NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.5846 8.0433 122.7625 55.1791 43.6484 175.0185 2 I 4.7916 8.6908 127.9472 58.3883 40.6845 173.2813 3 L 4.9037 9.5828 129.9053 53.3824 44.7064 174.5991 4 Y 4.7088 8.8168 125.8911 57.9097 39.0037 174.5664 5 D 5.0380 9.5466 123.8130 52.6559 45.5770 173.1889 6 Y 5.6951 8.7402 124.6060 54.5989 41.0335 176.3644 7 F 4.0569 8.8979 121.3986 59.1020 38.2120 176.3469 8 R 3.9818 5.8400 117.9866 55.4619 30.2325 175.5929 9 S 4.4994 7.5503 112.7976 58.3156 63.1344 174.8005 10 T 4.0248 8.7619 120.5125 64.5749 68.4839 176.3846 11 A 3.8996 7.9489 123.5093 55.4075 18.5460 179.2465 12 C 4.1604 8.0900 114.9718 62.8145 28.1472 175.6383 13 Y 4.1638 8.1563 121.4081 60.8798 38.3479 178.1828 14 R 3.7932 8.0995 119.0052 59.5117 30.2290 179.2334 15 V 3.5215 7.4869 117.5405 65.9399 31.6342 177.9921 16 R 3.9109 8.5168 118.1909 59.4798 29.9293 178.8220 17 I 3.6393 7.8363 118.9280 64.5409 37.1291 178.3258 18 A 3.9847 7.6669 120.8684 55.1625 18.0637 179.6233 19 L 3.9006 7.9036 117.4781 57.9069 41.5482 179.6039 20 N 4.3724 8.0052 116.2679 56.3695 38.3596 177.5353 21 L 4.0152 8.1128 119.5010 57.1732 41.7602 178.7611 22 K 4.2492 7.8757 115.4999 54.9293 32.6466 176.4407 23 K 3.8449 7.8825 117.9461 57.1697 30.3796 175.0569 24 I 4.0937 7.8519 118.7368 60.3933 37.9488 176.3564 25 A 4.3593 8.5369 128.7658 52.3361 19.1846 175.7051 26 Y 4.8990 7.6372 116.9674 56.2865 40.7433 173.3624 27 E 4.3304 8.9915 121.0626 55.3416 31.2821 175.1051 28 K 5.0193 8.4739 125.4090 54.6884 34.4848 175.0470 29 I 4.4585 8.5709 127.7879 59.5605 40.3892 174.7103 30 E 5.2920 8.7725 127.3149 56.0372 29.7526 178.3719 31 V 3.9300 8.8166 121.6537 62.3428 32.0158 179.3097 *54 V 4.0345 8.9489 115.8692 61.1201 33.2655 173.3099 55 P 4.9354 0.0000 0.0000 62.8826 32.6845 175.5933 56 S 4.8914 8.7071 116.8375 56.8349 67.1927 172.5628 57 L 4.8669 8.9660 126.8840 53.7212 43.9076 174.5670 58 D 5.2410 9.6059 127.6628 52.9324 42.7027 174.9624 59 I 4.3054 9.2223 128.9878 59.3846 38.0275 175.9712 60 N 4.1272 9.5554 127.5885 54.1704 35.7856 175.3618 61 G 4.1510 8.5423 105.8609 45.9153 0.0000 173.0156 62 Q 4.2628 8.0395 120.1800 55.0256 29.4518 174.8156 63 I 4.9170 8.1517 116.0892 58.8466 39.9872 174.6499 64 L 4.7523 8.9667 124.6243 53.3308 44.7416 176.7568 65 S 4.6033 8.5965 116.7573 57.5565 64.7442 173.5455 66 Q 4.5632 7.7663 121.4945 53.9966 30.2660 176.4371 67 S 4.0364 8.7806 116.9330 59.3730 63.5294 176.0360 *69 A 4.2585 8.1438 125.1682 53.0674 20.3585 179.7776 70 I 3.7236 8.5178 116.9684 64.7102 37.0968 178.7060 71 I 3.7088 7.6792 120.3167 64.6284 36.9591 178.2012 72 D 4.4541 8.1919 119.1413 57.5149 40.5032 178.2933 73 Y 4.0305 8.1217 120.0747 60.6530 38.8689 177.7840 74 L 3.9217 8.3225 120.3302 57.9748 41.2616 179.4618 75 E 4.1892 8.6442 118.8307 58.8628 29.0969 179.0194 76 E 3.9576 7.8379 118.8861 59.2380 29.9371 178.4698 77 I 3.8094 7.5970 118.8853 62.9480 38.2661 175.8824 78 H 4.7622 8.3860 119.3163 52.7814 29.4545 171.3846 79 P 4.5959 0.0000 0.0000 64.4374 31.6981 177.1117 80 E 4.1143 7.2699 118.1280 55.2855 27.3811 173.5226 *82 P 4.4325 0.0000 0.0000 62.5398 32.6782 177.3295 83 L 4.4525 9.2306 120.5096 55.2877 42.1630 176.3261 84 L 4.9788 7.3166 117.2980 52.2904 45.6319 173.9514 85 P 4.6513 0.0000 0.0000 62.3008 32.1746 176.9036 86 K 4.1346 