NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3156 8.1627 120.6024 55.3600 33.8694 173.5672 2 L 4.7995 8.2256 128.3747 53.6746 43.5697 173.7584 3 Y 4.8119 9.8275 123.8288 56.5990 43.2002 173.7889 4 H 5.1274 8.9892 119.1868 54.1937 30.6748 173.8159 5 L 4.5442 8.4915 127.7234 53.8429 42.6832 175.8169 6 F 4.9136 9.0778 125.6811 56.4015 40.1417 176.4518 7 V 2.5569 8.4307 121.7589 62.7578 31.6785 175.6599 8 N 4.1845 8.1934 117.7696 52.7165 36.8444 172.8188 9 N 4.9778 7.5075 115.7153 53.9212 42.5026 172.0861 10 Q 4.9505 8.3702 115.1524 55.8720 32.0517 173.7469 11 V 4.5256 8.5018 111.7646 59.3805 35.5411 175.0263 12 K 4.6648 8.6627 126.3861 55.3006 32.8992 176.1852 13 L 4.1430 8.5623 128.5581 54.5792 41.7071 177.5517 14 Q 4.1954 9.6434 124.7465 58.3874 29.3619 175.9418 15 N 5.2213 7.8252 112.5891 50.8289 42.4608 173.4624 16 D 4.7562 8.5551 120.2702 54.4784 41.9918 176.0451 17 F 4.6114 9.7308 126.6865 57.8932 40.4985 174.2200 18 K 5.1099 7.9546 125.0271 54.2580 36.7054 173.3312 19 P 4.4574 0.0000 0.0000 64.8753 31.6841 176.4949 20 E 4.0449 9.3285 121.8181 56.2492 29.1277 175.1677 21 S 4.5860 7.8591 115.1773 58.4831 64.2443 173.5972 22 V 5.0666 8.8222 121.7695 61.2081 35.0556 173.8807 23 A 5.2996 9.7729 129.3076 50.2799 21.8786 174.6215 24 A 4.7460 9.2102 125.9411 50.7954 20.9771 175.3619 25 I 4.6881 8.6835 124.1121 60.5287 39.2439 175.6064 26 R 4.8695 9.1428 125.4314 54.3876 34.4585 174.1300 27 S 5.0559 8.6711 117.9852 56.5858 64.6725 174.5571 28 S 4.5432 8.6557 119.4961 58.6850 63.3078 173.1784 29 A 4.9260 7.3367 120.8623 52.0443 22.2633 175.9469 30 F 4.8913 8.6825 120.5408 57.0564 41.9640 174.3840 31 N 4.6050 8.6823 126.7171 50.9790 37.0220 175.9714 32 S 3.7729 8.0337 117.9676 60.6382 63.0936 176.4280 33 K 4.2780 7.6897 117.8697 55.8738 31.8827 176.4614 34 G 3.7054 7.9950 109.7668 45.1314 0.0000 173.7374 35 G 4.0711 8.5456 109.9531 44.4164 0.0000 173.2161 36 T 4.0924 8.3058 117.7536 64.2426 69.2028 174.1072 37 T 4.6647 8.9389 122.9054 61.6308 71.9408 173.1418 38 V 4.9890 8.7323 126.0091 61.0931 35.0120 174.1819 39 F 5.3196 9.0168 124.5555 55.8441 42.6846 173.5717 40 N 5.6620 9.3957 120.6580 51.5247 42.5215 173.3438 41 F 4.5962 9.3404 121.8493 55.9429 41.0234 174.8399 42 L 5.4131 8.9626 124.6518 52.9647 44.7447 176.8945 43 S 4.9612 8.8767 116.2010 56.1374 64.6902 175.1353 44 A 3.9498 8.6162 123.1454 55.2446 18.0652 178.6727 45 G 3.8746 8.0703 101.9041 45.4594 0.0000 173.2082 46 E 3.8037 8.2220 117.7192 57.2533 27.5349 174.3109 47 N 4.6594 8.1505 115.8045 52.8956 39.6924 175.0440 48 I 4.4724 8.3591 123.6903 60.3869 36.8436 176.5185 49 L 4.2525 8.8208 128.3749 57.1364 42.4457 177.8707 50 L 4.5206 7.9134 120.7338 53.6591 45.5269 174.1939 51 H 5.4810 9.1655 126.5882 53.7045 32.4961 172.7615 52 I 4.3518 8.6741 126.7932 59.6753 39.7999 174.8267 53 S 4.3850 8.8338 124.4009 56.5959 63.6278 173.1655 54 I 4.4325 8.7654 130.5239 60.5242 38.3154 175.5967 55 R 4.4964 8.7680 128.5431 53.3624 31.3090 175.1589 56 P 2.9923 0.0000 0.0000 64.9404 31.6780 179.5507 57 G 3.4682 7.8053 106.9554 47.6000 0.0000 173.4834 58 E 4.2373 7.9753 117.6475 54.9238 30.5204 174.4979 59 N 4.2820 7.7299 115.6330 54.4812 38.0928 173.0671 60 V 5.0279 7.8060 114.6327 60.6762 35.8618 173.8502 61 I 4.8699 8.9035 122.7215 59.5996 40.2299 174.6249 62 V 4.5939 8.7315 127.2500 61.0452 34.2536 174.1951 63 F 5.6537 8.8743 125.6740 55.3402 42.2508 174.1539 64 N 5.4739 8.2260 119.1018 54.8332 42.3933 172.3772 65 S 5.5239 8.7099 114.6032 57.7153 67.4480 173.9989 66 R 4.4207 8.4128 114.4431 55.6712 32.5211 174.5850 