NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.3544 8.3444 119.6380 55.8102 30.0437 173.9976 2 V 4.0976 8.3695 124.9590 61.9362 32.5880 173.5870 3 Q 4.7427 9.9652 126.8899 54.1832 34.0415 173.6503 4 L 5.1888 8.4537 120.4895 53.1186 45.4750 175.6033 5 K 4.8198 10.1202 123.6388 54.5027 36.0284 175.0738 6 E 5.7277 9.1177 121.7661 53.6723 31.3682 175.4001 7 S 4.8334 8.4612 117.2762 57.0600 66.9338 173.0387 8 G 4.1853 8.1633 106.4875 45.9552 0.0000 171.1759 9 P 4.5840 0.0000 0.0000 61.6507 31.6741 176.1156 10 G 4.0341 7.8840 111.1994 45.5395 0.0000 173.1876 11 L 5.3532 7.1859 120.5040 52.9013 45.7206 174.9575 12 V 4.5640 8.4637 113.4659 60.1629 36.8729 173.0494 13 A 4.4340 8.4684 124.3145 50.6329 20.0053 175.4282 14 P 4.2700 0.0000 0.0000 64.7089 31.7243 176.7917 15 S 4.4644 8.8820 116.4473 58.2076 62.1516 168.4746 16 Q 5.0029 7.7996 121.8346 55.9963 31.5172 174.2867 17 S 4.8775 8.4196 118.2917 58.0313 68.1958 172.8165 18 L 4.7870 8.4235 121.7644 53.9424 45.6773 174.0596 19 S 5.4759 8.4622 119.8474 55.7049 65.4098 173.1898 20 I 4.6502 7.8760 123.4372 59.5915 40.5023 174.5836 21 T 4.9251 8.2742 117.8576 61.2253 71.1338 173.2500 22 C 5.1941 8.9316 124.4332 55.1224 43.9290 172.6789 23 T 4.5688 9.0235 124.8932 63.3599 69.1176 174.2787 24 V 4.6006 7.9858 125.8192 61.3384 34.8941 174.5869 25 S 4.4002 9.2503 119.3446 58.3153 65.9851 174.5382 26 G 4.0077 9.8415 109.8833 45.2381 0.0000 172.6040 27 F 4.9302 7.2269 111.5067 55.3422 40.8629 173.2207 28 S 4.5551 8.7531 112.5107 56.7946 65.6156 175.0158 29 L 4.5761 8.5000 123.6705 56.2174 42.1947 179.5636 30 T 4.0319 7.7564 108.4191 64.7872 68.6465 175.5476 31 N 4.3525 8.1431 117.6274 54.5928 39.1651 174.1732 32 Y 4.7930 7.8622 115.0129 56.0308 42.4772 173.8405 33 G 4.2865 8.3970 107.1432 43.4612 0.0000 171.9987 34 V 4.6372 7.8226 121.6389 60.8442 35.0265 174.4513 35 D 5.0263 8.2990 126.6277 53.1371 43.4624 175.6135 36 W 4.8372 9.5219 121.0660 55.3399 31.1456 175.1392 37 V 5.0613 8.2652 124.5716 61.3625 33.9189 174.6254 38 R 5.4826 8.9369 120.8546 54.6462 33.3103 174.0072 39 Q 4.8101 8.2258 120.4054 53.3445 30.9317 171.7452 40 P 5.1791 0.0000 0.0000 61.2723 32.6639 174.0957 41 P 4.4524 0.0000 0.0000 63.9936 31.4835 176.8861 42 G 3.9051 8.9890 110.6657 45.8168 0.0000 172.5898 43 K 4.6398 7.9752 119.3026 54.3997 34.8375 175.2857 44 G 4.1341 8.1697 108.0772 43.6800 0.0000 173.1910 45 L 4.3550 8.3638 119.0386 55.4290 42.4421 177.1687 46 E 4.7053 9.5953 122.0537 53.9789 32.9449 175.0613 47 W 4.4463 9.1836 135.0000 58.1509 31.1545 175.1019 48 V 3.9249 8.9147 127.7788 63.7463 32.5707 175.4035 49 G 3.5647 6.3653 104.6376 45.5051 0.0000 171.8415 50 V 4.5180 7.5288 118.0375 59.8820 35.2795 174.7065 51 I 4.7264 7.9903 121.9183 58.7764 40.5575 174.6221 52 W 4.3834 8.4558 129.8044 56.3516 30.2754 177.6088 53 S 4.9339 8.3493 112.6859 58.9350 62.2851 174.4720 54 G 4.1966 8.1930 110.5846 45.7370 0.0000 175.5471 55 G 4.0669 8.6390 107.6738 45.4327 0.0000 174.5349 56 S 4.7112 7.8847 115.7337 58.2668 63.7210 172.9166 57 T 5.3343 8.6073 115.8080 58.9132 71.4230 172.6503 58 N 5.4102 8.8745 121.7873 51.8174 42.0092 173.0434 59 Y 4.8624 8.7392 118.6161 55.5980 42.3069 174.5960 60 N 4.8159 8.5408 119.7601 53.9393 39.4624 175.7194 61 S 4.1424 9.4038 122.9011 61.9549 63.0379 175.7572 62 A 4.2494 8.0779 119.8804 53.9948 18.2444 178.3834 63 L 4.6031 8.0927 114.1877 56.4209 42.5027 177.4188 64 M 3.4788 8.3534 120.3199 58.6525 30.9561 177.9132 65 S 4.4341 7.9332 111.1590 59.0808 63.6017 174.1698 66 R 4.5671 8.8532 119.7144 55.8011 32.4408 175.0466 67 L 4.7208 7.6409 119.1166 52.7179 44.4982 177.1060 68 S 6.1078 8.1604 124.3479 59.4672 63.2154 174.3285 69 I 4.1996 8.9265 128.1499 61.8984 37.5877 175.3647 70 S 4.9430 8.4627 123.4822 57.2595 66.3148 172.5460 71 K 3.9825 8.0184 119.3781 56.2383 34.9061 174.7635 72 D 4.6894 8.4603 123.4623 51.7906 41.5215 175.2813 73 N 4.1654 8.7308 121.1742 56.1429 39.1258 177.6566 74 S 4.1322 7.7159 111.1435 61.2347 