NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5843 8.3049 120.5884 55.7668 33.3857 174.3994 2 H 5.2040 9.0910 123.3705 53.5631 32.5277 171.3956 3 A 4.9832 10.1735 124.9380 50.5925 21.4954 175.6168 4 L 5.1355 9.3626 123.5221 52.9357 44.5257 175.8127 5 V 4.8503 8.7513 123.5510 60.9516 34.7693 174.1133 6 Q 4.6442 8.8130 129.7070 56.1966 29.5761 175.8772 7 L 4.8548 8.8646 124.9853 54.3929 43.8055 176.7845 8 R 4.6608 8.0188 117.5844 53.7648 33.0427 175.5944 9 G 3.9127 8.5852 111.2945 45.0651 0.0000 173.2748 10 E 3.9318 8.5641 116.6135 58.4983 30.0199 177.5058 11 V 3.6896 7.6280 119.2114 64.3709 31.6034 175.5625 12 N 4.4492 8.9350 123.2758 53.4876 36.3533 173.9942 13 M 4.2693 7.7336 116.2138 54.0700 32.6844 176.4150 14 H 4.0718 8.5700 118.0393 56.9290 30.6723 176.6953 15 T 3.8785 8.4959 121.1484 66.7198 68.1415 176.8001 16 D 4.3502 8.0394 120.1751 55.8983 39.5361 178.4471 17 I 3.8429 7.4569 121.3992 64.1019 37.4127 177.6964 18 Q 3.8501 7.9368 120.4252 59.2223 28.8918 177.9733 19 D 4.3594 8.4165 120.2982 57.4556 40.6814 178.9162 20 T 3.8536 7.4295 115.1395 66.6596 68.3802 176.7348 21 L 4.0162 7.7310 120.3482 57.7675 41.6886 179.4144 22 E 3.8325 8.1631 118.4416 59.0972 29.1635 178.6542 23 M 4.3360 7.8563 117.2035 56.6312 32.1448 177.3374 24 L 4.6440 7.1983 118.0572 53.8684 42.3321 176.0331 25 N 4.3052 7.6923 113.5804 53.8975 36.6470 173.7098 26 I 4.4834 7.8893 112.2150 59.7061 38.8272 174.9564 27 H 4.8014 8.9109 120.3729 55.4664 29.8361 172.8411 28 H 4.8371 7.4903 115.8816 53.8882 32.7255 172.9599 29 V 3.6337 8.0415 120.8747 64.3176 32.0049 176.1410 30 N 4.5171 9.3361 122.1065 53.7640 37.2470 173.5495 31 H 4.9256 7.7893 116.4969 55.3020 30.3699 173.9626 32 C 5.9918 9.0305 122.2109 57.2966 35.0302 172.4070 33 T 4.9416 8.2512 116.8839 60.6308 71.3033 171.7921 34 L 5.1927 8.4232 124.7794 52.8685 43.7677 176.3891 35 V 4.0874 8.8880 123.2415 58.7924 34.2549 173.5630 36 P 4.4830 0.0000 0.0000 62.8458 32.0934 176.8596 37 E 4.2985 9.1963 124.0410 55.4559 28.2437 176.3289 38 T 4.7849 7.7746 119.4191 60.6690 73.7129 174.1533 39 D 4.3317 8.5295 121.2579 57.6717 41.0406 178.9146 40 A 3.9189 7.9561 120.6636 55.5629 18.3931 179.1300 41 Y 4.1350 7.9036 114.5102 60.7018 38.0594 178.1024 42 R 3.9918 8.5940 120.6092 59.3644 30.3346 178.7945 43 G 3.6241 8.1179 105.5783 47.9511 0.0000 175.5984 44 M 4.0570 7.6243 119.7373 58.4566 32.1219 179.3712 45 V 3.5602 7.8347 112.1169 63.9231 31.3458 178.5721 46 A 3.9668 7.6942 120.3149 54.9593 18.2834 179.2945 47 K 4.0506 7.8229 116.9667 59.0717 32.5445 178.3929 48 V 4.1161 7.6416 116.6669 63.4567 31.4590 177.2889 49 N 4.1629 7.6254 116.4943 57.5253 38.9965 174.8482 50 D 4.5230 8.0436 114.5210 55.0756 41.4437 176.2831 51 F 5.0507 8.7299 118.0616 56.7226 41.6063 174.4496 52 V 5.0282 7.8091 117.9808 60.4401 35.6399 173.0957 53 A 5.3373 9.1647 122.0199 50.1472 21.8851 175.3041 54 F 5.9352 7.8913 115.9046 54.9071 42.1212 173.7812 55 G 4.1466 8.2218 107.5209 46.3095 0.0000 170.8654 56 E 4.9606 8.0862 121.4172 54.4008 30.5046 174.2229 57 P 4.8254 0.0000 0.0000 61.9957 32.9129 176.4398 58 S 4.4911 8.7319 114.6658 57.4991 65.3333 174.9674 59 Q 3.9692 8.5977 123.2470 59.7369 28.6880 178.3544 60 E 3.9080 8.2415 118.6583 59.9320 29.5488 179.0753 61 T 3.8622 7.7008 115.1402 66.9404 68.6370 176.1897 62 L 3.9475 8.0305 121.7735 58.2658 41.9266 178.8827 63 E 4.0050 8.1285 118.4916 59.6651 29.2968 179.4981 64 T 3.8553 7.9963 115.8504 66.6446 68.2949 177.0141 65 V 3.5641 7.9314 120.1739 65.7287 31.5333 177.9780 66 L 4.1982 8.3568 118.9820 57.7262 41.2935 179.2709 67 A 4.1717 7.7263 120.3281 55.0125 18.4593 179.3379 68 T 4.0092 7.9704 110.2359 64.4985 67.4650 175.3666 69 R 4.5078 8.6691 117.5524 55.6021 31.1233 175.0879 70 