NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.6397 8.2644 122.4676 52.2997 20.6127 175.8070 2 E 4.5451 8.7062 119.4836 53.8662 32.9497 172.3520 3 T 5.3701 8.4131 116.4035 60.3337 72.9233 172.5294 4 V 4.7738 8.3415 121.3558 60.3438 35.5081 173.6476 5 S 5.3414 8.3550 115.6572 58.4637 64.3713 176.2229 6 F 5.0076 8.0377 118.2558 56.7447 41.3902 173.8158 7 S 5.3259 8.2545 117.0803 57.0463 66.4434 174.3257 8 W 5.3587 8.8938 125.5388 55.2698 32.6303 176.4360 9 N 4.8415 9.3519 122.5765 53.2348 37.9273 172.4749 10 K 4.8613 7.5924 118.3241 55.3342 36.1149 180.1765 11 F 4.7750 9.4189 121.5782 57.3898 41.3908 176.0244 12 V 4.6658 8.0704 122.0179 58.7846 33.8399 171.5919 13 P 4.2839 0.0000 0.0000 63.9259 31.5906 177.0270 14 K 3.9388 8.9387 122.4576 54.8988 29.0739 172.9442 15 Q 4.0374 8.0777 119.2644 56.5873 28.4395 175.6950 16 P 4.3234 0.0000 0.0000 64.4141 31.6367 176.1803 17 N 5.1945 7.7883 116.1142 52.4310 38.4600 174.1335 18 M 5.4716 7.7469 118.1182 53.8901 36.2680 174.9927 19 I 4.5815 8.9080 121.4433 59.6844 40.8235 174.3258 20 L 5.0678 8.6662 127.1087 53.3236 43.2030 175.9979 21 Q 4.5319 8.7116 122.0807 54.4363 32.2165 176.5598 22 G 3.7752 8.7349 108.6340 46.7570 0.0000 175.6163 23 D 4.2239 9.7859 121.8648 56.3653 41.3285 177.2320 24 A 4.4269 7.2305 120.8314 52.6909 19.0092 176.8173 25 I 4.6214 8.9567 114.8559 59.8908 41.9872 173.5840 26 V 4.9067 8.1016 122.0740 59.9679 32.9323 176.0957 27 T 4.2416 8.8662 116.2073 60.6937 69.6881 175.5950 28 S 4.0950 8.7431 117.8713 61.7488 62.7887 175.4811 29 S 4.3932 8.1443 112.9182 58.0372 62.6546 174.2292 30 G 4.5690 8.3826 107.5592 46.8925 0.0000 173.8177 31 K 4.5861 7.6860 118.9893 55.4284 34.0776 175.9939 32 L 4.1764 8.3387 126.1772 53.8650 43.1629 175.3039 33 Q 4.6920 9.0728 130.1833 54.5091 29.6112 175.8430 34 L 4.1338 8.5047 128.7141 56.8085 42.8310 176.8982 35 N 5.4151 8.2091 116.0257 51.6717 42.5665 174.8942 36 K 4.5520 8.4561 123.1859 54.8209 33.4184 176.7376 37 V 5.1245 8.2223 117.4956 59.7597 36.1526 175.5117 38 D 4.6208 10.0687 124.4988 53.5329 40.5069 179.1535 39 E 4.0116 8.8966 115.8176 61.0499 29.6598 178.3592 40 N 4.3899 8.0961 115.2714 53.8334 37.6263 177.5020 41 G 4.0650 8.2301 104.0979 45.7002 0.0000 173.8888 42 T 4.5111 7.6780 116.9559 62.6863 69.7206 172.2714 43 P 4.5845 0.0000 0.0000 63.3766 32.6629 176.0862 44 K 4.5521 8.4716 125.6495 53.2141 32.8830 175.0282 45 P 4.6005 0.0000 0.0000 61.2247 32.5254 176.2048 46 S 3.7404 8.9082 114.4046 59.0995 60.3253 170.8250 47 S 4.9657 7.7559 114.7154 58.2061 64.4033 172.7370 48 L 4.9298 9.5575 126.0117 54.1187 45.8681 174.2562 49 G 4.8627 8.9105 112.4982 43.4696 0.0000 171.5429 50 R 5.4746 8.9321 121.1703 54.3943 35.0676 174.3352 51 A 5.2665 9.2446 122.2035 50.9271 22.9306 175.4843 52 L 5.3175 9.5872 121.7059 53.0629 46.3733 174.7057 53 Y 5.0022 8.5577 122.1880 56.4626 39.7053 175.2980 54 S 4.0960 8.9201 125.0845 62.1803 63.2804 174.9672 55 T 4.1180 7.0625 113.2106 59.6367 68.7514 174.2259 56 P 4.8413 0.0000 0.0000 62.0166 32.8584 175.4516 57 I 4.4917 9.2458 122.7009 60.1581 39.7095 174.8126 58 H 3.8079 8.4577 127.0976 55.0230 28.0348 174.3401 59 I 4.1792 8.4256 126.5659 63.1572 38.3131 175.4701 60 W 5.6283 7.4136 116.1554 55.2614 30.7903 173.7824 61 D 4.7562 9.6500 122.5415 53.1365 43.0378 176.4573 62 K 4.1560 8.9843 130.9423 58.6242 31.3822 174.9080 63 E 3.9466 8.0246 116.4874 60.3700 30.2020 181.2270 64 T 4.0144 8.1064 112.2057 63.2581 68.8210 177.9464 65 G 4.0373 9.8347 110.7728 46.3059 0.0000 174.2480 66 S 4.5608 7.8774 117.3438 58.1746 63.8912 176.4938 67 V 4.8073 8.1548 120.6711 60.8751 33.7389 175.3271 68 A 4.6026 9.2028 129.9064 52.4104 19.5775 176.5631 69 S 5.1142 9.4970 115.8251 56.7608 65.9764 173.7108 70 F 5.3272 8.0908 117.6501 55.2983 42.0002 173.1405 71 A 5.3452 8.5224 118.5545 50.9414 22.7661 175.2028 72 A 5.3909 9.3089 121.5266 50.8701 23.4539 175.1541 73 S 5.2451 9.2342 112.8361 57.9620 67.1050 173.1249 74 F 5.2732 7.5737 111.7912 57.0124 40.5746 172.3909 75 N 5.2645 8.9026 119.6501 52.7885 40.0198 174.2777 76 F 5.6515 8.9417 117.6242 56.0056 42.4339 172.8951 77 T 5.2425 9.1961 109.3052 60.3561 72.8813 172.2351 78 F 6.3000 8.3106 114.4208 54.9832 42.0219 172.8154 79 Y 5.1183 