NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 D 4.5863 8.3493 120.3197 53.6982 40.9295 174.2603 4 T 4.4342 7.8004 109.4390 58.7624 72.3467 173.6248 5 K 3.9652 9.2921 122.8199 59.9182 32.6429 179.7080 6 E 3.8281 8.1961 118.2394 59.4274 29.3220 179.2535 7 Q 3.9823 7.8308 118.2551 58.9163 28.7025 178.8833 8 R 3.8497 8.0346 119.2108 59.0442 30.0469 179.2277 9 I 2.8958 7.5621 119.6585 63.9141 37.0992 178.0848 10 L 3.7702 7.6607 121.1296 58.2061 41.8950 179.0129 11 R 3.9149 7.9860 118.6130 59.4651 29.9261 177.7325 12 Y 3.8254 7.8506 119.4681 60.6486 38.6993 178.3785 13 V 3.4422 7.7622 119.0632 66.0692 31.3771 178.0761 14 Q 3.0963 7.4428 116.6771 58.2696 28.5838 177.9075 15 Q 4.2668 7.6253 116.5543 56.5485 29.1900 176.1512 16 N 4.6289 7.4398 114.5744 53.1771 41.1551 174.7458 17 A 4.4309 8.1850 120.3614 50.9507 20.1124 176.1054 18 K 4.4283 8.7183 121.1564 54.1042 33.0505 174.4803 19 P 3.2164 0.0000 0.0000 63.8109 31.5572 176.6774 20 G 3.7217 8.7922 110.2912 45.7567 0.0000 173.9521 21 D 4.7116 7.5807 120.0377 51.1748 41.6594 174.0313 22 P 4.2438 0.0000 0.0000 65.4249 31.4611 177.8608 23 Q 3.9609 8.0929 117.9195 59.2703 29.0196 178.3801 24 S 4.2120 8.6802 115.5237 61.2291 63.0078 176.6028 25 V 3.6426 7.8249 121.7973 65.8394 31.2935 177.9028 26 L 4.0636 7.9652 118.6018 58.0980 41.4926 179.4948 27 E 4.0739 8.3746 118.1773 59.2201 29.3612 179.2799 28 A 4.2430 8.4736 121.1801 55.3442 18.4869 179.7713 29 I 3.7382 8.0004 118.2382 64.7897 37.2577 178.4637 30 D 4.4973 8.5280 119.7783 57.5838 40.5885 179.0804 31 T 3.8232 8.1746 116.2835 66.7407 68.5501 175.9214 32 Y 3.4044 7.7825 121.2692 60.9233 38.5242 178.1684 33 C 4.9019 7.6291 116.9643 62.0500 28.0594 175.7285 34 T 4.0218 7.2548 116.8560 65.4134 68.2839 176.0154 35 Q 4.4069 7.8462 117.5814 55.9275 30.0951 175.2648 36 K 4.1855 7.8911 116.3002 56.6245 34.8847 175.6620 37 E 4.6080 6.6988 115.6432 53.8665 33.3119 175.2756 38 W 4.2311 8.7982 133.0150 57.3541 31.5284 174.9059 39 A 4.4992 6.7929 126.0636 50.4934 21.7931 175.8882 40 M 4.0724 7.5488 116.2178 54.5203 31.3324 176.5938 41 N 4.7133 7.5516 115.7863 53.4014 39.8862 176.2640 42 V 3.5700 8.3972 120.7114 63.0288 31.7717 177.3550 43 G 3.4903 7.5339 105.3338 44.9749 0.0000 173.4257 44 D 4.4422 8.3434 116.4243 56.8791 40.6840 177.7481 45 A 4.0214 7.8914 120.8941 55.4217 18.5812 179.7287 46 K 3.8697 8.0947 116.1675 59.1491 32.1288 179.7755 47 G 3.6925 8.0174 106.3068 47.9689 0.0000 175.8137 48 Q 4.0063 8.3552 120.3289 58.6546 28.6547 178.9467 49 I 3.7231 7.2611 120.7846 64.3746 37.0431 178.2137 50 M 3.8888 7.9728 119.5323 58.4612 31.7541 178.2875 51 D 4.2999 8.2430 118.9206 57.5805 41.1579 179.0073 52 A 3.9543 7.7965 120.5045 55.1184 18.3418 179.9192 53 V 3.6163 7.7939 116.7948 66.0639 31.5504 178.3277 54 I 3.7485 8.0506 119.9381 64.5420 36.7510 178.5270 55 R 3.8559 7.8792 117.5926 59.1638 29.9408 178.4980 56 E 3.9003 7.7804 117.6182 59.5749 29.7777 178.1638 57 Y 4.1595 7.8428 114.6933 58.0174 39.4104 175.5270 58 S 3.7015 8.6813 114.0521 58.4842 61.1483 170.0504 59 P 4.5131 0.0000 0.0000 63.2229 32.5856 176.9516 60 S 4.5641 8.8559 115.2380 59.4383 65.2422 173.4246 61 L 5.1015 8.7323 121.8223 53.3132 44.8002 175.4424 62 V 4.9292 8.8192 126.8562 60.9103 34.6919 173.8213 63 L 5.0938 8.8646 129.2014 53.2018 44.7143 174.3275 64 E 5.0640 9.3917 127.4703 54.4032 32.7138 174.4418 65 L 4.3674 8.8849 127.3993 56.4127 43.5481 176.1938 66 G 3.7348 9.0081 113.6172 46.4613 0.0000 171.8792 67 A 4.4067 8.6048 128.9811 53.2131 21.2037 180.7189 68 Y 3.6890 9.0005 116.1370 59.2155 38.6281 170.1476 69 C 4.1342 9.0438 117.9374 59.2859 29.5971 174.7294 70 G 4.0617 8.3745 109.2205 45.7056 0.0000 174.8997 71 Y 3.9970 8.1796 121.0337 60.8131 38.7878 178.4374 72 S 4.0518 8.3561 114.2958 61.1280 63.1373 176.0446 73 A 3.9562 7.9337 124.2362 55.0118 18.2832 179.6135 74 V 3.4506 7.8535 