NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9277 8.3549 109.7496 44.9039 0.0000 173.4411 2 L 4.3084 7.5538 119.1058 51.0679 43.3524 175.4453 3 S 4.5062 9.5332 118.3687 57.9042 66.2087 174.9282 4 D 4.6803 8.7407 122.1893 57.6503 40.6672 179.2986 5 G 3.6908 8.1221 105.6782 47.8747 0.0000 175.4781 6 E 3.9330 8.1851 120.8495 58.9174 29.3876 179.2909 7 W 4.4922 8.1309 119.0402 60.0967 29.0324 178.5913 8 Q 4.1149 8.3670 117.9276 59.0091 28.2742 178.8218 9 L 4.0417 7.9750 119.8397 57.5921 41.5639 179.7382 10 V 3.7153 8.0778 118.3673 66.2732 31.6146 178.2344 11 L 4.2090 8.4949 118.9938 57.7918 41.1858 179.3292 12 N 4.4081 8.4032 116.2078 56.5073 38.8308 177.5753 13 V 3.8305 7.9604 113.3541 63.7765 31.5992 178.4519 14 W 3.9696 8.7457 128.6528 60.0154 29.9636 177.9742 15 G 3.7947 8.2021 106.0160 47.8638 0.0000 175.6315 16 K 3.9380 7.6815 119.4910 58.7651 32.3330 179.3771 17 V 2.8497 6.8039 118.3161 65.5685 31.1752 177.7111 18 E 4.1119 7.9815 117.8957 58.5004 29.0205 178.4156 19 A 4.2442 7.2584 118.6407 52.9059 20.3446 177.3617 20 D 4.5701 7.9904 114.1944 52.2010 43.7395 175.7012 21 V 3.4483 7.7890 124.0091 65.8359 32.0096 176.7832 22 A 4.0872 7.9879 119.9975 55.1015 18.3042 179.6780 23 G 3.4685 8.3373 104.2637 48.2119 0.0000 175.6806 24 H 4.1276 8.2580 118.8127 58.4570 28.7064 178.1783 25 G 3.5578 8.4695 107.9803 47.6507 0.0000 175.3802 26 Q 3.8763 8.1905 122.2999 59.1815 29.1114 178.5545 27 E 3.9123 8.1097 119.3979 59.0821 29.3093 179.5665 28 V 3.4996 7.8224 118.4086 65.9661 31.5510 178.0004 29 L 3.3810 7.7100 118.6063 57.8363 41.3552 179.7492 30 I 3.6818 7.6071 119.4071 63.9674 36.8375 178.8868 31 R 3.8294 7.9207 119.2839 59.0658 29.9076 178.1474 32 L 3.8912 7.8948 120.3130 58.7435 41.6013 179.1950 33 F 4.5609 8.1076 117.3876 60.6220 38.6582 178.0024 34 K 4.2155 8.2338 117.5495 59.1965 31.9719 179.4517 35 G 3.7368 8.2144 105.6334 46.6893 0.0000 173.7455 36 H 4.6629 8.3856 118.9010 51.4730 29.5912 171.6575 37 P 4.4347 0.0000 0.0000 64.7427 31.2850 177.4678 38 E 4.1280 8.2403 115.8398 59.3382 29.5014 179.1008 39 T 3.7605 8.2322 111.4964 64.6164 68.6970 176.1755 40 L 3.6769 7.8920 123.0082 57.7682 41.7524 178.7026 41 E 4.0998 7.8974 117.7001 58.7588 29.4331 178.7296 42 K 4.4189 8.1090 117.3223 56.9373 32.6059 176.8638 43 F 4.4929 8.1045 119.0477 55.4099 38.7427 175.9201 44 D 4.3520 8.5517 126.5430 57.2056 40.8301 178.8557 45 K 4.0344 7.8211 116.8181 58.4740 32.0992 177.5128 46 F 5.1742 7.6786 116.6295 57.1859 39.2945 177.0563 47 K 4.0383 8.2313 121.5135 59.7026 32.0018 178.9581 48 H 3.9202 8.3077 113.8145 57.6171 28.5155 174.6988 49 L 4.4001 7.8196 121.3965 54.1470 41.3561 176.5023 50 K 4.4650 8.6868 122.8638 56.0332 32.9871 176.5014 51 S 4.5645 7.2392 113.2873 56.3116 66.6507 175.0306 52 E 3.8909 8.5755 122.5184 59.3979 29.3915 178.4700 53 D 4.3828 8.0349 118.6788 57.3079 40.7301 178.4572 54 E 3.9707 8.3040 119.2193 59.5897 29.2560 179.1531 55 M 3.9555 7.9883 117.9049 58.4359 32.0861 178.7162 56 K 4.0393 8.2803 117.7489 59.1485 32.2709 178.7721 57 A 4.3753 7.6688 119.2065 52.7216 18.9521 177.2861 58 S 4.1383 7.4587 113.3753 58.1807 62.6201 174.6339 59 E 4.0700 8.8449 127.9304 59.5538 29.5639 178.6260 60 D 4.5113 8.1710 119.4489 56.8879 40.8421 178.2748 61 L 3.4103 8.2406 121.3907 57.9036 42.0977 178.8779 62 K 3.8457 7.8030 119.0475 59.5015 32.0079 178.8895 63 K 4.0381 8.2328 118.7763 59.6776 31.9437 178.8636 64 H 4.3353 8.5581 118.7840 59.1916 29.7566 177.5464 65 G 3.5639 8.4662 107.9528 47.6595 0.0000 175.1175 66 N 4.2902 8.2568 119.4128 56.8006 39.0843 176.9736 67 T 3.8674 8.0452 117.1220 66.6895 68.5735 175.8984 68 N 4.2833 8.2362 118.7957 56.9824 39.0242 177.0190 