NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 F 4.9961 8.3249 122.8333 57.8327 40.5846 174.0293 16 N 3.9762 9.6003 121.9166 52.6510 39.0353 173.0682 17 A 4.7366 9.4028 125.0297 52.0105 21.2455 175.6833 18 H 4.8504 8.3032 114.9294 58.3351 34.7089 173.5554 19 L 5.3199 8.5936 118.6000 53.6917 45.2380 175.4894 20 V 4.8421 9.5466 125.2329 61.5780 35.5554 173.7431 21 A 4.0237 7.9786 125.9395 50.4364 22.8936 174.5533 22 G 3.4507 5.7003 103.6289 46.4794 0.0000 171.6874 23 L 5.0993 8.3510 120.5214 53.3434 44.8183 176.2431 24 T 4.3858 8.5268 122.8869 61.0973 70.1786 170.8917 25 P 3.3870 0.0000 0.0000 61.1560 31.5500 175.2545 26 I 4.0584 7.9761 127.4456 60.9089 38.3955 174.8909 27 E 5.0810 8.6807 126.3178 53.9319 32.4584 175.4831 28 A 4.1640 8.2744 126.2249 54.0412 18.5719 177.5105 29 N 4.3875 9.4836 119.5696 53.7915 36.9938 174.9691 30 G 3.9931 8.1900 109.7680 44.5932 0.0000 175.2095 31 V 3.8330 8.3051 117.7364 63.6157 31.4789 176.8089 32 L 4.5230 7.7152 118.4503 54.5346 42.1439 177.0173 33 D 4.6387 7.7119 119.5613 52.8530 39.0800 174.4081 34 F 4.8976 7.2331 114.1697 55.1623 40.1824 174.5404 35 F 4.3660 9.5097 122.9879 57.7400 39.5616 174.7591 36 I 4.4628 8.4127 123.9301 60.5512 39.7859 174.1790 37 D 5.1748 8.4348 126.9222 53.1455 44.2325 174.8630 38 R 4.5027 9.1028 122.9012 53.5930 30.8605 173.8727 39 P 4.2348 0.0000 0.0000 65.9666 31.3753 177.3979 40 L 4.4258 7.9879 116.5733 53.5521 42.2067 178.6779 41 G 3.9199 7.6198 107.4514 45.8564 0.0000 172.3688 42 M 4.8527 8.1031 121.7346 53.8796 36.3252 176.8701 43 K 3.9204 8.8575 121.0057 56.6544 32.0813 176.0996 44 G 3.7615 7.8381 104.3295 44.4899 0.0000 172.7904 45 Y 4.6534 7.9322 117.6447 56.8863 39.9043 175.2964 46 I 5.9292 8.1464 119.6513 60.7777 42.0825 173.8910 47 L 5.4300 9.3086 126.5504 53.1000 44.5645 174.6864 48 N 5.6955 9.5704 122.1801 51.7251 42.0978 172.5592 49 L 5.5811 8.9091 128.0313 52.5651 45.1617 175.0093 50 T 4.8294 8.5976 123.4333 63.2251 69.4288 174.5887 51 I 4.0705 9.0216 122.9741 62.8346 39.3177 176.8180 52 R 4.3827 7.9327 123.7082 55.1952 31.8680 178.0367 53 G 4.4264 8.8248 111.5612 45.3567 0.0000 172.1698 54 Q 4.8548 8.4877 118.5933 54.4009 33.9409 174.5770 55 G 2.8358 8.1901 107.0535 44.8242 0.0000 171.5446 56 V 4.8511 7.2903 117.6764 60.8221 34.8844 173.9810 57 V 5.1281 9.3215 119.0023 60.1981 34.1437 175.0787 58 K 5.2742 9.4971 121.2892 55.3429 36.4303 176.4592 59 N 4.1308 9.1016 118.8693 53.8007 41.2531 174.6198 60 Q 3.1510 9.4875 127.1685 56.7756 26.0659 174.6224 61 G 4.1194 7.9436 106.9299 45.6689 0.0000 172.9053 62 R 4.1874 7.4514 118.7716 55.9982 31.0676 176.0002 63 E 5.4380 8.7285 121.4055 54.8400 33.7488 175.0243 64 F 4.9241 9.1768 123.3920 56.9567 43.4105 173.0421 65 V 4.4339 7.4178 126.0455 61.4081 32.8782 174.3017 66 C 4.6916 8.4276 125.7828 57.3918 31.6239 174.5326 67 R 4.7132 9.1910 124.8431 54.0506 32.0920 170.3992 68 P 4.3230 0.0000 0.0000 66.1122 31.4364 177.1590 69 G 3.9153 9.5061 111.6875 45.0303 0.0000 172.3856 70 D 4.7003 7.8378 120.2554 52.7785 43.1407 175.4433 71 I 5.1746 8.2774 123.6935 59.7064 39.8961 174.4731 72 L 5.4492 9.2836 127.3797 52.9132 44.5672 175.0951 73 L 4.9785 8.7106 125.2344 53.4480 44.5811 175.1874 74 F 4.8880 9.2668 124.5913 54.6757 41.0883 172.9642 75 P 3.8433 0.0000 0.0000 61.1762 32.7532 174.2495 76 P 4.3249 0.0000 0.0000 64.2296 31.6094 177.1666 77 G 4.0178 8.9921 111.4303 45.4057 0.0000 173.7049 78 E 4.2235 7.7787 120.7712 56.1300 30.9538 176.2644 79 I 4.1992 8.5309 126.0647 61.9117 38.2598 175.2149 80 H 4.9957 9.0565 123.8695 54.7832 30.9439 173.0365 81 H 5.7806 9.1152 124.4928 54.7698 31.6720 171.2522 82 Y 5.4193 7.3140 121.9484 55.8518 42.0161 173.5688 83 G 3.0742 7.8517 105.9844 