NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 R 4.3036 8.1133 117.2841 55.9348 30.5930 174.4569 17 S 4.0482 8.2148 112.2682 62.0764 62.3900 174.9420 18 L 4.1349 8.3337 123.3093 58.0987 41.7611 179.2454 19 A 4.0530 7.5751 118.0292 54.3462 18.4253 179.1644 20 A 4.1941 8.5195 120.0675 55.0163 18.6941 179.3986 21 I 3.8951 7.9853 116.7352 65.0026 37.3670 177.6130 22 D 4.4907 7.6282 116.8406 55.9035 41.9245 176.5518 23 S 4.6929 7.9745 113.6666 57.8002 62.9347 174.1880 *25 I 3.8335 7.3130 119.0875 61.5267 38.5612 175.1004 26 D 4.3464 8.5762 122.9460 53.5825 40.6387 175.6785 27 P 4.2528 0.0000 0.0000 65.7752 31.2708 177.4865 28 D 4.3525 8.3053 118.5762 56.9600 40.8096 176.0820 29 I 3.7858 7.7921 120.0595 61.9397 36.6154 175.5733 30 S 4.6929 8.5395 121.6726 57.8343 65.5611 177.2676 31 G 3.7479 8.3472 112.3475 45.8044 0.0000 172.6003 32 P 3.7688 0.0000 0.0000 63.0810 31.6483 177.3714 *34 R 4.2072 8.0981 120.6469 56.6701 31.9531 177.0405 35 H 4.1810 8.1874 117.0270 59.3317 29.8290 177.3627 36 I 3.6551 7.5792 121.1972 64.2780 36.8663 178.4528 37 V 3.5964 7.6171 118.7202 65.7934 31.3753 178.0916 38 V 3.5417 7.9860 118.2098 65.8977 31.3122 178.0495 39 K 3.8810 8.0102 117.9407 59.5196 31.9922 179.1176 40 A 4.0789 7.9422 122.1602 54.6926 18.1967 179.7353 41 I 3.5796 8.0070 118.5835 64.6054 37.1323 178.2114 42 H 4.0345 8.4151 118.9342 59.2973 29.5586 177.0706 43 A 3.9225 7.9978 121.1066 54.9876 18.2328 178.8067 44 A 4.2419 7.9369 117.1869 51.6710 19.5806 177.2951 45 G 3.7730 7.7129 105.4178 45.5944 0.0000 174.4654 46 D 4.4116 7.6004 118.3018 53.0502 43.4621 175.5517 47 F 4.1806 9.2212 126.9367 60.1985 39.4396 177.6373 48 A 3.9740 8.2971 123.5916 55.3953 18.2839 178.7811 49 I 3.8911 7.6178 106.4095 62.6038 37.7604 177.8921 50 A 3.9568 8.9116 126.3972 55.2434 18.1791 177.5875 51 P 4.5579 0.0000 0.0000 63.7509 31.7130 177.0512 52 L 4.5329 7.7504 118.3469 54.5477 42.3491 176.0968 53 I 4.5119 7.2976 119.8527 61.2114 37.8734 175.7704 54 R 4.8272 8.9477 124.7022 54.7929 34.1114 173.9049 55 Y 4.4560 7.6346 118.7846 55.5123 40.8546 174.3158 56 S 4.3177 7.8497 115.9041 57.9264 64.1707 174.8229 57 D 4.4095 9.0845 122.0357 57.4339 40.8381 178.0063 58 G 4.1337 8.0572 104.5906 44.5899 0.0000 174.7983 59 F 4.0903 8.5205 122.9025 61.2579 39.4056 176.4523 60 F 4.1147 8.3622 118.1642 61.2616 39.3340 176.8130 61 K 3.9405 8.0150 117.2493 59.4383 32.0513 179.1753 62 S 3.9452 7.9293 110.4439 59.7459 62.3488 175.1531 *64 L 3.9223 7.8402 122.9646 54.8739 43.6525 178.4555 65 A 3.8793 7.9970 120.4522 55.1168 18.1745 179.4377 66 K 3.7148 7.5685 116.0753 59.9155 32.0053 179.6534 67 L 4.0621 7.5420 116.8618 57.3587 41.5576 179.3018 68 K 4.0478 7.8348 119.0875 59.6078 32.3489 178.3168 69 E 4.1399 8.1310 118.6560 56.8819 29.6233 177.5455 70 G 4.0333 8.6891 107.7435 45.5172 0.0000 172.1714 71 C 4.6462 9.7004 119.6843 57.7175 33.6733 172.0248 72 T 4.8793 8.3659 114.9888 62.4196 70.4076 174.1897 73 I 4.5809 9.0557 128.3187 59.9202 38.8560 175.0066 74 I 4.3919 8.7590 130.3056 60.6324 38.0071 175.1279 75 C 5.3165 8.7692 125.7428 58.1897 29.6779 174.1220 76 D 4.7599 8.5303 121.3133 55.0611 40.0621 176.3086 77 S 4.7557 7.7598 112.7250 56.4907 66.2770 175.1739 78 E 4.0983 8.4984 119.2992 56.4421 28.7529 179.8162 *80 V 3.9299 8.0247 119.3240 63.0732 33.4569 176.9140 81 R 3.8741 8.0677 119.0535 59.6874 29.6415 178.3409 82 A 4.2278 8.5686 118.7534 