67 L 4.4682 8.1255 121.1903 54.2667 42.6310 177.9198 68 K 3.9504 8.7474 123.4636 59.5577 32.0721 178.6861 69 N 4.9399 7.9459 113.9807 53.0366 39.3247 173.7707 70 G 4.1157 7.9042 108.0950 43.6865 0.0000 172.7887 71 A 4.5400 7.9784 120.9286 49.7630 20.9109 177.0751 72 W 4.5124 8.4144 119.9506 57.5168 29.9020 176.9099 73 G 4.4563 8.6141 110.2076 44.7055 0.0000 171.4662 74 P 4.7302 0.0000 0.0000 62.9016 32.1676 176.2648 75 E 4.7392 8.7788 121.2912 56.1115 31.1043 175.6434 76 E 4.8596 9.1084 121.1942 54.8804 32.6805 175.4120 77 R 5.5732 8.8381 122.7429 54.6803 34.0496 174.9146 78 I 4.7481 8.2803 112.8332 59.0040 41.1902 172.6035 79 P 4.7470 0.0000 0.0000 63.3839 31.4343 175.8787 80 Y 4.3294 8.5164 123.9648 60.2213 39.4344 176.2181 81 A 3.7541 8.2473 120.8876 54.0064 19.2849 177.0231 82 E 3.7429 8.4412 118.9775 57.8395 28.6803 174.7823 83 K 4.2782 7.4009 117.6111 57.6962 35.0354 176.9358 84 F 5.0590 7.5147 115.4243 55.5920 40.6061 175.1002 85 R 4.4451 8.8181 125.3448 53.6404 30.7728 174.1059 86 P 4.4807 0.0000 0.0000 62.0098 32.2357 174.3895 87 P 4.7795 0.0000 0.0000 63.3237 32.1339 174.8644 88 N 5.9616 7.8173 115.6816 50.0175 37.9297 172.1961 89 P 4.9019 0.0000 0.0000 62.8726 33.4189 176.5544 90 S 5.0418 8.6272 113.3262 57.0134 66.9014 173.3353 91 I 4.7468 8.6667 120.7375 60.0709 41.2168 174.4096 92 T 5.0166 8.9395 124.0838 61.5871 71.6096 173.2445 93 V 4.8340 8.8745 126.1204 61.0723 34.6323 174.1627 94 I 5.0648 8.8502 128.1179 59.5306 40.9907 173.9853 95 D 4.6849 8.7799 127.0789 53.3587 41.9696 175.9774 96 H 4.7525 8.8930 124.1098 55.5981 28.6636 176.0028 97 G 4.0149 8.5993 114.4092 45.1998 0.0000 174.8904 98 D 4.5790 7.4201 117.6242 52.6095 40.6790 175.6360 99 R 4.7951 7.1101 115.1191 55.9447 32.5441 173.2932 100 F 5.3267 9.2849 118.8094 56.0057 41.8636 174.6784 101 Q 4.7861 9.1716 123.2272 54.3056 31.6669 174.1755 102 I 4.7678 8.5589 126.8644 59.4441 40.5606 174.6116 103 R 4.4079 8.7948 125.8720 54.4397 33.2638 175.3025 104 F 4.8838 8.0235 122.8078 56.8653 40.6881 175.4662 105 D 4.2392 8.6142 121.0634 57.4473 40.9480 175.6407 106 Y 4.7372 7.4471 114.1696 56.7395 41.1928 175.7754 107 G 3.9377 8.7168 109.5368 44.9924 0.0000 173.1030 108 T 4.2589 8.0009 109.0141 60.8493 69.7605 174.3421 109 S 4.3844 8.2332 117.7158 58.4650 64.0927 173.7290 110 I 4.3771 8.0917 122.6020 59.7572 39.4743 174.2885 111 Y 5.0213 8.5174 123.7684 56.2789 40.3703 174.4940 112 Y 4.6384 9.1393 125.0959 55.5049 41.6134 174.3386 113 N 4.6775 8.5525 124.7753 52.9840 39.3230 175.5990 114 K 4.3426 8.5171 123.2881 56.8539 32.7160 177.1730 115 R 4.5379 8.8102 120.1920 56.0069 32.4659 176.1333 116 I 4.5491 7.8453 118.1501 59.2703 39.4049 176.2156 117 K 4.4078 8.5051 126.3021 55.2127 31.2745 175.4447 118 E 4.7501 7.8632 124.5557 55.8648 33.9941 174.5032 119 N 5.0469 8.5687 117.6930 52.4545 41.1919 173.9663 120 A 4.8927 8.9167 122.3995 51.6720 19.9870 177.9380 121 A 4.9401 9.5945 122.3869 52.1776 21.6489 175.9662 122 A 4.8991 7.6697 115.4043 50.8556 23.2855 175.0499 123 I 4.5918 8.2256 119.1004 59.3010 40.5419 174.9035 124 A 5.2578 9.0650 128.3473 50.3178 22.6693 174.7039 125 Y 4.8463 8.7865 120.2066 56.0869 41.9557 173.8554 126 N 5.3315 8.9251 124.0658 51.1423 42.5517 173.6585 127 A 4.2836 8.4204 122.4886 52.0898 22.0986 176.3586 128 E 4.1492 8.9305 119.9985 57.9721 30.9323 176.8090 129 N 4.8418 7.3995 115.9483 51.1585 39.0375 172.9306 130 S 4.1631 7.7463 114.4456 58.4349 63.5326 174.1043 131 L 3.9494 8.0267 125.4933 56.3457 42.3673 176.2807 132 F 5.8064 7.6832 116.6044 55.0973 42.5259 174.9067 133 S 