45.0083 0.0000 172.9366 84 R 4.1006 8.3933 120.0284 56.5296 30.5667 175.1739 85 H 4.4361 8.3772 124.0718 54.7547 30.2458 174.4458 86 P 3.7069 0.0000 0.0000 65.4495 30.8909 176.4860 87 E 4.5360 8.5754 115.5931 55.7479 29.8603 174.7872 88 A 4.6946 8.9248 127.2949 50.8149 20.9548 179.2859 89 R 3.9234 8.7770 125.6110 60.2268 30.7335 173.7532 90 E 5.2419 7.6888 112.5887 56.5697 35.1627 180.1429 91 W 5.6267 9.1838 129.5762 56.8419 32.3619 172.0206 92 Y 4.8800 9.4448 123.7986 56.8346 39.0896 174.1151 93 H 5.1983 8.2721 118.3881 54.2242 32.6206 172.1378 94 Q 5.1216 9.2557 120.2586 54.2079 31.2244 174.7021 95 W 6.3000 8.5960 119.4767 53.8307 32.5966 174.8244 96 V 4.8414 8.7334 119.6128 60.7954 34.0524 172.9596 97 Y 5.5865 10.0751 128.7215 56.2715 40.3083 174.3439 98 F 5.3491 8.5340 122.8831 56.4572 42.3788 174.1974 99 R 4.8328 8.6012 120.2282 54.0758 30.8343 174.1277 100 P 3.9470 0.0000 0.0000 61.7129 32.1685 176.2707 101 R 3.6777 5.8400 116.8199 54.6943 30.9227 177.5327 102 A 3.8518 8.4163 125.0270 55.7939 18.2693 179.1500 103 Y 4.2338 7.5907 109.3767 57.5446 38.4751 176.4838 104 W 3.7860 7.9020 122.6343 59.5368 29.7685 177.9936 105 H 4.1315 7.4958 116.2610 59.1037 28.2989 177.3021 106 E 3.9763 7.8863 116.9875 58.7426 29.3491 177.5941 107 W 5.0038 7.9256 116.9492 56.6986 29.1233 176.5136 108 L 4.7692 8.0490 117.1586 54.7171 42.0994 177.1644 109 N 4.8222 8.0853 119.6391 52.3009 37.4117 174.3395 110 W 4.7871 7.9558 120.0597 55.3626 31.2221 175.6261 111 P 4.5837 0.0000 0.0000 62.9573 31.8603 175.2179 112 S 5.5806 8.9534 119.7054 56.4622 64.2964 175.5014 113 I 3.2970 8.2500 116.9697 62.6881 37.7615 175.7190 114 F 4.5981 7.4071 114.7678 57.0831 41.5552 176.5932 115 A 3.6418 8.5994 125.8157 53.8567 17.6560 177.8870 116 N 4.9520 9.4152 113.2384 56.0468 39.2009 174.7258 117 T 4.2072 7.8126 116.0389 61.2641 69.3598 175.2194 118 G 4.1773 8.1937 114.5033 46.5086 0.0000 170.4050 119 F 5.6500 9.0378 123.5847 56.4943 43.1445 173.8359 120 F 4.4266 8.3307 127.1947 56.7172 42.7055 172.8509 121 R 4.1337 7.5505 126.7102 53.2578 31.2408 173.2324 122 P 3.6376 0.0000 0.0000 62.0729 32.1017 176.4964 123 D 4.4461 8.4389 123.3147 53.5287 40.0247 177.5113 124 E 3.8771 8.8148 115.7596 59.1562 29.5466 179.1533 125 A 4.3008 8.3919 120.4314 54.2151 19.1318 178.2667 126 H 4.9361 8.5263 114.6913 57.0862 29.6447 177.5389 127 Q 4.0969 8.2262 122.9412 59.9890 27.8250 182.5101 128 P 4.5311 0.0000 0.0000 66.3631 31.4429 178.8293 *129 H 4.0628 8.1720 116.8849 59.8926 27.8180 179.0582 130 F 4.3722 8.0558 120.3107 60.7517 38.8772 178.1821 131 S 4.2048 8.4095 114.4362 61.3511 62.4470 176.4216 132 D 4.3101 7.9733 120.5040 57.0285 41.0610 177.8447 133 L 3.8989 8.3300 121.2852 58.3132 42.0843 178.6017 134 F 4.0315 8.7697 120.9239 61.4418 39.1437 177.3280 135 G 3.7533 8.2703 105.1981 47.8917 0.0000 175.7280 136 Q 4.0519 8.3123 120.4348 58.6848 28.6536 178.5893 137 I 3.6219 7.7959 121.0748 64.3475 36.8397 178.4990 138 I 3.5800 7.3928 119.6572 64.3649 37.1488 178.0030 139 N 4.4444 7.9687 117.2085 56.1125 38.3795 177.3703 140 A 4.0737 8.3626 122.6872 55.2356 18.3326 179.9807 141 G 3.6991 8.2867 103.0294 47.1212 0.0000 174.7458 142 Q 4.6242 7.4250 117.2160 54.6263 29.6230 176.0952 143 G 3.7795 7.3845 112.0984 46.1745 0.0000 174.3907 144 E 4.3224 8.5208 115.1653 56.0781 30.9382 178.1853 145 G 4.0447 7.9769 105.4465 45.5517 0.0000 174.4296 146 R 3.7241 8.6360 122.0676 58.7427 30.3750 176.8238 147 Y 4.5766 7.7555 113.1291 57.8785 38.7873 177.2871 148 S 4.1363 8.2671 118.9664 61.8320 62.8271 176.2795 149 E 4.0996 8.1574 121.3341 59.3508 29.4916 178.6540 150 L 4.0556 7.9743 118.5280 57.6066 41.6992 179.4223 151 L 4.0210 8.0074 118.9972 57.6602 41.6288 