8.5066 118.6018 58.9680 32.3681 178.0200 87 D 4.4123 8.1652 117.7141 54.0652 41.5659 174.2888 88 P 4.3636 0.0000 0.0000 65.8005 31.8020 178.2792 89 F 4.2274 8.4107 115.8023 59.2417 39.2021 176.0250 *91 K 4.0563 8.1696 121.2500 56.2329 33.7936 177.6705 92 A 3.9094 8.1401 120.7678 55.4292 17.9539 179.6490 93 T 3.4530 7.6347 113.4548 66.6736 68.4861 176.4603 94 L 4.0537 7.4835 119.1621 56.9176 42.1342 178.6474 95 K 4.0709 7.9658 120.2080 59.3137 32.0625 179.6456 96 S 4.3768 7.9917 113.7364 58.6143 63.0934 175.9545 *98 A 4.3691 8.0459 127.1246 53.3105 20.5722 179.9153 99 L 3.9956 7.9542 115.7761 57.6323 41.5228 179.4200 100 I 3.8113 7.9528 120.2505 64.5985 36.8701 178.5043 101 V 3.4304 7.7009 116.4578 66.0823 31.7287 177.7081 102 A 4.1036 8.2160 119.0525 54.2104 18.1952 178.2028 103 C 4.5521 8.2727 113.9206 60.9645 30.0413 175.1673 104 D 4.4744 7.5742 117.0406 54.6300 40.7572 176.6368 *106 H 4.6906 7.8979 121.1153 55.7235 31.6632 173.5920 107 P 4.1568 0.0000 0.0000 65.4359 31.3049 178.5712 108 L 3.8817 7.5284 116.5414 56.8223 41.6840 177.3555 109 N 4.7882 7.5231 114.4029 52.3326 39.3605 174.0229 110 N 4.4536 7.5117 118.2501 53.6536 39.8050 174.9664 111 L 3.9783 8.9618 126.7384 58.7251 42.1602 179.7067 112 R 3.9694 8.0237 115.0788 59.1958 29.1925 178.9238 113 V 3.5262 7.8304 118.8778 65.7803 31.7622 177.8314 114 L 3.8354 7.9103 118.2190 57.9842 41.4511 178.9742 115 N 4.2809 8.4806 116.6014 56.5287 38.4789 177.2607 116 R 3.8531 7.7382 119.3984 59.4709 30.0663 178.5057 117 L 4.1007 7.9089 118.6750 57.8541 41.4977 179.6846 118 K 4.1494 7.9706 118.0223 58.9534 31.7361 179.2321 119 E 3.8395 8.2068 119.5023 59.5550 29.7863 178.5735 120 Q 3.9017 8.3989 116.9279 57.5511 28.8028 176.9776 121 F 4.6662 7.7917 115.1844 56.4265 40.2884 174.9070 122 N 4.7271 8.3651 117.4034 53.4733 37.0565 173.9574 123 A 4.6329 8.0017 120.2786 51.8041 19.6520 177.6069 124 N 4.8832 8.4842 118.1779 50.8068 41.0769 175.5487 125 E 3.9117 8.6720 120.1072 59.9644 29.5197 178.5411 126 E 4.0343 8.2391 118.0356 58.9775 29.6963 178.6159 127 Q 4.0594 8.3528 118.5280 58.6855 28.8152 178.2784 128 V 3.6602 8.0999 119.5724 66.1191 31.4582 178.0975 129 L 4.0708 8.1670 118.6158 57.8473 41.4391 179.3047 130 E 3.9931 8.1461 118.0874 59.3054 29.3042 178.8641 131 W 3.9394 8.3571 128.3775 60.5285 30.8368 176.9462 132 Y 4.9355 8.8233 120.8683 60.8308 38.2174 178.5054 133 H 4.4223 8.8198 116.9494 58.8546 28.7294 177.2540 134 H 3.9077 8.0267 120.2915 59.0660 29.5929 177.4517 135 W 4.2337 7.0900 120.2961 59.3141 28.6880 178.6129 136 L 3.3505 7.4389 118.6156 57.3863 40.9579 179.3967 137 K 4.2421 8.0913 119.7382 59.9626 32.0803 178.7997 138 T 3.9488 8.0227 116.3194 66.5681 68.3011 176.8928 139 G 3.4027 7.9828 107.3489 47.9059 0.0000 175.7172 140 F 4.2947 7.7756 121.3405 60.0903 38.7237 177.3465 141 D 4.7464 8.5056 118.3075 57.6128 40.7414 178.9281 142 A 4.0092 7.8393 121.0294 55.0966 18.3854 179.2947 143 F 3.8089 8.6274 119.5281 61.5049 39.6607 176.6332 144 E 4.1407 9.1389 119.2074 59.5317 29.1657 178.0787 145 E 3.9583 8.0874 117.9269 59.8038 29.8609 178.9697 146 K 4.0670 8.2051 117.9708 59.1997 32.0358 179.3338 147 L 4.0964 8.1590 119.8215 57.8037 41.3440 179.7128 148 G 3.7305 7.8944 103.7635 46.8340 0.0000 174.5535 149 A 4.4606 7.6001 120.5797 51.6016 19.5088 176.5584 150 L 