NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4840 8.1633 120.2678 54.6072 34.9868 174.5594 2 N 5.3005 8.0316 115.2192 49.5801 42.1103 172.0514 3 S 4.6067 8.9141 117.6123 57.0378 67.7587 172.3876 4 V 5.0607 8.1628 111.5839 59.9547 35.0542 175.3291 5 T 4.7947 8.9998 116.4136 60.5296 71.2924 172.4329 6 V 5.0376 8.4199 125.9705 60.3693 33.2434 173.7954 7 S 4.7602 8.8771 124.4551 58.3880 63.2994 174.3150 8 H 4.5655 9.3998 117.3287 55.0076 30.3517 172.8164 9 A 3.2102 7.9520 121.8023 52.5741 15.7164 175.6126 10 P 4.6246 0.0000 0.0000 62.9211 32.3885 175.3333 11 Y 4.3975 8.5428 118.2198 58.0080 36.0950 168.9172 12 T 5.1676 7.6328 113.6198 61.6760 72.2742 173.6901 13 I 4.4619 8.9858 127.0090 59.9033 39.6361 174.8019 14 T 4.9820 8.6066 124.3802 62.8316 70.0062 174.0047 15 Y 5.1138 8.3672 122.4698 55.6501 41.9621 174.0358 16 H 4.7036 9.9024 121.9174 55.8447 30.9452 175.6349 17 N 4.3029 8.5791 124.2264 57.5159 38.3855 176.8481 18 D 4.3809 8.4717 118.4450 56.7470 41.0914 177.9219 19 W 4.4408 8.8489 118.8309 57.7265 29.3197 177.9630 20 E 3.9024 8.3969 120.7058 58.9787 28.9398 177.1649 21 P 4.4319 0.0000 0.0000 64.2088 31.8555 177.0421 22 V 4.3010 7.8006 116.9182 61.7963 33.1788 177.8132 23 M 3.9010 7.8649 121.1766 57.9614 31.3497 178.3557 24 S 3.9973 7.8742 113.0771 61.5686 62.5923 176.1677 25 Q 3.5963 7.8167 120.1789 58.6025 28.3938 178.1639 26 L 4.0882 7.7051 121.0468 58.0918 42.0908 179.2101 27 V 3.5841 7.5970 117.8681 65.9947 31.1951 177.8381 28 E 3.9481 7.7149 118.0127 59.5838 28.7883 179.3964 29 F 4.8137 8.2894 118.1416 60.8307 38.9439 177.2370 30 Y 4.0882 8.5799 119.4036 60.9502 38.4973 177.4292 31 N 4.2235 8.1900 116.2535 56.2520 38.7571 176.4244 32 E 4.2780 7.8035 116.5271 57.2426 30.5731 177.2380 33 V 4.4266 6.9233 117.6490 60.4196 33.0499 177.2702 34 A 3.3775 7.5240 123.1793 54.5563 17.6276 179.3002 35 S 3.6734 7.3948 110.9530 61.3577 62.1352 176.0479 36 W 4.0225 7.0962 120.7716 59.4786 28.4404 178.5547 37 L 3.6534 7.3757 117.2410 57.3880 41.0904 178.0072 38 L 4.4997 7.3147 115.2753 54.8850 42.1035 177.9018 39 R 4.0246 7.5024 114.3862 57.9157 29.7410 176.4353 40 D 5.0682 7.6599 116.8669 51.8305 43.7565 175.5271 41 E 4.3251 8.6223 121.1022 57.0059 30.4501 176.1849 42 T 5.2192 8.5899 113.1152 59.9451 72.5245 172.9348 43 S 4.8389 8.7378 117.8512 56.1611 64.6762 172.4892 44 P 4.9305 0.0000 0.0000 61.3326 33.4547 175.4644 45 I 3.7436 8.0022 118.2248 60.8415 37.7854 175.3607 46 P 2.0000 0.0000 0.0000 65.2738 31.1104 178.0204 47 D 4.5346 7.7810 114.3986 55.7113 40.8830 176.6582 48 K 4.5168 8.1389 118.3242 55.6569 33.5343 177.6999 49 F 4.3463 7.7379 118.7003 60.2956 38.9883 176.3799 50 F 4.9066 7.9464 115.5723 56.6716 40.1295 176.8333 51 I 3.7785 7.8198 117.4109 63.9513 37.0195 177.2677 52 Q 4.2809 7.9916 120.0317 57.8066 29.0352 176.7406 53 L 3.5380 8.0371 119.0691 56.1571 41.5428 178.1486 54 K 4.4803 7.8912 117.9310 56.7391 32.5310 176.9500 55 Q 4.3145 7.6407 119.4260 54.5728 29.3113 174.4071 56 P 4.1943 0.0000 0.0000 62.9653 32.1138 175.9162 57 L 4.3309 8.8212 120.4419 55.8308 43.3071 179.4108 58 R 3.8558 8.1252 116.6846 58.5392 30.1566 176.8552 59 N 4.7813 8.0339 113.7482 52.2182 37.6495 173.8104 60 K 4.7356 7.9304 118.8969 55.3362 33.7448 176.3430 61 R 4.6168 8.9558 118.1550 55.6068 32.0871 175.2195 62 V 4.8383 7.6166 119.8301 61.2503 35.0240 173.2026 63 C 5.1277 9.1814 128.6909 57.8186 33.6911 172.1467 64 V 4.7843 8.4503 126.2187 61.3469 33.4753 173.7620 65 C 5.5158 9.2332 128.5087 57.7410 34.5712 173.0972 66 G 4.4164 9.1326 113.3586 44.3815 0.0000 174.1013 67 I 3.9216 8.4661 120.8273 63.8716 39.1535 174.7849 68 D 4.9512 7.2953 117.9413 52.3433 42.1002 173.0374 69 P 4.2060 0.0000 0.0000 62.0355 31.9470 176.2643 70 Y 4.3205 8.1602 118.4626 58.0455 38.4596 176.1987 71 P 4.3412 0.0000 0.0000 65.3416 31.4219 176.2737 72 K 4.7953 7.3177 114.9353 55.6295 35.8455 175.2126 73 D 4.5582 9.0454 118.9216 55.0699 37.9840 174.6519 74 G 3.8566 8.0859 