NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 S 4.4040 8.3349 116.7964 58.6949 64.0402 173.9921 8 C 4.2588 8.5328 124.2301 58.4602 26.6926 171.2619 9 I 4.1650 7.8478 125.5620 59.4875 36.5666 173.4413 10 Q 4.1192 8.0891 123.7492 55.4972 29.5677 175.5692 11 F 4.3655 9.1492 125.0915 57.0156 38.5683 176.0430 12 T 4.3693 8.4913 115.8322 62.0478 69.5208 175.3839 13 R 4.5198 7.7434 118.1084 56.3930 30.6532 177.2404 14 H 4.1479 8.3247 119.5301 59.4200 29.9010 176.6218 15 A 3.9380 8.1014 122.3648 55.4880 18.2446 179.7242 16 S 4.0914 7.9966 111.9102 61.4094 63.0869 176.1684 17 D 4.2980 7.9592 122.1990 57.1461 40.6099 178.5851 18 V 3.4902 7.6511 118.6248 66.2155 31.4786 177.9167 19 L 4.0215 7.7459 119.4866 57.7628 41.8665 178.5222 20 L 3.9623 7.9736 120.4690 58.3790 42.0581 178.8551 21 N 4.3868 8.3698 116.3609 56.1633 38.5256 177.4820 22 L 4.0629 8.4209 121.0768 57.7412 41.6799 179.0002 23 N 4.3608 8.7784 117.5670 56.4397 38.8093 177.3008 24 R 3.8844 8.1952 119.7428 59.2342 30.1303 178.7021 25 L 3.9709 7.9082 118.7646 57.8915 41.6012 179.7142 26 R 3.8605 7.8673 117.9572 59.6881 29.8337 178.5484 27 S 4.0861 7.7611 113.4167 61.5435 62.9352 176.3306 28 R 4.2065 7.8984 117.9435 55.2853 30.6306 175.5691 29 D 4.3559 7.7603 117.1544 55.2283 39.8121 173.5336 30 I 4.1375 8.4718 120.1386 60.7187 38.0376 176.6528 31 L 3.7938 8.8334 123.6993 55.2430 39.3138 174.6898 32 T 3.6207 7.3456 108.3782 62.3498 68.6594 173.4587 33 D 5.0771 8.4393 123.6901 52.8384 40.6090 175.9902 34 V 4.6523 7.4955 117.9808 60.6756 35.2335 173.1379 35 V 4.9045 9.7134 123.7976 61.4287 33.8873 174.1533 36 I 4.8649 9.0735 129.6844 59.9942 39.0493 174.7153 37 V 5.3738 9.0326 127.8273 61.0754 32.6390 176.1889 38 V 4.2502 8.4516 124.3847 62.6565 33.7387 174.3307 *41 E 4.1623 8.0656 118.6617 56.6813 31.3465 174.2727 42 Q 4.8295 8.1423 119.1177 54.7285 30.8498 175.6675 43 F 4.7492 8.8184 120.8300 55.9108 42.6578 174.0768 44 R 5.0098 8.7891 122.8875 55.4079 31.7216 175.5645 45 A 4.5468 8.6902 123.5007 51.7843 23.8200 174.0381 46 H 5.1615 9.1331 115.8780 54.5492 30.1666 177.0869 47 K 3.5001 9.9707 124.7545 59.8223 31.8729 179.5535 48 T 3.8466 7.7419 109.3034 64.7575 68.7042 176.5787 49 V 3.4024 7.6350 120.6124 65.5050 31.6706 177.5946 50 L 3.9410 7.5883 118.2860 58.3846 41.2594 179.6073 51 M 4.3974 8.3515 117.1453 58.4401 31.9665 178.4391 52 A 4.0936 7.9932 120.2355 54.5852 18.6447 178.5317 53 C 4.5134 7.9060 112.7331 59.0013 29.5277 173.9108 54 S 4.7003 7.7883 115.2480 55.4445 65.2947 174.7405 55 G 3.6904 8.4775 114.8371 47.3124 0.0000 175.7741 56 L 3.7672 7.6521 122.5800 57.8645 42.1497 178.9616 57 F 4.0799 7.8602 117.2335 60.4305 38.9619 176.9548 58 Y 4.2623 8.0889 118.9819 60.7892 38.4539 177.6927 59 S 3.9304 8.2914 113.1122 61.5591 62.5938 176.1060 60 I 3.6900 7.6114 122.0391 64.5722 36.6811 178.6180 61 F 4.6218 7.7038 117.0113 59.9034 38.7318 176.8286 62 T 4.4398 7.2811 108.0078 60.4929 68.7785 173.6050 63 D 4.6170 7.4504 122.7759 53.3801 41.7676 177.3523 64 Q 4.2352 8.6286 125.2263 58.9010 29.2245 177.5537 65 L 4.0949 8.0416 118.0930 57.2396 41.9553 177.6612 66 K 4.1576 7.2356 119.1721 56.0587 32.7045 176.3891 67 C 4.4026 8.3706 122.5861 59.6141 28.8441 172.8703 68 N 4.8086 8.5068 119.8194 52.5939 38.9876 174.9948 69 L 4.8442 8.2561 122.0613 53.1900 45.4305 176.2768 70 S 4.6791 8.6059 115.2357 58.9413 63.6402 173.1386 71 V 4.9086 7.7156 118.4013 61.8808 34.0936 174.3210 72 I 4.6528 9.2296 128.6066 59.5824 40.2815 174.2587 73 