NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 D 4.5612 8.3493 120.1910 54.2277 41.6093 174.2832 7 I 4.4136 7.9526 119.3068 58.0503 40.7576 173.8446 8 R 4.1114 8.8285 121.7973 55.3343 31.4865 177.7680 9 A 4.2258 8.2973 123.5917 54.1042 18.7317 178.2948 10 G 3.9466 9.0213 110.3237 44.9681 0.0000 173.2717 11 E 4.6789 7.6102 118.4016 55.1447 31.7790 175.4204 12 L 4.7826 8.5660 121.9804 53.5004 45.4781 174.8548 13 A 5.1889 8.5984 127.0145 50.0568 21.8044 175.6161 14 S 4.4968 9.0323 116.0873 57.2052 63.4972 174.2564 15 D 4.9671 8.3912 125.0946 52.4938 39.5978 176.1450 16 W 4.6116 8.0730 128.6924 57.3629 32.0597 175.9143 17 S 3.9628 7.4104 119.5912 56.6118 62.9187 172.9208 18 G 3.5612 5.6634 114.7894 43.2932 0.0000 170.1878 19 S 4.4243 8.2035 113.9960 56.6884 63.9547 172.4554 20 P 4.6593 0.0000 0.0000 63.1552 31.7769 175.8741 21 D 4.6295 8.6408 118.1375 55.4824 41.7679 176.2903 22 A 4.6930 7.7239 119.3547 50.6305 22.3976 174.7903 23 G 4.0573 8.3663 107.8073 43.6387 0.0000 173.0849 24 V 4.0761 7.8242 122.1356 60.5666 33.2898 174.8890 25 V 3.9848 7.8650 126.2806 60.9039 32.7966 175.0396 26 F 4.8120 8.4066 126.5457 57.4817 38.9355 175.2861 27 I 3.4021 8.1562 119.4149 60.1380 38.2377 175.7144 28 G 2.3866 6.5085 108.1036 45.5535 0.0000 171.4800 29 R 4.7712 7.6287 118.3884 54.7291 34.0582 174.5814 30 I 4.7143 8.6909 126.7039 59.9280 39.6818 174.0726 31 H 5.3605 9.4068 125.0618 54.3998 30.6728 174.1504 32 T 4.7719 8.7387 112.6856 59.2648 71.9817 172.4353 33 P 4.0009 0.0000 0.0000 63.4064 31.6662 176.5682 34 W 4.9472 7.4442 119.5970 55.3731 29.5010 176.2051 35 N 4.9594 9.2470 121.2694 53.2888 39.2698 175.6613 36 R 4.7859 7.7529 116.9208 53.7841 33.9523 176.1995 37 L 3.9881 8.6259 120.9790 58.0658 41.7625 179.7687 38 K 4.1417 7.8954 115.7413 58.4829 32.2730 177.9736 39 E 4.1526 7.9590 118.1331 58.7549 29.7237 177.4355 40 C 3.0218 7.3736 116.4955 58.1215 28.5948 171.9613 41 P 4.1673 0.0000 0.0000 62.3019 31.5827 176.4286 42 R 3.8716 8.3510 120.1298 59.4168 30.2248 176.3026 43 H 5.1861 7.0210 111.3540 52.8918 32.9194 173.8899 44 G 4.2602 8.6485 107.5514 46.1116 0.0000 173.0190 45 R 4.9072 8.3770 118.5258 53.7833 33.6868 176.7148 46 A 3.9587 9.0633 125.5742 54.6507 18.5569 178.0293 47 D 4.8000 8.0073 113.1163 53.0006 39.7042 176.6158 48 G 4.0112 7.9519 110.0866 44.4259 0.0000 171.9679 49 P 4.3547 0.0000 0.0000 62.1789 31.7740 176.7715 50 V 3.9701 8.1570 121.6998 63.3449 32.2215 174.8991 51 C 4.9577 9.3675 124.7716 57.8992 32.3562 172.6126 52 R 4.7641 8.8156 120.6965 54.7072 32.3688 174.4468 53 I 4.2977 8.6474 128.8200 60.3698 38.6242 174.6543 54 E 4.7535 9.0464 130.2060 54.8022 30.7109 174.8639 55 V 4.2672 8.3950 128.4653 61.8575 32.6867 175.9578 56 F 4.8954 9.1187 126.9005 57.3954 40.0604 175.9554 57 E 3.9306 9.3776 121.8195 60.3269 29.0178 179.2909 58 T 3.5183 7.7399 113.3838 65.9261 68.6199 175.2157 59 W 4.6957 8.0345 117.8106 56.2008 29.5224 177.4868 60 L 4.0068 7.8493 122.9436 58.1566 41.3387 177.3673 61 P 4.3174 0.0000 0.0000 65.0769 31.0776 177.7988 62 A 4.2994 7.8442 117.8971 53.5610 18.6044 178.4799 63 L 4.2736 8.1658 116.9604 53.9953 41.8149 176.5357 64 A 4.1368 7.1145 123.1917 54.0099 18.5504 177.7078 65 G 4.0777 9.1477 111.6503 45.2254 0.0000 173.4658 66 I 4.2186 7.6545 121.0410 60.3076 38.2916 174.5205 67 D 4.6329 8.6934 122.9963 52.7835 44.4541 173.4581 68 D 4.5579 8.5993 119.3858 56.5044 40.8936 177.7513 