8.7979 120.5040 55.9724 41.6036 173.9289 80 A 4.9962 8.3246 128.9189 48.6521 20.2426 173.7256 81 P 3.9577 0.0000 0.0000 65.5181 31.9211 176.6692 82 D 4.6776 7.6677 117.7975 52.4585 42.9657 175.6184 83 T 4.2004 8.6615 118.8685 63.3855 69.3538 176.1886 84 K 4.1653 9.2517 126.8684 56.6109 32.2717 183.3430 85 R 4.6486 7.9098 115.8296 54.2918 29.6779 179.2149 86 L 4.8787 7.7777 122.5323 52.2419 44.6439 176.0681 87 A 4.7034 7.5220 123.4138 52.4991 22.0896 177.0139 88 D 4.7992 9.8162 118.9038 53.6140 43.4465 177.2198 89 G 4.3671 6.1338 104.7732 43.9023 0.0000 171.0229 90 L 5.1773 8.4186 120.4485 53.7273 45.9295 174.9742 91 A 5.4125 9.5076 125.1895 50.6688 23.3908 174.6156 92 F 5.2217 9.0171 122.0553 56.6003 42.5558 174.4443 93 F 4.8342 7.3847 119.3805 56.1101 41.8398 172.3224 94 L 4.9765 8.8583 117.5788 53.0234 45.4034 176.2061 95 A 5.2918 8.7673 123.7944 49.8771 23.8078 173.6690 96 P 4.6774 0.0000 0.0000 62.3809 32.1348 178.2746 97 I 3.6828 8.4809 123.5378 65.3887 37.0414 178.3658 98 D 4.4670 8.0141 116.8437 54.8229 39.8093 178.2710 99 T 3.8672 7.4162 114.4523 64.1562 67.6056 173.5548 100 K 4.9313 8.1354 127.8276 51.6499 35.9947 171.7693 101 P 4.3616 0.0000 0.0000 63.8552 31.5802 177.2166 102 Q 4.7212 8.1533 122.9154 55.8556 31.4923 175.7277 103 T 4.1585 8.2573 120.4645 65.0960 69.9958 174.9690 104 H 5.1087 8.5022 119.8144 55.9961 32.1254 175.5189 105 A 4.3235 8.0565 122.8234 52.0748 17.6582 180.9372 106 G 3.6809 8.9631 105.7907 50.6968 0.0000 173.0514 107 Y 4.3761 8.8367 116.4472 57.1716 38.0645 175.7424 108 L 3.7209 10.0755 119.3863 55.4113 40.2122 175.6343 109 G 3.9146 8.4792 104.9017 45.8511 0.0000 175.5960 110 L 3.9456 8.0878 119.3197 54.2582 43.6323 176.6639 111 F 4.7783 7.8863 118.1693 56.1038 42.4806 174.2665 112 N 5.3054 8.4698 121.3322 50.1701 39.7020 176.2884 113 E 3.6268 8.4015 117.7210 60.2500 29.6400 179.9281 114 N 4.7736 7.7703 116.5481 51.5003 39.2604 176.5292 115 E 4.3049 8.4363 113.6198 57.3936 30.7050 172.7674 *118 D 4.3340 8.4678 123.1207 53.0629 41.2726 174.9686 119 Q 4.4189 8.5682 121.8972 53.6637 27.6686 173.6977 120 V 4.8116 8.2630 124.0397 60.1057 34.9334 174.1934 121 V 5.0710 8.8973 127.0632 61.1981 34.0755 174.0990 122 A 5.2728 9.6693 128.7637 50.4805 23.5938 174.6308 123 V 4.9252 8.8638 120.3162 61.2197 33.7614 174.3397 124 E 5.0138 9.3161 126.8600 54.9328 32.4957 175.2704 125 F 4.9424 9.4251 122.0288 55.8896 39.8773 172.3698 126 D 5.2784 9.2776 123.5145 53.3461 42.2726 176.3254 127 T 4.4655 8.7244 115.6565 61.7571 70.6792 174.1055 128 F 4.3248 9.2667 127.4396 56.5976 41.6787 175.7001 129 R 3.8154 7.1715 126.2667 56.3120 27.6342 172.6830 130 N 4.3688 8.6736 124.0810 51.2370 39.7663 176.5486 131 S 4.0629 7.4857 112.7711 60.5954 63.2339 175.0562 132 W 4.5218 7.0599 116.2087 57.1428 28.7012 176.1521 133 D 4.6615 6.9208 119.1333 53.2553 41.0837 173.7389 134 P 4.7393 0.0000 0.0000 60.0387 33.3913 173.4580 135 P 4.1482 0.0000 0.0000 63.9614 31.6437 176.3329 136 N 4.7389 8.6676 115.6893 52.5008 37.8509 172.3717 137 P 4.7694 0.0000 0.0000 63.7947 32.9106 175.0921 138 H 5.7139 9.0146 117.1607 55.2036 32.7737 171.6588 139 I 5.2201 8.5828 118.6430 58.9470 40.1782 175.5245 140 G 4.4696 8.2250 111.1911 45.1994 0.0000 171.0739 141 I 4.9777 8.5047 121.3828 59.4468 39.9645 174.7393 142 N 5.0471 9.5655 124.4185 51.7585 41.1830 173.7343 143 V 4.0354 8.2924 125.4631 61.1830 32.5199 174.7236 144 N 5.0224 9.4583 123.7617 53.3697 36.7640 174.3867 145 S 3.8866 6.7472 108.7981 57.0718 65.4896 175.1341 146 I 3.0268 7.2971 128.0127 62.7109 37.7826 176.6785 147 R 4.2030 7.3900 119.0128 54.8789 28.1299 181.7300 148 S 5.0056 8.6472 120.2822 57.7342 63.3108 175.8335 149 I 3.9163 8.5645 117.6227 62.4092 38.2239 175.7542 150 K 4.4928 7.4712 122.5477 56.2088 36.0957 173.6079 151 T 5.1797 8.4489 115.0196 61.2477 72.5663 172.3198 152 T 4.7165 9.5177 117.4591 61.1061 71.2326 173.4387 153 S 4.5934 8.9065 125.3302 59.5197 62.8970 173.1534 154 W 5.1349 8.7313 133.8292 54.4711 32.2839 176.3727 155 D 4.7548 9.2375 132.1297 52.5626 39.2904 176.3969 156 L 4.0980 6.9208 118.6209 55.3369 41.1340 177.7903 157 A 4.1868 8.0143 122.1011 50.3131 20.8840 175.7926 158 N 3.1400 8.7422 123.6334 55.7887 39.4550 176.1436 159 