NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4313 8.3044 118.1949 55.5488 32.5620 173.7942 2 E 4.7061 7.7633 118.6703 55.3581 32.5073 173.2389 3 L 5.2654 8.1429 116.8842 54.2351 46.1913 175.4357 4 T 4.8058 9.0622 115.6573 61.1910 70.9790 172.1903 5 T 5.2493 8.5871 115.0606 62.1082 72.3986 173.5606 6 R 4.7407 8.9125 124.0010 54.9058 34.1484 173.7717 7 T 5.0280 8.4310 120.8478 61.7450 70.8273 173.7957 8 L 4.4302 9.3243 128.6262 53.2026 42.7915 175.4955 9 P 4.6236 0.0000 0.0000 62.2573 32.1666 176.3146 10 A 4.1546 8.4964 121.7843 54.6092 18.3295 178.1565 11 R 4.1442 7.6437 117.4866 55.1313 29.3357 175.6284 12 K 4.3709 8.4562 125.0115 56.4953 33.9627 176.1470 13 H 4.9283 9.8994 121.7172 54.9071 30.0904 174.0026 14 I 4.9858 9.0910 125.6500 59.5728 39.3884 174.7639 15 A 5.1756 9.0875 129.4068 50.3981 21.2634 175.5147 16 L 5.0497 8.9287 122.7406 52.9052 44.5565 175.9410 17 V 4.7374 8.9707 123.6168 61.1815 35.1192 173.8670 18 A 5.4370 8.3988 126.9747 50.8146 22.4584 175.7060 19 H 4.6826 9.3974 118.6878 55.7065 30.2313 176.3372 20 D 4.4666 9.2394 121.2200 58.4240 40.5431 179.2864 21 H 4.3949 8.4105 113.0418 57.5544 29.0646 176.2060 22 C 4.7701 8.2892 118.1793 59.3396 28.7424 175.6360 23 K 4.1732 8.1901 124.7380 60.1961 31.5500 179.7912 24 Q 4.1804 8.2639 122.9881 61.0233 28.1105 180.9336 25 M 4.3708 8.0940 122.0251 59.6341 31.4586 180.1589 26 L 4.3835 8.2690 121.8767 58.1267 42.2119 178.7790 27 M 4.1120 8.6881 119.0253 58.6627 31.9932 178.7501 28 S 4.3183 8.4096 115.2457 61.5109 62.8651 176.4615 29 W 4.3240 8.2016 129.3507 60.7258 30.8557 177.6843 30 V 3.6257 8.5473 118.3447 66.0797 31.0363 177.7538 31 E 3.9478 8.3993 118.3085 59.5934 29.1686 179.5358 32 R 4.0638 7.9313 115.9652 58.0995 30.2604 177.0770 33 H 4.6730 7.3929 115.2376 54.9603 30.0161 175.2280 34 Q 3.9073 7.8749 123.1814 58.9714 28.3988 176.5880 35 P 4.2095 0.0000 0.0000 65.7542 31.6379 177.9748 36 L 4.1547 7.7606 118.1989 58.1963 42.2263 178.6705 37 L 4.1063 8.0398 118.8512 57.8302 41.2893 179.1955 38 E 4.1236 8.1618 117.3177 58.4890 29.4481 178.1808 39 Q 4.3297 7.9554 116.5257 55.8537 29.3116 174.2454 40 H 4.9857 7.7413 116.5240 53.7382 32.9080 172.9721 41 V 4.1915 8.3048 119.3275 61.8499 32.8356 174.4905 42 L 5.4030 8.3997 127.2576 53.3837 44.4708 174.9845 43 Y 5.2101 9.0242 119.4970 56.6285 42.5342 174.0690 44 A 5.2220 8.6703 120.5749 52.1684 23.5217 176.1213 45 T 4.0155 8.2909 110.1684 61.0708 70.3532 174.4763 46 G 3.7765 9.0013 106.2410 49.3142 0.0000 175.7595 47 T 3.8712 7.7743 115.4482 66.1403 69.0620 176.5312 48 T 3.9953 8.0803 117.0663 66.8432 68.5222 176.3214 49 G 3.7946 8.3304 107.5215 48.1725 0.0000 175.3612 50 N 4.3590 8.0186 118.5334 55.8698 38.5638 177.4136 51 L 3.9926 7.9638 120.3668 57.9386 41.6676 179.7109 52 I 3.6924 7.8069 119.4124 64.5804 37.1355 178.4112 53 S 4.2562 8.1762 116.3622 62.1552 61.9651 176.8782 54 R 4.1043 8.1851 121.7192 60.2166 29.2951 179.8290 55 A 4.6838 7.6205 117.2993 53.3796 19.7973 177.7017 56 T 4.2728 8.3209 105.9809 60.8979 70.6413 175.7032 57 G 3.9106 8.2763 109.2626 45.5601 0.0000 173.4340 58 M 4.2121 7.5792 120.7827 55.0726 32.7135 176.5833 59 N 4.5431 8.4938 118.7474 51.9528 37.9094 175.6600 60 V 4.4838 8.0653 123.6976 60.0553 34.4281 175.0132 61 N 4.5839 8.9287 126.0382 52.5519 38.6693 173.8150 62 A 4.7567 8.3825 125.9516 51.8281 19.6695 176.3728 63 M 4.8789 8.6480 122.5601 53.5361 35.8322 175.4639 64 L 4.2571 9.1486 119.3645 55.1048 43.2965 177.0007 65 S 4.4180 8.6179 115.1244 58.2679 63.5264 174.7541 66 G 3.8756 9.1447 112.2767 48.0696 0.0000 174.2040 67 P 4.3710 0.0000 0.0000 64.5620 31.4232 177.5772 68 M 4.4427 7.6607 114.8390 54.6105 32.6456 176.0040 69 G 3.9523 