108.4289 46.3094 0.0000 174.3640 75 T 4.3189 8.5289 112.0581 60.9668 70.1640 175.0153 76 G 3.9752 8.4554 109.6270 44.1418 0.0000 173.5804 77 V 4.1535 7.6417 120.2385 60.2607 32.4002 173.4255 78 P 4.1428 0.0000 0.0000 63.8827 31.5894 177.1388 79 F 3.9102 8.0112 118.3640 57.7467 37.4287 174.9236 80 E 4.1724 8.0858 122.1297 56.0711 29.7554 176.0701 81 S 4.5670 8.6572 120.2482 55.5331 63.5240 171.8535 82 P 4.2708 0.0000 0.0000 65.4388 31.1600 177.3802 83 N 4.6462 8.2294 111.5997 51.8290 38.1217 174.4199 84 F 4.0119 8.1228 120.1616 60.4396 37.9248 174.7971 85 T 4.3006 8.0204 113.2591 62.0516 69.9006 174.4975 86 K 4.0153 7.5561 121.7628 55.4153 33.1953 177.4019 87 K 3.8201 8.7225 124.1385 59.7989 31.9654 179.2359 88 S 4.2055 8.2011 114.6017 61.9331 62.8652 176.6096 89 I 3.9921 8.0190 120.4814 63.8884 37.8089 177.9506 90 K 3.9443 7.8466 119.2872 59.3221 31.8361 179.1983 91 E 4.0187 8.5645 119.2893 59.2041 29.3094 179.2312 92 I 3.5057 8.1518 120.0835 64.4064 37.1402 178.0768 93 A 3.1360 8.0978 121.6084 55.2442 18.1466 179.8838 94 S 4.2335 8.1941 113.4383 61.8263 62.9607 176.8612 95 S 4.0605 8.0916 115.7917 61.5250 62.0503 176.3461 96 I 3.6445 7.8461 122.8264 64.1469 36.6813 178.3727 97 S 4.3672 8.4532 114.6295 61.6039 62.0522 176.4862 98 R 4.0226 7.9044 119.7626 58.7036 29.8227 178.5537 99 L 4.1274 7.5774 119.6486 58.0341 42.2626 178.2730 100 T 4.4011 8.1995 108.0095 61.8932 69.6468 175.9106 101 G 3.8893 8.3464 109.2414 44.8510 0.0000 173.4594 102 V 3.5720 7.1259 117.9633 62.9503 30.5792 175.5118 103 I 4.1373 8.0271 121.1323 59.7713 39.2372 172.5692 104 D 4.1249 8.5339 125.0127 54.8576 38.0876 172.7750 105 Y 4.7882 7.3643 119.1982 56.3811 40.0704 174.0213 106 K 4.4236 9.0896 119.5920 57.1866 34.4752 176.1152 107 G 3.0544 7.5142 105.2368 45.6903 0.0000 171.3252 108 Y 4.9985 7.9576 119.7028 55.9884 41.8888 173.8360 109 N 4.9154 8.3431 124.4449 51.8670 41.6378 174.9395 110 L 4.1255 8.9676 126.4734 56.6990 41.9857 177.2582 111 N 4.7575 8.2472 116.5644 53.5774 38.9799 174.8594 112 I 4.4401 7.5100 108.7073 61.0234 38.3534 174.6102 113 I 4.4055 7.3449 122.2563 59.6616 38.4390 174.8985 114 D 4.4600 8.4759 126.5899 55.7774 41.2296 177.1789 115 G 4.0066 9.0503 111.9989 43.8394 0.0000 172.3535 116 V 4.7534 7.1171 119.2536 61.0045 33.4058 174.7301 117 I 4.6222 8.6905 128.7905 58.4397 39.8596 172.7624 118 P 5.0881 0.0000 0.0000 62.8105 32.3790 175.5994 119 W 5.3150 9.8346 131.5199 56.0871 34.6967 172.9688 120 N 4.9852 7.4099 123.3071 51.7137 39.2326 174.0150 121 Y 4.3105 9.0669 126.6897 60.9042 39.1774 175.6661 122 Y 4.3721 8.0101 117.3559 55.9937 39.4607 176.1928 123 L 3.5535 5.7768 122.2023 54.7375 41.9770 175.8951 124 S 4.9735 6.6395 112.1811 57.9251 65.9169 173.1593 125 C 4.7823 8.8948 114.0211 56.2038 33.4506 173.5668 126 K 4.3964 8.4953 120.2300 56.2884 32.7747 175.8866 127 L 4.0334 8.7592 127.2939 57.5447 41.8654 177.1321 128 G 3.9001 9.7331 114.8646 45.2880 0.0000 172.5226 129 E 4.4819 8.4591 119.2506 54.1579 31.4194 175.2514 130 T 4.0002 8.3575 121.0531 64.7032 68.9947 174.8955 131 K 3.9692 9.5121 124.4196 57.3285 30.0137 176.9777 132 S 4.3362 7.5793 111.6451 59.7091 63.5257 174.3508 133 H 5.0111 7.8235 117.7299 55.5985 29.8246 175.4125 134 A 2.5800 7.7023 123.4798 54.9990 17.8329 180.4277 135 I 3.4423 6.9933 114.5562 63.7290 38.0105 177.0542 136 Y 4.3095 6.9916 116.4402 60.4353 38.4199 177.3730 137 W 4.3814 8.6077 119.4985 59.6320 28.9957 179.6150 138 D 4.3672 7.9380 117.9134 56.4907 41.5780 178.5865 139 K 3.9623 7.8355 118.2761 59.0368 32.2156 179.4189 140 I 4.0149 7.6903 119.6985 64.4634 37.1218 178.3482 141 S 3.9365 8.6654 116.4637 61.3596 62.6069 176.6136 142 K 4.1784 7.7931 122.1133 59.5372 31.8816 178.1867 143 L 4.0940 8.1784 120.5696 58.5406 41.9728 179.1163 144 L 4.2822 8.5151 119.0311 57.8539 41.6361 179.3024 145 L 3.8611 8.1011 120.1733 58.1330 41.8106 179.0064 146 Q 4.2212 8.1207 118.8013 58.5581 28.7650 177.9184 147 H 4.2759 8.1675 119.2501 59.2523 