NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2554 8.1733 122.0557 56.3263 33.9848 174.0063 2 I 4.7850 8.3266 128.4774 59.5717 38.2086 174.8500 3 F 4.7635 8.7869 126.4386 56.8285 40.6682 175.4492 4 S 4.5871 8.6449 115.8620 57.3516 64.9848 175.3548 5 K 3.5573 8.7270 120.3138 59.9911 31.8211 179.3844 6 C 4.2861 8.0013 116.1873 59.6485 41.2282 175.1906 7 E 3.8991 7.7513 119.6986 59.4788 29.2165 178.6603 8 L 3.6820 7.6946 119.9029 58.0836 41.9347 178.8261 9 A 4.0016 7.8224 120.6326 55.1494 18.1445 179.9476 10 R 3.8350 8.3557 116.9352 59.1514 29.8284 178.7629 11 K 3.8519 8.0415 119.4986 59.9534 32.0320 178.6993 12 L 3.8736 7.9809 118.8487 57.3471 41.3784 179.2273 13 K 3.8788 7.8341 120.0747 59.5194 31.8690 178.8629 14 S 4.1049 7.6075 112.8351 61.3425 62.8999 174.8058 15 M 4.3141 7.6190 118.3050 54.7827 31.7161 176.2823 16 G 3.9326 7.7139 105.1065 46.9896 0.0000 175.7351 17 M 3.8782 8.1606 122.1042 56.8209 32.2007 175.4156 18 D 4.3619 7.9654 117.2016 57.1775 40.6168 175.7811 19 G 3.9321 9.5600 115.9752 44.7692 0.0000 170.8951 20 F 4.0280 8.3508 122.2401 59.5538 38.8149 174.4700 21 H 3.4849 8.9076 126.5849 56.9019 25.5634 176.4942 22 G 3.7063 8.2576 106.8419 45.4510 0.0000 173.5878 23 Y 4.6248 7.5272 117.4775 55.6668 39.0418 175.7088 24 S 4.7120 8.6941 119.7946 58.3529 63.8628 174.9211 25 L 4.1315 8.9429 123.2883 58.6040 41.6899 179.1692 26 A 4.2643 8.3080 120.0291 55.5833 18.2146 179.0152 27 N 4.3150 7.9826 114.5175 56.4184 38.6859 177.5514 28 W 4.0075 8.0035 119.4662 59.8140 29.1356 178.6116 29 V 3.8125 7.9998 118.0564 66.1839 30.9276 177.1674 30 C 4.3984 8.1936 119.5234 59.2797 44.5098 174.9534 31 M 4.0734 8.2265 119.4923 58.7678 31.7505 177.7090 32 A 4.1481 8.0330 120.6706 55.3784 18.6043 179.1355 33 E 2.7221 8.4522 117.5959 59.5129 29.4823 178.7796 34 Y 4.1179 8.0669 115.0345 60.4796 37.9339 177.5837 35 E 4.4310 8.3288 119.4037 58.0885 30.1775 177.3061 36 S 4.5354 7.8203 109.1675 56.6110 64.8108 173.5973 37 N 4.0253 8.6245 118.1572 54.8079 37.8566 173.9581 38 F 4.0957 7.9405 110.7271 57.8703 36.5933 173.8527 39 N 5.0081 7.9610 120.9604 52.4861 39.1225 176.1303 40 T 3.9874 8.9244 117.4107 64.5138 69.0005 175.7617 41 Q 4.3681 8.0357 118.1563 55.7641 29.7058 175.5463 42 A 4.2142 7.5850 121.0850 52.8072 19.3607 176.5679 43 F 5.0568 8.6185 122.7712 56.7513 43.1168 173.6771 44 Q 4.3285 8.0116 126.1174 54.3972 31.9854 173.8293 45 G 4.2234 8.9324 115.0580 45.9170 0.0000 172.3996 46 R 4.5473 8.2247 125.3797 54.7120 31.2596 177.7930 47 Q 4.5365 8.2282 122.1582 55.4451 27.6293 173.8193 48 S 4.5609 7.3810 115.6775 58.7568 66.2337 175.0349 49 Q 4.5238 7.2512 115.2645 56.7549 31.9461 174.3170 50 G 3.9772 8.7277 102.2961 45.2304 0.0000 172.2719 51 S 4.8308 7.7007 115.1019 57.1632 66.7612 174.6344 52 S 4.6810 9.0312 118.1424 56.8296 67.9102 172.2392 53 D 5.1793 8.1558 120.3848 52.8015 43.7814 175.0711 54 Y 4.8591 8.6469 119.8915 57.2444 41.5371 177.7712 55 G 4.6383 8.8213 112.3919 45.8026 0.0000 173.5582 56 I 3.9447 8.2076 116.6284 62.9649 37.7659 177.0222 57 F 4.9736 7.9068 115.7800 56.6054 39.6228 175.2778 58 Q 3.3348 7.9625 119.4558 56.8568 26.8614 175.3513 59 L 4.1853 8.0501 117.7368 54.6225 42.9998 178.1155 60 N 5.8275 9.2656 124.0483 53.5975 38.2766 175.7927 61 S 4.9424 9.2433 119.9425 60.4400 63.8869 175.9674 62 K 3.8255 9.4240 123.1146 58.7681 32.4297 178.1098 63 W 3.8737 8.2605 117.8002 57.9012 30.8852 178.7600 64 W 4.8003 8.5203 119.3282 58.6105 29.5260 173.5887 65 C 6.3000 7.8526 110.5005 52.6899 46.0362 172.8602 66 K 4.9401 8.6530 120.4166 54.8646 32.8632 175.5533 67 S 4.5435 8.3110 123.8620 59.5627 64.0597 173.3919 68 Q 4.4001 8.4671 121.3643 58.2472 32.1470 176.8688 69 S 4.1131 7.7296 117.6307 62.0582 63.6334 174.9008 70 H 4.2922 7.6324 