116.8567 65.8224 31.3447 178.1782 75 R 3.6567 7.4941 117.6214 59.7159 30.2490 178.1992 76 M 4.0819 8.2720 118.4911 58.2874 32.0338 178.6277 77 A 4.0081 8.1892 121.3874 55.0158 18.2985 179.7683 78 R 3.9531 7.7842 113.4266 58.4920 29.5142 177.4590 79 L 4.4675 7.4154 117.3105 54.3930 42.4980 176.7286 80 L 4.1623 7.4796 119.8612 54.2238 42.3920 176.8863 81 Q 4.1890 8.3768 123.0770 54.8278 29.8740 173.5173 82 P 4.4418 0.0000 0.0000 64.4110 31.7065 177.0777 83 G 3.9272 8.9656 110.6938 45.0447 0.0000 173.4820 84 A 4.5100 7.5775 120.8610 51.8720 19.4319 177.1925 85 R 4.8523 9.2781 118.1870 54.2207 34.6628 174.3787 86 L 5.0587 8.7849 123.9470 53.3135 45.1818 174.8396 87 L 5.0667 8.8991 126.6871 53.1851 44.4081 175.3610 88 T 4.9936 8.6323 117.9297 60.5248 70.7024 172.1369 89 M 4.9593 8.8495 128.5017 53.9086 34.5836 174.8918 90 E 4.7591 8.9323 124.2959 54.9503 32.4459 175.8405 91 M 4.0741 8.8086 125.1352 57.3930 32.2292 176.3818 92 N 4.4375 8.7774 119.4882 51.9496 39.6504 173.4613 93 P 4.2574 0.0000 0.0000 66.1569 31.1757 178.1100 94 D 4.3479 8.2812 118.6031 57.5023 40.6450 178.3276 95 Y 4.3705 7.9710 116.5966 60.9973 37.9765 178.0070 96 A 4.0137 8.3539 121.6576 54.9776 18.4095 179.6160 97 A 3.9540 7.9954 119.1375 55.3484 18.4514 179.9353 98 I 3.6217 7.6170 117.9634 64.8159 37.0868 178.7383 99 T 4.0921 8.1385 118.2099 66.0627 68.2468 176.3743 100 Q 3.9525 8.1223 121.3323 59.4147 29.0839 178.4147 101 Q 4.0165 8.0858 119.0695 59.0484 28.6957 178.4503 102 M 4.0346 8.4024 119.7006 58.6751 32.2598 178.3281 103 L 4.0257 8.2595 119.4450 57.7411 41.7767 179.2111 104 N 4.3109 8.3599 116.4992 56.4283 38.5536 177.2111 105 F 4.0066 8.4724 121.7842 61.1761 38.9679 176.6625 106 A 4.3591 8.3743 119.6250 52.5127 17.9966 178.2569 107 G 3.6176 7.8601 105.0563 46.7696 0.0000 174.2259 108 L 4.6848 7.9624 117.1713 53.9430 42.1611 178.7025 109 Q 4.0927 7.9991 119.6866 59.1110 28.5966 178.4185 110 D 4.3637 8.0113 117.6174 56.6168 41.3436 177.3852 111 K 4.1862 7.9980 117.7548 57.3814 32.6520 176.3357 112 V 4.9589 7.0620 118.1878 61.2347 33.8554 175.1723 113 T 4.6296 8.6789 123.2608 61.8332 71.5937 172.9057 114 I 4.6202 8.4598 127.6399 60.3092 38.7036 175.1662 115 L 4.4711 9.0120 127.9526 53.0930 43.3953 175.3967 116 N 5.0867 9.0646 124.4257 53.6320 39.3221 174.4995 117 G 4.1453 7.5295 113.1558 45.9076 0.0000 170.4884 118 A 4.4314 7.8024 122.9452 51.1089 19.6990 178.4009 119 S 4.1081 8.9392 118.4167 61.9506 62.5008 177.2151 120 Q 4.0568 8.0693 119.3382 58.7361 28.2765 177.5692 121 D 4.5687 7.8524 119.1474 56.1976 41.5460 178.0027 122 L 4.2833 7.9148 119.3834 57.1412 41.7594 178.9953 123 I 3.6708 8.1029 120.3448 64.0931 36.8938 176.3774 124 P 4.4647 0.0000 0.0000 64.2295 31.5374 177.3455 125 Q 4.5576 8.0501 116.3103 55.4518 29.4167 177.1712 126 L 4.1559 7.7311 121.6571 57.9229 41.4859 179.4948 127 K 4.6276 7.9638 117.0472 59.0475 32.2643 179.1464 128 K 3.9267 7.9469 118.3688 59.4318 32.3760 178.0816 129 K 3.9685 8.0433 117.3531 58.2836 32.2117 177.6792 130 Y 4.4518 7.7310 114.1951 56.5924 39.0468 175.3723 131 D 4.3149 8.0849 117.6221 55.4165 39.4974 172.9411 132 V 4.3686 7.6071 119.1710 61.1553 33.8413 174.1828 133 D 4.6256 8.2697 127.0792 55.1595 42.2031 175.6348 134 T 4.8479 7.2281 109.2280 59.7765 72.2810 173.1337 135 L 4.5600 8.5346 123.2087 53.9762 43.2752 176.8673 136 D 4.6557 8.7295 122.4593 57.0143 42.2211 176.2299 137 M 5.2934 7.7382 116.0087 54.0771 36.3079 173.7678 138 V 4.8192 9.1554 124.2608 61.0807 35.2520 173.7127 139 F 5.3845 9.4833 130.6628 56.6622 41.4051 174.0961 140 L 4.1564 8.2345 127.7873 52.8414 42.8599 177.7480 141 D 4.7464 8.0528 126.6268 53.8277 40.9227 174.8825 142 H 4.9559 8.3711 115.6283 53.8838 30.2077 173.6467 143 W 4.9266 8.3104 118.2753 57.1176 29.1465 177.1974 144 K 3.1359 8.8664 122.7204 59.1260 31.6041 178.1605 145 D 4.5401 7.9936 115.7417 