A 4.4591 7.7188 119.8282 51.4444 19.7831 177.6022 71 E 4.5258 8.1698 118.2330 53.8018 34.5881 173.5439 72 P 4.7070 0.0000 0.0000 61.9212 32.4932 177.5368 73 L 4.0275 8.4254 121.3982 57.7596 41.7454 178.2266 74 E 4.5353 7.9176 116.1551 56.0419 33.5718 175.0698 75 G 3.9776 8.8160 108.6793 44.8576 0.0000 173.2198 76 D 4.3433 8.9211 117.8130 57.2119 41.1363 177.4026 77 A 3.7492 7.1979 119.5970 50.2414 18.8182 176.4577 78 D 4.3473 8.5693 123.9265 54.1786 41.7875 177.1823 79 V 3.6123 7.8975 123.9190 61.3632 30.4405 174.3458 80 D 5.0111 8.0089 126.4881 50.7598 43.4296 176.2404 81 D 4.4286 8.6165 118.1991 57.7986 40.7008 178.6465 82 E 3.9348 8.3287 118.8973 59.0900 29.7665 178.3084 83 W 4.0214 9.2947 128.5323 60.6155 30.7063 177.7807 84 V 4.0164 8.7924 118.1945 66.3731 30.7105 177.8901 85 A 4.3997 8.2611 120.7360 54.5488 18.3972 178.7175 86 E 4.1161 8.4381 114.1399 57.4856 29.8182 177.0071 87 H 4.4717 7.7704 113.5643 54.9622 31.0071 172.7580 88 T 4.8078 7.8220 115.1687 61.5328 71.1874 173.4442 89 D 4.2979 8.5965 120.5399 56.9727 41.1122 176.7598 90 Y 4.4032 7.7398 116.6469 57.3333 39.1250 175.2525 91 D 4.7267 8.4362 119.2447 55.0325 42.2108 175.9879 92 D 4.6103 7.7924 116.9631 51.1738 41.9908 176.3253 93 I 3.7134 9.1585 121.1396 65.0310 36.9112 178.6153 94 S 4.6351 7.7470 116.5057 61.1174 62.6541 177.0569 95 G 3.7323 8.2718 107.8961 47.5481 0.0000 175.6445 96 L 2.9253 7.6854 121.8980 57.5156 42.1910 178.3107 97 A 3.9014 8.4306 121.1209 55.5086 18.2340 179.2383 98 F 4.0669 8.5738 118.8260 61.5543 39.3511 177.2464 99 A 3.9357 7.5633 121.1549 54.2882 18.0827 179.6466 100 L 3.7775 7.9533 117.7594 58.0307 41.5491 179.6094 101 L 3.9778 7.6720 117.7833 57.5269 41.4529 178.8132 102 S 4.2763 7.7367 112.5018 56.9657 63.6118 174.0595 103 E 3.6437 7.9231 120.3817 57.9020 27.2708 174.9883 104 E 4.3481 8.5810 118.0898 57.2773 30.9940 174.4065 105 T 5.0343 7.5697 109.8503 60.9565 70.2032 172.2265 106 T 4.7299 8.1770 110.0819 59.1413 73.0443 174.1100 107 L 4.0013 8.5849 121.8741 58.2403 41.5175 180.2431 108 R 4.1729 7.8113 118.5230 59.0457 30.3411 178.5433 109 E 4.0159 7.8648 118.1088 59.0965 29.1145 178.5424 110 Q 4.8781 7.7690 115.8736 55.2037 29.9064 175.8009 111 G 4.0889 8.8208 107.4701 46.5561 0.0000 173.7985 112 L 5.0941 8.3288 118.9915 51.8878 44.3699 176.3018 113 S 4.1632 8.4116 116.9257 58.1849 62.6232 172.8591 114 P 4.4978 0.0000 0.0000 63.9041 31.2588 175.9736 115 T 4.7830 7.5843 115.3401 61.6134 71.3038 173.7740 116 L 4.4755 9.2136 127.3446 53.2755 43.1230 176.2445 117 R 4.2624 8.3680 124.3161 55.4048 29.2381 176.7090 118 L 4.3615 8.3232 124.3178 54.6252 42.9889 175.5505 119 H 4.9030 8.5014 120.0501 53.8438 31.6958 172.9170 120 P 4.3605 0.0000 0.0000 61.6084 31.9836 174.6966 121 P 4.4291 0.0000 0.0000 62.4756 31.5159 176.0663 122 R 4.1555 8.8319 124.4171 57.5789 30.1148 177.2859 123 G 3.8397 8.8077 112.0339 44.1857 0.0000 173.3181 124 G 4.0254 8.0734 107.1898 45.5706 0.0000 173.4777 125 H 4.7623 7.8873 115.5420 54.2632 30.5143 175.2350 126 D 4.5298 9.7209 118.6076 54.4924 40.9585 176.7014 127 G 4.1733 7.5431 108.5746 45.1961 0.0000 174.9465 128 V 4.5357 8.2067 114.1440 61.0491 32.1632 176.7328 129 K 4.4481 8.0346 117.7327 56.3972 33.9342 175.8639 130 H 4.8879 7.5489 115.3605 53.2179 32.9565 171.3380 131 P 5.0207 0.0000 0.0000 61.6758 33.1366 177.3250 132 V 3.6730 8.0423 116.2626 65.6134 31.1971 178.0896 133 K 4.0921 8.0073 116.2486 58.2893 31.8581 177.0147 134 E 4.4377 8.1806 116.5259 55.8320 30.4025 176.6053 135 G 3.9180 8.6665 108.3920 44.8054 0.0000 174.2028 136 G 4.4256 8.2908 107.8310 44.3984 0.0000 174.2134 137 Q 4.7986 8.5314 121.6512 55.7551 30.2291 176.5146 138 L 4.5286 7.8696 117.9747 55.5054 44.1950 177.6448 139 G 4.1655 8.7326 