NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.1959 8.1233 123.5801 52.1594 20.4012 178.2047 *2 D 4.5309 8.1002 119.7646 55.3649 42.5751 176.4871 3 S 4.4802 7.6866 110.4922 58.1038 63.2357 173.7534 4 I 4.0612 7.4707 122.4155 60.0344 37.1337 175.5018 5 A 4.1293 8.3919 129.1819 51.6658 18.9093 177.0990 6 K 4.3365 8.4101 121.2762 56.7799 32.9262 176.8591 7 R 4.4664 9.0401 122.7818 54.5382 31.4063 174.9460 8 P 4.3362 0.0000 0.0000 62.7338 32.1938 176.4943 9 R 3.9364 8.6191 122.7465 56.7643 29.9858 175.8084 10 T 4.6600 8.2019 116.2910 60.1575 70.8507 172.6911 11 R 4.6049 8.4534 122.6971 54.3288 31.5660 175.8451 12 L 4.8912 8.1803 122.4627 52.0014 45.2787 177.3031 13 S 4.3571 8.3734 116.3309 57.7901 65.0954 173.4087 14 P 4.8741 0.0000 0.0000 65.4298 31.1413 178.6941 15 L 4.0589 7.6930 117.6210 57.9947 41.8944 179.1652 16 K 4.0224 7.9759 118.1461 59.1106 32.0497 179.1053 17 R 3.7132 8.2964 119.5263 59.1487 29.7438 178.2643 18 K 3.4798 7.5346 117.9792 59.7860 32.2962 178.4830 19 Q 4.1495 7.7589 115.6270 57.8947 28.8875 177.8521 20 Q 4.2147 7.6350 121.0007 58.5373 29.2248 178.6055 21 L 4.1599 7.9176 117.9338 55.2919 41.6171 178.9508 *23 E 4.3286 8.1412 120.2279 56.7006 31.7358 178.4457 24 I 3.6201 7.9761 119.1159 64.2640 37.1215 178.0657 25 A 3.4959 8.0882 121.9659 55.1595 18.0995 179.6676 26 L 4.0883 7.8185 116.6004 58.0116 41.8267 179.2050 27 E 3.6128 8.1963 119.1279 59.0722 29.4762 178.7831 28 V 3.4096 7.9732 118.5453 66.2865 31.4654 178.1342 29 F 4.4887 8.2889 117.3890 60.4314 38.4684 177.5676 30 A 4.0915 8.4527 120.3081 55.0435 18.2078 179.4564 31 R 4.1272 7.7473 115.4889 58.5804 30.6244 178.4711 32 R 4.4356 8.2085 115.4423 54.8406 31.8010 177.4178 33 G 4.0349 7.9486 105.7347 44.5770 0.0000 173.0742 34 I 3.1513 8.0466 120.6703 62.6670 37.4739 176.4888 35 G 3.8653 7.5786 113.2831 46.8807 0.0000 173.7863 36 R 4.6952 8.6185 112.0513 52.8894 31.0074 175.7722 37 G 4.4046 7.4380 110.3673 45.9903 0.0000 171.6186 38 G 3.8311 8.0924 110.6035 43.7992 0.0000 174.8473 39 H 3.8576 9.2390 116.2406 59.0528 28.6990 177.2643 40 A 4.1764 7.9787 121.9015 55.0768 18.4811 179.2285 41 D 4.2876 8.0081 117.0343 57.4769 40.9132 178.9396 42 I 3.5726 7.8326 120.0464 64.3170 37.1372 178.2173 43 A 4.0023 8.4566 121.9498 55.2594 17.9318 179.3505 44 E 3.8864 7.9792 116.7711 59.5008 29.9541 178.8316 45 I 3.8377 7.6844 119.3067 64.2321 36.9548 178.1621 46 A 3.4587 8.0943 120.3636 52.5069 18.6574 177.1109 47 Q 3.4911 8.0128 115.0734 57.6467 26.5712 173.4440 48 V 4.5666 7.4929 108.5605 58.8888 35.4092 176.0597 49 S 4.4019 8.2858 115.2919 58.0388 63.8767 175.4997 50 V 3.6867 8.5868 121.0019 66.2207 31.1688 178.0148 51 A 4.2041 8.2465 120.0646 55.6748 17.7928 179.4859 52 T 3.9314 8.2052 114.1662 66.9724 68.5037 176.9739 53 V 3.8484 7.7501 120.0898 66.2163 31.4218 178.1137 54 F 4.8491 8.6301 118.7498 59.6962 38.4367 176.9373 55 N 4.2303 8.2553 116.6456 57.0784 39.0801 175.8934 56 Y 4.2398 7.8747 116.8533 58.5380 38.9639 174.6039 57 F 4.7740 8.4520 118.3420 54.4502 40.1649 173.2521 58 P 4.7861 0.0000 0.0000 64.3054 31.7813 177.1407 59 T 5.0252 8.1611 106.8057 59.1112 73.2459 174.8485 60 R 4.1000 8.6147 120.6107 59.4999 30.0833 178.2343 61 E 4.0397 8.2998 118.1612 59.4187 29.5204 178.7535 62 D 4.4691 8.3341 118.9127 57.2998 40.9428 178.3880 63 L 3.7215 7.9959 120.6824 58.2614 41.9416 179.3233 64 V 3.6202 8.0548 117.8109 66.1727 31.5039 177.3048 65 D 4.4617 8.3208 118.8379 57.9497 40.7765 179.2375 66 E 4.1077 8.4728 118.6013 59.1852 29.3654 179.6184 67 V 3.7625 8.0047 118.4772 65.8871 31.6667 177.6820 68 L 3.4801 8.2437 120.3010 58.3198 41.8296 178.6724 69 N 4.2569 8.4249 116.6201 56.4556 38.4421 176.9336 70 H 4.0801 