NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9191 8.3544 109.7407 45.6778 0.0000 173.4461 2 H 4.6105 8.8084 123.2450 54.0990 31.9500 172.1884 3 L 4.5793 9.1118 129.3726 51.7467 42.1759 172.9377 4 P 4.2267 0.0000 0.0000 62.1020 31.8164 176.6248 5 K 3.9386 8.8086 124.4004 56.3463 32.4615 174.5399 6 P 4.8816 0.0000 0.0000 63.1710 32.6678 175.5102 7 T 4.6283 8.9609 118.6153 62.2088 70.3490 173.6433 8 L 5.3107 8.8211 128.7604 53.1955 44.3039 174.9158 9 W 5.3656 9.1191 123.2384 54.8761 32.2181 173.5149 10 A 4.9682 8.7196 119.4887 50.2914 21.8741 175.3736 11 E 4.8584 9.0733 119.9032 53.9676 32.5322 175.4396 12 P 4.3096 0.0000 0.0000 63.3243 32.0279 175.6167 13 G 3.9164 7.1488 107.0232 45.7888 0.0000 172.7977 14 S 4.3892 7.9112 111.8520 58.4208 64.4358 173.7089 15 V 4.3075 7.6169 120.7108 61.3727 33.0731 174.3027 16 I 4.6464 8.1253 129.3074 59.0505 40.5300 175.6631 17 T 4.7392 8.4384 116.9933 60.9048 69.9433 173.6212 18 Q 3.7021 8.2687 125.5718 57.8837 29.4231 176.1281 19 G 3.9218 8.4358 112.8304 45.3901 0.0000 174.1420 20 S 4.5184 7.5756 115.3124 57.3408 64.3018 172.3508 21 P 5.2351 0.0000 0.0000 62.2159 32.8024 175.6249 22 V 4.4455 8.2036 117.9289 61.1082 35.2193 172.3259 23 T 4.7419 9.1193 120.6569 61.7450 71.7430 172.9094 24 L 4.5136 8.3833 126.8579 53.8896 43.3153 176.0484 25 R 4.5654 8.2278 122.8598 54.1633 33.0288 174.4586 26 C 5.0624 8.6142 122.5376 54.9478 47.1208 172.3382 27 Q 4.7203 9.4364 127.4292 53.4112 32.5203 174.6078 28 G 4.1850 9.6755 115.7106 45.1641 0.0000 174.5142 29 G 3.6599 8.5445 111.0228 48.1230 0.0000 174.8989 30 Q 4.3742 7.3325 120.2379 54.5485 30.8375 175.4480 31 E 4.2111 8.7070 117.1487 59.5994 29.9474 177.3492 32 T 5.2407 7.2988 106.8900 61.5294 71.1272 172.5438 33 Q 4.3803 8.2312 123.9883 53.2358 33.5591 175.0051 34 E 4.5871 8.1311 120.8103 56.0751 27.3306 176.0144 35 Y 4.8567 7.6355 118.5421 58.2170 40.0051 176.8729 36 R 4.4544 9.0362 121.2187 54.8050 34.0567 173.7959 37 L 4.7816 8.3333 126.7123 53.8028 43.5723 175.0114 38 Y 4.8610 8.4306 122.2711 55.8963 41.6515 173.4739 39 R 4.3730 8.3457 120.7579 54.6913 32.3153 175.3583 40 E 4.3741 9.0078 124.1094 56.3918 30.8586 178.8096 41 K 4.0741 9.0972 120.0383 57.7192 31.5822 176.3341 42 K 4.4482 8.0449 118.6322 54.9037 35.3615 175.2389 43 T 3.7490 8.5457 120.9964 62.1004 68.1508 173.5203 44 A 4.5889 8.2011 131.3384 50.5442 18.9557 177.3566 45 L 3.9882 8.5951 122.9477 58.5763 41.8216 179.4104 46 W 4.3873 8.5335 116.0105 59.9711 27.3693 178.1637 47 I 3.0982 6.7847 120.2380 63.6925 36.1391 177.9041 48 T 4.0732 7.7611 109.6351 63.4784 68.9804 175.5190 49 R 4.2714 7.4147 118.8847 56.4426 30.5182 176.2939 50 I 4.0097 7.2599 120.5646 59.8745 37.7182 174.8582 51 P 4.3517 0.0000 0.0000 62.8785 33.2089 177.5384 52 Q 4.0414 8.5757 119.0984 58.7128 28.4199 178.9202 53 E 3.9250 8.0212 118.9665 59.2752 29.7306 178.8170 54 L 4.0174 7.6262 118.3074 57.5196 41.9521 179.0002 55 V 2.9159 7.2693 118.1338 66.1757 31.3228 178.2666 56 K 4.4302 7.9366 118.9307 58.4068 31.6341 178.4543 57 K 4.4558 8.0853 116.6386 55.7009 32.4989 177.1743 58 G 3.9903 8.2361 107.8601 46.5769 0.0000 172.6255 59 Q 4.6947 7.5299 117.4085 53.9287 30.9557 176.3867 60 F 4.8959 8.8663 121.7790 55.0011 40.1578 171.8739 61 P 4.7014 0.0000 0.0000 62.6350 32.8418 177.0342 62 I 4.0752 8.5979 122.4590 58.9876 39.6730 174.3322 63 P 3.9836 0.0000 0.0000 65.0221 31.3152 176.6129 64 S 4.5270 7.4053 114.5103 56.1490 64.5970 172.8665 65 I 3.5964 8.6084 129.3414 61.0261 39.3095 174.6847 66 T 4.3474 8.1305 116.7879 59.2982 72.5620 174.5278 67 W 4.4035 7.9332 120.1097 60.0746 29.0019 178.3596 68 E 4.1692 7.6824 116.5117 58.6408 29.1085 177.2019 69 H 4.4705 7.9818 114.4438 57.7447 29.2453 175.8907 70 A 4.2324 7.9568 122.1984 51.4565 18.8306 177.0537 71 G 3.4404 7.3599 109.9487 44.7485 0.0000 171.1834 72 R 4.6177 7.0011 119.9271 55.2731 31.1777 174.7299 73 Y 4.9299 8.9169 124.4342 