54.4838 39.8902 177.3294 146 R 4.4201 7.9941 119.0004 56.9031 30.5026 177.6182 147 Y 4.0354 7.6353 117.0298 61.0452 37.8858 178.4030 148 L 4.1312 8.0207 120.5797 57.7633 42.4457 176.8131 149 P 4.2505 0.0000 0.0000 66.2893 30.9558 177.9529 150 D 4.4235 8.4134 118.4357 57.1279 40.7142 178.8922 151 T 3.9191 7.8909 116.1728 66.6251 68.4036 176.7872 152 L 4.0719 8.0647 120.9633 57.4890 41.5234 179.3768 153 L 3.9400 7.8872 120.5157 58.1088 42.0530 178.9401 154 L 3.9456 8.1210 119.1607 57.7366 41.5157 179.2339 155 E 3.7788 8.1326 119.1723 58.9953 29.3985 178.6169 156 K 3.9429 7.9926 118.6532 59.7854 32.3536 177.8139 157 C 4.5070 8.0903 113.2290 59.0881 28.0629 173.6133 158 G 3.9742 7.7628 108.4235 46.7450 0.0000 175.0060 159 L 4.3109 7.9983 119.5348 54.7895 42.4131 176.7519 160 L 4.8961 7.4792 118.4759 52.7619 43.7318 175.5680 161 R 4.8261 8.6732 117.4453 53.6101 32.7187 174.4664 162 K 4.0720 8.6833 119.7471 58.5550 32.1592 176.6846 163 G 4.1209 9.3403 115.2400 45.3297 0.0000 173.8440 164 T 4.1243 8.4068 118.1204 63.9733 69.7917 173.3009 165 V 4.3854 8.5659 126.3960 61.4081 33.4941 174.2352 166 L 5.1454 8.8870 128.4252 52.9854 44.0250 175.0866 167 L 5.2809 9.2765 126.3361 53.2684 44.7805 174.6225 168 A 4.9499 9.1217 128.6693 50.1912 21.4513 175.0006 169 D 4.9805 8.5805 122.3076 53.3372 43.4453 175.2160 170 N 4.8906 8.6823 115.9236 53.7786 36.0041 176.6712 171 V 3.9841 7.7401 111.3304 63.1630 32.1824 177.1083 172 I 4.2685 8.0464 118.5301 62.1064 38.7153 175.9055 173 V 4.4052 8.2686 118.3290 60.3496 33.6696 173.7702 174 P 4.2532 0.0000 0.0000 63.8068 31.5242 177.4181 175 G 4.0107 8.8775 104.2779 46.1465 0.0000 173.9271 176 T 4.5080 7.9851 112.3817 58.7541 67.7571 172.0653 177 P 4.2313 0.0000 0.0000 66.1246 31.8586 177.9350 178 D 4.3727 8.0286 116.9229 56.4240 39.4555 178.0073 179 F 4.1384 8.2452 121.8069 60.9425 39.6470 176.5854 180 L 3.7595 8.3606 119.7688 58.0814 41.8232 178.8053 181 A 3.9684 8.0306 120.7011 55.1692 18.4475 178.9393 182 Y 3.8407 8.1801 118.1466 61.0947 38.7450 178.7870 183 V 3.3333 7.3866 112.0280 64.2970 31.5872 178.6335 184 R 4.1311 7.7017 116.6319 58.3086 29.9849 178.3371 185 G 3.7686 7.5295 103.2767 44.2863 0.0000 173.7782 186 S 4.3403 7.2954 116.7199 57.4369 63.1048 174.5851 187 S 4.4301 8.4582 120.4507 59.4764 63.3125 174.8136 188 S 4.1084 8.1149 117.5531 59.4038 63.0966 173.4584 189 F 5.4296 7.6952 118.7395 55.5600 42.6265 174.3148 190 E 4.6738 9.1858 121.9526 55.1081 31.3884 174.7523 191 C 5.5115 8.7564 122.2152 58.4302 30.9971 173.6939 192 T 4.6527 9.0926 118.3406 62.1270 72.4934 172.1650 193 H 5.2729 8.7560 125.3251 54.6692 32.1330 173.0987 194 Y 4.4901 8.7144 123.6994 56.1030 39.8390 174.9182 195 S 4.5229 8.6032 120.1793 58.1472 63.2741 173.1736 196 S 4.3129 9.0655 123.9846 57.7836 66.7052 171.9159 197 Y 5.1292 8.5577 114.9530 55.5429 42.0046 175.2113 198 L 4.2354 9.3606 125.6283 54.9358 43.1556 176.3171 199 E 3.6731 9.0180 122.9831 58.2888 29.4652 176.7309 200 Y 3.6072 8.1563 119.7184 58.6967 35.4844 169.2724 201 M 4.7442 7.7582 116.0309 54.7423 36.4060 174.9009 202 K 4.3228 8.5025 119.8540 56.7516 32.8407 176.7038 203 V 3.9368 7.5605 118.9724 63.3832 32.7569 175.0483 204 V 3.9703 8.3467 127.8009 63.0277 32.1668 174.2700 205 D 4.7814 8.4472 125.9850 53.7607 45.5161 173.1864 206 G 4.1087 8.3679 104.7207 45.6774 0.0000 172.0137 207 L 5.2604 8.5871 119.9383 52.7721 44.8138 175.3597 208 E 5.1475 9.1416 123.5873 54.3873 32.3618 174.2264 209 K 5.0817 9.5882 128.5894 54.8067 34.5413 174.5495 210 A 5.2260 9.3707 129.6639 50.3694 21.9041 174.6177 211 I 4.7164 8.9312 124.6560 60.5937 39.0094 175.2111 212 Y 4.4430 9.2204 130.0088 58.0702 39.2112 176.0824 213 Q 4.2429 8.3624 125.4599 55.1177 30.2457 174.9699 214 G 3.1904 6.0556 103.5708 42.9661 0.0000 171.1568 215 P 4.1637 0.0000 0.0000 63.3867 31.8023 177.7008 *216 S 4.2715 8.3937 