8.4186 119.5121 59.5480 29.9976 177.8926 71 V 3.8923 8.3343 114.5638 64.2807 31.3989 178.7548 72 V 3.7898 8.1234 118.2892 66.0191 31.4923 178.0116 73 R 3.8090 7.9014 118.3695 59.6212 29.9387 178.5026 74 Q 3.3882 7.7504 117.7118 58.6103 28.3979 178.6014 75 F 4.0659 8.1890 121.8946 61.1236 39.2258 177.3393 76 S 4.0651 8.1073 114.9463 61.7325 62.6179 176.4870 77 N 4.2416 7.8324 118.6234 56.0041 38.1323 177.2794 78 F 4.0228 8.0378 122.0173 61.2257 39.4713 177.1061 79 L 3.6197 7.9863 118.7839 57.7705 41.1832 179.4562 80 S 3.9950 7.9288 112.0312 61.5084 62.3887 175.6633 81 D 4.4316 7.9738 119.8814 55.9930 40.6723 176.6235 82 N 4.7360 7.1335 112.7104 52.5003 40.7339 174.3921 83 I 4.1108 7.7470 120.2459 59.9972 38.1799 174.8775 84 D 4.6764 9.1240 125.1728 52.1095 41.7009 176.1434 85 L 4.1503 8.2987 126.5504 56.6298 41.9601 178.6239 86 D 4.4620 8.0586 118.6147 56.7640 40.9769 177.1102 87 L 4.2255 7.5371 118.0830 54.3686 42.5122 176.9495 88 H 4.6462 8.3781 118.1712 54.8277 30.8766 176.6867 89 A 3.7927 9.8171 124.8115 55.4082 18.1023 179.8622 90 K 3.8509 8.0615 117.4436 59.7752 32.2771 178.3696 91 E 3.9342 8.1097 118.9086 59.2848 29.5838 178.2815 92 N 4.2910 8.1241 116.5271 56.3957 38.6350 177.4130 93 I 3.8470 8.0844 121.2359 64.3376 37.1463 178.2541 94 A 4.0828 8.2270 121.5764 55.3005 18.1727 179.4203 95 N 4.2777 8.2755 114.7912 56.5557 38.4442 177.6048 96 I 3.6966 7.7702 120.0871 64.7665 37.3491 178.3597 97 T 4.2630 8.0363 109.1295 64.9089 68.5514 175.9990 98 N 4.5329 8.6044 119.4326 55.8945 38.4086 177.6603 99 A 4.1567 8.2460 120.4304 52.6567 18.4588 179.3423 *101 I 4.0630 7.7622 123.6534 63.1009 39.3814 178.2335 102 E 3.9937 8.0923 119.5468 59.4660 29.2204 179.4657 103 L 4.0086 7.7601 119.1991 57.6112 41.5615 179.7734 104 V 3.5521 7.6539 117.8364 66.0277 31.3916 178.1485 105 V 3.5661 7.6697 116.7499 65.6922 31.3240 176.9745 106 Q 4.2664 7.6135 115.5666 54.4724 29.6992 175.4102 107 D 4.2589 7.9299 118.7411 55.2877 40.0134 174.5023 108 N 4.4863 8.0920 117.3621 53.2203 39.1531 176.6677 109 H 4.3766 8.8026 122.3213 58.4642 28.7832 177.6645 110 W 4.4897 8.3069 118.2635 59.7836 27.8135 178.0365 111 L 3.3360 6.5439 120.5932 57.3092 41.4423 178.8856 112 K 4.2382 7.8233 118.7911 59.4547 32.0048 179.5623 113 V 3.7855 8.2396 118.6817 65.6723 31.5203 177.8422 114 W 4.3094 8.8432 128.5437 60.6417 30.3761 177.8851 115 F 3.9701 8.2979 116.4598 60.7228 38.2318 177.3091 116 E 4.2967 8.3555 118.1822 59.0634 29.1130 179.1841 117 W 3.9522 8.3656 128.8752 60.3221 30.5475 178.2021 118 S 2.7900 7.2188 112.8801 59.8077 62.2084 175.2782 119 A 4.0928 6.9033 121.6894 50.7905 19.3313 177.1003 120 S 4.1331 7.1807 113.3641 58.6825 62.9443 173.9176 121 T 4.4151 8.2794 115.1910 61.1759 69.2681 173.7759 122 R 4.1676 8.1349 124.3171 56.0449 30.5885 176.4730 123 D 4.5393 9.0808 125.5475 57.1636 41.1228 176.7490 124 E 4.3167 8.0093 113.2447 56.3404 30.0164 176.0609 125 V 4.2783 7.9887 118.1392 64.5808 33.1525 177.1295 126 W 4.5148 8.1303 115.7944 59.4674 27.7894 176.0984 127 P 3.8827 0.0000 0.0000 65.0908 30.6739 178.2978 128 L 3.9367 7.7099 118.6750 57.6651 42.0147 178.5850 129 F 3.6236 7.9224 119.7888 61.1944 39.1604 177.2071 130 V 3.6449 8.1428 117.0262 66.2695 31.0728 177.6685 131 T 4.0870 7.8787 109.3447 64.8942 68.6729 177.1160 132 T 3.8588 7.6028 117.7518 65.8394 68.7704 175.2274 133 N 4.5471 8.0671 117.8502 53.5511 38.6195 176.3869 134 R 3.8864 7.4639 120.3018 60.0410 30.0540 178.7634 135 T 3.8994 7.8532 114.8500 66.5348 68.4576 176.3537 136 N 4.4517 8.1922 118.0790 56.3759 38.6331 176.9670 137 Q 4.1406 8.1184 120.5192 59.3287 29.1971 178.3309 138 L 4.0250 8.2701 120.2086 57.7773 41.4267 179.2571 139 L 3.9761 8.1049 