4.9022 7.1524 117.0226 52.9233 44.6234 175.7965 151 E 4.9565 8.8197 120.2441 55.0693 32.1979 175.1677 152 R 4.9515 8.3092 117.6348 55.0955 32.4943 174.2594 153 D 4.8196 8.0779 119.2649 53.2968 41.6218 175.5571 154 K 4.0405 7.0655 117.1273 55.9495 35.1321 174.0664 155 P 4.5336 0.0000 0.0000 61.9407 29.2706 175.8163 156 V 4.9840 6.8943 111.6750 59.1211 35.9262 176.0493 157 C 4.3208 9.1371 119.7782 62.7849 28.1549 175.0132 158 F 5.0951 7.8591 119.3302 57.6995 43.1052 174.2816 159 G 3.2722 8.4257 116.2323 47.0412 0.0000 175.0352 160 S 4.5903 8.4797 120.0193 57.6410 64.2905 173.2219 161 E 4.7831 7.7323 118.8259 54.0668 33.0086 175.7553 162 V 4.0911 8.4972 121.8500 63.2039 32.7117 175.8224 163 G 4.2003 9.2423 113.1971 43.7001 0.0000 172.3478 164 L 3.9470 8.9411 119.7913 58.2232 41.9422 179.8831 165 A 4.1486 8.1179 120.1969 55.3960 18.4136 179.1694 166 D 4.4275 8.2388 116.8073 57.6952 40.8274 178.9087 167 V 3.5729 7.7644 117.4428 66.1163 31.1637 177.2643 168 C 4.2814 8.0242 115.9593 61.6937 28.2331 175.6944 169 L 3.7463 8.3299 122.4266 58.1479 41.6601 178.8371 170 I 3.8418 7.6141 119.4729 64.3377 37.2834 176.7865 171 P 4.1130 0.0000 0.0000 65.2728 31.0869 178.5506 172 Q 4.0451 7.7772 117.6979 59.0245 28.9651 178.2903 173 V 3.6704 8.1721 119.6085 66.2495 31.5112 177.0668 174 Y 4.2123 8.3727 119.3549 61.2469 38.6507 178.1814 175 N 4.6005 8.5024 116.4623 56.1393 38.6084 177.3567 176 A 4.2379 8.2127 122.3499 55.5859 18.5505 179.4007 177 H 4.2085 8.2182 114.7146 59.1804 28.6131 177.8655 178 R 3.6276 7.6920 119.1765 58.6555 29.6124 177.4292 179 F 4.4145 7.4887 114.5777 56.3871 40.1002 175.1003 180 H 4.1249 8.4936 113.7860 56.9798 26.4111 174.7663 181 F 4.5670 8.3505 120.7541 56.4301 40.5577 175.0170 182 D 4.3787 7.5632 127.2671 53.5447 42.3304 174.9227 *184 A 4.3178 8.3043 121.3614 52.2229 20.0579 177.7122 185 S 4.2136 7.6198 108.4739 59.1990 63.8192 173.8857 186 Y 5.0792 7.0739 117.3899 55.3774 38.2829 174.0573 187 P 4.2643 0.0000 0.0000 65.8407 31.9328 178.5479 188 I 3.7364 7.8771 117.6732 64.5628 37.0131 178.3428 189 I 3.7376 7.8869 120.0788 64.8304 36.9806 178.2701 190 N 4.3792 8.4479 117.0993 56.1789 38.2214 177.4395 191 E 3.9903 8.2673 120.1109 59.3599 29.4879 179.3814 192 I 4.2732 8.0065 121.3801 63.9895 37.2405 177.6819 193 N 4.1851 8.3988 118.2078 56.8609 38.4494 176.3223 194 E 3.8972 7.8860 118.9075 59.5052 30.0986 177.6679 195 Y 4.2267 8.2472 119.7095 61.1712 38.8763 177.7352 196 C 3.3091 8.2330 117.5380 62.6897 27.9650 175.9264 197 L 4.3098 7.5361 118.1591 56.4999 41.3136 178.7988 198 T 4.0228 7.9584 110.0585 62.7961 69.4266 174.7622 199 L 4.3296 7.1337 122.7637 53.1396 42.9826 175.6296 200 P 4.2535 0.0000 0.0000 65.9910 31.0290 178.5527 201 A 4.0880 8.1149 117.6896 55.1750 18.5319 179.3392 202 F 4.2204 8.4117 115.5248 60.8193 39.2789 177.1890 203 H 4.1430 8.5922 118.0015 59.7520 29.4682 176.5913 204 D 4.5559 8.7378 117.6336 55.7756 40.8311 177.3266 205 A 4.4066 7.7566 119.8424 51.2333 20.2524 177.2187 206 A 2.8525 6.9298 121.1335 50.7555 19.4338 176.9879 207 P 4.3439 0.0000 0.0000 64.8995 31.7636 178.7333 208 E 3.8890 8.2082 117.7029 59.0892 29.6834 177.7368 209 A 4.0462 7.5779 120.0721 54.7102 18.6905 177.3015 210 I 3.9202 7.2529 120.4427 61.6100 37.2080 175.6390 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 L 