NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3911 8.2601 123.5849 52.1185 21.0892 177.6693 2 A 4.2202 9.3099 125.7213 49.7563 17.4908 180.1319 3 S 4.6988 8.9803 110.6370 56.9077 67.0183 173.6469 4 C 4.3657 8.4695 121.5003 56.7571 39.6823 173.9092 5 T 4.2987 8.5274 117.8424 60.8425 70.7764 175.4297 6 T 3.7953 8.3760 118.3859 67.0763 68.4857 176.1964 7 E 3.9513 8.2418 119.6057 59.7282 29.4033 179.0244 8 D 4.3404 8.1276 118.5354 57.6026 40.8692 179.0647 9 R 3.8156 8.2982 118.7120 59.2730 30.0890 178.8726 10 R 3.8991 8.0553 118.2598 59.5845 29.9958 178.1974 11 E 3.9324 8.1507 118.0347 59.6753 29.5700 178.6562 12 M 4.1052 8.7746 118.8540 59.2927 32.1412 178.1526 13 Q 4.1137 8.8389 118.2215 59.0883 28.7791 179.3242 14 L 4.0544 7.9999 119.6600 58.2236 40.9798 179.0128 15 M 4.1197 8.3581 118.7213 58.5890 32.1025 178.8888 16 W 4.4879 8.6984 128.0762 60.7290 30.9016 178.2720 17 G 3.8971 8.4143 104.4749 48.2071 0.0000 174.8642 18 N 4.5847 8.4004 117.8930 55.8299 38.7277 177.1539 19 V 3.9095 7.0672 111.9006 60.8156 32.4448 176.4911 20 W 3.8203 7.3350 129.1944 57.0053 31.0302 175.1490 21 S 4.3676 7.1430 119.2701 56.2242 62.5278 173.6313 22 A 4.3374 8.5610 131.3945 54.1259 18.5612 177.6618 23 Q 4.2833 7.9383 112.6721 55.9841 30.4449 175.4131 24 F 4.8190 7.4118 114.2669 55.0207 43.0183 175.4003 25 T 4.2072 8.5379 111.9172 63.4474 69.0359 176.1866 26 G 3.6447 8.3903 106.3164 49.3677 0.0000 175.1156 27 R 3.8535 7.8537 117.7362 58.6640 30.6006 178.8343 28 R 3.7598 7.8074 116.9335 59.6742 29.9796 178.7096 29 I 3.6765 7.9953 118.7992 64.3946 37.2031 178.2749 30 A 3.9576 8.0254 121.4002 55.3314 18.2225 179.8672 31 I 3.5174 8.2335 118.1970 64.3070 37.1610 178.2526 32 A 3.8445 8.3721 121.9848 55.4205 18.1046 179.6642 33 Q 4.0354 8.3963 116.2959 59.2205 28.9405 178.7387 34 A 3.8072 7.7759 121.6199 55.4414 18.2248 179.7576 35 V 3.0956 7.4941 116.3118 65.9627 31.5705 178.1063 36 F 3.7581 7.7684 117.4233 60.3022 38.6265 177.5206 37 K 3.8484 8.6735 119.6730 59.7681 31.4220 178.3161 38 D 4.2797 7.8232 117.6441 56.9252 41.0838 177.8920 39 L 3.9514 8.0296 121.3458 58.3775 42.0006 179.0386 40 F 4.6373 8.3149 116.2232 60.4849 38.8180 177.2830 41 A 4.2397 7.6360 120.1138 54.7898 18.4632 178.6561 42 N 4.8786 7.9451 111.8297 53.3425 39.9746 176.0352 43 V 4.3213 7.8837 120.4043 59.5464 32.0749 173.2689 44 P 4.0945 0.0000 0.0000 66.4832 31.2640 178.0231 45 D 4.4812 8.0222 115.7450 53.5102 39.9102 178.1217 46 A 4.1318 8.2818 123.7318 55.7175 18.5717 179.7988 47 V 2.8757 7.1789 115.8197 66.0467 31.0759 178.2006 48 G 3.6983 7.4420 102.5491 46.9214 0.0000 174.9788 49 L 4.0894 8.1877 120.7192 56.3071 42.0072 177.6065 50 F 4.8194 7.9301 117.4812 57.2086 40.3589 178.5773 51 G 3.5551 8.0566 107.2137 48.0302 0.0000 175.4593 52 A 4.1673 8.0725 121.5385 53.7720 18.4096 178.0285 53 V 4.3728 7.4960 109.9866 62.0430 33.2391 175.7724 54 K 3.7404 8.1132 115.1085 57.6228 29.8305 176.6355 55 G 3.0709 8.1275 104.8467 46.9310 0.0000 173.7133 56 D 4.2818 7.5449 120.2598 56.6731 41.4280 177.4866 57 E 4.3704 7.5166 120.8396 54.2988 27.9971 176.8630 58 V 3.6006 7.8351 115.3287 63.6218 32.1039 176.6721 59 N 4.8438 8.0288 116.1983 53.2221 39.1648 175.2882 60 S 4.4505 8.5706 113.5570 58.4148 65.1697 174.7370 61 N 4.3315 8.7457 121.3491 56.6505 38.2964 177.1757 62 E 4.0105 8.3615 119.4562 59.8064 29.5606 179.3192 63 F 4.3832 8.2694 119.8627 60.9745 39.4454 177.2315 64 K 3.8035 8.5086 118.3511 59.6798 31.9287 178.7646 65 A 4.0382 8.3479 121.1157 55.6339 18.1092 179.1809 66 H 4.0643 7.9156 116.0739 59.6165 29.9991 176.9079 