119.6514 58.1054 42.0596 178.9818 140 V 3.6771 7.6900 117.4257 65.9745 31.3092 177.5381 141 Q 4.3875 8.5249 118.2365 59.0120 28.5470 179.5544 142 N 4.2881 8.1584 116.1171 54.0812 38.9427 176.4159 *144 F 4.7997 8.1242 119.3060 57.0827 41.5059 177.6383 145 I 3.7511 8.2359 121.9743 64.2925 36.9627 178.1996 146 K 3.8570 7.9743 119.0494 59.6083 31.9254 179.0153 147 A 4.2528 7.8868 121.4577 54.6929 18.3144 179.5405 148 I 3.7184 8.0182 118.1960 64.7458 37.0052 178.5869 149 E 4.0388 8.1475 118.0221 58.9734 29.3675 178.6888 150 R 4.4233 7.7461 114.7618 55.1642 30.4337 176.8951 151 G 4.0356 7.8074 106.4965 45.7550 0.0000 175.1543 152 E 4.4123 8.1701 121.6521 57.7192 29.4018 177.4517 153 V 4.7837 7.5135 110.1920 58.7202 35.4584 174.1435 154 C 3.9654 8.9166 120.7179 60.5063 31.4473 174.0679 155 D 4.6699 8.7180 124.6176 54.3039 39.3765 176.5890 156 Q 4.3713 7.7380 117.7250 56.4035 29.3862 175.5728 157 H 4.4746 7.9410 115.9947 55.5814 29.6164 174.8203 158 N 5.1316 8.3238 118.9225 50.3806 40.9312 174.0051 159 P 4.3372 0.0000 0.0000 65.9580 31.4127 178.8046 160 E 4.2259 7.9950 119.2763 59.0489 29.5036 178.7732 161 D 4.3601 8.0056 118.3442 57.4279 40.8742 178.7929 162 L 3.6295 7.7854 119.1887 57.3334 41.3608 179.3505 163 A 4.2533 7.9166 120.8461 55.3369 18.2584 179.4608 164 N 4.3703 8.3321 115.0336 56.2108 38.4974 177.4199 165 L 3.9197 8.1189 121.8749 58.0679 42.1414 178.3921 166 F 4.3101 8.5518 121.0954 62.0292 39.2509 176.5649 167 H 4.2049 8.8967 117.7215 59.2754 29.7659 177.2891 168 G 3.7117 8.4927 107.7099 48.0017 0.0000 175.7557 169 I 3.8577 8.1620 122.5961 64.2339 37.0945 178.2159 170 C 4.1116 8.2571 117.9563 63.0819 27.9960 175.5480 171 Y 3.5354 8.4487 121.4064 60.5869 38.3291 178.1745 172 S 4.1725 8.1823 113.8037 61.4219 62.5356 176.1550 173 L 3.8896 7.9873 121.7566 57.4947 41.4282 178.9467 174 F 3.7775 8.1747 121.0942 61.3401 38.8576 177.4083 175 V 2.9332 7.0900 115.8628 65.8985 31.6174 177.5833 176 Q 3.9849 7.8759 117.5093 58.9388 28.3158 178.7344 177 A 3.9085 7.9522 121.0083 55.0245 18.4181 178.9409 178 N 4.3142 7.4397 112.8891 54.8137 38.6862 175.9975 179 R 4.4669 7.4239 117.5431 55.9070 31.1400 175.3693 180 T 4.5961 7.2775 110.9799 60.9417 70.2174 172.9415 181 N 4.5357 8.5543 121.8890 53.6135 39.5075 175.8713 182 N 4.6362 7.9160 118.6735 52.3761 38.6577 174.9543 183 T 3.8913 8.1982 119.1644 64.2824 69.0644 176.2257 184 A 3.9490 7.9064 123.1901 55.1250 18.5299 179.2886 185 E 3.8899 8.3269 117.0100 59.4800 29.4802 179.6619 186 L 3.9116 7.7834 118.6227 57.8189 41.7005 179.6261 187 S 4.3307 8.5302 116.8095 60.9643 62.7322 176.7556 188 K 3.9616 8.2358 122.3699 59.2676 31.9173 178.6339 189 L 3.8158 7.9023 120.8012 57.7980 41.8810 178.8524 190 V 3.4537 7.5642 118.2432 66.2239 31.3728 177.9224 191 S 4.1444 7.8267 113.9494 61.8861 62.5524 176.7188 192 S 4.1869 8.1654 116.4901 62.1408 62.7462 176.2659 193 Y 4.4551 8.3229 117.8064 61.4053 37.7611 178.6790 194 L 4.2648 8.0589 118.3290 57.4281 42.1258 179.3740 195 D 4.5773 8.1543 120.2835 53.0926 40.5326 176.2334 *197 L 4.1283 7.1999 117.3808 54.9158 43.2002 178.0503 198 C 4.2516 8.2813 119.4244 58.6843 26.4387 171.9691 199 I 4.7646 7.0869 121.0461 59.3481 40.0603 174.5513 200 Y 4.8053 9.0878 123.8180 55.8961 41.6472 174.6074 201 K 4.3896 8.8062 123.9090 55.8034 33.4203 176.8730 202 R 4.2951 8.6209 125.0114 56.4323 30.5877 175.5496 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 0 A 8.12 4.20 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 *2 D 8.10 4.53 0.00 2.70 2.78 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 3 S 7.69 4.48 0.00 3.95 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 4 I 7.47 4.06 1.84 