NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.6510 8.3301 115.5597 58.8056 65.0601 172.3110 3 A 4.6883 8.2683 118.5858 50.1472 23.0722 174.4931 4 F 5.3004 10.9936 127.2578 56.9031 41.6328 172.6761 5 I 5.2108 8.9207 128.1758 58.7334 39.5714 175.1751 6 T 4.8902 7.7669 116.5110 59.8191 72.1816 172.9121 7 F 5.0461 9.3309 121.9932 55.8954 41.7078 174.5839 8 E 5.1171 10.7800 122.5997 53.8223 33.6902 174.8192 9 G 4.0892 8.1404 111.7627 43.6669 0.0000 170.9130 10 P 4.9270 0.0000 0.0000 61.2645 32.6495 175.1912 11 E 3.9810 8.1354 119.7366 57.8021 29.8870 176.9484 12 G 3.9373 9.0121 112.6253 45.9782 0.0000 174.4349 13 S 4.4601 7.8060 112.5297 57.5708 63.5784 175.3055 14 G 3.8862 8.0203 109.7229 45.8673 0.0000 175.0242 15 K 3.7990 7.6344 121.0605 60.0464 32.0981 178.4683 16 T 3.7788 7.8312 114.8973 67.0342 68.4106 176.6138 17 T 3.8563 7.8056 117.0591 66.4735 68.4959 176.7787 18 V 3.5296 7.9874 120.3172 65.9898 31.6174 177.8735 19 I 2.9277 7.5772 118.3660 63.8303 37.7094 177.5170 20 N 4.3694 7.8197 116.6773 56.5354 38.4844 177.2928 21 E 3.9761 8.3177 120.0039 59.4701 29.5349 179.6938 22 V 3.7854 8.3756 118.7596 65.8944 31.6320 177.4070 23 Y 4.3254 8.5093 119.9198 61.1246 38.5011 177.2706 24 H 3.8014 8.0654 117.8454 59.4032 30.2920 176.7685 25 R 4.0519 7.9243 119.7106 59.5239 29.8664 178.5654 26 L 4.5049 8.4107 119.1389 57.6176 41.4189 179.5858 27 V 3.6850 7.7405 118.5164 64.7943 31.0659 178.2879 28 K 4.2213 7.5970 116.5730 58.4522 31.9181 177.2124 29 D 4.7239 8.3519 115.5373 53.7497 43.3766 174.4458 30 Y 4.8068 7.6626 115.4329 56.5081 42.1416 174.8840 31 D 4.9040 8.6260 122.6454 53.0000 40.3627 174.9003 32 V 5.2735 8.1313 121.7273 59.3414 34.8717 174.9769 33 I 5.2281 8.9486 114.5458 58.4014 41.5032 173.6592 34 M 4.9829 7.9791 119.2857 53.7544 33.8565 174.4245 35 T 4.6614 8.7769 115.0168 60.4211 72.0663 172.5231 36 R 4.6486 8.2596 125.4572 54.2389 32.7822 174.1814 37 E 3.7611 8.8552 125.4875 56.5284 30.1154 175.4104 38 P 4.4824 0.0000 0.0000 62.2504 31.5175 176.4380 39 G 3.7023 9.5316 105.5567 47.0239 0.0000 175.4819 40 G 3.9032 8.4150 106.4890 45.0901 0.0000 175.2304 41 V 3.6667 7.7779 120.9454 62.4117 32.4438 173.7092 42 P 4.1547 0.0000 0.0000 66.9475 30.8454 178.0072 43 T 3.9877 8.0916 109.5886 64.1249 68.4373 176.2190 44 G 3.6454 7.9664 107.6986 47.0743 0.0000 175.4121 45 E 4.0616 8.4260 121.3555 58.9286 29.2668 179.4092 46 E 3.9412 8.3381 118.6343 59.6067 29.4275 179.2107 47 I 3.6875 7.6619 118.4564 64.4513 37.3627 178.2962 48 R 4.0817 8.2076 119.2800 59.5069 30.0076 178.1949 49 K 3.7921 8.1140 119.3852 59.9714 31.7496 178.4369 50 I 3.6720 7.2775 119.1644 64.2904 37.2873 178.2427 51 V 3.6196 7.9296 119.3520 65.9451 31.1274 178.0762 52 L 4.0945 7.8228 117.0757 57.7090 41.5308 178.3163 53 E 4.4860 8.2877 116.2754 58.3832 29.8259 178.1099 54 G 4.0029 7.8003 108.3732 43.8996 0.0000 174.9524 *56 D 4.5309 8.2745 125.7206 53.9087 42.4672 175.1969 57 M 3.9850 8.0633 118.5390 55.5889 32.8113 176.0864 58 D 4.4115 8.6511 124.4421 54.5481 42.7700 177.5693 59 I 3.8003 8.4147 120.4071 63.9086 37.5423 178.7051 60 R 3.9349 8.3146 120.3589 59.3069 29.8858 178.7510 61 T 3.8063 8.0750 115.0546 66.7375 68.4051 176.1127 62 E 3.6343 8.1910 119.9948 59.3719 29.5697 179.3042 63 A 4.1154 8.2742 121.0270 55.5631 18.3379 179.6669 64 M 4.0384 8.3710 117.4688 58.3871 31.9359 179.0202 65 L 3.9295 7.9610 119.2040 57.9301 41.8257 179.6803 66 F 4.6185 8.3084 117.3990 60.1715 38.8479 177.6833 67 A 4.0690 8.0395 120.7089 54.8446 18.2093 179.4669 68 A 3.9817 8.2545 119.6109 55.4138 18.6219 179.7106 69 S 4.0875 8.4771 112.0375 61.6758 