NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.6620 8.2785 119.2136 53.8329 40.4979 173.8213 3 A 4.1519 9.2874 119.7031 53.8401 18.9468 177.7424 4 Q 3.6793 8.5016 119.4995 59.6370 29.3275 177.5467 5 A 3.5351 7.7417 120.9785 54.8190 18.7378 179.2170 6 E 4.1339 7.6930 117.6262 59.7679 29.5466 179.4965 7 E 4.0183 8.5135 118.9062 59.1068 29.4345 179.2575 8 F 3.8670 7.5942 120.1039 60.8381 39.3977 176.8517 9 K 3.2575 7.9044 119.2693 59.4751 31.8911 178.5474 10 K 3.7854 7.7342 118.1451 59.6202 32.1264 178.5009 11 Y 4.0521 7.8527 119.4447 60.8622 38.6424 178.1981 12 L 3.5387 7.6820 120.0509 57.7010 41.5721 179.5455 13 E 4.1807 8.1529 120.0397 58.9972 29.2342 179.4640 14 T 3.9228 7.7551 108.7394 64.2400 68.7310 175.2021 15 N 4.5983 7.3348 117.3813 52.6752 38.7528 176.2550 16 G 3.8615 7.8473 108.9681 45.4194 0.0000 174.2506 17 I 3.9294 7.7268 122.2282 60.7367 37.2456 175.0443 18 K 4.6628 8.4048 127.0716 54.0938 33.5808 174.1429 19 P 3.8701 0.0000 0.0000 62.4856 32.3885 175.5024 20 K 4.5147 8.5878 120.2583 54.7085 35.7941 175.1714 21 Q 4.8101 8.2131 122.4870 54.9801 30.1969 175.1448 22 F 4.9339 9.3405 121.2787 56.1644 43.7067 173.5974 23 H 5.3928 8.7957 118.0451 53.2932 32.1482 173.8619 24 K 4.0221 8.2981 120.1569 58.0950 32.2663 178.0498 25 K 4.2483 8.4121 121.1007 56.5257 31.4478 175.8520 26 E 4.3251 7.7776 120.1119 55.8878 31.1165 175.0783 27 L 4.8834 8.2403 124.7974 53.3337 42.8288 176.4505 28 I 3.5391 8.4427 126.4365 63.6706 37.2688 176.3464 29 F 5.2399 7.4060 115.2433 55.0016 41.8989 172.9265 30 N 5.5493 8.7877 115.6955 50.6601 40.3628 175.1207 31 Q 3.8990 9.1241 118.4286 58.3011 28.6933 178.9811 32 W 4.9222 7.5361 112.8852 57.0873 29.5791 175.9630 33 D 4.5853 8.0213 120.1596 53.3940 40.7495 174.3901 34 P 4.3005 0.0000 0.0000 64.5844 31.9409 176.1009 35 Q 3.9103 8.4412 121.8800 55.4413 29.4781 174.7087 36 E 4.1977 8.1187 124.7200 55.6934 31.6494 174.8259 37 Y 5.2324 8.7766 119.8967 56.4070 43.2560 173.8499 38 C 4.9538 9.4266 120.7460 58.0172 34.2145 173.0222 39 I 4.5346 9.3062 130.0889 60.1789 38.1186 175.1467 40 F 5.1487 9.1404 132.0794 56.8566 39.3035 173.0211 41 L 4.2236 8.7763 126.6808 55.1845 42.2497 176.3383 42 Y 3.8157 8.6522 128.2511 59.7793 39.5433 174.9419 43 D 4.5162 8.5801 117.9517 53.1584 45.2529 173.5211 44 G 3.9174 8.4875 109.5985 43.9772 0.0000 171.9339 45 I 5.2380 8.3927 118.6652 59.7134 40.7463 175.4161 46 T 5.1989 9.1752 115.5105 59.9347 73.0478 172.5178 47 K 4.4786 8.9620 120.8477 54.8061 36.1565 174.8526 48 L 4.8899 8.8577 126.2731 54.0742 43.5303 175.4881 49 T 5.0947 8.6834 116.7795 60.0743 72.4589 173.0305 50 S 4.9201 8.8486 115.5648 56.8464 66.1925 172.4198 51 I 4.7076 8.2153 127.6118 59.6882 38.2228 176.0467 52 S 4.3919 8.6904 124.0882 57.8070 63.3883 175.3928 53 E 4.0500 8.5921 119.7144 58.7463 29.4220 177.5411 54 N 4.5141 8.0056 115.3534 53.0039 38.0088 175.7057 55 G 4.0720 8.1335 107.5511 45.0341 0.0000 173.9342 56 T 4.0911 8.1066 111.4016 61.6620 69.9472 173.7409 57 I 4.5481 8.3523 126.8758 60.8054 38.5079 174.6533 58 M 4.6328 8.9560 127.2099 53.7362 34.6326 174.0590 59 N 4.7827 8.8346 124.0524 52.8929 38.9588 174.5657 60 L 4.4897 8.5176 124.4576 56.2199 43.6636 176.9022 61 Q 4.5278 7.2337 116.6498 55.1273 32.3822 172.4906 62 Y 4.8162 8.3286 121.8106 56.2539 40.8191 174.5795 63 Y 4.5784 8.7288 120.7003 55.9981 41.4991 174.7401 64 K 4.8055 8.4036 123.7089 54.1231 34.8438 177.0184 65 G 3.9441 8.7582 112.6246 44.7024 0.0000 172.4210 66 A 4.7789 7.5310 116.9749 52.3551 21.6596 175.7423 67 F 4.5995 8.3399 121.4676 58.4869 43.8306 172.4988 68 V 5.0290 7.5671 122.9104 61.2324 33.5944 174.8461 69 I 4.4790 8.7926 127.5013 59.7155 40.6771 174.0842 70 M 5.2160 8.6192 126.4534 53.5856 34.2042 175.8350 71 S 4.3290 8.7869 118.0663 58.8300 64.3856 173.9099 72 G 4.2731 7.4513 106.6835 44.2655 0.0000 172.3831 73 F 4.7500 8.8289 121.3571 56.7990 39.5922 177.1417 74 I 3.7614 8.7552 117.4947 63.9899 37.8530 177.3106 75 D 4.4878 8.3068 119.8259 56.2493 39.4660 177.4053 76 T 4.1421 7.8959 108.5200 60.7255 69.8324 174.0215 77 E 3.9260 8.2088 120.9407 58.0908 27.4485 173.9061 78 T 4.7847 7.5106 106.8459 59.3418 72.7869 173.8979 79 S 4.3388 8.6227 117.7605 