NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.3055 8.3144 119.9991 56.7340 33.5826 174.1220 3 E 4.4525 8.6479 118.0307 54.9116 33.0841 173.3987 4 G 3.9081 9.9399 108.5510 44.8749 0.0000 172.2509 5 K 4.5714 8.5894 115.4304 55.8218 36.9987 174.1681 6 H 5.3518 8.5947 121.5230 54.6636 32.6134 172.2825 7 F 4.9905 9.7837 125.1221 55.8283 41.5443 174.9454 8 V 4.3344 8.7519 123.6059 61.1594 33.6825 174.0654 9 L 4.1748 8.1948 128.6544 52.8288 43.6140 175.8651 10 V 4.4599 8.1532 123.7862 60.9535 34.0375 174.7398 11 H 4.7599 9.3577 124.4277 56.3021 29.3976 173.1741 12 G 4.6125 8.3931 104.5397 44.1690 0.0000 172.5651 13 A 4.3693 8.9064 122.0742 54.0269 18.9621 177.7861 14 C 4.6435 8.9266 116.3357 60.7035 26.0034 172.5706 15 H 5.5115 7.8664 117.4858 54.9917 31.4531 171.3930 16 G 3.7466 6.9971 106.8660 45.6634 0.0000 173.7200 17 G 3.9861 9.9634 107.6336 47.4861 0.0000 176.0943 18 W 4.4025 8.3953 117.3330 59.4620 28.1980 177.9603 19 S 3.7271 6.1359 113.0269 60.7532 61.7258 175.3198 20 W 4.7065 8.2423 118.8733 56.7098 28.7421 177.6584 21 Y 4.3264 8.6965 120.6478 59.6497 37.2534 177.6297 22 K 4.0954 7.4185 118.1839 57.0375 33.1800 177.6326 23 L 4.1953 7.6361 120.2712 57.1169 42.4430 177.8296 24 K 3.7698 8.2797 120.0347 59.5331 32.0648 176.7390 25 P 4.2850 0.0000 0.0000 65.4010 30.9695 178.6937 26 L 3.9402 7.7091 116.5597 57.7822 42.0256 178.7762 27 L 4.0157 7.7122 118.8090 58.1044 41.5779 179.6500 28 E 4.2732 8.6194 119.3470 58.7551 29.1353 179.1938 29 A 4.2194 7.9362 119.7104 54.4324 18.4644 178.5367 30 A 4.3398 7.7413 117.4035 52.1814 19.2427 177.7145 31 G 3.8330 8.5185 105.8909 45.9325 0.0000 173.0909 32 H 5.2682 8.0817 114.7540 53.5008 32.7725 173.2185 33 K 4.6102 9.4022 122.0559 55.5535 33.7878 175.5551 34 V 5.0334 8.2310 124.7427 61.6357 35.2932 175.0087 35 T 4.3975 8.5662 121.6225 61.8875 71.8796 173.0740 36 A 4.8044 8.3697 131.7112 49.9329 17.3290 176.1748 37 L 4.1071 7.9232 121.2641 55.5365 41.9876 178.2219 38 D 4.8709 8.4447 119.6296 52.0237 41.4583 176.0733 39 L 4.0058 8.4241 124.1585 53.8994 42.3834 176.8996 40 A 4.2512 7.9846 122.5581 53.8489 18.6165 177.3256 41 A 4.6595 8.9813 121.0843 52.2738 16.5272 177.4098 42 S 4.9570 7.7211 113.4422 58.7180 67.8990 177.0756 43 G 4.2276 9.3535 114.2964 47.2501 0.0000 174.5414 44 T 4.4510 7.0932 111.5550 60.8391 69.8201 174.5333 45 D 4.3942 8.3481 123.4440 54.8034 41.3345 176.0985 46 L 4.2751 8.5120 125.2654 55.7361 42.1673 177.3039 47 R 4.2676 7.9349 120.0874 55.6783 30.9478 176.3888 48 K 4.5205 8.7149 121.3116 55.6640 33.2906 178.0585 49 I 3.6460 8.0893 121.5598 64.0981 38.0485 177.4709 50 E 3.7786 7.7981 117.2445 57.6291 29.2720 176.9858 51 E 4.3402 7.9147 117.9170 56.6950 30.2044 176.0312 52 L 4.6314 7.8479 119.8970 53.7860 41.9688 176.6259 53 R 4.5444 8.9986 123.5157 57.2643 30.7334 176.8441 54 T 4.9336 7.6460 107.2752 59.0348 73.2573 174.1129 55 L 2.8460 8.3071 122.6603 57.9020 41.5965 178.5306 56 Y 3.8934 7.8384 118.5219 60.7255 38.6721 176.9175 57 D 4.5850 8.0767 120.0261 57.7094 41.0212 178.3417 58 Y 4.3897 7.7401 119.3800 60.6399 38.4917 176.9016 59 T 3.9985 7.3944 114.7844 63.1918 68.3158 176.1163 60 L 3.4797 7.0065 123.4314 57.7064 42.3351 176.3992 61 P 4.4486 0.0000 0.0000 65.7258 31.3441 179.5358 62 L 3.9329 6.9143 115.6178 55.7009 41.3871 177.4757 *64 E 4.3854 8.1848 118.1750 55.9185 31.3582 177.5819 65 L 4.0395 7.6519 119.0312 55.2758 41.3040 177.9981 *67 E 4.0504 8.1736 119.1223 55.4050 31.1200 176.1321 68 S 4.5898 8.0452 113.4479 58.2026 62.9144 173.8248 69 L 4.3165 7.3042 120.5863 53.7380 42.5761 176.9840 70 S 4.3328 8.2906 117.8857 57.8309 63.6689 174.9941 71 A 3.9973 8.6232 125.0229 54.9180 17.9753 178.3812 72 D 4.8454 7.9560 112.3810 53.0218 39.7815 176.1593 73 E 4.2971 7.7853 122.7749 55.1841 28.3294 175.4608 74 K 4.3167 7.7550 124.1728 55.7003 33.9050 175.5965 75 