NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 I 4.1666 8.0249 114.2716 60.9219 39.4993 176.3799 3 M 4.1322 7.9435 118.8227 54.9533 33.0540 175.0129 4 L 4.4723 8.4840 119.8714 53.6693 43.8731 176.8132 5 E 4.2340 9.1884 123.5171 56.0100 31.4863 178.0538 6 D 4.4257 8.5759 120.6746 57.6686 40.9453 178.7002 7 Y 4.2422 7.9847 117.8856 59.9504 38.0737 178.1969 8 Q 3.7112 6.9602 119.5458 58.4941 28.8722 178.3108 9 K 4.0154 7.8632 119.4786 59.6528 32.1859 179.1666 10 N 4.5460 8.3350 116.6539 56.2229 38.4742 177.1927 11 F 4.1852 8.3453 122.0120 61.4997 39.5125 177.2572 12 L 3.7833 7.9279 118.7757 57.3605 41.2019 179.3624 13 E 4.0011 7.9696 117.7847 59.4475 29.5419 179.2618 14 L 3.8557 7.8680 119.8033 57.1663 41.6732 179.2154 15 A 3.4911 8.1151 121.1105 55.2166 18.0699 179.8382 16 I 3.9456 7.6302 119.5187 63.9975 36.9446 178.5578 17 E 3.9629 8.1078 118.9111 59.1193 29.4320 178.3819 18 C 4.1866 7.8085 111.5843 58.1048 30.1946 174.3324 19 Q 3.7493 7.3409 119.1764 56.1742 26.5915 174.1656 20 A 3.9851 7.5331 122.1522 53.7692 19.5123 177.4109 21 L 5.0823 8.0321 118.4068 53.5101 44.1973 175.9009 22 R 4.7510 8.7576 125.1072 54.3281 33.8528 174.8004 23 F 5.4358 10.1076 119.3594 55.3855 42.4437 176.6615 24 G 3.7191 7.6091 107.7862 45.9315 0.0000 171.0396 25 S 4.9809 7.7224 118.3890 56.5722 64.0837 174.7724 26 F 4.8845 9.2661 125.8774 55.6254 42.9356 173.9767 27 K 5.1110 8.7201 122.5237 55.0144 33.3784 176.9313 28 L 4.3944 8.9479 126.0107 53.7470 42.6782 178.1285 29 K 3.9967 8.6632 118.9981 59.8377 31.9248 179.1710 30 S 4.1642 7.9498 112.0467 59.7376 63.0879 175.0291 31 G 4.0452 7.9268 108.7055 45.1033 0.0000 174.1174 32 R 3.9297 7.7014 120.6394 56.3889 30.5965 174.4657 33 E 4.9024 8.6342 125.6118 55.3165 30.8052 175.0106 34 S 4.5121 9.7456 122.7070 55.6830 65.7974 172.2225 35 P 5.3868 0.0000 0.0000 63.1947 32.2857 174.5224 36 Y 5.4366 7.4721 117.5274 56.4508 41.4200 173.6847 37 F 4.3171 8.8688 121.5305 56.1457 43.0379 173.0166 38 F 5.1080 7.3162 126.3105 56.3688 42.2905 173.3822 39 N 4.4349 8.5014 124.3677 51.6229 41.1496 174.6718 40 L 3.9148 8.4027 129.5225 57.4961 42.6454 178.9134 41 G 3.7715 7.9859 107.3705 48.5822 0.0000 174.3470 42 L 4.1319 7.4364 117.5922 56.1531 41.8194 178.2917 43 F 4.3561 8.1500 119.4112 56.4317 36.7154 174.6027 44 N 4.9463 8.2245 116.8193 51.9587 38.6692 175.5714 45 T 4.6815 7.5142 110.0711 59.8784 72.6085 175.2338 46 G 3.6721 8.4459 107.5760 47.8086 0.0000 175.7582 47 K 3.9630 7.9722 121.4776 59.3625 32.2907 178.8170 48 L 4.1848 7.8866 119.0218 57.8356 41.4483 179.5418 49 L 4.0828 8.5690 119.5042 57.5911 41.5230 179.2935 50 S 4.0985 8.3544 113.3595 61.7153 62.3569 176.1350 51 N 4.4089 8.2935 118.9851 56.1418 38.2784 177.0874 52 L 3.8580 8.4345 121.9322 58.2170 42.1484 178.9739 53 A 4.1058 8.3496 120.8339 55.4747 18.2277 179.8101 54 T 3.7913 8.0181 114.0815 66.5845 68.4476 176.8617 55 A 3.9825 8.1518 122.6972 55.3866 18.4941 179.2275 56 Y 3.9116 7.8822 115.0035 61.2053 37.9651 178.8596 57 A 3.9166 8.0315 121.6031 55.2131 18.4335 179.8217 58 I 3.4351 7.7384 118.2402 64.1450 36.9342 178.4473 59 A 3.7703 7.2173 121.3483 55.0977 17.9089 179.8309 60 I 3.7237 7.3462 117.3810 64.4491 37.6023 178.3875 61 I 3.9278 7.6573 120.6780 64.5720 36.7111 178.5893 62 Q 4.1287 8.0155 117.8913 58.4945 28.6074 178.3772 63 S 4.2383 7.7795 114.3042 59.1827 63.1788 174.8407 64 D 4.5257 7.9403 119.7016 54.3605 39.1980 173.6921 65 L 4.1135 7.7355 121.1117 55.2033 42.5436 176.1689 66 K 4.6291 8.5473 124.8894 54.6684 33.7049 175.5097 67 F 4.9491 8.0004 117.0755 56.2649 40.6622 173.0878 68 D 4.7964 9.7077 120.2629 54.4738 44.0776 176.6527 69 V 5.0784 7.8740 117.2987 61.0874 35.3981 173.8347 70 I 4.9324 8.8710 128.0290 59.5184 40.0068 173.7780 71 F 5.8435 9.2248 131.7874 55.3807 42.2996 173.7133 72 G 