NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 3.8716 8.0549 120.6159 63.2187 33.2189 175.6112 3 Q 4.2009 8.1396 123.8299 54.6654 31.6803 171.1308 4 L 4.6014 8.5307 124.4152 53.5046 43.8734 175.4734 5 V 4.6501 8.4013 123.9888 61.1210 34.7841 174.8959 6 E 5.7478 9.1958 126.8960 55.4939 31.8298 174.9003 7 S 4.7756 8.6525 114.6100 57.8599 66.1558 173.9784 8 G 4.0754 8.8068 108.8210 46.7927 0.0000 175.1117 9 G 3.8646 8.0976 107.2133 45.0556 0.0000 173.6378 10 G 3.9143 7.2207 104.6818 46.0330 0.0000 171.1298 11 V 4.9706 8.1430 119.7037 61.6917 33.4432 176.8327 12 V 4.7423 8.5407 124.8773 60.5426 35.1769 173.2688 13 Q 5.2443 8.3724 118.9801 52.6372 32.0552 172.7611 14 P 4.7963 0.0000 0.0000 63.5694 31.2505 174.9773 15 G 4.0355 9.5988 116.9011 46.1913 0.0000 174.6872 16 R 4.2751 7.7734 119.1329 55.9939 31.3876 174.5932 17 S 4.8763 8.2302 113.1782 57.6425 66.8854 172.2038 18 L 4.6816 8.3883 118.6774 53.9574 46.9999 175.1119 19 R 4.9406 8.1920 118.5335 54.5535 33.2310 172.8875 20 L 5.3492 9.9956 125.8254 53.5408 43.7219 176.6757 21 S 5.8261 8.1354 121.3965 58.9644 63.1632 174.4573 22 C 5.3020 8.1810 124.6997 54.5439 40.0101 172.3784 23 A 4.6081 8.5862 127.9975 51.4811 19.3871 175.8308 24 A 5.3036 8.5655 122.7099 49.7175 22.1309 176.1014 25 S 4.4210 8.2954 113.0146 58.5068 66.3296 174.6595 26 G 3.9709 9.1865 105.7088 46.5012 0.0000 172.5712 27 F 4.7042 7.9235 112.6021 56.9095 41.1151 174.7638 28 T 4.1293 8.1109 115.4956 59.9006 65.3544 174.3086 29 F 3.2679 7.6854 127.9260 59.7362 40.0826 176.3926 30 S 4.2310 7.8951 114.4221 61.0920 63.4319 175.7014 31 S 4.4528 7.8526 113.8964 58.9334 62.2384 173.0353 32 Y 4.8470 7.4368 117.0180 56.1312 42.1018 174.7480 33 G 4.0255 8.6718 108.5135 45.7432 0.0000 173.2923 34 M 4.8616 8.5619 123.9842 54.7377 34.5979 174.6573 35 H 5.4993 8.4327 115.8573 54.2912 34.2948 172.7742 36 W 5.8257 9.2107 118.5691 55.6228 33.1021 174.7748 37 V 5.3224 9.7830 124.9366 61.2067 35.1783 174.3102 38 R 4.9972 9.6130 120.7129 54.7209 33.3818 174.1590 39 Q 4.9396 9.0663 120.6061 53.0439 30.8575 174.4299 40 A 4.3609 8.7535 126.6100 51.8463 19.5843 174.8279 41 P 4.1524 0.0000 0.0000 64.7020 30.2787 174.1849 42 G 4.3017 9.1191 113.3845 45.9206 0.0000 173.6034 43 K 4.4652 8.0055 119.4706 55.6822 34.6942 177.0312 44 G 4.1731 8.2961 109.3101 46.8021 0.0000 173.3956 45 L 4.8115 8.5219 125.0212 53.1148 43.4305 175.3087 46 E 4.7211 8.9297 123.6480 54.1224 32.7765 174.2766 47 W 4.7242 9.2901 135.0000 57.7899 31.3147 175.4983 48 V 3.7833 8.6466 126.1086 63.6641 33.7640 174.8540 49 A 4.4132 6.4020 119.7526 51.5104 22.1272 175.2234 50 V 5.1163 8.3967 117.9234 60.6469 35.6023 174.2516 51 I 4.9414 8.6024 120.3277 60.1297 41.8927 174.2839 52 S 5.1661 7.8041 122.1205 56.8818 65.3139 172.6192 53 Y 4.8104 9.1611 116.5670 59.5645 37.2996 176.7557 54 D 4.4140 7.3001 117.4375 53.8230 43.2095 176.1449 55 G 4.4257 8.3064 107.9570 46.2637 0.0000 172.5786 56 S 4.5043 8.1031 109.5213 59.1128 66.4436 175.3603 57 N 4.8500 8.0464 118.2218 52.1161 40.1932 174.9263 58 K 4.8586 7.9917 121.4161 56.3290 36.3325 174.6046 59 Y 4.7735 8.8075 122.5263 56.4055 41.2626 174.5213 60 Y 4.9349 8.9060 119.8345 55.9243 41.1852 175.1461 61 A 4.3474 7.8719 122.8895 50.5141 19.5082 180.4461 62 D 4.8159 8.7660 122.2695 52.0016 40.0310 178.1148 63 S 3.7681 9.0333 120.9649 60.8634 62.0545 172.3354 64 V 3.9053 8.0446 116.9843 58.2628 33.7108 172.3293 65 K 3.4914 8.8229 132.9759 56.6942 32.4622 174.8009 66 G 3.9517 8.5309 109.8048 46.3797 0.0000 173.5336 67 R 4.5522 7.4357 121.2701 56.1371 37.7400 174.1457 68 F 4.6598 7.9894 117.5494 56.3254 41.6517 174.7010 69 T 4.7663 8.2599 116.5658 60.8935 69.9847 172.8093 70 I 5.0109 9.6531 130.4133 60.8858 39.8960 174.5131 71 S 4.8819 8.5934 118.6809 59.0131 66.6036 174.0034 72 R 5.0596 8.4288 113.5250 56.0910 31.6592 174.4263 73 D 4.9510 8.7056 120.7048 51.8012 41.2752 176.0451 74 N 4.8281 8.8207 115.6985 54.1660 