V 4.4931 7.5999 112.4175 60.5771 36.9437 173.8829 76 I 4.5545 8.1948 123.3965 59.5869 39.1572 175.1550 77 L 4.5132 8.0155 127.6582 54.1437 43.3631 176.6112 78 V 4.4984 8.4503 122.7262 61.2513 34.3857 173.8574 79 G 4.4245 8.9591 116.4279 44.7067 0.0000 170.4302 80 H 5.4630 8.8929 124.2423 55.3939 32.6083 174.1603 81 S 3.8121 8.7855 121.3116 59.3102 60.8264 172.1702 82 L 4.7719 9.3344 124.9476 56.0056 43.0677 177.2254 83 G 3.9762 8.4670 107.7524 48.7584 0.0000 176.4384 84 G 4.5280 7.7727 106.8036 45.9592 0.0000 175.2590 *86 N 4.6541 8.3302 118.7531 53.0021 40.4615 176.7573 87 L 3.9546 8.1239 116.7026 57.8961 41.9769 178.8168 88 G 3.8399 8.0043 106.5493 48.8094 0.0000 174.4436 89 L 4.4172 8.5378 120.2405 57.6298 41.8150 180.8965 90 A 4.4860 7.8735 118.8786 52.6342 17.5994 178.8051 *92 E 4.4361 8.2376 121.8802 57.7500 31.4596 177.1438 93 K 3.9575 8.0403 116.6264 58.5168 33.1788 177.0296 94 Y 4.8609 8.0613 114.8574 55.7345 38.0183 174.4416 95 P 4.2407 0.0000 0.0000 65.9642 31.8034 178.9848 96 Q 4.1308 7.9884 114.2361 57.2547 28.8853 176.2073 97 K 4.3437 7.9592 118.7219 56.1438 32.1124 175.7385 98 I 4.7675 7.0454 118.8142 59.6595 40.1942 175.4655 99 Y 4.4283 8.9660 123.4045 60.0919 37.8654 176.1535 100 A 4.4844 7.2499 119.7746 51.3891 22.0781 175.1317 101 A 4.5321 8.1164 123.8135 50.6051 21.0058 176.3167 102 V 4.5481 8.4009 123.0346 61.0747 34.3978 174.5207 103 F 4.9293 9.8055 128.2122 55.6546 40.3365 174.2285 104 L 4.4122 8.6830 127.1406 53.3564 42.8785 176.7543 105 A 3.9403 8.0483 133.6497 53.4290 16.5483 173.8388 106 A 4.7476 6.8681 122.5252 50.3008 23.2498 176.7603 107 F 4.9036 8.9881 117.9550 56.3523 41.6275 173.0704 *109 P 4.6397 0.0000 0.0000 63.7549 32.4016 174.2998 110 D 4.8553 8.4129 117.7130 53.5023 41.9328 174.5445 111 S 5.0505 8.5844 110.9877 57.6382 63.6222 175.6263 112 V 3.8805 8.1872 118.7551 65.8117 33.1064 175.2120 113 H 4.5236 8.0589 114.4939 54.0087 30.1439 174.4413 114 N 4.5667 8.3542 118.1275 53.6863 39.3177 175.7070 115 S 4.2691 8.1137 119.8458 61.4295 63.3525 175.7071 116 S 4.7951 8.0550 112.8100 58.2034 63.3917 175.5172 117 F 4.2826 8.6967 125.3559 61.9662 39.0851 177.2736 118 V 3.7867 8.1312 117.2236 66.2614 31.3769 177.8150 119 L 3.8266 7.9653 117.4723 56.8799 41.4182 179.1106 120 E 4.0289 7.9688 119.1427 59.0738 29.6568 178.7619 121 Q 3.7062 7.9826 118.2663 59.1110 28.6556 177.7995 122 Y 2.7598 7.7248 120.1901 60.7062 38.3860 177.6530 123 N 4.0886 7.6617 116.0655 56.8034 38.8764 176.4953 124 E 3.9766 7.8822 118.6202 59.7815 29.7039 179.8863 125 R 3.9779 7.4563 116.4142 58.3708 30.3188 177.4574 126 T 3.7457 6.9733 116.6150 62.2064 68.6507 173.0311 127 P 4.2900 0.0000 0.0000 62.4336 31.9844 177.2062 128 A 4.6876 8.6096 120.3592 53.6277 18.1109 177.9999 129 E 4.4762 8.3903 119.6152 58.7166 30.5649 178.4763 130 N 4.3417 8.2904 115.5152 56.1484 38.7259 176.2777 131 W 4.1895 8.3308 117.1580 57.8688 30.9305 179.3972 132 L 3.6587 7.9373 116.2282 56.1417 41.3615 174.7246 133 D 4.8628 9.2479 122.1950 54.5669 39.8053 176.3910 134 T 4.1525 8.0462 117.0833 64.2914 69.0984 174.0036 135 Q 4.3648 8.4344 125.3641 54.4627 30.2657 175.3135 136 F 5.4159 8.6617 123.0190 55.1816 40.5567 174.5420 137 L 4.9638 8.2694 123.2913 52.0937 44.4913 174.4604 138 P 5.2421 0.0000 0.0000 62.0506 33.0072 175.4084 139 Y 4.9344 8.8342 119.6637 55.9688 38.6422 175.7513 140 G 4.0379 8.1812 112.0392 46.2966 0.0000 175.3490 141 S 4.6984 9.2557 119.4604 55.2191 65.9148 173.1282 142 P 4.2611 0.0000 0.0000 65.2644 30.8615 176.9519 143 E 4.3847 8.0291 114.8992 56.9061 31.1723 175.9698 144 E 4.6405 7.8893 118.9521 53.7102 30.0044 172.4225 145 P 4.5569 0.0000 0.0000 62.6963 32.8856 177.3533 146 L 4.3518 8.1001 122.8523 53.1086 44.7731 175.2924 147 T 4.9438 8.3426 120.9319 62.2541 70.5046 174.8722 148 S 5.2281 9.0295 121.1566 55.9898 66.8370 172.4737 *150 