114.4539 58.5571 62.9013 174.0336 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 3 D 8.35 4.59 0.00 2.94 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 T 7.80 4.43 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 1.27 0.00 0.00 5 K 9.29 3.97 0.00 1.94 1.96 0.00 1.95 0.00 0.00 2.04 0.00 0.00 3.12 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.60 1.68 7.81 6 E 8.20 3.83 0.00 2.10 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.87 0.00 7 Q 7.83 3.98 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 8 R 8.03 3.85 0.00 2.00 1.92 0.00 3.23 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.92 0.00 9 I 7.56 2.90 1.78 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 1.12 0.76 0.75 0.00 0.00 10 L 7.66 3.77 0.00 1.64 1.72 0.78 0.65 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 11 R 7.99 3.91 0.00 1.92 1.97 0.00 3.13 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.57 0.00 12 Y 7.85 3.83 0.00 2.85 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 13 V 7.76 3.44 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 0.64 0.00 0.00 0.92 0.00 0.00 14 Q 7.44 3.10 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.62 0.00 0.00 0.00 0.00 0.00 1.83 2.26 0.00 15 Q 7.63 4.27 0.00 1.82 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.77 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 16 N 7.44 4.63 0.00 2.15 2.52 0.00 0.00 6.89 8.49 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 17 A 8.19 4.43 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 18 K 8.72 4.43 0.00 1.80 1.70 0.00 1.64 0.00 0.00 1.80 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.37 7.81 19 P 0.00 3.22 0.00 1.78 1.34 0.00 3.70 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.69 0.00 20 G 8.79 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 21 D 7.58 4.71 0.00 2.67 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 22 P 0.00 4.24 0.00 2.16 2.06 0.00 3.63 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.30 0.00 23 Q 8.09 3.96 0.00 2.15 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 24 S 8.68 4.21 0.00 4.13 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 V 7.82 3.64 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 1.08 0.00 0.00 1.21 0.00 0.00 26 L 7.97 4.06 0.00 1.91 1.73 0.76 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.37 4.07 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.72 0.00 28 A 8.47 4.24 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 29 I 8.00 3.74 2.31 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.89 0.97 0.00 0.00 30 D 8.53 4.50 0.00 2.85 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 T 8.17 3.82 4.53 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 1.27 0.00 0.00 32 Y 7.78 3.40 0.00 2.13 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 33 C 7.63 4.90 0.00 1.86 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 7.25 4.02 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 1.22 0.00 0.00 35 Q 7.85 4.41 0.00 1.81 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 2.24 2.46 0.00 36 K 7.89 4.19 0.00 0.79 1.14 0.00 1.45 0.00 0.00 1.55 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.76 0.90 7.81 37 E 6.70 4.61 0.00 1.99 1.82 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 2.23 2.07 0.00 38 W 8.80 4.23 0.00 3.23 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 A 6.79 4.50 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 40 M 7.55 4.07 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 41 N 7.55 4.71 0.00 2.36 2.18 0.00 0.00 7.18 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 V 8.40 3.57 2.34 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 0.95 0.00 0.00 1.06 0.00 0.00 43 G 7.53 3.49 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 0.00 44 D 8.34 4.44 0.00 3.09 