113.4084 56.4617 34.2268 173.7276 251 I 4.4758 8.4946 113.3796 59.5854 39.5567 174.5581 252 V 4.7647 8.1340 125.1646 61.1857 33.7565 174.1198 253 L 5.3050 9.5473 128.7329 53.1107 44.6593 176.0409 254 V 5.1413 8.7808 116.1640 59.7910 36.3363 174.6249 255 T 5.2924 8.5046 112.2038 60.2534 72.0765 172.5291 256 N 5.3367 9.1249 120.4304 52.3416 43.3394 173.9499 257 Q 4.7882 8.2424 124.7430 55.3291 31.2254 174.5947 258 V 5.2249 8.2898 112.0961 59.9507 35.8267 175.2295 259 A 4.6867 8.6656 121.7433 51.0169 22.8660 176.2211 260 A 4.1132 9.2596 119.6732 52.8100 17.1522 177.9245 261 K 3.5696 9.4170 119.5581 58.0979 31.8693 173.8662 *269 A 4.3219 7.6416 118.8386 52.4726 20.3208 175.6873 270 E 5.1513 7.4971 112.4344 55.1861 34.4309 174.8434 271 Q 4.8439 8.6464 116.8431 54.5713 32.3036 174.0953 272 A 4.8454 9.2535 123.6319 52.3887 19.1704 177.4571 273 I 4.0767 8.1316 115.5778 60.4242 38.6496 175.9308 274 G 3.9229 9.9435 108.3295 44.3709 0.0000 175.4034 275 G 4.1196 8.1299 108.7069 46.5759 0.0000 174.5329 276 H 4.1117 8.6516 114.8491 59.0302 28.7713 177.2802 277 V 3.5470 7.8724 119.6823 66.4681 31.1950 178.1049 278 V 3.6870 7.5496 116.6704 65.4963 31.1119 178.0646 279 G 3.5854 7.5269 104.3354 48.3548 0.0000 175.0860 280 H 4.3452 8.2173 118.1563 58.1805 28.7818 177.5807 281 A 4.1351 7.6180 121.4414 53.7736 18.4053 177.9677 282 A 4.1039 7.4020 120.7183 52.2917 19.2081 177.6179 283 T 3.9604 8.7591 120.8772 65.6319 70.0480 174.9674 284 F 5.0027 8.1260 119.4152 55.4306 42.7065 174.5045 285 R 4.6125 8.1930 121.9353 54.1434 33.1241 174.7504 286 F 5.4491 8.9263 121.5613 55.6591 43.3756 173.9555 287 F 5.7337 9.4740 120.1252 56.0131 41.5762 174.2866 288 L 5.5729 9.4684 124.6351 53.2435 43.6438 176.1831 289 R 4.7382 8.7954 118.2796 54.5036 33.3089 174.4538 290 K 4.4665 8.4633 119.4006 56.2474 33.1265 177.1906 291 S 4.7058 7.9496 119.0452 57.5884 65.1829 173.7554 292 K 4.1317 8.6415 123.0451 58.1068 33.4897 176.3944 293 G 3.7186 8.2082 113.0850 47.2299 0.0000 173.9968 294 D 4.6243 8.5746 124.9737 53.1209 39.9127 175.8322 295 K 4.5977 7.7890 120.7143 56.8245 33.3658 176.2657 296 R 4.8107 8.6599 121.6125 54.4309 35.2848 174.0991 297 V 4.8579 8.4561 119.7783 61.1516 34.9875 173.9460 298 A 5.3774 9.5015 130.2356 50.4140 21.2689 175.2460 299 K 4.9792 9.6698 125.6862 54.9506 34.1297 175.1394 300 L 4.0475 9.1802 132.3204 54.7659 42.6296 176.2885 301 Y 5.0327 8.1430 123.3295 55.7646 39.4103 175.1132 302 D 4.5134 6.6483 119.4518 53.3685 44.6492 173.8724 303 S 5.1037 8.0931 118.0225 57.9553 64.5780 174.5121 304 P 4.3416 0.0000 0.0000 64.9710 31.5627 176.6456 305 H 4.8655 7.9033 109.9067 54.6621 30.2105 172.5865 306 L 4.6784 7.7093 120.3576 52.3590 43.8117 174.5545 307 P 4.5783 0.0000 0.0000 61.7828 32.6395 175.5815 308 D 4.8049 8.2615 118.7686 54.7830 41.9090 175.4720 309 S 4.6517 8.4493 114.5330 57.5400 65.9290 172.7025 310 E 5.5135 8.8958 123.0202 54.5882 32.5317 175.2966 311 A 4.9186 9.0328 123.8249 50.3297 22.3816 175.1302 312 V 4.7239 8.9011 123.3761 61.9035 33.1166 174.9559 313 F 5.0780 8.5508 121.2917 56.0772 42.0752 172.7787 314 R 5.1164 9.2217 116.5813 54.4647 34.4967 174.8548 315 I 5.0023 8.3971 121.8951 60.1421 39.4045 175.2020 316 T 4.7148 8.9275 117.9097 59.6986 71.8711 174.0099 317 E 3.9761 8.8798 118.1081 59.7070 29.8277 178.4522 318 K 4.1423 7.9132 118.6956 59.1412 33.4860 174.8198 319 G 4.0707 6.5326 107.1508 44.3719 0.0000 175.1772 320 I 4.7356 9.1829 129.0794 59.7914 38.0074 174.7530 321 Q 4.7954 8.6813 121.4567 55.3144 31.7329 174.5708 322 D 4.9127 8.7704 116.7239 54.7240 40.2526 175.1427 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 A 8.11 3.93 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 3 D 7.72 3.78 0.00 2.89 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 4 V 8.86 3.95 2.26 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 1.04 0.00 0.00 0.94 0.00 0.00 5 L 8.11 4.47 0.00 1.87 1.83 0.88 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 6 T 7.80 4.36 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 1.26 0.00 0.00 7 E 8.05 4.20 0.00 2.35 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 0.00 2.41 2.39 0.00 8 L 7.92 3.99 0.00 1.98 1.56 1.06 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.30 0.00 2.14 2.04 0.00 3.63 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 1.92 1.91 0.00 10 G 9.12 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 0.00 0.00 0.00 11 V 7.98 4.10 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.93 0.00 0.00 12 G 8.10 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 0.00 0.00 0.00 0.00 13 