F 4.8367 8.5072 122.1524 58.2611 40.3650 175.7426 151 F 4.5913 8.4972 125.6004 57.9313 38.9892 176.7567 152 G 3.8294 8.5417 112.5823 43.0811 0.0000 172.5517 153 P 4.2414 0.0000 0.0000 65.6014 31.4298 178.8713 154 K 3.8507 9.0341 118.7345 59.1995 31.5298 179.0824 155 F 4.1888 9.0526 120.8732 60.3832 39.2214 176.5138 156 L 4.0733 7.6612 119.1988 56.6027 41.8593 177.2822 157 A 4.5395 7.5596 118.2535 52.4528 19.5270 176.8835 158 H 4.8730 7.9029 112.1161 55.2211 31.2529 174.8916 159 K 4.3158 7.3867 115.7377 55.9341 32.6197 176.8352 160 L 4.4568 7.6304 117.2427 55.2796 43.9802 177.2225 161 Y 4.9101 8.1332 113.9884 56.7691 38.4212 177.4329 162 Q 3.9677 8.4521 119.1795 59.6520 28.1728 178.0051 163 L 4.4358 7.9103 115.9270 54.0495 41.6899 176.3831 164 C 4.5834 7.7545 117.5509 58.2618 29.9326 174.1807 165 S 4.4897 8.3972 116.3273 57.6119 64.8842 173.4685 166 P 4.3538 0.0000 0.0000 65.7346 31.1144 178.6677 167 E 3.9656 8.1314 118.3063 59.5233 29.5489 178.6324 168 D 4.5747 8.3358 118.9603 57.4188 40.8259 178.7453 169 L 3.6184 8.0682 120.4856 57.9454 41.8656 178.8808 170 A 3.9372 7.8402 119.8835 54.8115 18.5590 179.1697 171 L 3.8293 8.1000 118.7139 58.1613 42.2697 178.8403 172 A 3.9651 8.0106 120.5376 55.5362 18.1496 179.4693 173 S 4.0464 7.9332 112.4608 61.9836 63.0564 176.4868 174 S 4.3157 7.6160 112.3917 59.2670 62.3230 174.1643 175 L 4.4983 7.1977 118.0350 55.3483 43.9468 177.3002 176 V 4.6942 8.0921 112.2180 61.5812 32.0541 176.0419 177 R 4.9211 8.7154 122.6423 53.1415 34.4932 172.9781 178 P 4.4979 0.0000 0.0000 63.4366 31.7678 176.3483 179 S 4.1115 7.9422 115.5385 58.1292 64.2442 171.6752 180 S 4.2440 7.9366 112.0564 58.0375 64.8356 174.5858 181 L 4.6200 7.9679 120.2032 53.2206 43.6620 173.6805 182 F 3.5243 7.6754 125.0276 56.9439 39.3094 175.4064 *184 E 4.1915 8.7231 125.4777 56.1106 30.7030 175.5225 185 D 4.5685 7.3844 118.5456 55.6707 41.9963 177.3636 186 L 4.2351 7.8807 122.9843 57.8709 42.2043 179.1935 187 S 4.7801 7.9987 110.6008 59.1715 63.9860 174.2076 188 K 4.6078 7.7566 120.2555 53.8886 32.2622 175.3132 189 A 4.2425 6.7738 120.5588 52.0796 22.1517 176.3457 190 K 4.6923 7.5095 119.4026 54.7195 32.0441 176.4279 191 Y 3.5850 7.5470 118.8478 60.4068 38.1812 177.9882 192 F 5.4740 7.0510 118.0431 55.8737 40.9768 174.7849 193 T 4.7581 9.6805 115.3869 59.6218 71.2885 175.2353 194 D 4.8034 8.5438 122.1932 56.8109 41.2168 178.6930 195 E 4.1321 8.2852 117.9235 58.3855 29.3450 177.1044 196 R 4.4301 7.0979 115.7140 57.3814 31.1916 177.8027 197 F 4.1818 8.4666 119.8725 61.5949 39.4889 177.2084 198 G 3.9461 8.2592 103.4917 45.0232 0.0000 174.1534 199 S 4.4048 8.0792 115.1820 58.5990 63.9226 174.2501 200 V 4.0121 6.9031 121.1543 61.0820 32.0892 175.5359 201 K 4.0909 8.4896 126.7620 56.8706 33.3316 175.8304 202 R 5.0999 8.6383 122.7443 54.4318 33.0149 175.1524 203 V 4.9281 9.3830 122.9271 61.2222 35.1681 173.4042 204 Y 5.2634 8.6690 127.8562 55.9120 41.9340 174.0513 205 I 4.9890 8.4666 128.1520 59.6240 39.0743 174.9217 206 V 4.5124 8.8902 128.7963 62.9838 33.0428 174.6615 207 C 4.8949 10.1564 127.2566 58.3354 29.2113 174.6702 208 T 3.9616 8.2533 113.9109 65.0645 67.9192 175.3393 209 E 4.3662 8.1862 120.8595 55.5695 29.6144 175.9861 210 D 4.4883 7.9040 119.7786 54.3907 41.6711 176.8230 211 K 4.5013 8.3803 122.8843 56.3327 34.6078 178.0563 212 G 3.4325 8.2819 107.3782 47.9978 0.0000 174.6530 213 I 4.5994 8.0597 126.1447 56.9551 37.5517 173.8989 214 P 4.5221 0.0000 0.0000 63.0530 32.9674 176.5516 215 E 4.0520 8.9976 119.5570 59.4587 29.2948 179.3041 216 E 3.9912 8.1762 118.2410 59.6296 29.7468 178.8834 217 F 4.3727 8.3279 119.9921 61.1094 39.4349 177.0491 218 Q 3.8815 8.3113 118.0309 59.0634 28.6085 178.6831 219 R 3.8047 8.3693 119.3548 58.9382 30.0269 178.6637 220 W 4.0943 8.2902 128.0744 60.9250 30.6147 178.0350 221 Q 3.6032 7.9138 117.5024 