69 L 4.2281 8.3053 120.3833 57.8794 41.6800 179.6609 70 T 3.9526 8.3307 116.0933 66.5902 68.3872 176.4359 71 A 3.9772 8.0018 122.4728 54.9606 18.3489 179.3043 72 L 3.6633 8.0470 119.0243 58.0955 42.1166 179.2198 73 G 3.4144 8.2402 105.7938 47.8499 0.0000 175.6459 74 G 3.6698 7.7412 107.0716 47.4068 0.0000 175.5323 75 I 3.8168 7.5338 122.0042 64.1645 37.1234 178.4649 76 L 3.9244 7.7713 120.1005 57.7919 41.1655 179.8197 77 K 3.9006 7.6809 116.9902 58.6652 32.3139 178.6146 78 K 3.9932 7.8948 117.4650 55.2625 32.3384 178.6790 79 K 2.0000 8.7358 119.6844 55.9759 32.3725 174.3495 80 G 4.2090 8.8380 115.5132 47.1774 0.0000 173.7294 81 H 4.5640 7.0791 116.8739 55.0738 27.4180 175.1045 82 H 5.1441 7.3645 110.9268 54.3765 29.6813 176.3234 83 E 3.9463 8.6221 122.5158 60.2286 29.0342 178.5813 84 A 4.0000 7.9230 118.6749 55.2713 19.1239 178.9876 85 E 4.1006 8.0887 116.6545 59.2454 29.6033 179.0967 86 L 3.9146 8.5626 120.9162 58.2174 42.1597 178.6860 87 T 3.9202 8.1841 116.3361 66.4781 68.4283 174.3576 88 P 4.3289 0.0000 0.0000 66.0130 30.9363 178.0916 89 L 4.0111 7.5230 118.4655 57.9587 42.0571 178.7287 90 A 4.1962 8.3582 121.0144 55.2258 18.2908 179.5411 91 Q 3.9136 8.7569 117.0816 59.3158 28.9186 179.3582 92 S 4.0554 8.3541 115.2330 61.6168 63.0196 175.9352 93 H 4.3051 8.6357 119.5238 58.0164 28.3828 177.5005 94 A 2.9427 8.1375 122.7653 54.7270 16.8331 178.1347 95 T 3.8320 7.5616 107.6789 63.3252 69.1890 176.9868 96 K 4.0143 7.5266 125.1924 58.3987 32.9000 178.0325 97 H 4.4142 7.8290 113.9762 55.4096 29.6047 174.9900 98 K 3.5488 6.9023 116.0312 57.3050 29.5913 176.1642 99 I 4.3267 7.5999 118.8265 58.8369 38.3346 175.0275 100 P 4.4372 0.0000 0.0000 62.0285 32.2976 177.3629 101 V 3.2574 8.3665 119.4969 66.2915 31.1164 178.1126 102 K 3.6208 7.9213 118.5398 59.9099 31.7791 178.1053 103 Y 4.1479 8.1282 117.0989 60.7956 37.7616 178.0490 104 L 4.1112 7.9040 120.0795 57.7378 41.5970 179.4099 105 E 4.0402 7.8320 118.3239 59.2404 29.4837 179.1041 106 F 4.4828 7.6314 117.6928 60.6991 38.9066 177.6284 107 I 3.8910 8.2629 118.3092 63.8661 37.7385 178.0621 108 S 4.2003 8.2530 116.5069 61.4230 62.6000 176.1153 109 E 3.9707 8.3622 121.7651 59.4261 29.3599 178.8137 110 A 4.3739 8.0329 122.0523 54.5549 18.3864 179.6700 111 I 3.6533 8.1838 118.7524 64.6554 37.1682 178.6709 112 I 3.7945 7.8179 120.5325 64.6176 36.7759 178.5806 113 Q 4.0214 8.5543 119.2975 58.8520 28.4547 178.9589 114 V 3.6076 7.9567 120.8872 65.4169 31.4705 177.9967 115 L 3.7874 7.7388 118.6342 57.7985 41.0710 179.4132 116 Q 4.2318 8.0246 118.8715 59.1919 28.9206 178.0116 117 S 4.2493 8.4679 115.8407 61.1990 62.9524 176.3209 118 K 4.0772 8.1412 121.0699 57.4650 33.2441 176.6908 119 H 5.0427 8.3830 116.6074 53.7595 29.5764 173.0240 120 P 4.3806 0.0000 0.0000 65.9847 31.6429 178.3357 121 G 3.7147 8.2221 106.7770 48.3021 0.0000 173.8812 122 D 4.6619 8.0873 116.6352 54.3263 41.9260 176.3154 123 F 5.0498 7.7127 121.0830 56.7395 38.9770 174.6188 124 G 3.8578 7.4365 110.0920 43.7862 0.0000 171.2103 125 A 3.8611 8.3560 120.6448 55.3534 18.3293 179.6902 126 D 4.2000 7.9494 116.5708 57.4807 40.9556 178.7669 127 A 4.0087 7.7921 120.7583 55.0243 18.3579 179.4372 128 Q 3.3168 7.7572 116.8944 58.9610 28.7746 179.5038 129 G 3.4998 8.0639 106.3980 47.6601 0.0000 175.6347 130 A 3.8941 8.0808 123.1976 54.9941 18.3725 179.4558 131 M 4.0155 8.5409 117.2482 58.7626 32.2902 178.4298 132 S 4.1777 8.4074 115.7409 61.7762 63.0740 176.8208 133 K 3.8261 7.9335 120.6133 59.5684 31.7039 179.2535 134 A 3.9471 8.1080 121.0527 55.0747 18.2038 179.7236 135 L 4.0656 8.1706 117.6336 57.6581 41.6480 179.2437 136 E 3.9468 8.4974 119.6816 59.1132 29.5634 178.5828 137 