69 G 4.0068 9.2105 112.4674 45.3131 0.0000 173.7351 70 T 4.0863 7.7813 117.9800 63.3890 69.7503 173.3559 71 L 4.6701 8.6249 128.6455 54.3786 43.3600 175.1602 72 L 5.1864 9.0105 126.6728 52.9673 45.4046 175.0582 73 E 4.8181 9.4128 123.3274 54.7447 31.5890 174.5796 74 V 4.8356 8.8137 128.0055 61.2553 34.0337 174.1248 75 F 5.2152 9.4489 127.0023 55.8375 41.3942 174.2733 76 Y 5.3168 8.3714 121.1889 55.0001 42.0727 173.9105 77 W 4.9693 8.8894 130.8364 55.9233 32.1173 176.8248 78 L 4.3985 8.7135 129.6127 54.2110 39.2967 177.2296 79 H 4.6984 8.6352 116.3882 56.9410 29.0994 177.0263 80 R 4.3866 7.7102 117.8637 56.1692 30.7601 176.2383 81 S 4.4149 7.6748 115.7143 57.4242 63.5964 174.5302 82 R 4.1586 8.3871 121.2184 56.4715 29.9488 176.5411 83 R 4.9658 8.8112 116.3639 55.4097 31.2223 176.4719 84 D 4.8847 7.8325 117.3794 53.2856 41.1055 176.0945 85 L 4.4782 7.8422 120.3356 55.1635 41.9412 176.2916 86 L 4.3318 9.3420 123.2187 55.4474 44.3751 176.4391 87 L 5.1296 7.7045 118.0774 52.8867 44.7818 175.7504 88 Q 4.8177 9.1369 122.0978 54.1762 32.6454 175.0582 89 C 4.7191 9.2254 122.4378 57.4045 25.7554 172.0999 90 P 4.1133 0.0000 0.0000 64.8647 31.7302 177.3401 *94 G 3.7063 7.8134 105.8473 44.9657 0.0000 172.3114 95 D 4.4157 8.5668 123.8289 53.6789 41.5898 176.1721 96 A 4.3986 8.4349 124.7736 52.5816 19.1996 176.8834 97 R 4.6616 9.0366 118.8117 53.7228 34.7225 175.4590 98 G 3.8134 8.5614 108.7614 46.7519 0.0000 174.5597 99 T 3.8586 8.6424 121.5054 66.6615 68.5979 176.5412 100 F 4.6636 7.5445 117.7828 59.4963 39.0728 175.9324 101 S 4.5787 7.9793 114.2868 58.1683 63.4226 173.4412 102 I 4.7150 7.3071 113.8935 59.6061 40.3505 174.7949 103 R 4.5392 8.2437 116.8886 55.7359 30.3948 176.8999 104 S 4.1135 8.1044 111.9911 58.2795 62.5609 172.5543 105 P 4.2494 0.0000 0.0000 63.9613 31.5805 176.0999 106 L 4.4489 7.5376 120.1742 53.7999 41.5624 175.9318 107 R 4.6353 7.8414 121.4198 53.9086 34.3310 174.6482 108 P 4.4187 0.0000 0.0000 64.3592 31.3903 176.3858 109 N 4.7807 7.8596 115.3426 50.7230 40.5597 173.2929 110 P 4.3506 0.0000 0.0000 61.6481 29.5786 175.2155 111 I 4.4972 7.2145 121.8227 60.9011 38.7013 176.8575 112 G 3.8766 8.6184 115.0030 44.4211 0.0000 172.3126 113 T 5.3245 7.7037 110.4255 58.4948 72.1466 173.2528 114 S 4.7589 8.3561 117.4080 56.9983 67.6126 172.7930 115 I 4.8641 8.3520 123.9275 60.0075 38.1956 174.9698 116 A 4.6915 9.0037 128.0943 50.6381 23.0483 174.6248 117 R 4.7763 8.4518 121.2767 54.8308 31.8157 176.1696 118 V 3.6696 8.8101 127.2306 63.5846 31.9086 176.2953 119 D 4.4704 9.1011 129.1022 57.2339 41.5694 177.2578 120 R 4.8444 7.9104 117.4547 55.1684 33.7031 173.3257 121 R 4.9107 9.4225 127.6060 55.0216 31.9017 175.6313 122 D 4.6256 9.0731 125.6200 53.0946 43.5780 176.9542 123 G 3.8021 8.3819 118.9914 46.8472 0.0000 172.6272 124 A 4.4100 8.8460 128.9620 51.9755 19.1095 176.6131 125 N 5.2124 8.0325 115.1744 51.4822 41.3599 173.9017 126 L 4.9038 8.5350 123.2127 52.9273 44.7689 175.3128 127 F 5.2131 9.1416 123.6846 56.1758 40.8713 174.9285 128 I 4.8051 8.8605 122.9196 59.9367 41.6802 173.4861 129 R 4.7461 8.5217 126.8040 55.0163 33.1063 175.8430 130 G 4.2003 8.8923 110.1531 45.8282 0.0000 173.6796 131 L 5.0120 7.8639 119.2750 53.3209 43.4586 176.1958 132 D 4.3214 8.2165 114.7079 53.4104 40.4412 174.5386 133 C 4.5286 7.8305 113.6612 56.2725 31.9360 173.0896 134 L 4.2487 8.2397 122.3615 55.0185 42.2191 175.9716 135 