NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 E 4.3034 8.5445 116.7569 55.3012 31.4961 175.7345 26 T 3.4460 8.8801 112.2670 62.0680 68.4890 173.5940 27 R 3.3581 9.3407 121.0444 55.5416 29.8803 174.0971 28 E 4.9558 8.1117 126.4307 55.2820 34.2214 174.8518 29 C 5.0909 9.6535 121.6007 54.6599 45.2608 173.1335 30 I 4.5406 8.3121 121.1631 61.6379 36.8964 175.3733 31 Y 4.8915 8.7393 127.9586 56.4439 41.9269 173.8403 32 Y 4.6906 6.9010 120.9285 56.9128 43.4248 172.1978 33 N 4.7185 7.9293 125.9019 51.4474 40.5340 174.4198 34 A 3.9793 8.5634 130.6611 54.9811 18.6286 177.6409 35 N 4.7469 8.4747 112.1210 53.6572 39.4264 177.1890 36 W 4.5612 8.4343 116.7269 59.5220 29.0224 177.9325 37 E 3.3307 6.9197 119.0827 58.8251 28.5291 179.2708 38 L 3.9279 7.4280 116.9609 57.7592 41.9364 178.7532 39 E 4.2017 7.8769 117.5863 56.6010 30.7471 177.5137 40 R 3.7623 7.5032 116.7561 57.5559 26.8511 178.7493 41 T 4.8471 8.3788 113.6700 60.2461 71.3969 172.4027 42 N 4.7361 8.3827 119.4677 52.4232 39.7004 175.6493 43 Q 3.7040 7.8165 121.4333 58.5651 29.4691 175.1483 44 S 5.2504 6.8303 108.6909 57.9265 65.6562 171.7614 45 G 4.0257 8.3843 105.0449 44.1076 0.0000 172.2140 46 L 5.3196 8.4294 121.9219 54.0149 43.4552 175.9569 47 E 4.6179 9.5281 123.7249 54.6697 31.9375 174.2606 48 R 4.8763 8.4632 126.7925 54.9196 31.3535 176.2210 49 C 4.7484 8.4046 123.5259 56.6585 41.3110 172.8804 50 E 4.9199 8.5121 119.9956 54.4656 33.8402 177.9540 51 G 3.9952 7.7782 112.4972 46.3985 0.0000 175.6768 *54 D 4.3791 8.8652 125.4072 52.8135 39.9190 174.7120 55 K 4.6997 8.2303 121.6390 54.0970 36.4651 176.0268 56 R 4.1784 8.3286 119.2200 56.6076 31.4607 176.0240 57 L 4.6478 8.1594 119.8100 53.8423 45.0645 175.5802 58 H 5.4752 9.2388 123.1136 54.7131 32.6024 172.3929 59 C 5.7298 9.1892 114.6876 56.6994 43.5595 172.9827 60 Y 5.1961 9.0398 118.3483 54.6718 42.1968 173.7862 61 A 4.3387 7.6533 118.2136 51.0481 22.6390 175.3799 62 S 5.6582 9.7618 118.3671 55.4414 66.0127 173.5234 63 W 5.9248 8.0052 119.6119 55.3949 32.3628 173.1441 64 R 5.1004 9.2310 117.7623 54.6331 32.9666 174.9695 65 N 5.8667 9.3659 123.8422 50.8993 38.0481 172.1772 66 S 4.6327 8.1639 119.6261 57.3256 66.0645 174.6533 67 S 3.8837 9.4876 121.6528 59.3686 58.8012 168.6397 68 G 4.1278 8.1363 112.6050 46.5497 0.0000 172.3158 69 T 4.6111 7.4856 111.7161 59.9260 73.5557 175.5110 70 I 5.3152 8.4535 127.6931 58.3701 38.4493 174.6687 71 E 4.5537 8.6114 129.4531 54.1910 30.9007 175.1040 72 L 4.3412 8.7117 127.5388 55.7704 42.2201 176.2678 73 V 4.3979 9.8024 122.9798 64.0201 33.4390 175.2995 74 K 5.6593 8.3057 117.6825 55.7898 37.3792 174.6496 75 K 4.0893 6.9849 119.4222 54.9815 36.9134 176.4880 76 G 4.1921 6.9976 109.2396 46.2974 0.0000 171.8336 77 C 5.2055 10.1759 118.7299 56.7021 38.5771 173.4438 78 W 4.9502 9.4017 133.2679 55.4806 33.2922 174.2490 79 L 4.2237 8.5714 127.2574 55.4894 41.9100 179.1552 80 D 4.4817 7.5358 120.6558 55.6186 38.2870 172.9320 81 D 4.9410 7.9929 120.8030 51.5720 43.5687 176.9633 82 F 2.3000 8.3360 121.4744 59.3191 37.9414 176.6154 83 N 4.3297 6.3025 116.5906 54.8182 38.1193 174.6127 84 C 4.8102 7.5433 114.7432 56.6344 37.0827 173.7314 85 Y 5.5372 8.0203 118.4008 58.3460 38.0769 175.0035 86 D 4.3927 8.7824 119.4754 55.2706 38.9873 174.3539 87 R 4.4426 7.7548 122.0963 55.4661 29.9942 177.8107 88 Q 4.6232 8.6016 122.2503 56.2125 28.7948 173.0809 89 E 4.8004 7.8573 114.8872 54.8678 32.2845 176.5993 90 C 4.7719 8.7228 124.0290 55.7016 44.5049 172.1353 91 V 5.0522 8.2575 125.5688 61.0279 34.4980 174.2824 92 A 4.8048 9.2632 129.5763 50.6908 19.6724 178.0030 93 T 4.1255 8.5690 112.5258 62.7822 70.3799 175.2612 94 E 4.2532 7.9489 120.4596 56.5350 29.9898 176.6641 95 E 4.2131 8.6534 122.2031 58.9264 30.0774 178.9749 96 N 5.0281 7.6412 116.0585 52.2799 39.6271 172.7933 97 P 4.2618 0.0000 0.0000 62.8418 32.4736 176.7703 98 Q 4.1070 8.2861 118.1460 56.6588 28.5893 177.2398 99 V 4.5555 7.2656 117.2165 61.2611 33.7667 175.2331 100 Y 4.0844 9.2392 126.7305 57.2509 39.5885 174.2205 101 F 5.0717 7.7100 121.2683 57.3375 43.1833 171.6538 102 C 4.7695 7.7787 118.4264 53.8625 44.8857 171.8905 103 C 5.2956 8.1460 119.6414 55.2312 47.2417 171.2296 104 C 5.1111 8.6436 116.1114 54.6594 45.9362 172.0539 105 E 4.8864 9.8449 122.2210 54.8007 31.9326 173.4636 106 G 3.7736 9.6482 113.1853 44.5653 0.0000 172.1053 107 N 3.9939 8.6594 122.0700 53.8585 39.2492 174.6359 108 F 3.9021 8.5328 119.8104 58.1642 37.6513 174.8477 