NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 Y 4.6890 8.0033 118.9225 57.4557 39.2048 175.5385 16 N 4.0651 9.0638 114.9226 53.1248 36.8015 170.5502 17 E 4.7338 8.1793 118.3450 54.3480 34.1880 174.6025 18 S 4.0733 8.9173 116.6662 60.9184 62.6695 174.8293 19 R 3.1668 7.8023 115.1615 56.5435 29.5663 172.8319 20 P 4.2204 0.0000 0.0000 62.6688 32.5496 174.9773 21 V 3.7963 8.0310 118.4245 63.1779 32.0230 175.0217 22 E 4.9796 8.5989 127.8105 54.6686 33.2158 174.8211 23 L 4.4248 8.2754 127.6220 53.3332 41.6932 176.3541 24 R 4.2853 8.2353 124.1926 54.3647 31.1442 174.6738 25 P 4.5670 0.0000 0.0000 64.3250 31.7564 175.7245 26 D 4.2893 8.7072 118.9984 55.1581 37.8350 174.4347 27 F 4.4784 7.2467 112.9975 56.7730 38.5986 175.5511 28 S 4.5053 9.1620 118.4014 57.4353 65.3930 175.1414 29 L 4.0446 8.3518 123.0151 58.4688 41.5423 178.3643 30 D 4.3463 8.0632 116.5266 57.2158 41.2619 177.4119 31 D 4.5231 7.8614 118.4420 57.5025 41.2385 178.4345 32 A 3.9861 8.1990 121.0462 54.7235 18.3256 179.6765 33 K 4.0545 7.9843 115.1398 57.1549 32.0248 179.2171 *35 V 3.9578 7.7625 121.3715 63.0814 33.5203 177.5775 36 I 3.4787 7.7421 120.3315 64.5147 36.8391 178.7061 37 R 4.1031 7.9655 118.4175 59.1477 29.8558 178.9572 38 A 4.0232 7.9905 120.2837 55.1821 18.3200 179.7083 39 V 3.5916 7.7557 116.8006 66.2162 31.6090 178.0020 40 Y 4.3217 7.9566 116.6590 60.9591 37.7097 178.2443 41 R 3.9750 8.3456 119.8533 59.4662 29.8513 178.4609 42 Q 3.9688 8.2197 119.3438 59.0988 28.9835 177.7487 43 V 4.0000 7.9489 117.0012 63.9897 31.8307 176.8131 44 L 4.9527 7.8540 117.7471 53.5310 41.9072 176.4487 45 G 3.9466 8.4407 105.0162 46.9007 0.0000 175.2633 46 N 4.4880 8.4970 115.0725 53.0411 37.4912 174.6345 47 D 4.4221 7.7017 118.9622 54.3182 40.7239 175.3979 48 Y 3.9738 8.6090 126.6698 57.0030 39.6528 175.0471 49 I 4.2661 7.1636 121.5477 59.6290 40.6095 173.7214 *51 D 4.6412 8.5770 117.5912 54.8753 42.4539 178.5850 52 S 4.2288 8.0868 111.4174 60.7904 62.9340 174.9911 53 E 4.1637 7.9261 119.4028 58.0676 29.8900 177.2525 54 R 3.7659 7.4406 117.2068 56.9318 30.8172 178.0277 55 L 4.5028 8.3625 122.9506 53.7497 39.2719 177.8544 56 K 4.2151 8.1636 122.5356 58.7537 32.6443 178.5930 57 G 3.7583 8.2656 105.7523 48.1482 0.0000 175.4581 58 A 4.1871 8.0938 123.3552 54.3724 18.4551 179.1562 59 E 3.5440 8.6488 117.8070 59.7410 29.5976 179.8675 60 S 4.1278 8.3344 114.1504 61.3676 63.1856 176.4871 61 L 4.0304 7.9054 122.2574 57.1993 41.2240 179.3260 62 L 3.9737 7.8586 120.4011 58.6187 41.8764 179.1706 63 T 4.0260 7.7852 114.2112 66.1247 68.3091 174.9648 64 N 4.9718 8.1774 117.0541 52.6723 39.5080 175.3233 65 G 4.2189 8.2722 106.3019 46.5926 0.0000 175.7341 66 S 4.3365 8.1686 117.4184 60.4138 63.0374 174.7183 67 I 4.8705 7.2881 111.2887 57.9206 40.6190 175.5132 68 S 4.3801 9.0424 117.5644 57.8337 65.1133 175.3485 69 V 3.5456 8.3676 123.0407 66.5475 31.0280 178.2694 70 R 3.9490 8.1552 117.9286 59.7800 30.0818 178.3816 71 E 3.9511 8.5937 118.5330 59.1909 29.3731 179.2561 72 F 4.2415 8.3814 121.0767 61.0973 39.4596 177.3897 73 V 3.3600 8.2457 118.3431 66.0445 31.1720 177.9004 74 R 3.7274 8.1419 118.7020 59.8304 29.5987 178.6133 75 T 3.8468 7.3657 114.3728 66.2985 68.8044 176.7574 76 V 3.5875 7.4460 120.1839 65.7658 31.3385 177.9954 77 A 3.0691 7.7423 119.2427 53.7406 18.1766 178.6297 78 K 4.5933 7.1936 114.9295 55.5889 33.1357 176.9012 79 S 4.5563 7.1719 114.7693 57.3097 64.2036 175.0139 80 E 3.9452 8.8549 120.9728 59.5115 29.0429 179.0669 81 L 4.2397 8.0207 119.8114 58.5678 41.9639 178.3820 82 Y 3.9170 7.8083 118.4645 60.6680 38.7446 178.0945 83 K 3.5009 8.4378 119.7348 59.2576 31.8313 179.2953 84 K 3.9059 8.5239 118.3657 59.6643 32.0505 179.1954 85 K 3.7093 7.0961 117.0045 58.2848 31.9061 177.9231 86 F 4.8589 7.4730 113.9281 56.4846 41.2556 175.2433 87 L 4.3483 7.8471 122.1284 56.9540 42.6902 177.8726 88 Y 4.5691 7.4310 113.0930 59.9405 37.9329 176.1521 89 N 5.0510 8.0007 115.3783 52.6148 39.7441 173.4618 90 N 4.6993 7.7265 114.7013 51.0821 43.0105 174.3822 91 F 4.5202 6.9535 115.2190 56.3215 39.1762 176.0459 92 Q 3.8319 9.0006 123.2662 59.9985 28.4742 179.4742 93 T 3.9270 8.1098 115.9731 66.9111 