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 1.31 0.77 0.93 0.00 0.00 5 A 8.39 4.13 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 6 K 8.41 4.34 0.00 1.65 1.76 0.00 1.74 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.47 7.81 7 R 9.04 4.47 0.00 1.62 1.84 0.00 3.34 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 8 P 0.00 4.34 0.00 1.93 2.00 0.00 3.68 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 2.03 2.13 0.00 9 R 8.62 3.94 0.00 1.80 1.91 0.00 3.16 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 10 T 8.20 4.66 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 11 R 8.45 4.60 0.00 1.82 1.84 0.00 3.21 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 12 L 8.18 4.89 0.00 1.58 1.52 0.97 0.96 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 13 S 8.37 4.36 0.00 4.07 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 14 P 0.00 4.87 0.00 2.25 2.28 0.00 3.91 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.11 0.00 15 L 7.69 4.06 0.00 1.86 1.68 0.94 0.41 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 16 K 7.98 4.02 0.00 1.91 1.83 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.44 7.81 17 R 8.30 3.71 0.00 1.83 1.87 0.00 3.03 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.93 0.00 18 K 7.53 3.48 0.00 1.92 2.03 0.00 1.59 0.00 0.00 1.69 0.00 0.00 3.17 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.48 1.56 7.81 19 Q 7.76 4.15 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 20 Q 7.64 4.21 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.08 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 21 L 7.92 4.16 0.00 1.91 1.80 0.71 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 *23 E 8.14 4.33 0.00 2.27 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 2.35 2.50 0.00 24 I 7.98 3.62 1.94 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.62 0.81 0.00 0.00 25 A 8.09 3.50 1.16 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 26 L 7.82 4.09 0.00 2.01 1.92 1.08 1.16 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 27 E 8.20 3.61 0.00 1.97 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 2.19 2.06 0.00 28 V 7.97 3.41 1.67 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 0.73 0.00 0.00 0.76 0.00 0.00 29 F 8.29 4.49 0.00 3.11 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.45 4.09 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 7.75 4.13 0.00 1.96 1.97 0.00 3.29 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 32 R 8.21 4.44 0.00 1.94 2.04 0.00 3.10 0.00 0.00 3.32 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 33 G 7.95 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.05 3.15 1.25 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 -0.14 -0.71 0.00 0.00 35 G 7.58 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 0.00 0.00 0.00 36 R 8.62 4.70 0.00 2.10 1.86 0.00 3.47 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 37 G 7.44 4.40 0.00 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8.24 3.79 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 1.25 0.00 0.00 114 W 8.84 4.31 0.00 3.75 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 0.00 115 F 8.30 3.97 0.00 2.32 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 0.00 0.00 0.00 116 E 8.36 4.30 0.00 2.11 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 2.59 2.72 0.00 117 W 8.37 3.95 0.00 3.67 2.81 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 0.00 118 S 7.22 2.79 0.00 2.94 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 6.90 4.09 0.77 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 0.00 120 S 7.18 4.13 0.00 3.74 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 0.00 121 T 