N 4.2344 8.0807 118.3255 52.9875 36.8832 174.3426 160 K 4.4103 7.3425 115.5235 55.9883 33.3454 176.5192 161 V 3.9936 8.3205 122.5065 62.8311 32.1932 174.8937 162 A 4.1519 8.3425 129.9671 49.9088 21.3900 175.1616 163 K 4.6078 9.1507 123.7789 54.4554 34.8562 175.1301 164 V 4.7197 7.9636 126.4476 60.8581 34.9319 173.8239 165 L 5.1200 9.0117 127.8318 53.3456 45.4018 174.9936 166 I 5.2895 9.0584 127.0296 59.7353 40.7557 174.6272 167 T 4.9486 9.1306 116.2939 60.0100 72.2795 172.2621 168 Y 4.5966 8.5961 125.3020 55.9183 41.6940 173.8340 169 D 4.5077 7.9547 128.2932 52.2760 41.1161 176.3444 170 A 3.9654 8.1858 129.7187 55.1705 18.6855 179.2136 171 S 4.1976 8.3473 109.8709 61.0081 63.1265 175.3160 172 T 4.1669 7.7310 108.0961 60.5785 69.5591 174.4496 173 S 3.6921 8.0606 117.7017 58.5814 61.2627 170.6834 174 L 5.0149 7.2107 121.2678 53.1469 44.5630 174.2892 175 L 5.2587 9.0708 129.0534 53.6860 44.1344 175.1304 176 V 4.9513 9.0741 125.6187 61.0240 35.0773 173.8695 177 A 5.3721 9.4976 128.9342 50.1603 22.2474 174.9410 178 S 5.1544 9.3017 116.9363 56.3914 66.7969 172.8588 179 L 5.1434 9.5350 124.6179 53.3556 45.2171 175.2103 180 V 4.8724 8.9922 125.0508 61.5140 35.8019 173.7814 181 Y 4.7187 8.8118 124.2583 55.3722 38.8833 174.3996 182 P 4.3374 0.0000 0.0000 66.1435 31.8754 179.9201 183 S 4.1735 8.2603 113.0575 60.4898 62.1650 176.7735 184 Q 4.5376 8.0574 117.7702 55.5078 29.3659 176.0784 185 R 3.9415 7.6199 115.3361 57.8005 27.6115 180.7601 186 T 5.0602 7.7508 113.9454 62.6624 72.2293 173.8447 187 S 5.2944 8.4833 117.5898 57.4600 66.0400 173.1064 188 N 5.2386 9.5479 118.8821 51.7162 42.6605 173.2073 189 I 5.1789 8.2056 120.8287 59.6779 42.1198 173.8140 190 L 4.7167 8.7349 125.4491 54.1924 45.7475 173.8779 191 S 5.1515 8.3730 118.8303 57.4895 66.2286 172.1898 192 D 4.5472 8.9612 120.2028 53.9113 45.2978 174.2721 193 V 4.7158 8.3109 114.7550 60.4370 33.0000 176.1653 194 V 4.4078 8.6454 123.6579 61.3619 34.4758 174.6803 195 D 4.6582 8.7943 127.4967 52.6721 40.7185 176.1616 196 L 3.9524 8.6621 127.6072 57.9437 42.1328 180.0275 197 K 2.4800 7.8258 117.2379 59.4144 31.8861 179.0831 198 T 4.0494 7.2771 107.6479 63.4745 68.8081 175.0285 199 S 4.7820 7.7153 117.1073 59.1186 64.1960 173.5379 200 L 4.6795 7.3475 117.5019 52.8172 45.8062 173.1461 201 P 4.7368 0.0000 0.0000 62.2115 32.5074 176.1681 202 E 2.9843 8.3003 118.6147 58.2063 30.3288 176.9411 203 W 5.2373 8.0838 117.6926 54.9409 31.9392 175.5495 204 V 4.8099 9.2347 116.1526 60.0393 36.4213 174.1724 205 R 5.0411 9.1379 120.4104 54.3941 33.7731 175.1497 206 I 4.6968 7.1108 114.5287 58.4075 41.3286 175.3338 207 G 3.6550 5.7499 109.0407 45.6901 0.0000 171.6165 208 F 5.3850 8.3790 117.1932 55.7260 42.6210 174.8539 209 S 5.2991 9.6044 115.6217 56.9681 66.4746 172.5422 210 A 5.0027 8.5610 124.3577 51.0108 22.9416 175.2060 211 A 5.2735 8.7757 123.1224 50.4007 22.9288 175.5808 212 T 4.8222 8.2124 110.3535 59.6227 71.4643 174.6989 213 G 3.4850 8.4540 108.7007 46.4328 0.0000 173.6692 214 L 4.3279 8.7251 125.1595 57.3930 41.5468 177.5017 215 D 4.7357 8.0327 116.4396 52.9324 40.0044 175.5161 216 I 4.6970 7.0063 113.1503 58.2960 40.8509 174.4543 217 P 4.2816 0.0000 0.0000 63.6587 33.3249 179.8804 218 G 4.2878 9.0290 106.5761 43.9198 0.0000 174.0418 219 E 5.7500 9.1582 111.7372 55.1036 33.3996 176.7712 220 S 4.5713 8.7801 116.4361 58.5960 65.5298 172.7625 221 H 5.3067 8.5767 114.1820 54.6743 32.1561 172.0960 222 D 5.1710 9.1996 124.0522 52.3933 43.6908 175.7522 223 V 4.4098 8.5379 123.8411 61.6270 32.4787 176.2205 224 L 4.6241 9.4024 129.2064 57.1000 42.8236 176.8117 225 S 4.9057 8.1350 111.2120 57.3812 67.2000 172.8732 226 W 5.7577 8.9805 128.0860 56.8979 34.5248 173.2502 227 S 4.4502 10.0661 122.3698 56.8513 67.1254 172.7706 228 F 5.0469 7.8748 124.1226 56.9210 43.1328 172.7867 229 A 4.7626 7.7010 125.9670 50.4567 22.9235 174.9216 230 S 4.9418 8.8172 114.5918 56.7180 66.7585 172.1932 231 N 5.5304 9.0814 123.0752 51.6912 42.4861 172.7410 232 L 5.0036 9.0175 127.4314 52.8493 45.2242 174.1669 233 P 4.9167 0.0000 0.0000 62.0926 33.8743 176.2022 *234 H 4.4365 8.4919 115.2069 54.8407 28.0512 173.5261 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 A 8.26 4.64 