56.7102 41.6190 174.8448 74 R 4.8596 8.0149 118.8979 55.9011 35.5965 171.2422 75 C 5.6273 8.9826 113.6862 56.2844 44.3611 171.9018 76 Y 5.1933 7.7239 116.5130 56.6033 41.0884 172.4370 77 Y 5.8170 8.1022 116.5889 55.0729 41.8367 174.3387 78 G 4.6031 9.0919 103.7136 45.1779 0.0000 172.7993 79 S 4.7305 8.4103 111.6012 56.5809 65.5205 176.7891 80 D 4.5820 8.5792 125.9574 54.2325 39.5573 177.2183 *82 A 4.1404 8.1250 119.9823 50.9617 20.5280 175.5498 83 G 3.4653 7.2647 103.9814 44.1437 0.0000 173.4357 84 R 5.1029 8.1522 122.8543 54.3456 31.9686 176.1307 85 S 4.3773 7.9558 116.4718 57.2907 64.7147 173.1357 86 E 4.2620 8.4097 119.7803 56.1402 30.1844 177.1189 87 S 4.9335 8.4931 117.1102 58.2620 63.8598 174.6530 88 S 4.5364 9.2481 119.1785 58.0570 63.8143 173.6769 89 D 4.5795 8.5852 119.9660 53.4325 41.1451 174.9147 90 P 4.7242 0.0000 0.0000 62.9206 32.6238 175.3623 91 L 4.6811 9.0568 123.2069 53.4559 44.8962 175.1159 92 E 4.7946 8.9516 126.8636 55.3569 30.5745 175.8958 93 L 4.3982 9.0147 129.1824 53.9958 43.2892 175.4169 94 V 4.5565 8.5972 127.4268 61.1960 33.9485 174.5767 95 V 4.8815 8.4830 126.4038 61.3397 34.2648 174.7361 96 T 5.0523 8.6922 118.0755 60.4946 71.6979 175.2568 97 G 4.0170 9.7418 110.4756 45.7458 0.0000 174.6000 98 A 3.5892 8.1468 124.0473 53.0571 18.9171 177.3146 99 Y 5.0104 7.4363 112.1185 55.4954 41.8087 174.2804 100 I 4.4057 8.4572 114.6023 60.8226 38.2725 176.2899 101 K 4.6198 8.9377 124.5142 55.9685 33.3494 174.7851 102 P 4.8131 0.0000 0.0000 62.5845 33.3445 174.5432 103 T 4.5813 9.2729 116.0463 60.3721 69.5103 172.7382 104 L 5.3114 8.4846 129.8926 53.3096 44.2371 175.3882 105 S 4.8841 9.0482 120.0226 56.2105 66.7892 173.1774 106 A 4.3879 8.5535 122.9724 52.2134 19.4743 177.6445 107 Q 4.3894 9.0746 120.2413 53.7325 30.3486 174.3577 108 P 4.4906 0.0000 0.0000 63.7475 31.9271 176.9519 109 S 4.5772 7.3956 109.5942 56.7063 64.5785 175.2138 110 P 4.3374 0.0000 0.0000 64.4932 32.1614 175.5550 111 V 4.5916 7.3788 119.4209 61.4599 32.3247 175.1845 112 V 4.5837 8.7127 121.4945 59.0809 35.9429 175.1767 113 N 4.8752 8.5398 120.4912 52.9684 39.5437 174.8120 114 S 4.2443 9.0197 118.7218 60.1174 62.8526 174.9957 115 G 3.9265 9.5427 115.5148 45.4577 0.0000 173.9131 116 G 3.9398 7.9564 107.7444 45.8011 0.0000 172.3147 117 N 5.7140 8.7601 116.3567 50.3347 41.9923 174.4080 118 V 4.7290 8.0482 120.3259 60.0151 35.6801 173.9472 119 I 4.8011 7.8921 121.3936 59.9783 39.1329 174.5871 120 L 5.0732 9.3347 127.8631 52.9703 44.3071 175.1469 121 Q 5.0200 9.0856 124.5347 54.3755 32.1661 173.1294 122 C 5.1963 9.1308 126.9632 55.1701 43.8206 171.6202 123 D 5.3611 9.4865 127.0083 52.4176 43.7277 174.6550 124 S 5.1761 8.4612 118.7854 56.5307 64.6788 174.2489 125 Q 4.2643 9.1525 125.0994 57.7552 28.8512 176.6634 126 V 4.3581 7.4587 110.6982 58.7309 35.5315 175.1268 127 A 4.0057 8.3627 126.0083 52.9089 18.6205 177.1072 128 F 4.6713 8.3385 119.9919 56.0845 42.9084 174.0099 129 D 4.8261 8.6910 122.9819 53.3561 40.2983 176.1992 130 G 3.4766 7.2833 106.0890 44.6694 0.0000 171.9654 131 F 5.0436 8.5668 119.6372 55.6317 44.1673 173.6112 132 S 5.0752 8.9251 114.2821 56.7057 66.2322 172.2514 133 L 4.7492 8.6543 128.3483 53.2724 44.6535 174.2130 134 C 5.6034 9.0854 123.1296 55.0972 43.8388 173.2839 135 K 3.8928 8.8505 126.2547 54.3935 31.3006 177.1277 136 E 4.3455 8.0433 132.6848 56.6646 26.8075 175.2557 *143 Q 4.3123 7.6062 118.9730 56.4788 31.2140 176.1235 144 C 6.2981 8.9812 114.2990 54.3748 45.3015 173.7902 145 L 5.1114 8.5687 120.6902 54.2515 43.1416 175.0420 146 N 5.5223 9.0363 118.9310 52.4912 41.1550 174.2737 147 S 4.7378 9.3568 115.4956 57.2226 66.3735 171.9116 148 Q 5.2102 8.2577 116.9626 53.2248 33.9255 174.2948 149 P 5.2024 0.0000 0.0000 63.8897 29.8125 178.1898 *152 R 4.0858 9.0372 117.0848 56.4081 31.4641 178.0758 153 G 3.6758 8.4249 110.2859 49.0656 0.0000 174.7253 154 S 4.5122 8.0448 111.0617 58.6265 