119.9101 55.5843 26.7422 174.8656 71 S 4.2756 8.2078 120.6887 58.6086 64.0177 173.4888 72 S 4.6472 8.0853 115.7556 56.4000 66.4417 174.9845 73 A 3.8642 7.9954 122.4629 53.2463 18.9577 177.2697 74 N 4.1428 8.2053 114.2920 53.9991 37.3522 174.5312 75 A 4.1106 8.4267 123.6782 55.8821 19.0018 178.7867 76 C 4.5404 8.5660 110.6971 57.4553 41.1971 173.1713 77 N 4.1133 7.9629 116.6371 53.4481 36.0248 173.0245 78 I 4.4188 7.0096 116.5800 59.7636 41.7716 172.9197 79 M 4.4958 8.2477 124.4727 54.8246 32.6322 178.2545 80 C 3.7334 8.6057 122.1602 60.1588 34.9322 176.4617 81 S 4.0481 7.7977 113.9812 61.0356 61.7745 175.9902 82 K 3.9429 7.8105 120.9261 59.0186 32.0537 178.5666 83 F 5.0248 7.7962 117.4647 59.2228 38.7172 176.7192 84 L 4.8212 7.8085 117.3312 55.0291 41.0925 176.2059 85 D 4.9886 7.8007 118.8787 52.7705 42.4564 177.5875 86 D 4.0440 8.6086 120.9519 56.3019 41.0986 176.0255 87 N 4.7280 7.4538 118.2253 52.1393 38.9033 175.0589 88 I 4.2191 8.3199 119.4968 61.7034 37.9371 177.0539 89 D 4.3540 7.9721 121.7823 57.9493 40.6774 178.3902 90 D 4.4586 8.1233 118.9546 56.3102 39.6520 177.6617 91 D 4.3651 8.4955 120.0660 57.5061 40.8264 179.0585 92 I 3.6541 7.9653 119.4242 64.5321 37.2299 178.3638 93 A 4.0457 7.7628 121.0062 55.2975 18.0891 178.9220 94 C 4.3530 8.6452 117.1203 59.5281 37.9103 175.4180 95 A 4.0616 7.8847 122.4020 55.3992 17.7325 179.6932 96 K 3.8285 7.9182 115.7516 59.5051 32.1027 179.3541 97 R 4.0704 7.6097 117.5685 59.2912 29.6042 178.3144 98 V 2.4639 7.3176 118.3422 65.9255 31.2655 178.1991 99 V 3.7265 7.7141 117.9434 65.0175 30.6820 178.3135 100 K 3.9217 7.6787 118.3259 58.4748 32.3606 177.2593 101 D 4.6512 7.2707 117.2429 53.7763 41.6600 176.0557 102 P 4.2760 0.0000 0.0000 65.9338 31.2184 178.1998 103 Q 4.1035 8.2665 118.4135 56.8213 30.5936 177.0154 104 G 4.4256 7.7399 107.3023 45.8475 0.0000 176.0418 105 M 3.9407 8.7877 123.4235 56.7745 31.3930 177.4578 106 S 4.9491 8.0008 114.1118 58.8830 63.2239 175.0670 107 A 4.0363 7.5823 123.7045 53.5176 18.3602 178.3224 108 W 4.6536 7.8927 116.5267 55.2645 30.0188 177.0599 109 V 3.5699 8.5772 123.7708 65.9264 30.9228 177.2274 110 A 4.1163 7.9953 119.3902 55.2156 18.2305 179.1652 111 W 4.0951 8.4163 125.9693 60.6977 30.5043 177.8233 112 V 3.1440 7.6017 116.3578 66.0717 31.1024 177.8210 113 K 4.0286 7.7213 114.8558 58.0324 32.0919 177.3065 114 H 4.5797 7.4981 113.5333 55.0486 31.0235 173.6349 115 C 4.4565 7.2894 113.3798 57.4457 43.4266 175.9164 116 K 2.9276 7.0693 120.1009 59.0339 31.4750 177.9270 117 G 3.6386 7.4508 104.1597 46.3742 0.0000 173.6782 118 K 4.1053 7.0467 119.4028 55.5313 32.9708 176.6893 119 D 4.5626 8.2857 121.7180 53.4194 40.4018 175.4818 120 L 4.5966 8.2186 125.5974 54.5389 41.8479 179.2473 121 S 4.2474 8.1266 115.4726 60.5605 62.6133 175.2753 122 K 4.4398 7.9511 118.4360 56.3379 33.8373 177.2053 123 Y 4.2706 7.8866 120.8100 60.6056 38.7079 178.0021 124 L 4.3800 8.1317 116.7212 55.5309 42.7724 179.1448 125 A 3.8805 7.6722 121.8128 55.2088 18.4476 178.8219 126 S 4.3220 7.9154 107.2197 59.5114 63.5274 174.4610 127 C 4.5201 8.3696 120.4537 55.8834 40.8342 173.1417 128 N 4.6714 8.6480 122.7061 52.5757 37.7894 175.1973 129 L 4.3559 8.2899 122.4965 54.7547 42.3719 176.8250 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 K 8.17 4.26 0.00 1.93 1.73 0.00 1.34 0.00 0.00 1.47 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.14 1.29 7.81 2 I 8.33 4.79 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.66 1.09 0.00 0.00 3 F 8.79 4.76 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 4 S 8.64 4.59 0.00 3.95 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 5 K 8.73 3.56 0.00 2.06 1.87 0.00 0.88 0.00 0.00 1.63 0.00 0.00 2.73 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.38 