67 C 3.9257 8.1789 118.7775 63.1405 27.9768 176.0661 68 I 3.7215 8.0359 121.3399 64.9246 36.7462 178.6120 69 R 3.9946 8.0997 118.4571 59.1458 29.7459 179.3628 70 V 3.6464 8.1564 118.4820 66.0836 31.6619 177.9993 71 V 3.9523 8.4087 118.4199 66.3188 31.2453 177.4261 72 N 4.7029 8.7523 116.7518 56.7798 38.8671 176.7872 73 G 3.7504 8.2562 107.1342 48.0284 0.0000 175.2697 74 L 3.7090 8.2120 123.3924 57.4709 41.9073 178.4673 75 D 4.0178 8.2113 118.0462 57.2970 41.1491 178.0957 76 S 4.0515 8.1240 116.1907 61.7481 62.6691 177.0836 77 S 3.8897 7.5072 114.8023 61.4995 63.0967 175.8680 78 I 3.6217 7.5823 124.7552 63.9239 36.3309 178.7049 79 G 3.5632 8.0951 106.2609 47.4098 0.0000 174.7434 80 L 4.1791 7.6749 120.7999 56.1525 41.9417 178.4265 81 L 3.9288 7.4257 118.0301 58.3372 41.5823 178.7416 82 S 4.4037 7.4895 112.4950 59.4050 64.3585 174.0893 83 D 4.7174 8.1037 121.4764 50.3014 41.3447 173.1853 84 P 4.1275 0.0000 0.0000 65.4590 31.4648 177.3140 85 A 3.9390 8.0741 118.7162 55.9772 18.1654 179.7229 86 T 3.7394 7.7295 112.3369 66.0629 68.4738 176.9865 87 L 3.8524 7.9876 122.7350 58.2457 42.0937 178.4895 88 N 4.2167 8.4936 116.6418 56.5958 38.5501 177.0780 89 E 3.9190 7.6243 119.0621 59.4431 29.6210 179.1118 90 Q 3.9348 8.0710 119.4139 59.3969 29.1077 178.5185 91 L 3.9436 8.5901 120.3961 57.7326 41.5700 179.4151 92 S 4.0539 8.1644 113.2024 61.4532 62.2670 175.7612 93 H 4.0874 8.1942 120.8464 59.3557 29.7884 177.0675 94 L 4.0239 8.0552 120.5360 57.7855 41.3550 179.2678 95 A 4.7165 8.3637 122.1175 55.1579 18.1895 179.7181 96 T 3.7906 7.9694 113.9384 67.0699 68.3344 176.8868 97 Q 4.0554 8.1144 118.4202 58.7109 28.9404 177.7782 98 H 4.6635 8.0634 116.1383 57.3675 29.1811 177.5592 99 K 4.0711 8.1742 119.8231 59.0676 31.9323 178.4671 100 A 4.3853 7.7227 119.0568 52.2178 18.5042 177.1164 101 R 4.4243 7.4803 117.7950 53.8903 31.4200 175.8036 102 S 4.2035 8.4845 120.4068 58.9819 63.2949 173.9736 103 G 3.8720 8.9651 113.7864 45.8870 0.0000 173.9530 104 V 3.8656 7.4694 120.0779 62.7724 30.9914 175.1404 105 T 4.7353 8.2275 117.6039 59.4593 71.3750 175.4249 106 K 4.0127 8.8774 123.6498 59.8943 32.0072 179.2175 107 G 3.9181 8.5834 105.7776 46.9847 0.0000 176.0428 108 G 3.7534 8.4919 108.8754 47.8215 0.0000 175.8881 109 F 4.0013 8.6334 119.9627 60.5274 38.8840 177.2774 110 S 4.2166 8.0830 110.9321 61.7122 62.2815 176.1371 111 A 4.1934 7.9056 123.2324 55.1485 18.3852 179.1812 112 I 3.6217 8.1274 116.7792 64.2673 37.8829 177.8588 113 A 3.7527 8.5935 121.9194 55.2455 18.0596 179.4890 114 Q 3.9868 7.8867 115.0534 59.3300 29.0751 178.9275 115 S 4.3153 8.0358 116.7490 61.0350 62.8026 176.3345 116 F 3.6544 8.3437 120.2299 60.9575 38.5719 178.0467 117 L 3.8919 7.7867 116.5651 57.7157 41.3993 179.3834 118 R 4.0807 8.1679 117.4770 58.2322 30.4404 178.7602 119 V 3.5924 7.2602 117.5810 65.8785 31.7392 177.4561 120 M 3.4502 7.6222 118.9931 57.9707 31.4738 177.0803 121 P 3.5032 0.0000 0.0000 66.0211 31.0424 177.8558 122 Q 4.0485 8.0246 117.7902 57.8806 28.7151 177.1322 123 V 3.9639 7.3107 117.1844 62.7164 32.9777 176.4915 124 A 4.3186 8.1383 122.8437 51.7033 20.0039 178.8879 125 S 4.8634 8.0777 121.9735 58.3462 61.6978 178.9166 126 C 4.4997 8.7988 125.8092 60.4622 25.4212 171.7493 127 F 4.5062 8.3225 125.2421 57.7044 40.1272 174.9298 128 N 4.5839 7.5378 125.9942 50.2390 39.0196 172.5989 129 P 3.9338 0.0000 0.0000 65.9192 31.1470 177.5279 130 D 4.3210 8.1512 118.1913 56.8384 40.7778 178.4059 131 A 3.9545 8.2579 120.6592 55.0899 18.5029 179.1267 132 W 4.1240 8.0586 126.6415 60.9136 30.7143 177.6799 