59.1320 62.2413 174.6836 80 V 3.0539 8.4192 120.7566 62.4844 31.9514 176.4207 81 G 3.6213 6.7655 107.3137 45.7693 0.0000 172.9449 82 Y 3.8980 7.6500 117.9452 56.4362 36.3375 174.4998 83 Y 5.2494 7.7437 121.1910 55.9928 43.0715 173.5810 84 N 5.0355 9.0456 117.0845 51.5245 42.5360 173.9470 85 L 4.4397 7.8130 125.5932 53.2772 42.5257 174.1250 86 E 4.7444 8.5202 127.1175 54.5999 31.8224 174.9117 87 V 3.9981 8.6709 126.7493 62.8493 32.3355 176.2706 88 I 4.4004 8.3125 127.8955 62.4211 39.3439 176.6455 89 S 4.4351 8.0382 114.9441 57.5625 64.0727 173.7977 90 E 4.2395 8.9463 120.0704 59.4415 29.6392 177.2640 91 Q 4.9866 7.9907 114.7045 54.2577 33.1603 174.2918 92 A 4.9299 9.3601 122.4588 50.9357 23.2336 175.1552 93 T 5.2011 9.0281 117.7910 61.9905 71.5840 173.4557 94 A 4.9738 8.7901 125.4874 51.1976 23.5895 174.8738 95 Y 4.7183 9.1621 119.2148 56.6106 39.6321 175.2169 96 V 4.3977 8.5170 125.6086 61.8382 32.6000 175.0900 97 I 4.8088 8.4010 128.3679 59.3030 41.0437 175.5624 98 K 4.4578 8.7045 125.5998 55.8432 32.8319 178.1281 99 I 3.6483 8.2887 122.7011 64.5041 37.8830 177.9410 100 N 4.3540 8.0369 117.1973 56.2607 38.8029 176.7387 101 E 4.0049 8.1113 120.1103 59.0338 29.5461 178.5612 102 L 3.8946 7.9929 119.9580 58.3187 42.0114 178.7171 103 K 3.7518 7.6373 118.2782 59.8049 32.0060 178.7120 104 E 3.9307 7.6663 117.9661 59.1224 29.4028 178.5766 105 L 4.0402 8.2790 119.4908 58.1182 41.5398 179.6615 106 L 4.1902 7.8687 117.2977 57.4661 41.5091 179.4148 107 S 4.4232 7.8384 114.7375 61.7140 62.9065 176.5912 108 K 4.4336 8.1677 119.8598 57.8311 31.9986 176.5087 109 N 4.7502 7.8566 117.0560 50.7652 40.5478 174.5753 110 L 3.8710 8.3887 127.2261 57.7002 41.7606 179.3922 111 T 4.0193 7.8834 115.5305 67.1906 68.4272 176.0871 112 H 4.4755 7.9871 117.7825 58.3816 28.6126 177.5790 113 F 4.0553 7.8660 122.5271 61.5179 39.1625 177.1056 114 F 4.4466 8.1169 117.3899 60.7595 38.7811 177.0201 115 Y 4.1583 8.0658 118.8934 60.8926 38.5224 178.4669 116 V 2.9368 7.6739 119.0520 65.5291 31.6581 177.6264 117 F 4.0595 8.6112 120.7280 61.5801 39.2946 177.1495 118 Q 4.3087 8.5296 117.7055 59.2280 28.4115 178.8565 119 T 3.6266 7.4505 116.4255 66.5151 68.3054 176.4447 120 L 3.9039 7.3604 120.7642 57.9967 41.6487 179.5319 121 Q 4.0031 7.8461 117.5743 58.8666 28.5264 179.1540 122 K 4.2058 8.6308 119.7338 59.7734 32.2186 179.0357 123 Q 4.1671 8.6428 118.5561 59.2336 28.8277 179.4063 124 V 3.6269 8.1906 119.4647 66.2340 31.6108 178.2693 125 S 4.2748 8.3410 113.9540 61.3874 62.8365 175.6041 126 Y 2.8009 8.3597 123.4737 60.2551 38.3540 178.2997 127 S 3.9877 7.9896 115.8196 61.7955 63.0167 176.8964 128 L 4.1034 7.8533 120.6931 57.4542 41.2528 179.6260 129 A 3.9666 7.8802 120.8773 55.0424 18.3665 179.4290 130 K 3.6294 7.7399 117.3311 59.8418 32.0770 179.1697 131 F 4.3129 8.3389 120.5237 61.2268 39.3915 176.5365 132 N 4.0661 8.2805 116.5871 56.9401 38.8379 176.5865 133 D 4.3612 8.0539 120.1908 57.2753 40.8571 178.6720 134 F 4.3088 8.4272 121.3700 61.4152 39.1977 177.4622 135 S 3.7466 7.7832 114.0253 61.1067 62.5182 176.5163 136 I 3.8917 7.2549 121.4353 63.7476 37.0206 177.2701 137 N 4.7630 8.0218 114.7649 52.9347 39.4074 176.0581 138 G 3.4749 8.2647 110.0678 46.0987 0.0000 176.7314 139 K 4.1479 8.6021 120.0444 59.3098 32.1232 178.6103 140 L 4.0344 7.9594 120.5712 58.0189 42.0779 179.0458 141 G 3.6567 7.7017 104.9447 48.1400 0.0000 175.5110 142 S 4.1870 8.0803 115.2868 61.2295 62.4401 176.3887 143 I 3.7264 8.0634 122.4512 64.6761 36.9454 177.9331 144 C 4.1579 8.2916 117.6577 62.9876 28.0442 176.4958 145 G 3.7750 8.2622 107.1847 48.0287 0.0000 175.6411 146 Q 4.1010 8.1698 120.6366 58.9539 28.4914 178.6428 147 L 3.9937 8.5151 121.4047 57.2056 41.5350 179.2044 148 L 3.7767 8.6317 121.0248 57.9186 42.0691 179.0703 149 I 3.9034 8.0500 113.1252 64.1759 37.5777 178.0470 150 L 4.2247 7.9520 120.8317 57.9716 41.4430 179.5141 151 T 3.7588 8.0466 115.6671 66.8743 68.1679 176.2209 152 Y 4.1737 7.7103 117.9671 61.2737 37.9942 178.8558 153 V 3.8007 7.8825 117.8866 65.2540 31.8233 176.1299 154 Y 4.8280 8.0872 114.2686 57.4798 39.8212 175.3044 155 G 4.6418 8.1937 106.7142 44.7007 0.0000 174.1114 156 K 4.8383 8.2102 120.8491 54.4201 