68.6905 176.3854 94 R 4.0286 8.3435 120.1865 58.8745 29.9985 178.7745 95 V 3.5405 7.5827 118.0023 66.0027 31.7114 177.7369 96 I 3.7995 8.1765 119.9682 64.4826 37.0475 177.8299 97 E 3.9862 8.1650 119.3313 59.7503 29.3944 179.4941 98 L 3.6596 7.7194 118.1936 57.9046 41.6152 179.1901 99 N 3.9808 8.3909 116.5457 56.7530 38.3998 177.0177 100 Y 3.7494 7.8560 117.6634 60.5994 37.7257 178.7353 101 K 4.0265 7.7855 120.4144 59.9972 32.2121 178.7826 102 H 4.2732 8.2952 115.3465 58.2087 28.7444 176.9610 103 L 4.5790 7.9352 118.2436 54.6327 42.6854 177.0846 104 L 4.7536 7.8681 116.1035 53.6331 44.1687 176.8402 105 G 3.8974 9.6698 106.6406 46.4177 0.0000 173.0011 106 R 3.9330 7.3058 113.0805 54.6856 32.3097 173.8345 107 A 4.3957 7.9439 121.4028 50.0428 20.0743 175.7416 108 P 3.5757 0.0000 0.0000 62.5542 31.9547 177.0898 109 F 4.5820 9.1441 121.9263 60.0883 38.9308 175.8100 110 S 4.7917 7.5980 112.9375 55.2243 66.2450 174.4717 111 E 4.1038 8.7134 118.9804 59.5052 29.0872 178.9013 112 D 4.5069 7.7320 119.9627 57.1703 40.8675 178.4412 113 E 4.0335 7.9076 117.8565 59.4208 29.5455 179.2096 114 V 3.7534 7.9057 117.6915 66.3981 31.5223 177.6670 115 I 3.7324 8.2853 119.5984 64.5202 37.0583 177.9719 116 F 4.0419 8.4446 121.2016 61.7791 39.1714 176.9951 117 H 4.1425 8.5826 115.5217 58.7675 28.6544 177.1939 118 L 4.0319 8.6261 122.5194 58.6835 41.7321 179.0422 119 D 4.3071 8.1818 118.3688 57.3380 40.9779 178.5083 120 L 3.8190 7.5271 120.5997 58.0511 41.8660 178.4768 121 Y 4.0445 8.5250 120.1862 60.6331 38.5530 177.5641 122 E 3.9498 7.9477 117.9922 59.2227 29.7088 178.4217 123 N 4.6867 7.9108 113.9948 54.1020 39.2162 175.8057 124 Q 4.2663 7.7745 115.0364 54.2954 32.0028 175.6866 125 G 3.6262 8.0193 105.2727 44.7340 0.0000 174.0566 126 F 4.3181 8.6114 119.0355 61.6203 39.1732 176.2502 127 D 4.2862 8.4370 117.4147 57.6076 40.4930 178.6218 128 A 3.9357 7.9840 118.8446 55.7049 18.4509 178.4049 129 D 4.2844 7.9393 116.9994 56.8079 41.2708 178.4861 130 I 3.6793 7.6325 119.8237 64.8185 37.2600 177.8954 131 D 4.3773 8.1182 119.3490 57.2539 40.0212 178.8163 132 S 3.9972 8.0521 116.0294 62.0725 62.6571 176.4629 133 Y 4.0277 7.3494 116.8965 61.1744 37.7361 178.3408 134 I 3.1783 7.1350 117.5556 63.1302 37.4163 177.3962 135 D 4.4896 8.3521 118.8765 54.7209 41.3469 177.1328 136 S 4.2865 7.1938 114.4812 57.7062 63.9666 175.3397 137 V 3.5454 8.4733 121.3605 66.3077 31.1602 177.9698 138 E 3.8333 8.1090 118.4318 59.3361 29.4375 178.0276 139 Y 3.6234 7.8455 118.9986 60.6046 38.7270 177.4645 140 Q 4.0758 8.4544 120.8742 59.6005 28.8795 178.3708 141 E 3.8373 8.3269 119.0025 58.8893 29.7161 177.9826 142 N 4.2505 7.4962 115.4461 55.1303 38.5456 176.3701 143 F 4.9184 7.6688 117.9373 59.1499 41.0348 176.4697 144 G 4.3940 7.8342 105.9437 45.8494 0.0000 173.4357 145 E 4.2492 8.7621 116.9677 58.6494 30.1308 177.3421 146 N 5.1010 8.2010 112.9841 52.5495 41.0952 173.6139 147 I 4.9576 7.4426 119.6387 59.0440 39.4788 175.8291 148 V 3.6680 8.4576 127.8462 62.1202 31.7721 174.3822 149 P 2.9700 0.0000 0.0000 62.1906 32.1051 175.0411 150 Y 4.7699 6.8159 116.9169 55.0763 41.0573 173.8638 151 Y 3.9866 8.7339 122.8898 57.2277 38.9149 174.9559 152 R 4.6365 7.8047 125.0747 54.9000 30.5424 176.6030 153 F 4.3178 9.2024 121.3093 58.1574 39.6158 174.8617 154 N 4.8961 8.2466 118.8836 52.1302 39.4914 173.3782 155 N 4.7596 8.7936 122.3084 53.2987 39.4416 175.4432 156 Q 4.2005 7.9136 122.8474 56.0330 29.0003 175.4393 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 15 Y 8.00 4.69 0.00 3.11 3.13 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 16 N 9.06 4.07 0.00 2.98 2.96 0.00 0.00 6.61 6.78 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 17 E 8.18 4.73 0.00 1.91 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 2.24 2.39 0.00 18 S 8.92 4.07 0.00 3.87 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 19 R 7.80 3.17 0.00 1.79 1.76 0.00 3.28 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 20 P 0.00 4.22 0.00 2.08 1.49 0.00 3.72 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 21 V 8.03 3.80 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 0.96 0.00 0.00 0.86 0.00 0.00 22 