4.3662 7.8689 112.7126 43.2927 0.0000 170.9176 73 P 4.9926 0.0000 0.0000 61.6047 32.5603 176.1936 74 A 4.1454 8.7688 127.0384 52.7516 19.1723 176.6925 75 Y 4.4383 8.5139 118.5480 59.0244 40.3354 178.4989 76 K 4.0855 8.1716 118.9153 58.8973 32.4628 178.6081 77 G 3.5761 8.0859 106.8503 46.7337 0.0000 176.0313 78 I 3.4149 7.6235 121.3442 64.0771 37.0702 176.6278 79 P 4.1752 0.0000 0.0000 65.0786 31.2967 178.8757 80 L 3.7923 7.2551 116.5030 57.6772 41.5961 179.0590 81 A 3.9028 8.0438 120.6794 55.1713 18.3799 179.5831 82 A 3.0775 7.5136 119.0865 55.1271 18.5240 180.0507 83 I 3.6234 7.6733 111.5450 63.8983 37.5620 178.4873 84 V 3.5946 7.5409 119.7105 65.4931 31.2037 177.4876 85 C 4.0874 8.0014 118.6225 62.4117 31.4475 175.6059 86 V 3.5811 7.4826 119.2419 66.1242 31.1227 178.0714 87 K 3.9245 8.0379 117.9572 59.3284 31.8635 179.0386 88 L 3.6773 8.0348 119.0681 58.0351 41.4185 179.4903 89 A 4.2789 7.5375 118.9706 55.3932 18.2906 179.1291 90 E 4.1859 7.8282 115.9811 58.1426 29.7834 177.5531 91 I 4.4725 7.7467 108.7945 60.1064 38.8634 176.1576 92 G 3.4960 8.5828 109.8524 45.4956 0.0000 174.7560 93 G 3.9005 7.9921 108.1903 44.2915 0.0000 173.7733 94 S 4.1906 8.5910 111.5755 61.2353 62.9085 176.7220 95 K 3.8872 8.0478 119.2824 58.4712 31.9022 177.4751 96 F 4.6279 7.7809 114.9867 57.1688 39.2148 176.7255 97 Q 4.1538 7.8407 121.0532 58.6487 28.4955 177.2122 98 N 4.8970 7.8318 111.7550 52.8088 39.0304 174.4228 99 I 4.0031 7.6189 120.0913 61.6947 37.6925 176.0288 100 Q 4.7035 8.9438 126.3792 55.3302 30.6337 174.2400 101 Y 5.5480 8.4132 117.8488 55.8168 41.4757 174.1520 102 A 4.3227 8.6951 119.9217 52.4807 23.6163 175.4854 103 F 3.9454 7.2847 112.6399 55.9502 41.0844 172.1207 104 N 5.2950 8.4420 114.4001 51.3678 40.6449 173.7468 105 R 4.3340 8.4208 121.7150 55.5078 30.7867 178.0459 106 K 4.2777 8.1151 125.4957 55.4498 31.4593 176.1094 107 E 4.1785 7.9593 122.7684 57.0939 30.7539 177.0888 108 A 4.6818 8.2320 123.7547 51.7575 19.5070 177.3944 *115 G 4.0186 8.0501 108.2480 46.9385 0.0000 174.7428 116 I 4.0166 7.6765 120.9628 61.5753 38.5595 174.8882 117 I 4.5427 8.0534 125.3232 60.0431 38.6993 175.5876 118 V 3.6308 8.6242 127.6909 63.7955 32.0365 175.9401 119 G 3.7844 7.8249 116.1946 44.7697 0.0000 171.1856 120 S 4.3522 7.9071 116.0007 57.2164 63.7440 174.0178 121 A 3.9928 8.3385 124.9080 52.9760 18.4181 177.8997 122 L 4.2518 8.4087 121.6112 54.9251 42.4438 176.4426 123 E 4.1543 8.0379 120.3219 57.7550 29.6864 175.8193 124 N 4.2299 8.3485 121.4302 53.9426 37.3071 173.5984 125 K 4.6748 8.0098 118.9195 55.0123 34.2870 176.0086 126 R 4.6274 9.4809 124.9664 56.0270 31.4087 175.4084 127 I 4.9480 8.9172 125.8658 59.4062 39.9986 174.3294 128 L 4.8203 8.9031 129.6316 53.6073 43.7498 175.2098 129 I 4.6907 8.2755 127.5173 60.6353 38.8337 174.5977 130 I 4.8736 8.8742 126.8485 59.3389 41.0331 173.7195 131 D 4.8619 8.6997 127.5181 53.1288 45.3801 175.5578 132 D 4.5518 8.9272 119.0249 56.0074 40.3920 176.7947 133 V 4.6471 7.6532 109.4513 59.0688 35.7244 174.6207 134 M 4.6975 8.4894 119.3489 54.2579 32.8094 174.2420 135 T 4.4563 8.2379 113.6432 61.2720 71.3304 175.2310 *139 A 4.4631 8.0464 124.4230 52.3606 20.5273 178.7037 140 I 4.0055 7.7831 115.9505 64.6915 37.2490 178.3326 141 N 4.5553 8.2816 116.8899 56.1678 38.3496 176.8081 142 E 3.9768 8.4473 119.4806 59.6637 29.5186 179.1630 143 A 3.9097 7.6259 119.0712 55.2980 18.3699 179.6619 144 F 3.6975 7.9073 116.3189 60.4010 38.8920 177.3975 145 E 3.9403 8.6215 119.2449 59.4602 29.3540 178.7613 146 I 3.6400 7.8174 119.7350 64.6586 37.1443 178.5726 147 I 3.4813 7.6768 120.8093 64.2236 36.9834 178.7202 148 S 4.3054 8.3395 115.4156 61.2631 62.6943 176.2531 149 N 4.3335 8.1114 119.3643 56.0161 38.3832 176.3723 150 A 4.2411 7.4119 118.5635 51.7471 18.3654 177.6413 151 K 3.8428 