62.8954 175.5055 75 K 4.2652 8.5060 117.2296 55.9023 32.2827 176.5401 76 S 3.6054 7.4253 114.4186 59.6411 61.2819 171.3964 77 Q 4.7274 7.6815 116.3277 54.2422 32.2260 175.4399 78 V 4.1876 8.1841 122.5320 60.8665 32.3184 174.9643 79 F 5.0200 7.1140 125.0059 57.3545 40.9827 174.5297 80 L 4.5869 7.9161 120.5600 55.1868 44.0540 174.6467 81 K 4.1772 8.3845 124.9399 56.2087 33.8100 176.2348 82 M 5.4504 8.0272 118.0747 55.5537 33.9136 174.2965 82A N 4.9134 8.7890 122.1458 52.4564 39.8389 175.8697 82B S 3.8412 7.9823 111.1166 59.2060 59.6801 172.1265 82C L 4.1272 9.1604 127.0286 55.4965 42.7554 176.7731 83 Q 4.8876 8.9503 118.3920 54.9472 33.0232 175.9353 84 T 4.0835 8.4670 113.1382 64.0968 67.5259 174.4716 85 D 4.8298 7.9444 118.5764 53.5114 39.7709 176.4684 86 D 4.6029 7.8850 118.8297 55.5537 41.2526 176.3232 87 T 4.3529 8.0787 117.2030 63.9080 69.5433 173.1464 88 A 4.7553 8.5518 126.7841 52.1574 23.1454 174.2027 89 V 4.4099 7.9527 118.5536 62.2398 33.3239 174.4328 90 Y 4.9215 9.6026 126.8150 56.4184 38.9231 174.3425 91 Y 4.9398 8.5993 122.5123 57.6553 40.1449 172.5174 92 C 4.4847 9.3723 117.5118 53.6696 39.2373 172.7869 93 A 4.7982 7.8420 126.1227 50.1260 21.2097 175.3037 94 K 4.5376 8.2212 120.7685 54.6855 35.1045 175.0750 95 H 4.8058 8.4227 123.4235 55.6454 28.6772 175.0728 96 W 4.6644 8.7979 132.0947 57.4330 32.4006 176.2435 97 G 3.4332 8.3497 107.8440 44.2741 0.0000 174.0835 98 G 3.2621 7.0668 102.4279 48.4215 0.0000 173.5628 99 Y 4.2097 8.9342 115.4127 57.2638 41.5077 176.6538 100 Y 4.3701 9.3831 121.0782 54.1952 38.2340 175.6830 100A I 5.0211 7.2645 125.3240 60.4151 38.5722 171.4579 100B P 4.6627 0.0000 0.0000 62.2845 31.6644 177.0817 100C Y 4.2378 9.2779 122.3390 59.0600 38.3175 177.2261 100D G 4.4298 7.1749 111.9020 45.4402 0.0000 172.2029 100E M 4.1209 8.2655 121.2721 54.3095 29.3719 175.9515 101 D 3.9072 7.6535 118.5055 56.4495 41.3459 175.4046 102 H 5.0084 8.0666 111.0167 53.7588 32.2296 172.5668 103 W 4.8949 8.9654 122.9506 54.5472 31.4972 176.3829 104 G 4.1577 8.4179 110.9928 46.3037 0.0000 173.2837 105 Q 4.2877 8.8537 117.0864 59.4204 29.1657 176.0993 106 G 3.8453 8.7475 107.7138 43.9035 0.0000 172.7105 107 T 4.4762 8.4699 119.9141 61.0624 69.1410 173.3662 108 T 4.8028 8.4218 125.2114 62.2595 70.3315 174.1811 109 V 4.4927 8.7395 125.4262 61.4007 34.6516 174.0648 110 T 4.6619 9.0524 125.0259 61.7150 71.2063 173.3090 111 V 4.8537 7.6862 126.4506 61.1087 32.8446 174.3313 112 S 4.6079 8.3122 121.3666 57.8680 65.0898 175.2131 113 S 4.1488 8.7764 116.7996 61.2577 62.9047 174.6138 114 A 3.8522 7.4125 123.8353 50.9770 18.8622 176.4505 115 K 4.6478 8.0145 118.3081 54.3041 34.8642 176.0208 116 T 4.2760 8.5453 116.7386 65.2204 68.5626 173.5466 117 T 4.6772 9.1653 124.9377 61.1697 70.0983 173.4297 118 P 4.6920 0.0000 0.0000 62.0173 32.4797 174.1765 119 P 4.7396 0.0000 0.0000 62.5566 33.1219 175.7596 120 S 4.3219 9.0899 115.5563 56.5992 66.0187 173.7797 121 V 3.9783 8.0674 125.3211 62.5804 32.4643 174.9219 122 Y 5.2205 8.2707 124.6233 55.6753 41.8310 173.1248 123 P 4.7426 0.0000 0.0000 62.9417 32.5426 176.5860 124 L 4.7001 9.6375 123.5283 53.0687 41.4456 174.5773 125 A 4.6151 8.0416 123.3425 49.3350 21.5160 175.0062 126 P 4.7801 0.0000 0.0000 61.6429 33.0304 177.4692 127 G 3.9293 8.5023 111.4070 45.8349 0.0000 172.3609 128 C 4.3682 8.5213 117.7219 60.7990 32.3062 175.5168 129 G 3.7137 8.2569 107.9604 48.4389 0.0000 173.6173 130 D 4.5313 7.7780 120.2291 53.0520 42.3147 175.6702 126 T 4.7101 7.8404 112.9698 60.1429 70.7305 174.8692 127 T 4.3193 8.3223 116.2069 62.5349 70.3338 172.1609 128 G 3.7782 8.5313 107.9219 47.6990 0.0000 175.8168 129 S 4.2237 8.2369 114.8604 61.6389 63.6328 173.3174 130 S 4.3613 7.7480 115.5291 57.1520 65.0147 173.9702 138 V 4.5449 9.0352 120.7920 61.5248 35.0037 174.2992 139 T 4.7777 8.1698 119.1304 61.8105 71.3919 173.3538 140 L 4.6119 8.2319 125.1070 53.5319 47.1517 174.8864 141 G 4.2998 7.6177 103.3803 46.9715 0.0000 171.3052 142 C 5.6399 