133 S 4.2136 8.9230 112.9665 61.6906 61.6868 175.9835 134 R 3.8753 8.1759 120.5658 60.0648 29.9645 178.3961 135 C 4.2105 8.1132 115.6119 59.4807 39.3619 176.0201 136 F 3.3477 8.2065 122.8761 61.2178 38.9645 177.0226 137 N 4.3894 8.7751 116.3150 56.0583 37.6905 177.4518 138 R 3.8069 7.4957 120.5698 59.4156 30.1576 178.6765 139 I 3.5338 7.3564 119.5797 64.4553 36.8874 178.2762 140 T 3.6266 7.8541 116.8913 66.9712 68.0928 176.5648 141 T 3.8674 8.0716 117.3163 66.7331 68.6210 176.2968 142 G 3.5932 7.2916 104.8580 48.1745 0.0000 175.3629 143 M 4.2177 7.8377 121.6359 56.7623 32.9522 176.3112 144 T 4.3758 7.2859 113.8072 60.6022 64.7117 173.4071 145 E 4.0708 7.8002 124.5792 57.8209 30.5749 176.4885 146 P 4.5918 0.0000 0.0000 62.6440 32.4763 175.8409 147 L 4.1078 7.8169 118.8489 54.5154 43.6860 174.3030 148 P 4.2241 0.0000 0.0000 64.1077 30.3950 176.3253 149 A 4.1386 9.1516 133.0357 53.8107 19.0073 177.4774 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 1 A 8.26 4.39 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 2 A 9.31 4.22 1.07 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 3 S 8.98 4.70 0.00 3.91 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 4 C 8.47 4.37 0.00 3.01 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 5 T 8.53 4.30 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 1.30 0.00 0.00 6 T 8.38 3.80 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 1.19 0.00 0.00 7 E 8.24 3.95 0.00 2.04 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 2.40 2.48 0.00 8 D 8.13 4.34 0.00 2.93 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 9 R 8.30 3.82 0.00 1.99 1.94 0.00 3.29 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 10 R 8.06 3.90 0.00 1.92 2.16 0.00 3.16 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 11 E 8.15 3.93 0.00 2.27 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 2.35 2.47 0.00 12 M 8.77 4.11 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 13 Q 8.84 4.11 0.00 2.42 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.61 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 14 L 8.00 4.05 0.00 1.97 1.80 1.01 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 15 M 8.36 4.12 0.00 2.52 2.73 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.81 0.00 16 W 8.70 4.49 0.00 3.70 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 17 G 8.41 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 18 N 8.40 4.58 0.00 2.77 2.93 0.00 0.00 7.01 7.94 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 19 V 7.07 3.91 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 0.72 0.00 0.00 0.79 0.00 0.00 20 W 7.33 3.82 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 21 S 7.14 4.37 0.00 3.61 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 22 A 8.56 4.34 1.48 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 0.00 0.00 0.00 23 Q 7.94 4.28 0.00 2.14 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 24 F 7.41 4.82 0.00 2.97 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 25 T 8.54 4.21 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 26 G 8.39 3.64 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 0.00 0.00 0.00 27 R 7.85 3.85 0.00 1.68 1.85 0.00 3.13 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 28 R 7.81 3.76 0.00 1.87 1.91 0.00 2.91 0.00 0.00 2.95 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.36 0.00 29 I 8.00 3.68 1.98 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 1.44 0.80 0.92 0.00 0.00 30 A 8.03 3.96 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.23 