58.9377 27.8351 179.0445 222 I 3.5197 6.9531 119.5747 63.7266 37.1125 177.4189 223 D 4.4586 7.5180 118.5756 55.3932 41.1108 177.5660 224 N 4.4492 7.4282 115.6638 54.8806 39.6771 176.5105 225 I 3.7180 7.0654 119.9783 64.3158 37.5672 175.4244 226 G 4.1502 7.1152 105.5907 44.0360 0.0000 173.0406 227 V 4.5056 7.7191 113.4580 60.5426 35.8262 174.4243 228 T 4.4082 8.8465 118.3667 65.5983 69.1438 175.2327 229 E 4.9056 8.0688 119.5755 54.5530 33.8331 173.7740 230 A 5.1341 8.6285 124.9881 50.3209 21.7160 175.3953 231 I 4.7777 8.8910 123.4607 59.4195 40.7259 174.6964 232 E 5.1738 8.8725 122.8251 54.5877 32.9301 175.4433 233 I 4.4221 8.5651 122.0801 59.3603 39.6008 174.9513 234 K 4.1746 8.6541 129.0121 57.2666 32.6601 177.4353 235 G 3.8952 8.9780 114.3768 45.2431 0.0000 173.1928 236 A 4.6613 7.5205 122.7794 50.5072 21.4328 176.4510 237 D 5.2009 7.9493 122.2469 52.3775 40.5960 178.6673 238 H 5.0764 7.8089 114.2534 55.5654 29.2005 176.1259 *240 A 3.9498 7.8251 116.3941 51.8201 19.8823 179.1015 *242 L 4.0864 7.9257 122.0333 55.2551 43.8206 178.6177 243 C 4.4205 7.7762 110.6898 59.2488 30.7397 173.4185 244 E 4.7010 8.0003 121.6758 53.5703 30.3448 175.4506 245 P 4.0850 0.0000 0.0000 66.6132 31.0494 176.5731 246 Q 3.9420 8.0753 117.7075 58.4070 28.8798 179.6130 247 K 3.9162 8.0247 118.4458 59.3149 32.0074 178.9829 248 L 3.9129 7.9203 120.4951 58.2495 42.0895 178.4185 249 C 3.9050 8.4024 118.7993 62.6297 31.5770 175.4498 250 A 4.0371 8.1450 122.1327 55.2180 17.8418 179.8998 251 S 4.1282 7.9091 113.4412 61.8017 62.8262 176.8716 252 L 4.1875 8.3118 121.8799 57.4508 41.2112 179.6079 253 L 4.2014 8.0593 119.4088 57.6527 41.7764 178.8868 254 E 3.9894 8.1477 118.8507 59.2612 29.5632 178.9143 255 I 3.9012 7.9770 119.7869 64.2486 36.9557 178.2159 256 A 3.9032 7.6425 120.4765 55.5950 18.3865 178.8577 257 H 4.1642 8.1722 115.2618 59.7334 29.8665 176.4851 258 K 3.9543 7.8219 121.0333 58.3198 33.3923 177.5217 259 Y 4.2049 7.8172 119.6165 58.0170 35.7781 176.1288 260 N 4.3940 7.7521 120.0048 53.5319 38.4299 174.6502 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 K 8.31 4.31 0.00 1.89 1.89 0.00 1.49 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.45 7.81 3 E 8.65 4.45 0.00 1.95 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 2.18 2.44 0.00 4 G 9.94 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 5 K 8.59 4.57 0.00 1.40 1.27 0.00 1.36 0.00 0.00 1.67 0.00 0.00 2.22 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.42 1.26 7.81 6 H 8.59 5.35 0.00 3.14 3.04 0.00 5.66 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 F 9.78 4.99 0.00 2.82 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 8 V 8.75 4.33 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 0.81 0.00 0.00 0.67 0.00 0.00 9 L 8.19 4.17 0.00 0.42 0.13 0.43 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 10 V 8.15 4.46 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 0.89 0.00 0.00 0.79 0.00 0.00 11 H 9.36 4.76 0.00 3.11 3.60 0.00 5.73 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 G 8.39 4.61 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 0.00 0.00 0.00 13 A 8.91 4.37 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 14 C 8.93 4.64 0.00 3.14 3.15 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 15 H 7.87 5.51 0.00 3.19 2.83 0.00 5.89 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 16 G 7.00 3.75 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 0.00 0.00 0.00 17 G 9.96 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 0.00 0.00 0.00 18 W 8.40 4.40 0.00 3.66 3.43 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 19 S 6.14 3.73 0.00 2.87 3.03 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 20 W 8.24 4.71 0.00 3.42 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 21 Y 8.70 4.33 0.00 3.12 3.53 