NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2558 7.8827 121.4560 61.2023 38.7645 173.7582 17 V 4.4153 8.8461 125.7978 61.7274 32.8151 174.3984 18 G 3.8080 8.4696 114.1632 46.6131 0.0000 173.3662 19 G 4.2399 7.7868 110.1712 44.1723 0.0000 172.6233 20 Y 4.9715 7.8979 117.2015 55.2291 42.2871 174.8998 21 T 4.1032 8.6007 117.0955 63.9033 68.4125 175.2192 22 C 4.2904 8.5209 125.2637 60.7069 35.2787 174.9751 23 G 4.1108 8.7019 106.3388 44.0205 0.0000 172.8064 24 A 4.1735 8.6993 125.3167 53.8412 18.4932 176.9333 25 N 4.2390 8.8228 119.9758 54.5887 36.2255 175.3050 26 T 4.2418 7.5828 107.1765 62.4903 70.0124 175.0800 27 V 4.0810 7.0188 121.8647 59.7170 31.3777 173.5312 28 P 4.5180 0.0000 0.0000 64.3903 31.6910 178.2543 29 Y 5.0385 6.8727 114.7228 56.6146 38.7856 174.5920 30 Q 4.6039 7.3633 123.5945 56.3342 29.5807 175.4740 31 V 4.8777 8.9527 118.7000 59.6247 36.2772 174.1916 32 S 4.7819 8.6897 117.0871 56.5321 64.9632 172.7193 33 L 4.4132 8.5140 127.8769 53.6328 42.9702 175.1806 34 N 5.6774 8.9550 122.5056 49.9140 42.2224 174.8485 *37 S 4.2229 8.4040 119.7711 58.3529 64.1369 174.5208 38 G 4.0135 9.1338 107.8912 45.9516 0.0000 172.6035 39 Y 4.4823 6.4916 113.6604 56.3192 40.8380 172.6278 40 H 4.5387 8.8809 121.7827 56.0903 30.3239 174.7371 41 F 5.0051 7.6115 120.2216 56.9066 39.7133 174.0378 42 C 4.7505 6.7768 114.8848 56.2052 44.7139 173.3534 43 G 4.2228 8.7112 109.5141 45.5643 0.0000 172.2721 44 G 4.4336 8.0305 105.6190 46.3586 0.0000 172.6807 45 S 5.4967 8.7829 115.4552 56.4493 66.9358 173.5514 46 L 4.8639 9.1250 127.2975 54.6867 42.3946 177.0443 47 I 4.3866 8.5108 119.8559 61.1334 38.6760 174.4767 48 N 4.6493 7.6259 117.4640 52.0867 39.5354 175.0965 49 S 4.3110 8.6244 112.1382 60.8576 63.1276 175.1211 50 Q 4.6173 9.1740 118.1411 55.0033 30.9538 175.0082 51 W 5.4415 8.4419 118.3193 54.7538 33.3353 174.4895 52 V 5.1504 9.1700 123.3790 61.0674 34.5537 174.3361 53 V 4.9533 8.9050 126.8546 60.5201 33.6655 174.9316 54 S 5.1239 9.0244 117.3898 57.6810 66.0947 172.1061 55 A 4.6439 8.5116 120.4808 50.8090 20.2694 178.5730 56 A 3.8099 8.2816 124.1052 55.2207 18.4832 179.2112 57 H 4.5339 8.1821 109.2718 57.2639 28.6870 175.3201 58 C 4.6931 7.7067 117.1884 57.2139 40.5668 173.3616 59 Y 4.2478 7.7849 122.2443 57.5248 38.8667 175.1703 60 K 3.5338 6.5300 122.8462 56.0863 34.4312 174.5319 61 S 4.2003 8.1756 115.0658 58.4384 64.2551 173.2346 62 G 3.7104 8.2772 106.2072 46.7473 0.0000 173.8139 63 I 4.2329 7.4839 119.6990 60.0617 39.2229 175.2679 64 Q 4.7605 8.8337 128.2588 54.1821 31.5376 174.2100 65 V 4.1596 8.9172 127.3509 62.0516 33.3961 174.6389 65A R 5.0820 8.8264 127.3158 54.7041 32.3125 175.1965 66 L 4.7484 9.0572 124.7808 52.6588 44.8206 177.5595 *69 G 3.9668 8.2360 107.3135 45.4648 0.0000 172.8520 70 E 4.5085 8.1917 118.1675 55.2759 30.4091 174.1522 71 D 4.7585 7.8069 117.0762 55.1608 43.7846 174.2514 72 N 4.9727 8.8071 122.3810 52.7821 38.9746 176.1228 73 I 3.7910 8.3557 119.7545 62.1158 37.8249 176.2893 74 N 4.7897 7.9340 117.1714 53.1112 39.5323 174.6528 75 V 4.3074 7.3501 117.5787 60.7189 34.4145 175.0514 76 V 4.0966 8.4403 126.7577 62.6622 30.7903 175.0843 77 E 4.3477 9.2177 127.8096 55.4926 30.5369 176.9198 78 G 4.0042 8.7542 106.4813 45.8329 0.0000 174.0966 79 N 4.6078 8.9983 116.9003 52.7528 36.7691 174.5146 80 E 4.5031 7.6295 116.9003 56.3945 30.7616 176.4444 81 Q 4.3767 9.0453 120.7976 54.4487 32.8897 173.9500 82 F 5.5449 8.8380 123.2775 56.0613 40.8612 175.4665 83 I 4.7024 8.8964 124.6394 59.4074 41.0976 175.4063 84 S 4.5618 8.7202 122.2753 58.3306 64.2864 173.0706 85 A 4.5585 8.3051 125.7401 51.8301 18.3543 177.9224 86 S 4.4553 9.0091 118.6285 60.5261 64.3306 174.8621 87 K 4.5568 7.4854 116.4096 55.8603 35.3164 174.5476 88 S 5.1714 8.8888 118.1466 56.9611 65.8683 173.6666 89 I 4.4392 9.4262 126.5297 59.4851 38.8675 174.8378 90 V 4.1477 8.2159 127.3251 62.1331 32.6489 175.1896 91 