108.5357 43.9735 0.0000 172.2778 140 K 2.7832 7.9146 119.5349 56.3743 32.6090 176.5958 141 H 4.9232 8.5034 123.3856 53.6781 32.2987 173.2599 142 D 4.6028 8.3551 118.9726 54.2656 41.9698 178.2098 143 T 3.9557 8.4610 118.1105 66.2806 68.5314 176.7080 144 E 4.1083 8.1858 121.1333 58.8525 29.6052 178.9184 145 G 3.5864 7.8331 105.5320 47.8219 0.0000 175.7132 146 I 3.7267 8.4927 123.3242 64.0179 37.0924 178.1016 147 D 4.3804 8.0201 119.6742 57.5425 40.6391 178.6599 148 D 4.3269 7.9357 118.6581 57.3007 40.9774 178.5301 149 L 3.9346 7.5979 120.5839 58.2674 41.9241 178.7140 150 L 3.9923 8.1322 117.8495 58.2372 41.8472 179.3692 151 E 4.0955 8.9028 118.2406 59.1565 29.4023 178.9820 152 A 4.2363 8.3058 120.2719 53.9082 18.4461 178.4133 153 M 4.7412 7.4387 116.0359 54.9415 32.4124 176.0706 154 R 4.0467 7.5712 125.4832 56.7181 30.2227 176.1868 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 8.30 4.58 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 2 H 9.09 5.20 0.00 3.14 3.25 0.00 5.67 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 3 A 10.17 4.98 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 4 L 9.36 5.14 0.00 1.71 1.59 0.91 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.75 4.85 2.10 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 1.07 0.00 0.00 0.95 0.00 0.00 6 Q 8.81 4.64 0.00 2.25 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.38 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 7 L 8.86 4.85 0.00 1.58 1.65 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.02 4.66 0.00 2.09 2.05 0.00 3.23 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 9 G 8.59 3.91 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 0.00 0.00 0.00 10 E 8.56 3.93 0.00 2.25 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 0.00 2.33 2.27 0.00 11 V 7.63 3.69 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 0.81 0.00 0.00 0.93 0.00 0.00 12 N 8.93 4.45 0.00 2.95 3.00 0.00 0.00 7.14 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 13 M 7.73 4.27 0.00 1.75 1.08 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.50 0.00 14 H 8.57 4.07 0.00 3.16 3.46 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 T 8.50 3.88 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 16 D 8.04 4.35 0.00 2.84 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 17 I 7.46 3.84 1.86 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.91 0.76 0.00 0.00 18 Q 7.94 3.85 0.00 2.15 2.10 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 2.26 2.27 0.00 19 D 8.42 4.36 0.00 2.67 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 20 T 7.43 3.85 4.39 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 1.19 0.00 0.00 21 L 7.73 4.02 0.00 1.78 1.78 0.85 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.16 3.83 0.00 2.18 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 2.07 2.29 0.00 23 M 7.86 4.34 0.00 1.98 2.21 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.55 0.00 24 L 7.20 4.64 0.00 1.74 1.70 0.95 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 25 N 7.69 4.31 0.00 2.94 2.95 0.00 0.00 6.71 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 26 I 7.89 4.48 1.91 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.68 0.99 0.00 0.00 27 H 8.91 4.80 0.00 2.97 3.17 0.00 5.88 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 28 H 7.49 4.84 0.00 2.57 2.96 0.00 5.62 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.04 3.63 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 0.88 0.00 0.00 0.95 0.00 0.00 30 N 9.34 4.52 0.00 2.98 3.01 0.00 0.00 7.04 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 H 7.79 4.93 0.00 3.29 3.24 0.00 5.57 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 C 