9.0284 116.5290 55.2368 40.5413 173.5332 143 L 4.5504 9.5279 126.8080 53.7965 42.8559 175.5876 144 V 4.2803 8.4510 128.3816 61.9588 32.3780 174.6016 145 K 4.8885 9.4981 130.8225 54.9542 35.7305 175.6845 146 G 4.0120 8.4888 111.7226 47.0917 0.0000 173.0348 147 Y 5.2913 7.5953 116.5715 55.3763 41.4161 174.4895 148 F 5.0230 9.9696 121.7600 57.1484 43.5910 171.9885 149 P 3.8126 0.0000 0.0000 60.9066 33.8153 174.7322 150 E 4.3405 8.2185 119.1896 56.0121 29.9402 173.9997 151 P 4.8636 0.0000 0.0000 61.2893 33.7772 174.0702 152 V 4.3664 7.5896 111.7376 60.2248 34.1582 175.6812 153 T 4.3179 9.0071 116.8763 61.4584 70.2835 172.9992 154 V 4.4513 8.1953 128.9303 61.8203 34.0081 174.6568 *156 T 4.6675 8.0886 120.0756 63.4357 70.2558 172.7369 157 W 4.9103 8.5976 126.1982 54.7283 31.1701 176.8739 *162 N 4.8111 8.1933 122.5409 53.9151 39.1817 174.5983 163 S 3.8046 9.0949 105.2326 59.1981 60.0217 172.8149 164 G 4.0187 8.2571 106.9739 45.1025 0.0000 175.9153 165 S 4.0350 8.1853 113.6436 59.7109 62.6935 173.7486 166 L 4.6413 6.9380 119.3542 54.2558 42.6931 175.8098 167 S 4.4484 8.0632 115.1765 58.4384 66.2436 175.8927 168 S 4.0772 8.1994 114.0734 59.6220 61.9334 173.6258 169 S 3.2939 8.2320 123.9405 59.2513 59.5113 171.4177 *171 V 4.1758 7.3814 117.2512 63.1177 32.6364 174.4497 172 H 4.8587 9.6182 126.1873 54.2164 31.6786 173.5397 173 T 4.8086 8.0796 117.7724 61.7070 71.4856 173.3753 174 F 4.8062 8.8801 124.6581 55.1099 41.2592 173.4724 175 P 4.4054 0.0000 0.0000 61.8759 32.2601 174.9581 176 A 5.1215 8.3798 121.5199 49.9896 20.6864 176.6625 177 L 4.8010 8.5882 121.6279 53.0227 45.1509 175.3084 178 L 4.4582 8.0115 121.9010 54.5657 43.9393 175.6084 179 Q 4.1276 9.0467 119.5993 56.1362 32.8651 174.1119 180 S 3.3629 8.4854 121.7280 59.8615 60.4281 173.0110 *183 G 3.7262 7.9489 105.7172 44.8619 0.0000 172.9767 184 L 4.7984 7.5335 118.4708 52.6762 46.2550 175.8136 185 Y 5.1091 8.6138 119.8228 57.8756 39.2052 175.3826 186 T 4.8689 8.3841 118.6163 63.1745 72.8708 172.6011 187 M 5.1267 9.3586 124.0696 53.6406 35.5029 174.3178 188 S 5.2140 8.5324 110.9492 57.2074 67.0371 173.0960 189 S 5.5481 9.2827 116.4870 56.6704 65.6017 172.6141 190 S 5.3121 9.4307 121.6888 56.4660 66.0817 173.3254 191 V 4.6487 8.8945 122.5026 60.3289 34.2624 174.1469 192 T 4.9178 9.4209 122.5905 62.1137 69.9858 174.7162 193 V 4.5301 8.8132 118.6256 58.6942 36.3567 172.9496 194 P 4.5855 0.0000 0.0000 63.3353 31.9480 177.7680 195 S 4.1526 8.8950 119.3343 61.4470 63.2435 176.3066 196 S 4.3129 7.6488 114.3709 60.3536 63.0305 175.7509 *198 T 4.6843 7.6851 110.3692 61.0366 70.4101 173.2152 199 W 5.2947 7.7533 130.1976 55.4257 33.4841 172.6036 200 P 2.9700 0.0000 0.0000 63.0393 30.5849 177.0299 *202 S 4.3211 7.6673 112.6626 57.3609 63.9319 173.5415 203 Q 4.5297 8.7249 121.1100 54.5472 31.5934 174.6866 204 T 4.4057 8.4024 116.5358 61.1706 67.0461 174.0459 205 V 5.0390 8.4371 128.6933 62.4922 33.3367 174.5523 206 T 5.6829 8.8209 118.8486 63.6643 72.9965 171.4627 *208 C 4.2549 8.5862 118.9503 55.1240 44.1287 172.2316 209 S 5.1407 8.1813 117.9441 56.3883 64.5880 172.5663 210 V 4.4973 8.4903 128.3914 61.3879 32.8578 174.4525 211 A 5.1766 9.4965 130.3472 50.4195 21.5783 175.7176 212 H 5.0324 8.1984 115.7689 54.6840 31.3673 172.2750 213 P 4.1655 0.0000 0.0000 64.9914 31.9583 178.4278 214 A 3.8895 7.8227 120.1960 54.5829 18.1844 177.9493 215 S 4.5784 7.9571 106.9860 57.1564 64.0707 176.1578 216 S 3.9954 8.2971 118.0062 59.4403 63.3747 171.1397 217 T 4.1308 7.6972 110.0668 62.7451 69.7422 173.5708 218 T 5.3990 8.1442 117.8671 62.1303 73.4000 172.7812 219 V 4.4942 8.3183 125.0162 61.1780 34.7477 173.4902 220 D 5.1111 8.7350 127.9094 52.8861 42.0467 175.7736 221 K 4.5310 9.5445 126.5417 54.8154 34.5355 174.8185 222 K 5.1038 8.4643 126.0777 54.0396 34.4460 174.9818 223 L 4.7119 8.4512 126.0637 53.3799 43.6500 175.7314 *226 E 4.6166 8.5338 121.7700 55.5868 30.6107 174.0185 227 P 4.6258 0.0000 0.0000 62.9021 32.2109 176.4215 228 R 4.1917 