64.6969 175.9337 155 S 3.9305 8.5321 113.6385 59.2352 62.5793 171.4256 156 R 4.6718 7.2053 115.0153 54.8350 32.9740 173.5421 157 A 4.6997 8.2805 121.4837 50.0095 22.6010 174.9738 158 I 4.7180 7.8785 121.0165 59.4676 39.5692 175.0958 159 F 4.8265 9.4220 125.8968 55.5111 42.5728 174.2659 160 S 4.9695 8.7864 116.7845 56.7097 64.2410 173.5219 161 V 4.2428 8.4983 122.1660 59.8246 32.5868 176.4096 162 G 4.4089 9.4678 113.2799 46.4009 0.0000 170.8083 163 P 4.4427 0.0000 0.0000 59.2714 29.7656 175.9054 164 V 2.8978 8.9833 127.4587 62.0291 32.4299 175.0850 165 S 4.9074 9.0548 121.4258 56.1608 65.6853 172.0756 166 P 4.5462 0.0000 0.0000 66.1198 31.2520 178.2935 167 S 3.8715 7.9922 112.9256 58.7020 63.5745 174.3252 *169 R 3.9024 7.8761 119.2046 57.1007 30.8317 174.4595 170 W 4.7167 8.4579 123.4938 54.6689 32.0276 173.3428 171 W 5.7483 8.2936 124.0907 55.1002 32.0504 174.4163 172 Y 5.4198 9.0619 119.8417 56.5938 42.3730 174.4836 173 R 5.0409 9.0438 120.2177 54.6013 34.8842 171.8897 174 C 5.4851 9.1821 116.5756 53.9477 44.8078 172.1019 175 Y 5.2144 8.9608 116.1348 56.3095 42.6670 174.1251 176 A 4.4749 8.3577 121.5486 50.3374 22.2983 174.7669 177 Y 4.6164 7.2240 117.1794 56.0705 42.4754 172.5663 178 D 5.2086 8.7541 119.1624 52.3887 42.7541 177.3393 179 S 4.4256 9.4179 121.0766 61.1215 63.1793 174.7057 180 N 4.7676 9.3334 118.3643 53.1717 38.8450 175.3758 181 S 4.7987 8.1593 109.7249 56.4250 64.3226 175.2160 182 P 3.7794 0.0000 0.0000 65.3769 31.3414 176.5492 183 Y 4.2582 7.9084 114.9265 57.6964 39.6628 174.6962 184 E 5.0327 8.3784 120.1524 54.8736 30.5024 175.8266 185 W 5.2411 9.1110 125.7692 55.4598 32.0293 176.9382 186 S 5.3706 8.6211 115.6506 57.9834 65.2259 173.4368 187 L 4.8594 8.7349 119.6325 54.4072 42.5739 175.3739 188 P 3.9744 0.0000 0.0000 62.4123 32.2920 176.1177 189 S 4.4927 8.0224 116.8928 57.6383 64.1803 173.6189 190 D 4.4588 8.4508 119.8950 53.9525 41.1451 176.3783 191 L 4.1908 8.1985 123.7207 55.3264 43.2498 176.3237 192 L 4.6156 9.2730 127.9194 53.1456 44.0838 174.3096 193 E 5.1535 8.6918 127.7094 55.7797 30.2916 175.7963 194 L 4.6727 9.4289 128.0217 54.2183 43.3376 176.3689 195 L 4.7493 10.6365 122.0836 52.9636 44.2001 175.9030 196 V 4.4198 8.4553 124.5467 62.3353 32.8154 175.7806 197 L 4.4644 8.8221 126.4702 54.9769 42.6451 176.3322 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 G 8.35 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 0.00 0.00 0.00 2 H 8.81 4.61 0.00 3.14 3.19 0.00 5.71 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 9.11 4.58 0.00 1.58 1.45 0.90 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.23 0.00 2.14 2.07 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.80 0.00 5 K 8.81 3.94 0.00 1.77 1.82 0.00 1.89 0.00 0.00 1.91 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.64 7.81 6 P 0.00 4.88 0.00 2.24 2.49 0.00 3.91 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 2.45 2.91 0.00 7 T 8.96 4.63 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 1.25 0.00 0.00 8 L 8.82 5.31 0.00 1.61 1.59 0.78 0.94 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 9 W 9.12 5.37 0.00 3.35 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 10 A 8.72 4.97 1.13 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 11 E 9.07 4.86 0.00 1.80 1.84 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 2.45 2.20 0.00 12 P 0.00 4.31 0.00 2.17 2.15 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 1.95 1.92 0.00 13 G 7.15 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 0.00 0.00 0.00 14 S 7.91 4.39 0.00 4.07 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 15 V 7.62 4.31 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 0.65 0.00 0.00 0.81 0.00 0.00 16 I 8.13 4.65 1.69 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 1.13 0.86 0.77 0.00 0.00 17 T 8.44 4.74 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 1.26 0.00 0.00 18 Q 8.27 3.70 0.00 1.53 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.45 0.00 0.00 0.00 0.00 0.00 1.81 1.16 0.00 19 G 8.44 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 0.00 0.00 0.00 20 S 7.58 4.52 0.00 3.78 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 5.24 0.00 1.97 2.04 0.00 3.32 0.00 0.