H 3.8814 8.6212 127.2765 56.0721 29.9561 174.3672 92 P 4.3055 0.0000 0.0000 65.3712 31.3631 177.1820 93 S 4.6782 8.0210 111.5213 58.0662 63.0553 173.3396 94 Y 4.2868 7.9663 122.7193 57.7464 39.0592 174.9801 95 N 4.4860 8.1392 125.5376 51.3690 40.1322 175.1190 96 S 4.0246 7.8832 120.7225 60.1438 63.5933 175.1210 97 N 4.3953 8.4733 119.4431 55.3303 38.6013 176.0779 98 T 4.0028 7.7046 105.4169 60.6583 70.1167 174.9482 99 L 3.7435 8.0684 120.8378 55.4098 39.7891 173.8842 100 N 4.4979 7.6669 117.7287 54.5626 39.4745 174.5967 101 N 4.6775 8.6818 119.7209 54.2673 35.8654 175.4472 102 D 4.7303 7.9940 117.6209 53.1101 39.6731 174.4625 103 I 4.7772 7.1587 120.9456 59.2753 42.3048 172.8278 104 M 5.3655 9.2458 127.1802 54.1099 36.2130 173.2849 105 L 5.4195 9.3206 124.9977 53.1814 44.8976 175.3795 106 I 5.0132 9.2203 123.7566 59.4273 40.5602 174.2431 107 K 3.7056 8.4850 128.7390 54.4828 33.5809 175.5354 108 L 4.3543 8.3234 127.9723 54.0933 41.9470 177.0756 109 K 4.0365 8.7982 124.7989 59.1110 32.5973 177.2802 110 S 4.6653 7.7218 112.6861 56.0192 66.7643 173.3384 111 A 4.3895 8.4040 124.6144 51.9938 18.7438 177.4474 112 A 4.2367 9.0121 123.7805 51.8761 19.7613 177.6669 113 S 4.5328 9.0265 116.9732 57.2259 63.4009 174.5255 114 L 4.5255 8.4964 125.9761 54.4198 42.5828 176.6252 115 N 4.8410 8.8270 119.5714 52.3871 39.4604 174.8518 116 S 4.0995 8.7237 111.3026 61.3027 63.4813 175.1552 117 R 4.1670 8.9427 120.1349 56.8090 30.6238 175.7991 118 V 4.6106 7.8061 116.4387 60.8902 33.2208 173.6889 119 A 5.2079 8.3809 128.0794 50.1800 22.9800 175.0052 120 S 5.1186 8.7116 113.7879 57.6993 64.9563 173.1165 121 I 4.4773 8.2680 121.2056 59.2081 39.6509 175.4511 122 S 4.4632 8.3923 123.7257 58.2762 64.1670 173.7077 123 L 4.3766 8.3249 122.8816 53.2126 42.5682 175.3216 124 P 4.4811 0.0000 0.0000 63.1020 32.0516 176.2942 125 T 4.2060 8.2463 108.8276 62.2708 70.0956 174.5220 *127 S 4.5342 7.5694 114.8852 58.0528 64.0426 174.0953 128 C 4.4262 8.4032 118.1576 56.6538 40.7278 173.6257 129 A 4.3402 8.0799 125.2227 51.6173 19.4841 177.4075 130 S 4.3906 8.0866 114.3998 56.7447 65.1497 173.1706 *132 A 4.2001 8.1644 123.1187 53.4441 19.1814 177.2678 133 G 3.9629 9.1142 110.3795 45.2733 0.0000 174.3163 134 T 3.9562 7.4639 117.2267 63.6748 69.4200 173.3615 135 Q 4.6175 8.5799 127.6915 55.7729 30.1488 175.2712 136 C 5.2793 9.3527 122.7534 55.1387 46.3556 172.2841 137 L 5.1667 9.1009 122.5595 53.5565 43.9904 175.0421 138 I 5.1731 9.1246 127.2917 58.8206 40.1181 174.8254 139 S 4.9241 8.6484 119.2034 56.4027 66.6222 173.0585 140 G 3.7979 7.2242 108.6206 46.1443 0.0000 172.7948 141 W 4.7436 8.4909 117.0113 56.2548 29.3753 177.0648 142 G 4.1447 8.4149 109.1394 44.4456 0.0000 173.5352 143 N 4.2348 8.9702 118.6669 54.3172 39.0033 174.6123 144 T 5.1124 8.2124 113.1017 60.5726 69.6367 174.3046 145 K 4.5773 7.7114 121.7620 54.6677 34.4263 176.2915 146 S 4.1763 8.7161 118.0136 60.3583 62.6060 173.5427 147 S 4.3529 8.0919 113.6338 57.5666 62.4915 171.5067 148 G 3.8182 7.9053 111.8716 43.5056 0.0000 170.3527 149 T 4.5053 8.0474 115.6224 61.6509 71.2947 174.7010 150 S 4.2251 9.7005 122.9332 57.7956 64.9106 171.9749 151 Y 5.1413 8.3363 125.4924 56.0483 38.9004 174.3214 152 P 4.6999 0.0000 0.0000 62.4196 33.0246 175.8933 153 D 4.5816 8.7625 118.7842 56.5058 41.3899 177.1836 154 V 5.4681 7.3988 109.8302 58.5460 34.4629 175.8259 155 L 3.1571 8.2975 124.0539 55.0589 42.9754 176.0012 156 K 4.8277 8.1015 124.8686 54.9297 35.0663 174.6222 157 C 5.1979 8.7768 119.7736 55.2028 42.7227 173.0326 158 L 4.9261 8.4588 122.4666 53.9656 45.6024 174.3553 159 K 5.0967 9.0256 125.8266 55.4215 33.3246 175.9198 160 A 4.8415 9.1462 126.4890 49.7238 23.1548 173.1439 161 P 5.1120 0.0000 0.0000 61.5047 34.1493 174.9073 162 I 4.4188 8.2336 122.6619 61.3883 38.1062 175.7122 163 L 4.8642 8.7193 127.3079 53.1386 43.5661 176.9545 164 S 4.2961 8.4360 115.0357 58.1448 63.9059 