8.28 4.42 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 122 R 8.13 4.17 0.00 1.97 1.88 0.00 3.17 0.00 0.00 3.09 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.82 0.00 123 D 9.08 4.54 0.00 2.70 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 0.00 124 E 8.01 4.32 0.00 2.06 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 2.18 2.20 0.00 125 V 7.99 4.28 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 1.15 0.00 0.00 0.88 0.00 0.00 126 W 8.13 4.51 0.00 3.68 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 P 0.00 3.88 0.00 1.76 1.50 0.00 3.17 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.44 0.00 128 L 7.71 3.94 0.00 1.71 1.85 0.87 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 129 F 7.92 3.62 0.00 3.04 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 0.00 130 V 8.14 3.64 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 1.05 0.00 0.00 1.34 0.00 0.00 131 T 7.88 4.09 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 132 T 7.60 3.86 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 1.10 0.00 0.00 133 N 8.07 4.55 0.00 1.54 2.22 0.00 0.00 6.76 8.25 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 0.00 134 R 7.46 3.89 0.00 2.12 1.89 0.00 3.21 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 135 T 7.85 3.90 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 136 N 8.19 4.45 0.00 3.26 3.29 0.00 0.00 6.78 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 Q 8.12 4.14 0.00 2.27 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.52 0.00 138 L 8.27 4.02 0.00 1.94 1.73 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 139 L 8.10 3.98 0.00 1.78 1.98 0.88 1.07 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 0.00 140 V 7.69 3.68 2.40 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 0.97 0.00 0.00 1.19 0.00 0.00 141 Q 8.52 4.39 0.00 2.34 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.87 0.00 0.00 0.00 0.00 0.00 2.67 2.74 0.00 142 N 8.16 4.29 0.00 2.97 2.94 0.00 0.00 7.21 7.05 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 *144 F 8.12 4.80 0.00 3.30 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 0.00 145 I 8.24 3.75 2.03 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 1.57 1.14 0.96 0.00 0.00 146 K 7.97 3.86 0.00 1.81 1.84 0.00 1.56 0.00 0.00 1.87 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.50 7.81 147 A 7.89 4.25 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 0.00 148 I 8.02 3.72 2.08 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.77 0.98 0.00 0.00 149 E 8.15 4.04 0.00 2.12 2.02 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 2.36 2.61 0.00 150 R 7.75 4.42 0.00 1.74 1.91 0.00 3.33 0.00 0.00 3.56 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 151 G 7.81 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 0.00 152 E 8.17 4.41 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.19 0.00 153 V 7.51 4.78 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 1.06 0.00 0.00 1.08 0.00 0.00 154 C 8.92 3.97 0.00 3.00 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 0.00 155 D 8.72 4.67 0.00 2.84 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 0.00 156 Q 7.74 4.37 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 7.07 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 157 H 7.94 4.47 0.00 3.35 3.21 0.00 5.60 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 N 8.32 5.13 0.00 3.01 2.90 0.00 0.00 5.72 7.76 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 0.00 159 P 0.00 4.34 0.00 2.36 2.57 0.00 3.73 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 160 E 7.99 4.23 0.00 2.09 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 