62.4815 176.3627 70 R 4.0877 8.1467 121.3737 59.4069 29.7600 178.5479 71 R 3.9466 8.0602 118.3418 59.2799 30.0468 178.1476 72 E 3.9483 8.1865 118.4962 59.8899 29.5407 178.8858 73 H 4.1692 8.2690 118.0764 59.0221 29.8271 177.0923 74 L 3.7725 7.9359 122.1137 58.2569 41.8262 179.2190 75 V 3.5750 8.1530 117.0556 65.7128 31.6275 177.3966 76 L 4.3045 8.1098 116.8703 55.5615 42.0455 176.8060 77 K 4.3122 7.5186 117.7553 57.3735 34.3715 178.0274 78 V 3.3630 7.6065 117.6524 65.9494 31.3141 177.8256 79 I 3.5227 7.8388 119.7577 64.0926 36.7988 176.5592 80 P 4.1858 0.0000 0.0000 65.6756 31.3826 178.2202 81 A 4.1240 7.8285 118.9957 55.0326 18.2594 179.7357 82 L 3.9562 8.0743 117.9271 57.8346 41.4852 179.7672 83 K 4.1602 8.2290 117.4972 58.5872 31.9512 178.1039 84 E 4.4589 7.5865 117.5155 55.8424 29.5159 177.2928 85 G 3.9489 7.8973 106.8353 45.5260 0.0000 174.4348 86 K 4.5379 7.5837 118.9577 56.0318 34.0098 175.8738 87 V 4.3094 8.6394 122.9238 61.9751 33.3133 174.8535 88 V 4.6915 9.2289 128.1628 61.2254 33.8581 174.0581 89 L 5.0206 8.8006 129.3496 53.9933 43.3560 175.4917 90 C 5.2574 9.4831 124.3572 57.5698 34.8350 172.2581 91 D 4.9603 8.6140 126.1572 54.5387 40.9064 175.1352 92 R 4.6383 10.2973 126.1548 57.0753 31.0723 176.1512 93 Y 4.7498 8.6393 121.5595 56.0289 41.9586 175.2345 94 I 3.5335 7.7925 109.3759 64.6351 37.3749 177.6045 95 D 4.5079 8.3451 119.9891 57.1466 40.5804 178.7001 96 S 4.6800 8.1916 114.7723 61.1803 62.4075 176.3410 97 S 4.1952 8.1272 117.3674 61.4968 62.5596 176.3001 98 L 3.9794 8.1917 122.7747 58.2507 41.8309 178.9996 99 A 3.7548 7.9277 120.6621 55.1731 18.0323 179.0390 100 Y 3.8514 8.4252 115.6391 61.0545 38.2050 178.2624 101 Q 4.2625 8.7219 118.8438 59.2912 29.0704 178.5702 102 G 3.5344 8.1845 108.3992 48.9432 0.0000 174.3586 103 Y 4.1277 7.9952 119.0458 58.1515 37.7285 177.5773 104 A 3.6291 8.3223 124.9601 55.8209 18.8734 179.8199 105 R 4.3395 8.8406 114.1284 56.3445 30.7358 176.7416 106 G 3.8543 8.0096 106.7832 46.7443 0.0000 174.9496 107 I 3.8292 7.6748 121.1804 61.5061 38.0660 176.3305 108 G 3.9364 8.1763 110.4215 44.8987 0.0000 174.5768 109 V 3.4181 8.4717 127.1809 64.8403 30.9218 178.1218 110 E 3.9219 7.9851 118.7107 58.8755 29.3950 179.0482 111 E 3.9260 8.0194 118.0266 59.5675 29.6854 179.5394 112 V 3.6492 8.0742 118.4456 65.6335 31.4200 178.1376 113 R 3.8745 8.2040 118.7123 59.4210 30.0174 178.2834 114 A 4.0277 8.1507 120.6441 54.9880 18.3132 179.3460 115 L 3.8750 8.0196 118.7369 58.6166 42.2668 179.1307 116 N 4.3930 8.2721 116.2863 56.2144 38.3046 177.3726 117 E 3.9822 8.5280 120.4424 59.1797 29.3092 179.0178 118 F 3.9926 8.1216 119.7331 61.2678 39.5361 176.7776 119 A 4.1906 8.0406 119.5872 54.6203 18.4762 178.8440 120 I 3.9675 8.4346 110.3089 60.1716 39.2230 174.8486 121 N 3.9810 9.1436 119.2520 54.5973 37.3109 174.4592 122 G 4.1709 8.0220 104.8094 45.6976 0.0000 173.0291 123 L 4.3706 7.6938 122.0719 54.3313 40.5044 175.2374 124 Y 4.7995 8.2215 121.1113 55.1742 39.9835 174.2226 125 P 4.2086 0.0000 0.0000 62.7313 32.0228 176.6004 126 D 4.5871 8.7571 121.7662 56.7716 41.6605 176.9602 127 L 4.4858 7.1819 118.8424 53.4243 45.9807 175.0712 128 T 4.5886 8.7217 121.9267 61.6375 72.1197 172.8506 129 I 4.4549 8.1733 128.0519 60.2711 38.8189 174.1083 130 Y 4.9671 8.7282 129.6049 56.0926 40.3624 174.8052 131 L 4.2671 8.0632 128.4886 53.5701 41.3319 175.4462 132 N 4.1193 8.6395 122.6124 53.0307 39.1946 173.4537 133 V 4.8055 7.8258 125.4100 59.3895 34.2734 175.9581 134 S 4.3591 9.5118 117.7791 57.7121 64.1078 175.1109 135 A 4.0402 8.5846 123.5024 55.4894 18.1196 180.1373 136 E 3.9519 8.0678 