29.9219 177.3011 148 I 3.4073 7.7665 121.9612 64.4440 36.8157 178.0091 149 T 4.0894 7.9784 108.9819 63.2219 68.6452 176.3552 150 K 4.0093 7.6097 121.0342 58.4696 32.1337 177.0540 151 H 4.5539 7.7391 115.3247 56.9883 30.2445 175.8713 152 V 4.1330 7.3740 110.4267 61.1096 32.4502 175.9983 153 S 4.5152 8.6205 118.0020 59.8821 64.5356 174.5258 154 V 4.6466 7.6301 119.1009 60.8545 34.9270 173.8326 155 L 4.9512 9.2213 130.3855 53.6236 44.1959 174.2009 156 Y 5.2933 9.5847 129.2243 56.4269 40.4904 173.8852 157 C 4.4631 9.1957 125.6008 58.1386 30.4702 173.0207 158 L 4.6544 8.0517 123.0144 54.4913 43.4456 175.9550 159 G 4.0559 9.3541 114.7755 45.0365 0.0000 174.2148 160 K 3.9672 8.4795 127.2045 58.9478 32.4940 179.1581 161 T 4.1212 7.8399 107.9711 64.3237 69.4616 175.6267 162 D 4.2200 8.1939 120.8164 56.3696 40.9083 176.4388 163 F 4.5930 7.9370 115.6910 55.3650 41.3211 174.8832 *166 I 3.9602 7.8403 121.2990 60.7971 38.6022 176.6499 167 R 4.1730 8.4184 122.7763 58.2065 29.2415 178.9108 168 A 3.9503 7.8563 121.3435 55.1481 18.6296 178.8162 169 K 4.0010 7.3470 114.7206 59.7981 32.3135 178.7214 170 L 4.2667 7.9365 117.0918 55.8033 42.3294 176.2951 171 E 3.7773 7.8648 117.4664 57.5534 27.1828 173.2820 172 S 4.8268 7.4559 111.1415 55.6680 66.5746 172.7446 173 P 4.5085 0.0000 0.0000 63.2611 31.2971 176.5681 174 V 3.7529 7.4031 119.4634 63.3013 32.5744 175.6573 175 T 4.0798 8.4226 124.4582 64.0861 69.2168 173.4368 176 T 5.0108 8.4754 123.9213 61.9816 70.4364 174.1967 177 I 4.4746 9.1051 127.8491 59.4902 39.8037 174.8132 178 V 4.7330 8.7874 126.8779 61.4346 33.2267 174.5969 179 G 3.6304 8.8916 115.7302 43.8089 0.0000 171.1556 180 Y 4.4732 7.7189 116.9762 57.8453 38.7697 176.4547 181 H 4.2953 8.9068 121.7557 55.3941 30.7630 174.4156 182 P 4.4214 0.0000 0.0000 65.7568 31.2582 176.7374 183 A 4.5123 8.2313 117.7674 51.7254 18.8325 176.8636 184 A 4.2843 8.1319 121.3039 53.4983 18.8885 179.6501 185 R 4.1700 8.3293 119.5925 55.4947 28.6169 176.3337 *188 Q 4.2574 8.1691 119.6015 55.1719 30.9466 174.7157 189 F 4.4483 8.5732 116.2993 57.8597 38.6379 174.3518 190 E 4.3891 7.9232 119.2299 57.4289 30.7510 177.6851 191 K 3.9205 8.2007 117.2378 59.7184 32.0702 177.5428 192 D 4.5899 7.9447 114.5328 54.8506 41.1312 176.3371 193 R 4.2302 7.6248 121.0990 56.3883 30.6128 176.7310 194 S 4.6886 9.0271 119.7973 58.7725 63.2916 176.1015 195 F 3.8926 8.6857 122.0495 60.3486 38.3955 176.6409 196 E 3.3999 7.9110 117.5495 59.2332 29.4114 178.3626 197 I 3.8078 7.5049 117.0424 63.6332 38.5627 176.9762 198 I 4.0499 7.6772 112.3004 61.4441 37.8665 176.9376 199 N 4.1490 7.6826 120.2444 57.4102 38.7330 176.6948 200 V 3.7317 7.9362 118.4502 65.7680 31.4102 177.7931 201 L 4.0514 7.7970 118.5963 57.5783 41.2630 179.1336 202 L 4.1751 7.7946 118.3740 57.3444 41.6125 178.8880 203 E 4.0815 8.1355 118.7538 59.5727 29.4029 179.2719 204 L 4.2823 7.8219 121.2670 57.4186 41.8210 178.3705 205 D 4.6624 7.2819 115.2317 54.9568 40.4925 174.8855 206 N 4.5813 7.4333 120.4249 52.9618 43.3597 174.7372 207 K 4.5541 10.3858 117.0227 53.3114 35.1447 175.3175 208 A 4.0510 8.2054 123.2442 51.3862 18.7712 175.8961 209 P 4.4730 0.0000 0.0000 62.5601 32.2570 175.6028 210 I 3.8502 7.7201 119.4298 60.0108 38.2917 176.3111 211 N 4.6021 7.9753 123.8124 51.7252 37.4936 175.1860 212 W 4.4028 8.3383 124.4697 58.7916 29.8599 178.5207 213 A 4.5207 8.1149 120.1535 54.8629 17.9924 179.3909 214 Q 4.1590 7.9120 114.1959 58.4593 29.0641 178.2103 215 G 2.7404 7.6050 106.8845 47.9282 0.0000 173.7684 216 F 4.5857 7.4402 119.3184 57.5196 39.6224 174.9428 217 I 4.2445 8.6922 124.4428 59.8601 39.1877 175.5355 218 Y 4.5084 8.4766 123.3440 58.1037 37.7458 175.7056 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 1 M 8.16 4.48 0.00 1.87 2.16 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.51 0.00 2 N 8.03 5.30 0.00 2.58 2.58 0.00 0.00 6.68 6.68 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 3 S 8.91 4.61 0.00 3.72 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 4 V 8.16 5.06 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 0.70 0.00 0.00 0.93 0.00 0.00 5 T 9.00 4.79 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 6 V 8.42 5.