L 3.9680 8.4071 120.7996 58.0857 42.2052 178.5415 138 F 4.1945 8.5361 120.6940 61.5433 39.2455 177.2409 139 R 3.4991 8.4263 117.8380 59.2067 29.8881 178.7340 140 N 4.2245 8.4100 116.5297 56.6350 38.5794 177.2934 141 D 4.4095 8.2625 120.1248 57.2822 40.8105 178.8359 142 M 3.8867 7.8193 119.1889 58.2991 31.9815 178.5974 143 A 3.6323 7.9260 120.8423 54.9878 18.3237 179.5752 144 A 3.9904 7.9840 119.3823 54.9451 18.5385 179.8609 145 K 3.9733 8.1775 118.4159 59.8190 32.3383 178.5581 146 Y 4.2970 8.4469 117.1973 61.4022 37.7195 179.0885 147 K 4.7749 8.1856 120.3554 58.8631 31.8820 178.9649 148 E 4.0094 7.9450 118.9115 58.4281 29.6794 177.8216 149 L 4.3761 7.6322 116.6213 54.8602 42.0402 177.3718 150 G 3.6467 7.6135 107.5805 45.1624 0.0000 172.9697 151 F 4.8665 8.3402 118.5008 54.6813 41.7424 174.5354 152 Q 4.3715 8.8316 123.2490 56.1874 29.2951 175.9148 153 G 3.7493 8.6921 113.2036 45.7454 0.0000 173.2061 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 G 8.35 3.93 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 0.00 0.00 0.00 2 L 7.55 4.31 0.00 0.50 0.80 0.55 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.53 4.51 0.00 4.03 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 4 D 8.74 4.68 0.00 2.77 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 5 G 8.12 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 6 E 8.19 3.93 0.00 2.05 1.71 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 2.22 2.26 0.00 7 W 8.13 4.49 0.00 3.52 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 8 Q 8.37 4.11 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.72 2.61 0.00 9 L 7.97 4.04 0.00 1.92 1.76 0.90 0.72 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 10 V 8.08 3.72 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 1.23 0.00 0.00 0.93 0.00 0.00 11 L 8.49 4.21 0.00 1.93 1.80 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.40 4.41 0.00 2.92 2.93 0.00 0.00 7.07 8.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.96 3.83 2.21 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 1.15 0.00 0.00 1.01 0.00 0.00 14 W 8.75 3.97 0.00 3.64 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 15 G 8.20 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 0.00 0.00 0.00 16 K 7.68 3.94 0.00 1.60 1.46 0.00 1.62 0.00 0.00 1.43 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.33 7.81 17 V 6.80 2.85 0.67 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 0.07 0.00 0.00 -0.02 0.00 0.00 18 E 7.98 4.11 0.00 2.08 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 2.42 2.39 0.00 19 A 7.26 4.24 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 20 D 7.99 4.57 0.00 2.64 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.79 3.45 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.93 0.00 0.00 22 A 7.99 4.09 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 23 G 8.34 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 24 H 8.26 4.13 0.00 3.24 3.24 0.00 5.82 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 25 G 8.47 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 26 Q 8.19 3.88 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 27 E 8.11 3.91 0.00 1.96 1.89 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 2.24 2.41 0.00 28 V 7.82 3.50 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 1.09 0.00 0.00 0.97 0.00 0.00 29 L 7.71 3.38 0.00 1.56 0.99 0.92 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.61 3.68 1.77 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.54 0.87 0.00 0.00 31 R 7.92 3.83 0.00 1.91 1.92 0.00 3.27 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 32 L 7.89 3.89 0.00 1.69 1.53 1.