7.7649 116.4497 57.3547 30.2358 175.3916 152 G 3.7804 8.1811 106.8906 45.8469 0.0000 174.1655 153 Q 4.4834 8.5190 126.1760 54.0317 29.9493 174.6653 154 V 3.9890 8.3110 127.1474 63.5258 31.7326 175.8273 155 V 4.3830 9.1326 120.5268 60.3438 32.9026 175.6315 156 G 4.1316 7.2329 109.4541 46.4381 0.0000 171.7307 157 S 5.2603 8.3026 113.8894 56.5110 66.6403 172.4902 158 I 5.2445 8.9209 125.5055 59.3024 41.5842 173.9762 159 I 5.5986 8.8247 120.9787 58.2098 41.1847 176.3461 160 A 3.4748 8.9259 123.2678 54.2459 19.1124 177.2245 161 L 4.7633 7.6017 116.5912 53.1308 44.6337 175.0065 162 D 4.6435 8.8210 127.5596 53.3316 41.3811 177.3518 163 R 4.0872 8.8475 126.0199 57.2978 30.7198 176.8541 164 Q 3.5716 8.3506 116.2570 56.8871 27.0346 172.6705 165 E 5.0807 7.9088 115.8254 54.4566 31.4420 176.4260 166 V 4.1569 8.1753 116.8752 61.4907 32.1912 177.0299 167 V 3.7159 8.1886 124.1505 64.9062 31.6711 176.1995 168 S 4.7702 7.7156 113.5307 56.3463 63.8985 173.2522 169 T 4.0078 8.6711 125.1787 67.0445 68.9156 175.1876 170 D 4.7017 7.6568 120.4949 52.5259 40.5719 178.1398 171 D 4.6793 7.1266 115.4086 53.5423 43.1909 175.6349 172 K 3.9082 8.1751 121.3854 58.8543 32.6970 177.9698 173 E 4.3791 8.0475 115.8129 56.0340 29.5934 175.8893 174 G 3.9381 7.7882 107.5891 45.9804 0.0000 173.4264 175 L 4.8425 8.2842 119.3971 53.7421 43.8979 177.3093 176 S 5.5153 9.2708 116.2584 57.3105 64.9465 175.0719 177 A 4.0139 8.8342 120.8416 55.7480 17.9744 179.7745 178 T 3.8945 7.9070 107.6870 65.1480 68.7823 176.4552 179 Q 4.0053 8.0449 120.3812 58.8010 28.7356 178.6040 180 T 3.8366 8.0195 116.8150 66.6719 68.5685 176.6758 181 V 3.6339 7.7935 119.8184 66.2634 31.5274 177.7985 182 S 4.8211 8.3964 114.5390 60.7357 61.8460 176.2283 183 K 3.9341 8.0193 121.4908 59.2313 32.0929 178.4764 184 K 3.8305 7.8457 118.6661 59.0404 32.2013 177.4857 185 Y 4.5214 7.7117 113.3149 56.5804 38.4181 175.9014 186 G 4.0058 7.8505 108.2318 46.3965 0.0000 173.5239 187 I 4.8873 7.4679 111.4864 57.6286 41.5474 172.6336 188 P 4.6106 0.0000 0.0000 62.9745 32.7659 175.3646 189 V 4.8152 8.2941 122.8525 61.1161 32.5340 174.9681 190 L 4.5481 9.1916 128.6766 54.7168 43.1006 176.1929 191 S 5.6298 8.0728 113.4615 57.5459 65.3395 174.2714 192 I 3.8205 8.2634 123.4235 64.2551 37.1077 176.4203 193 V 4.3946 7.6842 113.1744 59.7757 36.7820 174.4892 194 S 5.5985 8.4214 116.4183 55.1990 66.3891 175.1792 195 L 3.8618 8.4115 121.8344 58.4127 41.6035 178.5491 196 I 3.6988 7.8586 118.2016 64.2923 37.8269 177.6620 197 H 4.2481 7.9408 116.8437 58.5642 28.6182 177.6478 198 I 3.6988 7.7080 121.1859 64.6397 36.8149 178.0361 199 I 3.7251 7.5447 118.9733 65.0338 36.9393 178.3303 200 T 4.0353 7.9350 116.2560 66.8220 68.0821 176.2962 201 Y 4.0537 7.9703 120.3877 60.3476 39.1529 177.2390 202 L 4.2061 7.9510 118.3191 54.7079 41.7025 176.3177 203 E 4.0901 7.1866 121.2107 57.3542 29.7118 176.9792 204 G 3.9342 8.9456 114.4608 45.5829 0.0000 173.5766 205 R 4.2940 7.6733 117.5699 56.4105 31.4097 176.1530 206 I 4.5488 7.2535 115.8689 59.4725 40.7109 174.6667 207 T 4.3173 8.1503 118.2719 62.1907 69.7153 175.7315 208 A 4.5917 8.0960 126.1168 52.2638 15.1422 175.9141 209 E 4.7437 7.5023 118.0691 55.8487 35.7734 178.2603 210 E 4.2043 7.9903 119.0539 57.4589 29.9961 178.5489 211 K 3.8001 7.5467 119.8196 59.6688 32.0426 178.6261 212 S 4.1466 8.1183 113.6857 61.4210 62.8462 175.9640 213 K 3.9619 7.7108 122.9323 59.1111 31.8670 178.5026 214 I 3.9573 7.8714 119.6997 64.4859 37.0973 178.2881 215 E 4.0463 8.0760 119.6252 59.4100 29.3910 178.9010 216 Q 4.2781 8.5906 116.9688 57.5349 28.9179 177.2667 217 Y 4.4407 7.8095 121.3747 59.9474 39.0793 176.9236 218 L 4.0742 8.5285 121.7435 58.0122 41.9328 178.6624 219 Q 3.9064 7.9520 118.7400 59.5914 29.1573 178.0807 220 T 3.7185 7.2180 113.9987 66.0612 68.8106 174.8655 