174.9160 165 D 4.4132 8.7314 121.2687 57.5352 41.0592 178.8025 166 S 4.1542 8.0138 114.4896 61.6313 63.2028 176.5840 167 S 4.3124 7.9571 119.7720 60.5178 62.5207 175.8893 168 C 4.3359 8.1424 121.1059 59.8201 41.7597 175.9071 169 K 4.0025 8.3411 120.2139 59.1628 31.4198 179.5194 170 S 4.2807 8.1034 114.2685 61.0767 62.8124 176.3776 171 A 3.9001 7.6256 123.3492 53.5764 19.7857 177.2377 172 Y 4.8306 7.8201 113.8942 54.9101 38.2684 172.7200 173 P 4.4579 0.0000 0.0000 63.3509 32.2197 176.7268 174 G 4.0533 9.0614 110.0193 46.4745 0.0000 173.7119 175 Q 4.5517 8.2385 116.3040 55.0398 30.6029 175.5232 176 I 4.4136 7.9013 119.6446 59.9917 38.3116 175.4680 177 T 4.5565 8.2258 115.7392 59.6295 70.8449 175.4222 178 S 4.3041 8.5356 115.2415 60.5369 63.1560 174.4604 179 N 4.9560 8.0946 118.6893 53.3205 38.4492 173.8530 180 M 5.6197 7.8309 116.8668 53.9735 36.4519 174.5219 181 F 5.1000 8.6437 114.1415 56.1060 41.8811 172.5719 182 C 5.4898 9.0868 117.1377 55.9666 42.2603 172.5058 183 A 5.0297 9.1861 122.1772 51.0612 22.4158 175.6054 184 G 4.0089 7.0371 107.5405 44.7142 0.0000 172.6120 184A Y 4.6800 8.4597 119.3803 56.0435 41.1963 176.4886 185 L 4.1675 8.6143 124.6617 57.3515 42.0620 178.8507 186 E 4.0859 8.2338 116.9219 57.1648 29.7158 177.4528 187 G 3.8667 7.6008 105.2691 45.2921 0.0000 173.1944 188 G 4.0080 9.5733 106.4900 44.7217 0.0000 173.4256 188A K 4.9928 7.2826 117.5754 55.1510 35.5953 175.1075 189 D 4.6555 8.7859 123.3470 53.8133 45.6184 174.9141 190 S 4.9169 8.8119 116.9286 58.0386 65.1692 173.0075 191 C 4.7619 9.5292 119.1969 55.1583 45.5895 172.1694 192 Q 4.2718 8.7026 120.9969 57.9538 28.7210 176.6505 193 G 4.2706 8.5223 112.0421 46.1411 0.0000 174.4287 194 D 4.6445 8.6657 118.8405 55.5813 41.6329 176.6321 195 S 4.4019 8.0904 115.1910 60.4892 63.2302 175.5949 196 G 4.1328 8.9836 112.9442 46.3579 0.0000 173.6206 197 G 4.2923 7.9785 107.7080 44.9451 0.0000 171.1818 198 P 5.1029 0.0000 0.0000 62.3961 33.5191 175.8555 199 V 4.6124 8.4920 120.5198 61.4656 34.3396 173.9086 200 V 4.8646 8.7618 128.8821 61.2302 33.9577 173.6711 201 C 5.1797 8.9392 125.3049 55.2642 43.5237 174.5792 202 S 3.3703 9.6856 119.8791 59.4526 61.2854 173.2103 203 G 3.9149 8.3017 104.2775 46.5814 0.0000 173.3259 204 K 4.6878 7.5183 118.3068 53.1292 34.9919 175.4212 *209 L 4.2204 8.2752 123.1597 55.4288 42.0454 175.7767 210 Q 4.5217 8.7480 125.8924 56.6311 30.8180 175.8326 211 G 5.2553 8.0186 104.6029 45.7851 0.0000 171.4363 212 I 5.2147 8.2000 119.8089 58.8405 41.0807 175.2450 213 V 3.6399 8.9585 127.4285 64.0108 31.7712 174.2250 214 S 4.8561 8.4667 121.3829 58.6130 64.3171 174.8752 215 W 5.0096 7.3830 114.5283 56.4321 31.7695 172.7738 216 G 3.9366 8.4358 107.6705 46.6345 0.0000 172.9292 217 S 4.6193 8.3172 115.3514 56.8846 62.3292 172.7825 *219 G 4.3732 8.0178 118.4667 45.6621 0.0000 170.9435 220 C 4.9135 8.1320 116.0053 56.4576 44.8302 173.9006 221 A 3.9365 9.1481 125.8238 53.1705 16.5610 176.8639 221A Q 4.5310 7.3859 118.2147 56.2195 29.7046 176.2025 222 K 4.1872 8.3767 120.5513 58.2411 33.2174 176.5881 223 N 4.2918 9.1227 117.6642 54.0419 36.8935 175.5147 224 K 4.3266 7.5450 117.5776 53.8088 32.5221 173.7885 225 P 4.6314 0.0000 0.0000 62.0355 33.2232 177.3398 226 G 3.6765 8.4851 106.1922 46.1237 0.0000 172.7536 227 V 4.4522 7.8289 121.9588 60.7555 34.0673 174.1664 228 Y 4.8514 8.3322 124.0088 55.9928 42.4927 174.8029 229 T 4.4677 8.4681 119.3146 63.5166 70.0217 174.4825 230 K 5.0949 9.2858 128.4669 55.4891 31.3042 177.0848 231 V 3.9415 8.8527 126.4687 65.9203 31.3918 174.8906 232 C 4.4356 8.3557 112.5722 58.3338 41.4364 174.8936 233 N 4.2319 8.0085 117.0510 54.5270 38.5295 175.5795 234 Y 4.8214 8.0440 117.6806 57.3591 38.8528 177.2279 235 V 3.6816 7.9159 121.2159 66.4636 31.5676 178.0201 236 S 4.1622 8.1105 114.1743 61.3012 62.7419 176.3335 237 W 4.1346 8.3074 130.6113 60.4099 30.4823 177.9256 238 I 3.2226 8.3410 120.0801 