116.6616 59.5585 29.6826 179.5195 137 V 3.7387 7.8737 118.3560 65.6993 31.5803 178.3264 138 G 3.7832 8.5339 106.0378 47.8485 0.0000 175.3883 139 R 3.8649 8.0281 121.5073 59.3599 29.9954 178.3444 140 E 3.9588 8.0719 117.8072 59.4251 29.3584 179.6444 141 R 3.9357 8.1705 118.0366 59.2636 29.9458 178.8842 142 I 3.6831 7.5433 118.1146 64.6910 37.2475 178.1141 143 I 3.8363 7.7257 119.0418 64.3945 37.0580 178.2171 144 K 4.0987 8.6045 119.8362 58.5410 31.9235 176.9477 145 N 4.8345 7.8090 114.0132 53.0978 39.3772 174.2773 *151 R 4.1203 7.6969 116.3818 56.0942 31.2738 174.8679 152 L 4.6412 8.0654 120.2850 53.1045 43.8553 176.7113 153 D 4.5803 8.2422 120.0400 54.0662 43.2947 177.2613 154 Q 3.9782 8.4817 123.5039 59.1617 29.1167 177.9975 155 E 4.0052 8.2503 119.1455 59.5285 29.5601 178.8082 156 D 4.4582 8.1792 118.2668 57.6742 40.9577 178.7215 157 L 4.0779 7.9223 119.0851 58.1322 41.6366 179.9929 158 K 4.3099 8.3186 119.5254 58.6223 31.8622 179.3581 159 F 3.9833 8.6773 121.6865 61.2937 39.3613 176.4664 160 H 4.1918 8.9996 118.3098 59.5367 29.6105 176.7833 161 E 3.8664 8.2602 120.0237 59.5499 29.2585 179.5757 162 K 3.9060 7.9996 118.3330 59.2257 31.9730 179.4968 163 V 3.0384 7.4722 118.5778 65.9784 31.3623 178.1508 164 I 3.8342 7.5656 119.3807 64.5699 36.9445 178.3741 165 E 3.9652 8.4531 119.7907 59.0281 29.1692 179.7549 166 G 2.4617 7.8427 106.1616 47.5407 0.0000 175.4200 167 Y 3.8153 7.6427 119.5369 60.5038 37.5869 178.3638 168 Q 3.7268 7.7583 119.5797 59.3739 29.2003 178.1399 169 E 3.9467 7.3900 118.0520 58.9936 29.6711 178.4481 170 I 3.7360 7.0914 119.4084 62.5334 37.4828 176.3271 171 I 3.3457 6.5602 120.4234 59.7404 38.1694 176.0187 *177 R 4.2652 8.3447 119.9779 55.6517 31.7667 175.0221 178 F 4.8221 8.2743 118.7973 57.1819 40.3885 175.4399 179 K 4.5227 9.0301 121.6411 54.7326 35.3457 175.7395 180 S 5.0739 8.8232 120.2032 57.9742 63.8187 173.3852 181 V 4.3696 8.7119 124.7693 60.8291 35.1142 173.9397 182 N 4.8083 8.9249 125.8772 54.0282 38.7544 174.1545 183 A 4.4767 8.9777 126.8082 52.3889 18.5643 177.7459 184 D 4.4088 8.0879 116.6823 56.2258 41.2888 176.8730 185 Q 4.3023 7.2430 116.7743 54.4222 29.6886 173.9814 186 P 4.4285 0.0000 0.0000 62.3519 32.1582 177.6348 187 L 3.9094 8.7978 122.3414 58.2693 41.4914 179.3352 188 E 3.8901 8.3023 118.3253 59.8482 29.4276 178.7544 189 N 4.4326 8.3710 116.0720 56.0792 38.5777 177.7044 190 V 3.6271 7.6311 119.5119 65.7428 31.6681 178.1693 191 V 3.6146 8.0630 118.2712 65.8793 31.4255 177.3846 192 E 3.9667 7.9684 118.5650 59.5739 29.4638 178.3117 193 D 4.4110 8.1474 118.5787 57.9179 40.9970 179.1110 194 T 3.9018 8.0133 115.8877 66.8039 68.3858 176.0342 195 Y 4.0852 8.7467 121.5510 61.0077 38.9319 178.1257 196 Q 3.9408 8.9314 119.1959 59.1150 28.5971 179.0908 197 T 3.8558 8.2680 117.3762 66.5825 68.4054 176.8832 198 I 3.6489 7.7203 121.6136 64.3779 37.2913 178.2796 199 I 3.4725 7.5102 120.9323 64.2809 36.6782 178.0681 200 K 3.8310 7.6125 118.8524 59.8786 31.7883 177.7262 201 Y 4.0820 7.6977 119.6376 60.7245 38.5226 177.9472 202 L 4.0529 8.1584 118.4446 56.5084 41.7811 178.0880 203 E 4.5607 7.6092 116.0869 55.0676 30.1483 176.0105 204 K 4.1102 6.8874 120.9028 56.1725 33.3250 177.7422 *205 I 3.9715 8.0637 116.8584 60.3408 36.0903 175.8559 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 S 8.33 4.65 0.00 4.12 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 3 A 8.27 4.69 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 4 F 10.99 5.30 0.00 2.90 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 5 I 8.92 5.21 1.72 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 