NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.8562 8.3549 109.7497 44.8183 0.0000 174.2731 *2 P 3.8218 0.0000 0.0000 61.7100 32.2911 176.2836 3 T 4.0458 7.6206 111.1572 61.3656 69.3776 175.2059 4 E 4.2231 8.6683 122.2842 59.3831 29.3752 179.1127 5 T 3.8711 7.7835 115.1069 66.4570 68.6891 175.7929 6 F 4.2874 7.8390 122.6405 61.4311 39.1634 177.3310 7 F 4.2825 7.4959 116.0206 59.9732 38.7515 176.4913 8 N 4.7210 8.0964 114.0249 52.3947 38.9001 175.4212 9 L 4.1741 6.8219 121.5931 53.4622 42.5775 175.8586 10 P 4.3224 0.0000 0.0000 62.7374 32.9972 176.8170 11 E 3.8299 8.8975 121.3997 59.8381 29.2641 178.9846 12 E 3.9101 8.0934 118.3914 59.2737 29.8970 178.8570 13 K 3.9728 7.8892 118.0681 59.2989 32.1551 179.2393 14 R 3.6673 7.9770 119.0609 59.3882 29.9796 178.5225 15 S 4.0944 8.2177 113.0883 61.3664 62.2173 176.1302 16 R 3.9254 7.8450 121.4804 59.1233 29.7158 178.3603 17 L 3.9936 7.8619 119.8383 58.2417 42.1519 178.8862 18 I 3.8847 8.1118 120.0209 64.5348 37.1751 177.8139 19 D 4.3897 8.2195 118.8485 57.4043 41.0484 178.6236 20 V 3.6434 7.7039 118.6639 66.0177 31.5938 178.0316 21 L 4.2299 8.4314 119.1664 57.7411 41.4920 179.5307 22 L 4.0883 8.5281 119.3717 57.9145 41.5543 179.2223 23 D 4.3628 8.0234 118.4339 57.3955 40.3642 178.5085 24 E 3.8367 8.2700 119.6091 59.4705 29.4702 178.8339 25 F 4.2159 8.2925 115.7005 59.6591 39.0836 177.1156 26 A 4.4169 7.9085 119.7912 54.4845 18.9325 178.9596 27 Q 4.2223 8.2517 114.9804 56.6281 29.3102 175.8109 28 N 5.1066 7.0644 115.3654 51.0036 42.6569 174.0083 29 D 4.6466 8.3437 119.8695 54.0545 41.9828 176.7860 30 Y 4.0172 8.9693 122.9253 61.3254 38.3461 178.7721 31 D 4.3271 8.1554 117.3990 55.6651 39.7754 177.1436 32 S 4.4262 7.6536 112.4146 57.0963 62.8318 173.9048 33 V 3.4178 6.6814 121.7689 63.3520 31.6612 175.3599 34 S 4.5004 9.0103 122.1199 56.5712 63.9538 174.8254 35 I 3.2665 7.9570 130.5457 64.3760 36.9446 178.1200 36 N 4.4504 7.8908 118.2663 55.6193 38.3970 177.3110 37 R 3.9129 7.7723 120.1870 59.1043 30.0115 178.6848 38 I 3.7028 7.4641 119.9634 64.6634 36.9716 178.5346 39 T 3.9517 7.8724 110.5991 64.6739 67.9852 176.1622 40 E 3.9953 8.2903 122.1326 59.3262 29.5355 179.0868 41 R 4.0256 7.9893 116.5936 58.9003 30.2409 178.3462 42 A 4.2547 8.3920 119.4063 52.1598 18.8244 177.2132 43 G 3.7882 7.8292 104.3090 46.9240 0.0000 173.3302 44 I 4.5646 7.6757 111.0178 57.7311 40.7171 174.9395 45 A 4.1251 8.2954 123.0250 51.8833 18.7411 176.8941 46 K 4.1724 8.4455 122.5743 57.6465 32.6642 177.4977 47 G 4.1849 9.1677 114.8555 45.4591 0.0000 173.8217 48 S 4.3804 7.9694 113.8284 59.1783 63.9654 176.0630 49 F 4.2677 8.3422 124.1564 61.7501 39.1233 175.8670 50 Y 5.1722 7.7227 114.3923 58.9695 37.7969 176.1070 51 Q 4.1123 7.5283 118.4206 56.6879 29.5494 175.9818 52 Y 4.3118 7.3493 115.4169 58.1903 39.9893 175.8942 53 F 4.7708 7.0919 116.9650 55.0438 42.6333 175.2356 54 A 4.1128 8.9150 128.6569 55.2990 18.0005 176.8777 55 D 5.0949 7.7685 113.3874 51.5208 43.5149 175.8410 56 K 4.2642 8.9332 119.1626 59.4501 32.0116 178.2849 57 K 4.1518 8.4011 119.6182 59.8950 32.1723 178.1884 58 D 4.4589 8.7524 119.0908 57.6191 40.8822 178.4942 59 C 3.2595 7.8242 118.2261 62.2768 31.4959 174.9884 60 Y 3.5595 8.2962 123.6506 61.1255 38.3421 178.5964 61 L 3.9571 8.2423 123.4131 59.5429 40.9661 180.5154 62 Y 4.3198 7.9912 120.2026 60.6995 38.7943 178.2140 63 L 3.7360 7.6050 119.5310 57.4638 41.6330 179.5548 64 I 3.4887 7.3721 119.8637 64.4202 36.9635 178.5485 65 Q 3.9651 8.1108 119.0063 58.6511 28.4722 178.5459 66 L 3.9119 7.7171 121.7897 57.9067 42.0661 179.3194 67 G 3.6600 7.9499 105.6930 47.6856 0.0000 175.8416 68 I 3.6031 7.6573 122.2425 64.2403 37.1759 178.3789 69 E 3.9506 8.2548 119.4292 59.5725 29.2764 179.5619 70 Q 4.1044 8.1916 118.0925 58.7786 28.7980 178.7049 71 K 2.8268 7.7895 120.9643 59.1998 32.1921 179.0703 