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.73 0.00 22 V 8.20 4.45 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 0.42 0.00 0.00 0.87 0.00 0.00 23 T 9.12 4.74 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 24 L 8.38 4.51 0.00 1.55 1.33 0.49 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 25 R 8.23 4.57 0.00 0.67 0.66 0.00 2.89 0.00 0.00 2.89 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.03 0.00 26 C 8.61 5.06 0.00 2.69 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 27 Q 9.44 4.72 0.00 2.49 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.22 0.00 0.00 0.00 0.00 0.00 2.34 2.28 0.00 28 G 9.68 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.54 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 30 Q 7.33 4.37 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 7.08 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 31 E 8.71 4.21 0.00 1.96 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 2.31 2.29 0.00 32 T 7.30 5.24 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 1.21 0.00 0.00 33 Q 8.23 4.38 0.00 0.93 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.28 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 34 E 8.13 4.59 0.00 1.99 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 2.39 2.29 0.00 35 Y 7.64 4.86 0.00 3.19 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 36 R 9.04 4.45 0.00 0.94 1.07 0.00 3.15 0.00 0.00 3.13 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 0.00 37 L 8.33 4.78 0.00 0.27 0.62 0.65 0.23 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 38 Y 8.43 4.86 0.00 3.05 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 39 R 8.35 4.37 0.00 0.93 1.65 0.00 3.00 0.00 0.00 2.71 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.70 0.00 40 E 9.01 4.37 0.00 1.82 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 2.33 2.28 0.00 41 K 9.10 4.07 0.00 1.90 1.96 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.39 7.81 42 K 8.04 4.45 0.00 1.63 1.60 0.00 1.83 0.00 0.00 1.65 0.00 0.00 3.14 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.38 7.81 43 T 8.55 3.75 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 1.20 0.00 0.00 44 A 8.20 4.59 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 45 L 8.60 3.99 0.00 1.78 1.78 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 46 W 8.53 4.39 0.00 3.67 3.39 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 47 I 6.78 3.10 1.55 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.72 0.00 0.00 48 T 7.76 4.07 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 1.19 0.00 0.00 49 R 7.41 4.27 0.00 2.06 2.06 0.00 3.28 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 50 I 7.26 4.01 1.90 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.89 0.68 0.00 0.00 51 P 0.00 4.35 0.00 2.09 1.95 0.00 3.54 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00 52 Q 8.58 4.04 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 53 E 8.02 3.92 0.00 1.86 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 2.29 2.44 0.00 54 L 7.63 4.02 0.00 1.46 1.60 0.83 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 55 V 7.27 2.92 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 1.09 0.00 0.00 0.82 0.00 0.00 56 K 7.94 4.43 0.00 1.85 1.86 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.64 7.81 57 K 8.09 4.46 0.00 1.78 1.81 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.43 1.67 7.81 58 G 8.24 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 59 Q 7.53 4.69 0.00 1.73 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.28 