36.9941 175.1821 157 E 4.6801 8.8407 124.1380 56.3071 30.0672 176.2699 158 T 4.6462 8.9623 113.5264 59.7275 72.1940 173.1762 159 P 4.1992 0.0000 0.0000 66.1104 31.3129 177.0432 160 D 4.4103 7.3668 119.9878 53.0144 39.9295 178.5295 161 G 3.6589 7.7431 113.5581 46.1913 0.0000 169.9688 162 I 4.5337 8.0977 123.0802 59.5643 38.9754 175.2529 163 K 4.0490 8.7226 130.2319 55.8062 33.3683 175.9224 164 I 4.2530 7.9382 129.5536 60.4478 37.3465 176.3344 165 T 4.3991 8.3969 122.2086 61.6331 68.4594 175.4202 166 L 4.2279 7.5325 121.6488 53.7407 43.3028 176.6237 167 D 4.3143 8.6843 123.6968 54.8717 41.2549 177.4136 168 N 4.4833 9.0253 122.6141 56.1525 36.5975 176.9888 169 L 4.0353 7.8140 120.2097 58.0170 41.9091 178.8154 170 T 4.1271 8.4575 115.9796 66.3605 68.4356 176.6398 171 M 4.1941 7.8315 119.4465 57.4611 31.9448 178.2767 172 Q 4.1408 7.9507 117.8825 58.2526 28.9691 177.1895 173 E 4.4138 7.5693 117.5324 56.2645 31.0350 176.9976 174 L 4.5557 7.8386 120.1080 56.9506 42.9876 175.1026 175 G 3.8185 7.0974 106.8484 43.8866 0.0000 172.1123 176 Y 3.9482 7.9520 123.4471 60.2723 39.1217 176.3664 177 S 3.7005 7.3457 111.9843 57.1261 60.7570 167.5468 *183 S 4.2673 8.2799 116.1222 59.4015 63.3439 173.7921 184 S 4.5975 8.2793 116.0488 57.3370 66.6221 175.9636 185 A 4.0875 8.0703 123.1929 54.6830 17.9276 179.5824 186 V 3.5342 7.7142 116.8756 66.1905 31.4856 177.8821 187 S 4.0806 7.9362 112.4054 61.3980 62.2579 175.6017 188 R 3.9952 8.4209 121.6850 59.8534 29.5960 178.3592 189 I 3.7008 7.7784 119.1785 64.4401 37.2619 178.2336 190 I 3.7524 8.7461 121.6920 64.5855 36.9383 178.4006 191 S 4.0843 9.1259 114.7780 61.3557 62.1937 176.1095 192 K 3.8812 7.9719 122.1777 59.5990 31.8814 178.6563 193 L 3.8247 8.2539 119.5044 57.5707 41.4701 179.7077 194 K 4.3202 8.1388 119.7727 58.9693 31.8261 178.9421 195 Q 3.9608 7.9573 118.5294 59.4302 29.1046 178.0455 196 E 4.0399 8.1468 116.1230 55.9679 30.1045 176.2959 197 K 3.7561 7.6651 119.2161 57.5173 31.1750 175.9741 198 V 4.0746 7.8929 119.8091 64.1006 33.1556 175.7781 199 I 5.4413 7.3819 111.4786 58.1966 41.7036 174.6085 200 V 4.5904 8.4778 121.9590 62.0302 34.9735 172.9127 201 Y 4.5724 8.9640 129.7935 55.2294 38.6594 175.2318 202 K 4.7702 8.0448 129.6269 55.0097 33.9358 177.3296 203 N 4.6600 8.3133 112.1496 52.8500 40.3431 175.3233 204 S 3.4106 7.9968 108.7366 58.4613 61.8230 171.5935 205 C 4.2835 6.3260 115.8447 58.9992 32.6433 173.3852 206 F 5.0240 8.1857 125.3551 57.7740 40.9997 173.9234 207 Y 5.1128 8.9932 121.8009 56.1200 42.3141 174.6781 208 V 4.5437 8.4781 119.8542 61.7551 33.5444 175.5836 209 Q 4.3552 8.8758 126.7485 56.0350 30.3966 175.8629 210 N 4.7933 7.8523 116.9573 50.7665 39.6691 173.8346 211 L 3.8351 8.1912 126.1071 57.6164 42.4886 177.5774 212 D 4.3964 8.1717 118.4936 57.4477 40.6769 178.1513 213 Y 4.0267 7.9940 119.2599 60.7340 38.7829 177.9383 214 L 4.1332 7.6772 119.5423 57.9479 41.5415 179.6733 215 K 4.0300 7.9754 117.0520 59.4310 32.0539 178.9814 216 R 3.8639 7.7366 117.7996 59.3906 30.0381 177.3871 217 Y 4.3984 7.6184 113.8399 57.4835 39.0405 175.5034 218 A 5.0052 7.8402 123.0329 49.7293 19.4623 176.0476 219 P 4.3776 0.0000 0.0000 65.6408 31.9458 178.4512 220 K 4.0360 8.2296 119.1854 58.8809 32.1022 178.7247 221 L 4.1122 8.2379 120.6234 58.1875 42.2350 178.2390 222 D 4.8269 8.6520 118.3558 57.6227 41.0859 177.8413 223 E 3.9901 8.7241 119.9934 59.0317 29.4942 178.3699 224 W 4.2065 8.5931 128.6022 60.6623 30.7478 177.7093 225 F 3.6628 8.7457 117.4522 60.7180 38.2136 176.9303 226 Y 3.5802 7.3677 116.9590 60.5249 38.3914 177.9269 227 L 3.6077 7.6260 118.5723 57.0241 41.9495 178.8152 228 A 4.0633 7.9517 120.9473 53.3077 19.1596 177.6964 229 C 4.4760 7.2305 114.1833 54.9985 30.0504 172.5426 230 P 4.4439 0.0000 0.0000 65.3472 31.1390 178.2515 231 A 4.0057 7.8922 120.5192 55.3691 18.6049 179.1017 232 T 3.9975 7.8927 107.7975 64.8990 68.9158 176.0873 233 W 3.7063 7.9624 130.8503 59.8652 30.6699 178.1280 234 G 3.8431 8.4919 105.3975 47.5987 0.0000 175.8076 235 K 4.1191 7.8005 120.0087 58.3559 32.0215 177.7570 236 L 4.6280 7.1317 114.8782 54.2161 42.2645 176.1902 237 N 4.2342 7.4861 121.9906 53.3872 39.3894 174.1668 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 