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 E 8.71 4.55 0.00 2.04 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 3 T 8.41 5.37 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 1.21 0.00 0.00 4 V 8.34 4.77 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.14 0.00 0.00 5 S 8.36 5.34 0.00 3.82 3.78 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 6 F 8.04 5.01 0.00 2.98 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.25 5.33 0.00 3.36 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 W 8.89 5.36 0.00 3.14 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 9 N 9.35 4.84 0.00 2.73 2.70 0.00 0.00 6.50 7.44 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 10 K 7.59 4.86 0.00 1.49 1.54 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.27 1.03 7.81 11 F 9.42 4.77 0.00 3.20 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 12 V 8.07 4.67 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 0.79 0.00 0.00 0.93 0.00 0.00 13 P 0.00 4.28 0.00 2.03 2.05 0.00 3.76 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.28 0.00 14 K 8.94 3.94 0.00 1.95 1.80 0.00 1.81 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.24 0.98 7.81 15 Q 8.08 4.04 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.25 0.00 16 P 0.00 4.32 0.00 2.14 2.17 0.00 3.66 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 1.93 1.91 0.00 17 N 7.79 5.19 0.00 2.64 2.99 0.00 0.00 6.50 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 M 7.75 5.47 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.12 3.18 0.00 19 I 8.91 4.58 1.91 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.83 0.93 0.00 0.00 20 L 8.67 5.07 0.00 1.53 1.73 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 21 Q 8.71 4.53 0.00 2.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 5.80 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 22 G 8.73 3.78 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 0.00 0.00 0.00 23 D 9.79 4.22 0.00 2.42 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.23 4.43 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 I 8.96 4.62 1.86 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 1.26 0.66 0.96 0.00 0.00 26 V 8.10 4.91 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 0.79 0.00 0.00 1.03 0.00 0.00 27 T 8.87 4.24 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 1.24 0.00 0.00 28 S 8.74 4.10 0.00 4.01 4.07 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 29 S 8.14 4.39 0.00 4.03 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 30 G 8.38 4.57 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 0.00 0.00 0.00 31 K 7.69 4.59 0.00 1.68 1.73 0.00 1.81 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.43 7.81 32 L 8.34 4.18 0.00 0.27 0.66 0.70 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 9.07 4.69 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.59 0.00 0.00 0.00 0.00 0.00 2.46 2.32 0.00 34 L 8.50 4.13 0.00 1.84 1.69 0.78 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 35 N 8.21 5.42 0.00 2.61 2.74 0.00 0.00 6.75 7.61 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 36 K 8.46 4.55 0.00 1.49 1.67 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.33 1.29 7.81 37 V 8.22 5.12 2.27 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 0.90 0.00 0.00 0.95 0.00 0.00 38 D 10.07 4.62 0.00 2.61 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 39 E 8.90 4.01 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.88 0.00 40 N 8.10 4.39 0.00 2.73 2.78 0.00 0.00 6.94 7.51 0.00 0.00 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 G 8.23 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 42 T 7.68 4.51 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 1.27 0.00 0.00 43 P 0.00 4.58 0.00 2.26 2.11 0.00 3.54 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.22 0.00 44 K 8.47 4.55 0.00 1.56 1.64 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.28 7.81 45 P 0.00 4.60 0.00 1.99 2.30 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 2.03 1.94 0.00 46 S 8.91 3.74 0.00 3.67 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 S 7.76 4.97 0.00 3.95 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 48 L 9.56 