8.04 4.58 0.00 1.81 1.74 1.01 0.68 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 2 I 8.69 4.79 1.70 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 1.02 0.73 0.47 0.00 0.00 3 L 9.58 4.90 0.00 1.58 1.66 0.89 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 4 Y 8.82 4.71 0.00 3.07 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 5 D 9.55 5.04 0.00 2.82 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 Y 8.74 5.70 0.00 3.05 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 7 F 8.90 4.06 0.00 3.12 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 8 R 5.84 3.98 0.00 0.67 1.44 0.00 3.18 0.00 0.00 3.13 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.45 0.00 9 S 7.55 4.50 0.00 4.14 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 10 T 8.76 4.02 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 1.56 0.00 0.00 11 A 7.95 3.90 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 12 C 8.09 4.16 0.00 3.32 3.31 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 13 Y 8.16 4.16 0.00 2.97 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 14 R 8.10 3.79 0.00 2.02 1.92 0.00 3.12 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.88 0.00 15 V 7.49 3.52 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.94 0.00 0.00 16 R 8.52 3.91 0.00 2.06 2.04 0.00 3.23 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.93 0.00 17 I 7.84 3.64 1.78 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.86 -0.01 0.00 0.00 18 A 7.67 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 19 L 7.90 3.90 0.00 1.78 1.66 -0.12 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 20 N 8.01 4.37 0.00 2.96 2.86 0.00 0.00 7.00 6.58 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 21 L 8.11 4.02 0.00 1.66 1.74 0.87 0.97 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 22 K 7.88 4.25 0.00 1.77 1.54 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.49 1.41 7.81 23 K 7.88 3.84 0.00 1.85 1.86 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.40 7.81 24 I 7.85 4.09 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.51 0.97 0.00 0.00 25 A 8.54 4.36 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 26 Y 7.64 4.90 0.00 3.07 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 27 E 8.99 4.33 0.00 1.92 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 0.00 2.22 2.21 0.00 28 K 8.47 5.02 0.00 1.67 1.61 0.00 1.93 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.59 7.81 29 I 8.57 4.46 1.71 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.51 0.98 0.00 0.00 30 E 8.77 5.29 0.00 1.95 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.17 0.00 31 V 8.82 3.93 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.07 0.00 0.00 *54 V 8.95 4.03 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 0.84 0.00 0.00 1.00 0.00 0.00 55 P 0.00 4.94 0.00 2.10 2.08 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.17 0.00 56 S 8.71 4.89 0.00 3.87 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 0.00 57 L 8.97 4.87 0.00 1.69 1.41 0.83 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 58 D 9.61 5.24 0.00 2.96 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 59 I 9.22 4.31 1.86 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.34 1.05 0.00 0.00 60 N 9.56 4.13 0.00 2.83 2.84 