1.45 7.81 6 C 8.00 4.29 0.00 2.98 3.09 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 7 E 7.75 3.90 0.00 2.08 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 2.47 2.34 0.00 8 L 7.69 3.68 0.00 1.19 1.34 0.31 0.80 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 9 A 7.82 4.00 1.43 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 10 R 8.36 3.84 0.00 2.02 1.99 0.00 3.16 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 11 K 8.04 3.85 0.00 1.95 1.95 0.00 1.50 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.45 7.81 12 L 7.98 3.87 0.00 1.65 1.49 0.87 0.61 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 13 K 7.83 3.88 0.00 1.87 1.98 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 S 7.61 4.10 0.00 3.96 4.14 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 15 M 7.62 4.31 0.00 1.90 1.97 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 2.50 2.69 0.00 16 G 7.71 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 17 M 8.16 3.88 0.00 1.18 1.86 0.00 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.16 0.00 18 D 7.97 4.36 0.00 2.67 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 19 G 9.56 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 20 F 8.35 4.03 0.00 3.45 3.29 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 21 H 8.91 3.48 0.00 3.11 3.46 0.00 5.98 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 G 8.26 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 23 Y 7.53 4.62 0.00 2.71 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 S 8.69 4.71 0.00 4.10 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 25 L 8.94 4.13 0.00 1.92 1.84 1.01 1.30 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 26 A 8.31 4.26 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 27 N 7.98 4.31 0.00 2.84 2.58 0.00 0.00 7.08 8.10 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 28 W 8.00 4.01 0.00 3.50 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.00 3.81 2.44 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 1.41 0.00 0.00 1.10 0.00 0.00 30 C 8.19 4.40 0.00 2.67 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 31 M 8.23 4.07 0.00 1.84 1.68 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 2.30 0.00 32 A 8.03 4.15 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 0.00 0.00 33 E 8.45 2.72 0.00 1.70 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 1.47 1.56 0.00 34 Y 8.07 4.12 0.00 2.98 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 35 E 8.33 4.43 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 36 S 7.82 4.54 0.00 4.13 4.06 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 37 N 8.62 4.03 0.00 2.74 2.83 0.00 0.00 7.18 7.05 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 38 F 7.94 4.10 0.00 3.36 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 39 N 7.96 5.01 0.00 2.97 2.77 0.00 0.00 6.98 7.23 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 40 T 8.92 3.99 4.50 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 1.41 0.00 0.00 41 Q 8.04 4.37 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 42 A 7.58 4.21 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 F 8.62 5.06 0.00 2.90 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 44 Q 8.01 4.33 0.00 2.14 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.75 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 45 G 8.93 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 0.00 0.00 0.00 46 R 8.22 4.55 0.00 1.99 1.90 0.00 3.32 0.00 0.00 3.36 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 47 Q 8.23 4.54 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.83 0.00 0.00 0.00 0.00 0.00 2.26 2.44 0.00 48 S 7.38 4.56 0.00 3.87 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 