4.6061 8.9649 115.4540 58.4414 64.1953 173.7810 134 S 4.7998 8.4120 114.3504 56.1508 64.5513 171.7858 135 P 4.7477 0.0000 0.0000 62.1385 33.5220 175.1815 136 V 4.5012 8.3124 111.9000 59.9720 34.8659 175.6301 137 T 4.5065 8.6473 120.8414 63.1656 70.0397 174.0671 138 V 4.7759 8.7647 125.4639 61.3701 34.6798 173.6570 139 D 5.3072 8.9831 128.7080 52.7217 42.8659 175.5986 140 V 5.0007 8.9091 124.5454 61.5610 33.4201 174.4760 141 H 5.0502 9.6857 125.2093 54.0343 31.2241 175.9997 142 G 3.6923 8.9122 109.9309 47.5847 0.0000 173.4348 143 L 4.9943 7.3230 116.4305 55.1166 42.5999 174.1755 144 L 3.8310 8.5077 122.0197 55.0841 42.2420 175.2708 145 P 4.6433 0.0000 0.0000 60.7576 32.7555 173.8537 146 P 4.2871 0.0000 0.0000 63.0646 31.7055 175.8960 147 L 4.6382 8.1244 121.5573 52.2151 43.1425 175.0132 148 P 4.5157 0.0000 0.0000 61.6881 32.1496 175.3267 149 P 3.9704 0.0000 0.0000 65.5563 31.4760 176.4880 150 A 4.1745 7.4956 124.3537 52.4554 19.2470 175.5022 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 M 8.16 4.32 0.00 2.26 2.00 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.43 0.00 2 L 8.23 4.80 0.00 1.65 1.38 0.90 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 3 Y 9.83 4.81 0.00 2.87 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 4 H 8.99 5.13 0.00 3.11 3.04 0.00 5.71 0.00 0.00 0.00 0.00 6.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.49 4.54 0.00 1.83 1.59 1.09 1.04 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 6 F 9.08 4.91 0.00 2.98 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 7 V 8.43 2.56 1.67 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 0.57 0.00 0.00 0.26 0.00 0.00 8 N 8.19 4.18 0.00 2.72 2.84 0.00 0.00 6.67 7.96 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 9 N 7.51 4.98 0.00 2.80 2.90 0.00 0.00 6.59 7.06 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 10 Q 8.37 4.95 0.00 2.19 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.46 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 11 V 8.50 4.53 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 0.96 0.00 0.00 0.64 0.00 0.00 12 K 8.66 4.66 0.00 1.78 1.76 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.48 7.81 13 L 8.56 4.14 0.00 1.64 1.72 0.94 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 14 Q 9.64 4.20 0.00 2.08 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 15 N 7.83 5.22 0.00 2.77 2.71 0.00 0.00 6.93 8.06 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 16 D 8.56 4.76 0.00 2.62 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 17 F 9.73 4.61 0.00 3.22 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 18 K 7.95 5.11 0.00 1.82 1.92 0.00 1.58 0.00 0.00 1.82 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.37 7.81 19 P 0.00 4.46 0.00 1.99 1.99 0.00 3.64 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 1.98 2.05 0.00 20 E 9.33 4.04 0.00 2.00 2.19 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 2.12 2.35 0.00 21 S 7.86 4.59 0.00 2.72 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 22 V 8.82 5.07 2.15 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 1.00 0.00 0.00 0.90 0.00 0.00 23 A 9.77 5.30 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 24 A 9.21 4.75 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 25 I 8.68 4.69 1.60 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.59 0.39 0.00 0.00 26 R 9.14 4.87 0.00 1.59 1.69 0.00 3.05 0.00 0.00 3.05 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.47 0.00 27 S 8.67 5.06 0.00 3.71 3.74 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 