N 8.28 4.66 0.00 2.77 2.85 0.00 0.00 6.89 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 A 9.29 4.15 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Q 8.50 3.68 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.87 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 5 A 7.74 3.54 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 7.69 4.13 0.00 2.39 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 2.69 2.60 0.00 7 E 8.51 4.02 0.00 2.10 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 2.51 2.44 0.00 8 F 7.59 3.87 0.00 2.65 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 9 K 7.90 3.26 0.00 2.01 1.92 0.00 1.52 0.00 0.00 1.52 0.00 0.00 2.85 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.16 0.94 7.81 10 K 7.73 3.79 0.00 2.04 1.84 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.64 7.81 11 Y 7.85 4.05 0.00 2.89 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 12 L 7.68 3.54 0.00 1.26 1.33 -0.55 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.15 4.18 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.29 0.00 14 T 7.76 3.92 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 1.25 0.00 0.00 15 N 7.33 4.60 0.00 2.50 2.58 0.00 0.00 7.08 7.12 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 16 G 7.85 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 17 I 7.73 3.93 1.96 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.00 1.08 0.00 0.00 18 K 8.40 4.66 0.00 1.69 1.67 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.47 7.81 19 P 0.00 3.87 0.00 1.77 1.08 0.00 3.74 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.92 0.00 20 K 8.59 4.51 0.00 1.74 1.23 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.27 1.32 7.81 21 Q 8.21 4.81 0.00 1.74 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.77 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 22 F 9.34 4.93 0.00 2.89 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 23 H 8.80 5.39 0.00 3.03 3.25 0.00 5.86 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.30 4.02 0.00 1.92 1.72 0.00 1.87 0.00 0.00 1.89 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.45 7.81 25 K 8.41 4.25 0.00 2.00 1.95 0.00 1.73 0.00 0.00 1.49 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.33 7.81 26 E 7.78 4.33 0.00 2.21 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 2.47 2.39 0.00 27 L 8.24 4.88 0.00 1.55 1.66 0.93 0.78 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 28 I 8.44 3.54 1.44 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 -0.30 -0.21 0.57 0.00 0.00 29 F 7.41 5.24 0.00 3.12 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 30 N 8.79 5.55 0.00 3.04 2.98 0.00 0.00 5.92 7.07 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 31 Q 9.12 3.90 0.00 1.46 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.91 0.00 0.00 0.00 0.00 0.00 2.26 2.12 0.00 32 W 7.54 4.92 0.00 3.60 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 33 D 8.02 4.59 0.00 2.86 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.30 0.00 2.20 2.18 0.00 3.87 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 1.97 1.97 0.00 35 Q 8.44 3.91 0.00 1.81 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 1.94 1.16 0.00 36 E 8.12 4.20 0.00 1.76 1.62 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 2.30 2.11 0.00 37 Y 8.78 5.23 0.00 2.60 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 38 C 9.43 4.95 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 39 I 9.31 4.53 1.95 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.18 0.90 0.00 0.00 40 F 9.14 5.15 0.00 3.52 3.30 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 41 L 8.78 4.22 0.00 1.81 1.70 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 42 Y 8.65 3.82 0.00 3.14 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 43 D 8.58 4.52 0.00 2.56 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.49 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 45 I 8.39 5.24 1.93 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 1.47 0.77 1.07 0.00 0.00 46 T 9.18 5.20 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 1.16 0.00 0.00 47 K 8.96 4.48 0.00 