64.2336 36.6183 178.5678 239 K 3.7491 7.9304 119.1427 59.6028 31.6547 179.5361 240 Q 3.9034 7.7958 117.0996 59.0739 28.3979 178.6798 241 T 3.6988 7.4155 116.8100 66.4686 68.2271 176.9967 242 I 2.6254 7.2766 121.6636 63.8549 36.7212 178.4001 243 A 4.0042 7.7397 120.9167 54.0797 18.1840 178.7479 244 S 4.6391 7.2508 109.8363 58.2624 63.5144 174.0990 245 N 4.6715 7.8782 125.6651 53.8921 39.3059 174.0374 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 16 I 7.88 4.26 1.81 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 1.39 0.73 0.87 0.00 0.00 17 V 8.85 4.42 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 1.03 0.00 0.00 0.99 0.00 0.00 18 G 8.47 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 19 G 7.79 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 0.00 0.00 0.00 20 Y 7.90 4.97 0.00 2.94 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.60 4.10 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 1.23 0.00 0.00 22 C 8.52 4.29 0.00 2.78 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 23 G 8.70 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 0.00 0.00 0.00 24 A 8.70 4.17 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 0.00 0.00 0.00 0.00 0.00 25 N 8.82 4.24 0.00 2.87 2.90 0.00 0.00 7.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.58 4.24 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 27 V 7.02 4.08 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 0.32 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.52 0.00 2.38 2.31 0.00 3.78 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.97 0.00 29 Y 6.87 5.04 0.00 3.27 3.43 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 30 Q 7.36 4.60 0.00 1.83 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.73 0.00 0.00 0.00 0.00 0.00 1.93 2.53 0.00 31 V 8.95 4.88 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 0.80 0.00 0.00 0.98 0.00 0.00 32 S 8.69 4.78 0.00 3.06 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.51 4.41 0.00 0.39 0.85 0.76 0.15 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 34 N 8.96 5.68 0.00 2.46 2.42 0.00 0.00 6.78 8.38 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 *37 S 8.40 4.22 0.00 3.80 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 38 G 9.13 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 6.49 4.48 0.00 3.10 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 40 H 8.88 4.54 0.00 2.84 3.14 0.00 5.86 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 41 F 7.61 5.01 0.00 3.00 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 42 C 6.78 4.75 0.00 2.19 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.71 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.03 4.43 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 0.00 45 S 8.78 5.50 0.00 3.81 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 46 L 9.13 4.86 0.00 1.88 1.68 1.09 0.87 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 47 I 8.51 4.39 1.90 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 1.64 0.90 0.96 0.00 0.00 48 N 7.63 4.65 0.00 2.99 3.00 0.00 0.00 6.01 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.62 4.31 0.00 4.05 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 9.17 4.62 0.00 2.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.79 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 51 W 8.44 5.44 0.00 3.35 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 9.17 5.