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 0.00 22 K 7.42 4.10 0.00 1.34 1.66 0.00 1.44 0.00 0.00 1.45 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.95 0.21 7.81 23 L 7.64 4.20 0.00 1.78 1.91 0.87 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.28 3.77 0.00 2.09 1.90 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.53 7.81 25 P 0.00 4.29 0.00 2.21 2.12 0.00 3.70 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 26 L 7.71 3.94 0.00 1.77 1.67 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 27 L 7.71 4.02 0.00 1.69 1.48 0.29 0.32 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 28 E 8.62 4.27 0.00 2.15 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 0.00 2.35 2.51 0.00 29 A 7.94 4.22 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.74 4.34 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 31 G 8.52 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 H 8.08 5.27 0.00 3.35 3.63 0.00 5.61 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 33 K 9.40 4.61 0.00 1.75 1.61 0.00 1.48 0.00 0.00 1.35 0.00 0.00 2.64 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.84 1.27 7.81 34 V 8.23 5.03 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.93 0.00 0.00 35 T 8.57 4.40 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 1.19 0.00 0.00 36 A 8.37 4.80 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.92 4.11 0.00 1.75 1.65 0.87 0.79 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 38 D 8.44 4.87 0.00 2.69 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 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0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.63 0.00 48 K 8.71 4.52 0.00 1.94 1.94 0.00 1.55 0.00 0.00 1.90 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.44 7.81 49 I 8.09 3.65 1.82 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 1.06 0.72 0.57 0.00 0.00 50 E 7.80 3.78 0.00 1.91 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 0.00 2.21 1.96 0.00 51 E 7.91 4.34 0.00 2.11 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 2.35 0.00 52 L 7.85 4.63 0.00 2.00 1.96 1.22 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 53 R 9.00 4.54 0.00 2.05 2.08 0.00 3.33 0.00 0.00 3.38 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 54 T 7.65 4.93 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 1.34 0.00 0.00 55 L 8.31 2.85 0.00 1.43 1.41 0.81 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.60 0.00 0.00 1.28 0.00 0.00 119 L 7.97 3.83 0.00 1.68 1.58 0.88 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 120 E 7.97 4.03 0.00 2.21 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 121 Q 7.98 3.71 0.00 1.79 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.73 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 122 Y 7.72 2.76 0.00 2.27 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 0.00 123 N 7.66 4.09 0.00 2.89 2.84 0.00 0.00 7.17 7.52 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 0.00 124 E 7.88 3.98 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 2.28 2.30 0.00 125 R 7.46 3.98 0.00 1.49 1.71 0.00 2.94 0.00 0.00 3.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.46 0.00 126 T 6.97 3.75 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 0.85 0.00 0.00 127 P 0.00 4.29 0.00 2.63 2.12 0.00 3.53 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.89 0.00 128 A 8.61 4.69 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.39 4.48 0.00 2.10 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 2.29 2.34 0.00 130 N 8.29 4.34 0.00 2.42 2.75 0.00 0.00 6.91 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 0.00 131 W 8.33 4.19 0.00 3.54 3.23 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 0.00 132 L 7.94 3.66 0.00 1.97 1.11 1.05 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.00 0.00 133 