9.03 5.99 0.00 2.96 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 33 T 8.25 4.94 4.25 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 1.26 0.00 0.00 34 L 8.42 5.19 0.00 1.48 1.49 0.87 0.80 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 35 V 8.89 4.09 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.41 0.00 0.00 36 P 0.00 4.48 0.00 1.77 1.93 0.00 2.34 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.92 0.00 37 E 9.20 4.30 0.00 1.88 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 2.17 2.19 0.00 38 T 7.77 4.78 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 1.26 0.00 0.00 39 D 8.53 4.33 0.00 2.69 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 40 A 7.96 3.92 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 41 Y 7.90 4.13 0.00 3.14 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 42 R 8.59 3.99 0.00 2.12 2.09 0.00 3.14 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 43 G 8.12 3.62 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 0.00 0.00 0.00 0.00 44 M 7.62 4.06 0.00 2.15 2.30 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.52 0.00 45 V 7.83 3.56 1.51 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 0.85 0.00 0.00 0.61 0.00 0.00 46 A 7.69 3.97 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 47 K 7.82 4.05 0.00 1.89 2.02 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.46 7.81 48 V 7.64 4.12 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 1.10 0.00 0.00 0.93 0.00 0.00 49 N 7.63 4.16 0.00 2.98 2.98 0.00 0.00 7.15 8.33 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 50 D 8.04 4.52 0.00 2.14 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 0.00 0.00 0.00 0.00 51 F 8.73 5.05 0.00 3.00 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 52 V 7.81 5.03 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 0.96 0.00 0.00 1.10 0.00 0.00 53 A 9.16 5.34 1.18 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 54 F 7.89 5.94 0.00 3.16 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 55 G 8.22 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 0.00 0.00 0.00 56 E 8.09 4.96 0.00 2.11 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 2.34 2.39 0.00 57 P 0.00 4.83 0.00 2.21 2.03 0.00 3.82 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 58 S 8.73 4.49 0.00 4.10 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 59 Q 8.60 3.97 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.90 0.00 0.00 0.00 0.00 0.00 2.49 2.70 0.00 60 E 8.24 3.91 0.00 2.05 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 2.42 2.43 0.00 61 T 7.70 3.86 4.37 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 1.21 0.00 0.00 62 L 8.03 3.95 0.00 1.75 1.80 0.89 0.85 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 63 E 8.13 4.01 0.00 2.32 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 2.34 2.36 0.00 64 T 8.00 3.86 4.36 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 1.20 0.00 0.00 65 V 7.93 3.56 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 1.01 0.00 0.00 0.92 0.00 0.00 66 L 8.36 4.20 0.00 1.86 1.67 0.88 0.80 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 67 A 7.73 4.17 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 68 T 7.97 4.01 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 1.36 0.00 0.00 69 R 8.67 4.51 0.00 1.60 1.81 0.00 3.59 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 70 A 7.72 4.46 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 71 E 8.17 4.53 0.00 1.76 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 0.00 2.17 2.21 0.00 72 P 0.00 4.71 0.00 2.30 2.15 0.00 3.63 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.51 0.00 73 L 8.43 4.03 0.00 1.69 1.79 0.98 