54.4288 18.4127 179.0665 83 G 3.9677 7.8878 102.9040 45.2200 0.0000 173.8590 84 I 4.0744 7.1333 122.3230 60.3251 36.5662 174.9055 85 Y 4.6808 7.3169 121.7987 55.3205 39.3354 175.8774 86 S 4.1783 8.0418 115.7100 58.9922 62.9723 173.8443 87 R 3.9590 8.8952 129.3178 59.5510 29.5981 176.3475 88 P 4.2835 0.0000 0.0000 65.4071 31.4045 178.6608 89 V 3.7566 7.6031 116.6150 66.0150 31.5644 177.7342 90 L 4.3539 7.9054 116.0740 56.1712 41.4006 178.6686 91 E 4.1210 7.7979 119.9042 58.9805 29.8373 177.3334 92 R 4.6678 7.7735 114.3781 55.7411 32.0215 174.5076 93 N 5.2323 8.1019 116.2092 51.3080 42.2655 173.6909 94 R 4.5880 8.5883 121.7626 54.5772 32.8443 174.4717 95 V 4.6930 8.3865 126.0531 61.7122 32.9407 175.1375 96 V 4.7300 8.7751 119.9050 59.9327 36.4941 174.0715 97 C 5.0631 8.6044 121.7624 58.1120 34.5089 173.1539 98 Y 4.5684 8.7142 122.9900 57.7431 38.1001 177.3788 99 L 3.9775 8.2050 124.6450 57.9844 42.1842 177.4237 100 N 4.7945 7.8967 112.6265 52.7444 39.0186 174.3380 101 D 4.3582 7.7782 119.8585 53.8346 42.0371 177.0686 102 V 3.6057 8.6540 125.6867 66.5913 31.2373 178.5919 103 R 4.0656 8.0027 115.7703 58.7017 30.0282 179.1405 104 S 4.3222 8.0680 115.8463 61.4826 62.9910 176.6071 105 K 4.0498 8.0254 121.0559 59.8698 32.2303 178.4522 106 E 3.7400 7.8194 116.2978 57.3243 29.3987 177.8153 *108 A 4.4120 7.9201 120.0454 52.4321 20.4743 179.2265 109 D 4.2795 8.1496 113.9424 57.6692 40.5519 178.2887 110 V 3.5664 7.1511 117.0424 66.6546 31.6506 176.5443 111 N 4.4682 7.9845 116.9122 53.6839 38.7556 175.6392 112 G 3.9055 7.8839 106.5770 46.3786 0.0000 173.5769 113 I 4.5428 7.3713 111.8243 58.0947 40.3307 175.0596 114 T 3.9755 8.2110 112.4167 62.1269 70.3281 175.1957 115 R 3.8980 8.5027 121.4916 59.4959 30.1208 179.1263 116 S 4.0889 8.0303 114.4934 61.5638 62.9949 176.2019 117 A 3.9936 7.9791 123.1895 55.1953 18.0747 179.5745 118 A 4.0785 8.3700 119.5502 55.0715 18.3348 180.0995 119 G 3.8496 8.3233 104.5440 48.9019 0.0000 175.9369 120 I 3.6590 7.5586 121.2897 63.9873 37.1839 178.2575 121 R 4.0186 7.6882 118.2479 59.5661 30.3008 178.3127 122 I 3.8921 7.9212 119.4327 64.1124 36.9557 178.9399 123 A 2.6942 7.6209 118.6494 52.5696 17.7013 179.0950 *125 Q 4.3346 8.0333 121.3531 57.5959 30.8330 176.7639 126 D 4.3518 7.9824 117.0274 56.4351 41.0029 175.9087 127 H 4.6592 8.1439 115.7577 53.7190 30.5770 173.2435 128 R 3.3575 8.3983 125.9024 58.6039 30.3539 175.9949 129 N 4.6247 7.6627 118.0196 52.4126 38.4668 173.8263 130 S 5.6028 7.8913 118.2095 55.3575 67.3533 173.1089 131 V 4.4341 8.0930 118.1070 61.1130 34.9494 173.7553 132 I 4.8358 8.3908 127.9305 59.6115 39.5081 174.6351 133 V 4.7156 8.9766 127.6683 61.3208 34.0054 174.1740 134 I 4.7190 9.3358 130.7106 59.7717 38.9682 176.4117 135 G 3.7577 9.6107 113.1007 46.1131 0.0000 172.3969 136 N 5.0569 9.1883 117.2928 54.0317 41.2814 173.1423 137 A 4.5611 7.9576 118.3486 50.7249 20.1313 176.6574 138 P 4.2987 0.0000 0.0000 65.7783 31.3727 179.0448 139 T 3.8407 7.8980 108.1041 64.6563 68.6972 176.3785 140 A 3.9827 7.8872 123.5618 54.5758 18.1294 179.4244 141 L 3.8486 7.6437 117.6972 58.3935 42.4248 178.5784 142 L 4.0878 7.8410 117.6958 57.8818 41.6108 178.9166 143 E 4.0900 8.1841 118.0563 58.9601 29.5919 179.2525 144 A 4.1019 7.5627 116.6568 52.7347 18.3813 177.7299 *146 R 3.9763 7.7497 118.5025 57.8045 31.7689 176.9974 *148 I 3.9694 7.6883 117.7839 61.2632 39.2242 177.7049 149 E 3.7412 