N 5.1224 8.7444 124.2606 52.0879 39.2436 175.2408 74 L 4.2714 8.7002 124.7729 54.7404 43.0031 176.5515 75 D 4.4823 8.6346 121.5678 53.3796 42.1893 177.1548 *77 E 4.1056 8.4205 125.4705 56.1442 30.4798 176.4444 78 I 3.8287 8.1499 120.4658 61.0837 38.3289 177.2847 79 N 4.6545 8.6109 123.2266 52.2208 39.3484 174.6724 80 P 4.4041 0.0000 0.0000 65.9666 31.3327 178.1896 81 E 4.0747 8.4959 118.8406 59.1683 29.5026 179.0462 82 G 3.4949 8.0282 105.1209 47.5302 0.0000 175.4391 83 F 4.0013 7.9106 123.3490 61.1257 39.4819 176.6224 84 C 3.8719 8.2097 118.5402 62.5565 31.2223 175.7671 85 I 3.8150 7.2726 121.0581 64.1458 36.7727 178.3701 86 L 4.0022 7.6453 119.4545 57.5372 41.3044 179.1818 87 L 3.8117 8.0154 120.6011 58.2748 41.9684 178.7451 88 D 4.4214 7.9345 118.2815 57.2936 40.8624 178.5260 89 F 4.3682 8.0817 122.4294 61.1115 39.1842 176.8387 90 M 3.7566 8.2910 117.3073 58.5037 31.8507 177.7298 91 Y 4.2782 7.6533 114.7964 58.5904 38.5133 176.2856 92 T 4.4174 7.6957 107.7894 60.2776 70.1564 174.6139 93 S 3.2555 7.4348 116.1027 59.0856 61.2958 171.6237 94 R 4.5267 7.5205 118.7879 54.3027 31.4956 175.0683 95 L 4.6968 8.4414 125.1001 53.1192 42.0347 174.8649 96 N 4.5294 8.5510 125.4413 52.7612 39.1721 174.1968 97 L 4.7053 8.1894 125.2315 52.8202 44.8818 176.1813 98 R 4.7458 8.7696 121.7034 54.2768 33.6750 176.5479 99 E 3.8230 8.6844 123.0887 59.2056 30.0088 178.2948 100 G 4.0635 8.0578 103.8621 45.3889 0.0000 173.7879 101 N 4.8768 8.2935 117.7329 52.7934 38.4452 176.5500 102 I 3.6950 7.6558 121.4632 64.5118 38.1989 177.3786 103 M 4.1733 8.0706 118.9300 58.0501 31.8057 178.3226 104 A 3.9701 7.9544 120.5583 55.1525 18.6112 179.3651 105 V 3.4692 8.1036 116.8546 66.5499 31.6202 177.7683 106 M 3.8937 8.4757 117.8275 58.5806 31.6610 178.0110 107 A 3.9912 8.1154 120.6680 55.5767 18.7621 179.7072 108 T 3.9804 8.5249 114.3064 66.8976 68.5582 176.7986 109 A 4.0508 8.7158 123.1075 55.2202 18.3007 179.7413 110 M 3.9860 8.2037 117.4167 58.8243 31.9416 178.2314 111 Y 4.3495 7.5962 116.2332 59.5359 39.3688 176.4309 112 L 4.0477 7.8123 118.2425 53.8048 42.1788 176.5344 113 Q 3.7446 7.8057 117.0351 56.7420 26.9523 173.1905 114 M 4.4739 7.8869 118.7960 54.2709 32.4287 176.7425 115 E 4.3171 8.4452 124.3372 58.3071 30.3344 178.4552 116 H 4.2373 7.9218 116.0311 58.8047 28.8577 177.6286 117 V 3.3157 7.6238 119.4681 65.9317 31.2467 177.5800 118 V 3.5222 7.2008 116.5507 66.5507 31.1939 177.5119 119 D 4.3917 7.9024 117.8842 57.8644 40.7688 179.3755 120 T 3.8978 7.7510 115.8614 66.6942 68.4646 176.5138 121 C 4.1245 8.2088 118.6819 62.9523 28.1761 176.0203 122 R 3.9296 8.2050 119.9581 59.7882 29.2505 179.2385 123 K 4.1934 8.0009 117.1934 58.7636 31.8634 178.5518 124 F 4.2311 7.9300 118.7117 59.1860 39.5015 176.7995 125 I 4.1599 8.0562 118.7283 64.3372 37.7139 177.6369 126 K 3.9930 8.2769 117.8942 58.4052 32.0136 177.3732 127 A 4.0529 6.7205 120.1170 52.6955 19.0409 177.4416 128 S 4.3643 8.4532 112.8500 58.6538 63.2237 169.0719 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 7 S 8.33 4.40 0.00 3.89 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 8 C 8.53 4.26 0.00 3.05 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 9 I 7.85 4.17 2.01 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 1.32 0.56 0.89 0.00 0.00 10 Q 8.09 4.12 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.05 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 11 F 9.15 4.37 0.00 3.02 3.04 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 