7.17 0.00 0.00 0.00 0.00 0.00 2.14 2.37 0.00 60 F 8.87 4.90 0.00 2.97 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 61 P 0.00 4.70 0.00 2.02 1.99 0.00 3.69 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 1.99 1.95 0.00 62 I 8.60 4.08 1.44 0.00 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.24 -0.13 0.16 0.00 0.00 63 P 0.00 3.98 0.00 2.08 2.04 0.00 3.40 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 2.07 2.03 0.00 64 S 7.41 4.53 0.00 3.71 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 65 I 8.61 3.60 1.60 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.66 0.68 0.00 0.00 66 T 8.13 4.35 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 1.12 0.00 0.00 67 W 7.93 4.40 0.00 3.45 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 68 E 7.68 4.17 0.00 2.10 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 0.00 2.35 2.34 0.00 69 H 7.98 4.47 0.00 3.18 3.02 0.00 5.72 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 70 A 7.96 4.23 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 7.36 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 0.00 0.00 0.00 72 R 7.00 4.62 0.00 1.70 1.64 0.00 3.29 0.00 0.00 3.67 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 73 Y 8.92 4.93 0.00 2.77 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 74 R 8.01 4.86 0.00 0.88 1.59 0.00 3.13 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.44 0.00 75 C 8.98 5.63 0.00 2.98 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 76 Y 7.72 5.19 0.00 3.16 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 77 Y 8.10 5.82 0.00 2.77 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 78 G 9.09 4.60 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 0.00 0.00 0.00 79 S 8.41 4.73 0.00 3.83 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 80 D 8.58 4.58 0.00 2.69 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 *82 A 8.13 4.14 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 83 G 7.26 3.47 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 84 R 8.15 5.10 0.00 1.72 1.91 0.00 2.72 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.37 0.00 85 S 7.96 4.38 0.00 3.73 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 86 E 8.41 4.26 0.00 1.89 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 2.30 2.33 0.00 87 S 8.49 4.93 0.00 3.89 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 88 S 9.25 4.54 0.00 3.99 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 D 8.59 4.58 0.00 2.74 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 90 P 0.00 4.72 0.00 2.10 2.06 0.00 3.74 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 2.03 2.00 0.00 91 L 9.06 4.68 0.00 1.71 1.53 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.95 4.79 0.00 2.04 2.35 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 2.49 2.43 0.00 93 L 9.01 4.40 0.00 1.65 1.74 0.71 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 94 V 8.60 4.56 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 -0.98 0.00 0.00 0.22 0.00 0.00 95 V 8.48 4.88 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 0.64 0.00 0.00 0.84 0.00 0.00 96 T 8.69 5.05 4.78 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 1.03 0.00 0.00 97 G 9.74 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 98 A 8.15 3.59 0.11 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 99 Y 7.44 5.01 0.00 2.99 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.46 4.41 1.97 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 1.65 0.71 1.02 0.00 0.00 101 K 8.94 4.62 0.00 1.85 1.89 0.00 1.35 0.00 0.00 0.61 0.00 0.00 2.95 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.44 1.30 7.81 102 P 0.00 4.81 0.00 2.23 2.19 0.00 3.80 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 1.97 1.95 0.00 103 T 9.27 4.58 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 1.29 0.00 0.00 104 L 