72 T 3.8258 7.8011 110.0058 64.7461 68.7129 176.5175 73 A 4.0461 8.1008 123.6903 54.6953 18.2164 179.4380 74 F 4.1035 8.4011 119.4934 61.2814 39.2726 177.2448 75 L 3.9525 7.9792 119.2163 58.1529 41.9626 178.7805 76 R 4.2208 7.8294 116.7559 58.5845 30.2511 178.2535 77 Q 4.1779 7.7043 115.9123 56.6646 29.2620 176.4038 78 T 4.0185 6.8957 117.6220 61.9991 69.1352 172.8396 79 P 4.3224 0.0000 0.0000 62.1937 31.7683 174.7185 80 P 4.0843 0.0000 0.0000 61.9817 32.0777 175.5880 81 A 3.9178 7.0022 124.8608 52.7028 19.1062 179.7511 82 S 4.5385 8.2515 122.0403 56.2622 60.9834 169.7978 83 T 4.7457 7.2558 118.1249 60.9793 70.6321 173.1869 84 T 4.4486 8.2726 112.6937 61.2731 70.5040 174.1873 85 D 4.6277 7.7254 123.3066 53.7249 43.4290 175.6914 *87 F 4.7712 8.5621 113.2579 57.8413 41.0220 177.1370 88 A 4.1790 8.4588 122.4745 55.1680 17.9729 179.1122 89 Y 4.1915 8.2544 118.3119 60.9222 38.8956 177.9909 90 L 4.1543 8.1030 119.4781 57.5813 41.7611 179.3589 91 R 3.9034 8.2411 119.0345 59.0529 29.9847 178.3428 92 W 4.0772 8.0116 128.2229 60.5136 30.8831 177.7176 93 L 3.7926 8.3951 120.6882 57.9756 41.4856 178.6967 94 L 3.5925 8.2070 120.5316 57.7901 41.8398 178.4515 95 D 4.1132 8.0315 118.2772 57.2836 41.2153 178.6410 96 V 3.6331 7.6035 120.0752 64.6778 31.1447 178.5839 97 G 3.5914 7.8972 106.1044 47.5307 0.0000 175.8895 98 I 3.3673 7.5317 122.2216 64.0340 37.2054 178.3802 99 Q 3.8760 8.0427 119.0932 58.9275 28.4707 178.9571 100 F 3.0035 7.9118 121.4201 60.9144 39.2533 176.9164 101 Q 3.7523 7.6883 118.8582 59.3168 28.8865 178.3842 102 F 4.4313 8.4031 118.7078 60.1919 38.6398 176.7205 103 H 4.6756 7.6708 113.7915 55.7271 30.7905 175.0527 104 N 4.8704 7.6437 117.8607 50.2443 38.8238 173.2176 105 P 4.3827 0.0000 0.0000 65.2725 31.9352 179.0830 106 R 3.9360 7.7952 117.2923 59.0162 30.2512 178.6265 107 L 3.9961 7.8667 118.0623 57.7500 41.5569 179.3256 108 A 4.1181 7.9361 120.6693 55.3354 18.4563 179.5240 109 Q 4.0334 8.3232 118.0868 59.2963 28.6388 178.5703 110 I 3.9010 8.0836 120.8830 64.3613 36.9523 178.2747 111 A 4.0641 8.0038 120.6236 55.1493 18.3384 178.7999 112 Y 4.3049 8.5731 118.6148 60.9129 38.9243 178.2395 113 K 4.1096 8.4059 119.0469 59.2691 31.9145 179.1223 114 A 4.3055 7.6767 119.8557 55.0269 18.2769 179.3512 115 L 3.8012 7.3652 116.9985 56.9113 41.5181 177.4212 116 Y 4.5802 7.3356 113.9451 59.2884 40.2037 176.1861 117 D 4.5638 8.3357 118.3476 53.9067 41.4333 176.7403 118 D 4.5324 8.4150 121.9736 53.8091 39.5420 175.1603 119 V 3.8120 7.6256 117.1829 58.1968 33.9386 175.0258 120 P 4.4483 0.0000 0.0000 61.2664 30.0332 174.6200 121 L 4.8356 7.6531 124.9344 52.4545 44.5892 175.0720 122 P 4.4195 0.0000 0.0000 62.1697 32.1431 177.2333 123 A 4.0075 8.7574 123.4191 55.6342 18.2060 179.0129 124 E 4.0931 8.2947 115.9245 59.8350 30.0560 179.0854 125 T 3.9867 7.5885 113.7469 64.1342 68.1756 176.1871 *127 Q 4.2938 8.2267 124.5375 56.2628 31.0557 177.3688 128 V 3.5975 7.5455 116.9254 66.0640 31.8809 178.0624 129 I 3.6680 7.8562 119.3474 64.4055 36.9144 177.5854 130 R 4.1714 7.7626 116.2056 57.4569 30.6847 176.6997 131 H 4.9585 8.4605 112.2853 54.3012 31.1143 175.5389 132 G 3.6318 8.2341 107.3575 47.9335 0.0000 176.0020 133 S 3.9447 8.0088 117.0919 60.7193 63.0954 175.9083 134 F 4.2907 8.4408 123.7143 61.1525 39.2924 176.7683 135 A 4.0922 8.3039 120.3119 55.2840 18.1302 179.0612 136 Y 4.0092 7.7938 118.0318 60.8811 38.8004 178.0657 137 F 4.1809 7.8438 118.7384 60.3442 38.8665 177.5363 138 K 3.7232 7.9266 119.3021 59.3860 31.9248 178.6272 139 Q 3.8484 7.7888 119.3569 59.1417 28.9822 178.2805 140 L 3.7768 7.5604 119.9976 57.6726 41.6151 179.7242 141 V 3.5272 7.9093 118.3950 66.0014 31.5110 177.9260 142 E 3.9600 8.3402 118.5364 59.4355 29.2240 179.4444 143 Q 4.0294 8.1231 118.3045 58.9308 28.7861 179.0296 144 G 3.5861 8.0678 106.7381 47.7179 0.0000 175.9272 