3.52 1.99 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 1.37 0.97 0.93 0.00 0.00 32 A 8.37 3.84 1.40 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 0.00 0.00 33 Q 8.40 4.04 0.00 2.32 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 34 A 7.78 3.81 1.28 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 0.00 0.00 0.00 35 V 7.49 3.10 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 -0.04 0.00 0.00 36 F 7.77 3.76 0.00 2.95 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 0.00 0.00 0.00 0.00 37 K 8.67 3.85 0.00 1.89 1.92 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.49 7.81 38 D 7.82 4.28 0.00 2.74 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 39 L 8.03 3.95 0.00 1.65 1.61 1.03 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 40 F 8.31 4.64 0.00 3.13 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 41 A 7.64 4.24 1.39 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 42 N 7.95 4.88 0.00 2.75 2.91 0.00 0.00 6.74 7.55 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 43 V 7.88 4.32 2.33 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 1.13 0.00 0.00 1.02 0.00 0.00 44 P 0.00 4.09 0.00 2.26 2.27 0.00 3.80 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.02 0.00 45 D 8.02 4.48 0.00 2.93 2.95 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 46 A 8.28 4.13 1.69 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 47 V 7.18 2.88 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 0.35 0.00 0.00 0.41 0.00 0.00 48 G 7.44 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 49 L 8.19 4.09 0.00 1.10 1.20 0.96 0.72 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 50 F 7.93 4.82 0.00 3.07 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 51 G 8.06 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.07 4.17 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 V 7.50 4.37 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 0.87 0.00 0.00 1.22 0.00 0.00 54 K 8.11 3.74 0.00 1.97 1.76 0.00 1.83 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.38 1.39 7.81 55 G 8.13 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 56 D 7.54 4.28 0.00 2.55 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 57 E 7.52 4.37 0.00 2.01 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 2.32 2.27 0.00 58 V 7.84 3.60 2.29 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 0.59 0.00 0.00 0.98 0.00 0.00 59 N 8.03 4.84 0.00 2.69 2.83 0.00 0.00 7.03 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 60 S 8.57 4.45 0.00 4.10 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 61 N 8.75 4.33 0.00 2.82 2.95 0.00 0.00 6.95 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 62 E 8.36 4.01 0.00 2.14 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 2.45 2.50 0.00 63 F 8.27 4.38 0.00 3.40 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 64 K 8.51 3.80 0.00 2.02 1.87 0.00 1.78 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.50 1.69 7.81 65 A 8.35 4.04 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 66 H 7.92 4.06 0.00 3.34 3.16 0.00 5.81 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 67 C 8.18 3.93 0.00 3.05 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 68 I 8.04 3.72 2.10 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.85 0.95 0.00 0.00 69 R 8.10 3.99 0.00 2.07 2.04 0.00 3.19 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.90 0.00 70 V 8.16 3.65 2.34 0.00 0.00 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 1.02 0.00 0.00 71 V 