221 Y 4.5448 7.7899 116.0473 57.5319 39.8022 175.8687 222 G 4.2093 7.9400 107.5328 45.8385 0.0000 173.6759 223 A 4.6840 8.8892 125.5906 50.8716 19.7032 177.7292 224 S 4.4057 8.5457 114.5807 57.5596 64.5037 174.2228 225 A 4.1550 8.4024 122.4229 52.6594 18.1441 177.6185 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 I 8.02 4.17 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.12 0.91 0.00 0.00 3 M 7.94 4.13 0.00 2.12 2.16 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 2.53 2.63 0.00 4 L 8.48 4.47 0.00 1.64 1.60 1.07 1.01 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 5 E 9.19 4.23 0.00 1.53 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 2.30 2.64 0.00 6 D 8.58 4.43 0.00 2.75 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 7 Y 7.98 4.24 0.00 3.23 3.22 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 8 Q 6.96 3.71 0.00 1.93 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.94 0.00 0.00 0.00 0.00 0.00 2.03 1.16 0.00 9 K 7.86 4.02 0.00 2.05 2.02 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.68 1.67 7.81 10 N 8.34 4.55 0.00 2.98 2.95 0.00 0.00 6.70 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 11 F 8.35 4.19 0.00 3.21 3.23 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 12 L 7.93 3.78 0.00 1.50 0.66 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 13 E 7.97 4.00 0.00 2.34 2.38 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 2.53 2.38 0.00 14 L 7.87 3.86 0.00 1.94 1.72 1.05 0.77 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 15 A 8.12 3.49 1.13 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 16 I 7.63 3.95 2.04 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.29 1.06 0.00 0.00 17 E 8.11 3.96 0.00 2.07 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 2.33 2.46 0.00 18 C 7.81 4.19 0.00 2.82 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 19 Q 7.34 3.75 0.00 2.16 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.03 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 20 A 7.53 3.99 0.96 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 21 L 8.03 5.08 0.00 1.90 1.45 0.79 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 22 R 8.76 4.75 0.00 1.66 1.92 0.00 3.10 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 23 F 10.11 5.44 0.00 3.02 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 24 G 7.61 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 25 S 7.72 4.98 0.00 3.81 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 26 F 9.27 4.88 0.00 2.91 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 27 K 8.72 5.11 0.00 1.67 1.77 0.00 1.79 0.00 0.00 1.85 0.00 0.00 2.79 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.41 7.81 28 L 8.95 4.39 0.00 1.67 1.61 0.90 0.42 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 29 K 8.66 4.00 0.00 1.76 1.91 0.00 1.78 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.48 7.81 30 S 7.95 4.16 0.00 3.99 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 31 G 7.93 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 32 R 7.70 3.93 0.00 1.74 1.71 0.00 2.76 0.00 0.00 2.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.92 0.00 33 E 8.63 4.90 0.00 2.05 1.92 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 2.34 2.46 0.00 34 S 9.75 4.51 0.00 3.59 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 P 0.00 5.39 0.00 2.33 2.34 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.73 0.00 36 Y 7.47 5.44 0.00 2.88 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 37 F 8.87 4.32 0.00 1.51 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 F 7.32 5.11 0.00 3.03 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 39 N 8.50 4.43 0.00 2.71 2.50 0.00 0.00 6.46 6.61 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 