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.98 0.00 0.00 53 V 8.91 4.95 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 1.02 0.00 0.00 54 S 9.02 5.12 0.00 3.87 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 55 A 8.51 4.64 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.28 3.81 0.27 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 57 H 8.18 4.53 0.00 3.40 3.57 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.71 4.69 0.00 3.22 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 7.78 4.25 0.00 2.96 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 6.53 3.53 0.00 1.45 1.30 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.51 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.74 0.83 7.81 61 S 8.18 4.20 0.00 3.92 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 62 G 8.28 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 63 I 7.48 4.23 1.85 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 0.59 0.92 0.00 0.00 64 Q 8.83 4.76 0.00 1.99 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.91 0.00 0.00 0.00 0.00 0.00 2.02 2.18 0.00 65 V 8.92 4.16 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 0.95 0.00 0.00 0.89 0.00 0.00 65A R 8.83 5.08 0.00 1.61 1.71 0.00 2.61 0.00 0.00 2.46 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 1.11 0.00 66 L 9.06 4.75 0.00 1.62 1.63 0.96 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.24 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.19 4.51 0.00 2.07 1.86 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 2.35 2.09 0.00 71 D 7.81 4.76 0.00 2.77 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 72 N 8.81 4.97 0.00 2.88 2.85 0.00 0.00 7.18 7.60 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 73 I 8.36 3.79 1.42 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 1.22 0.52 -0.47 0.00 0.00 74 N 7.93 4.79 0.00 2.72 2.88 0.00 0.00 6.66 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 75 V 7.35 4.31 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 0.77 0.00 0.00 1.00 0.00 0.00 76 V 8.44 4.10 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 0.81 0.00 0.00 0.95 0.00 0.00 77 E 9.22 4.35 0.00 1.98 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 2.28 2.45 0.00 78 G 8.75 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 79 N 9.00 4.61 0.00 2.93 3.12 0.00 0.00 6.95 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.63 4.50 0.00 1.57 1.77 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 2.71 2.45 0.00 81 Q 9.05 4.38 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 82 F 8.84 5.54 0.00 2.80 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 83 I 8.90 4.70 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 1.25 0.74 0.93 0.00 0.00 84 S 8.72 4.56 0.00 3.75 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.31 4.56 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 S 9.01 4.46 0.00 3.77 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 87 K 7.49 4.56 0.00 1.83 1.88 0.00 1.54 0.00 0.00 1.90 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.24 1.35 7.81 88 S 8.89 5.17 0.00 4.10 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 89 I 9.43 4.44 2.06 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.00 1.07 0.00 0.00 90 V 8.22 4.15 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 0.60 0.00 0.00 0.70 0.00 0.00 91 H 8.62 3.88 0.00 2.91 3.06 0.00 5.66 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.31 0.00 2.08 2.15 0.00 3.23 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.23 0.00 93 S 8.02 4.68 0.00 3.89 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.97 4.29 0.00 2.93 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 95 N 8.14 4.49 0.00 2.58 2.43 0.00 0.00 6.65 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 96 S 7.88 4.02 0.00 3.95 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.47 4.40 0.00 2.70 2.78 0.00 0.00 6.86 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 98 T 7.70 4.00 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 1.09 0.00 0.00 99 L 8.07 3.74 0.00 1.40 1.84 0.48 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.67 4.50 0.00 2.73 2.63 0.00 0.00 7.25 7.63 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 0.00 101 N 8.68 4.68 0.00 2.91 2.60 0.00 0.00 7.24 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.99 