39.0017 175.6136 75 S 4.5630 8.3038 114.0260 59.0481 64.3802 175.2768 76 K 4.3405 7.7488 116.5346 55.5428 32.2606 175.9935 77 N 3.7174 8.1069 115.0163 53.9387 35.9436 173.4446 78 T 4.5901 7.1457 108.0441 59.6708 72.4767 172.3650 79 L 5.1541 8.1570 123.2933 53.5790 45.2419 174.9678 80 Y 5.2446 9.1459 123.2950 56.7306 42.0195 175.0952 81 L 4.2720 8.3183 122.2613 54.7834 43.9226 173.9330 82 Q 4.2301 8.9138 130.3262 55.0459 29.6367 174.3959 83 M 3.7370 8.1723 126.8811 54.7879 33.8005 175.4123 84 N 4.9522 8.3420 117.3792 53.1235 43.8026 175.3630 85 S 3.8069 7.8050 113.8405 58.5315 62.1062 170.3878 86 L 3.8503 6.9529 117.5109 55.3682 41.7942 176.6630 87 R 5.0713 8.5495 120.6542 53.9490 34.0296 176.3606 88 A 4.0336 8.6754 120.4060 55.8893 18.4819 179.5501 89 E 3.6930 8.2637 114.8254 59.7027 29.7367 178.0993 90 D 4.5130 7.7805 116.7475 56.0511 41.3443 175.6998 91 T 4.1131 8.8636 116.0840 63.5192 68.2623 172.5511 92 A 4.4053 8.9480 129.4153 51.4819 23.8110 174.6509 93 V 4.2727 7.8734 119.8290 62.2495 32.9545 174.3396 94 Y 4.9335 9.3190 126.9091 57.0364 39.6394 174.4217 95 Y 6.2512 9.9136 122.0781 55.6631 41.6376 172.4430 96 C 5.4777 9.3206 115.5218 52.6560 38.5534 172.6751 97 A 4.7246 8.0286 125.1298 49.6965 21.6847 175.4914 98 K 4.4003 8.6512 119.5636 55.9277 33.6497 176.2658 99 D 4.8372 8.7012 123.5242 53.5633 42.1622 177.0261 100 G 3.6888 8.3521 112.4390 48.9410 0.0000 175.2907 *109 S 4.3592 8.0889 113.2240 57.3755 64.5828 175.4535 110 G 3.6938 9.0307 107.8491 45.7524 0.0000 173.7991 111 L 4.5613 7.6109 121.2447 52.2266 42.2831 175.4260 112 L 5.0410 8.0608 123.6226 54.1408 39.2195 177.4090 113 D 4.3388 8.1053 119.8310 54.3700 40.3801 176.3821 114 Y 4.8176 7.5335 117.9329 57.2076 42.8327 174.2464 115 W 4.8641 9.2231 124.0375 55.0444 32.7044 174.3302 116 G 4.5782 8.3258 104.1546 44.4785 0.0000 174.0293 117 Q 4.4090 8.9728 116.5454 55.6432 28.8524 176.4492 118 G 4.6834 8.3513 106.9443 45.3489 0.0000 173.4126 119 T 4.7765 7.9251 114.9225 61.4501 72.9389 172.4878 120 L 4.7588 8.5265 126.7573 53.7403 44.1703 174.9023 121 V 4.9378 9.0572 127.0706 61.3228 34.1788 174.2001 122 T 5.2480 8.6857 117.4029 58.8356 71.7921 172.9276 123 V 5.0951 8.5776 124.9580 60.1456 33.3461 173.4438 124 S 4.4533 8.4558 125.1353 58.2527 66.2002 176.2587 *128 F 5.1314 9.1259 120.9635 57.3528 39.3940 172.7750 129 K 4.8009 9.0201 124.1993 54.6463 36.0307 175.7113 130 G 4.3392 8.7445 112.1935 45.0054 0.0000 171.6499 131 P 4.9867 0.0000 0.0000 62.4980 32.3490 176.8316 132 S 4.3550 8.8824 119.3996 56.7136 64.2697 173.1767 133 V 4.0916 7.7366 125.2457 62.2448 31.9438 175.0936 134 F 5.3794 8.6457 126.5603 54.9930 42.6429 172.9107 135 P 5.0728 0.0000 0.0000 62.6056 32.9134 175.8301 136 L 4.7448 9.2708 122.1096 52.6754 43.4720 176.0337 137 A 4.3124 8.6207 125.6071 52.3262 19.1702 176.2433 *147 T 4.0770 8.2421 112.4066 62.0190 68.3952 172.5418 148 A 4.9263 8.8631 126.2488 51.0858 23.0634 174.2967 149 A 4.7988 8.2447 116.2302 51.2728 22.2738 176.1262 150 L 4.6991 8.4537 122.2160 54.4107 45.1950 174.7236 151 G 4.2870 8.1859 103.9906 46.9369 0.0000 171.1393 152 C 5.7020 8.8844 116.2900 55.0352 41.1151 173.6706 153 L 4.5860 8.9674 124.7501 53.4545 43.8158 175.6093 154 V 4.0554 8.4106 128.0988 61.9353 32.3617 174.5875 155 K 4.8824 8.2659 129.0903 55.7543 35.6739 173.8279 156 D 4.4665 9.1836 126.0522 54.9015 37.7109 172.0770 157 Y 5.1875 8.0163 119.0330 55.6824 42.4426 173.9240 158 F 5.0343 9.3778 122.3338 56.4041 43.0686 171.3483 159 P 3.6159 0.0000 0.0000 62.2307 33.2997 173.7794 160 E 4.4541 8.1342 120.8983 53.9624 31.7895 172.9509 161 P 4.7316 0.0000 0.0000 61.2323 33.6221 174.0601 162 V 4.6077 7.7757 110.2602 60.1932 36.0060 175.5710 163 T 4.5664 7.8742 110.7809 60.6289 72.2040 172.8430 164 V 4.7018 8.4270 125.3368 61.2752 33.5303 174.7368 165 S 4.8521 9.3461 124.7678 56.7409 66.3653 173.4662 166 W 4.7423 8.2079 119.8799 55.2899 32.1992 175.4565 167 N 