4.93 0.00 1.74 1.44 0.98 1.32 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 49 G 8.91 4.86 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 50 R 8.93 5.47 0.00 1.77 1.91 0.00 2.93 0.00 0.00 3.09 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 51 A 9.24 5.27 1.25 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 0.00 0.00 0.00 52 L 9.59 5.32 0.00 1.56 1.54 0.96 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 53 Y 8.56 5.00 0.00 2.95 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 54 S 8.92 4.10 0.00 3.70 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 55 T 7.06 4.12 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 1.21 0.00 0.00 56 P 0.00 4.84 0.00 2.42 2.17 0.00 3.70 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 1.95 1.94 0.00 57 I 9.25 4.49 1.86 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.73 1.02 0.00 0.00 58 H 8.46 3.81 0.00 1.40 2.55 0.00 5.74 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.43 4.18 1.85 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.48 1.10 0.00 0.00 60 W 7.41 5.63 0.00 3.39 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 D 9.65 4.76 0.00 2.69 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 62 K 8.98 4.16 0.00 1.77 1.71 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.40 1.27 7.81 63 E 8.02 3.95 0.00 1.98 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 2.24 1.90 0.00 64 T 8.11 4.01 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 1.21 0.00 0.00 65 G 9.83 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 66 S 7.88 4.56 0.00 3.44 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 67 V 8.15 4.81 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 1.13 0.00 0.00 0.92 0.00 0.00 68 A 9.20 4.60 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 69 S 9.50 5.11 0.00 3.68 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 70 F 8.09 5.33 0.00 2.82 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 71 A 8.52 5.35 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 A 9.31 5.39 1.41 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 0.00 0.00 73 S 9.23 5.25 0.00 3.83 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 74 F 7.57 5.27 0.00 3.29 3.44 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 75 N 8.90 5.26 0.00 2.90 2.84 0.00 0.00 6.51 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 76 F 8.94 5.65 0.00 3.24 3.29 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 77 T 9.20 5.24 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 1.22 0.00 0.00 78 F 8.31 6.30 0.00 3.29 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 Y 8.80 5.12 0.00 3.25 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 80 A 8.32 5.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 P 0.00 3.96 0.00 1.99 2.13 0.00 3.68 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.04 0.00 82 D 7.67 4.68 0.00 2.59 2.45 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 83 T 8.66 4.20 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 1.21 0.00 0.00 84 K 9.25 4.17 0.00 1.76 1.76 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.25 7.81 85 R 7.91 4.65 0.00 1.72 1.81 0.00 3.20 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.42 0.00 86 L 7.78 4.88 0.00 1.57 1.82 0.78 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 87 A 7.52 4.70 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 D 9.82 4.80 0.00 2.86 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 89 G 6.13 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 0.00 0.00 0.00 0.00 90 L 8.42 5.18 0.00 1.62 1.45 0.93 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 91 A 9.51 5.41 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 0.00 0.00 0.00 0.00 0.00 0.00 92 F 9.02 5.22 0.00 2.89 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 93 F 7.38 4.83 0.00 3.07 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 94 L 8.86 4.98 0.00 1.51 1.38 0.80 0.38 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 95 A 8.77 5.29 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 96 P 0.00 4.68 0.00 2.20 2.00 0.00 3.63 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 97 I 8.48 3.68 1.85 