P 0.00 4.26 0.00 2.28 2.33 0.00 3.72 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 2.08 2.03 0.00 14 S 8.04 4.05 0.00 3.91 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 15 T 7.88 3.90 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 1.20 0.00 0.00 16 A 8.24 4.06 1.43 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 0.00 0.00 17 D 7.75 4.28 0.00 2.90 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 18 K 7.59 4.21 0.00 1.97 1.88 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.70 7.81 19 L 7.79 4.05 0.00 1.87 1.79 0.93 1.00 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 20 I 7.28 4.61 1.90 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 1.56 1.07 0.94 0.00 0.00 21 E 8.02 4.26 0.00 2.36 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 2.35 2.51 0.00 22 G 7.78 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 23 G 8.62 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 24 Y 7.53 4.22 0.00 3.43 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 25 L 8.28 4.73 0.00 1.68 1.69 0.92 0.69 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 26 D 7.92 4.63 0.00 2.77 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 8.70 4.71 0.00 3.15 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 28 M 8.01 4.13 0.00 2.04 2.29 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.74 0.00 29 K 7.65 4.01 0.00 1.80 2.17 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.65 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.31 1.63 7.81 30 I 7.80 4.18 1.99 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.88 0.00 0.00 31 A 8.22 4.05 1.34 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 0.00 0.00 32 T 7.82 4.37 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 1.25 0.00 0.00 33 A 7.48 4.74 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.14 4.67 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 1.28 0.00 0.00 35 I 8.24 3.86 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.52 0.89 0.00 0.00 36 G 8.04 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 37 E 7.77 4.55 0.00 2.28 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 2.41 2.38 0.00 38 L 7.52 4.14 0.00 1.84 1.62 0.47 0.40 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 39 T 7.63 4.71 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 40 D 7.76 4.50 0.00 3.02 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 41 I 8.00 4.32 1.94 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.06 0.96 0.00 0.00 42 E 7.92 3.15 0.00 1.98 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 2.27 2.36 0.00 43 G 9.08 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 0.00 0.00 0.00 44 I 7.45 4.23 1.96 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 1.32 1.19 0.86 0.00 0.00 45 S 8.18 4.75 0.00 4.03 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 46 E 8.56 4.10 0.00 2.02 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 2.35 2.34 0.00 47 K 7.96 4.03 0.00 1.97 2.06 0.00 1.50 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.49 7.81 48 A 7.81 3.89 1.30 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 0.00 0.00 0.00 0.00 0.00 49 A 7.62 3.86 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.56 3.92 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 51 K 8.41 3.90 0.00 1.90 1.93 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.42 7.81 52 M 8.47 4.06 0.00 2.22 2.28 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.86 0.00 53 I 7.59 3.65 2.01 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.09 0.90 0.00 0.00 54 M 8.00 4.01 0.00 2.23 2.03 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.53 0.00 55 A 8.15 3.88 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 56 A 8.42 3.80 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 57 R 7.95 3.81 0.00 2.00 1.96 0.00 3.11 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 58 D 7.93 4.24 0.00 2.84 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 59 L 8.14 3.84 0.00 1.51 1.62 0.74 -0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 60 C 8.41 4.40 0.00 3.01 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 61 D 7.61 4.34 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 L 8.23 4.66 0.00 1.61 1.52 0.90 0.86 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 63 G 7.48 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 0.00 0.00 0.00 64 F 8.79 4.31 0.00 3.06 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.50 4.90 0.00 1.72 1.69 0.00 1.80 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.53 1.32 7.81 66 S 