4.3747 9.4166 125.2163 54.8967 35.3741 175.5972 168 S 4.1775 8.9434 107.9727 59.0744 60.5309 173.4826 169 G 4.0106 8.6559 106.6916 45.3281 0.0000 175.2453 170 A 4.0444 7.7869 122.7223 54.4678 18.8245 178.0714 171 L 4.4176 8.1022 120.5985 54.7153 41.2439 175.6335 172 T 4.3859 8.3270 122.3211 64.8367 71.0291 174.6678 173 S 4.3132 7.9194 117.7555 60.9817 62.7740 173.8735 174 G 3.8666 8.9918 114.1920 44.8712 0.0000 171.6328 175 V 4.4019 6.9017 118.1315 61.5830 33.1665 175.9652 176 H 4.6451 8.8471 123.8368 54.2637 30.8558 170.9514 177 T 4.4863 8.0689 118.2276 62.7814 68.9685 174.3334 178 F 4.4478 9.3396 126.7634 56.1769 39.7594 174.4391 179 P 4.3220 0.0000 0.0000 62.8749 31.7502 176.0285 180 A 4.6543 8.3175 122.9426 51.4603 20.2811 176.9807 181 V 4.4102 8.1464 109.8498 59.3432 34.9642 175.7876 182 L 3.6627 8.7912 128.3427 55.1295 42.7626 176.1158 183 Q 4.6495 7.7393 123.1394 53.3366 31.7015 176.6596 184 S 4.3033 8.5434 113.9762 60.9922 62.7442 175.6892 185 S 4.2736 7.7241 114.2433 58.7934 63.6923 174.9736 186 G 3.8124 8.3095 107.3768 44.6118 0.0000 172.8551 187 L 4.6692 7.5978 120.6048 53.0297 43.2576 176.1369 188 Y 4.3286 8.2201 122.2656 58.3230 39.2332 175.6177 189 S 5.1405 8.4335 116.1066 57.5880 66.3319 173.1703 190 L 5.0787 9.1454 127.5128 54.0082 44.1790 174.8370 191 S 5.2042 8.6250 111.4932 56.8608 66.4262 172.4686 192 S 5.2314 9.1457 119.4344 56.8777 65.5925 173.0826 193 V 5.1391 8.6288 119.1900 59.5658 36.1201 174.8918 194 V 5.2444 8.8590 121.5983 59.0502 34.9589 174.4202 195 T 4.9534 8.1312 112.9610 59.5879 69.9941 173.8464 196 V 4.4658 7.9300 119.4807 58.3284 35.6683 173.9628 197 P 4.3502 0.0000 0.0000 63.4569 31.2912 177.9303 198 S 3.8799 8.4712 118.9049 55.7040 65.8244 174.9510 199 S 3.2086 8.4619 126.3754 60.5266 61.8963 170.4131 *204 Q 3.8784 8.3441 123.3451 57.1517 29.7157 175.1206 205 T 4.4513 8.0073 120.8090 61.8863 70.8303 173.2404 206 Y 5.4148 8.3152 122.2587 56.4677 41.3987 174.6486 207 I 5.1965 10.1078 124.4082 59.6585 41.7213 171.6460 208 C 3.8467 7.9278 120.5174 53.3613 40.1625 172.3662 209 N 4.8332 9.2845 120.9367 51.9019 39.8108 173.9153 210 V 4.6266 8.3832 124.8264 61.0527 32.9868 174.3538 211 N 4.9470 8.6461 125.5966 52.6669 42.0956 173.3150 212 H 4.8262 9.3000 130.2876 53.9062 27.4402 175.0921 213 K 3.7781 8.1822 122.0435 58.9186 32.5437 177.4556 214 P 4.1648 0.0000 0.0000 64.4711 31.3067 176.7425 215 S 4.6593 7.8486 109.7731 56.9358 64.2043 173.3773 216 N 4.2082 7.8821 118.0313 55.1861 37.3822 173.8547 217 T 4.4767 7.8870 113.9050 61.4757 70.3116 173.0183 218 K 4.9147 8.4809 127.9105 54.5071 34.4117 175.5985 219 V 4.4258 9.0774 126.7743 61.5959 35.0269 173.1537 220 D 5.3152 8.6351 126.8444 51.7936 43.5162 175.8705 221 K 4.4416 8.0328 122.1946 54.6982 35.3533 175.5643 222 K 4.3508 8.8157 128.8221 56.5998 33.4475 175.8380 223 V 4.6322 8.4601 122.5257 61.2316 34.3566 175.1728 224 E 4.3353 8.7655 125.9948 56.8113 30.5261 175.0201 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 V 8.05 3.87 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 -0.11 0.00 0.00 -0.40 0.00 0.00 3 Q 8.14 4.20 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 4 L 8.53 4.60 0.00 1.62 1.62 0.97 0.84 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 5 V 8.40 4.65 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 1.02 0.00 0.00 1.04 0.00 0.00 6 E 9.20 5.75 0.00 2.19 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 2.83 2.40 0.00 7 S 8.65 4.78 0.00 3.88 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 G 8.81 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 0.00 0.00 0.00 9 G 8.10 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 10 G 7.22 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 0.00 0.00 0.00 11 V 8.14 4.97 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 1.21 0.00 0.00 12 V 8.54 4.74 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 0.64 0.00 0.00 0.92 