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.11 4.56 0.00 2.99 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 34 K 8.23 4.22 0.00 1.76 1.84 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.69 1.58 7.81 35 G 8.21 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 0.00 0.00 0.00 36 H 8.39 4.66 0.00 2.79 2.87 0.00 5.65 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 37 P 0.00 4.43 0.00 2.15 2.12 0.00 3.82 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.01 0.00 38 E 8.24 4.13 0.00 2.30 2.31 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 2.47 2.64 0.00 39 T 8.23 3.76 4.38 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 0.75 0.00 0.00 40 L 7.89 3.68 0.00 1.25 1.78 0.13 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.90 4.10 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.55 0.00 42 K 8.11 4.42 0.00 1.81 1.70 0.00 1.88 0.00 0.00 1.76 0.00 0.00 3.16 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.75 1.91 7.81 43 F 8.10 4.49 0.00 3.19 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 44 D 8.55 4.35 0.00 2.60 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 45 K 7.82 4.03 0.00 1.17 1.38 0.00 1.65 0.00 0.00 1.58 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.34 7.81 46 F 7.68 5.17 0.00 2.80 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 47 K 8.23 4.04 0.00 1.83 1.85 0.00 1.94 0.00 0.00 1.88 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.74 1.40 7.81 48 H 8.31 3.92 0.00 3.28 3.48 0.00 5.52 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.82 4.40 0.00 1.49 1.54 0.71 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.69 4.47 0.00 1.71 1.79 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.70 1.48 7.81 51 S 7.24 4.56 0.00 3.98 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 52 E 8.58 3.89 0.00 2.04 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 2.34 2.36 0.00 53 D 8.03 4.38 0.00 2.71 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 8.30 3.97 0.00 2.07 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 2.32 2.33 0.00 55 M 7.99 3.96 0.00 1.91 2.23 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.52 0.00 56 K 8.28 4.04 0.00 1.84 1.84 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.62 7.81 57 A 7.67 4.38 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 58 S 7.46 4.14 0.00 3.90 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 59 E 8.84 4.07 0.00 2.25 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 0.00 2.39 2.44 0.00 60 D 8.17 4.51 0.00 2.98 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 61 L 8.24 3.41 0.00 1.12 1.55 0.63 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.80 3.85 0.00 1.85 1.94 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.46 7.81 63 K 8.23 4.04 0.00 2.08 1.91 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.74 7.81 64 H 8.56 4.34 0.00 3.60 3.73 0.00 5.79 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 65 G 8.47 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 66 N 8.26 4.29 0.00 2.79 3.02 0.00 0.00 7.23 6.52 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 67 T 8.05 3.87 4.41 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 1.26 0.00 0.00 68 N 8.24 4.28 0.00 2.79 3.03 0.00 0.00 7.29 6.29 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 69 L 8.31 4.23 0.00 1.79 1.91 0.91 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.33 3.95 4.47 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 1.25 0.00 0.00 71 A 8.00 3.98 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 72 L 8.05 3.66 0.00 1.60 1.71 0.09 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.24 3.41 