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 45 A 7.89 4.02 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 46 K 8.09 3.87 0.00 2.02 1.92 0.00 1.88 0.00 0.00 1.88 0.00 0.00 3.21 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.58 1.68 7.81 47 G 8.02 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 0.00 0.00 0.00 48 Q 8.36 4.01 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.65 0.00 49 I 7.26 3.72 1.98 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 1.55 0.70 0.61 0.00 0.00 50 M 7.97 3.89 0.00 1.86 2.16 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.33 0.00 51 D 8.24 4.30 0.00 2.82 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 52 A 7.80 3.95 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 7.79 3.62 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.76 0.00 0.00 54 I 8.05 3.75 1.98 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 1.70 0.86 0.89 0.00 0.00 55 R 7.88 3.86 0.00 1.91 1.97 0.00 3.15 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 56 E 7.78 3.90 0.00 1.82 1.87 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 1.47 1.89 0.00 57 Y 7.84 4.16 0.00 3.07 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 58 S 8.68 3.70 0.00 3.88 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.51 0.00 2.23 2.07 0.00 3.92 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 2.00 2.01 0.00 60 S 8.86 4.56 0.00 3.98 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.73 5.10 0.00 1.71 1.48 0.98 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 62 V 8.82 4.93 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 1.02 0.00 0.00 0.92 0.00 0.00 63 L 8.86 5.09 0.00 1.71 1.43 0.82 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 64 E 9.39 5.06 0.00 2.11 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.43 0.00 65 L 8.88 4.37 0.00 1.09 0.96 0.65 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 66 G 9.01 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 0.00 0.00 0.00 67 A 8.60 4.41 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 68 Y 9.00 3.69 0.00 2.88 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 69 C 9.04 4.13 0.00 2.65 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 70 G 8.37 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 0.00 0.00 0.00 71 Y 8.18 4.00 0.00 3.14 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.36 4.05 0.00 3.99 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 A 7.93 3.96 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 74 V 7.85 3.45 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 0.90 0.00 0.00 0.91 0.00 0.00 75 R 7.49 3.66 0.00 1.50 1.82 0.00 2.99 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.61 0.00 76 M 8.27 4.08 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.34 0.00 77 A 8.19 4.01 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 78 R 7.78 3.95 0.00 1.97 2.18 0.00 3.00 0.00 0.00 3.13 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.62 0.00 79 L 7.42 4.47 0.00 1.77 1.70 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 80 L 7.48 4.16 0.00 1.74 1.58 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 8.38 4.19 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 7.04 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 82 P 0.00 4.44 0.00 2.07 1.98 0.00 3.72 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 83 G 8.97 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 84 A 7.58 4.51 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 R 9.28 4.85 0.00 1.67 1.78 0.00 3.09 0.00 0.00 3.12 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 86 L 8.78 5.06 0.00 1.70 1.45 0.97 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 87 L 8.90 5.07 0.00 1.48 1.34 0.81 0.35 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 88 T 8.63 4.99 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 