E 8.60 4.98 0.00 1.95 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.51 0.00 23 L 8.28 4.42 0.00 1.44 1.35 0.37 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 24 R 8.24 4.29 0.00 1.99 1.88 0.00 3.21 0.00 0.00 3.42 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.65 0.00 25 P 0.00 4.57 0.00 2.21 2.11 0.00 3.92 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 2.02 2.03 0.00 26 D 8.71 4.29 0.00 2.84 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 27 F 7.25 4.48 0.00 3.25 3.21 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 28 S 9.16 4.51 0.00 4.08 4.06 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 29 L 8.35 4.04 0.00 1.80 1.73 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.06 4.35 0.00 2.71 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 31 D 7.86 4.52 0.00 3.16 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 32 A 8.20 3.99 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 33 K 7.98 4.05 0.00 1.96 1.85 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.59 7.81 *35 V 7.76 3.96 1.89 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 0.86 0.00 0.00 0.84 0.00 0.00 36 I 7.74 3.48 1.93 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.45 0.68 0.00 0.00 37 R 7.97 4.10 0.00 1.99 2.18 0.00 3.21 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.08 0.00 38 A 7.99 4.02 1.35 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 0.00 0.00 0.00 39 V 7.76 3.59 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 0.96 0.00 0.00 1.06 0.00 0.00 40 Y 7.96 4.32 0.00 2.97 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.35 3.97 0.00 2.27 2.02 0.00 3.24 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.87 0.00 42 Q 8.22 3.97 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.54 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 43 V 7.95 4.00 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 0.93 0.00 0.00 0.91 0.00 0.00 44 L 7.85 4.95 0.00 1.99 1.66 0.86 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.44 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 0.00 0.00 0.00 46 N 8.50 4.49 0.00 2.98 3.10 0.00 0.00 6.86 7.35 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 47 D 7.70 4.42 0.00 2.83 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 48 Y 8.61 3.97 0.00 2.92 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 49 I 7.16 4.27 1.72 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.30 0.67 0.00 0.00 *51 D 8.58 4.64 0.00 2.81 2.74 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 52 S 8.09 4.23 0.00 4.00 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 53 E 7.93 4.16 0.00 1.84 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 2.21 2.26 0.00 54 R 7.44 3.77 0.00 1.92 2.21 0.00 3.15 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.54 0.00 55 L 8.36 4.50 0.00 1.90 1.72 0.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 56 K 8.16 4.22 0.00 1.85 1.91 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.61 1.57 7.81 57 G 8.27 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 0.00 0.00 0.00 58 A 8.09 4.19 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 59 E 8.65 3.54 0.00 2.20 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 2.47 2.78 0.00 60 S 8.33 4.13 0.00 4.06 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 61 L 7.91 4.03 0.00 1.95 1.79 0.96 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 62 L 7.86 3.97 0.00 1.38 1.45 0.79 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 63 T 7.79 4.03 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 1.28 0.00 0.00 64 N 8.18 4.97 0.00 2.73 2.84 0.00 0.00 7.03 7.01 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 65 G 8.27 4.22 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 0.00 0.00 0.00 66 S 8.17 4.34 0.00 4.11 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 I 7.29 4.87 2.00 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 1.60 0.67 0.94 0.00 0.00 68 S 9.04 4.38 0.00 4.25 4.05 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 0.00 0.00 0.00 69 V 8.37 3.55 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 1.06 0.00 