NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3805 8.3001 118.1890 54.6886 32.7385 175.1631 2 A 3.7483 8.3945 121.2988 53.5471 18.3825 177.5143 3 S 3.9374 8.1230 107.6472 59.0678 61.7898 171.8430 4 V 3.6043 7.3214 121.3888 64.0703 31.1067 176.2115 5 E 4.6820 7.6977 118.7739 54.5622 32.4781 174.9707 6 R 4.6310 9.0185 117.6996 56.0481 32.3815 174.2969 7 D 4.8797 8.0439 117.6313 52.0954 44.1213 175.6952 8 E 4.2028 8.7430 124.2012 58.0696 29.5441 179.1055 9 T 3.9818 8.4983 117.4426 67.0788 68.5197 176.4043 10 R 4.0230 8.0319 119.0649 59.2364 30.0982 178.8993 11 E 4.1531 8.2070 118.0796 59.7230 29.3639 178.8712 12 H 4.2851 8.2967 115.6263 58.8302 29.0998 177.8886 13 R 4.0500 8.4304 120.2380 59.3334 29.9184 178.9305 14 I 3.4498 7.9494 118.6272 63.9808 37.7021 177.3186 15 E 3.9751 8.0726 119.4990 58.8441 29.4893 177.9923 16 T 4.4842 7.4047 106.2488 61.5297 69.2922 174.5452 17 E 4.5032 7.8597 119.8800 56.2638 32.2261 175.8410 18 I 4.2533 7.9737 117.6182 61.2151 39.5083 175.9797 19 I 4.5493 7.2098 112.7622 60.2255 37.9719 177.7917 20 V 3.5237 8.1095 116.8831 65.2025 31.4083 176.6215 21 D 4.6502 7.9350 115.6357 53.6435 41.2610 175.3100 22 A 4.8491 7.6160 119.7734 51.0708 21.7435 176.1210 23 E 4.6288 9.5536 118.7055 54.9611 32.1275 175.7253 24 D 4.8558 7.6771 117.7194 51.1468 45.8720 175.5758 25 K 3.9158 8.7420 124.2910 60.4782 32.2100 179.1521 26 E 3.9990 8.8125 119.6415 59.3204 29.3802 179.1525 27 E 3.9968 8.0862 118.1281 59.5507 29.5550 179.5164 28 R 3.9458 8.3837 118.0824 58.7861 29.9165 178.8935 29 A 4.2586 8.4667 121.2166 55.6303 18.3198 179.6278 30 M 4.2632 8.1814 117.0671 58.2062 31.8916 179.2154 31 G 3.7424 8.4669 106.1332 47.6807 0.0000 175.5298 32 W 4.4552 8.6688 122.2397 59.6699 29.1040 177.8453 33 Y 3.8925 8.6078 119.4960 60.8734 38.2890 177.3617 34 Y 4.2535 8.6807 120.8543 61.1765 39.0949 177.9001 35 Y 3.7722 8.0220 118.2400 59.5888 38.0396 177.6685 36 L 3.1094 7.1280 122.0951 57.7699 41.9824 178.4456 37 D 4.0624 7.5256 116.8499 57.3169 41.1448 177.5022 38 D 4.3362 7.5887 117.3341 56.9834 41.1580 177.5774 39 T 4.2642 7.1603 114.7199 63.8931 69.1500 175.4942 40 L 3.8174 7.4883 121.4230 55.2109 42.1763 177.6426 41 E 4.1819 8.4332 127.5189 55.8033 29.1007 177.1510 42 F 4.7592 7.7006 113.3148 55.9689 39.0329 173.5318 43 P 4.9164 0.0000 0.0000 63.1674 32.2042 175.6182 44 F 5.1221 8.7852 113.7504 56.2791 41.4483 172.5054 45 M 5.0862 8.7257 114.2876 54.5644 35.3930 173.9158 46 G 4.5051 8.6949 105.2861 45.8735 0.0000 171.5313 47 K 5.0318 8.8718 121.5088 54.0930 34.7432 175.1693 48 W 4.7901 9.4061 135.0000 56.4666 31.2650 176.4734 49 K 4.8227 8.5734 132.1967 55.6455 30.8155 178.2930 50 K 4.1447 7.8005 122.4234 57.3567 32.9424 177.5397 51 K 4.3531 8.4852 127.6037 57.6653 32.6473 178.2287 52 S 4.1784 7.8971 111.1758 59.6426 62.4762 174.2199 53 R 3.9928 7.7288 122.0547 55.8484 30.4062 177.2382 54 K 3.7935 8.6670 123.8877 59.7747 32.4731 177.6902 55 T 4.1089 7.8761 106.2305 61.4496 69.1906 175.2922 56 S 3.9127 8.1701 116.8942 59.6767 61.2701 172.3982 57 T 4.1110 7.1937 115.5866 63.1511 68.7394 174.5667 58 I 4.1008 8.1376 125.3669 61.7805 37.8479 175.2387 59 E 4.7761 9.3337 124.5982 54.5741 33.8708 175.0179 60 E 4.9100 8.7115 120.5867 54.7440 32.5273 175.0036 61 K 4.5319 8.7782 127.1930 54.4843 34.6729 175.4674 62 T 4.6010 8.5377 124.7510 63.8951 69.6664 173.9217 63 V 5.0178 8.9694 118.6958 59.6672 36.6848 173.8045 64 E 4.5967 8.9508 125.1061 54.9936 31.4039 174.8575 65 V 4.2077 8.1659 127.9841 61.3879 31.9595 176.3085 66 L 3.9827 8.7774 130.0896 55.6003 42.4982 177.9539 67 G 3.5962 7.6029 105.4888 44.2916 0.0000 171.0640 68 M 4.5795 6.9695 119.0162 55.0522 32.4450 176.8791 69 A 4.2976 8.4562 124.0102 50.8158 19.9890 175.4734 70 P 4.2911 0.0000 0.0000 63.3214 31.8894 177.9331 71 D 3.4467 8.7773 123.4727 56.3937 38.7851 178.4454 72 D 4.2801 7.8960 118.0738 56.9900 41.0182 177.3552 73 E 4.2207 8.1867 118.8019 58.2534 29.6493 177.2045 74 C 5.4509 7.5841 117.6288 59.2465 28.5101 175.1940 75 L 4.3399 7.5679 120.7135 56.2599 41.3932 178.0125 76 K 4.7913 7.8383 114.0013 57.1641 35.3262 175.9929 