NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 97 S 4.4615 8.1927 115.3005 57.8516 63.9186 173.9265 98 Y 3.9349 8.8097 125.7086 60.7941 38.2780 177.1960 99 D 4.5515 9.2077 120.6986 57.8907 41.4993 178.1226 100 T 3.9720 7.8887 115.8923 66.9040 68.6549 176.6385 101 V 3.5676 7.7848 119.3389 66.3094 31.6496 177.5691 102 M 4.0379 8.0101 117.8756 58.6356 32.0389 177.9593 103 D 4.6801 8.4252 120.5692 56.8801 41.0586 178.7884 104 K 3.9593 8.1732 119.0142 59.6328 32.1189 178.7499 105 Y 3.8258 7.7060 119.3636 60.3248 38.5917 178.0170 106 W 3.4723 7.4736 119.4461 58.9876 28.9950 178.6856 107 L 4.0097 7.9691 119.5814 57.5307 40.8857 179.5134 108 S 3.9321 7.8193 113.0678 61.4742 62.3256 176.0175 109 Q 3.7105 7.2560 120.3950 59.0274 28.2995 178.4524 110 Y 3.8359 8.2175 120.6432 60.8468 38.8544 178.4647 111 V 3.4412 7.9804 119.0917 65.7904 31.6101 178.0743 112 I 3.5600 7.8382 119.6033 64.1718 36.7437 178.2387 113 A 3.9693 7.6581 120.3270 55.2423 18.3014 179.4155 114 R 3.4929 7.4082 116.0182 59.0163 30.1482 177.8306 115 E 4.3936 8.1772 116.5586 56.9075 30.2303 176.8208 116 T 4.5853 7.0591 115.2497 63.5134 69.9085 174.0459 117 Y 4.5913 8.9895 124.8826 56.1579 42.0961 173.9120 118 D 4.5906 7.9319 126.9427 52.6784 43.7299 175.1015 119 W 4.1666 9.2611 135.0000 60.9731 30.5595 176.6423 120 Y 4.5310 7.9391 112.1379 58.4010 37.3344 175.9414 121 T 4.5494 8.0713 108.6214 59.7879 70.9783 175.3577 122 L 3.6910 7.3403 124.8498 58.6702 41.8609 178.4956 123 Q 3.6927 7.6982 118.4810 59.0738 28.8427 178.4199 124 K 3.9345 7.8057 118.8472 59.5213 32.1960 178.8916 125 D 4.2197 8.3530 119.5439 57.4421 40.7322 178.0445 126 Y 4.1812 8.4768 122.0806 60.3209 38.7563 178.3431 127 E 3.9526 8.4366 119.2019 59.4092 29.4348 179.6579 128 T 3.8239 7.9373 116.2269 66.4655 68.6737 176.7999 129 V 3.2152 7.7561 120.6710 65.9055 31.1172 177.7407 130 G 3.6707 7.5085 103.9885 48.5126 0.0000 175.2056 131 M 4.1985 7.9885 118.9817 57.0512 31.6704 177.6542 132 L 4.3448 8.1616 118.7092 54.5364 42.1448 176.2883 133 S 5.0541 7.0546 114.7201 56.2588 65.4734 173.9535 134 S 4.4320 8.2252 117.2906 57.0126 64.2851 173.5919 135 P 4.2258 0.0000 0.0000 65.8170 30.9078 179.0117 136 S 4.1189 7.9754 112.1514 61.7797 63.0874 176.2590 137 E 4.1454 7.9347 121.6335 58.6574 29.0443 179.6404 138 G 3.6064 8.4467 106.3168 47.6941 0.0000 175.6698 139 Q 3.9710 8.0767 121.6612 58.9187 28.9069 177.8502 140 S 4.1234 7.9943 113.1027 61.6988 62.2393 175.4154 141 Y 4.2523 8.0648 121.4775 60.8782 38.7001 177.8404 142 A 4.1456 8.4628 122.0305 54.9723 18.0798 179.3990 143 S 4.2889 8.5435 113.5109 62.0585 62.8478 176.8808 144 Q 3.8169 8.0798 120.8013 57.6054 28.1401 177.3373 145 F 4.5856 8.2158 116.8326 56.5089 40.1104 175.8777 146 Q 4.2382 7.0383 117.8686 56.0850 29.6447 176.7740 147 G 3.7973 8.6266 107.9799 45.2820 0.0000 172.8882 148 D 4.7008 8.4987 119.4281 54.8004 41.2428 177.8437 149 K 4.2292 7.7375 119.3775 54.0176 32.4002 181.8786 150 A 4.0795 7.7339 121.2401 53.6976 19.2681 178.2177 151 L 3.0569 7.8172 124.8005 57.7822 41.6568 179.8587 152 D 5.4083 8.0538 119.6968 56.3153 39.3856 178.6669 153 K 4.1000 8.0297 118.3383 58.4106 32.1478 178.7172 154 Q 4.0801 7.6762 119.4639 59.0287 29.5129 177.1649 155 Y 4.3768 8.2986 118.2691 61.5242 38.2094 176.1317 156 G 3.3717 8.4183 108.3915 46.7137 0.0000 174.4336 157 S 4.7723 8.0771 118.7606 58.3558 63.4796 174.5048 158 N 4.8866 7.9544 116.6426 53.9018 39.5554 174.6487 159 V 4.9347 7.6552 118.0537 61.1017 35.0838 174.3633 160 R 5.0811 8.9261 126.1466 55.0732 34.0422 173.7758 161 T 5.0909 9.2182 122.3807 62.1661 71.4190 173.1429 162 S 5.0643 9.1289 123.6243 57.3361 65.0165 173.7019 163 V 4.9730 8.3669 122.5588 61.7013 33.8471 175.2568 164 T 4.6484 8.8919 122.5723 61.7145 71.9218 173.4319 165 I 4.2227 8.6145 127.9679 61.7474 37.4300 175.8699 166 V 4.3913 8.9229 126.5108 64.3494 33.1293 175.8225 167 S 4.8081 7.7234 112.3229 57.4342 66.2446 173.3473 168 I 5.0852 8.2460 121.2014 59.9051 40.9056 174.9475 169 V 4.3226 9.1285 