8.68 4.63 0.00 3.89 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 67 G 8.39 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 68 V 8.44 3.62 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 1.07 0.00 0.00 0.94 0.00 0.00 69 E 8.25 4.04 0.00 2.26 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 2.42 2.42 0.00 70 L 7.64 4.06 0.00 1.78 1.73 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 71 L 7.94 4.21 0.00 1.88 1.72 0.93 0.90 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 72 K 7.97 4.20 0.00 1.88 1.87 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.76 1.45 7.81 73 Q 7.99 3.95 0.00 2.20 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.85 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 74 R 7.76 4.10 0.00 2.01 2.08 0.00 3.18 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 75 Q 8.03 4.36 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.67 0.00 0.00 0.00 0.00 0.00 2.42 2.66 0.00 76 S 7.56 4.64 0.00 4.05 4.03 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 77 V 7.39 4.10 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.94 0.00 0.00 78 W 8.76 5.18 0.00 3.64 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 R 9.32 5.64 0.00 2.01 1.81 0.00 3.17 0.00 0.00 3.31 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.45 0.00 80 L 8.22 5.09 0.00 1.96 1.50 0.98 0.93 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 81 S 8.69 4.99 0.00 4.21 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 82 T 9.59 4.10 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 1.14 0.00 0.00 83 G 8.36 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 84 S 7.52 4.73 0.00 3.77 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 T 8.37 3.88 4.37 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 1.22 0.00 0.00 86 E 8.15 4.02 0.00 2.10 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 2.45 2.41 0.00 87 L 7.95 4.07 0.00 1.74 1.57 0.86 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 88 D 8.34 4.40 0.00 2.99 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 89 T 8.18 3.78 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 1.32 0.00 0.00 90 V 7.54 3.72 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.10 0.00 0.00 91 L 8.07 4.24 0.00 1.82 1.81 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.44 3.73 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.93 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 G 7.13 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 95 I 7.70 3.78 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 1.19 0.57 0.77 0.00 0.00 96 E 8.24 4.46 0.00 1.75 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 2.26 2.08 0.00 97 S 7.79 3.87 0.00 3.69 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 8.81 4.00 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 99 S 7.46 4.74 0.00 3.81 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 0.00 100 V 8.37 4.65 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 0.95 0.00 0.00 0.91 0.00 0.00 101 T 8.63 5.16 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 102 E 9.28 5.19 0.00 1.98 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 2.23 2.28 0.00 103 F 9.33 5.09 0.00 3.09 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 0.00 104 A 9.30 5.94 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.43 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 M 7.87 4.57 0.00 2.06 1.92 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.57 0.00 107 F 8.71 4.35 0.00 3.18 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 0.00 108 G 8.99 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 0.00 109 S 7.69 3.96 0.00 4.01 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 0.00 110 G 7.93 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 0.00 111 K 8.37 3.87 0.00 1.90 1.98 0.00 1.94 0.00 0.00 2.13 0.00 0.00 3.11 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.70 1.65 7.81 112 T 7.94 4.06 4.30 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 0.00 0.00 1.35 0.00 0.00 113 Q 8.09 4.00 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.42 0.00 114 I 7.62 3.51 1.55 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.57 0.28 0.00 0.00 115 M 7.49 4.02 0.00 1.84 2.48 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.97 0.00 116 H 8.56 4.40 0.00 3.33 3.35 0.00 5.62 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 0.00 117 Q 8.31 3.99 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.79 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 118 T 7.96 4.09 