40 L 8.40 3.91 0.00 1.82 1.69 1.03 1.17 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 41 G 7.99 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 42 L 7.44 4.13 0.00 1.42 1.70 0.89 1.11 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 43 F 8.15 4.36 0.00 3.18 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 8.22 4.95 0.00 2.76 3.08 0.00 0.00 6.22 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 45 T 7.51 4.68 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 1.19 0.00 0.00 46 G 8.45 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 0.00 0.00 0.00 47 K 7.97 3.96 0.00 1.85 1.83 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.55 7.81 48 L 7.89 4.18 0.00 1.85 1.92 0.83 0.37 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 49 L 8.57 4.08 0.00 1.68 1.74 0.95 0.87 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 50 S 8.35 4.10 0.00 4.02 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 51 N 8.29 4.41 0.00 2.96 2.98 0.00 0.00 6.74 6.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.43 3.86 0.00 1.58 1.85 0.58 1.05 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 53 A 8.35 4.11 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 54 T 8.02 3.79 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 1.21 0.00 0.00 55 A 8.15 3.98 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 7.88 3.91 0.00 3.15 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.03 3.92 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 58 I 7.74 3.44 1.08 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 1.27 0.55 0.25 0.00 0.00 59 A 7.22 3.77 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 60 I 7.35 3.72 1.96 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 1.43 0.66 1.05 0.00 0.00 61 I 7.66 3.93 1.71 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.57 0.90 0.00 0.00 62 Q 8.02 4.13 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 63 S 7.78 4.24 0.00 4.00 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 0.00 64 D 7.94 4.53 0.00 2.93 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 65 L 7.74 4.11 0.00 1.68 1.69 1.03 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 66 K 8.55 4.63 0.00 1.81 1.70 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.56 7.81 67 F 8.00 4.95 0.00 3.30 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 68 D 9.71 4.80 0.00 2.56 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 69 V 7.87 5.08 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 1.15 0.00 0.00 0.97 0.00 0.00 70 I 8.87 4.93 2.08 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 1.15 1.26 1.15 0.00 0.00 71 F 9.22 5.84 0.00 3.01 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 72 G 7.87 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 73 P 0.00 4.99 0.00 2.10 2.07 0.00 3.96 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.12 0.00 74 A 8.77 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 Y 8.51 4.44 0.00 3.02 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 76 K 8.17 4.09 0.00 1.82 1.89 0.00 1.70 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.59 1.43 7.81 77 G 8.09 3.58 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 0.00 0.00 0.00 78 I 7.62 3.41 1.64 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.19 -0.04 0.00 0.00 79 P 0.00 4.18 0.00 2.10 2.02 0.00 3.64 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 80 L 7.26 3.79 0.00 1.70 1.38 0.96 0.98 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 81 A 8.04 3.90 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 82 A 7.51 3.08 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.67 3.62 1.82 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 1.62 0.71 0.85 0.00 0.00 84 V 7.54 3.59 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 