145 I 3.7508 7.9679 121.9231 64.0935 36.9165 178.3007 146 A 4.0474 7.7431 120.8218 54.8203 18.2942 178.4346 147 D 4.6805 7.8847 114.7316 53.0499 39.8124 177.3874 148 G 3.9467 7.6514 107.3154 46.2682 0.0000 175.1341 149 S 4.2846 8.0643 116.6453 60.0478 63.5138 174.5692 150 L 4.8484 7.4973 119.6105 52.2761 43.4298 176.3158 151 V 3.6480 8.2759 119.7939 62.7744 31.7246 175.1799 152 P 4.2799 0.0000 0.0000 65.7418 31.2133 176.7436 153 D 4.6106 7.9588 115.2823 52.9547 39.8703 176.0429 154 L 3.9270 7.4844 122.8599 55.3698 42.6827 176.2444 155 D 4.5930 8.6794 124.9732 53.2765 42.0057 176.5558 156 A 3.9782 8.6298 129.7767 55.3457 18.4839 178.5033 157 D 4.3240 8.0901 115.9044 57.8547 41.4459 178.4889 158 T 4.0277 8.5738 116.1581 66.7352 68.5230 176.5896 159 A 4.0496 8.2486 122.4713 55.0940 18.2900 179.5691 160 A 3.7873 8.2307 119.5390 54.9380 18.3271 179.5893 161 F 4.4770 8.5787 119.2872 61.6336 39.5253 177.5294 162 V 3.2397 7.8070 117.6589 65.8459 31.2646 177.9647 163 L 3.7607 7.7089 118.6157 57.6277 41.3371 178.9926 164 N 4.4213 8.1453 117.2391 56.9680 38.8379 177.3760 165 V 3.6889 7.6455 113.7593 64.1446 31.5267 178.8731 166 V 3.5726 7.6017 117.6950 66.1718 31.2461 178.2254 167 F 4.1015 8.4636 116.3152 60.8424 38.7796 177.5717 168 T 4.2529 8.1780 114.8431 65.9334 68.7643 175.7961 169 E 4.5906 8.0868 118.6545 56.4734 30.4629 177.8833 170 L 4.0559 7.9583 121.5069 58.1151 42.2204 178.8869 171 G 3.9962 7.9872 106.3020 47.4847 0.0000 175.1162 172 N 4.3706 8.1044 118.6674 56.1639 38.4883 176.9016 173 H 4.2130 8.2507 119.3476 59.0900 29.8702 177.2937 174 L 4.1796 8.3532 121.1708 57.8839 41.3999 179.6370 175 I 3.6579 7.8075 119.4271 64.4134 36.8783 178.0060 176 E 3.8309 7.9102 118.7210 59.2124 29.4373 178.5861 177 R 3.7421 7.8110 117.7947 58.7937 30.2655 177.5520 178 F 4.8029 7.9939 115.1223 57.2082 40.1454 176.1508 179 A 4.2013 7.7968 122.4852 51.2637 18.7744 176.8804 180 V 3.6646 8.6764 123.9012 65.7432 31.6567 176.2957 181 N 4.8472 7.6569 122.0387 50.5064 38.9360 172.4405 182 P 4.2362 0.0000 0.0000 64.7001 31.6323 177.7769 183 A 3.9279 7.9099 119.3124 55.3025 18.3258 179.2093 184 E 3.8844 8.1044 117.9273 59.1913 29.7113 178.6365 185 L 3.9687 8.0614 123.0004 58.7498 42.2764 179.6517 186 L 4.1228 8.0856 124.7791 59.7660 40.6621 182.1718 187 R 4.2434 7.6217 116.9172 59.1857 29.4120 180.2334 188 E 4.1172 8.4617 115.2900 56.4524 29.8280 176.8450 189 G 3.8741 7.5969 106.7274 46.5060 0.0000 174.2855 190 G 3.7745 7.7416 106.1041 45.6102 0.0000 174.6059 191 I 4.1184 8.1725 123.8670 60.9423 37.9436 175.5382 192 V 3.8079 7.9189 127.5467 61.5003 32.2902 175.2392 193 L 4.2783 8.1689 128.3244 53.1002 42.1992 176.1199 194 L 4.1402 8.6536 126.4628 55.4336 42.1844 176.1091 195 Q 4.6018 8.2136 124.8875 53.4116 31.2241 173.9347 196 P 4.2672 0.0000 0.0000 65.9742 31.1772 179.8082 197 A 3.9262 7.6723 118.9947 52.4550 17.9300 179.2149 *199 R 4.2376 8.0871 120.5924 57.8233 32.3338 178.2643 200 R 3.9461 7.9756 117.5305 59.1232 29.8497 178.8048 201 V 3.6826 7.5962 117.8875 65.8377 31.5558 177.9933 202 I 3.7109 7.8723 121.6154 65.0797 36.8943 178.7408 203 E 4.0099 8.2591 119.0240 61.1469 29.5569 180.8961 204 Q 4.1754 8.1092 119.3125 58.7928 28.8531 179.2301 205 V 3.5546 8.1177 119.4583 66.1990 31.6132 178.1723 206 I 3.8161 7.7372 119.4724 64.4438 36.8928 178.1079 207 D 4.3247 8.3500 119.9511 57.3758 40.6246 179.0006 208 I 3.6693 7.7088 120.1631 64.4784 36.9341 178.5855 209 L 4.0423 7.5999 118.3190 57.5013 41.4703 179.0045 210 E 2.5400 8.1190 118.8443 58.9039 29.6265 178.8419 211 R 4.0928 7.7199 116.7869 58.9366 30.1543 178.5878 212 G 3.6724 7.5824 102.1920 45.0869 0.0000 173.1211 *214 R 4.4267 7.1947 120.1517 55.6390 31.1676 175.0730 215 R 4.1099 8.9338 128.1481 56.9756 30.9612 177.2430 216 R 4.2547 8.4739 124.4293 57.1776 29.1986 175.1416 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 