4.73 0.00 3.06 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 0.00 103 I 7.16 4.78 1.45 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.15 0.15 0.00 0.00 104 M 9.25 5.37 0.00 2.22 1.80 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.63 0.00 105 L 9.32 5.42 0.00 1.82 1.93 0.34 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.22 5.01 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 1.19 0.96 0.93 0.00 0.00 107 K 8.49 3.71 0.00 0.79 1.08 0.00 1.34 0.00 0.00 1.35 0.00 0.00 2.85 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.75 0.21 7.81 108 L 8.32 4.35 0.00 1.43 1.58 0.90 0.80 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 0.00 109 K 8.80 4.04 0.00 1.77 1.85 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.40 7.81 110 S 7.72 4.67 0.00 3.81 3.67 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 0.00 111 A 8.40 4.39 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 9.01 4.24 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 0.00 113 S 9.03 4.53 0.00 3.75 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.50 4.53 0.00 1.66 1.63 0.96 1.07 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 0.00 115 N 8.83 4.84 0.00 2.89 2.92 0.00 0.00 6.50 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.72 4.10 0.00 4.01 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 0.00 117 R 8.94 4.17 0.00 1.93 2.02 0.00 3.24 0.00 0.00 3.10 7.38 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.57 4.53 0.00 4.00 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 0.00 128 C 8.40 4.43 0.00 2.94 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 0.00 129 A 8.08 4.34 1.04 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 0.00 130 S 8.09 4.39 0.00 3.97 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *132 A 8.16 4.20 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.11 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 0.00 134 T 7.46 3.96 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 1.14 0.00 0.00 135 Q 8.58 4.62 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 136 C 9.35 5.28 0.00 2.78 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 0.00 137 L 9.10 5.17 0.00 1.75 1.57 1.01 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.12 5.17 1.90 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.51 1.00 0.00 0.00 139 S 8.65 4.92 0.00 3.55 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 0.00 140 G 7.22 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.49 4.74 0.00 3.08 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.41 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.97 4.23 0.00 2.45 2.72 0.00 0.00 7.12 7.33 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 0.00 144 T 8.21 5.11 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 1.31 0.00 0.00 145 K 7.71 4.58 0.00 1.64 1.70 0.00 1.61 0.00 0.00 1.59 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 1.42 7.81 146 S 8.72 4.18 0.00 3.83 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 0.00 147 S 8.09 4.35 0.00 3.81 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 0.00 148 G 7.91 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 0.00 0.00 0.00 149 T 8.05 4.51 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 150 S 9.70 4.23 0.00 3.73 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.34 5.14 0.00 3.00 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 0.00 152 P 0.00 4.70 0.00 2.45 2.11 0.00 4.21 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 2.20 2.07 0.00 153 D 8.76 4.58 0.00 2.80 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 V 7.40 5.47 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 1.12 0.00 0.00 0.97 0.00 0.00 155 L 8.30 3.16 0.00 1.41 1.27 -0.60 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.10 4.83 0.00 1.70 1.51 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.49 