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.50 0.88 0.00 0.00 98 D 8.01 4.47 0.00 2.69 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 T 7.42 3.87 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 100 K 8.14 4.93 0.00 1.75 1.50 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.24 0.99 7.81 101 P 0.00 4.36 0.00 1.90 1.98 0.00 3.59 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 2.11 0.00 102 Q 8.15 4.72 0.00 1.73 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.89 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 103 T 8.26 4.16 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 1.13 0.00 0.00 104 H 8.50 5.11 0.00 3.37 3.51 0.00 5.60 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 0.00 105 A 8.06 4.32 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 0.00 106 G 8.96 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 8.84 4.38 0.00 3.26 3.29 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 0.00 108 L 10.08 3.72 0.00 1.68 1.75 1.06 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 109 G 8.48 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 0.00 110 L 8.09 3.95 0.00 0.80 0.62 0.75 -0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 111 F 7.89 4.78 0.00 3.21 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 0.00 112 N 8.47 5.31 0.00 2.73 2.58 0.00 0.00 6.87 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 E 8.40 3.63 0.00 1.97 1.94 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 2.25 1.92 0.00 114 N 7.77 4.77 0.00 2.74 2.67 0.00 0.00 6.52 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 E 8.44 4.30 0.00 1.98 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.87 0.00 *118 D 8.47 4.33 0.00 2.72 2.53 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 0.00 119 Q 8.57 4.42 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.65 0.00 0.00 0.00 0.00 0.00 2.26 1.91 0.00 120 V 8.26 4.81 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 0.92 0.00 0.00 0.71 0.00 0.00 121 V 8.90 5.07 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 1.14 0.00 0.00 1.00 0.00 0.00 122 A 9.67 5.27 1.37 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 0.00 0.00 0.00 123 V 8.86 4.93 2.37 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 0.91 0.00 0.00 1.15 0.00 0.00 124 E 9.32 5.01 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.38 0.00 125 F 9.43 4.94 0.00 3.09 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 9.28 5.28 0.00 2.78 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 0.00 0.00 0.00 0.00 127 T 8.72 4.47 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 1.05 0.00 0.00 128 F 9.27 4.32 0.00 2.96 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 R 7.17 3.82 0.00 1.87 1.76 0.00 3.31 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.22 0.00 130 N 8.67 4.37 0.00 1.44 1.42 0.00 0.00 6.64 7.93 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 0.00 131 S 7.49 4.06 0.00 3.97 3.92 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 0.00 132 W 7.06 4.52 0.00 3.32 3.40 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 0.00 133 D 6.92 4.66 0.00 2.54 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 4.74 0.00 2.08 1.99 0.00 3.49 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 1.55 1.80 0.00 135 P 0.00 4.15 0.00 2.16 2.05 0.00 3.77 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 1.96 1.95 0.00 136 N 8.67 4.74 0.00 2.95 2.98 0.00 0.00 7.06 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 0.00 137 P 0.00 4.77 0.00 1.90 1.87 0.00 3.55 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 1.89 1.91 0.00 138 H 9.01 5.71 0.00 3.37 3.47 0.00 5.20 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 I 8.58 5.22 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 1.17 0.57 0.00 0.00 140 G 8.23 4.47 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 0.00 141 I 8.50 4.98 1.90 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 1.27 0.73 0.99 0.00 0.00 142 N 9.57 5.05 0.00 2.84 2.84 0.00 0.00 6.11 7.72 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 0.00 143 V 8.29 4.04 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 1.04 0.00 0.00 0.98 0.00 0.00 144 N 9.46 5.02 