2.55 0.00 161 D 8.01 4.36 0.00 2.96 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 0.00 162 L 7.79 3.63 0.00 0.98 0.18 0.82 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 163 A 7.92 4.25 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 N 8.33 4.37 0.00 2.93 2.89 0.00 0.00 6.67 6.02 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 0.00 165 L 8.12 3.92 0.00 1.71 1.76 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 166 F 8.55 4.31 0.00 3.57 3.63 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.90 4.20 0.00 3.54 3.59 0.00 5.84 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 0.00 168 G 8.49 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 I 8.16 3.86 2.06 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.54 1.14 0.00 0.00 170 C 8.26 4.11 0.00 3.19 3.29 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 0.00 171 Y 8.45 3.54 0.00 3.14 3.08 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 0.00 172 S 8.18 4.17 0.00 4.08 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 0.00 173 L 7.99 3.89 0.00 1.87 1.63 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 174 F 8.17 3.78 0.00 1.82 2.23 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 0.00 175 V 7.09 2.93 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.79 0.00 0.00 176 Q 7.88 3.98 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 177 A 7.95 3.91 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 N 7.44 4.31 0.00 2.47 2.62 0.00 0.00 6.85 7.31 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 0.00 179 R 7.42 4.47 0.00 1.81 1.84 0.00 3.06 0.00 0.00 3.08 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.53 0.00 180 T 7.28 4.60 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 181 N 8.55 4.54 0.00 2.72 2.81 0.00 0.00 6.85 8.00 0.00 0.00 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 N 7.92 4.64 0.00 2.73 2.68 0.00 0.00 6.87 6.65 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 0.00 183 T 8.20 3.89 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 184 A 7.91 3.95 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 E 8.33 3.89 0.00 2.22 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 2.32 0.00 186 L 7.78 3.91 0.00 1.82 1.63 0.89 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 187 S 8.53 4.33 0.00 3.90 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 0.00 188 K 8.24 3.96 0.00 1.80 1.91 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.43 7.81 189 L 7.90 3.82 0.00 1.83 1.55 0.84 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 190 V 7.56 3.45 2.24 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 1.03 0.00 0.00 0.92 0.00 0.00 191 S 7.83 4.14 0.00 4.07 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 0.00 192 S 8.17 4.19 0.00 3.97 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 0.00 193 Y 8.32 4.46 0.00 3.08 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 L 8.06 4.26 0.00 1.69 1.80 1.06 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 195 D 8.15 4.58 0.00 2.83 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 *197 L 7.20 4.13 0.00 1.68 1.65 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 198 C 8.28 4.25 0.00 3.04 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 I 7.09 4.76 1.81 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.60 0.99 0.00 0.00 200 Y 9.09 4.81 0.00 2.86 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 K 8.81 4.39 0.00 1.82 1.77 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.51 7.81 202 R 8.62 4.30 0.00 1.84 1.82 0.00 3.48 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 * Residues marked with a * may have inaccurate shift predictions.