0.00 0.00 7.20 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 61 G 8.54 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Q 8.04 4.26 0.00 2.35 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.71 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 63 I 8.15 4.92 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.60 0.97 0.00 0.00 64 L 8.97 4.75 0.00 1.41 1.27 0.84 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.60 4.60 0.00 3.94 3.87 0.00 0.00 0.00 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2.54 2.55 0.00 145 E 8.09 3.96 0.00 2.22 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 0.00 2.36 2.44 0.00 146 K 8.21 4.07 0.00 1.73 1.66 0.00 1.56 0.00 0.00 1.47 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.41 7.81 147 L 8.16 4.10 0.00 2.05 1.80 0.97 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 148 G 7.89 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 0.00 149 A 7.60 4.46 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 0.00 150 L 7.15 4.90 0.00 1.72 1.76 0.85 0.67 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 0.00 151 E 8.82 4.96 0.00 2.00 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 2.35 2.35 0.00 152 R 8.31 4.95 0.00 1.93 1.83 0.00 2.98 0.00 0.00 3.42 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 153 D 8.08 4.82 0.00 2.57 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 0.00 154 K 7.07 4.04 0.00 1.21 1.50 0.00 1.66 0.00 0.00 1.50 0.00 0.00 2.91 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.02 0.99 7.81 155 P 0.00 4.53 0.00 2.19 2.09 0.00 2.48 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 156 V 6.89 4.98 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.99 0.00 0.00 157 C 9.14 4.32 0.00 3.13 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 0.00 158 F 7.86 5.10 0.00 2.84 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 0.00 159 G 8.43 3.27 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 0.00 0.00 0.00 0.00 160 S 8.48 4.59 0.00 3.73 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 0.00 161 E 7.73 4.78 0.00 1.92 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 2.19 2.22 0.00 162 V 8.50 4.09 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.09 0.00 0.00 163 G 9.24 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 0.00 164 L 8.94 3.95 0.00 1.75 1.71 0.92 1.36 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 0.00 165 A 8.12 4.15 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 D 8.24 4.43 0.00 3.22 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 0.00 167 V 7.76 3.57 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 0.74 0.00 0.00 0.94 0.00 0.00 168 C 8.02 4.28 0.00 3.08 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 0.00 169 L 8.33 3.75 0.00 1.61 1.78 0.28 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 170 I 7.61 3.84 2.02 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 1.52 0.49 0.93 0.00 0.00 171 P 0.00 4.11 0.00 1.99 1.80 0.00 3.53 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.82 0.00 172 Q 7.78 4.05 0.00 2.25 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.80 0.00 0.00 0.00 0.00 0.00 2.10 2.30 0.00 173 V 8.17 3.67 2.30 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 0.96 0.00 0.00 0.86 0.00 0.00 174 Y 8.37 4.21 0.00 