0 G 8.35 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 *2 P 0.00 3.82 0.00 0.95 0.67 0.00 3.97 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.90 0.00 3 T 7.62 4.05 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 1.06 0.00 0.00 4 E 8.67 4.22 0.00 2.16 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 2.43 2.56 0.00 5 T 7.78 3.87 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 1.15 0.00 0.00 6 F 7.84 4.29 0.00 2.64 2.57 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 7 F 7.50 4.28 0.00 3.05 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 8 N 8.10 4.72 0.00 2.81 2.86 0.00 0.00 7.04 8.34 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 9 L 6.82 4.17 0.00 1.45 1.45 0.45 1.04 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 10 P 0.00 4.32 0.00 2.24 2.16 0.00 3.70 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.01 0.00 11 E 8.90 3.83 0.00 2.00 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 2.37 2.34 0.00 12 E 8.09 3.91 0.00 2.06 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 2.37 2.40 0.00 13 K 7.89 3.97 0.00 2.03 1.78 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.53 1.06 7.81 14 R 7.98 3.67 0.00 1.59 1.76 0.00 2.45 0.00 0.00 2.55 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.91 0.00 15 S 8.22 4.09 0.00 3.99 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 R 7.85 3.93 0.00 2.02 2.05 0.00 3.16 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 17 L 7.86 3.99 0.00 1.79 1.84 1.02 0.58 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 18 I 8.11 3.88 2.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.85 1.06 0.00 0.00 19 D 8.22 4.39 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 20 V 7.70 3.64 2.28 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 1.05 0.00 0.00 0.99 0.00 0.00 21 L 8.43 4.23 0.00 2.02 1.88 1.02 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.53 4.09 0.00 1.87 1.76 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.02 4.36 0.00 2.91 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 24 E 8.27 3.84 0.00 2.11 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.97 0.00 25 F 8.29 4.22 0.00 3.28 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 26 A 7.91 4.42 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 27 Q 8.25 4.22 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.63 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 28 N 7.06 5.11 0.00 2.67 2.57 0.00 0.00 7.01 7.94 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 29 D 8.34 4.65 0.00 2.72 2.62 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 30 Y 8.97 4.02 0.00 2.90 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 31 D 8.16 4.33 0.00 2.85 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 32 S 7.65 4.43 0.00 3.84 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 33 V 6.68 3.42 1.59 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 -0.14 0.00 0.00 0.30 0.00 0.00 34 S 9.01 4.50 0.00 3.74 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 35 I 7.96 3.27 1.66 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.44 0.29 0.00 0.00 36 N 7.89 4.45 0.00 2.68 2.84 0.00 0.00 7.26 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 37 R 7.77 3.91 0.00 1.76 1.99 0.00 3.05 0.00 0.00 3.12 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 38 I 7.46 3.70 1.96 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 1.57 0.55 1.09 0.00 0.00 39 T 7.87 3.95 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 1.36 0.00 0.00 40 E 8.29 4.00 0.00 2.23 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 2.31 2.35 0.00 41 R 7.99 4.03 0.00 1.92 1.99 0.00 3.20 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 42 A 8.39 4.25 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 43 G 7.83 