89 M 8.85 4.96 0.00 1.91 1.84 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 90 E 8.93 4.76 0.00 2.06 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 91 M 8.81 4.07 0.00 2.16 2.13 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.35 0.00 92 N 8.78 4.44 0.00 2.52 2.57 0.00 0.00 6.79 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 4.26 0.00 2.27 2.28 0.00 3.65 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 94 D 8.28 4.35 0.00 2.72 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 95 Y 7.97 4.37 0.00 3.13 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 96 A 8.35 4.01 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 97 A 8.00 3.95 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 98 I 7.62 3.62 1.94 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 1.79 0.86 0.79 0.00 0.00 99 T 8.14 4.09 4.40 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 1.22 0.00 0.00 100 Q 8.12 3.95 0.00 2.30 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 101 Q 8.09 4.02 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 102 M 8.40 4.03 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.72 0.00 103 L 8.26 4.03 0.00 1.88 1.70 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 104 N 8.36 4.31 0.00 2.95 2.90 0.00 0.00 6.66 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 0.00 105 F 8.47 4.01 0.00 3.23 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 0.00 106 A 8.37 4.36 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 0.00 107 G 7.86 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 7.96 4.68 0.00 1.67 1.62 0.88 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 109 Q 8.00 4.09 0.00 2.20 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.92 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 110 D 8.01 4.36 0.00 2.68 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 K 8.00 4.19 0.00 1.81 1.83 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.35 7.81 112 V 7.06 4.96 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 0.82 0.00 0.00 0.97 0.00 0.00 113 T 8.68 4.63 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 1.26 0.00 0.00 114 I 8.46 4.62 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.50 0.91 0.00 0.00 115 L 9.01 4.47 0.00 1.41 1.49 0.41 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 116 N 9.06 5.09 0.00 2.72 2.76 0.00 0.00 7.10 7.98 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 0.00 117 G 7.53 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 0.00 0.00 0.00 118 A 7.80 4.43 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 0.00 119 S 8.94 4.11 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 0.00 120 Q 8.07 4.06 0.00 2.23 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.06 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 121 D 7.85 4.57 0.00 2.79 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 0.00 122 L 7.91 4.28 0.00 1.67 1.69 0.91 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 123 I 8.10 3.67 1.91 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 1.48 1.52 0.90 0.00 0.00 124 P 0.00 4.46 0.00 2.03 2.12 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 125 Q 8.05 4.56 0.00 2.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.79 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 126 L 7.73 4.16 0.00 1.67 1.76 0.88 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 127 K 7.96 4.63 0.00 1.84 1.87 0.00 1.95 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.70 1.41 7.81 128 K 7.95 3.93 0.00 1.72 1.83 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.44 7.81 129 K 8.04 3.97 0.00 1.76 1.30 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.35 7.81 130 Y 7.73 4.45 0.00 3.15 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 0.00 131 D 8.08 4.31 0.00 2.73 