NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 43 A 4.2738 8.2649 123.5779 51.6772 20.5718 176.0819 44 H 5.1241 7.9214 111.9468 53.4976 32.8889 170.7890 45 A 4.8242 9.3089 121.8655 50.6922 23.5963 175.0878 46 V 4.8620 8.9685 112.3881 59.7219 34.9916 175.0302 47 S 5.2789 9.1056 119.2220 56.9552 63.6020 173.3412 48 V 4.6431 8.6233 127.3029 61.0434 33.3061 174.7103 49 W 4.8753 9.1858 127.9160 56.1985 30.7947 175.4296 50 E 5.4677 10.0798 122.6470 54.7161 33.7954 174.4326 51 F 5.7742 8.5464 115.5887 55.1770 42.0926 173.1556 52 E 3.9187 8.8185 121.3669 55.2343 30.3746 176.0484 53 S 4.3051 8.9744 121.9969 57.5732 64.3282 173.7417 54 R 3.6730 9.5844 129.0382 57.4014 27.3904 177.5848 55 G 3.8075 8.3024 102.2763 45.3569 0.0000 173.5735 56 K 4.5443 7.6153 118.9445 54.1090 35.3814 175.6067 57 W 5.0068 8.8327 124.5904 55.5244 29.3796 175.4508 58 L 4.5120 8.2414 126.0687 52.5215 43.0755 174.6863 59 P 4.9114 0.0000 0.0000 63.0343 32.1798 175.7711 60 Y 4.9406 9.3705 121.5374 57.2731 39.3048 175.5052 61 S 4.5127 8.8958 115.4075 57.5525 64.3103 173.5686 62 P 3.1659 0.0000 0.0000 65.4652 30.9147 178.7836 63 A 3.9096 7.7526 118.8486 55.2506 18.2786 179.7378 64 V 3.4895 7.7043 116.3792 66.1026 31.4802 178.5191 65 S 4.1238 8.6601 115.5807 61.4420 62.7005 176.3739 66 Q 3.9762 8.6889 122.8107 59.3801 28.6728 177.8105 67 H 4.1034 8.1910 119.3337 59.1220 29.8887 177.3115 68 L 3.3651 7.6818 120.9782 57.3301 41.1880 179.0451 69 E 4.2504 8.0860 119.4893 59.5546 29.5805 179.1222 70 R 4.0398 7.9652 117.8429 59.2088 30.0731 178.9569 71 A 3.9419 7.7047 120.4744 55.0909 18.2285 179.2690 72 H 4.1640 8.4017 116.7880 59.3679 29.8196 177.2587 73 A 4.1140 8.4409 121.7911 55.1673 18.3255 179.0058 74 K 4.2093 8.0814 113.4364 55.8466 32.2534 177.1352 75 K 3.8433 8.0515 117.9425 57.3565 30.0867 175.8348 76 L 4.4305 8.1688 117.7877 54.9418 42.9884 176.8922 77 T 4.4923 8.5093 115.6332 64.9453 70.6687 174.8133 78 R 5.2296 7.9727 118.2519 54.8026 32.5166 176.2180 79 V 4.2302 8.4545 122.4390 62.0993 34.7702 175.2784 *81 L 4.3952 8.6738 115.7536 54.8833 42.1338 178.9444 82 S 4.3456 7.9398 113.2380 61.1484 62.4923 175.9908 83 D 4.5112 8.0785 121.4311 56.5237 40.5705 177.2495 84 A 4.6913 6.9754 118.7170 51.5548 20.5723 176.1358 85 D 4.3909 7.8828 116.5249 51.7029 42.2938 173.8476 86 P 4.2361 0.0000 0.0000 64.7301 31.1692 177.3853 87 S 4.3542 8.0674 112.5487 59.1283 64.0335 174.9265 88 L 3.8099 8.0997 125.1063 55.0082 39.1499 176.9684 89 E 3.5140 6.5246 114.9962 58.6801 31.5573 178.2261 90 Q 4.5872 7.9614 115.6318 54.6223 29.7587 174.0097 91 Y 4.7282 8.4066 115.4224 56.9934 39.6080 175.9182 92 Y 5.0545 9.0816 127.1659 55.8748 41.3657 174.2875 93 V 4.5728 9.1239 127.6280 61.1266 34.1447 173.6249 94 N 5.2795 8.3680 127.3994 52.1632 39.6538 175.5731 95 V 3.8060 9.1415 127.5155 65.2798 31.7094 177.3312 96 R 4.1503 9.0244 120.8534 59.1881 29.6685 176.7026 97 T 4.0129 6.7965 105.0593 63.3608 69.7021 174.5731 *99 T 4.4801 7.4076 109.3654 60.7537 71.2812 172.3198 100 Q 5.0721 9.0232 123.3512 54.3565 31.8879 174.3187 101 E 4.9624 9.1811 125.4136 54.8594 32.3580 176.7667 102 S 4.5868 8.3597 113.3641 58.2284 66.9457 174.7902 *112 L 4.1588 7.5886 119.1706 54.2135 42.9529 176.6689 113 T 4.1573 8.1366 121.1433 63.3312 68.8695 174.5993 114 I 3.8254 7.5796 122.9728 61.2537 39.1147 175.4692 115 G 4.3143 8.8988 116.5422 46.5135 0.0000 172.5215 116 V 5.8129 8.5630 120.6286 61.4252 35.1254 174.3018 117 R 4.5674 9.4992 121.7123 54.9952 33.0683 173.5845 118 R 3.8705 