7.81 157 C 8.78 5.20 0.00 1.62 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 0.00 0.00 0.00 0.00 158 L 8.46 4.93 0.00 1.72 1.46 1.01 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.03 5.10 0.00 1.83 1.83 0.00 1.88 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.51 7.81 160 A 9.15 4.84 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 5.11 0.00 2.00 2.06 0.00 3.13 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.68 0.00 162 I 8.23 4.42 1.71 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.58 0.72 0.00 0.00 163 L 8.72 4.86 0.00 1.55 1.59 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.44 4.30 0.00 4.00 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 0.00 165 D 8.73 4.41 0.00 2.84 2.73 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 0.00 166 S 8.01 4.15 0.00 4.10 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 0.00 167 S 7.96 4.31 0.00 4.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.14 4.34 0.00 3.25 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.34 4.00 0.00 1.89 1.90 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.38 0.00 0.00 0.00 0.00 1.54 1.65 7.81 170 S 8.10 4.28 0.00 4.08 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 A 7.63 3.90 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 0.00 172 Y 7.82 4.83 0.00 3.11 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 0.00 173 P 0.00 4.46 0.00 2.08 2.07 0.00 3.94 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.19 0.00 174 G 9.06 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.24 4.55 0.00 2.35 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.21 6.61 0.00 0.00 0.00 0.00 0.00 2.30 2.65 0.00 176 I 7.90 4.41 1.99 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 1.86 0.96 1.00 0.00 0.00 177 T 8.23 4.56 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 1.25 0.00 0.00 178 S 8.54 4.30 0.00 4.01 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 8.09 4.96 0.00 3.01 3.09 0.00 0.00 6.59 9.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 7.83 5.62 0.00 1.82 2.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.61 0.00 181 F 8.64 5.10 0.00 3.07 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 0.00 182 C 9.09 5.49 0.00 3.00 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 0.00 183 A 9.19 5.03 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 0.00 184 G 7.04 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A Y 8.46 4.68 0.00 3.06 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.61 4.17 0.00 1.73 1.73 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.23 4.09 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 2.36 2.42 0.00 187 G 7.60 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 0.00 188 G 9.57 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A K 7.28 4.99 0.00 1.33 1.60 0.00 1.42 0.00 0.00 0.61 0.00 0.00 2.43 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.18 1.17 7.81 189 D 8.79 4.66 0.00 2.85 2.55 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 0.00 190 S 8.81 4.92 0.00 4.01 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 0.00 191 C 9.53 4.76 0.00 2.93 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.70 4.27 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.39 0.00 0.00 0.00 0.00 0.00 2.59 2.64 0.00 193 G 8.52 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 0.00 194 D 8.67 4.64 0.00 2.94 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 8.09 4.40 0.00 3.99 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 0.00 196 G 8.98 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 0.00 197 G 7.98 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 0.00 198 P 0.00 5.10 0.00 2.31 2.36 0.00 3.71 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 199 V 8.49 4.61 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 0.84 0.00 0.00 0.66 0.00 