127.6219 60.5012 33.1255 173.1636 170 P 4.9819 0.0000 0.0000 62.1664 32.1123 176.3204 171 N 4.7607 8.9192 117.3330 52.6210 38.6601 175.9091 172 G 4.0138 9.6458 106.5178 45.6547 0.0000 174.1623 173 K 4.4410 8.9436 114.7129 56.3467 34.7627 177.5257 174 G 3.4663 8.4449 108.7808 45.3495 0.0000 173.0364 175 I 4.9400 7.6654 121.0615 59.5193 39.5132 174.7686 176 G 4.6471 9.8137 114.4082 44.7335 0.0000 171.6098 177 T 5.1796 8.8361 120.3808 61.5792 71.1679 173.4506 178 V 4.8919 9.1964 127.0419 61.2388 34.2974 174.1725 179 R 5.4881 9.0031 127.7116 54.6760 32.3381 175.5313 180 F 5.5511 9.3066 117.7704 55.6207 42.4267 172.8221 181 A 5.1720 9.3880 120.6562 49.9475 22.1563 175.2825 182 K 5.1624 9.8450 122.9480 55.0435 35.1967 174.8872 183 T 5.0972 9.0264 124.6596 62.2482 71.1664 173.2575 184 T 5.0743 9.3353 124.2606 61.9199 71.0190 174.0942 185 K 4.9119 8.9701 125.0484 54.5275 36.8923 174.8550 186 R 4.8592 8.2689 118.9269 54.0545 32.3124 176.8429 187 T 4.1026 7.9720 124.4901 64.1718 65.5321 174.3125 *192 D 4.4333 8.0314 120.0962 52.9641 43.5501 177.1464 193 G 3.8229 8.2080 105.6929 44.2778 0.0000 171.3324 194 E 4.7411 8.7886 117.7222 54.8025 32.1352 175.5434 195 T 5.0767 8.5499 120.6342 62.1653 70.6116 173.9035 196 T 4.5703 9.4523 123.0108 61.9328 72.9370 172.4982 197 H 5.2029 7.9296 120.3059 53.8797 31.7994 173.3309 198 W 5.3339 9.0316 121.5505 54.9483 34.2746 174.0751 199 I 5.1277 9.3823 121.6863 59.7297 39.9637 174.4643 200 A 5.0837 9.8870 130.6956 50.6265 21.2688 175.3662 201 T 4.9094 9.2202 121.1079 62.1824 70.5514 173.8470 202 I 4.9467 9.3428 128.5782 59.4040 40.4255 174.8628 203 G 4.6086 9.6405 114.8149 44.2045 0.0000 172.2498 204 Y 5.2516 8.9134 123.3415 55.8807 42.2746 173.7506 205 Q 4.3507 8.5622 117.6488 55.4256 33.2885 172.4064 206 Y 4.9363 8.4194 115.4896 56.3580 41.0161 175.1316 207 V 4.0518 8.9480 125.6952 61.8821 33.6926 174.4445 208 N 4.2641 8.3754 126.2836 52.4697 37.9118 172.9939 209 P 4.3662 0.0000 0.0000 65.1207 31.6952 178.8590 210 S 4.3209 7.8677 111.6906 59.9989 63.0041 174.6427 211 L 4.4543 7.6363 120.5536 54.6636 41.3878 175.5591 212 M 4.8126 7.4723 115.8505 52.6080 34.1989 176.0254 213 S 4.4283 8.2053 114.1255 57.9139 65.2291 174.9899 214 E 4.0418 8.6517 122.0207 59.5781 29.1460 179.1742 215 S 4.2465 8.0808 114.4674 60.9469 63.2160 176.0734 216 A 4.0950 7.8341 124.2632 54.8117 18.4034 179.4481 217 R 4.2297 8.0251 115.9010 58.4084 29.9143 178.5190 218 L 4.3389 7.4597 117.5172 56.3435 41.7793 177.2925 219 T 4.6663 7.6662 106.7130 61.4427 70.8671 174.3502 220 N 4.7463 7.6664 118.7582 51.9188 40.4992 172.4417 221 P 4.2633 0.0000 0.0000 65.2811 32.0269 177.7537 222 L 4.3546 7.7662 114.3733 54.0008 42.2839 176.5945 223 G 3.9158 7.8739 106.8267 45.9917 0.0000 173.2108 224 F 4.1576 8.1690 120.8561 58.7003 39.8753 174.0315 225 N 4.7474 7.9986 123.5997 52.0751 42.6906 172.8152 226 V 4.2769 8.4582 127.3233 61.8461 32.4373 176.1859 227 T 4.4036 8.7250 118.9693 62.9495 70.4076 175.3262 228 S 5.3846 7.6652 115.3797 56.8549 66.7069 172.7743 229 Y 5.1141 8.7636 123.1436 56.2474 41.4483 173.8920 230 R 4.5810 8.8034 127.1878 54.3703 33.4675 173.8836 231 V 4.9173 8.4501 125.6403 61.2881 33.7218 174.1547 232 D 5.3181 9.4829 127.2466 51.7789 44.7830 173.9277 233 P 4.2453 0.0000 0.0000 62.2669 32.2532 176.1669 234 E 4.4314 7.4959 123.3979 55.2401 28.2503 176.5406 *235 M 4.2903 7.8287 121.0239 54.4916 32.1894 176.6906 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 97 S 8.19 4.46 0.00 3.93 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Y 8.81 3.93 0.00 3.23 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 99 D 9.21 4.55 0.00 2.85 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 0.00 100 T 7.89 3.97 4.45 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 1.27 0.00 0.00 101 V 7.78 3.57 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 0.93 0.00 0.00 102 M 8.01 4.04 0.00 2.40 1.87 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.05 2.83 0.00 103 D 8.43 4.68 0.00 