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 0.00 74 G 7.74 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.53 3.82 1.84 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 1.51 0.98 0.86 0.00 0.00 76 L 7.77 3.92 0.00 1.06 1.50 -0.15 0.90 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 77 K 7.68 3.90 0.00 1.71 1.80 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.46 1.50 7.81 78 K 7.89 3.99 0.00 1.86 1.83 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.55 1.89 7.81 79 K 8.74 2.00 0.00 1.01 0.74 0.00 1.39 0.00 0.00 1.53 0.00 0.00 2.77 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.54 0.97 7.81 80 G 8.84 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 0.00 0.00 0.00 0.00 81 H 7.08 4.56 0.00 3.07 3.23 0.00 5.80 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 82 H 7.36 5.14 0.00 3.25 3.40 0.00 5.66 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.62 3.95 0.00 2.06 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 2.42 2.37 0.00 84 A 7.92 4.00 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 85 E 8.09 4.10 0.00 2.21 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 2.38 2.42 0.00 86 L 8.56 3.91 0.00 1.73 1.71 0.84 0.84 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 87 T 8.18 3.92 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 1.24 0.00 0.00 88 P 0.00 4.33 0.00 2.30 2.35 0.00 3.71 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.06 0.00 89 L 7.52 4.01 0.00 1.90 1.92 1.02 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.36 4.20 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.76 3.91 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 92 S 8.35 4.06 0.00 3.96 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 H 8.64 4.31 0.00 3.51 3.57 0.00 5.81 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 94 A 8.14 2.94 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.56 3.83 4.16 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 1.25 0.00 0.00 96 K 7.53 4.01 0.00 1.60 1.60 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.12 1.35 7.81 97 H 7.83 4.41 0.00 3.05 3.13 0.00 5.86 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 6.90 3.55 0.00 1.79 1.76 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.42 7.81 99 I 7.60 4.33 2.05 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 1.40 0.96 1.12 0.00 0.00 100 P 0.00 4.44 0.00 1.89 1.94 0.00 3.33 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 1.28 0.00 101 V 8.37 3.26 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 0.84 0.00 0.00 0.47 0.00 0.00 102 K 7.92 3.62 0.00 1.69 1.60 0.00 1.95 0.00 0.00 2.00 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.62 1.28 7.81 103 Y 8.13 4.15 0.00 3.21 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.90 4.11 0.00 1.79 1.71 0.56 1.04 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 0.00 105 E 7.83 4.04 0.00 1.97 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 2.36 2.30 0.00 106 F 7.63 4.48 0.00 3.08 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 0.00 107 I 8.26 3.89 2.00 0.00 0.00 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 1.58 1.64 1.09 0.00 0.00 108 S 8.25 4.20 0.00 4.17 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 0.00 109 E 8.36 3.97 0.00 2.17 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 0.00 2.38 2.41 0.00 110 A 8.03 4.37 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 0.00 111 I 8.18 3.65 2.08 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 1.59 0.97 1.03 0.00 0.00 112 I 7.82 3.79 2.11 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.83 1.16 0.00 0.00 113 Q 8.55 4.02 