7.6301 119.5603 54.1372 32.8291 174.8082 *120 F 5.2196 8.3614 119.8236 57.8401 40.2265 174.1407 121 Y 4.8181 9.1324 119.1107 55.8386 42.5311 174.9797 122 A 4.5238 8.6168 122.6266 51.1113 19.6418 177.0923 123 P 4.2933 0.0000 0.0000 65.4586 31.5480 178.8593 124 S 4.3709 7.9983 110.8183 59.2751 63.6272 174.2288 125 S 4.5311 7.9128 117.1148 57.1680 63.9435 173.5041 126 P 4.2101 0.0000 0.0000 65.6467 31.0989 178.9154 127 A 4.0574 8.1766 120.8799 55.2438 18.3987 179.7988 128 G 3.5714 7.7317 102.6430 47.8157 0.0000 174.7720 129 K 4.1976 8.3474 117.3441 56.4004 32.6943 176.9165 130 G 3.9065 8.9668 107.4961 45.7692 0.0000 172.8826 131 T 5.2685 8.0044 107.7657 59.6438 72.1851 173.1777 132 K 4.8035 9.0960 121.6181 55.2002 36.8557 174.7241 133 W 5.2579 8.8820 120.6863 55.2429 32.0822 174.6351 134 E 5.3654 9.5735 122.9795 54.4789 34.0913 174.3224 135 W 5.8181 8.7478 117.8363 54.8928 31.8723 174.1708 136 S 3.7186 8.9096 116.6764 57.2806 62.4103 174.1417 137 G 3.8567 8.3590 113.6221 46.6476 0.0000 174.0319 138 G 4.2903 7.6884 105.7426 46.0923 0.0000 172.4539 139 S 4.4498 7.4961 111.8015 57.1805 65.4862 172.5482 140 A 4.1858 8.6791 122.0302 54.8407 19.2095 178.4311 141 D 5.0374 7.8134 113.0540 53.4667 40.6719 176.4171 142 S 4.8220 7.5532 112.7539 56.6419 65.7259 174.3347 143 N 5.1984 8.5661 118.1785 52.8253 40.3237 175.1011 144 N 4.5389 8.1077 115.4756 54.6713 38.0484 174.5122 145 D 4.7058 7.3839 118.6581 51.8095 41.7843 173.6096 146 W 4.9743 8.2973 121.9014 54.9055 31.2762 175.5650 147 R 4.5400 8.4864 122.2429 53.4289 33.2557 173.2979 148 P 4.9464 0.0000 0.0000 63.1493 32.4181 175.5246 149 Y 4.6085 8.1624 118.3261 55.8975 39.6227 178.0474 150 N 4.7582 8.8228 116.6317 53.5363 38.5521 176.2328 *152 H 4.8162 8.8994 111.6541 55.9834 31.7059 175.3614 153 V 3.5434 8.3505 118.6545 66.0893 31.1379 177.9518 154 Q 3.9649 8.4277 118.3285 58.9631 28.4559 179.0203 155 S 4.1985 7.8743 114.8480 61.4647 63.1226 176.5088 156 I 3.7112 7.6496 123.4965 63.9596 36.7956 178.5177 157 I 3.5702 7.8296 121.0785 64.1741 36.8868 177.9217 158 E 4.2246 8.1789 120.5243 59.5574 29.4972 178.3978 159 D 4.3823 8.4773 118.0403 57.3472 41.2683 178.1096 160 A 3.9564 8.2200 121.4756 54.5333 18.3195 179.3679 161 W 2.7839 8.1855 127.0633 60.2709 30.6155 177.9823 162 A 3.5448 8.4213 119.6583 55.0889 17.9372 179.0932 163 R 4.0939 7.6621 113.3282 56.3976 30.1582 177.3188 164 G 3.6680 7.5367 107.0555 45.9337 0.0000 174.0401 165 E 4.1844 7.7811 118.3440 56.2679 30.1890 177.2000 166 Q 4.4999 8.6687 120.0554 58.2642 30.2975 175.5926 167 T 5.0869 7.8094 111.0353 60.4231 71.1173 173.0990 168 L 4.5651 8.6646 128.0397 53.5753 45.5836 174.8678 169 D 4.9011 8.7115 127.3686 52.8889 40.9782 176.4746 170 L 4.3080 8.6489 126.7219 56.7132 41.4665 178.8922 171 S 4.3205 8.8368 113.7268 60.4860 62.7657 174.6554 172 N 4.4408 7.8485 119.9944 54.2914 38.8874 178.2849 173 T 2.8786 6.6645 104.4369 64.0251 71.1724 174.9077 174 H 4.5969 8.3788 119.7412 57.6599 30.9707 176.0436 175 I 4.6162 6.9407 119.1020 60.9480 37.2979 177.7212 176 G 4.1180 8.2391 110.2054 45.7660 0.0000 173.6892 177 L 4.7602 7.9964 121.1144 51.9765 42.8233 175.2757 178 P 4.7505 0.0000 0.0000 61.2373 29.6943 174.9084 179 Y 5.1884 7.6065 119.8321 57.1103 43.3145 175.4970 180 T 5.0368 8.8145 118.8586 61.9091 71.8607 173.0339 181 I 4.6523 8.6363 127.5404 59.6802 39.7215 174.1401 182 N 5.1301 8.8775 125.3478 51.9276 40.5821 174.9969 183 F 4.7972 8.8201 125.9199 59.9521 39.1950 177.5408 184 S 4.4179 8.9635 113.6508 60.1361 