179.1906 152 A 3.9815 8.0605 120.7347 55.2027 18.2581 179.6946 153 I 3.7898 8.0391 118.3937 64.5811 37.2454 178.1100 154 N 4.4082 8.3554 117.7582 56.9003 38.7480 176.9100 155 L 3.9545 8.5228 120.6437 57.4960 41.6409 179.2128 156 L 3.6840 8.3321 120.7690 58.0629 41.9097 178.6241 157 E 3.0151 8.0438 119.2465 58.9796 29.4951 178.5882 158 Q 3.7382 7.9164 119.5677 58.8339 29.0525 177.8261 159 L 3.8907 7.9334 121.5254 58.1974 42.1366 178.7140 160 L 3.9648 7.7193 118.6543 58.0504 41.4805 179.3892 161 L 3.3271 7.6614 118.7349 57.8876 41.4077 180.0354 162 R 3.7708 8.3631 118.0390 59.0668 29.8635 178.9925 163 R 3.6775 8.0883 118.6009 59.6135 29.7114 178.2927 164 M 3.8996 7.5909 119.6608 59.2038 32.2235 178.9547 165 E 4.1272 7.8949 117.7290 60.4838 29.7409 180.6171 166 A 4.3983 8.2052 122.4350 55.8631 18.5649 179.6186 167 I 3.9336 7.7613 115.9379 62.1288 35.6096 178.5512 168 N 4.8840 8.0926 122.7151 54.8608 38.9731 174.0484 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 F 8.32 5.00 0.00 2.99 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 16 N 9.60 3.98 0.00 2.73 3.00 0.00 0.00 6.67 6.46 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 17 A 9.40 4.74 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 18 H 8.30 4.85 0.00 3.25 3.25 0.00 5.60 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.59 5.32 0.00 1.72 1.57 0.92 0.84 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 20 V 9.55 4.84 2.49 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 1.10 0.00 0.00 0.93 0.00 0.00 21 A 7.98 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 5.70 3.45 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 0.00 0.00 0.00 0.00 23 L 8.35 5.10 0.00 1.47 1.44 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 24 T 8.53 4.39 3.71 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 1.00 0.00 0.00 25 P 0.00 3.39 0.00 0.90 1.02 0.00 3.55 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 1.65 1.71 0.00 26 I 7.98 4.06 2.13 0.00 0.00 0.68 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 0.94 0.96 0.00 0.00 27 E 8.68 5.08 0.00 1.92 1.91 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 2.38 2.31 0.00 28 A 8.27 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 29 N 9.48 4.39 0.00 2.96 3.04 0.00 0.00 7.05 7.17 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 30 G 8.19 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 0.00 0.00 0.00 31 V 8.31 3.83 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 0.80 0.00 0.00 1.00 0.00 0.00 32 L 7.72 4.52 0.00 1.56 1.53 0.83 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 33 D 7.71 4.64 0.00 2.96 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 F 7.23 4.90 0.00 3.15 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 35 F 9.51 4.37 0.00 2.90 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 36 I 8.41 4.46 1.81 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.12 0.51 0.00 0.00 37 D 8.43 5.17 0.00 2.85 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 38 R 9.10 4.50 0.00 1.81 1.94 0.00 2.70 0.00 0.00 2.98 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.50 0.00 39 P 0.00 4.23 0.00 2.19 2.22 0.00 3.74 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 1.97 1.98 0.00 40 L 7.99 4.43 0.00 1.63 1.70 0.90 0.92 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 41 G 7.62 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 42 M 8.10 4.85 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 43 K 8.86 3.92 0.00 1.78 1.72 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.00 7.81 44 G 7.84 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 45 Y 7.93 4.65 0.00 1.43 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 