0.86 1.14 0.00 1.17 0.00 0.00 1.41 0.00 0.00 2.75 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.15 1.12 7.81 48 L 8.86 4.89 0.00 1.76 1.43 0.43 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 49 T 8.68 5.09 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 50 S 8.85 4.92 0.00 4.04 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 51 I 8.22 4.71 1.78 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 1.28 0.93 0.92 0.00 0.00 52 S 8.69 4.39 0.00 4.05 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 E 8.59 4.05 0.00 2.10 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 2.28 2.31 0.00 54 N 8.01 4.51 0.00 2.86 2.98 0.00 0.00 6.31 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 55 G 8.13 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 56 T 8.11 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 1.26 0.00 0.00 57 I 8.35 4.55 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.71 0.89 0.00 0.00 58 M 8.96 4.63 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.52 0.00 59 N 8.83 4.78 0.00 2.71 2.66 0.00 0.00 7.06 7.85 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 60 L 8.52 4.49 0.00 1.47 1.62 1.01 0.99 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 61 Q 7.23 4.53 0.00 1.93 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.86 0.00 0.00 0.00 0.00 0.00 1.77 1.31 0.00 62 Y 8.33 4.82 0.00 2.65 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 8.73 4.58 0.00 2.89 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 64 K 8.40 4.81 0.00 1.76 1.66 0.00 1.55 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.55 7.81 65 G 8.76 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 A 7.53 4.78 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 F 8.34 4.60 0.00 3.27 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 68 V 7.57 5.03 1.72 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 0.81 0.00 0.00 0.90 0.00 0.00 69 I 8.79 4.48 1.84 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.03 0.85 0.00 0.00 70 M 8.62 5.22 0.00 1.92 1.87 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.46 0.00 71 S 8.79 4.33 0.00 3.45 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.45 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 73 F 8.83 4.75 0.00 3.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 8.76 3.76 1.91 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.47 0.87 0.00 0.00 75 D 8.31 4.49 0.00 2.83 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 76 T 7.90 4.14 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 77 E 8.21 3.93 0.00 2.15 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 2.35 2.24 0.00 78 T 7.51 4.78 4.34 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 1.31 0.00 0.00 79 S 8.62 4.34 0.00 3.72 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 80 V 8.42 3.05 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 -0.19 0.00 0.00 0.97 0.00 0.00 81 G 6.77 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 0.00 0.00 0.00 82 Y 7.65 3.90 0.00 2.61 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 83 Y 7.74 5.25 0.00 3.11 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 84 N 9.05 5.04 0.00 2.51 2.53 0.00 0.00 6.89 6.25 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 85 L 7.81 4.44 0.00 0.32 0.36 0.87 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 86 E 8.52 4.74 0.00 2.00 1.66 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 2.20 2.31 0.00 87 V 8.67 4.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.90 0.00 0.00 88 I 8.31 4.40 1.93 0.00 0.00 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 1.54 0.77 0.98 0.00 0.00 89 S 8.04 4.44 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 90 E 8.95 4.24 0.00 1.94 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 2.42 2.32 0.00 91 Q 7.99 4.99 0.00 1.91 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.70 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 92 A 9.36 4.93 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 93 T 9.03 5.20 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 94 A 8.79 4.97 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 95 Y 9.16 4.72 