0.00 0.00 13 Q 8.37 5.24 0.00 2.10 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.05 0.00 0.00 0.00 0.00 0.00 2.31 2.19 0.00 14 P 0.00 4.80 0.00 1.94 2.06 0.00 3.68 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.95 0.00 15 G 9.60 4.04 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 0.00 0.00 0.00 16 R 7.77 4.28 0.00 1.83 1.91 0.00 3.08 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 17 S 8.23 4.88 0.00 4.12 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 18 L 8.39 4.68 0.00 1.42 1.39 0.87 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.19 4.94 0.00 1.94 1.69 0.00 3.16 0.00 0.00 3.48 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.79 0.00 20 L 10.00 5.35 0.00 1.18 1.12 0.62 0.18 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 21 S 8.14 5.83 0.00 3.78 3.99 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 22 C 8.18 5.30 0.00 2.86 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.59 4.61 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 24 A 8.57 5.30 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 25 S 8.30 4.42 0.00 3.88 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 26 G 9.19 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 27 F 7.92 4.70 0.00 3.17 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 28 T 8.11 4.13 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 29 F 7.69 3.27 0.00 2.40 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 30 S 7.90 4.23 0.00 4.03 4.10 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 31 S 7.85 4.45 0.00 3.52 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 32 Y 7.44 4.85 0.00 2.82 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.67 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 34 M 8.56 4.86 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.84 0.00 35 H 8.43 5.50 0.00 3.03 3.10 0.00 5.57 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 W 9.21 5.83 0.00 3.39 3.14 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 37 V 9.78 5.32 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 1.30 0.00 0.00 0.80 0.00 0.00 38 R 9.61 5.00 0.00 1.05 1.50 0.00 2.54 0.00 0.00 3.34 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.51 0.00 39 Q 9.07 4.94 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.01 0.00 0.00 0.00 0.00 0.00 2.64 2.47 0.00 40 A 8.75 4.36 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 P 0.00 4.15 0.00 2.12 2.00 0.00 3.82 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.15 0.00 42 G 9.12 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 8.01 4.47 0.00 1.83 1.83 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.89 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.50 1.55 7.81 44 G 8.30 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 45 L 8.52 4.81 0.00 1.60 1.77 0.78 1.00 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 46 E 8.93 4.72 0.00 2.07 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 2.28 2.32 0.00 47 W 9.29 4.72 0.00 3.40 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 48 V 8.65 3.78 2.29 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 0.71 0.00 0.00 1.08 0.00 0.00 49 A 6.40 4.41 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 50 V 8.40 5.12 2.39 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 1.06 0.00 0.00 0.88 0.00 0.00 51 I 8.60 4.94 1.95 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 1.38 1.18 1.00 0.00 0.00 52 S 7.80 5.17 0.00 4.03 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 53 Y 9.16 4.81 0.00 3.23 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 D 7.30 4.41 0.00 1.90 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 0.00 0.00 0.00 0.00 55 G 8.31 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.10 4.50 0.00 3.92 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 8.05 4.85 0.00 2.79 2.92 0.00 0.00 6.95 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 