0.00 0.00 0.00 0.00 46 I 8.15 5.93 2.12 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 1.83 0.73 1.07 0.00 0.00 47 L 9.31 5.43 0.00 1.93 2.07 1.02 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 48 N 9.57 5.70 0.00 2.80 2.84 0.00 0.00 6.30 7.17 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 49 L 8.91 5.58 0.00 0.44 0.23 0.79 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 50 T 8.60 4.83 4.62 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 1.62 0.00 0.00 51 I 9.02 4.07 1.88 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 1.22 0.68 0.88 0.00 0.00 52 R 7.93 4.38 0.00 1.49 1.81 0.00 3.32 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.16 0.00 53 G 8.82 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 0.00 0.00 0.00 54 Q 8.49 4.85 0.00 1.88 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.57 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 55 G 8.19 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 0.00 0.00 0.00 56 V 7.29 4.85 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 0.77 0.00 0.00 1.03 0.00 0.00 57 V 9.32 5.13 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 1.30 0.00 0.00 1.41 0.00 0.00 58 K 9.50 5.27 0.00 1.85 1.74 0.00 1.71 0.00 0.00 1.63 0.00 0.00 3.08 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.56 1.56 7.81 59 N 9.10 4.13 0.00 2.41 1.48 0.00 0.00 7.32 6.87 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 60 Q 9.49 3.15 0.00 2.14 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.39 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 61 G 7.94 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 0.00 0.00 0.00 62 R 7.45 4.19 0.00 1.45 1.63 0.00 3.02 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.50 0.00 63 E 8.73 5.44 0.00 1.85 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 2.23 2.27 0.00 64 F 9.18 4.92 0.00 3.24 2.99 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 65 V 7.42 4.43 1.75 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 0.76 0.00 0.00 0.84 0.00 0.00 66 C 8.43 4.69 0.00 3.27 3.29 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 67 R 9.19 4.71 0.00 1.48 1.86 0.00 3.29 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.47 0.00 68 P 0.00 4.32 0.00 2.04 2.22 0.00 3.63 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.27 0.00 69 G 9.51 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 70 D 7.84 4.70 0.00 2.80 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 71 I 8.28 5.17 2.16 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.90 1.51 0.00 0.00 72 L 9.28 5.45 0.00 1.99 1.78 1.28 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.71 4.98 0.00 0.51 1.03 0.96 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 74 F 9.27 4.89 0.00 3.09 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 75 P 0.00 3.84 0.00 1.99 1.85 0.00 3.62 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 2.25 2.17 0.00 76 P 0.00 4.32 0.00 1.80 1.99 0.00 2.95 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.31 0.00 77 G 8.99 4.02 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 0.00 0.00 0.00 78 E 7.78 4.22 0.00 2.23 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 0.00 2.36 2.55 0.00 79 I 8.53 4.20 2.01 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 1.38 0.66 1.04 0.00 0.00 80 H 9.06 5.00 0.00 2.98 2.95 0.00 5.62 0.00 0.00 0.00 0.00 6.