8.2028 107.5066 45.3404 0.0000 176.4409 70 G 3.6804 8.6379 108.2573 48.0321 0.0000 175.6243 71 D 4.2620 7.9730 120.4898 57.3354 40.8185 178.7372 72 Q 4.0333 7.9714 118.0594 58.7668 28.7752 178.5565 73 Q 3.9257 7.9340 119.3277 58.8357 28.7464 178.8888 74 V 3.5763 7.8495 119.3341 65.9971 31.5718 178.2230 75 G 3.5995 8.4049 105.6187 47.6840 0.0000 175.4864 76 A 3.8994 8.2195 123.2071 55.0520 18.4392 179.7434 77 L 3.8021 7.8195 117.4465 57.7671 41.4813 179.9807 78 I 3.5033 7.7206 120.0719 64.3308 36.8843 178.6764 79 S 2.7900 7.6306 113.5189 60.5223 62.7187 175.3288 80 E 4.0405 7.4372 119.8165 55.3125 29.3052 176.5992 81 G 3.6700 7.3309 106.9804 46.5192 0.0000 174.8877 82 K 4.1655 8.1012 117.8704 55.6557 32.8345 176.5400 83 I 4.3086 7.2167 119.8079 59.5047 39.6107 174.6489 84 D 4.7886 9.0742 125.1189 55.0246 42.5499 177.1880 85 V 4.7219 7.6239 116.9202 60.8853 35.6175 173.8256 86 L 5.1039 8.9783 128.5078 53.3826 45.0334 174.9800 87 I 4.5557 8.9204 127.9948 59.7989 39.2984 174.4132 88 F 5.3633 9.2644 131.2380 56.5754 41.0211 173.2802 89 F 4.8251 9.5078 126.6417 56.0916 37.8811 174.9831 90 W 4.3059 7.9176 119.3709 55.1655 29.9285 176.1348 91 D 4.3616 8.9319 121.6931 52.9048 40.3894 174.3804 92 P 4.1482 0.0000 0.0000 63.4375 31.7520 176.5240 93 L 4.6826 8.3996 118.2864 54.4259 42.3989 175.7786 94 N 4.9023 7.8408 115.3317 51.2780 42.3157 173.9374 95 A 4.2858 8.6563 126.4015 51.7276 19.2915 176.9665 96 V 4.5657 8.0506 121.9401 58.7796 34.1687 174.2421 97 P 4.4102 0.0000 0.0000 65.7135 31.5933 177.0005 98 Q 4.4574 7.8526 117.1433 56.5036 29.9938 177.5728 99 D 4.3592 8.1851 122.3999 58.0370 41.3747 175.0374 100 P 4.2291 0.0000 0.0000 65.9755 31.2414 178.1660 101 D 4.3516 8.0521 118.2088 56.9486 40.7667 178.6696 102 V 3.7754 7.7562 118.7363 66.0809 31.5681 178.2077 103 K 3.7744 8.1448 118.0041 59.3862 31.8962 179.1779 104 A 3.9592 8.3464 121.3912 55.0519 18.3324 179.4153 105 L 3.9009 8.1036 118.8708 58.4094 42.1714 179.2984 106 L 4.1013 8.0084 118.9444 57.4811 41.4017 179.4536 107 R 3.8450 8.0837 118.9945 59.4367 30.0730 178.6158 108 L 4.0378 8.0377 118.5826 57.8081 41.5071 179.3324 109 A 4.2438 8.0725 120.6429 55.3644 18.3258 179.9869 110 T 3.8419 7.8731 114.3358 66.6949 68.3853 177.0246 111 V 3.3242 7.6138 119.2831 65.9516 31.4299 176.9382 112 W 4.2993 8.4932 116.0063 56.1297 29.2029 175.9443 113 N 4.1197 7.5501 116.5492 54.8175 37.0572 172.8616 114 I 4.6888 7.2698 110.8257 58.2447 41.2991 175.4427 115 P 4.4742 0.0000 0.0000 62.9434 32.2900 175.5761 116 V 4.9914 8.4856 123.4290 61.0741 34.4883 174.0487 117 A 4.9661 9.1888 129.9870 50.4817 21.1652 176.6100 118 T 5.0768 9.0787 110.9490 60.9158 70.1966 173.9459 119 N 4.1633 7.5270 119.4006 50.3170 41.5676 175.0744 120 V 3.4683 7.6464 119.3604 66.0333 31.4935 177.6639 121 A 4.1111 7.8413 119.8590 55.7317 18.3030 179.6676 122 T 3.8894 8.6274 114.3819 66.4667 68.4230 177.0075 123 A 3.9478 8.1372 122.8350 55.1591 18.4204 179.3079 124 D 4.5563 8.7632 117.8261 57.8692 40.7766 179.1301 125 F 3.9132 8.3583 116.6951 60.5177 39.2639 177.6412 126 I 3.9637 7.9784 119.4683 64.5030 36.8109 178.3538 127 I 2.4732 7.7262 117.6082 62.7692 37.8359 176.8112 128 Q 4.2355 7.4855 116.5554 55.0233 29.3091 175.7925 129 S 4.2340 7.1996 115.7708 56.9752 62.6252 171.2507 130 P 4.0122 0.0000 0.0000 67.9061 31.2427 177.1980 131 H 5.3655 7.3531 113.9374 54.4937 28.6604 177.6847 132 F 4.2635 8.7114 124.4087 60.3402 39.5167 175.5017 133 N 4.8107 8.2667 115.5096 52.8409 38.7653 173.2736 134 D 5.1333 7.5573 118.6313 52.0605 44.9505 174.8012 135 A 4.5878 8.3941 121.6272 51.7411 19.4400 177.2662 136 V 4.4603 8.6173 121.7306 61.1477 35.2812 173.9652 137 D 5.3875 8.7829 127.0557 