D 4.4776 8.8905 125.2794 56.2487 41.3572 176.7096 136 G 3.9238 8.9885 115.0812 45.0969 0.0000 173.4128 137 T 3.7668 7.6981 117.4821 62.9569 69.5435 172.1000 138 P 4.4378 0.0000 0.0000 62.3432 32.6577 175.2134 139 L 4.5464 8.4114 126.5546 54.8712 42.8152 177.3242 140 V 4.3599 8.7786 117.9318 61.8617 34.4049 175.0726 141 D 4.5501 7.7564 117.4130 53.2436 44.5399 173.9997 142 L 5.3677 8.2977 121.6591 53.0651 45.3987 176.1066 143 K 4.7560 9.0189 121.6095 53.5979 36.8531 173.9311 144 P 4.6857 0.0000 0.0000 62.5972 32.2585 175.6936 145 D 4.4439 9.0623 123.7636 54.2733 41.9320 177.1572 146 R 4.0470 9.0596 123.5872 59.5380 30.3158 178.8389 147 A 4.0731 8.4214 119.6252 54.5896 18.4146 177.8216 148 E 4.7405 8.2287 112.6283 55.8065 31.0570 174.9747 149 F 5.0476 7.7149 122.4282 55.7815 42.1776 172.0873 *151 P 3.9367 0.0000 0.0000 62.5910 32.2087 176.5654 152 L 4.1652 8.4989 121.4145 56.6793 42.4369 177.7057 153 A 4.1892 7.7699 120.0248 51.1103 18.9485 175.2854 154 P 4.4997 0.0000 0.0000 61.6003 32.2108 174.7440 155 P 4.5180 0.0000 0.0000 63.0691 31.9543 175.7245 156 K 4.8272 8.9844 119.8024 53.6313 35.7965 175.7035 157 P 4.4817 0.0000 0.0000 65.8415 31.5578 179.4209 158 G 3.6875 8.1485 106.6299 48.3414 0.0000 175.0161 159 D 4.2218 8.0885 119.0120 56.2248 40.7473 176.9765 160 F 4.5941 7.8341 115.8646 56.9166 39.5868 175.1111 161 Q 4.3036 7.7016 123.0484 54.9634 28.8141 174.9248 162 V 4.3125 8.1607 125.3630 60.9586 33.3668 175.6373 163 G 3.8835 8.3258 114.6243 44.9481 0.0000 173.4848 164 E 4.1539 8.5484 117.1815 56.3217 29.9204 176.5579 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 6 D 8.35 4.56 0.00 2.65 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 7 I 7.95 4.41 2.02 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 1.41 0.96 0.90 0.00 0.00 8 R 8.83 4.11 0.00 1.91 1.87 0.00 3.12 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 9 A 8.30 4.23 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 G 9.02 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 E 7.61 4.68 0.00 1.97 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 2.25 2.22 0.00 12 L 8.57 4.78 0.00 1.70 1.40 0.91 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.60 5.19 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 S 9.03 4.50 0.00 3.86 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 15 D 8.39 4.97 0.00 2.82 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 16 W 8.07 4.61 0.00 3.26 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 7.41 3.96 0.00 3.74 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 18 G 5.66 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 19 S 8.20 4.42 0.00 4.01 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 20 P 0.00 4.66 0.00 2.42 2.20 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 21 D 8.64 4.63 0.00 2.73 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 7.72 4.69 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 23 G 8.37 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 24 V 7.82 4.08 1.40 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 0.45 0.00 0.00 0.72 0.00 0.00 25 V 7.86 3.98 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 0.89 0.00 0.00 0.90 0.00 0.00 26 F 8.41 4.81 0.00 3.20 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 27 I 8.16 3.40 1.17 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.01 -0.48 0.00 0.00 28 G 