8.48 5.31 0.00 1.61 1.49 0.94 0.88 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 0.00 105 S 9.05 4.88 0.00 3.85 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 A 8.55 4.39 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 0.00 107 Q 9.07 4.39 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.23 2.41 0.00 108 P 0.00 4.49 0.00 2.01 2.08 0.00 3.68 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 1.99 2.04 0.00 109 S 7.40 4.58 0.00 3.92 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 0.00 110 P 0.00 4.34 0.00 2.11 2.27 0.00 3.55 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 2.12 2.09 0.00 111 V 7.38 4.59 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 0.82 0.00 0.00 0.94 0.00 0.00 112 V 8.71 4.58 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 0.66 0.00 0.00 0.74 0.00 0.00 113 N 8.54 4.88 0.00 2.60 2.71 0.00 0.00 6.53 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 0.00 114 S 9.02 4.24 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 0.00 115 G 9.54 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 0.00 116 G 7.96 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 0.00 0.00 0.00 117 N 8.76 5.71 0.00 2.58 2.66 0.00 0.00 7.11 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 0.00 118 V 8.05 4.73 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 0.64 0.00 0.00 0.91 0.00 0.00 119 I 7.89 4.80 2.02 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.00 0.94 0.00 0.00 120 L 9.33 5.07 0.00 1.52 1.48 0.27 -0.48 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 0.00 121 Q 9.09 5.02 0.00 2.03 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.16 2.28 0.00 122 C 9.13 5.20 0.00 3.11 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 0.00 123 D 9.49 5.36 0.00 2.74 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 S 8.46 5.18 0.00 4.22 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 0.00 125 Q 9.15 4.26 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.50 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 126 V 7.46 4.36 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.68 0.00 0.00 127 A 8.36 4.01 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 0.00 128 F 8.34 4.67 0.00 2.46 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.69 4.83 0.00 2.65 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 0.00 130 G 7.28 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 F 8.57 5.04 0.00 3.06 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 0.00 132 S 8.93 5.08 0.00 3.23 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 0.00 133 L 8.65 4.75 0.00 0.27 0.47 0.79 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 134 C 9.09 5.60 0.00 3.14 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 0.00 135 K 8.85 3.89 0.00 1.49 1.60 0.00 1.55 0.00 0.00 1.43 0.00 0.00 2.25 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.06 0.67 7.81 136 E 8.04 4.35 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 *143 Q 7.61 4.31 0.00 2.21 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.44 6.83 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 144 C 8.98 6.30 0.00 3.07 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 0.00 145 L 8.57 5.11 0.00 1.88 1.89 1.28 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 146 N 9.04 5.52 0.00 2.80 3.16 0.00 0.00 6.70 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 0.00 147 S 9.36 4.74 0.00 3.05 3.25 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 0.00 148 Q 8.26 5.21 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.89 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 149 P 0.00 5.20 0.00 2.13 1.82 0.00 3.77 0.00 0.00 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.27 0.00 *152 R 9.04 4.09 0.00 1.99 2.12 0.00 3.01 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.63 0.00 153 G 8.42 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 0.00 154 S 8.04 4.51 0.00 3.93 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 S 8.53 3.93 0.00 4.33 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 0.00 156 R 7.21 4.67 0.00 1.66 2.00 0.00 2.83 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.45 0.00 157 A 8.28 4.