53.3640 42.2106 175.7502 138 I 4.7519 8.8649 116.0062 58.9531 41.3733 174.3015 139 L 5.0365 8.5018 123.7029 54.3569 42.6120 176.2471 140 I 4.8792 8.5768 116.1740 58.1427 41.4509 172.8666 141 P 4.5532 0.0000 0.0000 63.0651 32.2372 176.7219 142 D 4.6530 9.1205 122.4306 53.5522 40.7591 176.1920 143 Y 4.3218 8.6788 128.2522 60.5492 38.8318 177.5079 144 Q 3.9387 8.4523 120.9791 59.8392 28.9600 179.6307 145 R 3.9176 8.1209 120.9205 61.4290 29.4901 180.0920 146 Y 4.1609 7.9538 119.7719 60.6775 38.8742 177.9731 147 L 3.5566 8.1775 121.1668 57.7953 41.9361 178.5889 148 A 3.8954 7.7862 119.8781 55.5809 18.1599 179.1303 149 D 4.3539 8.0532 117.0108 57.4520 40.5439 179.3588 150 R 3.8254 7.2622 117.7073 58.6295 30.0083 177.8418 151 L 4.5006 7.3974 116.7574 54.6327 42.3712 177.0071 152 K 4.1168 7.4690 124.1575 56.8411 31.9415 176.9438 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 4.43 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.60 0.00 2 E 7.76 4.71 0.00 2.05 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.44 0.00 3 L 8.14 5.27 0.00 1.53 1.52 0.90 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 4 T 9.06 4.81 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 1.34 0.00 0.00 5 T 8.59 5.25 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 1.23 0.00 0.00 6 R 8.91 4.74 0.00 1.91 1.76 0.00 3.01 0.00 0.00 3.19 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 7 T 8.43 5.03 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 8 L 9.32 4.43 0.00 1.55 1.58 0.94 -0.01 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 9 P 0.00 4.62 0.00 2.18 2.07 0.00 3.78 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 2.12 2.03 0.00 10 A 8.50 4.15 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 11 R 7.64 4.14 0.00 1.73 1.85 0.00 3.19 0.00 0.00 3.18 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.71 0.00 12 K 8.46 4.37 0.00 1.49 1.60 0.00 1.60 0.00 0.00 1.88 0.00 0.00 2.60 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.32 0.74 7.81 13 H 9.90 4.93 0.00 3.13 3.22 0.00 5.78 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 9.09 4.99 2.01 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 1.26 0.90 1.06 0.00 0.00 15 A 9.09 5.18 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 16 L 8.93 5.05 0.00 1.60 1.57 1.03 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.97 4.74 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.74 0.00 0.00 18 A 8.40 5.44 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 19 H 9.40 4.68 0.00 3.24 3.31 0.00 5.67 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 9.24 4.47 0.00 2.77 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 21 H 8.41 4.39 0.00 3.29 3.38 0.00 5.85 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 22 C 8.29 4.77 0.00 3.23 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 23 K 8.19 4.17 0.00 2.03 1.92 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.76 7.81 24 Q 8.26 4.18 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.90 0.00 0.00 0.00 0.00 0.00 2.36 2.00 0.00 25 M 8.09 4.37 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.17 0.00 26 L 8.27 4.38 0.00 1.86 1.95 0.44 1.00 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 27 M 8.69 4.11 0.00 2.07 2.33 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 2.68 3.08 0.00 28 S 8.41 4.32 0.00 4.14 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 29 W 8.20 4.32 0.00 3.54 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 30 V 8.55 3.63 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.19 0.00 0.00 31 E 8.40 3.95 0.00 2.21 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.65 0.00 32 R 7.93 