NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 D 4.4786 8.3493 120.4933 54.4014 41.4753 175.4968 4 W 4.3887 7.7404 118.5368 56.0894 29.3401 171.6941 5 V 3.1701 6.0086 119.7735 60.5957 31.8493 175.4238 6 P 4.5898 0.0000 0.0000 61.1388 32.5501 175.4721 7 P 4.5204 0.0000 0.0000 66.0458 31.1201 178.3223 8 E 4.0091 8.3312 118.1584 59.5248 29.4432 179.2804 9 V 3.5401 7.6992 117.7867 65.7271 31.2181 178.2015 10 F 3.9978 8.0047 117.2013 60.3719 39.0737 177.0493 11 D 4.5566 8.1678 118.1231 57.3123 40.5148 178.2725 12 L 4.0158 7.6530 119.5460 58.1954 42.4446 178.7250 13 V 4.1862 7.6732 109.3821 61.8259 31.7026 177.9925 14 A 4.0352 7.8882 122.3775 55.0985 18.2383 179.3368 15 E 3.8990 8.1812 117.2451 59.7314 29.8692 178.6223 16 D 4.3337 8.1282 118.3797 57.0298 40.8814 178.3394 17 K 3.9800 8.7305 120.3344 59.6593 32.2338 178.4660 18 A 4.0361 8.1250 120.7622 55.2025 18.3033 179.4665 19 R 3.8488 8.2023 117.1244 60.0390 30.0928 178.1870 20 C 4.5464 8.8200 116.5576 60.2813 38.7197 176.1067 21 M 4.2152 8.7532 122.2909 57.7343 31.3000 178.7712 22 S 4.0781 8.0829 112.4734 61.5467 62.7280 175.6769 23 E 4.0626 8.4759 120.3193 58.9053 29.3647 178.0801 24 H 4.9482 8.0655 113.6117 54.5410 29.5866 175.2366 25 G 3.8867 8.1060 108.7983 46.5761 0.0000 174.1039 26 T 4.3469 7.8088 116.0684 63.0575 69.6042 174.0140 27 T 4.4954 8.5254 115.7106 59.8374 72.3769 175.4584 28 Q 3.8463 8.5518 122.8020 59.4600 28.9074 178.7106 29 A 3.9755 7.9724 121.0754 55.4148 18.3928 179.3269 30 Q 3.9372 8.1261 116.3310 59.2511 28.6992 179.3853 31 I 3.6456 7.4207 120.1286 64.4944 37.0579 178.1734 32 D 4.3875 8.4384 120.1096 57.3834 40.5716 178.6550 33 D 4.3653 8.3392 119.4535 57.3585 40.8938 178.7769 34 V 4.0967 7.8179 119.9026 65.8594 31.3445 177.5150 35 D 4.4839 8.1704 117.2752 57.5101 40.7183 178.4810 36 K 4.4693 8.0658 115.9535 56.5038 32.0655 178.0576 37 G 3.9753 8.9680 108.3263 45.3751 0.0000 173.6037 38 N 4.7426 8.3858 118.4816 51.8261 38.5135 173.9936 39 L 4.9792 8.4462 123.3252 52.8333 44.3646 176.7054 40 V 4.6134 8.3101 115.8783 59.5148 35.3629 175.7374 41 N 3.6866 8.0506 121.3320 52.4074 37.3249 175.0842 42 E 4.5399 7.4519 119.7318 54.0600 32.3453 174.7504 43 P 4.7713 0.0000 0.0000 65.1282 31.1887 178.7215 44 S 4.7204 8.0147 112.9528 60.3199 63.2173 175.6548 45 I 4.1380 7.6405 121.7538 63.5099 38.2997 177.5711 46 T 4.0841 8.2151 111.0082 65.1930 68.6681 176.0554 47 C 4.4071 8.7571 119.7996 59.3506 41.3301 175.3112 48 Y 4.0983 8.0769 120.9879 61.1428 38.4333 178.0518 49 M 3.9065 8.3170 119.4494 58.4200 31.9672 178.1827 50 Y 3.9291 8.1440 119.6385 60.7112 39.0271 176.9381 51 C 4.0214 8.5127 119.8818 59.8263 42.9915 175.5236 52 L 3.7826 7.6168 121.5532 57.8632 41.6591 178.6015 53 L 3.9671 7.6584 119.0013 57.9193 41.5694 179.1957 54 E 3.6760 7.9424 119.0336 59.1287 29.2874 178.6161 55 A 3.7910 7.7235 119.6188 54.1555 18.2456 178.5590 56 F 4.4961 7.2128 113.3831 56.5538 40.0294 175.6576 57 S 3.7476 7.7679 112.3562 59.7091 61.0007 173.6071 58 L 4.3916 7.9317 120.9661 55.8049 42.2165 177.1930 59 V 5.5414 7.5988 109.1888 58.5106 36.0201 174.5385 60 D 5.1653 8.1557 120.8904 52.1829 41.4181 176.3753 61 D 4.6896 8.7682 116.9357 55.8354 38.3487 176.3061 62 E 5.1014 8.8917 119.4875 54.9107 30.3714 175.6879 63 A 4.1353 7.9823 118.6260 53.3502 16.8486 178.1450 64 N 4.7078 7.8089 116.9700 53.5645 39.5705 175.4400 65 V 4.1304 8.2671 123.6007 62.6276 32.3589 175.7713 66 D 4.6049 8.9936 127.3551 53.2846 40.8739 176.7015 67 E 3.9609 8.5596 127.5789 59.3359 29.6542 178.7249 68 D 4.3994 8.1464 118.3687 57.5559 40.9817 178.8423 69 I 3.7089 7.9079 119.9098 64.4699 36.8781 178.0705 70 M 4.0185 8.0139 117.9455 58.7703 32.5051 177.9860 71 L 4.2063 8.6998 119.9375 57.8237 41.6159 179.8320 72 G 3.6878 8.3276 104.7181 47.6048 0.0000 175.3654 73 L 4.1761 7.8408 120.4181 56.2786 41.9861 177.6239 74 L 4.2844 6.9185 117.8275 52.7209 42.9129 174.8690 75 P 4.3806 0.0000 0.0000 62.8549 31.5107 177.1214 76 D 4.3955 8.5254 118.5669 57.3587 41.1144 179.0388 77 Q 3.9764 7.9574 119.4190 58.9364 29.3696 177.5148 78 L 4.0783 7.3467 115.8531 56.0870 41.5592 178.9689 79 Q 3.8442 7.2521 119.4085 59.0596 28.5082 179.1212 80 E 3.8578 8.0291 119.2045 59.5404 