7.9892 118.1339 57.1820 30.9428 175.4848 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 Q 8.34 4.35 0.00 1.95 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 2 V 8.37 4.10 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 0.53 0.00 0.00 1.06 0.00 0.00 3 Q 9.97 4.74 0.00 1.92 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.53 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 4 L 8.45 5.19 0.00 1.62 1.52 0.99 0.64 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 5 K 10.12 4.82 0.00 1.83 1.67 0.00 1.50 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.44 7.81 6 E 9.12 5.73 0.00 1.88 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 2.44 2.23 0.00 7 S 8.46 4.83 0.00 3.86 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 8 G 8.16 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.58 0.00 2.18 2.05 0.00 3.70 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.00 0.00 10 G 7.88 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.19 5.35 0.00 1.57 1.50 1.32 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.46 4.56 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 0.76 0.00 0.00 0.94 0.00 0.00 13 A 8.47 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 14 P 0.00 4.27 0.00 2.05 2.06 0.00 3.72 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 15 S 8.88 4.46 0.00 4.15 4.36 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 16 Q 7.80 5.00 0.00 2.21 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.65 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 17 S 8.42 4.88 0.00 3.67 3.65 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 18 L 8.42 4.79 0.00 1.62 1.27 0.79 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.46 5.48 0.00 3.81 3.71 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 20 I 7.88 4.65 1.55 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.75 1.16 0.00 0.00 21 T 8.27 4.93 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 1.35 0.00 0.00 22 C 8.93 5.19 0.00 2.77 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 23 T 9.02 4.57 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 24 V 7.99 4.60 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 -0.09 0.00 0.00 0.89 0.00 0.00 25 S 9.25 4.40 0.00 3.80 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 26 G 9.84 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 27 F 7.23 4.93 0.00 2.82 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 28 S 8.75 4.56 0.00 3.84 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 29 L 8.50 4.58 0.00 1.93 1.68 0.78 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.76 4.03 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 1.22 0.00 0.00 31 N 8.14 4.35 0.00 2.89 2.42 0.00 0.00 6.65 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 32 Y 7.86 4.79 0.00 3.41 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 33 G 8.40 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 34 V 7.82 4.64 1.88 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 0.59 0.00 0.00 0.88 0.00 0.00 35 D 8.30 5.03 0.00 2.50 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 36 W 9.52 4.84 0.00 3.02 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 37 V 8.27 5.06 2.44 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 1.39 0.00 0.00 0.89 0.00 0.00 38 R 8.94 5.48 0.00 0.86 1.62 0.00 2.83 0.00 0.00 3.08 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.15 0.00 39 Q 8.23 4.81 0.00 2.27 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.01 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 40 P 0.00 5.18 0.00 2.18 2.21 0.00 4.10 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 41 P 0.00 4.45 0.00 2.11 2.10 0.00 3.81 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 42 G 8.99 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 43 K 7.98 4.64 0.00 1.92 1.79 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.39 1.37 7.81 44 G 8.17 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 