0.98 0.00 0.00 0.75 0.00 0.00 85 C 8.00 4.09 0.00 3.22 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 86 V 7.48 3.58 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 0.96 0.00 0.00 0.87 0.00 0.00 87 K 8.04 3.92 0.00 1.98 1.79 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.70 7.81 88 L 8.03 3.68 0.00 1.90 1.68 1.23 0.39 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 89 A 7.54 4.28 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 90 E 7.83 4.19 0.00 2.10 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 2.33 2.30 0.00 91 I 7.75 4.47 1.82 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 1.40 0.53 0.88 0.00 0.00 92 G 8.58 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 7.99 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 S 8.59 4.19 0.00 4.00 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 K 8.05 3.89 0.00 1.36 1.46 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.32 1.40 7.81 96 F 7.78 4.63 0.00 3.11 3.03 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 105 R 8.42 4.33 0.00 1.71 1.90 0.00 3.08 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 106 K 8.12 4.28 0.00 1.84 1.75 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.03 1.48 7.81 107 E 7.96 4.18 0.00 2.09 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 2.32 2.30 0.00 108 A 8.23 4.68 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 *115 G 8.05 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 I 7.68 4.02 1.81 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.89 0.84 0.00 0.00 117 I 8.05 4.54 1.80 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 1.33 0.53 0.88 0.00 0.00 118 V 8.62 3.63 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 0.75 0.00 0.00 0.24 0.00 0.00 119 G 7.82 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 S 7.91 4.35 0.00 3.93 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 0.00 121 A 8.34 3.99 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 0.00 122 L 8.41 4.25 0.00 1.81 1.65 0.81 0.91 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 0.00 123 E 8.04 4.15 0.00 1.90 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 2.28 2.33 0.00 124 N 8.35 4.23 0.00 2.89 2.88 0.00 0.00 7.02 7.32 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 0.00 125 K 8.01 4.67 0.00 1.79 1.72 0.00 1.66 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.55 1.54 7.81 126 R 9.48 4.63 0.00 1.88 1.94 0.00 3.11 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.63 0.00 127 I 8.92 4.95 1.76 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.52 0.79 0.00 0.00 128 L 8.90 4.82 0.00 1.09 1.01 0.71 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 129 I 8.28 4.69 1.73 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.27 0.89 0.00 0.00 130 I 8.87 4.87 1.67 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 1.08 0.83 0.00 0.00 131 D 8.70 4.86 0.00 2.76 2.49 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 0.00 132 D 8.93 4.55 0.00 2.88 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 0.00 133 V 7.65 4.65 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 0.87 0.00 0.00 0.99 0.00 0.00 134 M 8.49 4.70 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.55 0.00 135 T 8.24 4.46 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 1.24 0.00 0.00 *139 A 8.05 4.46 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 0.00 140 I 7.78 4.01 2.01 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 1.75 0.79 1.18 0.00 0.00 141 N 8.28 4.56 0.00 2.82 2.97 0.00 0.00 7.08 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 0.00 142 E 8.45 3.98 0.00 2.26 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 2.46 2.54 0.00 143 A 7.63 3.91 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 0.00 144 F 7.91 3.70 0.00 3.08 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 0.00 145 E 8.62 3.94 0.00 2.27 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 2.33 2.40 0.00 146 I 7.82 3.64 1.88 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.93 0.87 0.00 0.00 147 I 7.68 3.48 1.57 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 -0.07 0.72 0.00 0.00 148 S 8.34 4.31 0.00 4.05 4.20 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 0.00 149 N 8.11 4.33 0.00 2.90 2.90 0.00 0.00 7.