29.8508 178.8076 81 R 3.8776 7.8999 117.7485 59.0259 30.1427 178.1120 82 A 4.0488 8.5885 121.3285 55.0168 18.3291 179.5507 83 Q 3.9313 8.4388 117.1004 59.0883 28.5955 179.0120 84 S 4.0550 7.8283 114.2711 61.3922 62.4700 176.4265 85 V 3.6242 7.8605 121.0128 66.1058 31.1972 178.0368 86 M 4.1725 8.3820 118.8726 58.2605 31.6272 178.5874 87 G 3.8090 8.0145 104.9340 47.9924 0.0000 175.0657 88 K 4.1490 7.7445 120.5520 58.4755 32.4758 177.3568 89 C 4.6832 8.1099 113.9298 55.9111 41.4687 173.5820 90 L 4.8743 7.7337 120.8837 51.8075 43.5177 174.6702 91 P 4.4974 0.0000 0.0000 62.4409 32.0923 176.4589 92 T 4.1620 8.1785 110.2256 62.0263 69.5532 173.7546 93 S 4.6046 7.9944 115.9980 56.3677 65.8175 174.0751 94 G 4.0499 7.8890 109.7178 45.7925 0.0000 172.0301 95 S 4.3176 8.1973 113.0147 59.8829 63.7328 173.5877 96 D 4.3604 7.3093 119.5635 51.7834 42.6137 176.0681 97 N 4.1226 8.0883 116.0901 56.6896 38.2244 178.2869 98 C 4.3540 7.9294 117.3100 60.0915 41.6111 175.5732 99 N 4.3106 9.1265 119.0079 56.5146 38.5150 177.0464 100 K 4.3632 8.4174 121.8350 59.0398 32.1056 179.3118 101 I 3.9249 7.8888 119.6678 64.0618 37.0791 177.4703 102 Y 4.2031 8.4469 121.0090 61.1884 38.5370 178.3585 103 N 4.1261 8.4123 117.0760 55.9005 38.5952 177.3018 104 L 3.8544 7.9464 121.5689 58.1740 42.3092 178.7325 105 A 3.9026 8.5268 121.0018 55.1610 18.2610 179.8230 106 K 3.5227 7.6235 116.7980 59.3947 32.0702 178.8230 107 C 4.1060 8.0408 118.7694 59.7240 43.4722 175.7986 108 V 3.4681 8.0572 120.1489 65.9265 30.8473 177.7773 109 Q 3.4809 7.0037 118.4232 58.8933 28.8258 177.4462 110 E 3.9637 7.7407 119.3218 59.2278 29.6969 178.6171 111 S 4.3463 7.9450 114.1781 60.1396 64.1280 174.7227 112 A 4.7696 8.2518 123.2716 49.6807 19.0841 174.3280 113 P 4.3938 0.0000 0.0000 66.0035 32.0781 179.4859 114 D 4.4361 7.9407 118.0044 56.4832 41.3145 178.2679 115 V 4.6493 7.3437 115.0877 61.8032 30.9789 174.6593 116 W 5.1370 8.1045 130.0952 55.5212 33.6331 174.2407 117 F 4.2724 6.0861 123.4839 57.7026 41.2574 173.0956 118 V 3.6475 8.5308 126.0660 60.6576 34.2697 175.5298 119 I 3.7385 7.6342 125.7141 61.5290 37.0294 175.7189 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 3 D 8.35 4.48 0.00 2.01 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 0.00 0.00 0.00 0.00 4 W 7.74 4.39 0.00 3.58 3.20 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 5 V 6.01 3.17 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 -0.09 0.00 0.00 0.49 0.00 0.00 6 P 0.00 4.59 0.00 2.58 2.24 0.00 3.63 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 7 P 0.00 4.52 0.00 2.30 2.33 0.00 3.73 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 8 E 8.33 4.01 0.00 2.09 2.07 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 2.42 2.46 0.00 9 V 7.70 3.54 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 0.71 0.00 0.00 0.85 0.00 0.00 10 F 8.00 4.00 0.00 3.24 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 11 D 8.17 4.56 0.00 2.89 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 12 L 7.65 4.02 0.00 1.64 1.79 1.04 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.67 4.19 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 0.28 0.00 0.00 0.95 0.00 0.00 14 A 7.89 4.04 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 15 E 8.18 3.90 0.00 2.08 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 2.40 2.43 0.00 16 D 8.13 4.33 0.00 2.85 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 K 8.73 3.98 0.00 2.06 2.05 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.72 1.72 7.81 18 A 8.13 4.04 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 19 R 8.20 3.85 0.00 1.90 2.11 0.00 3.18 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.68 0.00 20 C 8.82 4.55 0.00 3.22 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 M 8.75 4.22 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.07 0.00 22 S 8.08 4.08 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 23 E 8.48 4.06 0.00 1.92 1.68 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 2.31 2.50 0.00 24 H 8.07 4.95 0.00 3.34 3.37 0.00 5.68 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 8.11 3.89 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 0.00 0.00 0.00 26 