0.00 0.00 0.00 0.00 45 L 8.36 4.35 0.00 1.64 1.81 0.99 0.88 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 46 E 9.60 4.71 0.00 1.94 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 0.00 2.28 2.40 0.00 47 W 9.18 4.45 0.00 3.29 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 48 V 8.91 3.92 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 0.80 0.00 0.00 0.94 0.00 0.00 49 G 6.37 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 V 7.53 4.52 2.46 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 0.95 0.00 0.00 -0.00 0.00 0.00 51 I 7.99 4.73 1.83 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 1.21 1.63 0.89 0.00 0.00 52 W 8.46 4.38 0.00 3.51 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 53 S 8.35 4.93 0.00 4.20 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 0.00 54 G 8.19 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.64 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 0.00 0.00 0.00 56 S 7.88 4.71 0.00 4.08 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 57 T 8.61 5.33 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 58 N 8.87 5.41 0.00 3.16 3.11 0.00 0.00 6.92 7.48 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 59 Y 8.74 4.86 0.00 2.86 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.54 4.82 0.00 3.00 2.80 0.00 0.00 7.63 7.71 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 61 S 9.40 4.14 0.00 4.00 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 62 A 8.08 4.25 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 63 L 8.09 4.60 0.00 1.79 1.83 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 64 M 8.35 3.48 0.00 2.39 2.23 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.87 0.00 65 S 7.93 4.43 0.00 3.96 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 66 R 8.85 4.57 0.00 1.65 1.90 0.00 3.09 0.00 0.00 3.16 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.65 0.00 67 L 7.64 4.72 0.00 1.65 1.79 0.98 1.26 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 68 S 8.16 6.11 0.00 4.01 4.02 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 69 I 8.93 4.20 1.80 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.50 1.22 0.00 0.00 70 S 8.46 4.94 0.00 4.23 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 71 K 8.02 3.98 0.00 1.52 1.53 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.11 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.23 1.27 7.81 72 D 8.46 4.69 0.00 3.09 2.56 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 0.00 0.00 0.00 0.00 73 N 8.73 4.17 0.00 2.79 2.89 0.00 0.00 7.01 7.15 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 74 S 7.72 4.13 0.00 4.08 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.51 4.27 0.00 2.16 1.91 0.00 1.78 0.00 0.00 2.19 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.48 7.81 76 S 7.43 3.61 0.00 3.85 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.68 4.73 0.00 2.04 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.89 0.00 0.00 0.00 0.00 0.00 2.49 2.36 0.00 78 V 8.18 4.19 1.96 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 1.04 0.00 0.00 0.76 0.00 0.00 79 F 7.11 5.02 0.00 2.88 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 80 L 7.92 4.59 0.00 0.95 0.67 -0.09 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 81 K 8.38 4.18 0.00 1.63 1.72 0.00 1.90 0.00 0.00 2.25 0.00 0.00 2.66 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.21 7.81 82 M 8.03 5.45 0.00 1.96 1.78 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.15 0.00 82A N 8.79 4.91 0.00 2.61 2.75 0.00 0.00 7.50 7.57 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 82B S 7.98 3.84 0.00 3.92 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 82C L 9.16 4.13 0.00 1.69 1.60 0.89 0.63 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 83 Q 8.95 4.89 0.00 2.27 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 84 T 8.47 4.08 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 85 D 7.94 4.83 0.00 2.83 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 86 D 7.88 4.60 0.00 3.02 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.08 4.35 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 88 A 8.55 4.