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 0.00 132 V 7.61 4.37 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.05 0.00 0.00 133 D 8.27 4.63 0.00 2.66 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.23 4.85 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 1.27 0.00 0.00 135 L 8.53 4.56 0.00 1.60 1.61 0.89 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 136 D 8.73 4.66 0.00 2.78 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 M 7.74 5.29 0.00 2.03 1.80 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.54 0.00 138 V 9.16 4.82 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 0.80 0.00 0.00 0.91 0.00 0.00 139 F 9.48 5.38 0.00 2.97 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 8.23 4.16 0.00 0.69 0.13 0.74 0.02 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 0.00 141 D 8.05 4.75 0.00 1.58 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 0.00 0.00 0.00 0.00 142 H 8.37 4.96 0.00 3.00 3.08 0.00 5.59 0.00 0.00 0.00 0.00 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 W 8.31 4.93 0.00 3.28 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.87 3.14 0.00 1.58 1.52 0.00 1.22 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.43 1.31 7.81 145 D 7.99 4.54 0.00 2.77 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 0.00 146 R 7.99 4.42 0.00 1.85 2.17 0.00 3.34 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 147 Y 7.64 4.04 0.00 2.72 2.33 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 0.00 148 L 8.02 4.13 0.00 1.83 1.67 0.80 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 149 P 0.00 4.25 0.00 2.31 2.31 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.17 0.00 150 D 8.41 4.42 0.00 2.88 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 0.00 151 T 7.89 3.92 4.50 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 1.38 0.00 0.00 152 L 8.06 4.07 0.00 1.84 1.70 0.76 0.15 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 0.00 153 L 7.89 3.94 0.00 1.98 1.76 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.12 3.95 0.00 1.87 1.65 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 155 E 8.13 3.78 0.00 2.18 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 2.34 2.17 0.00 156 K 7.99 3.94 0.00 1.93 1.97 0.00 1.86 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.51 7.81 157 C 8.09 4.51 0.00 2.98 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 0.00 158 G 7.76 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 L 8.00 4.31 0.00 1.83 1.68 0.91 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 160 L 7.48 4.90 0.00 0.99 1.00 0.50 0.74 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 0.00 161 R 8.67 4.83 0.00 2.02 2.02 0.00 2.90 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 162 K 8.68 4.07 0.00 1.70 1.80 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.51 7.81 163 G 9.34 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 0.00 0.00 0.00 164 T 8.41 4.12 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 1.29 0.00 0.00 165 V 8.57 4.39 1.83 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 0.68 0.00 0.00 0.18 0.00 0.00 166 L 8.89 5.15 0.00 2.01 1.67 1.14 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 167 L 9.28 5.28 0.00 1.75 1.70 0.99 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 168 A 9.12 4.95 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 0.00 169 D 8.58 4.98 0.00 2.84 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 0.00 170 N 8.68 4.89 0.00 3.06 3.01 0.00 0.00 7.64 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 V 7.74 3.98 2.23 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 0.93 0.00 0.00 1.15 0.00 0.00 172 I 8.05 4.27 2.06 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 1.40 0.90 0.95 0.00 0.00 173 V 8.27 4.41 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 0.80 0.00 