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 A 7.41 4.24 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 0.00 151 K 7.76 3.84 0.00 2.02 1.91 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.35 7.81 152 G 8.18 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 8.52 4.48 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.92 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 154 V 8.31 3.99 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 0.47 0.00 0.00 0.39 0.00 0.00 155 V 9.13 4.38 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.11 0.00 0.00 156 G 7.23 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 0.00 157 S 8.30 5.26 0.00 3.89 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 I 8.92 5.24 1.86 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.87 0.00 0.00 159 I 8.82 5.60 2.09 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 1.24 1.86 0.97 0.00 0.00 160 A 8.93 3.47 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 0.00 161 L 7.60 4.76 0.00 0.76 0.90 0.67 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 162 D 8.82 4.64 0.00 2.74 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 0.00 163 R 8.85 4.09 0.00 1.92 2.30 0.00 3.43 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 164 Q 8.35 3.57 0.00 2.35 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.79 0.00 0.00 0.00 0.00 0.00 2.30 2.49 0.00 165 E 7.91 5.08 0.00 2.09 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 166 V 8.18 4.16 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 0.69 0.00 0.00 1.05 0.00 0.00 167 V 8.19 3.72 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 0.74 0.00 0.00 0.98 0.00 0.00 168 S 7.72 4.77 0.00 3.86 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 0.00 169 T 8.67 4.01 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 1.31 0.00 0.00 170 D 7.66 4.70 0.00 2.67 2.65 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 0.00 0.00 0.00 171 D 7.13 4.68 0.00 2.69 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 0.00 172 K 8.18 3.91 0.00 1.75 1.84 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.69 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.41 7.81 173 E 8.05 4.38 0.00 1.94 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 2.24 2.22 0.00 174 G 7.79 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 0.00 175 L 8.28 4.84 0.00 1.62 1.59 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 176 S 9.27 5.52 0.00 3.93 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 0.00 177 A 8.83 4.01 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 0.00 178 T 7.91 3.89 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 179 Q 8.04 4.01 0.00 2.24 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 180 T 8.02 3.84 4.47 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 1.20 0.00 0.00 181 V 7.79 3.63 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 1.19 0.00 0.00 1.10 0.00 0.00 182 S 8.40 4.82 0.00 4.00 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 0.00 183 K 8.02 3.93 0.00 1.91 1.91 0.00 1.83 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.42 7.81 184 K 7.85 3.83 0.00 1.66 1.27 0.00 1.52 0.00 0.00 0.71 0.00 0.00 2.63 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.63 1.11 