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 7.95 4.41 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 0.51 0.00 0.00 0.89 0.00 0.00 90 Y 9.60 4.92 0.00 2.82 3.06 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 91 Y 8.60 4.94 0.00 3.17 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 C 9.37 4.48 0.00 2.14 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 93 A 7.84 4.80 0.09 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 0.00 0.00 0.00 0.00 0.00 94 K 8.22 4.54 0.00 1.38 1.56 0.00 0.61 0.00 0.00 0.81 0.00 0.00 2.23 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.10 1.10 7.81 95 H 8.42 4.81 0.00 3.14 3.21 0.00 5.68 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 W 8.80 4.66 0.00 3.34 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 97 G 8.35 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 98 G 7.07 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 0.00 0.00 0.00 99 Y 8.93 4.21 0.00 2.87 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 0.00 100 Y 9.38 4.37 0.00 2.81 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100A I 7.26 5.02 1.98 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 1.59 0.36 1.00 0.00 0.00 100B P 0.00 4.66 0.00 2.06 1.97 0.00 3.88 0.00 0.00 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.53 0.00 100C Y 9.28 4.24 0.00 2.92 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 100D G 7.17 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100E M 8.27 4.12 0.00 1.25 1.71 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.29 0.00 101 D 7.65 3.91 0.00 2.91 2.61 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 0.00 102 H 8.07 5.01 0.00 2.96 3.12 0.00 5.63 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 W 8.97 4.89 0.00 2.97 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 0.00 104 G 8.42 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 0.00 0.00 0.00 105 Q 8.85 4.29 0.00 2.24 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.20 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 106 G 8.75 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 0.00 0.00 0.00 107 T 8.47 4.48 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 108 T 8.42 4.80 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 109 V 8.74 4.49 2.13 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 0.84 0.00 0.00 0.63 0.00 0.00 110 T 9.05 4.66 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 111 V 7.69 4.85 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 1.10 0.00 0.00 0.96 0.00 0.00 112 S 8.31 4.61 0.00 3.96 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 0.00 113 S 8.78 4.15 0.00 3.94 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 A 7.41 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 K 8.01 4.65 0.00 1.77 1.78 0.00 1.82 0.00 0.00 1.90 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.38 7.81 116 T 8.55 4.28 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 1.35 0.00 0.00 117 T 9.17 4.68 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 1.25 0.00 0.00 118 P 0.00 4.69 0.00 2.09 2.09 0.00 3.81 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 119 P 0.00 4.74 0.00 1.96 1.89 0.00 3.68 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.79 0.00 120 S 9.09 4.32 0.00 3.72 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 8.07 3.98 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 0.67 0.00 0.00 0.80 0.00 0.00 122 Y 8.27 5.22 0.00 3.00 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 0.00 123 P 0.00 4.74 0.00 2.17 2.14 0.00 3.91 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 2.09 0.00 124 L 9.64 4.70 0.00 1.58 1.64 0.96 0.96 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 