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 0.00 0.00 0.00 44 I 7.68 4.56 2.01 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.89 1.00 0.00 0.00 45 A 8.30 4.13 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 46 K 8.45 4.17 0.00 1.76 1.77 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.47 1.47 7.81 47 G 9.17 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 0.00 0.00 0.00 48 S 7.97 4.38 0.00 3.99 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 49 F 8.34 4.27 0.00 3.04 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Y 7.72 5.17 0.00 3.10 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 51 Q 7.53 4.11 0.00 1.60 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.76 0.00 0.00 0.00 0.00 0.00 2.23 2.21 0.00 52 Y 7.35 4.31 0.00 2.47 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 0.00 0.00 0.00 0.00 53 F 7.09 4.77 0.00 2.30 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 54 A 8.92 4.11 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 D 7.77 5.09 0.00 3.13 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 56 K 8.93 4.26 0.00 1.89 1.97 0.00 1.21 0.00 0.00 1.45 0.00 0.00 2.63 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.43 1.63 7.81 57 K 8.40 4.15 0.00 2.04 2.14 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.61 1.75 7.81 58 D 8.75 4.46 0.00 3.12 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 59 C 7.82 3.26 0.00 2.37 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 60 Y 8.30 3.56 0.00 3.26 3.21 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 61 L 8.24 3.96 0.00 1.69 1.66 0.92 0.64 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 62 Y 7.99 4.32 0.00 3.11 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.60 3.74 0.00 1.47 1.45 0.52 0.58 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 64 I 7.37 3.49 1.56 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.16 0.79 0.00 0.00 65 Q 8.11 3.97 0.00 2.31 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.24 0.00 66 L 7.72 3.91 0.00 1.49 1.59 0.81 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 67 G 7.95 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 68 I 7.66 3.60 1.93 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 0.58 0.85 0.00 0.00 69 E 8.25 3.95 0.00 2.05 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 2.31 2.45 0.00 70 Q 8.19 4.10 0.00 2.48 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.52 2.59 0.00 71 K 7.79 2.83 0.00 0.87 1.48 0.00 1.24 0.00 0.00 1.44 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.04 0.45 7.81 72 T 7.80 3.83 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 1.17 0.00 0.00 73 A 8.10 4.05 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 F 8.40 4.10 0.00 3.46 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 75 L 7.98 3.95 0.00 1.86 1.91 0.95 0.88 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 76 R 7.83 4.22 0.00 1.88 1.99 0.00 3.22 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.90 0.00 77 Q 7.70 4.18 0.00 2.24 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.26 0.00 78 T 6.90 4.02 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 1.09 0.00 0.00 79 P 0.00 4.32 0.00 2.15 2.07 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 80 P 0.00 4.08 0.00 1.96 1.92 0.00 3.78 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00 81 A 7.00 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 8.25 4.54 0.00 3.64 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 83 T 7.26 4.75 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 1.31 0.00 0.00 84 T 8.27 4.45 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 1.18 0.00 0.00 85 D 7.73 4.63 0.00 2.87 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *87 F 8.56 4.77 0.00 3.41 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 88 