T 7.81 4.35 4.08 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 0.88 0.00 0.00 27 T 8.53 4.50 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 28 Q 8.55 3.85 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 29 A 7.97 3.98 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 30 Q 8.13 3.94 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 31 I 7.42 3.65 1.89 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.57 0.92 0.00 0.00 32 D 8.44 4.39 0.00 2.81 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 33 D 8.34 4.37 0.00 2.96 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 34 V 7.82 4.10 2.30 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 1.67 0.00 0.00 1.13 0.00 0.00 35 D 8.17 4.48 0.00 2.86 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 36 K 8.07 4.47 0.00 1.99 1.90 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.66 7.81 37 G 8.97 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 38 N 8.39 4.74 0.00 3.07 2.83 0.00 0.00 6.73 6.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.45 4.98 0.00 1.62 1.72 0.61 1.23 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 40 V 8.31 4.61 2.07 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 0.76 0.00 0.00 0.96 0.00 0.00 41 N 8.05 3.69 0.00 1.44 2.33 0.00 0.00 6.92 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 42 E 7.45 4.54 0.00 1.99 1.83 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 2.27 2.30 0.00 43 P 0.00 4.77 0.00 2.09 2.12 0.00 4.11 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.89 0.00 44 S 8.01 4.72 0.00 4.05 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 45 I 7.64 4.14 1.91 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 1.77 1.37 1.05 0.00 0.00 46 T 8.22 4.08 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 1.36 0.00 0.00 47 C 8.76 4.41 0.00 2.97 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 48 Y 8.08 4.10 0.00 3.19 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 M 8.32 3.91 0.00 2.21 2.37 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.01 2.69 0.00 50 Y 8.14 3.93 0.00 3.15 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 51 C 8.51 4.02 0.00 3.17 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.62 3.78 0.00 1.29 1.33 0.97 0.40 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 53 L 7.66 3.97 0.00 1.76 1.59 0.95 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 54 E 7.94 3.68 0.00 1.22 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.39 0.00 55 A 7.72 3.79 1.06 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 0.00 0.00 56 F 7.21 4.50 0.00 3.08 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 57 S 7.77 3.75 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 58 L 7.93 4.39 0.00 1.91 1.71 0.95 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.60 5.54 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 0.53 0.00 0.00 0.67 0.00 0.00 60 D 8.16 5.17 0.00 2.91 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 D 8.77 4.69 0.00 2.85 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 62 E 8.89 5.10 0.00 2.02 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 2.17 0.00 63 A 7.98 4.14 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 64 N 7.81 4.71 0.00 3.17 2.78 0.00 0.00 6.72 7.56 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 65 V 8.27 4.13 2.11 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 0.82 0.00 0.00 0.98 0.00 0.00 66 D 8.99 4.60 0.00 2.72 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 67 E 8.56 3.96 0.00 2.06 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 2.41 2.41 0.00 68 D 8.15 4.40 0.00 2.94 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 69 I 7.91 3.71 2.00 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 1.42 1.08 0.94 0.00 0.00 70 M 8.01 4.02 0.00 2.15 2.18 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 2.63 2.66 0.00 71 L 8.70 4.21 0.00 1.71 1.68 0.91 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.33 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 73 L 7.84 4.18 0.00 1.92 1.76 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 74 L 6.92 4.28 0.00 1.86 1.31 0.84 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 