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 1.16 0.00 0.00 119 C 7.68 4.22 0.00 3.25 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 0.00 120 V 7.59 3.73 2.26 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 1.06 0.00 0.00 1.01 0.00 0.00 121 N 8.63 4.32 0.00 2.71 2.83 0.00 0.00 6.72 6.77 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 0.00 122 L 7.81 4.03 0.00 1.95 1.86 0.91 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 123 Q 7.70 4.26 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.56 0.00 0.00 0.00 0.00 0.00 2.54 2.45 0.00 124 M 7.93 4.55 0.00 2.28 2.03 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 125 R 8.61 3.98 0.00 1.81 1.90 0.00 3.10 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 126 E 8.02 4.08 0.00 1.98 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 2.32 2.39 0.00 127 K 8.44 3.92 0.00 2.05 1.69 0.00 1.53 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.41 7.81 128 I 6.82 4.40 1.79 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.38 0.73 0.00 0.00 129 F 9.31 5.09 0.00 3.01 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 0.00 130 A 8.59 5.19 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 0.00 131 D 8.67 4.64 0.00 2.76 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 0.00 132 L 8.64 4.26 0.00 1.69 1.74 0.93 1.02 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 0.00 133 E 9.22 4.12 0.00 2.10 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 2.49 2.42 0.00 134 G 8.33 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 0.00 135 V 7.48 4.29 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 0.76 0.00 0.00 1.12 0.00 0.00 136 V 8.24 3.81 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 0.94 0.00 0.00 0.94 0.00 0.00 137 E 8.78 3.92 0.00 2.06 1.90 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 2.34 2.31 0.00 138 E 8.04 4.16 0.00 2.21 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 2.26 2.28 0.00 139 E 7.88 4.20 0.00 1.93 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.27 0.00 140 L 7.43 4.21 0.00 1.61 1.39 0.78 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 141 E 7.83 3.76 0.00 1.87 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 2.25 2.27 0.00 142 A 8.54 3.73 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 0.00 143 P 0.00 4.70 0.00 2.01 2.01 0.00 3.65 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.88 0.00 144 K 9.25 4.96 0.00 1.81 1.91 0.00 2.04 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.34 1.54 7.81 145 A 8.78 5.29 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 0.00 146 V 8.85 4.81 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 0.83 0.00 0.00 0.96 0.00 0.00 147 Y 9.51 4.65 0.00 2.88 2.40 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 0.00 148 I 8.90 4.47 2.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.40 1.00 0.00 0.00 149 D 8.84 5.18 0.00 2.81 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 0.00 150 T 9.14 4.78 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 1.35 0.00 0.00 151 E 8.90 4.53 0.00 1.97 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 0.00 2.26 2.35 0.00 152 G 9.21 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 0.00 153 T 8.06 4.34 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 154 F 9.09 3.87 0.00 2.54 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 0.00 155 R 7.32 4.22 0.00 1.51 1.73 0.00 3.36 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.42 0.00 156 P 0.00 4.06 0.00 2.11 2.15 0.00 3.47 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.36 0.00 157 E 7.93 3.86 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 158 R 7.60 3.90 0.00 1.75 1.86 0.00 3.19 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.58 0.00 159 V 7.49 3.55 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.82 0.00 0.00 160 V 7.71 3.53 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 1.04 0.00 0.00 0.98 0.00 0.00 161 Q 8.39 3.92 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.57 0.00 0.00 0.00 0.00 0.00 2.48 2.38 0.00 162 M 8.66 4.79 0.00 2.07 2.23 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.51 0.00 163 A 7.96 3.96 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 0.00 164 E 8.25 3.98 0.00 1.99 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 0.00 2.58 2.46 0.00 165 G 8.24 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 0.00 166 A 7.66 4.44 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 0.00 167 G 8.27 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 0.00 0.00 0.00 168 I 7.28 4.34 