0.00 0.93 0.00 0.00 174 P 0.00 4.25 0.00 2.02 2.03 0.00 3.69 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 2.02 2.07 0.00 175 G 8.88 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 0.00 176 T 7.99 4.51 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 1.42 0.00 0.00 177 P 0.00 4.23 0.00 2.19 2.12 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 178 D 8.03 4.37 0.00 2.91 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 0.00 179 F 8.25 4.14 0.00 3.25 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 L 8.36 3.76 0.00 2.07 1.69 1.03 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 181 A 8.03 3.97 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 0.00 182 Y 8.18 3.84 0.00 3.15 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 0.00 183 V 7.39 3.33 1.50 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 -0.22 0.00 0.00 0.48 0.00 0.00 184 R 7.70 4.13 0.00 1.86 1.95 0.00 3.11 0.00 0.00 3.20 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 185 G 7.53 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 0.00 186 S 7.30 4.34 0.00 3.46 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 0.00 187 S 8.46 4.43 0.00 3.96 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 0.00 188 S 8.11 4.11 0.00 3.62 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 F 7.70 5.43 0.00 3.01 2.91 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 0.00 190 E 9.19 4.67 0.00 2.01 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 2.22 2.53 0.00 191 C 8.76 5.51 0.00 2.85 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 0.00 192 T 9.09 4.65 4.32 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 0.81 0.00 0.00 193 H 8.76 5.27 0.00 3.19 3.14 0.00 5.88 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 Y 8.71 4.49 0.00 2.95 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 0.00 195 S 8.60 4.52 0.00 3.90 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 0.00 196 S 9.07 4.31 0.00 3.90 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 Y 8.56 5.13 0.00 2.85 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 L 9.36 4.24 0.00 1.81 1.66 1.05 1.08 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 0.00 199 E 9.02 3.67 0.00 1.16 1.87 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 2.52 2.12 0.00 200 Y 8.16 3.61 0.00 3.43 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 M 7.76 4.74 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.53 0.00 202 K 8.50 4.32 0.00 1.70 1.84 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.55 7.81 203 V 7.56 3.94 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 0.90 0.00 0.00 0.95 0.00 0.00 204 V 8.35 3.97 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 0.66 0.00 0.00 0.79 0.00 0.00 205 D 8.45 4.78 0.00 2.86 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 G 8.37 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 L 8.59 5.26 0.00 1.72 1.67 0.91 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 208 E 9.14 5.15 0.00 2.30 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 2.32 2.39 0.00 209 K 9.59 5.08 0.00 2.10 1.98 0.00 1.71 0.00 0.00 1.85 0.00 0.00 3.25 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.44 7.81 210 A 9.37 5.23 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 0.00 211 I 8.93 4.72 1.96 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.02 0.96 0.00 0.00 212 Y 9.22 4.44 0.00 3.08 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 0.00 213 Q 8.36 4.24 0.00 1.64 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.52 0.00 0.00 0.00 0.00 0.00 2.41 2.32 0.00 214 G 6.06 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 P 0.00 4.16 0.00 2.03 2.05 0.00 3.66 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 2.06 2.19 0.00 *216 S 8.39 4.27 0.00 3.60 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.