63.0552 174.5490 185 N 4.8887 8.2541 114.9907 51.3706 38.7027 173.8847 186 L 3.8671 8.0256 118.5583 56.2897 38.9791 172.4703 187 T 5.2881 8.2557 109.1119 60.0936 73.6122 174.1728 188 Q 5.0024 9.1253 123.5958 54.2169 31.4418 174.1218 189 L 4.9157 9.0740 129.0020 53.0974 44.6343 175.1407 190 R 4.0002 8.8224 127.8601 56.0123 31.3196 175.7122 191 Q 4.3852 8.6196 126.5846 55.2715 29.4462 175.8147 192 P 4.4059 0.0000 0.0000 65.0423 31.9151 176.8536 193 S 4.5450 7.9149 112.6215 58.2213 63.3319 172.6456 194 G 3.7916 9.0768 107.1277 44.2914 0.0000 173.4109 195 P 4.6837 0.0000 0.0000 61.9944 33.0237 176.0642 *197 R 4.4156 8.5749 122.2145 56.9986 32.0984 175.5113 198 S 5.0642 8.6342 117.9072 58.7980 64.1965 173.1966 199 I 5.7554 8.5888 116.3929 59.7398 40.8889 174.4087 200 R 4.5851 9.1101 117.4679 55.2220 33.0674 173.6918 201 R 4.1935 7.7653 120.6097 54.4339 31.7122 174.6879 202 T 4.5370 8.2977 116.2118 59.4530 72.6148 173.4207 203 Q 4.5497 8.3557 121.1014 56.3853 29.1778 175.2651 204 Q 4.5971 8.7494 121.7439 54.4540 33.1437 173.9841 205 A 4.1190 8.4185 126.1697 51.0644 19.1853 175.7199 206 P 4.5367 0.0000 0.0000 62.8487 32.2101 175.9925 207 Y 4.3270 7.8704 118.1003 56.6338 39.3541 173.6945 208 P 4.4472 0.0000 0.0000 62.9268 32.4842 175.6633 209 L 4.7666 8.5470 126.2791 54.9407 43.3369 175.8808 210 V 4.5253 8.5106 123.7458 60.6809 35.6969 175.3444 211 K 4.0911 8.5792 123.5819 56.8584 31.8849 176.9995 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 43 A 8.26 4.27 1.15 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 44 H 7.92 5.12 0.00 3.03 3.14 0.00 5.66 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 45 A 9.31 4.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 V 8.97 4.86 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 0.84 0.00 0.00 1.09 0.00 0.00 47 S 9.11 5.28 0.00 4.24 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 48 V 8.62 4.64 2.20 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 0.75 0.00 0.00 0.43 0.00 0.00 49 W 9.19 4.88 0.00 3.65 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 10.08 5.47 0.00 1.92 2.04 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 2.29 2.47 0.00 51 F 8.55 5.77 0.00 3.04 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.82 3.92 0.00 1.61 1.64 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 1.76 1.47 0.00 53 S 8.97 4.31 0.00 3.97 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 54 R 9.58 3.67 0.00 1.96 1.96 0.00 3.37 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 55 G 8.30 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 0.00 0.00 0.00 56 K 7.62 4.54 0.00 1.86 1.65 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.36 7.81 57 W 8.83 5.01 0.00 3.15 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 L 8.24 4.51 0.00 0.34 1.18 0.89 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.91 0.00 2.22 2.02 0.00 3.70 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.29 0.00 60 Y 9.37 4.94 0.00 3.29 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 S 8.90 4.51 0.00 4.00 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 62 P 0.00 3.17 0.00 1.89 1.71 0.00 3.46 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.48 0.00 63 A 7.75 3.91 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 64 V 7.70 3.49 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 0.73 0.00 0.00 0.87 0.00 0.00 65 S 8.66 4.12 0.00 4.26 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 8.69 3.98 0.00 2.27 