0.60 -0.01 0.43 0.00 0.00 6 T 7.77 4.89 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 7 F 9.33 5.05 0.00 2.91 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 8 E 10.78 5.12 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.64 0.00 9 G 8.14 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.93 0.00 2.39 2.41 0.00 3.64 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 11 E 8.14 3.98 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 2.37 2.33 0.00 12 G 9.01 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 13 S 7.81 4.46 0.00 3.93 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 14 G 8.02 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 7.63 3.80 0.00 1.96 1.86 0.00 1.84 0.00 0.00 1.75 0.00 0.00 3.16 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.56 7.81 16 T 7.83 3.78 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 17 T 7.81 3.86 4.33 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 1.21 0.00 0.00 18 V 7.99 3.53 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 1.05 0.00 0.00 0.94 0.00 0.00 19 I 7.58 2.93 1.00 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 1.06 -0.01 0.84 0.00 0.00 20 N 7.82 4.37 0.00 2.97 2.87 0.00 0.00 7.08 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.32 3.98 0.00 2.11 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 2.29 2.38 0.00 22 V 8.38 3.79 2.27 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 1.27 0.00 0.00 1.11 0.00 0.00 23 Y 8.51 4.33 0.00 3.00 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 24 H 8.07 3.80 0.00 3.12 3.27 0.00 5.83 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 R 7.92 4.05 0.00 2.04 2.09 0.00 2.84 0.00 0.00 2.57 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.45 0.00 26 L 8.41 4.50 0.00 2.07 1.88 1.05 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.74 3.69 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.85 0.00 0.00 28 K 7.60 4.22 0.00 1.95 1.93 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.44 1.73 7.81 29 D 8.35 4.72 0.00 2.51 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Y 7.66 4.81 0.00 2.92 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 31 D 8.63 4.90 0.00 2.86 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 32 V 8.13 5.27 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.19 0.00 0.00 33 I 8.95 5.23 1.90 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 0.94 1.08 0.99 0.00 0.00 34 M 7.98 4.98 0.00 0.51 1.38 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.65 0.00 35 T 8.78 4.66 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 36 R 8.26 4.65 0.00 1.83 1.70 0.00 3.23 0.00 0.00 3.30 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 37 E 8.86 3.76 0.00 1.91 1.84 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 2.24 2.37 0.00 38 P 0.00 4.48 0.00 2.24 2.28 0.00 3.83 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 2.18 1.98 0.00 39 G 9.53 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.94 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 58 D 8.65 4.41 0.00 2.81 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.41 3.80 1.92 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 1.65 1.05 0.95 0.00 0.00 60 R 8.31 3.93 0.00 2.12 1.99 0.00 3.12 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 61 T 8.07 3.81 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 62 E 8.19 3.63 0.00 2.14 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 2.08 2.23 0.00 63 A 8.27 4.12 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 M 8.37 4.04 0.00 2.02 2.20 