6.51 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.63 4.77 0.00 1.91 1.70 0.00 3.18 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.50 0.00 30 I 8.69 4.71 1.70 0.00 0.00 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 1.10 0.62 0.78 0.00 0.00 31 H 9.41 5.36 0.00 3.06 3.18 0.00 5.56 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 32 T 8.74 4.77 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 33 P 0.00 4.00 0.00 1.13 1.72 0.00 2.20 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.53 0.00 34 W 7.44 4.95 0.00 3.49 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 N 9.25 4.96 0.00 2.74 2.89 0.00 0.00 6.84 7.41 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 36 R 7.75 4.79 0.00 1.82 1.79 0.00 3.32 0.00 0.00 3.35 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 37 L 8.63 3.99 0.00 1.69 1.70 0.90 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.90 4.14 0.00 1.73 1.85 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.43 7.81 39 E 7.96 4.15 0.00 2.30 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 0.00 2.43 2.33 0.00 40 C 7.37 3.02 0.00 2.79 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 41 P 0.00 4.17 0.00 2.19 1.80 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.41 0.00 42 R 8.35 3.87 0.00 1.70 1.93 0.00 3.18 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 43 H 7.02 5.19 0.00 2.98 3.09 0.00 5.81 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.65 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 0.00 0.00 0.00 0.00 45 R 8.38 4.91 0.00 1.76 1.99 0.00 3.15 0.00 0.00 3.36 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 46 A 9.06 3.96 1.30 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 47 D 8.01 4.80 0.00 2.78 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 48 G 7.95 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 49 P 0.00 4.35 0.00 1.81 1.88 0.00 3.98 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 50 V 8.16 3.97 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 0.86 0.00 0.00 0.98 0.00 0.00 51 C 9.37 4.96 0.00 2.93 2.85 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 52 R 8.82 4.76 0.00 1.96 1.78 0.00 3.16 0.00 0.00 3.05 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.05 0.00 53 I 8.65 4.30 1.76 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 1.03 0.40 0.82 0.00 0.00 54 E 9.05 4.75 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 55 V 8.40 4.27 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 0.99 0.00 0.00 0.88 0.00 0.00 56 F 9.12 4.90 0.00 3.50 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 E 9.38 3.93 0.00 2.10 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 58 T 7.74 3.52 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 0.01 0.00 0.00 59 W 8.03 4.70 0.00 3.56 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 60 L 7.85 4.01 0.00 1.83 1.89 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.32 0.00 2.21 2.09 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 62 A 7.84 4.30 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.17 4.27 0.00 1.86 1.73 0.94 0.80 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 64 A 7.11 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 65 G 9.15 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 66 I 7.65 4.22 2.02 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 1.19 0.63 0.92 0.00 0.00 