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 74 E 7.92 4.54 0.00 2.07 1.82 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 2.26 2.27 0.00 75 G 8.82 3.98 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 0.00 0.00 0.00 76 D 8.92 4.34 0.00 2.69 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.20 3.75 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 78 D 8.57 4.35 0.00 2.69 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.90 3.61 1.82 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 0.79 0.00 0.00 0.13 0.00 0.00 80 D 8.01 5.01 0.00 3.02 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 81 D 8.62 4.43 0.00 2.76 2.83 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 82 E 8.33 3.93 0.00 2.07 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 2.42 2.39 0.00 83 W 9.29 4.02 0.00 3.64 3.43 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 V 8.79 4.02 2.42 0.00 0.00 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 1.16 0.00 0.00 85 A 8.26 4.40 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 86 E 8.44 4.12 0.00 1.57 1.72 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 2.24 2.48 0.00 87 H 7.77 4.47 0.00 1.71 2.29 0.00 5.60 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 T 7.82 4.81 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 89 D 8.60 4.30 0.00 1.82 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 0.00 0.00 0.00 0.00 90 Y 7.74 4.40 0.00 3.20 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 91 D 8.44 4.73 0.00 2.70 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 D 7.79 4.61 0.00 3.15 2.78 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 0.00 0.00 0.00 0.00 93 I 9.16 3.71 1.90 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 1.57 0.93 0.92 0.00 0.00 94 S 7.75 4.64 0.00 4.09 3.95 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 95 G 8.27 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 0.00 0.00 0.00 96 L 7.69 2.93 0.00 1.69 1.79 0.67 1.19 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 97 A 8.43 3.90 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 98 F 8.57 4.07 0.00 3.11 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 A 7.56 3.94 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 0.00 100 L 7.95 3.78 0.00 1.74 1.63 0.85 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 0.00 101 L 7.67 3.98 0.00 1.53 1.59 0.91 1.10 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 0.00 102 S 7.74 4.28 0.00 3.77 3.40 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 0.00 103 E 7.92 3.64 0.00 1.97 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 2.16 2.22 0.00 104 E 8.58 4.35 0.00 1.83 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 2.34 2.34 0.00 105 T 7.57 5.03 4.40 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 1.23 0.00 0.00 106 T 8.18 4.73 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 107 L 8.58 4.00 0.00 1.70 1.77 0.93 0.84 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 0.00 108 R 7.81 4.17 0.00 1.88 2.01 0.00 3.46 0.00 0.00 3.33 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.60 0.00 109 E 7.86 4.02 0.00 2.23 2.10 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 2.38 2.42 0.00 110 Q 7.77 4.88 0.00 2.13 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.60 0.00 0.00 0.00 0.00 0.00 2.63 2.70 0.00 111 G 8.82 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 0.00 0.00 0.00 112 L 8.33 5.09 0.00 1.76 1.52 0.87 0.59 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 0.00 113 S 8.41 4.16 0.00 3.78 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 0.00 114 P 0.00 4.50 0.00 2.10 2.09 0.00 3.67 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 2.05 2.12 0.00 115 