3.04 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 0.00 104 K 8.17 3.96 0.00 1.99 1.84 0.00 1.68 0.00 0.00 1.58 0.00 0.00 3.13 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.70 7.81 105 Y 7.71 3.83 0.00 2.83 2.76 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 0.00 106 W 7.47 3.47 0.00 2.27 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 0.00 0.00 0.00 0.00 107 L 7.97 4.01 0.00 1.57 1.67 0.80 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 108 S 7.82 3.93 0.00 3.83 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 0.00 109 Q 7.26 3.71 0.00 1.94 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.57 0.00 0.00 0.00 0.00 0.00 1.30 1.16 0.00 110 Y 8.22 3.84 0.00 3.35 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 0.00 111 V 7.98 3.44 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 1.04 0.00 0.00 112 I 7.84 3.56 1.94 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.77 0.84 0.00 0.00 113 A 7.66 3.97 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.41 3.49 0.00 0.79 1.43 0.00 2.42 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.44 0.00 115 E 8.18 4.39 0.00 2.00 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 0.00 2.31 2.17 0.00 116 T 7.06 4.59 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 1.29 0.00 0.00 117 Y 8.99 4.59 0.00 3.37 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 0.00 118 D 7.93 4.59 0.00 2.72 2.41 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 0.00 119 W 9.26 4.17 0.00 3.45 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 0.00 120 Y 7.94 4.53 0.00 3.06 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 0.00 121 T 8.07 4.55 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 1.24 0.00 0.00 122 L 7.34 3.69 0.00 1.39 1.29 0.71 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 123 Q 7.70 3.69 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.69 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 124 K 7.81 3.93 0.00 1.93 1.80 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.47 7.81 125 D 8.35 4.22 0.00 2.72 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 0.00 126 Y 8.48 4.18 0.00 2.89 3.03 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 0.00 127 E 8.44 3.95 0.00 2.31 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 2.35 2.42 0.00 128 T 7.94 3.82 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 1.19 0.00 0.00 129 V 7.76 3.22 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 0.17 0.00 0.00 -0.12 0.00 0.00 130 G 7.51 3.67 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 0.00 0.00 0.00 131 M 7.99 4.20 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.87 0.00 132 L 8.16 4.34 0.00 2.05 2.07 1.22 0.72 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 0.00 133 S 7.05 5.05 0.00 3.86 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 0.00 134 S 8.23 4.43 0.00 3.97 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 0.00 135 P 0.00 4.23 0.00 2.16 2.15 0.00 3.57 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 136 S 7.98 4.12 0.00 4.06 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 0.00 137 E 7.93 4.15 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 138 G 8.45 3.61 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 0.00 0.00 0.00 139 Q 8.08 3.97 0.00 2.24 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.69 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 140 S 7.99 4.12 0.00 3.97 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 0.00 141 Y 8.06 4.25 0.00 3.09 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 0.00 142 A 8.46 4.15 1.53 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 0.00 0.00 143 S 8.54 4.29 0.00 4.01 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 0.00 144 Q 8.08 3.82 0.00 1.38 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.69 0.00 0.00 0.00 0.00 0.00 2.23 2.41 0.00 145 F 8.22 4.59 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 0.00 146 Q 7.04 4.24 