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.53 0.00 65 L 7.96 3.93 0.00 1.49 1.52 0.78 0.88 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 66 F 8.31 4.62 0.00 3.18 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 67 A 8.04 4.07 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.25 3.98 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 8.48 4.09 0.00 4.11 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 70 R 8.15 4.09 0.00 1.98 2.18 0.00 2.98 0.00 0.00 2.60 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.90 0.00 71 R 8.06 3.95 0.00 2.08 2.05 0.00 3.26 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 72 E 8.19 3.95 0.00 2.24 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 2.52 2.50 0.00 73 H 8.27 4.17 0.00 3.23 3.59 0.00 5.59 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.94 3.77 0.00 2.12 1.83 0.87 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 75 V 8.15 3.57 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 0.87 0.00 0.00 0.94 0.00 0.00 76 L 8.11 4.30 0.00 1.74 1.69 0.97 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.52 4.31 0.00 1.68 1.75 0.00 1.75 0.00 0.00 1.77 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.36 7.81 78 V 7.61 3.36 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.69 0.00 0.00 79 I 7.84 3.52 1.85 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 1.39 0.52 0.85 0.00 0.00 80 P 0.00 4.19 0.00 1.98 2.09 0.00 3.64 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 81 A 7.83 4.12 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 82 L 8.07 3.96 0.00 1.77 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 D 8.61 4.96 0.00 2.66 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 92 R 10.30 4.64 0.00 2.07 2.09 0.00 3.14 0.00 0.00 3.13 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 93 Y 8.64 4.75 0.00 2.92 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 94 I 7.79 3.53 1.76 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 1.64 0.62 0.28 0.00 0.00 95 D 8.35 4.51 0.00 3.28 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 96 S 8.19 4.68 0.00 4.24 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 97 S 8.13 4.20 0.00 4.10 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 98 L 8.19 3.98 0.00 1.95 1.87 1.00 0.94 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 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1.97 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 1.25 0.74 0.90 0.00 0.00 108 G 8.18 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 0.00 109 V 8.47 3.42 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 0.44 0.00 0.00 0.92 0.00 0.00 110 E 7.99 3.92 0.00 1.96 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 2.35 2.32 0.00 111 E 8.02 3.93 0.00 2.13 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 2.38 2.33 0.00 112 V 8.07 3.65 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 1.03 0.00 0.00 0.96 0.00 0.00 113 R 8.20 3.87 0.00 2.07 2.13 0.00 3.21 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.74 0.00 114 A 8.15 4.03 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 8.02 3.88 0.00 1.78 1.90 0.89 0.49 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 0.00 116 N 8.27 4.39 0.00 2.88 2.72 0.00 0.00 7.11 6.97 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 0.00 117 E 8.53 3.98 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.70 0.00 118 F 8.12 3.99 0.00 3.14 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 0.00 119 A 8.04 4.19 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 0.00 120 I 8.43 3.97 1.99 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.56 0.65 0.00 0.00 121 N 9.14 3.98 0.00 2.60 2.74 0.00 0.00 7.22 8.