A 8.46 4.18 1.47 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 89 Y 8.25 4.19 0.00 3.09 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 90 L 8.10 4.15 0.00 2.07 2.04 0.85 1.01 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 91 R 8.24 3.90 0.00 2.09 2.21 0.00 3.29 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 92 W 8.01 4.08 0.00 3.42 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 L 8.40 3.79 0.00 1.65 1.83 1.06 0.69 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 94 L 8.21 3.59 0.00 1.30 1.56 -0.06 0.61 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 95 D 8.03 4.11 0.00 2.87 2.47 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 96 V 7.60 3.63 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 0.00 0.00 0.28 0.00 0.00 0.79 0.00 0.00 97 G 7.90 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 I 7.53 3.37 1.52 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.41 -0.13 0.00 0.00 99 Q 8.04 3.88 0.00 2.53 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 100 F 7.91 3.00 0.00 2.57 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 0.00 101 Q 7.69 3.75 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.44 2.40 0.00 102 F 8.40 4.43 0.00 3.03 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 0.00 103 H 7.67 4.68 0.00 2.89 3.26 0.00 5.79 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 N 7.64 4.87 0.00 1.64 2.29 0.00 0.00 6.58 8.88 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 0.00 105 P 0.00 4.38 0.00 2.21 2.24 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 106 R 7.80 3.94 0.00 1.88 2.04 0.00 3.20 0.00 0.00 3.42 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 107 L 7.87 4.00 0.00 1.63 1.79 0.94 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 0.00 108 A 7.94 4.12 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 0.00 109 Q 8.32 4.03 0.00 2.39 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.76 0.00 0.00 0.00 0.00 0.00 2.42 2.57 0.00 110 I 8.08 3.90 2.03 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 1.73 1.02 0.88 0.00 0.00 111 A 8.00 4.06 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 Y 8.57 4.30 0.00 3.17 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 0.00 113 K 8.41 4.11 0.00 2.07 2.13 0.00 2.04 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.67 1.89 7.81 114 A 7.68 4.31 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 0.00 115 L 7.37 3.80 0.00 0.60 0.76 0.77 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 116 Y 7.34 4.58 0.00 2.87 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 0.00 117 D 8.34 4.56 0.00 2.76 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 0.00 118 D 8.42 4.53 0.00 2.61 2.60 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 0.00 119 V 7.63 3.81 1.48 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 0.57 0.00 0.00 0.96 0.00 0.00 120 P 0.00 4.45 0.00 2.07 1.92 0.00 2.50 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.46 0.00 121 L 7.65 4.84 0.00 1.64 1.61 1.01 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 122 P 0.00 4.42 0.00 2.19 1.98 0.00 3.64 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 123 A 8.76 4.01 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 0.00 124 E 8.29 4.09 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 2.34 0.00 125 T 7.59 3.99 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 1.19 0.00 0.00 *127 Q 8.23 4.29 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.91 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 128 V 7.55 3.60 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 0.97 0.00 0.00 129 I 7.86 3.67 1.84 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 1.46 0.90 0.87 0.00 0.00 130 R 7.76 4.17 0.00 1.60 1.67 0.00 3.07 0.00 0.00 3.10 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.53 0.00 131 H 8.46 4.96 0.00 3.35 3.31 0.00 5.82 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 G 8.23 3.63 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 0.00 0.00 0.00 133 S 8.01 3.94 0.00 4.