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.97 0.00 0.00 7 S 8.88 4.76 0.00 4.22 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 8 H 9.40 4.57 0.00 3.38 3.18 0.00 5.90 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.95 3.21 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.62 0.00 2.27 2.32 0.00 3.96 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.28 0.00 11 Y 8.54 4.40 0.00 3.23 3.31 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 12 T 7.63 5.17 4.31 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 1.25 0.00 0.00 13 I 8.99 4.46 1.71 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.61 0.59 0.00 0.00 14 T 8.61 4.98 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 1.19 0.00 0.00 15 Y 8.37 5.11 0.00 3.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 H 9.90 4.70 0.00 3.59 3.62 0.00 5.82 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.58 4.30 0.00 2.96 2.85 0.00 0.00 7.15 8.58 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 18 D 8.47 4.38 0.00 2.48 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 0.00 0.00 0.00 0.00 19 W 8.85 4.44 0.00 3.69 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 20 E 8.40 3.90 0.00 2.37 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 0.00 2.41 2.50 0.00 21 P 0.00 4.43 0.00 2.08 2.12 0.00 3.80 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 22 V 7.80 4.30 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 0.93 0.00 0.00 0.99 0.00 0.00 23 M 7.86 3.90 0.00 1.60 1.78 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.27 0.00 24 S 7.87 4.00 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 25 Q 7.82 3.60 0.00 2.14 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.67 0.00 0.00 0.00 0.00 0.00 2.15 2.26 0.00 26 L 7.71 4.09 0.00 1.82 1.73 1.13 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.60 3.58 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 1.05 0.00 0.00 0.96 0.00 0.00 28 E 7.71 3.95 0.00 1.91 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 2.28 2.40 0.00 29 F 8.29 4.81 0.00 3.12 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 30 Y 8.58 4.09 0.00 3.26 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 31 N 8.19 4.22 0.00 3.04 2.92 0.00 0.00 7.13 7.16 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 32 E 7.80 4.28 0.00 2.15 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 2.62 2.38 0.00 33 V 6.92 4.43 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 0.46 0.00 0.00 1.03 0.00 0.00 34 A 7.52 3.38 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 7.39 3.67 0.00 3.38 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 36 W 7.10 4.02 0.00 2.10 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 0.00 0.00 0.00 37 L 7.38 3.65 0.00 1.43 1.66 0.27 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.31 4.50 0.00 1.64 1.66 1.13 1.24 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 39 R 7.50 4.02 0.00 1.92 2.11 0.00 3.07 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.64 0.00 40 D 7.66 5.07 0.00 2.78 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 41 E 8.62 4.33 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.34 0.00 42 T 8.59 5.22 4.59 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 1.57 0.00 0.00 43 S 8.74 4.84 0.00 3.97 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 44 P 0.00 4.93 0.00 2.23 2.07 0.00 4.13 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 2.17 1.99 0.00 45 I 8.00 3.74 1.81 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 1.37 0.51 0.83 0.00 0.00 46 P 0.00 2.00 0.00 1.90 1.75 0.00 3.40 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 1.98 1.89 0.00 47 D 7.78 4.53 0.00 2.60 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 