0.00 3.27 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 96 V 8.52 4.40 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 1.00 0.00 0.00 97 I 8.40 4.81 2.08 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.67 0.94 0.00 0.00 98 K 8.70 4.46 0.00 1.78 1.65 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.59 1.64 7.81 99 I 8.29 3.65 1.89 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 1.38 1.30 0.84 0.00 0.00 100 N 8.04 4.35 0.00 2.80 2.77 0.00 0.00 7.24 7.65 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 0.00 101 E 8.11 4.00 0.00 2.09 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 102 L 7.99 3.89 0.00 1.69 1.89 0.84 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 103 K 7.64 3.75 0.00 1.98 1.87 0.00 1.75 0.00 0.00 1.59 0.00 0.00 3.24 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.83 7.81 104 E 7.67 3.93 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 2.31 2.48 0.00 105 L 8.28 4.04 0.00 1.88 1.89 0.81 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 106 L 7.87 4.19 0.00 0.95 1.10 0.36 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.84 4.42 0.00 4.06 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 0.00 108 K 8.17 4.43 0.00 2.07 2.00 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.73 7.81 109 N 7.86 4.75 0.00 2.58 2.29 0.00 0.00 7.13 6.51 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 0.00 110 L 8.39 3.87 0.00 1.66 1.45 0.85 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 111 T 7.88 4.02 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 112 H 7.99 4.48 0.00 3.19 3.61 0.00 5.63 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 F 7.87 4.06 0.00 2.99 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 F 8.12 4.45 0.00 3.31 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 0.00 115 Y 8.07 4.16 0.00 3.06 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 0.00 116 V 7.67 2.94 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 0.78 0.00 0.00 0.54 0.00 0.00 117 F 8.61 4.06 0.00 3.51 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 Q 8.53 4.31 0.00 2.40 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.56 0.00 0.00 0.00 0.00 0.00 2.43 2.54 0.00 119 T 7.45 3.63 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 -0.10 0.00 0.00 120 L 7.36 3.90 0.00 1.63 1.53 0.78 0.82 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 0.00 121 Q 7.85 4.00 0.00 2.37 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 122 K 8.63 4.21 0.00 2.17 2.24 0.00 1.51 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.59 1.69 7.81 123 Q 8.64 4.17 0.00 2.42 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.79 0.00 0.00 0.00 0.00 0.00 2.61 2.91 0.00 124 V 8.19 3.63 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.00 0.00 0.00 125 S 8.34 4.27 0.00 4.37 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 0.00 126 Y 8.36 2.80 0.00 2.20 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 S 7.99 3.99 0.00 4.20 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 0.00 128 L 7.85 4.10 0.00 1.94 1.80 0.98 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.88 3.97 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 0.00 130 K 7.74 3.63 0.00 1.75 1.78 0.00 1.35 0.00 0.00 0.87 0.00 0.00 2.76 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.24 0.85 7.81 131 F 8.34 4.31 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 0.00 132 N 8.28 4.07 0.00 3.02 2.95 0.00 0.00 7.24 7.77 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 0.00 133 D 8.05 4.36 0.00 2.91 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 F 8.43 4.31 0.00 3.13 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 S 7.78 3.75 0.00 3.66 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 0.00 136 I 7.25 3.89 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.55 0.87 0.00 0.00 137 N 8.02 4.76 0.00 2.90 2.83 0.00 0.00 7.01 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.26 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 K 8.60 4.15 0.00 1.99 1.87 0.00 1.70 0.00 0.00 1.79 0.00 0.00 3.12 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.55 1.61 7.81 140 L 7.96 4.03 0.00 1.73 1.76 