7.8775 118.8316 59.6483 29.3021 178.9358 150 E 4.1762 8.1465 115.3127 57.7492 29.4163 177.1743 151 N 4.4430 7.3060 114.1698 51.4246 40.2805 174.2199 152 G 4.0709 7.3534 105.6192 46.6906 0.0000 175.0107 153 W 4.9935 7.6849 118.3582 55.7535 27.7976 177.3026 154 Y 4.4006 7.9470 112.7507 58.7665 37.8934 177.0386 155 D 4.4869 8.0484 120.0497 54.9696 40.1493 176.3928 156 I 4.0318 7.5078 121.6209 59.9141 37.3363 173.6457 157 P 5.0590 0.0000 0.0000 62.0708 33.8896 174.7723 158 I 4.9898 8.8003 121.2301 59.8019 40.7104 175.0702 159 V 3.9230 9.3786 128.3611 61.8523 31.6253 174.0599 160 G 4.1607 8.8394 115.4090 43.6523 0.0000 171.5857 161 I 4.8853 8.6294 133.6297 59.6973 36.7898 173.4723 162 P 4.7704 0.0000 0.0000 62.9640 33.1615 176.7895 163 V 4.1618 9.6428 121.0106 61.4020 33.7891 175.1863 164 G 4.0391 7.5182 110.6047 43.6184 0.0000 173.2350 165 F 3.9462 8.6948 120.1422 57.9145 39.4763 178.2683 166 I 3.8144 9.0084 127.5425 65.1210 37.9360 176.8219 167 N 4.3245 8.2134 116.7408 56.1811 38.4482 177.2151 168 A 3.9828 7.8764 121.7211 55.1817 18.6195 179.7048 169 S 4.0976 8.2478 113.7432 61.7122 62.5103 177.0264 170 K 4.0637 8.3513 121.1404 59.4640 31.3283 179.2484 171 A 3.9853 7.8650 120.4727 55.1552 18.4805 179.7652 172 K 4.0458 8.1803 116.3985 58.9111 31.8986 179.4780 173 E 4.0915 8.0006 118.9389 59.1342 29.4884 179.0987 174 G 3.6545 7.7885 105.4924 47.3934 0.0000 175.2863 175 L 3.7767 7.3800 121.4532 58.1307 41.7605 180.1281 176 V 3.7364 6.7856 107.6357 61.5408 31.2245 177.1194 177 S 4.5785 8.2333 115.5668 58.4181 65.2531 174.7592 178 S 4.4775 7.5988 113.9614 58.3563 63.9850 173.5202 179 H 4.8860 8.8751 119.4872 56.2701 29.5600 174.4672 180 I 4.5022 7.4515 118.8071 60.1965 37.7280 175.4720 181 E 4.5833 8.8244 124.4238 56.9003 30.8681 175.4759 182 Y 5.0029 8.8393 120.8711 56.9815 42.2687 172.5482 183 I 4.3136 8.2688 118.1942 60.0250 41.9332 173.8519 184 S 4.8788 9.1995 122.4712 57.6996 66.3896 172.0757 185 V 4.9346 8.1142 119.1003 61.0209 33.9057 175.3425 186 E 4.0220 9.4695 128.8723 57.6194 29.9412 176.0975 187 G 3.8424 8.7125 108.4623 44.8539 0.0000 172.5502 188 H 4.6924 8.5633 114.4874 56.5214 29.7234 176.0264 189 R 4.0176 8.0539 118.4869 56.0760 30.5689 176.5853 190 G 4.0398 7.6156 106.5576 45.3052 0.0000 171.6430 191 G 4.4168 7.9667 105.3126 44.0779 0.0000 175.5220 192 S 4.1144 8.8732 116.5640 61.0238 62.7897 175.2475 193 P 4.2530 0.0000 0.0000 65.6703 31.2300 178.7273 194 I 3.6553 7.6846 117.6802 64.2348 36.7203 178.0121 195 A 3.9889 8.0241 121.3353 55.3753 18.2163 179.6262 196 A 3.9955 8.4575 119.8200 55.2014 18.1724 180.0202 197 S 4.0530 8.1516 112.9365 61.5121 62.8057 176.8543 198 I 3.8093 7.4683 122.3457 64.1421 37.1743 178.2797 199 V 3.8444 7.5404 117.8035 66.2769 31.4553 177.8017 200 N 4.4567 8.3994 116.3940 56.3341 37.8590 177.5317 201 G 3.8300 8.4426 107.1789 47.7496 0.0000 175.4666 202 F 4.1973 8.7206 119.5329 59.5596 38.8577 177.5647 203 G 4.0951 8.1110 107.5647 47.3540 0.0000 175.5564 204 R 4.0110 7.5175 117.8834 57.4669 29.9072 177.3482 205 F 4.8438 8.2076 117.2078 57.0011 39.6938 175.4517 206 L 4.3858 7.7347 126.6218 54.9548 41.6550 176.3873 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 16 R 8.11 4.30 0.00 2.07 2.19 0.00 2.99 0.00 0.00 3.45 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 17 S 8.21 4.05 0.00 4.00 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 18 L 8.33 4.13 0.00 