48 K 8.14 4.52 0.00 1.77 1.87 0.00 1.92 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.30 1.48 7.81 49 F 7.74 4.35 0.00 2.76 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 0.00 0.00 0.00 50 F 7.95 4.91 0.00 3.04 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 51 I 7.82 3.78 1.91 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 1.69 0.61 0.94 0.00 0.00 52 Q 7.99 4.28 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.02 0.00 0.00 0.00 0.00 0.00 2.69 2.92 0.00 53 L 8.04 3.54 0.00 1.66 1.14 0.67 -0.53 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 54 K 7.89 4.48 0.00 1.96 1.95 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.53 1.65 7.81 55 Q 7.64 4.31 0.00 2.51 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.85 0.00 0.00 0.00 0.00 0.00 2.54 2.63 0.00 56 P 0.00 4.19 0.00 2.15 1.81 0.00 3.65 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.93 0.00 57 L 8.82 4.33 0.00 0.95 0.98 -0.54 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 58 R 8.13 3.86 0.00 1.75 1.97 0.00 3.18 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 59 N 8.03 4.78 0.00 2.82 2.98 0.00 0.00 6.20 6.53 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 60 K 7.93 4.74 0.00 1.75 1.72 0.00 1.63 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.42 1.46 7.81 61 R 8.96 4.62 0.00 1.75 2.07 0.00 2.66 0.00 0.00 3.03 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.64 0.00 62 V 7.62 4.84 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 1.30 0.00 0.00 1.06 0.00 0.00 63 C 9.18 5.13 0.00 3.01 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 64 V 8.45 4.78 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 0.51 0.00 0.00 1.22 0.00 0.00 65 C 9.23 5.52 0.00 3.02 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 66 G 9.13 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 0.00 0.00 0.00 0.00 67 I 8.47 3.92 1.54 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.09 0.94 0.00 0.00 68 D 7.30 4.95 0.00 2.65 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 69 P 0.00 4.21 0.00 2.01 1.90 0.00 3.61 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 2.05 1.85 0.00 70 Y 8.16 4.32 0.00 2.96 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 71 P 0.00 4.34 0.00 2.24 2.36 0.00 3.85 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 72 K 7.32 4.80 0.00 1.71 1.70 0.00 1.86 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.35 1.45 7.81 73 D 9.05 4.56 0.00 2.82 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 74 G 8.09 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 75 T 8.53 4.32 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 1.37 0.00 0.00 76 G 8.46 3.98 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 0.00 0.00 0.00 77 V 7.64 4.15 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 1.05 0.00 0.00 1.00 0.00 0.00 78 P 0.00 4.14 0.00 2.22 1.83 0.00 3.90 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.80 0.00 79 F 8.01 3.91 0.00 3.29 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 80 E 8.09 4.17 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 81 S 8.66 4.57 0.00 3.74 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 82 P 0.00 4.27 0.00 2.12 2.16 0.00 3.76 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 2.08 2.15 0.00 83 N 8.23 4.65 0.00 2.87 2.95 0.00 0.00 6.03 7.43 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 84 F 8.12 4.01 0.00 3.06 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 85 T 8.02 4.30 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 86 K 7.56 4.02 0.00 1.39 1.10 0.00 1.02 0.00 0.00 1.46 0.00 0.00 2.69 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.00 0.21 7.81 87 K 8.72 3.82 0.00 1.77 1.90 0.00 1.67 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.49 7.81 88 S 8.20 4.21 0.00 4.27 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 89 I 8.02 3.99 2.42 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 