0.44 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 141 G 7.70 3.66 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 0.00 0.00 0.00 142 S 8.08 4.19 0.00 4.15 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 I 8.06 3.73 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.67 0.96 0.00 0.00 144 C 8.29 4.16 0.00 3.12 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 0.00 145 G 8.26 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 0.00 146 Q 8.17 4.10 0.00 2.30 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.76 0.00 0.00 0.00 0.00 0.00 2.62 2.42 0.00 147 L 8.52 3.99 0.00 1.82 1.66 0.86 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 148 L 8.63 3.78 0.00 1.85 1.94 0.55 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 149 I 8.05 3.90 2.43 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.86 1.44 0.00 0.00 150 L 7.95 4.22 0.00 2.10 1.81 1.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 151 T 8.05 3.76 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 152 Y 7.71 4.17 0.00 2.40 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 V 7.88 3.80 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 0.17 0.00 0.00 1.27 0.00 0.00 154 Y 8.09 4.83 0.00 3.08 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 0.00 155 G 8.19 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.21 4.84 0.00 1.65 1.65 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.42 7.81 157 E 8.84 4.68 0.00 1.85 1.88 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 2.29 2.28 0.00 158 T 8.96 4.65 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 159 P 0.00 4.20 0.00 2.13 2.21 0.00 3.49 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.14 0.00 160 D 7.37 4.41 0.00 2.30 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 0.00 161 G 7.74 3.66 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 0.00 0.00 0.00 162 I 8.10 4.53 1.83 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 0.99 0.89 0.00 0.00 163 K 8.72 4.05 0.00 1.97 1.66 0.00 1.48 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.24 0.83 7.81 164 I 7.94 4.25 1.94 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 1.25 0.54 0.90 0.00 0.00 165 T 8.40 4.40 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 166 L 7.53 4.23 0.00 1.44 1.43 0.53 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 167 D 8.68 4.31 0.00 2.74 2.61 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 0.00 168 N 9.03 4.48 0.00 2.98 3.10 0.00 0.00 6.25 6.67 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 0.00 169 L 7.81 4.04 0.00 1.61 1.78 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 170 T 8.46 4.13 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 171 M 7.83 4.19 0.00 2.11 2.22 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.58 0.00 172 Q 7.95 4.14 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.98 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 173 E 7.57 4.41 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.51 0.00 174 L 7.84 4.56 0.00 1.38 1.46 0.65 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 175 G 7.10 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 0.00 176 Y 7.95 3.95 0.00 2.51 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 S 7.35 3.70 0.00 3.67 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *183 S 8.28 4.27 0.00 3.85 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 S 8.28 4.60 0.00 3.92 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 0.00 185 A 8.07 4.09 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 V 7.71 3.53 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 1.04 0.00 0.00 0.95 0.00 0.00 187 S 7.94 4.08 0.00 3.89 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 R 8.42 4.00 0.00 1.91 2.16 0.00 3.19 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 189 I 7.78 3.70 2.01 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 1.51 0.67 0.93 0.00 0.00 190 I 8.75 3.75 1.92 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.17 1.09 0.00 0.00 191 S 9.13 4.08 0.00 3.76 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 K 7.97 3.88 0.00 2.01 1.95 0.00 1.64 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.48 