75 P 0.00 4.38 0.00 2.04 2.15 0.00 2.94 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 1.36 1.77 0.00 76 D 8.53 4.40 0.00 2.69 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 77 Q 7.96 3.98 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.08 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 78 L 7.35 4.08 0.00 1.47 1.42 -0.33 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 7.25 3.84 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.81 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 80 E 8.03 3.86 0.00 1.99 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 2.36 2.35 0.00 81 R 7.90 3.88 0.00 1.89 1.86 0.00 3.22 0.00 0.00 3.33 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 82 A 8.59 4.05 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 83 Q 8.44 3.93 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 84 S 7.83 4.05 0.00 3.85 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.86 3.62 2.23 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 1.01 0.00 0.00 1.05 0.00 0.00 86 M 8.38 4.17 0.00 2.11 2.22 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.58 0.00 87 G 8.01 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 K 7.74 4.15 0.00 1.70 1.96 0.00 1.76 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.45 7.81 89 C 8.11 4.68 0.00 3.06 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 90 L 7.73 4.87 0.00 1.67 1.58 0.98 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 91 P 0.00 4.50 0.00 2.18 2.06 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 92 T 8.18 4.16 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 1.27 0.00 0.00 93 S 7.99 4.60 0.00 3.98 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 94 G 7.89 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 0.00 0.00 0.00 95 S 8.20 4.32 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.31 4.36 0.00 2.83 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 97 N 8.09 4.12 0.00 2.18 1.57 0.00 0.00 6.84 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 98 C 7.93 4.35 0.00 2.94 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 99 N 9.13 4.31 0.00 2.83 2.85 0.00 0.00 7.26 6.67 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 0.00 100 K 8.42 4.36 0.00 2.02 1.90 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.47 7.81 101 I 7.89 3.92 2.04 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.24 1.05 0.00 0.00 102 Y 8.45 4.20 0.00 3.08 3.26 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 0.00 103 N 8.41 4.13 0.00 2.82 2.82 0.00 0.00 6.73 6.33 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 0.00 104 L 7.95 3.85 0.00 1.89 1.93 0.95 1.19 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 0.00 105 A 8.53 3.90 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 0.00 106 K 7.62 3.52 0.00 1.63 1.58 0.00 1.50 0.00 0.00 1.41 0.00 0.00 2.54 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.05 0.46 7.81 107 C 8.04 4.11 0.00 3.00 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 0.00 108 V 8.06 3.47 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 1.35 0.00 0.00 1.01 0.00 0.00 109 Q 7.00 3.48 0.00 0.93 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.75 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 110 E 7.74 3.96 0.00 1.95 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 2.26 2.29 0.00 111 S 7.95 4.35 0.00 3.87 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 0.00 112 A 8.25 4.77 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 0.00 113 P 0.00 4.39 0.00 2.29 2.36 0.00 3.87 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.02 0.00 114 D 7.94 4.44 0.00 2.77 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 0.00 115 V 7.34 4.65 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 1.01 0.00 0.00 116 W 8.10 5.14 0.00 3.53 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 0.00 117 F 6.09 4.27 0.00 2.73 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 0.00 118 V 8.53 3.65 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 0.78 0.00 0.00 0.48 0.00 0.00 119 I 7.63 3.74 1.65 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.45 0.73 0.00 0.00