28 S 8.66 4.54 0.00 4.08 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 29 A 7.34 4.93 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 30 F 8.68 4.89 0.00 3.05 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 31 N 8.68 4.60 0.00 2.53 2.59 0.00 0.00 6.40 7.46 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 32 S 8.03 3.77 0.00 4.00 4.09 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 33 K 7.69 4.28 0.00 1.67 1.78 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.36 7.81 34 G 8.00 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 0.00 0.00 0.00 35 G 8.55 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 0.00 0.00 0.00 36 T 8.31 4.09 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 1.16 0.00 0.00 37 T 8.94 4.66 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 1.31 0.00 0.00 38 V 8.73 4.99 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 1.10 0.00 0.00 0.89 0.00 0.00 39 F 9.02 5.32 0.00 3.13 2.88 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 40 N 9.40 5.66 0.00 2.64 2.77 0.00 0.00 6.51 8.73 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 41 F 9.34 4.60 0.00 2.82 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 42 L 8.96 5.41 0.00 1.55 1.57 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.88 4.96 0.00 4.08 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 44 A 8.62 3.95 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 45 G 8.07 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 46 E 8.22 3.80 0.00 2.12 2.08 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 2.24 2.27 0.00 47 N 8.15 4.66 0.00 2.81 2.76 0.00 0.00 7.03 7.09 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 48 I 8.36 4.47 2.00 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 1.28 0.58 1.19 0.00 0.00 49 L 8.82 4.25 0.00 1.82 2.03 1.22 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 50 L 7.91 4.52 0.00 1.02 1.01 0.45 -0.09 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 51 H 9.17 5.48 0.00 3.58 3.36 0.00 5.81 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.67 4.35 2.01 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 1.19 0.58 0.88 0.00 0.00 53 S 8.83 4.39 0.00 3.55 3.53 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.77 4.43 1.99 0.00 0.00 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 1.46 0.75 1.15 0.00 0.00 55 R 8.77 4.50 0.00 1.68 1.71 0.00 3.04 0.00 0.00 3.20 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.59 0.00 56 P 0.00 2.99 0.00 1.90 1.55 0.00 3.40 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.74 0.00 57 G 7.81 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 0.00 0.00 0.00 58 E 7.98 4.24 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.00 0.00 67 L 8.13 4.47 0.00 1.68 1.60 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.75 3.95 0.00 1.67 1.85 0.00 1.91 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.43 7.81 69 N 7.95 4.94 0.00 2.67 2.72 0.00 0.00 6.65 7.65 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 70 G 7.90 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 71 A 7.98 4.54 1.24 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 0.00 0.00 72 W 8.41 4.51 0.00 3.23 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 73 G 8.61 4.46 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 0.00 0.00 0.00 74 P 0.00 4.73 0.00 2.16 2.13 0.00 3.87 0.00 0.00 3.74 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 75 E 8.78 4.74 0.00 1.93 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 