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.66 0.89 0.00 0.00 169 D 8.29 4.79 0.00 2.76 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 0.00 170 G 8.65 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 0.00 171 Q 8.07 4.00 0.00 2.16 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.84 0.00 0.00 0.00 0.00 0.00 2.41 2.70 0.00 172 T 7.73 3.80 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 173 V 7.47 3.71 2.20 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 1.08 0.00 0.00 0.95 0.00 0.00 174 L 7.94 4.02 0.00 1.88 1.68 0.92 1.21 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 0.00 175 D 8.09 4.36 0.00 2.72 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 N 7.53 4.81 0.00 2.58 2.71 0.00 0.00 6.59 7.00 0.00 0.00 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 T 7.30 4.92 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 178 F 9.30 4.59 0.00 2.95 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 0.00 179 V 8.24 4.72 1.67 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 0.30 0.00 0.00 -0.25 0.00 0.00 180 A 8.66 4.22 -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 0.00 181 R 8.54 4.31 0.00 1.72 1.84 0.00 3.25 0.00 0.00 3.09 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.74 0.00 182 A 8.94 4.95 1.44 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 0.00 183 Y 8.94 4.34 0.00 3.01 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 0.00 184 N 7.62 4.99 0.00 3.00 2.88 0.00 0.00 6.00 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 S 9.71 3.71 0.00 2.94 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 D 7.88 4.28 0.00 2.65 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 0.00 187 M 7.87 3.74 0.00 1.97 2.26 0.00 0.00 0.00 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.47 0.00 188 Q 8.31 4.14 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 189 M 8.44 4.16 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.58 0.00 190 L 8.17 4.14 0.00 1.71 1.47 0.88 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 191 F 8.12 4.44 0.00 3.34 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 0.00 192 A 8.04 4.23 1.49 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 0.00 193 E 8.10 4.02 0.00 2.14 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 0.00 2.38 2.54 0.00 194 K 8.10 4.28 0.00 2.07 1.86 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.65 7.81 195 I 7.52 3.70 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 1.48 1.39 0.84 0.00 0.00 196 E 8.06 3.76 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 2.49 2.44 0.00 197 D 8.00 4.29 0.00 2.76 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 0.00 198 L 7.41 3.80 0.00 1.63 1.34 0.29 0.44 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 0.00 199 I 7.28 4.48 1.58 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.72 0.63 0.00 0.00 200 K 8.15 4.18 0.00 1.86 1.83 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.42 7.81 201 G 7.52 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 G 7.81 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 0.00 203 N 7.95 4.65 0.00 2.80 2.82 0.00 0.00 6.57 7.05 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 0.00 204 N 8.38 5.15 0.00 2.82 2.91 0.00 0.00 7.23 7.71 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 0.00 205 I 7.87 4.43 1.81 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 1.25 0.79 0.93 0.00 0.00 206 K 9.37 4.82 0.00 1.69 2.03 0.00 1.72 0.00 0.00 1.90 0.00 0.00 2.86 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.35 1.27 7.81 207 L 7.92 5.16 0.00 1.85 1.54 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 208 V 9.09 4.84 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 0.93 0.00 0.00 0.97 0.00 0.00 209 I 8.96 4.97 1.51 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 0.57 0.19 0.00 0.00 210 I 8.90 4.76 1.91 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 1.20 1.22 1.08 0.00 0.00 211 D 8.87 4.77 0.00 2.66 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 S 8.59 5.49 0.00 4.07 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 0.00 213 L 9.02 4.47 0.00 1.73 1.93 1.01 0.78 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 0.00 214 T 8.20 4.92 4.35 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 1.26 0.00 0.00 215 S 8.46 4.26 0.00 4.15 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 0.00 216 T 7.99 3.87 4.36 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 1.28 0.00 0.00 217 F 8.38 4.44 0.00 3.24 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 0.00 218 R 8.27 4.16 0.00 2.08 2.20 0.00 3.15 0.00 0.00 3.42 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.78 0.00 219 N 7.95 4.64 0.00 2.70 2.93 0.00 0.00 7.02 7.83 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 0.00 220 E 8.06 4.11 0.00 1.47 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 2.16 2.52 0.00 221 F 7.95 4.88 0.00 3.04 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 0.00 222 T 8.11 4.07 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 1.33 0.00 0.00 223 G 8.13 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 0.00 224 R 8.69 4.27 0.00 1.84 2.01 0.00 3.22 0.00 0.00 3.