77 D 4.7656 7.7089 116.5245 52.9554 44.0876 174.0352 78 M 4.2588 7.4558 124.6254 55.0437 30.6328 175.1002 79 Y 4.7005 8.0885 120.4218 57.7034 40.1373 174.5749 80 V 4.8478 8.7948 114.4631 59.6645 36.3474 174.8007 81 E 4.7073 8.7603 123.5541 56.2800 31.0189 176.2230 82 V 4.9241 8.9425 115.7367 59.7135 36.6930 173.8901 83 A 5.1744 8.8783 125.8614 48.8814 21.6144 176.7562 84 D 5.0652 8.4539 123.2892 52.9107 39.9039 177.1184 85 I 4.0345 7.6391 114.0747 63.3420 38.1155 177.9279 86 G 3.9600 8.1844 108.7547 46.1782 0.0000 173.7408 87 G 4.2453 8.0135 109.5991 45.9135 0.0000 174.4986 88 K 3.9856 6.3913 123.4086 57.5099 33.1664 179.7809 89 D 4.4547 8.4759 117.9874 55.2527 41.8421 173.4684 90 D 4.8328 8.2892 115.2521 53.6798 41.5873 174.2648 91 D 4.8989 7.6431 116.4988 52.9882 45.4228 173.7726 92 V 4.7691 7.8062 120.0150 61.6078 34.9922 173.8869 93 Y 4.8678 9.1378 122.4203 57.2320 42.7066 173.6751 94 T 5.1554 8.7932 114.7829 62.3427 71.9178 173.6709 95 A 4.2539 8.7349 125.1745 49.6650 23.3258 175.6083 96 K 4.0822 8.1825 118.9687 55.6585 33.0530 178.4973 97 L 3.8961 8.5624 126.1776 58.1386 42.1520 178.9897 98 S 4.3637 8.3253 113.3485 60.9113 63.0744 174.0230 99 D 5.0708 8.3326 118.8472 53.6250 42.6254 174.7392 100 I 5.1765 8.0200 116.5073 59.2790 41.0302 174.5116 101 E 4.7227 9.0401 124.7458 54.2886 32.1152 174.9122 102 A 4.9214 8.8323 129.1113 52.0416 18.5543 176.4143 103 I 4.5309 8.6668 121.5841 60.0038 41.4781 175.2426 104 D 4.5348 8.8264 123.5512 55.2852 39.6209 173.3734 105 V 4.3651 6.8493 115.2642 59.0282 34.0103 175.2430 106 D 4.4560 8.1031 118.6880 53.9600 42.9202 176.0555 107 D 4.2960 8.6089 123.6258 57.7761 41.2636 178.3427 108 D 4.3496 8.6673 118.3796 57.1357 41.1593 178.5031 109 T 3.6572 7.6534 116.1063 66.4995 68.5603 176.2047 110 Q 3.8963 8.1805 121.7436 59.3797 28.9803 178.3136 111 E 4.0057 8.5734 119.6745 59.2663 29.4770 179.2319 112 A 4.1112 7.9926 120.8420 55.1888 18.4717 179.8185 113 I 3.7282 7.9053 118.0883 64.4954 37.1916 178.4534 114 A 3.6106 8.2664 122.0365 55.1694 18.0483 179.2384 115 D 4.4885 8.4347 116.7646 57.0089 41.2293 178.2053 116 W 4.2738 8.5913 129.0945 60.5147 30.7458 177.9384 117 L 3.6441 7.9172 118.7846 57.9379 40.9709 179.1713 118 Y 4.3547 8.1410 117.0382 60.8079 37.8147 178.3469 119 W 4.2071 8.6515 129.6022 60.5003 30.6202 177.7514 120 L 3.3279 7.3691 118.6516 57.8634 41.4659 178.4747 121 A 3.9724 7.6351 119.6933 55.0515 18.3826 179.3761 122 R 3.9721 8.1418 116.7647 56.0342 30.2656 176.2012 123 G 4.0044 6.0880 115.3557 44.9573 0.0000 173.1503 124 Y 4.2758 7.7021 129.0267 56.8692 37.0971 175.0673 125 K 4.0397 7.0675 122.5184 58.9942 33.1272 177.6491 126 F 4.2995 7.5192 117.1109 57.3439 37.2338 173.5886 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 4.38 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 2 A 8.39 3.75 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.12 3.94 0.00 3.97 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 4 V 7.32 3.60 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 0.69 0.00 0.00 0.81 0.00 0.00 5 E 7.70 4.68 0.00 1.87 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 0.00 2.25 2.36 0.00 6 R 9.02 4.63 0.00 1.84 1.90 0.00 3.03 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 7 D 8.04 4.88 0.00 2.60 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.74 4.20 0.00 2.11 1.86 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 2.39 2.41 0.00 9 T 8.50 3.98 4.29 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 1.24 0.00 0.00 10 R 8.03 4.02 0.00 2.10 2.10 0.00 3.22 0.00 0.00 3.38 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.85 0.00 11 E 8.21 4.15 0.00 2.17 2.12 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 2.70 2.52 0.00 12 H 8.30 4.29 0.00 3.29 3.36 0.00 5.66 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.43 4.05 0.00 1.93 1.94 0.00 3.30 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.78 0.00 14 I 7.95 3.45 1.84 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.03 0.95 0.00 0.00 15 E 8.07 3.98 0.00 2.18 2.28 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 