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 H 9.12 5.78 0.00 3.26 3.53 0.00 5.90 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 Y 7.31 5.42 0.00 2.99 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 83 G 7.85 3.07 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 0.00 0.00 0.00 84 R 8.39 4.10 0.00 1.93 1.88 0.00 3.67 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 85 H 8.38 4.44 0.00 3.02 3.07 0.00 5.68 0.00 0.00 0.00 0.00 6.81 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 3.71 0.00 2.24 2.26 0.00 3.57 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 1.87 1.97 0.00 87 E 8.58 4.54 0.00 1.97 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 2.26 2.36 0.00 88 A 8.92 4.69 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 89 R 8.78 3.92 0.00 1.52 1.96 0.00 3.29 0.00 0.00 3.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.21 0.00 90 E 7.69 5.24 0.00 1.58 1.76 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 2.07 2.05 0.00 91 W 9.18 5.63 0.00 3.49 3.15 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 92 Y 9.44 4.88 0.00 2.92 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 93 H 8.27 5.20 0.00 3.09 2.64 0.00 5.24 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Q 9.26 5.12 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.70 0.00 0.00 0.00 0.00 0.00 2.30 2.27 0.00 95 W 8.60 6.30 0.00 3.61 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 96 V 8.73 4.84 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 0.82 0.00 0.00 1.03 0.00 0.00 97 Y 10.08 5.59 0.00 3.31 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 98 F 8.53 5.35 0.00 3.27 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 99 R 8.60 4.83 0.00 1.59 1.76 0.00 3.28 0.00 0.00 3.27 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.40 0.00 100 P 0.00 3.95 0.00 2.08 2.37 0.00 3.77 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.48 0.00 101 R 5.84 3.68 0.00 0.67 0.99 0.00 2.94 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.50 0.00 102 A 8.42 3.85 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 0.00 103 Y 7.59 4.23 0.00 2.95 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 0.00 104 W 7.90 3.79 0.00 3.12 3.05 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 0.00 105 H 7.50 4.13 0.00 3.21 3.37 0.00 5.62 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 E 7.89 3.98 0.00 1.58 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 2.26 2.11 0.00 107 W 7.93 5.00 0.00 3.47 3.05 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 0.00 108 L 8.05 4.77 0.00 1.84 1.68 0.65 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 109 N 8.09 4.82 0.00 2.82 2.88 0.00 0.00 7.14 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 0.00 110 W 7.96 4.79 0.00 3.16 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 0.00 111 P 0.00 4.58 0.00 2.18 2.25 0.00 3.78 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.02 0.00 112 S 8.95 5.58 0.00 4.08 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 0.00 113 I 8.25 3.30 0.97 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 -0.36 -0.62 0.00 0.00 114 F 7.41 4.60 0.00 3.05 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 0.00 115 A 8.60 3.64 1.29 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 0.00 116 N 9.42 4.95 0.00 2.67 2.89 0.00 0.00 7.08 7.27 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 0.00 117 T 7.81 4.21 3.94 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 0.64 0.00 0.00 118 G 8.19 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 0.00 0.00 0.00 0.00 119 F 9.04 5.65 0.00 2.84 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 0.00 120 F 8.33 4.43 0.00 2.21 2.35 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 0.00 121 R 7.55 4.13 0.00 1.67 1.69 0.00 3.41 0.00 0.00 3.26 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.57 0.00 122 P 0.00 3.64 0.00 1.89 1.88 0.00 3.40 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.77 0.00 123 