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 67 H 8.19 4.10 0.00 3.26 3.30 0.00 5.84 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 7.68 3.37 0.00 0.46 0.13 0.28 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.09 4.25 0.00 2.50 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 0.00 2.54 2.58 0.00 70 R 7.97 4.04 0.00 1.94 1.93 0.00 3.17 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 71 A 7.70 3.94 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 72 H 8.40 4.16 0.00 3.72 3.76 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 73 A 8.44 4.11 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.08 4.21 0.00 1.74 1.86 0.00 1.86 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.58 7.81 75 K 8.05 3.84 0.00 1.88 1.89 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.54 7.81 76 L 8.17 4.43 0.00 1.67 1.60 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 77 T 8.51 4.49 4.30 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 1.29 0.00 0.00 78 R 7.97 5.23 0.00 1.72 1.93 0.00 3.11 0.00 0.00 2.92 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.70 0.00 79 V 8.45 4.23 2.04 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 0.90 0.00 0.00 0.84 0.00 0.00 *81 L 8.67 4.40 0.00 1.74 1.62 0.83 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.94 4.35 0.00 4.01 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 0.00 83 D 8.08 4.51 0.00 2.35 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 84 A 6.98 4.69 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.88 4.39 0.00 2.56 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 0.00 0.00 0.00 0.00 86 P 0.00 4.24 0.00 2.18 2.14 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 1.95 1.93 0.00 87 S 8.07 4.35 0.00 3.96 3.97 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 88 L 8.10 3.81 0.00 1.47 0.98 0.79 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 89 E 6.52 3.51 0.00 2.09 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 90 Q 7.96 4.59 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.23 6.94 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 91 Y 8.41 4.73 0.00 2.71 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 92 Y 9.08 5.05 0.00 2.97 2.83 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 93 V 9.12 4.57 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 0.91 0.00 0.00 0.95 0.00 0.00 94 N 8.37 5.28 0.00 2.57 2.52 0.00 0.00 6.41 7.04 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 95 V 9.14 3.81 2.32 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 1.01 0.00 0.00 1.02 0.00 0.00 96 R 9.02 4.15 0.00 1.82 2.06 0.00 3.39 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 97 T 6.80 4.01 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 *99 T 7.41 4.48 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 1.30 0.00 0.00 100 Q 9.02 5.07 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.62 0.00 0.00 0.00 0.00 0.00 2.22 2.40 0.00 101 E 9.18 4.96 0.00 1.95 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.03 0.00 102 S 8.36 4.59 0.00 2.72 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 *112 L 7.59 4.16 0.00 1.63 1.58 0.90 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 113 T 8.14 4.16 4.23 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 1.19 0.00 0.00 114 I 7.58 3.83 1.89 0.00 0.00 1.00 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 1.52 0.90 0.00 0.00 115 G 8.90 4.31 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 0.00 116 V 8.56 