0.00 0.82 0.00 0.00 70 R 8.16 3.95 0.00 2.23 1.97 0.00 2.78 0.00 0.00 3.49 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 71 E 8.59 3.95 0.00 2.22 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 2.33 2.32 0.00 72 F 8.38 4.24 0.00 3.01 3.21 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 73 V 8.25 3.36 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 0.89 0.00 0.00 1.01 0.00 0.00 74 R 8.14 3.73 0.00 1.75 1.98 0.00 3.07 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 75 T 7.37 3.85 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 1.18 0.00 0.00 76 V 7.45 3.59 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 1.07 0.00 0.00 0.23 0.00 0.00 77 A 7.74 3.07 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.19 4.59 0.00 1.71 1.92 0.00 1.68 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.50 1.49 7.81 79 S 7.17 4.56 0.00 4.06 4.11 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 80 E 8.85 3.95 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 81 L 8.02 4.24 0.00 1.71 1.69 0.80 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 82 Y 7.81 3.92 0.00 3.25 3.13 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 83 K 8.44 3.50 0.00 1.24 0.81 0.00 0.61 0.00 0.00 1.29 0.00 0.00 2.85 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.33 1.39 7.81 84 K 8.52 3.91 0.00 1.56 1.81 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.60 1.64 7.81 85 K 7.10 3.71 0.00 0.79 0.74 0.00 1.39 0.00 0.00 1.24 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.08 1.42 7.81 86 F 7.47 4.86 0.00 2.52 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 7.85 4.35 0.00 1.35 1.06 1.01 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 88 Y 7.43 4.57 0.00 2.94 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 N 8.00 5.05 0.00 2.58 2.71 0.00 0.00 6.72 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 90 N 7.73 4.70 0.00 2.61 2.31 0.00 0.00 6.91 7.25 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 91 F 6.95 4.52 0.00 3.17 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 92 Q 9.00 3.83 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.92 0.00 0.00 0.00 0.00 0.00 1.73 2.31 0.00 93 T 8.11 3.93 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 94 R 8.34 4.03 0.00 1.88 1.72 0.00 3.11 0.00 0.00 3.07 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.53 0.00 95 V 7.58 3.54 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 1.08 0.00 0.00 1.05 0.00 0.00 96 I 8.18 3.80 2.12 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 1.74 0.86 1.22 0.00 0.00 97 E 8.17 3.99 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 98 L 7.72 3.66 0.00 1.70 1.18 0.89 0.45 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 99 N 8.39 3.98 0.00 2.01 1.42 0.00 0.00 7.10 7.51 0.00 0.00 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 Y 7.86 3.75 0.00 3.22 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 0.00 101 K 7.79 4.03 0.00 1.85 1.74 0.00 1.57 0.00 0.00 1.48 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.63 7.81 102 H 8.30 4.27 0.00 3.04 3.32 0.00 5.70 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 7.94 4.58 0.00 1.48 1.73 0.56 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.87 4.75 0.00 1.78 1.67 0.89 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 105 G 9.67 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 106 R 7.31 3.93 0.00 1.57 1.57 0.00 2.32 0.00 0.00 3.10 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.30 0.00 107 A 7.94 4.40 1.22 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 0.00 0.00 108 P 0.00 3.58 0.00 1.77 1.39 0.00 3.49 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.30 0.00 109 F 9.14 4.58 0.00 2.98 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 0.00 110 S 7.60 4.79 0.00 3.96 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 0.00 111 E 8.71 4.10 0.00 2.24 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 2.38 2.43 0.00 112 D 7.73 4.51 0.00 2.82 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 0.00 113 E 7.91 4.03 0.00 1.96 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 2.37 2.34 0.00 114 V 7.91 