2.40 2.41 0.00 16 T 7.40 4.48 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 1.26 0.00 0.00 17 E 7.86 4.50 0.00 1.87 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 2.04 2.22 0.00 18 I 7.97 4.25 1.49 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.38 0.24 0.00 0.00 19 I 7.21 4.55 1.70 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.08 0.85 0.00 0.00 20 V 8.11 3.52 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.88 0.00 0.00 21 D 7.94 4.65 0.00 2.55 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 22 A 7.62 4.85 1.07 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 0.00 0.00 23 E 9.55 4.63 0.00 1.84 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 2.19 2.17 0.00 24 D 7.68 4.86 0.00 2.71 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 0.00 0.00 0.00 0.00 25 K 8.74 3.92 0.00 2.13 2.17 0.00 1.59 0.00 0.00 1.85 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.61 7.81 26 E 8.81 4.00 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 27 E 8.09 4.00 0.00 2.10 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 2.38 2.39 0.00 28 R 8.38 3.95 0.00 1.56 1.53 0.00 2.25 0.00 0.00 2.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.55 0.00 29 A 8.47 4.26 1.59 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 30 M 8.18 4.26 0.00 2.06 2.30 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 2.60 2.87 0.00 31 G 8.47 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 W 8.67 4.46 0.00 3.78 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 Y 8.61 3.89 0.00 3.13 3.25 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 0.00 34 Y 8.68 4.25 0.00 3.29 3.37 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 35 Y 8.02 3.77 0.00 3.07 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 36 L 7.13 3.11 0.00 1.24 1.47 0.74 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 37 D 7.53 4.06 0.00 1.91 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 D 7.59 4.34 0.00 2.40 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.16 4.26 4.19 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 1.25 0.00 0.00 40 L 7.49 3.82 0.00 1.80 1.75 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 41 E 8.43 4.18 0.00 1.83 1.85 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 2.37 2.29 0.00 42 F 7.70 4.76 0.00 3.34 3.25 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 0.00 43 P 0.00 4.92 0.00 2.27 2.21 0.00 3.78 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.03 0.00 44 F 8.79 5.12 0.00 3.04 3.11 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 0.00 0.00 0.00 0.00 45 M 8.73 5.09 0.00 2.07 2.26 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.58 0.00 46 G 8.69 4.51 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 0.00 47 K 8.87 5.03 0.00 1.89 1.72 0.00 1.46 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.46 7.81 48 W 9.41 4.79 0.00 3.37 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 49 K 8.57 4.82 0.00 1.81 1.86 0.00 1.86 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.70 1.60 7.81 50 K 7.80 4.14 0.00 0.82 1.35 0.00 1.08 0.00 0.00 1.18 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.27 1.15 7.81 51 K 8.49 4.35 0.00 1.90 1.78 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.44 7.81 52 S 7.90 4.18 0.00 3.81 3.85 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 53 R 7.73 3.99 0.00 1.80 1.83 0.00 3.24 0.00 0.00 3.06 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.52 0.00 54 K 8.67 3.79 0.00 1.72 1.81 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.43 7.81 55 T 7.88 4.11 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 1.19 0.00 0.00 56 S 8.17 3.91 0.00 4.02 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 57 T 7.19 4.11 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 1.20 0.00 0.00 58 I 8.14 4.10 1.87 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 1.35 0.75 0.98 0.00 0.00 59 E 9.33 4.78 0.00 1.70 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 2.15 2.17 0.00 60 E 8.71 4.91 0.00 1.80 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 