5.81 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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9.57 5.37 0.00 1.91 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 2.25 2.26 0.00 135 W 8.75 5.82 0.00 3.40 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 0.00 136 S 8.91 3.72 0.00 2.72 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 G 8.36 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 0.00 0.00 0.00 138 G 7.69 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 0.00 0.00 0.00 0.00 139 S 7.50 4.45 0.00 3.74 3.70 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 0.00 140 A 8.68 4.19 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 0.00 141 D 7.81 5.04 0.00 2.67 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 S 7.55 4.82 0.00 3.86 3.75 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 N 8.25 4.89 0.00 2.87 2.97 0.00 0.00 6.12 7.79 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 0.00 186 L 8.03 3.87 0.00 2.03 2.10 1.07 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 187 T 8.26 5.29 4.36 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 1.35 0.00 0.00 188 Q 9.13 5.00 0.00 2.15 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.64 0.00 0.00 0.00 0.00 0.00 2.36 2.25 0.00 189 L 9.07 4.92 0.00 1.74 1.60 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 190 R 8.82 4.00 0.00 1.95 1.80 0.00 2.54 0.00 0.00 2.89 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.45 0.00 191 Q 8.62 4.39 0.00 1.91 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.60 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 192 P 0.00 4.41 0.00 2.14 2.13 0.00 3.64 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.90 0.00 193 S 7.91 4.54 0.00 3.92 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 0.00 194 G 9.08 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 P 0.00 4.68 0.00 2.11 1.94 0.00 3.62 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.16 0.00 *197 R 8.57 4.42 0.00 1.89 2.03 0.00 3.12 0.00 0.00 3.74 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 198 S 8.63 5.06 0.00 3.90 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 0.00 199 I 8.59 5.76 2.50 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.11 1.25 0.00 0.00 200 R 9.11 4.59 0.00 1.55 1.75 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.02 0.00 201 R 7.77 4.19 0.00 0.67 0.69 0.00 2.21 0.00 0.00 2.28 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.50 0.00 202 T 8.30 4.54 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 203 Q 8.36 4.55 0.00 1.86 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 204 Q 8.75 4.60 0.00 2.05 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.89 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 205 A 8.42 4.12 1.17 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 0.00 0.00 206 P 0.00 4.54 0.00 2.23 2.08 0.00 3.72 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 207 Y 7.87 4.33 0.00 2.87 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 0.00 208 P 0.00 4.45 0.00 2.24 2.08 0.00 4.20 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.20 0.00 209 L 8.55 4.77 0.00 1.68 1.59 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 210 V 8.51 4.53 1.74 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 0.69 0.00 0.00 0.98 0.00 0.00 211 K 8.58 4.09 0.00 1.75 1.68 0.00 1.84 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.43 7.81 * Residues marked with a * may have inaccurate shift predictions.