3.75 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 1.15 0.00 0.00 0.95 0.00 0.00 115 I 8.29 3.73 2.15 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.66 0.98 0.00 0.00 116 F 8.44 4.04 0.00 3.13 3.26 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 0.00 117 H 8.58 4.14 0.00 3.60 3.59 0.00 5.70 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 L 8.63 4.03 0.00 2.00 1.76 0.97 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 119 D 8.18 4.31 0.00 2.86 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.53 3.82 0.00 1.28 1.61 0.81 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 121 Y 8.52 4.04 0.00 3.10 3.24 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 0.00 122 E 7.95 3.95 0.00 2.14 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 0.00 2.84 2.56 0.00 123 N 7.91 4.69 0.00 2.64 2.81 0.00 0.00 6.83 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 0.00 124 Q 7.77 4.27 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.51 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 125 G 8.02 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 0.00 0.00 0.00 126 F 8.61 4.32 0.00 3.41 3.21 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 0.00 127 D 8.44 4.29 0.00 2.76 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 0.00 128 A 7.98 3.94 1.31 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 0.00 129 D 7.94 4.28 0.00 2.95 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 0.00 130 I 7.63 3.68 1.78 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 0.47 0.74 0.71 0.00 0.00 131 D 8.12 4.38 0.00 2.83 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 0.00 132 S 8.05 4.00 0.00 3.40 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 Y 7.35 4.03 0.00 2.76 2.85 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 0.00 0.00 0.00 134 I 7.14 3.18 1.61 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.31 0.32 0.00 0.00 135 D 8.35 4.49 0.00 2.61 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 0.00 136 S 7.19 4.29 0.00 3.96 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.47 3.55 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 0.99 0.00 0.00 0.91 0.00 0.00 138 E 8.11 3.83 0.00 2.05 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 0.00 2.23 2.25 0.00 139 Y 7.85 3.62 0.00 3.35 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 0.00 140 Q 8.45 4.08 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.60 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 141 E 8.33 3.84 0.00 2.13 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 2.28 2.31 0.00 142 N 7.50 4.25 0.00 1.58 1.42 0.00 0.00 6.88 7.38 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 0.00 143 F 7.67 4.92 0.00 2.25 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 0.00 144 G 7.83 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 E 8.76 4.25 0.00 2.06 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 2.45 2.31 0.00 146 N 8.20 5.10 0.00 2.62 2.90 0.00 0.00 6.99 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 I 7.44 4.96 2.16 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 1.16 0.65 1.10 0.00 0.00 148 V 8.46 3.67 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 0.70 0.00 0.00 0.99 0.00 0.00 149 P 0.00 2.97 0.00 1.65 0.77 0.00 3.48 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 1.88 1.45 0.00 150 Y 6.82 4.77 0.00 3.05 2.90 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 0.00 0.00 0.00 151 Y 8.73 3.99 0.00 2.88 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 R 7.80 4.64 0.00 2.05 1.94 0.00 2.75 0.00 0.00 3.01 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.51 0.00 153 F 9.20 4.32 0.00 3.17 3.33 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 0.00 154 N 8.25 4.90 0.00 2.76 2.81 0.00 0.00 6.96 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 0.00 155 N 8.79 4.76 0.00 3.03 3.02 0.00 0.00 7.14 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 Q 7.91 4.20 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.65 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 * Residues marked with a * may have inaccurate shift predictions.