12 T 8.49 4.37 4.26 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 1.23 0.00 0.00 13 R 7.74 4.52 0.00 2.02 2.20 0.00 3.13 0.00 0.00 3.29 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 14 H 8.32 4.15 0.00 3.25 3.49 0.00 5.60 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 15 A 8.10 3.94 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 16 S 8.00 4.09 0.00 4.04 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 17 D 7.96 4.30 0.00 2.96 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 18 V 7.65 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 0.83 0.00 0.00 0.76 0.00 0.00 19 L 7.75 4.02 0.00 1.75 1.57 0.76 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.97 3.96 0.00 1.87 1.91 0.92 0.44 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 21 N 8.37 4.39 0.00 2.90 2.84 0.00 0.00 7.08 6.26 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 22 L 8.42 4.06 0.00 1.84 1.82 0.84 0.48 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 N 8.78 4.36 0.00 3.23 2.97 0.00 0.00 7.19 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 24 R 8.20 3.88 0.00 2.08 1.95 0.00 3.19 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 25 L 7.91 3.97 0.00 1.91 1.95 0.89 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 26 R 7.87 3.86 0.00 1.46 1.65 0.00 2.90 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.39 0.00 27 S 7.76 4.09 0.00 4.00 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 28 R 7.90 4.21 0.00 1.77 1.96 0.00 3.27 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.93 0.00 29 D 7.76 4.36 0.00 2.77 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 30 I 8.47 4.14 1.89 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 1.30 1.03 0.92 0.00 0.00 31 L 8.83 3.79 0.00 1.85 1.81 0.92 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 32 T 7.35 3.62 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 0.97 0.00 0.00 33 D 8.44 5.08 0.00 2.64 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 34 V 7.50 4.65 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 0.71 0.00 0.00 1.09 0.00 0.00 35 V 9.71 4.90 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 1.03 0.00 0.00 0.94 0.00 0.00 36 I 9.07 4.86 1.94 0.00 0.00 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 1.27 1.00 0.67 0.00 0.00 37 V 9.03 5.37 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 0.99 0.00 0.00 0.95 0.00 0.00 38 V 8.45 4.25 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 0.97 0.00 0.00 0.49 0.00 0.00 *41 E 8.07 4.16 0.00 2.02 1.66 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 2.25 2.36 0.00 42 Q 8.14 4.83 0.00 1.77 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.73 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 43 F 8.82 4.75 0.00 3.39 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 44 R 8.79 5.01 0.00 1.67 1.81 0.00 3.21 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 45 A 8.69 4.55 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 46 H 9.13 5.16 0.00 3.16 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 9.97 3.50 0.00 1.53 1.27 0.00 1.33 0.00 0.00 0.89 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.35 1.22 7.81 48 T 7.74 3.85 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 1.18 0.00 0.00 49 V 7.63 3.40 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 0.24 0.00 0.00 0.67 0.00 0.00 50 L 7.59 3.94 0.00 1.88 1.30 0.47 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 51 M 