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 F 8.44 4.29 0.00 3.22 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 0.00 135 A 8.30 4.09 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 Y 7.79 4.01 0.00 2.81 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 0.00 137 F 7.84 4.18 0.00 3.04 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 0.00 138 K 7.93 3.72 0.00 1.50 1.79 0.00 1.67 0.00 0.00 1.60 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.32 7.81 139 Q 7.79 3.85 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 140 L 7.56 3.78 0.00 1.74 1.54 0.82 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 141 V 7.91 3.53 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 1.01 0.00 0.00 0.92 0.00 0.00 142 E 8.34 3.96 0.00 2.20 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 2.31 2.38 0.00 143 Q 8.12 4.03 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 144 G 8.07 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 I 7.97 3.75 1.86 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 1.46 1.15 0.91 0.00 0.00 146 A 7.74 4.05 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 0.00 147 D 7.88 4.68 0.00 2.82 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 7.65 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 0.00 0.00 0.00 149 S 8.06 4.28 0.00 4.04 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 0.00 150 L 7.50 4.85 0.00 1.70 1.69 0.95 1.13 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 0.00 151 V 8.28 3.65 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.99 0.00 0.00 152 P 0.00 4.28 0.00 2.22 2.18 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 153 D 7.96 4.61 0.00 2.80 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 L 7.48 3.93 0.00 1.71 1.70 0.96 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 155 D 8.68 4.59 0.00 2.85 2.57 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 0.00 156 A 8.63 3.98 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 D 8.09 4.32 0.00 2.84 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 0.00 158 T 8.57 4.03 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 1.31 0.00 0.00 159 A 8.25 4.05 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 0.00 160 A 8.23 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 F 8.58 4.48 0.00 3.46 3.46 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 0.00 162 V 7.81 3.24 2.21 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 0.96 0.00 0.00 1.14 0.00 0.00 163 L 7.71 3.76 0.00 1.09 0.18 0.73 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 164 N 8.15 4.42 0.00 3.24 3.12 0.00 0.00 7.28 7.42 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 0.00 165 V 7.65 3.69 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 0.68 0.00 0.00 0.55 0.00 0.00 166 V 7.60 3.57 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.94 0.00 0.00 167 F 8.46 4.10 0.00 3.12 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 0.00 168 T 8.18 4.25 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 1.48 0.00 0.00 169 E 8.09 4.59 0.00 2.04 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 0.00 2.52 2.54 0.00 170 L 7.96 4.06 0.00 1.88 1.57 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 171 G 7.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 N 8.10 4.37 0.00 2.84 2.82 0.00 0.00 6.72 8.16 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 0.00 173 H 8.25 4.21 0.00 3.29 3.49 0.00 5.79 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 0.00 174 L 8.35 4.18 0.00 2.19 2.03 0.