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 G 8.02 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 0.00 0.00 0.00 0.00 123 L 7.69 4.37 0.00 1.64 1.78 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 124 Y 8.22 4.80 0.00 3.03 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 0.00 125 P 0.00 4.21 0.00 1.67 1.19 0.00 3.78 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.35 0.00 126 D 8.76 4.59 0.00 2.42 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 0.00 127 L 7.18 4.49 0.00 0.58 0.65 0.67 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 128 T 8.72 4.59 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 0.89 0.00 0.00 129 I 8.17 4.45 1.29 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.13 0.87 0.00 0.00 130 Y 8.73 4.97 0.00 3.27 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 0.00 131 L 8.06 4.27 0.00 1.32 1.45 0.93 0.91 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 0.00 132 N 8.64 4.12 0.00 2.81 2.79 0.00 0.00 6.61 7.31 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 0.00 133 V 7.83 4.81 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 0.80 0.00 0.00 1.02 0.00 0.00 134 S 9.51 4.36 0.00 4.09 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 0.00 135 A 8.58 4.04 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.07 3.95 0.00 2.08 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 2.41 2.43 0.00 137 V 7.87 3.74 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.99 0.00 0.00 138 G 8.53 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 0.00 139 R 8.03 3.86 0.00 2.05 2.19 0.00 3.12 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 140 E 8.07 3.96 0.00 2.22 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.51 0.00 141 R 8.17 3.94 0.00 2.01 1.98 0.00 3.26 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 1.65 1.79 0.00 142 I 7.54 3.68 2.04 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 1.52 0.64 0.91 0.00 0.00 143 I 7.73 3.84 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 1.41 0.70 0.91 0.00 0.00 144 K 8.60 4.10 0.00 1.79 1.98 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.49 7.81 145 N 7.81 4.83 0.00 2.70 2.76 0.00 0.00 6.99 7.88 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 *151 R 7.70 4.12 0.00 1.83 1.91 0.00 3.19 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 152 L 8.07 4.64 0.00 1.64 1.59 0.92 1.04 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 0.00 153 D 8.24 4.58 0.00 2.79 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 0.00 154 Q 8.48 3.98 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 155 E 8.25 4.01 0.00 2.31 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 2.37 2.38 0.00 156 D 8.18 4.46 0.00 2.89 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 L 7.92 4.08 0.00 1.92 1.78 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 158 K 8.32 4.31 0.00 2.01 1.89 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.50 7.81 159 F 8.68 3.98 0.00 3.18 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 H 9.00 4.19 0.00 3.39 3.61 0.00 5.85 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 0.00 161 E 8.26 3.87 0.00 2.25 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 2.33 2.67 0.00 162 K 8.00 3.91 0.00 1.49 1.63 0.00 1.53 0.00 0.00 1.49 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.65 7.81 163 V 7.47 3.04 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 0.62 0.00 0.00 0.26 0.00 0.00 164 I 7.57 3.83 1.93 