D 9.25 4.86 0.00 2.80 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 0.00 134 T 8.05 4.15 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 0.50 0.00 0.00 135 Q 8.43 4.36 0.00 1.96 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 136 F 8.66 5.42 0.00 2.82 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 0.00 137 L 8.27 4.96 0.00 1.62 1.55 0.90 0.85 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 0.00 138 P 0.00 5.24 0.00 2.04 2.02 0.00 3.77 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 1.97 1.96 0.00 139 Y 8.83 4.93 0.00 2.88 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 8.18 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 0.00 141 S 9.26 4.70 0.00 3.90 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 P 0.00 4.26 0.00 2.18 2.22 0.00 3.73 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 143 E 8.03 4.38 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.29 0.00 144 E 7.89 4.64 0.00 1.97 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 2.20 2.20 0.00 145 P 0.00 4.56 0.00 1.98 1.99 0.00 3.66 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 2.01 1.95 0.00 146 L 8.10 4.35 0.00 0.29 0.13 0.76 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 147 T 8.34 4.94 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 1.25 0.00 0.00 148 S 9.03 5.23 0.00 3.61 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 *150 F 8.51 4.84 0.00 2.91 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 F 8.50 4.59 0.00 3.10 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 0.00 152 G 8.54 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 P 0.00 4.24 0.00 2.22 2.25 0.00 3.80 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.01 0.00 154 K 9.03 3.85 0.00 2.20 1.90 0.00 1.61 0.00 0.00 1.46 0.00 0.00 2.86 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.59 7.81 155 F 9.05 4.19 0.00 3.29 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 0.00 156 L 7.66 4.07 0.00 2.02 1.52 1.18 0.96 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 0.00 157 A 7.56 4.54 1.21 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 0.00 0.00 158 H 7.90 4.87 0.00 3.19 3.21 0.00 5.63 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 K 7.39 4.32 0.00 0.79 1.21 0.00 1.49 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.07 1.30 7.81 160 L 7.63 4.46 0.00 1.92 1.66 0.76 0.38 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 0.00 161 Y 8.13 4.91 0.00 3.09 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 0.00 162 Q 8.45 3.97 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.10 7.39 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 163 L 7.91 4.44 0.00 1.62 1.70 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 164 C 7.75 4.58 0.00 3.29 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 0.00 165 S 8.40 4.49 0.00 4.27 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 0.00 166 P 0.00 4.35 0.00 2.29 2.36 0.00 3.72 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 2.09 2.06 0.00 167 E 8.13 3.97 0.00 2.15 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 2.43 2.48 0.00 168 D 8.34 4.57 0.00 3.10 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 0.00 169 L 8.07 3.62 0.00 1.76 1.79 0.61 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 170 A 7.84 3.94 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 L 8.10 3.83 0.00 1.81 1.92 0.57 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 172 A 8.01 3.97 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 S 7.93 4.05 0.00 3.89 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 0.00 174 S 7.62 4.32 0.00 3.79 3.82 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 0.00 175 L 7.20 4.50 0.00 0.60 1.04 -0.81 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 176 V 8.09 4.69 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 1.07 0.00 0.00 1.03 0.00 0.00 177 R 8.72 4.92 0.00 1.78 1.74 0.00 3.28 0.00 0.00 3.48 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.92 0.00 178 P 0.00 4.50 0.00 1.76 1.48 0.00 3.48 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.54 0.00 179 S 7.94 4.11 0.00 3.74 3.52 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 0.00 180 S 7.94 4.24 0.00 3.47 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 0.00 181 L 7.97 4.62 0.00 1.64 1.72 0.