D 8.44 4.45 0.00 2.82 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 0.00 124 E 8.81 3.88 0.00 2.01 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 2.24 1.91 0.00 125 A 8.39 4.30 1.33 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 0.00 0.00 126 H 8.53 4.94 0.00 3.33 3.67 0.00 5.67 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 8.23 4.10 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.88 0.00 0.00 0.00 0.00 0.00 2.38 2.05 0.00 128 P 0.00 4.53 0.00 2.16 2.14 0.00 3.69 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 *129 H 8.17 4.06 0.00 2.91 3.08 0.00 7.20 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 F 8.06 4.37 0.00 3.17 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 0.00 131 S 8.41 4.20 0.00 3.97 3.94 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 0.00 132 D 7.97 4.31 0.00 2.91 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 0.00 133 L 8.33 3.90 0.00 1.84 1.71 0.82 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 134 F 8.77 4.03 0.00 3.42 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 0.00 135 G 8.27 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 0.00 0.00 0.00 136 Q 8.31 4.05 0.00 2.27 2.14 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.86 0.00 145 G 7.98 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 0.00 0.00 0.00 146 R 8.64 3.72 0.00 1.65 1.77 0.00 2.21 0.00 0.00 2.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.41 0.00 147 Y 7.76 4.58 0.00 3.09 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 0.00 148 S 8.27 4.14 0.00 3.94 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 0.00 149 E 8.16 4.10 0.00 2.10 1.99 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 2.43 2.48 0.00 150 L 7.97 4.06 0.00 2.04 1.82 1.12 0.70 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 0.00 151 L 8.01 4.02 0.00 2.02 1.73 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 152 A 8.06 3.98 1.47 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 0.00 153 I 8.04 3.79 2.12 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 1.48 0.84 1.06 0.00 0.00 154 N 8.36 4.41 0.00 2.98 3.05 0.00 0.00 7.29 6.27 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 0.00 155 L 8.52 3.95 0.00 1.76 1.63 0.89 0.44 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 0.00 156 L 8.33 3.68 0.00 1.55 1.82 0.53 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 157 E 8.04 3.02 0.00 1.98 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 0.00 2.21 2.19 0.00 158 Q 7.92 3.74 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.56 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 159 L 7.93 3.89 0.00 1.83 1.78 1.21 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 160 L 7.72 3.96 0.00 1.63 1.71 0.50 0.74 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 0.00 161 L 7.66 3.33 0.00 1.54 1.34 0.65 -0.25 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 0.00 162 R 8.36 3.77 0.00 1.81 1.66 0.00 3.05 0.00 0.00 2.91 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.48 0.00 163 R 8.09 3.68 0.00 1.22 1.72 0.00 2.21 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 0.72 0.50 0.00 164 M 7.59 3.90 0.00 1.88 1.98 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.65 0.00 165 E 7.89 4.13 0.00 1.92 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 2.24 2.19 0.00 166 A 8.21 4.40 1.65 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 0.00 167 I 7.76 3.93 1.87 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 0.73 0.91 0.00 0.00 168 N 8.09 4.88 0.00 2.88 2.87 0.00 0.00 6.76 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 * Residues marked with a * may have inaccurate shift predictions.