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.46 0.00 0.00 0.00 0.00 0.00 2.44 2.57 0.00 147 G 8.63 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 148 D 8.50 4.70 0.00 2.63 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 K 7.74 4.23 0.00 1.77 1.69 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.30 0.99 7.81 150 A 7.73 4.08 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 0.00 151 L 7.82 3.06 0.00 1.08 1.01 0.56 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 152 D 8.05 5.41 0.00 3.43 3.43 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 0.00 153 K 8.03 4.10 0.00 1.86 1.90 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.54 7.81 154 Q 7.68 4.08 0.00 1.93 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.97 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 155 Y 8.30 4.38 0.00 2.72 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 0.00 156 G 8.42 3.37 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 0.00 157 S 8.08 4.77 0.00 4.04 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 0.00 158 N 7.95 4.89 0.00 2.74 2.84 0.00 0.00 6.41 8.44 0.00 0.00 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 V 7.66 4.93 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 0.36 0.00 0.00 0.64 0.00 0.00 160 R 8.93 5.08 0.00 2.02 1.77 0.00 3.19 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.87 0.00 161 T 9.22 5.09 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 162 S 9.13 5.06 0.00 3.83 3.82 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 0.00 163 V 8.37 4.97 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 0.87 0.00 0.00 1.02 0.00 0.00 164 T 8.89 4.65 4.35 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 165 I 8.61 4.22 1.90 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 1.23 0.71 0.95 0.00 0.00 166 V 8.92 4.39 2.31 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 0.82 0.00 0.00 1.07 0.00 0.00 167 S 7.72 4.81 0.00 3.93 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 0.00 168 I 8.25 5.09 1.89 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.69 0.93 0.00 0.00 169 V 9.13 4.32 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 1.03 0.00 0.00 0.97 0.00 0.00 170 P 0.00 4.98 0.00 2.23 2.21 0.00 3.77 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 171 N 8.92 4.76 0.00 2.85 2.97 0.00 0.00 7.14 7.08 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 0.00 172 G 9.65 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 K 8.94 4.44 0.00 1.77 1.72 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.38 7.81 174 G 8.44 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.67 4.94 1.90 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 1.26 0.64 1.00 0.00 0.00 176 G 9.81 4.65 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 0.00 177 T 8.84 5.18 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 1.28 0.00 0.00 178 V 9.20 4.89 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 1.04 0.00 0.00 0.99 0.00 0.00 179 R 9.00 5.49 0.00 1.90 1.89 0.00 3.18 0.00 0.00 3.55 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 180 F 9.31 5.55 0.00 3.38 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 0.00 181 A 9.39 5.17 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 0.00 182 K 9.84 5.16 0.00 2.02 1.89 0.00 1.43 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.50 1.71 7.81 183 T 9.03 5.10 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 1.24 0.00 0.00 184 T 9.34 5.07 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 1.12 0.00 0.00 185 K 8.97 4.91 0.00 1.68 1.70 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.40 7.81 186 R 8.27 4.86 0.00 1.63 1.80 0.00 3.20 0.00 0.00 3.19 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.57 0.00 187 T 7.97 4.10 4.28 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 1.26 0.00 0.00 *192 D 8.03 4.43 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 0.00 193 G 8.21 3.82 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 