4.06 0.00 1.57 1.77 0.00 3.07 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.90 0.00 33 H 7.39 4.67 0.00 2.55 2.85 0.00 5.83 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 7.87 3.91 0.00 2.20 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.94 6.73 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 35 P 0.00 4.21 0.00 2.01 2.09 0.00 3.56 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.12 0.00 36 L 7.76 4.15 0.00 1.77 1.65 1.15 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.04 4.11 0.00 1.72 1.74 0.74 0.82 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 38 E 8.16 4.12 0.00 2.11 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 2.34 2.61 0.00 39 Q 7.96 4.33 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.67 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 40 H 7.74 4.99 0.00 3.18 3.43 0.00 5.64 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.30 4.19 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 0.95 0.00 0.00 0.86 0.00 0.00 42 L 8.40 5.40 0.00 1.59 1.57 0.95 0.92 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 43 Y 9.02 5.21 0.00 2.84 2.81 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 44 A 8.67 5.22 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 45 T 8.29 4.02 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 1.15 0.00 0.00 46 G 9.00 3.78 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 0.00 0.00 0.00 47 T 7.77 3.87 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 48 T 8.08 4.00 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 49 G 8.33 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 50 N 8.02 4.36 0.00 2.73 2.88 0.00 0.00 7.06 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 51 L 7.96 3.99 0.00 1.88 1.75 0.96 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.81 3.69 2.02 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.98 0.94 0.00 0.00 53 S 8.18 4.26 0.00 4.04 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 54 R 8.19 4.10 0.00 1.95 1.83 0.00 3.31 0.00 0.00 3.23 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 55 A 7.62 4.68 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 56 T 8.32 4.27 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 1.26 0.00 0.00 57 G 8.28 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 58 M 7.58 4.21 0.00 2.02 2.00 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 2.62 2.47 0.00 59 N 8.49 4.54 0.00 2.74 2.63 0.00 0.00 6.42 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.07 4.48 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 0.96 0.00 0.00 0.98 0.00 0.00 61 N 8.93 4.58 0.00 2.14 2.58 0.00 0.00 6.49 7.86 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 62 A 8.38 4.76 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 M 8.65 4.88 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.55 0.00 64 L 9.15 4.26 0.00 1.68 1.60 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.62 4.42 0.00 3.92 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 66 G 9.14 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 0.00 0.00 0.00 67 P 0.00 4.37 0.00 2.05 2.16 0.00 3.70 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 2.06 2.21 0.00 68 M 7.66 4.44 0.00 1.98 2.19 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 69 G 8.20 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 0.00 0.00 0.00 70 G 8.64 3.68 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 0.00 0.00 0.00 71 D 7.97 4.26 0.00 2.70 2.65 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 72 Q 7.97 4.03 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 73 Q 7.93 3.93 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 