1.65 1.70 0.69 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 19 A 7.58 4.05 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.52 4.19 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 21 I 7.99 3.90 1.93 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.82 0.95 0.00 0.00 22 D 7.63 4.49 0.00 2.78 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 23 S 7.97 4.69 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 *25 I 7.31 3.83 1.91 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 1.36 0.82 0.95 0.00 0.00 26 D 8.58 4.35 0.00 2.72 2.64 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 27 P 0.00 4.25 0.00 2.22 2.20 0.00 3.83 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 2.00 2.01 0.00 28 D 8.31 4.35 0.00 3.05 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 29 I 7.79 3.79 2.02 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.59 0.98 0.00 0.00 30 S 8.54 4.69 0.00 3.82 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 31 G 8.35 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 3.77 0.00 0.49 0.49 0.00 3.24 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 1.39 1.82 0.00 *34 R 8.10 4.21 0.00 1.85 2.11 0.00 3.18 0.00 0.00 3.38 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 35 H 8.19 4.18 0.00 3.34 3.65 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 I 7.58 3.66 1.75 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.65 0.99 0.00 0.00 37 V 7.62 3.60 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 1.15 0.00 0.00 0.95 0.00 0.00 38 V 7.99 3.54 2.19 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 1.03 0.00 0.00 0.97 0.00 0.00 39 K 8.01 3.88 0.00 1.95 1.84 0.00 1.74 0.00 0.00 1.64 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.42 7.81 40 A 7.94 4.08 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 I 8.01 3.58 1.94 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.50 0.60 0.00 0.00 42 H 8.42 4.03 0.00 3.24 3.44 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.00 3.92 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 44 A 7.94 4.24 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 45 G 7.71 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 0.00 0.00 0.00 46 D 7.60 4.41 0.00 2.72 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 47 F 9.22 4.18 0.00 3.17 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 48 A 8.30 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.62 3.89 1.89 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 1.48 0.62 0.92 0.00 0.00 50 A 8.91 3.96 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 51 P 0.00 4.56 0.00 2.08 2.12 0.00 3.95 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 2.06 2.14 0.00 52 L 7.75 4.53 0.00 1.86 1.85 1.03 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 53 I 7.30 4.51 1.95 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 1.26 0.71 1.06 0.00 0.00 54 R 8.95 4.83 0.00 1.85 1.83 0.00 3.31 0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 55 Y 7.63 4.46 0.00 2.61 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 56 S 7.85 4.32 0.00 4.02 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 57 D 9.08 4.41 0.00 2.74 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 58 G 8.06 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 59 F 8.52 4.09 0.00 3.12 3.30 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 60 