3.27 3.36 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 0.00 175 N 8.50 4.60 0.00 3.25 3.24 0.00 0.00 6.93 7.43 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 0.00 176 A 8.21 4.24 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 H 8.22 4.21 0.00 3.11 3.29 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 R 7.69 3.63 0.00 1.28 1.89 0.00 3.20 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.32 0.00 179 F 7.49 4.41 0.00 2.95 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 0.00 180 H 8.49 4.12 0.00 3.38 3.43 0.00 5.66 0.00 0.00 0.00 0.00 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 F 8.35 4.57 0.00 2.93 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 D 7.56 4.38 0.00 2.50 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 0.00 0.00 0.00 *184 A 8.30 4.32 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 0.00 185 S 7.62 4.21 0.00 2.98 3.38 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 0.00 186 Y 7.07 5.08 0.00 2.90 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 0.00 187 P 0.00 4.26 0.00 2.17 2.12 0.00 3.85 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 2.11 2.17 0.00 188 I 7.88 3.74 2.16 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.77 1.00 0.00 0.00 189 I 7.89 3.74 2.03 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.14 0.67 0.00 0.00 190 N 8.45 4.38 0.00 2.91 2.89 0.00 0.00 7.07 7.23 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 0.00 191 E 8.27 3.99 0.00 2.19 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 2.35 2.58 0.00 192 I 8.01 4.27 2.07 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 2.03 1.04 0.00 0.00 193 N 8.40 4.19 0.00 2.88 2.86 0.00 0.00 6.94 7.49 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 0.00 194 E 7.89 3.90 0.00 2.22 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 0.00 2.35 2.34 0.00 195 Y 8.25 4.23 0.00 3.05 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 0.00 196 C 8.23 3.31 0.00 2.45 1.18 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 0.00 197 L 7.54 4.31 0.00 1.65 1.79 1.04 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 198 T 7.96 4.02 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 1.23 0.00 0.00 199 L 7.13 4.33 0.00 1.83 1.63 0.64 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 200 P 0.00 4.25 0.00 2.19 2.14 0.00 3.63 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 201 A 8.11 4.09 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 0.00 202 F 8.41 4.22 0.00 3.43 3.23 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 0.00 203 H 8.59 4.14 0.00 3.48 3.37 0.00 5.58 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 0.00 204 D 8.74 4.56 0.00 2.78 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 0.00 205 A 7.76 4.41 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 A 6.93 2.85 1.18 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 0.00 207 P 0.00 4.34 0.00 2.13 2.00 0.00 3.26 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.42 0.00 208 E 8.21 3.89 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 2.30 2.29 0.00 209 A 7.58 4.05 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 I 7.25 3.92 1.96 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.81 0.90 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.