49 Q 7.25 4.52 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.57 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00 50 G 8.73 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 51 S 7.70 4.83 0.00 4.41 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 52 S 9.03 4.68 0.00 3.57 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 53 D 8.16 5.18 0.00 2.54 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 54 Y 8.65 4.86 0.00 3.33 3.15 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 55 G 8.82 4.64 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 0.00 0.00 0.00 56 I 8.21 3.94 1.69 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.93 -0.05 0.00 0.00 57 F 7.91 4.97 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 58 Q 7.96 3.33 0.00 2.47 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.97 0.00 0.00 0.00 0.00 0.00 2.54 2.71 0.00 59 L 8.05 4.19 0.00 1.50 1.64 0.31 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 60 N 9.27 5.83 0.00 3.00 3.12 0.00 0.00 7.45 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 61 S 9.24 4.94 0.00 4.19 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 0.00 62 K 9.42 3.83 0.00 1.68 0.74 0.00 1.24 0.00 0.00 1.33 0.00 0.00 2.54 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.30 0.42 7.81 63 W 8.26 3.87 0.00 2.68 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 64 W 8.52 4.80 0.00 3.68 3.30 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 65 C 7.85 6.30 0.00 3.09 3.33 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 66 K 8.65 4.94 0.00 1.87 1.67 0.00 1.63 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.40 1.24 7.81 67 S 8.31 4.54 0.00 4.13 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 68 Q 8.47 4.40 0.00 1.77 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 7.05 0.00 0.00 0.00 0.00 0.00 2.28 2.48 0.00 69 S 7.73 4.11 0.00 3.93 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 H 7.63 4.29 0.00 3.43 3.62 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.21 4.28 0.00 3.97 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 72 S 8.09 4.65 0.00 3.84 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 73 A 8.00 3.86 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 N 8.21 4.14 0.00 2.88 2.77 0.00 0.00 7.09 8.04 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 75 A 8.43 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 76 C 8.57 4.54 0.00 3.55 3.39 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 77 N 7.96 4.11 0.00 2.92 2.88 0.00 0.00 6.66 7.14 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 78 I 7.01 4.42 1.79 0.00 0.00 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 0.87 0.99 0.75 0.00 0.00 79 M 8.25 4.50 0.00 1.98 1.85 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.44 0.00 80 C 8.61 3.73 0.00 2.36 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 81 S 7.80 4.05 0.00 3.94 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 K 7.81 3.94 0.00 1.54 1.51 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.44 7.81 83 F 7.80 5.02 0.00 3.35 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.81 4.82 0.00 2.05 1.84 1.20 1.28 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 85 D 7.80 4.99 0.00 3.10 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 86 D 8.61 4.04 0.00 2.67 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 87 N 7.45 4.73 0.00 2.62 2.77 0.00 0.00 7.20 7.82 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 88 I 8.32 4.22 1.65 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.52 0.96 0.00 0.00 89 D 7.97 4.35 0.00 2.75 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 90 D 8.12 4.46 0.00 3.03 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 