F 8.36 4.11 0.00 3.00 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 61 K 8.01 3.94 0.00 1.92 1.81 0.00 1.86 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 3.45 0.00 0.00 0.00 0.00 1.67 1.50 7.81 62 S 7.93 3.95 0.00 3.86 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 *64 L 7.84 3.92 0.00 1.03 1.37 1.01 0.84 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 65 A 8.00 3.88 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 K 7.57 3.71 0.00 1.59 1.74 0.00 1.58 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.50 7.81 67 L 7.54 4.06 0.00 1.48 1.67 0.70 0.78 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 68 K 7.83 4.05 0.00 1.83 1.97 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.47 7.81 69 E 8.13 4.14 0.00 1.91 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 139 T 7.90 3.84 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 0.00 140 A 7.89 3.98 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 0.00 141 L 7.64 3.85 0.00 1.62 1.91 0.90 0.92 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 0.00 142 L 7.84 4.09 0.00 1.78 1.70 0.91 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 143 E 8.18 4.09 0.00 2.00 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 0.00 2.49 2.35 0.00 144 A 7.56 4.10 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 *146 R 7.75 3.98 0.00 2.03 1.96 0.00 3.17 0.00 0.00 3.44 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.62 0.00 *148 I 7.69 3.97 1.72 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 1.47 0.63 0.48 0.00 0.00 149 E 7.88 3.74 0.00 2.08 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 2.47 2.26 0.00 150 E 8.15 4.18 0.00 1.85 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 151 N 7.31 4.44 0.00 1.44 1.42 0.00 0.00 6.94 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 0.00 152 G 7.35 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 0.00 153 W 7.68 4.99 0.00 3.33 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 0.00 154 Y 7.95 4.40 0.00 3.03 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 0.00 155 D 8.05 4.49 0.00 2.76 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 0.00 156 I 7.51 4.03 2.03 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 1.46 0.54 0.97 0.00 0.00 157 P 0.00 5.06 0.00 2.17 2.13 0.00 3.58 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.80 0.00 158 I 8.80 4.99 1.99 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.15 0.97 0.00 0.00 159 V 9.38 3.92 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 0.97 0.00 0.00 1.09 0.00 0.00 160 G 8.84 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 0.00 161 I 8.63 4.89 1.93 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.12 0.91 0.00 0.00 162 P 0.00 4.77 0.00 2.08 2.15 0.00 3.75 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 2.04 1.94 0.00 163 V 9.64 4.16 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 0.60 0.00 0.00 0.92 0.00 0.00 164 G 7.52 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 0.00 165 F 8.69 3.95 0.00 3.05 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.01 3.81 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.72 0.94 0.00 0.00 167 N 8.21 4.32 0.00 2.75 2.87 0.00 0.00 7.03 8.06 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 0.00 168 A 7.88 3.98 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 0.00 169 S 8.25 4.10 