67 D 8.69 4.63 0.00 2.74 2.51 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 68 D 8.60 4.56 0.00 2.71 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 69 G 9.21 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 70 T 7.78 4.09 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 1.24 0.00 0.00 71 L 8.62 4.67 0.00 1.80 1.58 0.96 0.67 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 72 L 9.01 5.19 0.00 1.74 1.55 0.93 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 73 E 9.41 4.82 0.00 2.00 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 1.70 2.00 0.00 74 V 8.81 4.84 2.22 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 1.07 0.00 0.00 0.98 0.00 0.00 75 F 9.45 5.22 0.00 3.09 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 8.37 5.32 0.00 3.09 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 77 W 8.89 4.97 0.00 3.45 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.34 0.00 139 L 8.41 4.55 0.00 1.62 1.41 1.04 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 140 V 8.78 4.36 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 0.90 0.00 0.00 1.17 0.00 0.00 141 D 7.76 4.55 0.00 2.48 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 0.00 0.00 0.00 142 L 8.30 5.37 0.00 1.49 1.51 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 143 K 9.02 4.76 0.00 1.80 1.56 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.13 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.19 1.32 7.81 144 P 0.00 4.69 0.00 1.96 1.95 0.00 3.42 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.09 0.00 145 D 9.06 4.44 0.00 2.83 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 0.00 146 R 9.06 4.05 0.00 1.95 2.04 0.00 3.22 0.00 0.00 3.38 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.71 0.00 147 A 8.42 4.07 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 E 8.23 4.74 0.00 2.02 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 2.26 2.24 0.00 149 F 7.71 5.05 0.00 2.92 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 *151 P 0.00 3.94 0.00 2.03 2.03 0.00 3.53 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.13 0.00 152 L 8.50 4.17 0.00 1.68 1.73 1.02 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 153 A 7.77 4.19 1.26 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 0.00 154 P 0.00 4.50 0.00 2.22 2.09 0.00 3.80 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 155 P 0.00 4.52 0.00 2.35 2.08 0.00 3.68 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 2.19 2.17 0.00 156 K 8.98 4.83 0.00 1.76 1.70 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.38 7.81 157 P 0.00 4.48 0.00 2.23 2.18 0.00 3.65 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.15 0.00 158 G 8.15 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 0.00 0.00 0.00 159 D 8.09 4.22 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 F 7.83 4.59 0.00 3.19 3.09 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 0.00 161 Q 7.70 4.30 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.67 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 162 V 8.16 4.31 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 0.87 0.00 0.00 0.96 0.00 0.00 163 G 8.33 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 0.00 0.00 0.00 164 E 8.55 4.15 0.00 2.09 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 * Residues marked with a * may have inaccurate shift predictions.