58 K 7.99 4.86 0.00 1.59 1.51 0.00 1.90 0.00 0.00 2.56 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.33 7.81 59 Y 8.81 4.77 0.00 3.12 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 8.91 4.93 0.00 2.88 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 61 A 7.87 4.35 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 D 8.77 4.82 0.00 2.76 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 0.00 0.00 0.00 0.00 63 S 9.03 3.77 0.00 3.80 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 V 8.04 3.91 1.85 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 -0.08 0.00 0.00 0.92 0.00 0.00 65 K 8.82 3.49 0.00 1.62 1.61 0.00 1.66 0.00 0.00 0.61 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.98 0.46 7.81 66 G 8.53 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 67 R 7.44 4.55 0.00 1.86 2.06 0.00 3.13 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 68 F 7.99 4.66 0.00 2.82 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 69 T 8.26 4.77 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 1.20 0.00 0.00 70 I 9.65 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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 1.07 0.00 0.00 79 L 8.16 5.15 0.00 1.87 1.58 0.20 1.28 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 80 Y 9.15 5.24 0.00 3.05 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 81 L 8.32 4.27 0.00 1.00 0.68 0.94 -0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 8.91 4.23 0.00 2.14 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.70 0.00 0.00 0.00 0.00 0.00 2.21 2.40 0.00 83 M 8.17 3.74 0.00 1.51 1.51 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.81 0.00 84 N 8.34 4.95 0.00 2.54 2.59 0.00 0.00 6.74 7.23 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 85 S 7.81 3.81 0.00 4.13 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 86 L 6.95 3.85 0.00 2.03 1.62 0.86 0.89 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 87 R 8.55 5.07 0.00 1.80 1.82 0.00 3.14 0.00 0.00 3.18 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.57 0.00 88 A 8.68 4.03 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 89 E 8.26 3.69 0.00 1.95 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 2.32 2.40 0.00 90 D 7.78 4.51 0.00 3.00 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 91 T 8.86 4.11 4.41 0.00 0.00 0.00 0.00 0.00 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 92 A 8.95 4.41 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 V 7.87 4.27 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.88 0.00 0.00 94 Y 9.32 4.93 0.00 2.94 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 95 Y 9.91 6.25 0.00 3.38 3.20 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 96 C 9.32 5.48 0.00 2.26 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 97 A 8.03 4.72 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.65 4.40 0.00 1.58 1.49 0.00 1.16 0.00 0.00 0.61 0.00 0.00 2.48 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.25 1.38 7.81 99 D 8.70 4.84 0.00 2.75 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.35 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 *109 S 8.09 4.36 0.00 3.99 4.03 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 0.00 0.00 0.00 110 G 9.03 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 0.00 111 L 7.61 4.56 0.00 1.51 1.53 0.89 1.03 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 120 L 8.53 4.76 0.00 1.75 1.56 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 121 V 9.06 4.94 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 1.11 0.00 0.00 0.99 0.00 0.00 122 T 8.69 5.25 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 123 V 8.58 5.10 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 1.21 0.00 0.00 1.01 0.00 0.00 124 S 8.46 4.45 0.00 3.90 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *128 F 9.13 5.13 0.00 3.14 