8.35 4.40 0.00 2.30 2.42 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.19 3.04 0.00 52 A 7.99 4.09 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 53 C 7.91 4.51 0.00 3.01 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 54 S 7.79 4.70 0.00 4.04 4.10 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 55 G 8.48 3.69 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 0.00 0.00 0.00 56 L 7.65 3.77 0.00 1.43 1.13 0.46 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 57 F 7.86 4.08 0.00 3.40 3.20 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 0.00 58 Y 8.09 4.26 0.00 3.33 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 59 S 8.29 3.93 0.00 3.84 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 60 I 7.61 3.69 1.34 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 1.33 1.16 0.66 0.00 0.00 61 F 7.70 4.62 0.00 3.08 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 62 T 7.28 4.44 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 0.89 0.00 0.00 63 D 7.45 4.62 0.00 2.69 2.55 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 64 Q 8.63 4.24 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 65 L 8.04 4.09 0.00 1.77 1.77 0.92 0.86 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 66 K 7.24 4.16 0.00 1.83 1.71 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.42 7.81 67 C 8.37 4.40 0.00 3.03 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 68 N 8.51 4.81 0.00 2.73 2.78 0.00 0.00 6.72 7.85 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 69 L 8.26 4.84 0.00 1.66 1.56 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 70 S 8.61 4.68 0.00 3.91 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 71 V 7.72 4.91 2.12 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 0.97 0.00 0.00 0.95 0.00 0.00 72 I 9.23 4.65 2.07 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.23 0.99 0.00 0.00 73 N 8.74 5.12 0.00 2.62 2.77 0.00 0.00 7.10 7.85 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 74 L 8.70 4.27 0.00 1.60 1.60 0.76 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 75 D 8.63 4.48 0.00 2.63 2.46 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 0.00 *77 E 8.42 4.11 0.00 1.94 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 2.19 2.27 0.00 78 I 8.15 3.83 1.87 0.00 0.00 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 1.36 0.83 0.99 0.00 0.00 79 N 8.61 4.65 0.00 2.96 2.97 0.00 0.00 6.03 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 80 P 0.00 4.40 0.00 2.58 2.77 0.00 3.78 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.12 0.00 81 E 8.50 4.07 0.00 2.12 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 2.42 2.44 0.00 82 G 8.03 3.49 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 0.00 0.00 0.00 0.00 0.00 0.00 83 F 7.91 4.00 0.00 2.99 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 84 C 8.21 3.87 0.00 3.30 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 85 I 7.27 3.82 1.97 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 1.52 0.39 0.93 0.00 0.00 86 L 7.65 4.00 0.00 1.61 1.58 0.92 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 87 L 8.02 3.81 0.00 1.14 1.49 0.98 1.60 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 D 7.93 4.42 0.00 3.07 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 89 F 8.08 4.37 0.00 3.12 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 90 M 8.29 3.76 0.00 1.77 2.24 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.63 