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.61 0.00 114 V 7.96 3.61 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 1.12 0.00 0.00 0.92 0.00 0.00 115 L 7.74 3.79 0.00 1.03 0.37 0.69 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 8.02 4.23 0.00 2.33 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.98 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 117 S 8.47 4.25 0.00 4.03 4.15 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 0.00 118 K 8.14 4.08 0.00 1.40 1.46 0.00 1.65 0.00 0.00 1.33 0.00 0.00 2.55 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.26 1.39 7.81 119 H 8.38 5.04 0.00 3.18 3.19 0.00 5.63 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.38 0.00 2.20 2.24 0.00 3.84 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 121 G 8.22 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 0.00 122 D 8.09 4.66 0.00 2.75 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 0.00 123 F 7.71 5.05 0.00 3.01 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 0.00 124 G 7.44 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 0.00 0.00 0.00 125 A 8.36 3.86 1.26 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 0.00 0.00 126 D 7.95 4.20 0.00 2.66 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 0.00 127 A 7.79 4.01 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 7.76 3.32 0.00 1.99 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.43 1.38 0.00 129 G 8.06 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.08 3.89 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 0.00 131 M 8.54 4.02 0.00 2.43 2.38 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.86 0.00 132 S 8.41 4.18 0.00 4.01 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 0.00 133 K 7.93 3.83 0.00 1.82 1.67 0.00 1.52 0.00 0.00 1.53 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.57 7.81 134 A 8.11 3.95 1.20 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 0.00 0.00 135 L 8.17 4.07 0.00 1.79 1.83 1.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.50 3.95 0.00 2.11 2.09 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 2.43 2.32 0.00 137 L 8.41 3.97 0.00 1.88 1.95 0.99 1.14 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 0.00 138 F 8.54 4.19 0.00 3.09 3.32 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 0.00 139 R 8.43 3.50 0.00 1.94 1.83 0.00 3.14 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 2.00 0.00 140 N 8.41 4.22 0.00 2.91 2.85 0.00 0.00 7.09 7.62 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 0.00 141 D 8.26 4.41 0.00 2.70 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 0.00 142 M 7.82 3.89 0.00 1.58 1.72 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 1.42 1.99 0.00 143 A 7.93 3.63 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 0.00 144 A 7.98 3.99 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 K 8.18 3.97 0.00 2.06 2.08 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.61 7.81 146 Y 8.45 4.30 0.00 3.18 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 0.00 147 K 8.19 4.77 0.00 2.03 1.89 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.48 7.81 148 E 7.95 4.01 0.00 2.01 2.25 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 2.34 2.35 0.00 149 L 7.63 4.38 0.00 2.10 1.84 0.99 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.61 3.65 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 0.00 151 F 8.34 4.87 0.00 3.12 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 0.00 152 Q 8.83 4.37 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.93 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 153 G 8.69 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