8.41 3.95 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 1.56 0.00 0.00 1.24 0.00 0.00 72 N 8.75 4.70 0.00 3.16 3.17 0.00 0.00 7.11 7.47 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 73 G 8.26 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 74 L 8.21 3.71 0.00 1.63 1.73 0.27 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 75 D 8.21 4.02 0.00 3.01 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 76 S 8.12 4.05 0.00 4.08 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 77 S 7.51 3.89 0.00 3.80 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 78 I 7.58 3.62 1.54 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.15 0.72 0.00 0.00 79 G 8.10 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.67 4.18 0.00 2.00 1.56 0.86 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.43 3.93 0.00 1.68 1.63 0.73 0.75 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 82 S 7.49 4.40 0.00 3.84 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 83 D 8.10 4.72 0.00 2.58 2.43 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 84 P 0.00 4.13 0.00 2.15 2.07 0.00 3.64 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 2.08 2.28 0.00 85 A 8.07 3.94 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 86 T 7.73 3.74 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 1.17 0.00 0.00 87 L 7.99 3.85 0.00 1.88 1.70 0.84 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 88 N 8.49 4.22 0.00 2.91 2.83 0.00 0.00 7.10 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 89 E 7.62 3.92 0.00 2.14 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 2.30 2.44 0.00 90 Q 8.07 3.93 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 91 L 8.59 3.94 0.00 1.61 1.60 0.78 0.74 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 92 S 8.16 4.05 0.00 3.94 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 93 H 8.19 4.09 0.00 3.29 3.47 0.00 5.85 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 94 L 8.06 4.02 0.00 1.91 1.73 0.88 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.36 4.72 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 96 T 7.97 3.79 4.34 0.00 0.00 0.00 0.00 0.00 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 97 Q 8.11 4.06 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.86 0.00 0.00 0.00 0.00 0.00 2.34 2.59 0.00 98 H 8.06 4.66 0.00 3.46 3.51 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.17 4.07 0.00 1.72 1.88 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.70 7.81 100 A 7.72 4.39 1.28 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 0.00 0.00 0.00 101 R 7.48 4.42 0.00 1.83 1.79 0.00 3.23 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 102 S 8.48 4.20 0.00 3.84 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 0.00 103 G 8.97 3.87 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 0.00 104 V 7.47 3.87 2.29 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 1.18 0.00 0.00 0.95 0.00 0.00 105 T 8.23 4.74 4.33 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 1.32 0.00 0.00 106 K 8.88 4.01 0.00 1.85 1.90 0.00 1.72 0.00 0.00 1.81 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.50 7.81 107 G 8.58 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 0.00 108 G 8.49 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 0.00 109 F 8.63 4.00 0.00 3.42 3.28 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 0.00 110 S 8.08 4.22 0.00 4.01 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 0.00 111 A 7.91 4.19 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 