7.81 185 Y 7.71 4.52 0.00 2.93 2.93 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 0.00 186 G 7.85 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 0.00 187 I 7.47 4.89 1.95 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.87 1.01 0.00 0.00 188 P 0.00 4.61 0.00 2.16 2.24 0.00 3.85 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 189 V 8.29 4.82 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.05 0.00 0.00 190 L 9.19 4.55 0.00 1.59 1.56 0.89 0.64 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 0.00 191 S 8.07 5.63 0.00 3.82 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 0.00 192 I 8.26 3.82 1.18 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 -0.10 0.17 0.00 0.00 193 V 7.68 4.39 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 0.57 0.00 0.00 0.92 0.00 0.00 194 S 8.42 5.60 0.00 3.87 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 0.00 195 L 8.41 3.86 0.00 1.77 1.88 0.65 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 196 I 7.86 3.70 1.84 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 1.45 1.16 0.74 0.00 0.00 197 H 7.94 4.25 0.00 3.47 3.30 0.00 5.88 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 I 7.71 3.70 1.93 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.11 1.01 0.00 0.00 199 I 7.54 3.73 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.62 0.92 0.00 0.00 200 T 7.94 4.04 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 201 Y 7.97 4.05 0.00 3.03 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 0.00 202 L 7.95 4.21 0.00 1.87 1.56 0.62 0.25 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 0.00 203 E 7.19 4.09 0.00 1.87 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 204 G 8.95 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 0.00 205 R 7.67 4.29 0.00 1.83 1.88 0.00 2.78 0.00 0.00 3.13 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.40 0.00 206 I 7.25 4.55 1.77 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.48 0.96 0.00 0.00 207 T 8.15 4.32 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 1.20 0.00 0.00 208 A 8.10 4.59 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 0.00 209 E 7.50 4.74 0.00 2.10 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 2.39 2.31 0.00 210 E 7.99 4.20 0.00 1.98 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 2.39 2.35 0.00 211 K 7.55 3.80 0.00 1.91 2.01 0.00 1.50 0.00 0.00 1.67 0.00 0.00 3.12 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.43 1.51 7.81 212 S 8.12 4.15 0.00 4.11 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 0.00 213 K 7.71 3.96 0.00 2.04 1.97 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.54 1.59 7.81 214 I 7.87 3.96 1.94 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 1.68 0.72 1.02 0.00 0.00 215 E 8.08 4.05 0.00 2.28 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 2.36 2.39 0.00 216 Q 8.59 4.28 0.00 2.32 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.74 0.00 0.00 0.00 0.00 0.00 2.41 2.60 0.00 217 Y 7.81 4.44 0.00 3.32 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 L 8.53 4.07 0.00 1.94 1.91 1.01 1.10 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 0.00 219 Q 7.95 3.91 0.00 2.29 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.72 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 220 T 7.22 3.72 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 0.23 0.00 0.00 221 Y 7.79 4.54 0.00 2.53 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 G 7.94 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 0.00 0.00 0.00 223 A 8.89 4.68 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 0.00 224 S 8.55 4.41 0.00 3.89 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 0.00 225 A 8.40 4.16 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.