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 0.00 170 K 8.35 4.06 0.00 1.79 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.67 7.81 171 A 7.87 3.99 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 0.00 172 K 8.18 4.05 0.00 1.81 1.83 0.00 1.76 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.61 7.81 173 E 8.00 4.09 0.00 2.13 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 2.34 2.57 0.00 174 G 7.79 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 0.00 0.00 0.00 175 L 7.38 3.78 0.00 1.63 1.12 0.82 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 176 V 6.79 3.74 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 1.07 0.00 0.00 0.95 0.00 0.00 177 S 8.23 4.58 0.00 3.88 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 0.00 178 S 7.60 4.48 0.00 4.03 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 0.00 179 H 8.88 4.89 0.00 3.11 3.59 0.00 5.91 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 I 7.45 4.50 1.97 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 1.28 0.82 1.02 0.00 0.00 181 E 8.82 4.58 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.32 0.00 182 Y 8.84 5.00 0.00 3.20 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 0.00 183 I 8.27 4.31 0.56 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.16 0.58 0.00 0.00 184 S 9.20 4.88 0.00 4.03 3.84 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 0.00 185 V 8.11 4.93 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 0.89 0.00 0.00 0.94 0.00 0.00 186 E 9.47 4.02 0.00 1.93 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 0.00 2.37 2.43 0.00 187 G 8.71 3.84 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 0.00 0.00 0.00 188 H 8.56 4.69 0.00 3.16 3.24 0.00 5.73 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 R 8.05 4.02 0.00 1.80 1.86 0.00 3.45 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 190 G 7.62 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 0.00 191 G 7.97 4.42 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 0.00 0.00 0.00 192 S 8.87 4.11 0.00 3.87 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 0.00 193 P 0.00 4.25 0.00 2.14 2.10 0.00 3.53 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 2.18 0.00 194 I 7.68 3.66 1.99 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 1.56 1.01 0.91 0.00 0.00 195 A 8.02 3.99 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 0.00 196 A 8.46 4.00 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 0.00 197 S 8.15 4.05 0.00 4.09 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 0.00 198 I 7.47 3.81 2.13 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.72 1.19 0.00 0.00 199 V 7.54 3.84 2.19 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 1.00 0.00 0.00 0.98 0.00 0.00 200 N 8.40 4.46 0.00 2.87 2.81 0.00 0.00 6.97 7.13 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 0.00 201 G 8.44 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 F 8.72 4.20 0.00 3.40 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 0.00 203 G 8.11 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 0.00 0.00 0.00 204 R 7.52 4.01 0.00 1.11 1.25 0.00 3.02 0.00 0.00 2.96 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.56 0.00 205 F 8.21 4.84 0.00 3.07 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 0.00 206 L 7.73 4.39 0.00 1.75 1.58 0.98 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.