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 K 9.02 4.80 0.00 1.91 1.71 0.00 1.69 0.00 0.00 1.85 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.61 7.81 130 G 8.74 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 0.00 0.00 0.00 0.00 131 P 0.00 4.99 0.00 1.83 1.94 0.00 3.57 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 1.71 1.77 0.00 132 S 8.88 4.35 0.00 3.65 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 V 7.74 4.09 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 0.66 0.00 0.00 0.78 0.00 0.00 134 F 8.65 5.38 0.00 3.08 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 P 0.00 5.07 0.00 2.19 2.16 0.00 3.94 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.10 0.00 136 L 9.27 4.74 0.00 1.83 1.70 1.03 1.02 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 0.00 137 A 8.62 4.31 1.32 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 0.00 0.00 *147 T 8.24 4.08 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 1.20 0.00 0.00 148 A 8.86 4.93 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 A 8.24 4.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 L 8.45 4.70 0.00 1.90 1.79 0.55 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 151 G 8.19 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 0.00 0.00 0.00 152 C 8.88 5.70 0.00 2.96 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 0.00 153 L 8.97 4.59 0.00 1.96 1.73 1.05 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 154 V 8.41 4.06 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 0.66 0.00 0.00 0.89 0.00 0.00 155 K 8.27 4.88 0.00 1.99 1.74 0.00 2.00 0.00 0.00 1.78 0.00 0.00 2.86 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.49 7.81 156 D 9.18 4.47 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 0.00 157 Y 8.02 5.19 0.00 2.87 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 0.00 158 F 9.38 5.03 0.00 3.16 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 0.00 159 P 0.00 3.62 0.00 1.33 0.49 0.00 3.16 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.32 0.00 160 E 8.13 4.45 0.00 1.28 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 161 P 0.00 4.73 0.00 2.15 1.99 0.00 3.69 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 1.85 1.91 0.00 162 V 7.78 4.61 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.82 0.00 0.00 163 T 7.87 4.57 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 1.21 0.00 0.00 164 V 8.43 4.70 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 0.68 0.00 0.00 0.88 0.00 0.00 165 S 9.35 4.85 0.00 3.65 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 0.00 166 W 8.21 4.74 0.00 3.42 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 0.00 167 N 9.42 4.37 0.00 3.26 3.08 0.00 0.00 6.68 7.01 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 0.00 168 S 8.94 4.18 0.00 4.03 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 0.00 169 G 8.66 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 0.00 170 A 7.79 4.04 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 0.00 171 L 8.10 4.42 0.00 1.79 1.97 0.92 1.04 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 0.00 172 T 8.33 4.39 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 1.21 0.00 0.00 173 S 7.92 4.31 0.00 3.83 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 0.00 174 G 8.99 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 0.00 0.00 0.00 175 V 6.90 4.40 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 0.86 0.00 0.00 0.88 0.00 0.00 176 H 8.85 4.65 0.00 2.75 2.26 0.00 5.68 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 T 8.07 4.49 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 1.26 0.00 0.00 178 F 9.34 4.45 0.00 3.10 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 0.00 179 P 0.00 4.32 0.00 2.13 2.05 0.00 3.87 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 180 A 8.32 4.65 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 