0.00 2.28 2.37 0.00 76 E 9.11 4.86 0.00 2.31 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 2.32 2.43 0.00 77 R 8.84 5.57 0.00 1.74 1.89 0.00 3.27 0.00 0.00 3.32 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 78 I 8.28 4.75 2.01 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.90 1.07 0.00 0.00 79 P 0.00 4.75 0.00 1.99 2.08 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 80 Y 8.52 4.33 0.00 3.02 3.12 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 81 A 8.25 3.75 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 82 E 8.44 3.74 0.00 1.98 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 2.12 2.23 0.00 83 K 7.40 4.28 0.00 0.94 0.76 0.00 1.67 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 0.96 7.81 84 F 7.51 5.06 0.00 2.79 2.77 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 85 R 8.82 4.45 0.00 1.07 1.49 0.00 3.11 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 86 P 0.00 4.48 0.00 2.32 1.99 0.00 3.78 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 87 P 0.00 4.78 0.00 2.30 2.38 0.00 3.65 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 88 N 7.82 5.96 0.00 2.57 2.75 0.00 0.00 7.30 8.02 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 89 P 0.00 4.90 0.00 2.23 2.21 0.00 3.93 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 2.14 2.48 0.00 90 S 8.63 5.04 0.00 3.91 3.73 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 91 I 8.67 4.75 1.58 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.61 0.82 0.00 0.00 92 T 8.94 5.02 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 1.22 0.00 0.00 93 V 8.87 4.83 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 0.55 0.00 0.00 0.78 0.00 0.00 94 I 8.85 5.06 1.85 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 1.12 0.71 0.74 0.00 0.00 95 D 8.78 4.68 0.00 2.62 2.38 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 96 H 8.89 4.75 0.00 3.33 3.25 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 G 8.60 4.01 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 0.00 0.00 0.00 98 D 7.42 4.58 0.00 2.78 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 99 R 7.11 4.80 0.00 1.99 2.01 0.00 3.01 0.00 0.00 3.30 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.75 0.00 100 F 9.28 5.33 0.00 3.08 2.89 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 0.00 101 Q 9.17 4.79 0.00 2.18 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 1.96 1.58 0.00 102 I 8.56 4.77 1.56 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 1.23 0.38 0.51 0.00 0.00 103 R 8.79 4.41 0.00 1.46 1.59 0.00 3.02 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.37 0.00 104 F 8.02 4.88 0.00 2.75 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 0.00 0.00 0.00 0.00 105 D 8.61 4.24 0.00 2.29 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 0.00 0.00 0.00 106 Y 7.45 4.74 0.00 3.03 2.70 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 0.00 107 G 8.72 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 0.00 0.00 0.00 108 T 8.00 4.26 4.28 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 1.24 0.00 0.00 109 S 8.23 4.38 0.00 3.41 3.25 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 0.00 110 I 8.09 4.38 1.47 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 1.30 0.52 0.32 0.00 0.00 111 Y 8.52 5.02 0.00 2.81 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 0.00 112 Y 9.14 4.64 0.00 2.89 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 0.00 113 N 8.55 4.68 0.00 2.46 2.65 0.00 0.00 7.20 7.61 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 