T 7.58 4.78 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 1.20 0.00 0.00 116 L 9.21 4.48 0.00 1.50 1.57 0.89 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.37 4.26 0.00 1.62 1.83 0.00 3.17 0.00 0.00 3.16 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.49 0.00 118 L 8.32 4.36 0.00 1.67 1.83 0.93 1.48 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 0.00 119 H 8.50 4.90 0.00 3.13 3.30 0.00 5.96 0.00 0.00 0.00 0.00 6.87 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 4.36 0.00 1.99 1.92 0.00 3.07 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.00 0.00 121 P 0.00 4.43 0.00 2.23 2.24 0.00 3.68 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.98 0.00 122 R 8.83 4.16 0.00 1.77 1.93 0.00 3.12 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.61 0.00 123 G 8.81 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 0.00 0.00 0.00 124 G 8.07 4.03 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 0.00 125 H 7.89 4.76 0.00 3.54 3.51 0.00 5.47 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 9.72 4.53 0.00 2.79 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 0.00 127 G 7.54 4.17 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 0.00 128 V 8.21 4.54 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 0.78 0.00 0.00 0.96 0.00 0.00 129 K 8.03 4.45 0.00 1.56 1.58 0.00 1.67 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.26 1.37 7.81 130 H 7.55 4.89 0.00 3.10 3.08 0.00 5.61 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 5.02 0.00 2.18 2.18 0.00 3.87 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.93 0.00 132 V 8.04 3.67 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 0.93 0.00 0.00 0.67 0.00 0.00 133 K 8.01 4.09 0.00 1.75 1.83 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.42 7.81 134 E 8.18 4.44 0.00 2.04 1.87 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 2.16 2.24 0.00 135 G 8.67 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 0.00 136 G 8.29 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 0.00 137 Q 8.53 4.80 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.77 0.00 0.00 0.00 0.00 0.00 2.22 2.39 0.00 138 L 7.87 4.53 0.00 1.60 1.52 0.86 0.99 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 0.00 139 G 8.73 4.17 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 0.00 140 K 7.91 2.78 0.00 1.26 1.45 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.71 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.18 0.99 7.81 141 H 8.50 4.92 0.00 2.89 3.15 0.00 5.72 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 D 8.36 4.60 0.00 2.57 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 0.00 143 T 8.46 3.96 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 144 E 8.19 4.11 0.00 2.03 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 2.37 2.37 0.00 145 G 7.83 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 0.00 146 I 8.49 3.73 2.00 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 1.44 0.85 0.91 0.00 0.00 147 D 8.02 4.38 0.00 3.02 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 D 7.94 4.33 0.00 2.87 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 0.00 149 L 7.60 3.93 0.00 1.74 1.81 0.96 0.61 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 0.00 150 L 8.13 3.99 0.00 1.78 1.73 0.92 1.00 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 0.00 151 E 8.90 4.10 0.00 2.14 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 2.33 2.32 0.00 152 A 8.31 4.24 1.45 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 0.00 153 M 7.44 4.74 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.67 0.00 154 R 7.57 4.05 0.00 1.73 2.09 0.00 3.42 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00