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 225 G 7.92 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 0.00 226 K 7.81 4.68 0.00 1.85 2.01 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.67 1.56 7.81 227 L 8.25 4.00 0.00 1.82 1.76 0.91 1.09 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 0.00 228 A 7.97 3.96 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 0.00 229 E 8.07 3.84 0.00 2.12 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 0.00 2.46 2.44 0.00 230 R 7.55 2.93 0.00 1.93 1.90 0.00 3.27 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 231 Q 8.14 3.87 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 232 Q 7.84 3.88 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 233 K 7.70 4.01 0.00 1.79 1.90 0.00 1.93 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.69 1.56 7.81 234 L 7.84 3.64 0.00 1.09 1.29 0.10 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 235 G 8.07 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 236 R 7.87 3.98 0.00 2.02 2.02 0.00 3.16 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 237 H 8.18 4.24 0.00 3.45 3.46 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 M 8.25 3.95 0.00 2.01 2.18 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.96 0.00 239 A 7.95 3.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.07 3.83 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 1.25 0.00 0.00 241 L 7.96 3.97 0.00 1.81 1.67 0.77 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 242 N 8.40 4.33 0.00 2.82 2.84 0.00 0.00 6.71 7.59 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 0.00 243 K 8.27 3.90 0.00 1.86 1.79 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.39 7.81 244 L 7.97 4.04 0.00 2.27 2.05 1.01 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 245 A 7.85 4.17 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 0.00 246 D 7.86 4.20 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 0.00 247 L 7.51 3.65 0.00 1.44 0.61 0.77 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 248 Y 7.24 4.65 0.00 3.23 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 0.00 249 N 7.54 4.23 0.00 2.87 3.06 0.00 0.00 6.83 7.78 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 0.00 250 C 7.67 5.50 0.00 3.25 3.41 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 0.00 251 I 8.49 4.48 1.76 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 0.99 1.05 0.23 0.00 0.00 252 V 8.13 4.76 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 0.95 0.00 0.00 0.97 0.00 0.00 253 L 9.55 5.30 0.00 1.59 1.50 0.90 0.91 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 0.00 254 V 8.78 5.14 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 0.78 0.00 0.00 0.95 0.00 0.00 255 T 8.50 5.29 4.36 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 1.31 0.00 0.00 256 N 9.12 5.34 0.00 2.82 2.75 0.00 0.00 7.41 6.49 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 0.00 257 Q 8.24 4.79 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.40 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 258 V 8.29 5.22 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 0.84 0.00 0.00 1.00 0.00 0.00 259 A 8.67 4.69 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 0.00 260 A 9.26 4.11 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 261 K 9.42 3.57 0.00 1.81 1.85 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.35 1.48 7.81 *269 A 7.64 4.32 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 0.00 270 E 7.50 5.15 0.00 1.55 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 2.16 2.30 0.00 271 Q 8.65 4.84 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.98 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 272 A 9.25 4.85 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 273 I 8.13 4.08 1.93 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.71 0.98 0.00 0.00 274 G 9.94 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 0.00 0.00 0.00 275 G 8.13 