7.81 193 L 8.25 3.82 0.00 1.87 1.62 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 194 K 8.14 4.32 0.00 2.08 1.92 0.00 1.78 0.00 0.00 1.80 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.67 1.62 7.81 195 Q 7.96 3.96 0.00 2.12 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 196 E 8.15 4.04 0.00 1.95 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 2.29 2.25 0.00 197 K 7.67 3.76 0.00 1.87 1.82 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.33 7.81 198 V 7.89 4.07 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.34 0.00 0.00 199 I 7.38 5.44 1.14 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 1.27 2.15 0.58 0.00 0.00 200 V 8.48 4.59 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 0.96 0.00 0.00 201 Y 8.96 4.57 0.00 2.77 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 K 8.04 4.77 0.00 1.65 1.69 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.38 7.81 203 N 8.31 4.66 0.00 2.72 2.75 0.00 0.00 7.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 S 8.00 3.41 0.00 4.01 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 0.00 205 C 6.33 4.28 0.00 2.52 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 0.00 206 F 8.19 5.02 0.00 3.02 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 0.00 207 Y 8.99 5.11 0.00 3.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 V 8.48 4.54 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 0.88 0.00 0.00 0.75 0.00 0.00 209 Q 8.88 4.36 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.77 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 210 N 7.85 4.79 0.00 2.61 2.58 0.00 0.00 6.87 6.66 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 0.00 211 L 8.19 3.84 0.00 1.69 1.56 0.58 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 212 D 8.17 4.40 0.00 2.96 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 0.00 213 Y 7.99 4.03 0.00 3.16 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 L 7.68 4.13 0.00 1.91 1.74 0.82 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 215 K 7.98 4.03 0.00 1.94 2.04 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.18 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.88 1.60 7.81 216 R 7.74 3.86 0.00 1.69 1.81 0.00 2.88 0.00 0.00 3.00 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.17 0.00 217 Y 7.62 4.40 0.00 2.91 2.87 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 0.00 218 A 7.84 5.01 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 0.00 219 P 0.00 4.38 0.00 2.29 2.30 0.00 3.86 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 220 K 8.23 4.04 0.00 1.99 2.07 0.00 1.57 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.56 7.81 221 L 8.24 4.11 0.00 2.13 1.99 1.45 0.69 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 0.00 222 D 8.65 4.83 0.00 3.23 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 0.00 223 E 8.72 3.99 0.00 2.32 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 224 W 8.59 4.21 0.00 3.56 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 F 8.75 3.66 0.00 3.48 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 0.00 226 Y 7.37 3.58 0.00 1.43 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 0.00 227 L 7.63 3.61 0.00 1.55 1.48 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 228 A 7.95 4.06 0.07 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 0.00 229 C 7.23 4.48 0.00 2.99 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 0.00 230 P 0.00 4.44 0.00 2.32 2.22 0.00 3.35 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.85 0.00 231 A 7.89 4.01 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 T 7.89 4.00 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 0.00 233 W 7.96 3.71 0.00 3.32 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 0.00 234 G 8.49 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 0.00 235 K 7.80 4.12 0.00 1.83 1.90 0.00 1.68 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.70 7.81 236 L 7.13 4.63 0.00 1.65 1.52 0.78 0.89 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 0.00 237 N 7.49 4.23 0.00 1.44 1.49 0.00 0.00 6.73 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.