0.00 125 A 8.04 4.62 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 0.00 126 P 0.00 4.78 0.00 2.23 2.02 0.00 4.11 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 1.87 0.00 127 G 8.50 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.52 4.37 0.00 2.96 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.26 3.71 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 0.00 0.00 0.00 130 D 7.78 4.53 0.00 2.74 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 0.00 126 T 7.84 4.71 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 0.00 127 T 8.32 4.32 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 0.00 128 G 8.53 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 0.00 129 S 8.24 4.22 0.00 3.68 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 7.75 4.36 0.00 3.91 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 0.00 138 V 9.04 4.54 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 0.88 0.00 0.00 1.19 0.00 0.00 139 T 8.17 4.78 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 140 L 8.23 4.61 0.00 1.08 1.22 0.16 -1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 141 G 7.62 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 C 9.03 5.64 0.00 2.89 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 0.00 143 L 9.53 4.55 0.00 1.82 1.71 0.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 144 V 8.45 4.28 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 0.70 0.00 0.00 0.88 0.00 0.00 145 K 9.50 4.89 0.00 1.84 1.61 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.47 7.81 146 G 8.49 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 0.00 147 Y 7.60 5.29 0.00 2.88 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 0.00 148 F 9.97 5.02 0.00 3.02 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 0.00 149 P 0.00 3.81 0.00 1.58 0.80 0.00 3.78 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 150 E 8.22 4.34 0.00 1.69 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 1.47 1.47 0.00 151 P 0.00 4.86 0.00 2.08 1.95 0.00 3.63 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 1.82 1.89 0.00 152 V 7.59 4.37 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 -0.11 0.00 0.00 0.52 0.00 0.00 153 T 9.01 4.32 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 154 V 8.20 4.45 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.85 0.00 0.00 *156 T 8.09 4.67 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 1.22 0.00 0.00 157 W 8.60 4.91 0.00 3.32 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 *162 N 8.19 4.81 0.00 3.03 2.93 0.00 0.00 6.81 7.57 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 0.00 163 S 9.09 3.80 0.00 3.99 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 0.00 164 G 8.26 4.02 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 0.00 0.00 0.00 165 S 8.19 4.04 0.00 3.84 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 0.00 166 L 6.94 4.64 0.00 1.99 1.69 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 167 S 8.06 4.45 0.00 3.77 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 0.00 168 S 8.20 4.08 0.00 3.99 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 0.00 169 S 8.23 3.29 0.00 4.19 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 *171 V 7.38 4.18 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.83 0.00 0.00 172 H 9.62 4.86 0.00 2.94 2.58 0.00 5.81 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 T 8.08 4.81 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 174 F 8.88 4.81 0.00 3.06 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 0.00 175 P 0.00 4.41 0.00 2.13 2.09 0.00 3.78 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 2.10 2.17 0.00 176 A 8.38 5.12 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 L 8.59 4.80 0.00 1.63 1.61 0.94 0.61 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 0.00 178 L 8.01 4.46 0.00 1.23 1.36 0.43 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 179 Q 9.05 