0.00 2.93 2.96 0.00 0.00 6.70 7.65 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 0.00 145 S 6.75 3.89 0.00 3.39 3.42 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 0.00 146 I 7.30 3.03 1.34 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 0.24 0.44 -0.41 0.00 0.00 147 R 7.39 4.20 0.00 1.83 1.75 0.00 3.34 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.46 0.00 148 S 8.65 5.01 0.00 3.90 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 0.00 149 I 8.56 3.92 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.54 0.90 0.00 0.00 150 K 7.47 4.49 0.00 2.10 1.63 0.00 1.88 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.25 1.29 7.81 151 T 8.45 5.18 4.35 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 1.24 0.00 0.00 152 T 9.52 4.72 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 1.31 0.00 0.00 153 S 8.91 4.59 0.00 3.43 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 0.00 154 W 8.73 5.13 0.00 3.26 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 0.00 155 D 9.24 4.75 0.00 2.96 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 0.00 156 L 6.92 4.10 0.00 1.85 0.13 -0.24 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 157 A 8.01 4.19 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.74 3.14 0.00 2.88 2.63 0.00 0.00 7.28 6.71 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 0.00 159 N 8.08 4.23 0.00 2.91 2.76 0.00 0.00 6.98 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 0.00 160 K 7.34 4.41 0.00 1.71 1.77 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.36 7.81 161 V 8.32 3.99 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 0.69 0.00 0.00 0.94 0.00 0.00 162 A 8.34 4.15 -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 0.00 163 K 9.15 4.61 0.00 1.59 1.52 0.00 1.52 0.00 0.00 1.52 0.00 0.00 2.74 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.21 1.25 7.81 164 V 7.96 4.72 0.78 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 0.86 0.00 0.00 0.64 0.00 0.00 165 L 9.01 5.12 0.00 1.64 1.39 0.92 0.86 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 0.00 166 I 9.06 5.29 1.92 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.77 1.20 0.00 0.00 167 T 9.13 4.95 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 168 Y 8.60 4.60 0.00 2.05 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 D 7.95 4.51 0.00 2.54 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 A 8.19 3.97 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 S 8.35 4.20 0.00 3.93 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 0.00 172 T 7.73 4.17 4.13 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 1.13 0.00 0.00 173 S 8.06 3.69 0.00 4.00 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 0.00 174 L 7.21 5.01 0.00 1.64 1.34 0.94 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 175 L 9.07 5.26 0.00 2.09 1.78 1.26 0.83 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 0.00 176 V 9.07 4.95 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 1.04 0.00 0.00 0.89 0.00 0.00 177 A 9.50 5.37 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 0.00 178 S 9.30 5.15 0.00 3.83 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 0.00 179 L 9.53 5.14 0.00 1.73 1.50 0.57 0.55 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 0.00 180 V 8.99 4.87 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 0.93 0.00 0.00 0.93 0.00 0.00 181 Y 8.81 4.72 0.00 2.90 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 0.00 182 P 0.00 4.34 0.00 2.12 2.12 0.00 4.05 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.97 0.00 183 S 8.26 4.17 0.00 3.63 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 0.00 184 Q 8.06 4.54 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.75 0.00 0.00 0.00 0.00 0.00 2.24 2.21 0.00 185 R 7.62 3.94 0.00 1.92 1.85 0.00 3.20 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.45 0.00 186 T 7.75 5.06 4.35 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 1.45 0.00 0.00 187 S 8.48 5.29 0.00 3.86 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 0.00 188 N 9.55 5.24 0.00 2.75 2.78 0.00 0.00 6.45 6.90 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 0.00 189 I 8.21 5.18 