0.00 91 Y 7.65 4.28 0.00 2.84 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 92 T 7.70 4.42 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 93 S 7.43 3.26 0.00 3.95 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 94 R 7.52 4.53 0.00 1.89 1.86 0.00 3.10 0.00 0.00 3.11 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 95 L 8.44 4.70 0.00 1.55 1.52 0.56 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 96 N 8.55 4.53 0.00 2.71 2.71 0.00 0.00 7.01 7.78 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 97 L 8.19 4.71 0.00 0.94 1.16 0.38 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 98 R 8.77 4.75 0.00 1.82 1.79 0.00 3.18 0.00 0.00 3.11 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 99 E 8.68 3.82 0.00 1.98 2.01 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 2.33 2.40 0.00 100 G 8.06 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 0.00 0.00 0.00 101 N 8.29 4.88 0.00 2.98 3.20 0.00 0.00 6.60 7.49 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 0.00 102 I 7.66 3.69 2.05 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.26 1.03 0.00 0.00 103 M 8.07 4.17 0.00 2.08 2.11 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 2.70 2.57 0.00 104 A 7.95 3.97 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 0.00 105 V 8.10 3.47 2.16 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 0.90 0.00 0.00 0.97 0.00 0.00 106 M 8.48 3.89 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 107 A 8.12 3.99 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 108 T 8.52 3.98 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 1.44 0.00 0.00 109 A 8.72 4.05 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 0.00 110 M 8.20 3.99 0.00 2.13 2.27 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.55 0.00 111 Y 7.60 4.35 0.00 2.88 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 0.00 112 L 7.81 4.05 0.00 1.76 1.65 1.12 0.46 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 0.00 113 Q 7.81 3.74 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.77 0.00 0.00 0.00 0.00 0.00 2.23 2.16 0.00 114 M 7.89 4.47 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.70 0.00 115 E 8.45 4.32 0.00 1.89 1.95 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 2.30 2.29 0.00 116 H 7.92 4.24 0.00 3.17 3.29 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 V 7.62 3.32 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 0.87 0.00 0.00 0.15 0.00 0.00 118 V 7.20 3.52 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 1.06 0.00 0.00 0.99 0.00 0.00 119 D 7.90 4.39 0.00 2.88 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 0.00 120 T 7.75 3.90 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 1.16 0.00 0.00 121 C 8.21 4.12 0.00 3.11 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 0.00 122 R 8.21 3.93 0.00 2.04 2.03 0.00 3.13 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.91 0.00 123 K 8.00 4.19 0.00 1.82 1.88 0.00 1.78 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.46 7.81 124 F 7.93 4.23 0.00 3.30 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 0.00 125 I 8.06 4.16 2.01 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 1.59 1.02 0.93 0.00 0.00 126 K 8.28 3.99 0.00 1.74 1.88 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.67 7.81 127 A 6.72 4.05 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 0.00 128 S 8.45 4.36 0.00 4.09 4.07 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.