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 182 F 7.68 3.52 0.00 3.27 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 *184 E 8.72 4.19 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.36 0.00 185 D 7.38 4.57 0.00 2.95 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 L 7.88 4.24 0.00 2.06 1.83 1.06 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 187 S 8.00 4.78 0.00 4.01 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 0.00 188 K 7.76 4.61 0.00 1.70 1.78 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.36 1.47 7.81 189 A 6.77 4.24 1.19 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 0.00 190 K 7.51 4.69 0.00 1.74 1.60 0.00 1.63 0.00 0.00 1.80 0.00 0.00 3.14 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.44 7.81 191 Y 7.55 3.58 0.00 2.05 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 0.00 0.00 0.00 192 F 7.05 5.47 0.00 2.71 2.40 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 0.00 193 T 9.68 4.76 4.48 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 1.24 0.00 0.00 194 D 8.54 4.80 0.00 2.85 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 0.00 195 E 8.29 4.13 0.00 1.97 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 0.00 2.33 2.41 0.00 196 R 7.10 4.43 0.00 2.25 2.04 0.00 3.16 0.00 0.00 3.42 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 197 F 8.47 4.18 0.00 3.50 3.41 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 0.00 198 G 8.26 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 0.00 199 S 8.08 4.40 0.00 3.96 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 0.00 200 V 6.90 4.01 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 0.95 0.00 0.00 201 K 8.49 4.09 0.00 1.57 1.51 0.00 1.87 0.00 0.00 2.16 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.50 7.81 202 R 8.64 5.10 0.00 1.79 1.97 0.00 3.05 0.00 0.00 2.85 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 203 V 9.38 4.93 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 1.01 0.00 0.00 0.68 0.00 0.00 204 Y 8.67 5.26 0.00 3.10 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 0.00 205 I 8.47 4.99 1.83 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 1.15 0.64 0.93 0.00 0.00 206 V 8.89 4.51 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 1.15 0.00 0.00 1.10 0.00 0.00 207 C 10.16 4.89 0.00 2.83 3.11 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 0.00 208 T 8.25 3.96 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 1.23 0.00 0.00 209 E 8.19 4.37 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 210 D 7.90 4.49 0.00 2.83 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 0.00 211 K 8.38 4.50 0.00 1.85 1.68 0.00 2.10 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.27 1.37 7.81 212 G 8.28 3.43 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 0.00 213 I 8.06 4.60 1.86 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.50 1.14 0.00 0.00 214 P 0.00 4.52 0.00 2.46 2.22 0.00 3.90 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 2.19 2.05 0.00 215 E 9.00 4.05 0.00 2.09 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 2.42 2.47 0.00 216 E 8.18 3.99 0.00 2.17 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 217 F 8.33 4.37 0.00 3.16 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 0.00 218 Q 8.31 3.88 0.00 2.42 