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 1.24 1.07 0.93 0.00 0.00 190 L 8.73 4.72 0.00 1.78 1.55 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 191 S 8.37 5.15 0.00 3.84 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 0.00 192 D 8.96 4.55 0.00 2.71 2.53 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 0.00 193 V 8.31 4.72 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 0.78 0.00 0.00 0.94 0.00 0.00 194 V 8.65 4.41 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.03 0.00 0.00 195 D 8.79 4.66 0.00 2.78 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 L 8.66 3.95 0.00 1.66 1.74 0.76 0.65 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 0.00 197 K 7.83 2.48 0.00 1.39 0.77 0.00 0.98 0.00 0.00 1.50 0.00 0.00 2.75 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.30 0.86 7.81 198 T 7.28 4.05 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 1.26 0.00 0.00 199 S 7.72 4.78 0.00 4.02 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 0.00 200 L 7.35 4.68 0.00 2.01 1.66 0.95 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 201 P 0.00 4.74 0.00 2.36 2.09 0.00 3.87 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 2.15 2.04 0.00 202 E 8.30 2.98 0.00 1.77 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 1.47 1.60 0.00 203 W 8.08 5.24 0.00 3.04 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 0.00 204 V 9.23 4.81 2.17 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 0.87 0.00 0.00 0.89 0.00 0.00 205 R 9.14 5.04 0.00 1.62 1.70 0.00 3.05 0.00 0.00 3.52 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 206 I 7.11 4.70 1.27 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.21 0.38 0.00 0.00 207 G 5.75 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 F 8.38 5.39 0.00 2.71 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 0.00 209 S 9.60 5.30 0.00 3.63 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 0.00 210 A 8.56 5.00 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 0.00 211 A 8.78 5.27 1.28 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 0.00 0.00 0.00 212 T 8.21 4.82 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 1.36 0.00 0.00 213 G 8.45 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 L 8.73 4.33 0.00 1.59 1.62 1.00 1.21 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 0.00 215 D 8.03 4.74 0.00 2.80 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 0.00 216 I 7.01 4.70 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.86 0.90 0.00 0.00 217 P 0.00 4.28 0.00 2.20 2.48 0.00 3.91 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 1.97 1.96 0.00 218 G 9.03 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 0.00 219 E 9.16 5.75 0.00 2.06 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 1.90 1.92 0.00 220 S 8.78 4.57 0.00 4.03 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 0.00 221 H 8.58 5.31 0.00 3.11 3.28 0.00 5.77 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 D 9.20 5.17 0.00 2.74 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 V 8.54 4.41 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 0.41 0.00 0.00 0.11 0.00 0.00 224 L 9.40 4.62 0.00 1.77 1.84 0.99 0.96 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 0.00 225 S 8.14 4.91 0.00 4.12 4.07 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 0.00 226 W 8.98 5.76 0.00 3.58 3.17 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 0.00 227 S 10.07 4.45 0.00 3.61 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 0.00 228 F 7.87 5.05 0.00 2.07 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 0.00 229 A 7.70 4.76 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 S 8.82 4.94 0.00 3.80 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 0.00 231 N 9.08 5.53 0.00 2.74 2.57 0.00 0.00 6.69 6.10 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 0.00 232 L 9.02 5.00 0.00 1.68 1.39 0.92 0.69 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 0.00 233 P 0.00 4.92 0.00 2.11 2.05 0.00 3.83 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 1.94 1.96 0.00 *234 H 8.49 4.44 0.00 2.96 2.87 0.00 7.23 0.00 0.00 0.00 0.00 6.91 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.