0.00 200 V 8.76 4.86 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 0.64 0.00 0.00 0.62 0.00 0.00 201 C 8.94 5.18 0.00 2.78 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.69 3.37 0.00 4.07 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 8.30 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.52 4.69 0.00 1.73 1.64 0.00 1.85 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.40 7.81 *209 L 8.28 4.22 0.00 1.50 1.64 1.02 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.75 4.52 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.39 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 211 G 8.02 5.26 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 0.00 212 I 8.20 5.21 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.12 0.96 0.00 0.00 213 V 8.96 3.64 2.37 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 0.83 0.00 0.00 1.17 0.00 0.00 214 S 8.47 4.86 0.00 3.90 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 0.00 215 W 7.38 5.01 0.00 3.40 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 0.00 216 G 8.44 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 0.00 217 S 8.32 4.62 0.00 4.32 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *219 G 8.02 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 0.00 0.00 0.00 0.00 220 C 8.13 4.91 0.00 2.95 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 0.00 221 A 9.15 3.94 1.40 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 221A Q 7.39 4.53 0.00 2.27 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.93 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 222 K 8.38 4.19 0.00 2.01 1.83 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.46 7.81 223 N 9.12 4.29 0.00 2.82 2.91 0.00 0.00 6.73 7.40 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 0.00 224 K 7.55 4.33 0.00 1.79 1.77 0.00 1.64 0.00 0.00 1.37 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.50 7.81 225 P 0.00 4.63 0.00 2.15 2.11 0.00 3.60 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 2.13 2.00 0.00 226 G 8.49 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.83 4.45 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 -0.70 0.00 0.00 228 Y 8.33 4.85 0.00 1.43 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.47 4.47 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 230 K 9.29 5.09 0.00 2.11 1.91 0.00 1.81 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.67 7.81 231 V 8.85 3.94 2.35 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 1.17 0.00 0.00 1.10 0.00 0.00 232 C 8.36 4.44 0.00 3.17 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 8.01 4.23 0.00 2.38 2.40 0.00 0.00 6.82 7.35 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 0.00 234 Y 8.04 4.82 0.00 3.18 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 7.92 3.68 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 1.09 0.00 0.00 1.08 0.00 0.00 236 S 8.11 4.16 0.00 3.98 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 W 8.31 4.13 0.00 3.53 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.34 3.22 2.04 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.03 0.77 0.00 0.00 239 K 7.93 3.75 0.00 1.74 1.76 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.57 7.81 240 Q 7.80 3.90 0.00 1.94 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.97 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 241 T 7.42 3.70 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 242 I 7.28 2.63 1.38 0.00 0.00 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 -0.30 0.22 0.31 0.00 0.00 243 A 7.74 4.00 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 0.00 244 S 7.25 4.64 0.00 4.01 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 0.00 245 N 7.88 4.67 0.00 2.98 3.03 0.00 0.00 6.74 7.74 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 * Residues marked with a * may have inaccurate shift predictions.