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 175 I 7.81 3.66 2.00 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 1.16 0.81 0.84 0.00 0.00 176 E 7.91 3.83 0.00 2.06 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 2.25 2.28 0.00 177 R 7.81 3.74 0.00 1.42 1.21 0.00 2.97 0.00 0.00 2.42 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.19 0.00 178 F 7.99 4.80 0.00 3.12 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 A 7.80 4.20 1.20 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 0.00 0.00 180 V 8.68 3.66 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.93 0.00 0.00 181 N 7.66 4.85 0.00 2.69 2.62 0.00 0.00 7.10 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 0.00 182 P 0.00 4.24 0.00 2.16 2.04 0.00 3.63 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 2.07 2.26 0.00 183 A 7.91 3.93 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 E 8.10 3.88 0.00 2.08 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 2.30 2.18 0.00 185 L 8.06 3.97 0.00 1.92 1.72 0.84 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 186 L 8.09 4.12 0.00 1.72 1.65 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 187 R 7.62 4.24 0.00 1.83 1.87 0.00 3.23 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.44 0.00 188 E 8.46 4.12 0.00 2.03 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 2.59 2.31 0.00 189 G 7.60 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 G 7.74 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 0.00 191 I 8.17 4.12 1.83 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 1.23 0.42 0.96 0.00 0.00 192 V 7.92 3.81 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 0.00 0.00 -0.21 0.00 0.00 0.53 0.00 0.00 193 L 8.17 4.28 0.00 1.61 1.57 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 194 L 8.65 4.14 0.00 1.76 1.67 0.98 0.76 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 0.00 195 Q 8.21 4.60 0.00 1.87 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.76 0.00 0.00 0.00 0.00 0.00 2.41 2.22 0.00 196 P 0.00 4.27 0.00 2.11 2.08 0.00 3.53 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 197 A 7.67 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *199 R 8.09 4.24 0.00 1.96 2.01 0.00 3.11 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.82 0.00 200 R 7.98 3.95 0.00 2.02 1.93 0.00 3.10 0.00 0.00 3.10 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 201 V 7.60 3.68 2.21 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 1.15 0.00 0.00 1.23 0.00 0.00 202 I 7.87 3.71 1.99 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 1.39 0.41 0.83 0.00 0.00 203 E 8.26 4.01 0.00 1.99 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 0.00 204 Q 8.11 4.18 0.00 2.34 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 205 V 8.12 3.55 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.94 0.00 0.00 206 I 7.74 3.82 1.92 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.68 1.11 0.00 0.00 207 D 8.35 4.32 0.00 2.84 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 I 7.71 3.67 2.00 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 1.51 0.71 0.90 0.00 0.00 209 L 7.60 4.04 0.00 1.89 1.90 1.03 0.95 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 0.00 210 E 8.12 2.54 0.00 1.32 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 0.00 1.83 1.47 0.00 211 R 7.72 4.09 0.00 1.76 1.93 0.00 3.18 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 212 G 7.58 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 *214 R 7.19 4.43 0.00 1.85 1.86 0.00 3.23 0.00 0.00 3.19 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.86 0.00 215 R 8.93 4.11 0.00 2.02 1.84 0.00 3.57 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 216 R 8.47 4.25 0.00 1.64 1.68 0.00 3.35 0.00 0.00 3.26 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 * Residues marked with a * may have inaccurate shift predictions.