91 D 8.50 4.37 0.00 2.92 2.56 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 92 I 7.97 3.65 1.92 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 1.38 0.60 0.63 0.00 0.00 93 A 7.76 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 94 C 8.65 4.35 0.00 3.29 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 95 A 7.88 4.06 1.10 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 0.00 0.00 96 K 7.92 3.83 0.00 1.41 1.45 0.00 1.28 0.00 0.00 1.18 0.00 0.00 2.13 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.30 0.79 7.81 97 R 7.61 4.07 0.00 2.03 2.09 0.00 3.32 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.86 0.00 98 V 7.32 2.46 1.84 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 -0.30 0.00 0.00 -0.32 0.00 0.00 99 V 7.71 3.73 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.84 0.00 0.00 100 K 7.68 3.92 0.00 1.78 1.93 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.23 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.72 7.81 101 D 7.27 4.65 0.00 3.14 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 0.00 102 P 0.00 4.28 0.00 2.06 2.15 0.00 3.72 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 103 Q 8.27 4.10 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.87 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 104 G 7.74 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 0.00 105 M 8.79 3.94 0.00 0.51 0.57 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.82 0.00 106 S 8.00 4.95 0.00 4.19 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 0.00 107 A 7.58 4.04 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 7.89 4.65 0.00 3.56 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 0.00 109 V 8.58 3.57 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 1.06 0.00 0.00 0.94 0.00 0.00 110 A 8.00 4.12 1.64 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 0.00 0.00 111 W 8.42 4.10 0.00 3.31 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 0.00 112 V 7.60 3.14 2.16 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 0.80 0.00 0.00 1.19 0.00 0.00 113 K 7.72 4.03 0.00 1.39 1.64 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.62 7.81 114 H 7.50 4.58 0.00 2.55 1.82 0.00 5.60 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 0.00 115 C 7.29 4.46 0.00 2.12 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 0.00 116 K 7.07 2.93 0.00 0.79 1.34 0.00 1.85 0.00 0.00 1.49 0.00 0.00 2.79 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.19 1.05 7.81 117 G 7.45 3.64 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 0.00 0.00 0.00 118 K 7.05 4.11 0.00 1.68 1.63 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.50 7.81 119 D 8.29 4.56 0.00 2.61 2.60 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 0.00 120 L 8.22 4.60 0.00 1.76 1.67 0.81 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 121 S 8.13 4.25 0.00 4.01 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 0.00 122 K 7.95 4.44 0.00 1.84 1.90 0.00 1.75 0.00 0.00 1.78 0.00 0.00 2.87 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.47 1.36 7.81 123 Y 7.89 4.27 0.00 3.06 3.17 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 0.00 124 L 8.13 4.38 0.00 1.80 1.70 1.07 0.92 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 0.00 125 A 7.67 3.88 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 0.00 126 S 7.92 4.32 0.00 3.97 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 C 8.37 4.52 0.00 2.97 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 0.00 128 N 8.65 4.67 0.00 2.71 2.79 0.00 0.00 6.90 7.85 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 0.00 129 L 8.29 4.36 0.00 1.57 1.52 0.93 0.93 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