4.13 0.00 2.07 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 5.96 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 180 S 8.49 3.36 0.00 4.04 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 *183 G 7.95 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 L 7.53 4.80 0.00 1.69 1.46 0.97 1.00 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 0.00 185 Y 8.61 5.11 0.00 2.01 1.79 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 0.00 186 T 8.38 4.87 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 1.29 0.00 0.00 187 M 9.36 5.13 0.00 2.34 2.44 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 188 S 8.53 5.21 0.00 4.08 4.02 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 0.00 189 S 9.28 5.55 0.00 4.11 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 9.43 5.31 0.00 3.89 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 V 8.89 4.65 0.67 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 -0.70 0.00 0.00 0.62 0.00 0.00 192 T 9.42 4.92 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 1.20 0.00 0.00 193 V 8.81 4.53 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 0.71 0.00 0.00 0.88 0.00 0.00 194 P 0.00 4.59 0.00 2.09 2.02 0.00 3.61 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 2.13 2.16 0.00 195 S 8.89 4.15 0.00 4.07 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 S 7.65 4.31 0.00 3.90 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 0.00 *198 T 7.69 4.68 4.33 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 1.22 0.00 0.00 199 W 7.75 5.29 0.00 3.28 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 0.00 200 P 0.00 2.97 0.00 1.54 0.84 0.00 3.50 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.15 0.00 *202 S 7.67 4.32 0.00 3.82 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 0.00 203 Q 8.72 4.53 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 204 T 8.40 4.41 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 205 V 8.44 5.04 2.26 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 1.34 0.00 0.00 1.17 0.00 0.00 206 T 8.82 5.68 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 1.18 0.00 0.00 *208 C 8.59 4.25 0.00 1.44 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 0.00 209 S 8.18 5.14 0.00 3.84 3.70 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 0.00 210 V 8.49 4.50 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 0.78 0.00 0.00 0.75 0.00 0.00 211 A 9.50 5.18 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 0.00 212 H 8.20 5.03 0.00 3.03 3.02 0.00 5.62 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 P 0.00 4.17 0.00 2.13 2.06 0.00 3.57 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.06 0.00 214 A 7.82 3.89 1.09 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 0.00 0.00 0.00 0.00 0.00 215 S 7.96 4.58 0.00 4.04 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 0.00 216 S 8.30 4.00 0.00 4.01 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 0.00 217 T 7.70 4.13 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 218 T 8.14 5.40 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 219 V 8.32 4.49 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 1.07 0.00 0.00 0.86 0.00 0.00 220 D 8.74 5.11 0.00 2.51 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 K 9.54 4.53 0.00 1.65 1.64 0.00 1.49 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.45 7.81 222 K 8.46 5.10 0.00 1.84 1.73 0.00 1.98 0.00 0.00 1.56 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.65 1.29 7.81 223 L 8.45 4.71 0.00 1.89 1.70 1.21 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 *226 E 8.53 4.62 0.00 2.08 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 2.25 2.33 0.00 227 P 0.00 4.63 0.00 2.07 2.18 0.00 3.76 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.70 0.00 228 R 7.99 4.19 0.00 1.96 1.91 0.00 3.28 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 * Residues marked with a * may have inaccurate shift predictions.