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.45 0.93 0.00 0.00 165 E 8.45 3.97 0.00 2.03 1.89 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 2.26 2.45 0.00 166 G 7.84 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 Y 7.64 3.82 0.00 3.08 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 Q 7.76 3.73 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 7.01 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 169 E 7.39 3.95 0.00 1.82 1.64 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 2.36 2.32 0.00 170 I 7.09 3.74 1.74 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.49 0.90 0.00 0.00 171 I 6.56 3.35 1.41 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.03 -0.24 0.59 0.00 0.00 *177 R 8.34 4.27 0.00 1.67 2.13 0.00 2.77 0.00 0.00 3.32 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.14 0.00 178 F 8.27 4.82 0.00 2.90 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 0.00 179 K 9.03 4.52 0.00 1.55 1.67 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.78 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.46 7.81 180 S 8.82 5.07 0.00 4.04 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 V 8.71 4.37 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 0.88 0.00 0.00 0.93 0.00 0.00 182 N 8.92 4.81 0.00 2.89 2.72 0.00 0.00 7.11 8.15 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 0.00 183 A 8.98 4.48 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 0.00 184 D 8.09 4.41 0.00 2.77 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 0.00 185 Q 7.24 4.30 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.86 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 186 P 0.00 4.43 0.00 2.32 1.96 0.00 3.63 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 2.11 2.10 0.00 187 L 8.80 3.91 0.00 1.67 1.74 0.91 0.80 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 0.00 188 E 8.30 3.89 0.00 2.02 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 2.38 2.42 0.00 189 N 8.37 4.43 0.00 3.00 3.00 0.00 0.00 6.71 7.24 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 0.00 190 V 7.63 3.63 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.95 0.00 0.00 191 V 8.06 3.61 2.24 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 0.96 0.00 0.00 1.06 0.00 0.00 192 E 7.97 3.97 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 193 D 8.15 4.41 0.00 2.85 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 0.00 194 T 8.01 3.90 4.55 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 1.44 0.00 0.00 195 Y 8.75 4.09 0.00 3.04 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 0.00 196 Q 8.93 3.94 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.59 0.00 0.00 0.00 0.00 0.00 2.84 2.64 0.00 197 T 8.27 3.86 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 198 I 7.72 3.65 1.83 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 1.34 0.73 0.75 0.00 0.00 199 I 7.51 3.47 1.63 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.39 0.91 0.00 0.00 200 K 7.61 3.83 0.00 1.91 2.06 0.00 1.82 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.46 7.81 201 Y 7.70 4.08 0.00 3.03 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 0.00 202 L 8.16 4.05 0.00 1.56 1.74 0.03 1.22 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 0.00 203 E 7.61 4.56 0.00 1.96 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 2.51 2.52 0.00 204 K 6.89 4.11 0.00 1.57 1.64 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.61 7.81 *205 I 8.06 3.97 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 1.27 0.49 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.