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 276 H 8.65 4.11 0.00 3.20 3.32 0.00 5.68 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 0.00 277 V 7.87 3.55 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 0.99 0.00 0.00 0.97 0.00 0.00 278 V 7.55 3.69 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 0.94 0.00 0.00 0.90 0.00 0.00 279 G 7.53 3.59 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 0.00 0.00 0.00 280 H 8.22 4.35 0.00 3.08 3.29 0.00 5.66 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 281 A 7.62 4.14 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 0.00 282 A 7.40 4.10 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 0.00 283 T 8.76 3.96 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 0.85 0.00 0.00 284 F 8.13 5.00 0.00 2.83 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 0.00 285 R 8.19 4.61 0.00 0.67 0.96 0.00 2.97 0.00 0.00 2.73 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.12 0.00 286 F 8.93 5.45 0.00 2.71 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 0.00 287 F 9.47 5.73 0.00 3.02 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 0.00 288 L 9.47 5.57 0.00 1.84 1.73 1.36 1.05 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 0.00 289 R 8.80 4.74 0.00 1.79 1.95 0.00 2.73 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 290 K 8.46 4.47 0.00 1.54 1.66 0.00 1.55 0.00 0.00 1.64 0.00 0.00 2.13 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.27 1.23 7.81 291 S 7.95 4.71 0.00 3.77 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 0.00 292 K 8.64 4.13 0.00 1.75 1.71 0.00 1.81 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.36 7.81 293 G 8.21 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 0.00 294 D 8.57 4.62 0.00 3.12 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 0.00 295 K 7.79 4.60 0.00 1.81 1.64 0.00 1.55 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.51 7.81 296 R 8.66 4.81 0.00 0.67 0.99 0.00 3.19 0.00 0.00 2.90 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.45 0.00 297 V 8.46 4.86 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 1.08 0.00 0.00 0.89 0.00 0.00 298 A 9.50 5.38 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 299 K 9.67 4.98 0.00 2.01 2.14 0.00 1.81 0.00 0.00 1.86 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.63 7.81 300 L 9.18 4.05 0.00 1.51 1.56 0.07 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 301 Y 8.14 5.03 0.00 2.97 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 0.00 302 D 6.65 4.51 0.00 2.21 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 0.00 0.00 0.00 303 S 8.09 5.10 0.00 3.24 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 0.00 304 P 0.00 4.34 0.00 2.09 2.05 0.00 3.03 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 1.88 1.70 0.00 305 H 7.90 4.87 0.00 3.20 3.29 0.00 5.48 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 306 L 7.71 4.68 0.00 1.55 1.55 1.12 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 307 P 0.00 4.58 0.00 2.17 2.03 0.00 3.75 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 1.97 1.97 0.00 308 D 8.26 4.80 0.00 2.68 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 0.00 309 S 8.45 4.65 0.00 3.90 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 0.00 310 E 8.90 5.51 0.00 1.93 1.90 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 2.31 2.35 0.00 311 A 9.03 4.92 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 312 V 8.90 4.72 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 0.77 0.00 0.00 0.95 0.00 0.00 313 F 8.55 5.08 0.00 3.28 3.11 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 0.00 314 R 9.22 5.12 0.00 1.79 1.81 0.00 3.07 0.00 0.00 3.60 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 315 I 8.40 5.00 1.89 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.95 0.93 0.00 0.00 316 T 8.93 4.71 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 1.22 0.00 0.00 317 E 8.88 3.98 0.00 2.07 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 0.00 2.27 2.40 0.00 318 K 7.91 4.14 0.00 2.03 1.90 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.46 1.39 7.81 319 G 6.53 4.07 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 0.00 0.00 0.00 320 I 9.18 4.74 1.78 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.57 0.72 0.00 0.00 321 Q 8.68 4.80 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 5.43 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 322 D 8.77 4.91 0.00 2.83 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 * Residues marked with a * may have inaccurate shift predictions.