0.00 181 V 8.15 4.41 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 0.79 0.00 0.00 1.01 0.00 0.00 182 L 8.79 3.66 0.00 1.30 1.45 0.17 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 183 Q 7.74 4.65 0.00 2.16 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.44 0.00 0.00 0.00 0.00 0.00 2.22 2.36 0.00 184 S 8.54 4.30 0.00 3.93 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 0.00 185 S 7.72 4.27 0.00 3.93 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 0.00 186 G 8.31 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 L 7.60 4.67 0.00 1.57 1.55 0.99 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 0.00 188 Y 8.22 4.33 0.00 1.43 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 0.00 189 S 8.43 5.14 0.00 3.82 3.80 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 0.00 190 L 9.15 5.08 0.00 2.08 1.95 1.01 0.31 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 0.00 191 S 8.62 5.20 0.00 3.98 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 0.00 192 S 9.15 5.23 0.00 4.09 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 0.00 193 V 8.63 5.14 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 0.90 0.00 0.00 1.11 0.00 0.00 194 V 8.86 5.24 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 0.00 0.00 -0.13 0.00 0.00 0.47 0.00 0.00 195 T 8.13 4.95 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 1.26 0.00 0.00 196 V 7.93 4.47 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.00 0.81 0.00 0.00 197 P 0.00 4.35 0.00 2.19 2.11 0.00 3.80 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 198 S 8.47 3.88 0.00 3.96 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 0.00 199 S 8.46 3.21 0.00 3.95 3.76 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 *204 Q 8.34 3.88 0.00 1.89 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.72 0.00 0.00 0.00 0.00 0.00 1.98 1.34 0.00 205 T 8.01 4.45 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 206 Y 8.32 5.41 0.00 3.06 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 0.00 207 I 10.11 5.20 1.89 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 1.34 0.88 0.80 0.00 0.00 208 C 7.93 3.85 0.00 1.50 1.18 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 0.00 209 N 9.28 4.83 0.00 2.56 2.68 0.00 0.00 6.26 7.56 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 0.00 210 V 8.38 4.63 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 0.77 0.00 0.00 0.75 0.00 0.00 211 N 8.65 4.95 0.00 2.80 2.53 0.00 0.00 6.52 7.17 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 0.00 212 H 9.30 4.83 0.00 3.03 3.21 0.00 5.69 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 0.00 213 K 8.18 3.78 0.00 1.80 1.85 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.47 7.81 214 P 0.00 4.16 0.00 1.74 2.11 0.00 3.34 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 215 S 7.85 4.66 0.00 4.10 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 0.00 216 N 7.88 4.21 0.00 2.85 3.01 0.00 0.00 6.99 7.58 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 0.00 217 T 7.89 4.48 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 218 K 8.48 4.91 0.00 1.77 1.64 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.48 7.81 219 V 9.08 4.43 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 0.86 0.00 0.00 0.87 0.00 0.00 220 D 8.64 5.32 0.00 2.50 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 0.00 221 K 8.03 4.44 0.00 1.74 1.55 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.51 7.81 222 K 8.82 4.35 0.00 1.83 1.75 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.70 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.49 7.81 223 V 8.46 4.63 2.36 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 1.04 0.00 0.00 1.42 0.00 0.00 224 E 8.77 4.34 0.00 1.98 1.80 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 2.27 2.35 0.00 * Residues marked with a * may have inaccurate shift predictions.