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.54 0.00 0.00 0.00 0.00 0.00 2.63 2.85 0.00 219 R 8.37 3.80 0.00 1.97 1.98 0.00 3.30 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.82 0.00 220 W 8.29 4.09 0.00 3.51 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 0.00 221 Q 7.91 3.60 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.13 0.00 222 I 6.95 3.52 1.85 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 -0.03 0.81 0.00 0.00 223 D 7.52 4.46 0.00 2.56 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 0.00 224 N 7.43 4.45 0.00 1.44 2.26 0.00 0.00 7.04 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 0.00 225 I 7.07 3.72 2.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.47 0.93 0.00 0.00 226 G 7.12 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 0.00 227 V 7.72 4.51 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.93 0.00 0.00 228 T 8.85 4.41 4.37 0.00 0.00 0.00 0.00 0.00 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 0.00 229 E 8.07 4.91 0.00 2.21 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 2.36 2.39 0.00 230 A 8.63 5.13 1.23 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 0.00 0.00 0.00 231 I 8.89 4.78 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.04 0.95 0.00 0.00 232 E 8.87 5.17 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.32 0.00 233 I 8.57 4.42 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 1.12 1.28 0.90 0.00 0.00 234 K 8.65 4.17 0.00 1.75 1.70 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.51 7.81 235 G 8.98 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 0.00 236 A 7.52 4.66 1.21 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 0.00 0.00 237 D 7.95 5.20 0.00 2.80 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 0.00 238 H 7.81 5.08 0.00 3.12 3.40 0.00 5.82 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 *240 A 7.83 3.95 1.23 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 0.00 0.00 0.00 *242 L 7.93 4.09 0.00 1.49 1.73 0.96 0.99 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 0.00 243 C 7.78 4.42 0.00 3.02 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 0.00 244 E 8.00 4.70 0.00 2.05 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 0.00 2.17 2.34 0.00 245 P 0.00 4.09 0.00 2.18 2.21 0.00 3.62 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 246 Q 8.08 3.94 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.92 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 247 K 8.02 3.92 0.00 1.90 1.85 0.00 1.91 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.49 7.81 248 L 7.92 3.91 0.00 1.74 1.83 0.93 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 0.00 249 C 8.40 3.90 0.00 2.93 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 0.00 250 A 8.15 4.04 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 251 S 7.91 4.13 0.00 4.10 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 L 8.31 4.19 0.00 1.61 1.59 0.78 0.60 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 0.00 253 L 8.06 4.20 0.00 1.87 1.77 0.93 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 254 E 8.15 3.99 0.00 2.25 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 255 I 7.98 3.90 2.14 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 1.61 1.12 1.08 0.00 0.00 256 A 7.64 3.90 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 0.00 257 H 8.17 4.16 0.00 3.11 3.50 0.00 5.95 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 0.00 258 K 7.82 3.95 0.00 1.84 1.38 0.00 1.31 0.00 0.00 1.43 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.91 1.22 7.81 259 Y 7.82 4.20 0.00 2.95 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 260 N 7.75 4.39 0.00 2.08 2.26 0.00 0.00 7.08 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 * Residues marked with a * may have inaccurate shift predictions.