0.00 112 I 8.13 3.62 1.91 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 1.63 1.49 1.10 0.00 0.00 113 A 8.59 3.75 1.57 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 0.00 0.00 114 Q 7.89 3.99 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 2.44 2.63 0.00 115 S 8.04 4.32 0.00 3.96 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 0.00 116 F 8.34 3.65 0.00 3.05 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 0.00 117 L 7.79 3.89 0.00 1.93 1.78 1.03 1.02 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 0.00 118 R 8.17 4.08 0.00 1.82 1.89 0.00 3.11 0.00 0.00 3.13 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 119 V 7.26 3.59 1.78 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 0.85 0.00 0.00 0.71 0.00 0.00 120 M 7.62 3.45 0.00 0.60 0.69 0.00 0.00 0.00 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 2.44 0.00 121 P 0.00 3.50 0.00 2.12 2.16 0.00 3.17 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.05 0.00 122 Q 8.02 4.05 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 123 V 7.31 3.96 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 0.65 0.00 0.00 0.84 0.00 0.00 124 A 8.14 4.32 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 0.00 125 S 8.08 4.86 0.00 3.92 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 0.00 126 C 8.80 4.50 0.00 3.01 2.95 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 0.00 127 F 8.32 4.51 0.00 2.84 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 0.00 128 N 7.54 4.58 0.00 2.62 2.50 0.00 0.00 6.89 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 0.00 129 P 0.00 3.93 0.00 2.33 2.42 0.00 3.59 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 130 D 8.15 4.32 0.00 2.86 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 0.00 131 A 8.26 3.95 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 0.00 132 W 8.06 4.12 0.00 3.47 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 0.00 133 S 8.92 4.21 0.00 4.17 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 0.00 134 R 8.18 3.88 0.00 2.05 1.98 0.00 3.31 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 135 C 8.11 4.21 0.00 2.78 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 0.00 136 F 8.21 3.35 0.00 2.35 2.95 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 0.00 137 N 8.78 4.39 0.00 2.88 2.88 0.00 0.00 6.71 7.67 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 0.00 138 R 7.50 3.81 0.00 1.76 1.99 0.00 3.03 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 139 I 7.36 3.53 1.40 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.24 0.54 0.00 0.00 140 T 7.85 3.63 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 1.21 0.00 0.00 141 T 8.07 3.87 4.32 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 1.14 0.00 0.00 142 G 7.29 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 M 7.84 4.22 0.00 1.87 1.91 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 2.69 2.45 0.00 144 T 7.29 4.38 3.35 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 1.03 0.00 0.00 145 E 7.80 4.07 0.00 1.93 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 2.34 2.17 0.00 146 P 0.00 4.59 0.00 2.15 2.13 0.00 3.74 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.95 0.00 147 L 7.82 4.11 0.00 1.62 1.71 1.03 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 148 P 0.00 4.22 0.00 2.07 1.69 0.00 3.93 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 2.06 2.12 0.00 149 A 9.15 4.14 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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