109 C 4.3365 8.1505 116.4853 58.1696 41.2903 174.3327 110 N 4.6554 8.0441 115.7019 52.8762 37.2214 175.4675 111 E 4.0476 8.4626 124.1200 59.1000 29.9376 177.7406 112 R 4.6051 7.7787 115.7703 53.9301 32.3050 177.4487 113 F 5.1945 7.4760 115.7672 55.1068 41.1808 173.6111 114 T 4.7798 8.4731 117.3818 62.4155 72.8669 171.8000 115 H 5.4366 8.6011 120.2122 55.7603 32.6404 173.1221 116 L 4.7076 8.5794 128.8619 54.9250 45.5942 175.5303 117 P 5.6061 0.0000 0.0000 64.7616 31.5131 169.8642 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 25 E 8.54 4.30 0.00 2.01 1.81 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 2.13 1.88 0.00 26 T 8.88 3.45 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 27 R 9.34 3.36 0.00 1.94 2.08 0.00 3.10 0.00 0.00 3.42 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.65 0.00 28 E 8.11 4.96 0.00 1.49 1.46 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 2.27 2.35 0.00 29 C 9.65 5.09 0.00 2.74 2.93 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 30 I 8.31 4.54 2.24 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.87 0.99 0.00 0.00 31 Y 8.74 4.89 0.00 3.22 2.96 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 32 Y 6.90 4.69 0.00 2.99 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 33 N 7.93 4.72 0.00 2.93 2.79 0.00 0.00 6.63 7.83 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 34 A 8.56 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 35 N 8.47 4.75 0.00 2.83 2.97 0.00 0.00 6.97 7.95 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 36 W 8.43 4.56 0.00 3.86 3.40 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 37 E 6.92 3.33 0.00 1.40 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 38 L 7.43 3.93 0.00 1.54 1.68 0.92 0.84 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 39 E 7.88 4.20 0.00 1.99 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 0.00 2.36 2.33 0.00 40 R 7.50 3.76 0.00 1.97 1.78 0.00 3.21 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.41 0.00 41 T 8.38 4.85 4.40 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 1.53 0.00 0.00 42 N 8.38 4.74 0.00 2.61 2.74 0.00 0.00 6.79 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 43 Q 7.82 3.70 0.00 0.93 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.54 0.00 0.00 0.00 0.00 0.00 2.15 1.77 0.00 44 S 6.83 5.25 0.00 4.03 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 45 G 8.38 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 46 L 8.43 5.32 0.00 2.06 1.84 1.09 0.73 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 47 E 9.53 4.62 0.00 2.22 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 2.33 2.31 0.00 48 R 8.46 4.88 0.00 1.87 1.82 0.00 3.30 0.00 0.00 3.28 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.84 0.00 49 C 8.40 4.75 0.00 2.95 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 50 E 8.51 4.92 0.00 1.91 1.82 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 2.20 2.26 0.00 51 G 7.78 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.87 4.38 0.00 2.80 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.23 4.70 0.00 1.72 1.97 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.46 7.81 56 R 8.33 4.18 0.00 1.80 1.88 0.00 2.30 0.00 0.00 3.20 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.36 0.00 57 L 8.16 4.65 0.00 1.44 1.54 0.92 1.07 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 58 H 9.24 5.48 0.00 3.47 3.59 0.00 5.60 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 C 9.19 5.73 0.00 2.86 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 60 Y 9.04 5.20 0.00 2.35 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 61 A 7.65 4.34 1.09 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 0.00 0.00 62 S 9.76 5.66 0.00 3.91 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 63 W 8.01 5.92 0.00 3.37 2.96 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 64 R 9.23 5.10 0.00 1.90 1.97 0.00 3.14 0.00 0.00 3.26 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 65 N 9.37 5.87 0.00 2.02 2.45 0.00 0.00 6.99 7.63 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 66 S 8.16 4.63 0.00 3.64 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 67 S 9.49 3.88 0.00 3.74 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.14 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 0.00 0.00 0.00 69 T 7.49 4.61 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 70 I 8.45 5.32 