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 I 7.88 4.72 1.69 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.54 0.83 0.00 0.00 159 F 9.42 4.83 0.00 2.92 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 0.00 160 S 8.79 4.97 0.00 3.83 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 0.00 161 V 8.50 4.24 2.31 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 0.64 0.00 0.00 0.89 0.00 0.00 162 G 9.47 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 P 0.00 4.44 0.00 2.04 2.01 0.00 3.74 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 2.06 2.16 0.00 164 V 8.98 2.90 1.70 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 -0.31 0.00 0.00 0.45 0.00 0.00 165 S 9.05 4.91 0.00 3.98 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 0.00 166 P 0.00 4.55 0.00 2.11 2.22 0.00 3.79 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 2.07 2.13 0.00 167 S 7.99 3.87 0.00 3.98 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 *169 R 7.88 3.90 0.00 1.48 1.44 0.00 2.21 0.00 0.00 2.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.86 0.00 170 W 8.46 4.72 0.00 3.46 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 0.00 171 W 8.29 5.75 0.00 3.21 2.91 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 0.00 172 Y 9.06 5.42 0.00 2.93 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 0.00 173 R 9.04 5.04 0.00 1.80 1.53 0.00 3.35 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 174 C 9.18 5.49 0.00 2.97 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Y 8.96 5.21 0.00 2.38 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 0.00 176 A 8.36 4.47 0.26 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 0.00 177 Y 7.22 4.62 0.00 3.23 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 0.00 178 D 8.75 5.21 0.00 2.85 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 0.00 179 S 9.42 4.43 0.00 4.11 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 N 9.33 4.77 0.00 3.01 2.95 0.00 0.00 6.75 5.44 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 0.00 181 S 8.16 4.80 0.00 3.92 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 P 0.00 3.78 0.00 1.48 1.98 0.00 3.88 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.96 0.00 183 Y 7.91 4.26 0.00 2.99 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 8.38 5.03 0.00 2.03 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 0.00 2.57 2.45 0.00 185 W 9.11 5.24 0.00 3.19 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 0.00 186 S 8.62 5.37 0.00 4.28 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 0.00 187 L 8.73 4.86 0.00 1.83 1.71 1.00 1.31 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 0.00 188 P 0.00 3.97 0.00 1.87 1.91 0.00 3.87 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 189 S 8.02 4.49 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 0.00 190 D 8.45 4.46 0.00 2.66 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 0.00 191 L 8.20 4.19 0.00 1.53 1.41 1.04 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 192 L 9.27 4.62 0.00 1.75 1.76 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 193 E 8.69 5.15 0.00 1.98 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 2.58 3.07 0.00 194 L 9.43 4.67 0.00 1.91 1.59 0.83 0.85 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 0.00 195 L 10.64 4.75 0.00 1.73 1.59 1.09 0.80 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 0.00 196 V 8.46 4.42 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.84 0.00 0.00 197 L 8.82 4.46 0.00 1.59 1.45 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.