0.00 0.00 0.00 194 E 8.79 4.74 0.00 1.89 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 2.25 0.00 195 T 8.55 5.08 4.21 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 1.11 0.00 0.00 196 T 9.45 4.57 4.76 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 0.48 0.00 0.00 197 H 7.93 5.20 0.00 2.80 2.99 0.00 5.56 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 W 9.03 5.33 0.00 1.85 2.80 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 0.00 0.00 0.00 199 I 9.38 5.13 1.95 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 1.21 0.78 0.99 0.00 0.00 200 A 9.89 5.08 1.27 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 0.00 201 T 9.22 4.91 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 1.24 0.00 0.00 202 I 9.34 4.95 2.01 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.08 1.01 0.00 0.00 203 G 9.64 4.61 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 0.00 0.00 0.00 204 Y 8.91 5.25 0.00 2.33 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 0.00 205 Q 8.56 4.35 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.78 0.00 0.00 0.00 0.00 0.00 2.16 2.16 0.00 206 Y 8.42 4.94 0.00 3.02 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 0.00 207 V 8.95 4.05 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 0.89 0.00 0.00 0.86 0.00 0.00 208 N 8.38 4.26 0.00 2.78 2.69 0.00 0.00 7.23 7.71 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 0.00 209 P 0.00 4.37 0.00 2.22 2.26 0.00 3.65 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.24 0.00 210 S 7.87 4.32 0.00 3.92 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 0.00 211 L 7.64 4.45 0.00 1.81 1.72 0.91 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 212 M 7.47 4.81 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 213 S 8.21 4.43 0.00 4.07 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 0.00 214 E 8.65 4.04 0.00 2.15 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 0.00 2.28 2.38 0.00 215 S 8.08 4.25 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 0.00 216 A 7.83 4.09 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 0.00 217 R 8.03 4.23 0.00 2.06 2.01 0.00 3.14 0.00 0.00 3.37 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 218 L 7.46 4.34 0.00 1.83 1.76 0.94 0.78 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 0.00 219 T 7.67 4.67 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 1.25 0.00 0.00 220 N 7.67 4.75 0.00 2.83 2.63 0.00 0.00 7.04 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 P 0.00 4.26 0.00 2.22 2.21 0.00 3.79 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 2.28 2.50 0.00 222 L 7.77 4.35 0.00 1.66 1.62 1.15 0.94 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 0.00 223 G 7.87 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 0.00 0.00 0.00 224 F 8.17 4.16 0.00 2.20 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 0.00 225 N 8.00 4.75 0.00 2.54 2.32 0.00 0.00 6.50 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 0.00 226 V 8.46 4.28 1.55 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 0.79 0.00 0.00 -0.38 0.00 0.00 227 T 8.73 4.40 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 1.13 0.00 0.00 228 S 7.67 5.38 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 0.00 229 Y 8.76 5.11 0.00 2.98 3.10 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 0.00 230 R 8.80 4.58 0.00 1.87 1.67 0.00 3.10 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 231 V 8.45 4.92 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.83 0.00 0.00 232 D 9.48 5.32 0.00 2.61 2.57 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 0.00 233 P 0.00 4.25 0.00 1.81 1.53 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.49 0.00 234 E 7.50 4.43 0.00 1.92 1.70 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 2.15 2.19 0.00 *235 M 7.83 4.29 0.00 1.82 1.86 0.00 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 * Residues marked with a * may have inaccurate shift predictions.