74 V 7.85 3.58 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 0.89 0.00 0.00 0.92 0.00 0.00 75 G 8.40 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.22 3.90 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 77 L 7.82 3.80 0.00 1.68 1.47 0.76 0.55 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 78 I 7.72 3.50 1.94 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.73 0.89 0.00 0.00 79 S 7.63 2.79 0.00 3.77 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 80 E 7.44 4.04 0.00 1.94 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 2.14 2.15 0.00 81 G 7.33 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 82 K 8.10 4.17 0.00 1.57 1.61 0.00 1.52 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.24 1.35 7.81 83 I 7.22 4.31 1.70 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.64 0.81 0.00 0.00 84 D 9.07 4.79 0.00 2.50 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 85 V 7.62 4.72 2.18 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 1.18 0.00 0.00 1.01 0.00 0.00 86 L 8.98 5.10 0.00 1.78 1.51 0.86 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 87 I 8.92 4.56 1.66 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.84 -0.00 0.00 0.00 88 F 9.26 5.36 0.00 2.99 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 F 9.51 4.83 0.00 2.96 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 90 W 7.92 4.31 0.00 2.97 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 D 8.93 4.36 0.00 2.77 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 92 P 0.00 4.15 0.00 1.84 1.12 0.00 3.43 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.50 0.00 93 L 8.40 4.68 0.00 1.59 1.61 0.84 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 94 N 7.84 4.90 0.00 2.78 2.62 0.00 0.00 7.02 7.35 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 95 A 8.66 4.29 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 96 V 8.05 4.57 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 0.92 0.00 0.00 0.94 0.00 0.00 97 P 0.00 4.41 0.00 2.21 2.24 0.00 3.77 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 2.00 1.97 0.00 98 Q 7.85 4.46 0.00 2.42 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.94 0.00 0.00 0.00 0.00 0.00 2.47 2.42 0.00 99 D 8.19 4.36 0.00 3.00 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 0.00 100 P 0.00 4.23 0.00 2.30 2.29 0.00 3.79 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 2.06 0.00 101 D 8.05 4.35 0.00 2.99 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 0.00 102 V 7.76 3.78 2.22 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 0.75 0.00 0.00 1.25 0.00 0.00 103 K 8.14 3.77 0.00 2.05 1.78 0.00 1.33 0.00 0.00 1.81 0.00 0.00 2.91 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.37 1.36 7.81 104 A 8.35 3.96 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 0.00 105 L 8.10 3.90 0.00 1.83 1.91 0.86 0.00 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 0.00 106 L 8.01 4.10 0.00 1.80 1.65 0.40 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.08 3.85 0.00 1.98 2.09 0.00 3.07 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 108 L 8.04 4.04 0.00 1.95 1.86 0.98 0.97 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 0.00 109 A 8.07 4.24 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.87 3.84 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 1.19 0.00 0.00 111 V 7.61 3.32 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 -0.05 0.00 0.00 0.86 0.00 0.00 112 W 8.49 4.30 0.00 3.39 3.22 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 0.00 113 N 7.55 4.12 0.00 2.79 2.95 0.00 0.00 6.93 7.73 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 0.00 