2.07 1.95 1.11 0.00 0.00 90 K 7.85 3.94 0.00 1.85 1.65 0.00 1.34 0.00 0.00 1.40 0.00 0.00 2.75 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 0.95 7.81 91 E 8.56 4.02 0.00 2.12 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 2.49 2.65 0.00 92 I 8.15 3.51 1.98 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 1.27 0.71 0.59 0.00 0.00 93 A 8.10 3.14 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 0.00 0.00 0.00 0.00 0.00 0.00 94 S 8.19 4.23 0.00 4.10 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 95 S 8.09 4.06 0.00 3.84 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 96 I 7.85 3.64 1.39 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.03 0.96 0.00 0.00 97 S 8.45 4.37 0.00 4.17 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 98 R 7.90 4.02 0.00 2.00 2.00 0.00 3.23 0.00 0.00 3.18 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 99 L 7.58 4.13 0.00 1.84 1.86 0.83 1.18 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 0.00 100 T 8.20 4.40 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 1.50 0.00 0.00 101 G 8.35 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 7.13 3.57 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 0.53 0.00 0.00 1.02 0.00 0.00 103 I 8.03 4.14 1.88 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 1.43 0.76 0.95 0.00 0.00 104 D 8.53 4.12 0.00 2.87 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 0.00 105 Y 7.36 4.79 0.00 2.99 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 0.00 106 K 9.09 4.42 0.00 1.69 1.89 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.77 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.40 1.52 7.81 107 G 7.51 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 0.00 0.00 0.00 108 Y 7.96 5.00 0.00 2.68 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 0.00 109 N 8.34 4.92 0.00 2.62 2.44 0.00 0.00 7.03 6.70 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 0.00 110 L 8.97 4.13 0.00 1.77 1.79 0.38 1.30 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 0.00 111 N 8.25 4.76 0.00 2.76 2.93 0.00 0.00 6.93 8.02 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 0.00 112 I 7.51 4.44 1.82 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.81 0.88 0.00 0.00 113 I 7.34 4.41 1.75 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.86 0.73 0.00 0.00 114 D 8.48 4.46 0.00 2.60 2.55 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 0.00 115 G 9.05 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 0.00 116 V 7.12 4.75 2.16 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 0.91 0.00 0.00 0.60 0.00 0.00 117 I 8.69 4.62 1.94 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.96 0.00 0.00 118 P 0.00 5.09 0.00 2.60 2.23 0.00 3.94 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.09 0.00 119 W 9.83 5.31 0.00 3.45 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 0.00 120 N 7.41 4.99 0.00 1.98 2.45 0.00 0.00 6.93 7.46 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 0.00 121 Y 9.07 4.31 0.00 2.99 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 0.00 122 Y 8.01 4.37 0.00 2.80 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 0.00 123 L 5.78 3.55 0.00 0.27 0.39 0.27 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 124 S 6.64 4.97 0.00 4.11 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 C 8.89 4.78 0.00 3.15 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 0.00 126 K 8.50 4.40 0.00 1.72 1.81 0.00 1.90 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.68 1.31 7.81 127 L 8.76 4.03 0.00 1.63 1.68 0.99 1.19 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 0.00 128 G 9.73 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.46 4.48 0.00 2.08 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 0.00 2.21 2.25 0.00 130 T 8.36 4.