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.00 0.94 0.00 0.00 71 E 8.61 4.55 0.00 2.12 1.94 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 2.42 2.42 0.00 72 L 8.71 4.34 0.00 1.53 1.66 -0.08 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 73 V 9.80 4.40 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 1.06 0.00 0.00 1.04 0.00 0.00 74 K 8.31 5.66 0.00 2.01 1.75 0.00 1.90 0.00 0.00 1.89 0.00 0.00 3.10 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.40 7.81 75 K 6.98 4.09 0.00 1.63 1.69 0.00 1.98 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.10 7.81 76 G 7.00 4.19 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 0.00 77 C 10.18 5.21 0.00 2.91 3.16 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 78 W 9.40 4.95 0.00 3.65 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 79 L 8.57 4.22 0.00 1.30 1.49 0.80 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 80 D 7.54 4.48 0.00 2.94 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 81 D 7.99 4.94 0.00 3.08 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 82 F 8.34 2.30 0.00 2.91 2.93 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 83 N 6.30 4.33 0.00 2.28 2.71 0.00 0.00 6.88 7.52 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 84 C 7.54 4.81 0.00 2.56 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 85 Y 8.02 5.54 0.00 3.12 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 86 D 8.78 4.39 0.00 2.83 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 87 R 7.75 4.44 0.00 1.99 1.91 0.00 3.30 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.85 0.00 88 Q 8.60 4.62 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.70 0.00 0.00 0.00 0.00 0.00 2.26 1.94 0.00 89 E 7.86 4.80 0.00 1.83 1.88 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 2.21 2.27 0.00 90 C 8.72 4.77 0.00 3.03 3.19 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 91 V 8.26 5.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.98 0.00 0.00 92 A 9.26 4.80 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 0.00 0.00 0.00 0.00 0.00 0.00 93 T 8.57 4.13 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 1.23 0.00 0.00 94 E 7.95 4.25 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 2.27 2.20 0.00 95 E 8.65 4.21 0.00 1.97 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 2.32 2.29 0.00 96 N 7.64 5.03 0.00 2.63 2.73 0.00 0.00 6.99 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 97 P 0.00 4.26 0.00 1.81 1.71 0.00 3.73 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.49 0.00 98 Q 8.29 4.11 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.73 0.00 0.00 0.00 0.00 0.00 2.26 1.91 0.00 99 V 7.27 4.56 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 0.94 0.00 0.00 0.92 0.00 0.00 100 Y 9.24 4.08 0.00 1.43 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 F 7.71 5.07 0.00 2.89 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 0.00 102 C 7.78 4.77 0.00 3.11 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 C 8.15 5.30 0.00 2.83 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 0.00 104 C 8.64 5.11 0.00 3.19 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 0.00 105 E 9.84 4.89 0.00 2.41 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 2.24 2.32 0.00 106 G 9.65 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 N 8.66 3.99 0.00 2.90 2.55 0.00 0.00 7.21 8.13 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 0.00 108 F 8.53 3.90 0.00 3.32 3.16 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 0.00 109 C 8.15 4.34 0.00 3.12 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 N 8.04 4.66 0.00 2.83 2.91 0.00 0.00 5.99 7.66 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 0.00 111 E 8.46 4.05 0.00 2.24 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 2.37 2.41 0.00 112 R 7.78 4.61 0.00 1.83 1.65 0.00 3.27 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.14 0.00 113 F 7.48 5.19 0.00 2.65 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 0.00 114 T 8.47 4.78 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 1.22 0.00 0.00 115 H 8.60 5.44 0.00 3.51 3.26 0.00 5.67 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.58 4.71 0.00 1.48 1.47 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 117 P 0.00 5.61 0.00 2.02 1.72 0.00 3.67 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.47 0.00 * Residues marked with a * may have inaccurate shift predictions.