114 I 7.27 4.69 2.14 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 1.43 0.88 0.97 0.00 0.00 115 P 0.00 4.47 0.00 2.21 2.14 0.00 3.86 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.16 0.00 116 V 8.49 4.99 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 0.90 0.00 0.00 1.07 0.00 0.00 117 A 9.19 4.97 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 T 9.08 5.08 4.42 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 0.00 0.00 0.00 1.45 0.00 0.00 119 N 7.53 4.16 0.00 2.63 2.60 0.00 0.00 5.85 7.68 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 0.00 120 V 7.65 3.47 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 1.14 0.00 0.00 0.74 0.00 0.00 121 A 7.84 4.11 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 T 8.63 3.89 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 1.23 0.00 0.00 123 A 8.14 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 D 8.76 4.56 0.00 3.16 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 0.00 125 F 8.36 3.91 0.00 3.00 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 0.00 126 I 7.98 3.96 2.14 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 1.52 1.19 1.07 0.00 0.00 127 I 7.73 2.47 1.85 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 -0.24 0.92 0.00 0.00 128 Q 7.49 4.24 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.62 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 129 S 7.20 4.23 0.00 4.12 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 0.00 130 P 0.00 4.01 0.00 2.13 2.15 0.00 3.73 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 1.81 1.94 0.00 131 H 7.35 5.37 0.00 3.27 3.48 0.00 5.89 0.00 0.00 0.00 0.00 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 F 8.71 4.26 0.00 3.05 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 0.00 133 N 8.27 4.81 0.00 2.81 2.83 0.00 0.00 6.73 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 0.00 134 D 7.56 5.13 0.00 2.61 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 A 8.39 4.59 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 V 8.62 4.46 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 1.02 0.00 0.00 1.04 0.00 0.00 137 D 8.78 5.39 0.00 2.59 2.59 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 0.00 138 I 8.86 4.75 1.92 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.94 0.95 0.00 0.00 139 L 8.50 5.04 0.00 1.57 1.64 0.97 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 140 I 8.58 4.88 2.16 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.07 1.13 0.00 0.00 141 P 0.00 4.55 0.00 1.82 1.82 0.00 3.42 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.07 0.00 142 D 9.12 4.65 0.00 2.76 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 0.00 143 Y 8.68 4.32 0.00 3.36 3.16 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 0.00 144 Q 8.45 3.94 0.00 2.39 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.67 0.00 0.00 0.00 0.00 0.00 2.56 2.43 0.00 145 R 8.12 3.92 0.00 1.84 1.94 0.00 3.27 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 146 Y 7.95 4.16 0.00 3.11 2.99 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 0.00 147 L 8.18 3.56 0.00 1.03 1.30 0.86 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 148 A 7.79 3.90 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 0.00 149 D 8.05 4.35 0.00 2.73 2.62 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 0.00 150 R 7.26 3.83 0.00 1.81 1.81 0.00 3.06 0.00 0.00 2.78 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.12 0.00 151 L 7.40 4.50 0.00 1.57 1.63 0.88 0.83 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 0.00 152 K 7.47 4.12 0.00 1.80 1.69 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.43 7.81