0.00 114 K 8.52 4.34 0.00 1.74 1.79 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.13 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.18 1.15 7.81 115 R 8.81 4.54 0.00 1.93 2.03 0.00 3.37 0.00 0.00 3.33 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.75 0.00 116 I 7.85 4.55 2.00 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 1.55 0.74 0.98 0.00 0.00 117 K 8.51 4.41 0.00 1.88 1.86 0.00 1.58 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.47 7.81 118 E 7.86 4.75 0.00 2.02 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 2.26 2.38 0.00 119 N 8.57 5.05 0.00 2.73 3.02 0.00 0.00 6.71 7.54 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 0.00 120 A 8.92 4.89 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 0.00 121 A 9.59 4.94 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 0.00 122 A 7.67 4.90 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 123 I 8.23 4.59 1.50 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.46 0.39 0.00 0.00 124 A 9.07 5.26 1.19 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 0.00 125 Y 8.79 4.85 0.00 2.80 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 0.00 126 N 8.93 5.33 0.00 2.54 2.55 0.00 0.00 6.33 7.12 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 0.00 127 A 8.42 4.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.93 4.15 0.00 1.88 1.93 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 2.19 2.21 0.00 129 N 7.40 4.84 0.00 2.64 2.51 0.00 0.00 6.85 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 0.00 130 S 7.75 4.16 0.00 3.71 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 0.00 131 L 8.03 3.95 0.00 0.76 0.30 0.63 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 132 F 7.68 5.81 0.00 3.09 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 0.00 133 S 8.96 4.61 0.00 3.94 3.97 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 0.00 134 S 8.41 4.80 0.00 3.92 3.83 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 0.00 0.00 0.00 0.00 135 P 0.00 4.75 0.00 1.73 0.49 0.00 3.56 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.17 0.00 136 V 8.31 4.50 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 0.72 0.00 0.00 0.87 0.00 0.00 137 T 8.65 4.51 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 1.19 0.00 0.00 138 V 8.76 4.78 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 1.02 0.00 0.00 0.85 0.00 0.00 139 D 8.98 5.31 0.00 2.74 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 0.00 140 V 8.91 5.00 2.41 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 1.09 0.00 0.00 1.06 0.00 0.00 141 H 9.69 5.05 0.00 3.05 3.30 0.00 5.66 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 0.00 142 G 8.91 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 0.00 143 L 7.32 4.99 0.00 1.68 1.57 0.91 0.75 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 0.00 144 L 8.51 3.83 0.00 1.60 1.61 0.91 0.89 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 0.00 145 P 0.00 4.64 0.00 2.19 2.00 0.00 3.72 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.76 0.00 146 P 0.00 4.29 0.00 2.05 2.04 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 147 L 8.12 4.64 0.00 1.61 1.56 0.91 1.06 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 0.00 148 P 0.00 4.52 0.00 2.21 2.17 0.00 3.70 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.97 0.00 149 P 0.00 3.97 0.00 2.05 2.18 0.00 3.66 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 150 A 7.50 4.17 1.16 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 0.00 0.00