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 131 K 9.51 3.97 0.00 1.85 1.91 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.39 7.81 132 S 7.58 4.34 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 0.00 133 H 7.82 5.01 0.00 3.59 3.52 0.00 5.65 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 0.00 134 A 7.70 2.58 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 I 6.99 3.44 1.48 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 1.20 0.40 -0.15 0.00 0.00 136 Y 6.99 4.31 0.00 2.73 2.55 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 0.00 137 W 8.61 4.38 0.00 3.53 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 0.00 138 D 7.94 4.37 0.00 2.83 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 0.00 139 K 7.84 3.96 0.00 1.15 0.88 0.00 1.50 0.00 0.00 1.13 0.00 0.00 2.88 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.30 1.29 7.81 140 I 7.69 4.01 2.48 0.00 0.00 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 2.07 0.96 1.38 0.00 0.00 141 S 8.67 3.94 0.00 3.79 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 0.00 142 K 7.79 4.18 0.00 1.92 2.07 0.00 1.74 0.00 0.00 1.65 0.00 0.00 3.18 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.71 1.59 7.81 143 L 8.18 4.09 0.00 2.14 2.15 1.10 0.76 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 0.00 144 L 8.52 4.28 0.00 2.06 2.07 1.25 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 145 L 8.10 3.86 0.00 2.13 1.91 0.91 1.08 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 0.00 146 Q 8.12 4.22 0.00 2.40 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.74 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 147 H 8.17 4.28 0.00 3.35 3.49 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 I 7.77 3.41 1.73 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.18 0.71 0.00 0.00 149 T 7.98 4.09 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 1.22 0.00 0.00 150 K 7.61 4.01 0.00 1.59 1.68 0.00 1.61 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.58 7.81 151 H 7.74 4.55 0.00 3.06 3.31 0.00 5.65 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 V 7.37 4.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.98 0.00 0.00 153 S 8.62 4.52 0.00 3.76 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 0.00 154 V 7.63 4.65 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.93 0.00 0.00 155 L 9.22 4.95 0.00 1.74 1.50 0.90 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 156 Y 9.58 5.29 0.00 2.99 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 0.00 157 C 9.20 4.46 0.00 2.46 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 0.00 158 L 8.05 4.65 0.00 1.41 1.48 0.09 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 159 G 9.35 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 0.00 160 K 8.48 3.97 0.00 1.60 1.73 0.00 1.05 0.00 0.00 1.41 0.00 0.00 2.32 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 0.80 7.81 161 T 7.84 4.12 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 0.00 162 D 8.19 4.22 0.00 2.62 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 0.00 163 F 7.94 4.59 0.00 3.05 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 *166 I 7.84 3.96 1.87 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 1.48 1.57 0.97 0.00 0.00 167 R 8.42 4.17 0.00 2.05 2.17 0.00 3.18 0.00 0.00 3.35 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 168 A 7.86 3.95 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 0.00 169 K 7.35 4.00 0.00 2.07 2.01 0.00 1.63 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.50 7.81 170 L 7.94 4.27 0.00 1.82 1.87 0.96 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 171 E 7.86 3.78 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 172 S 7.46 4.83 0.00 3.91 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 0.00 173 P 0.00 4.51 0.00 2.18 2.18 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 1.96 1.93 0.00 174 V 7.40 3.75 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 0.84 0.00 0.00 0.91 0.00 0.00 175 T 8.42 4.08 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 1.18 0.00 0.00 176 T 8.48 5.01 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 177 I 9.11 4.47 2.02 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.61 1.17 0.00 0.00 178 V 8.79 4.73 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.95 0.00 0.00 179 G 8.89 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 0.00 180 Y 7.72 4.47 0.00 2.74 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 0.00 181 H 8.91 4.30 0.00 3.27 3.22 0.00 5.90 0.00 0.00 0.00 0.00 6.78 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 4.42 0.00 2.11 2.16 0.00 3.33 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 2.05 2.09 0.00 183 A 8.23 4.51 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 0.00 184 A 8.13 4.28 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 0.00 185 R 8.33 4.17 0.00 1.86 1.85 0.00 3.25 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 1.65 1.70 0.00 *188 Q 8.17 4.26 0.00 1.98 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 5.52 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 189 F 8.57 4.45 0.00 2.62 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 0.00 190 E 7.92 4.39 0.00 2.14 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 191 K 8.20 3.92 0.00 1.78 1.87 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.48 7.81 192 D 7.94 4.59 0.00 2.70 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 0.00 193 R 7.62 4.23 0.00 2.00 1.96 0.00 2.21 0.00 0.00 2.97 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.19 0.00 194 S 9.03 4.69 0.00 3.98 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 0.00 195 F 8.69 3.89 0.00 2.68 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 0.00 196 E 7.91 3.40 0.00 1.69 1.69 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 1.69 1.47 0.00 197 I 7.50 3.81 1.83 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 1.70 0.93 0.98 0.00 0.00 198 I 7.68 4.05 1.78 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.35 0.86 0.00 0.00 199 N 7.68 4.15 0.00 2.97 3.17 0.00 0.00 6.69 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 0.00 200 V 7.94 3.73 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 1.06 0.00 0.00 1.10 0.00 0.00 201 L 7.80 4.05 0.00 1.87 1.68 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 202 L 7.79 4.18 0.00 1.79 1.70 0.85 0.68 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 0.00 203 E 8.14 4.08 0.00 2.17 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.48 0.00 204 L 7.82 4.28 0.00 1.73 1.66 0.92 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 205 D 7.28 4.66 0.00 2.91 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 0.00 206 N 7.43 4.58 0.00 2.70 2.83 0.00 0.00 6.70 8.40 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 0.00 207 K 10.39 4.55 0.00 1.75 1.69 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.46 7.81 208 A 8.21 4.05 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 0.00 209 P 0.00 4.47 0.00 2.16 2.08 0.00 3.73 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 1.95 1.97 0.00 210 I 7.72 3.85 0.74 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.33 -0.63 0.00 0.00 211 N 7.98 4.60 0.00 2.73 2.63 0.00 0.00 7.22 7.95 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 0.00 212 W 8.34 4.40 0.00 3.51 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 0.00 213 A 8.11 4.52 1.63 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 0.00 214 Q 7.91 4.16 0.00 2.14 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.97 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 215 G 7.61 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 0.00 0.00 0.00 216 F 7.44 4.59 0.00 2.74 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 0.00 217 I 8.69 4.24 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.07 0.89 0.00 0.00 218 Y 8.48 4.51 0.00 2.90 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 * Residues marked with a * may have inaccurate shift predictions.