2.22 2.27 0.00 61 K 8.78 4.53 0.00 1.70 1.65 0.00 1.53 0.00 0.00 1.75 0.00 0.00 2.65 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.40 1.41 7.81 62 T 8.54 4.60 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 63 V 8.97 5.02 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 1.09 0.00 0.00 0.99 0.00 0.00 64 E 8.95 4.60 0.00 2.04 1.79 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 2.20 2.34 0.00 65 V 8.17 4.21 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 0.53 0.00 0.00 0.42 0.00 0.00 66 L 8.78 3.98 0.00 1.56 1.64 0.91 1.10 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 67 G 7.60 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 68 M 6.97 4.58 0.00 1.84 1.77 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 69 A 8.46 4.30 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 70 P 0.00 4.29 0.00 2.02 1.97 0.00 3.70 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 2.07 2.08 0.00 71 D 8.78 3.45 0.00 2.04 2.17 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 72 D 7.90 4.28 0.00 2.61 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 E 8.19 4.22 0.00 2.07 1.60 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 2.16 2.23 0.00 74 C 7.58 5.45 0.00 2.99 3.11 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 0.00 0.00 0.00 0.00 75 L 7.57 4.34 0.00 1.70 1.78 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 76 K 7.84 4.79 0.00 2.15 2.02 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.25 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.71 1.60 7.81 77 D 7.71 4.77 0.00 2.60 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 0.00 0.00 0.00 78 M 7.46 4.26 0.00 1.27 0.57 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.81 0.00 79 Y 8.09 4.70 0.00 2.89 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 80 V 8.79 4.85 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 0.69 0.00 0.00 0.80 0.00 0.00 81 E 8.76 4.71 0.00 1.84 1.79 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 2.26 2.23 0.00 82 V 8.94 4.92 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 0.53 0.00 0.00 0.86 0.00 0.00 83 A 8.88 5.17 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 84 D 8.45 5.07 0.00 2.93 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 85 I 7.64 4.03 1.89 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 1.40 0.73 0.98 0.00 0.00 86 G 8.18 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 G 8.01 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 0.00 0.00 0.00 0.00 88 K 6.39 3.99 0.00 1.95 1.98 0.00 1.91 0.00 0.00 1.61 0.00 0.00 2.86 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.72 1.74 7.81 89 D 8.48 4.45 0.00 2.76 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 90 D 8.29 4.83 0.00 2.62 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 91 D 7.64 4.90 0.00 2.75 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 0.00 0.00 0.00 0.00 92 V 7.81 4.77 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.88 0.00 0.00 93 Y 9.14 4.87 0.00 2.99 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 94 T 8.79 5.16 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 1.21 0.00 0.00 95 A 8.73 4.25 -0.34 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 96 K 8.18 4.08 0.00 1.80 1.61 0.00 1.75 0.00 0.00 1.95 0.00 0.00 3.33 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.29 7.81 97 L 8.56 3.90 0.00 1.64 1.58 1.01 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 98 S 8.33 4.36 0.00 3.92 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 99 D 8.33 5.07 0.00 2.83 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 0.00 100 I 8.02 5.18 1.91 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.45 0.93 0.00 0.00 101 E 9.04 4.72 0.00 2.05 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 2.24 2.27 0.00 102 A 8.83 4.92 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 0.00 103 I 8.67 4.53 1.94 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 1.16 1.18 0.96 0.00 0.00 104 D 8.83 4.53 0.00 2.78 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 0.00 105 V 6.85 4.37 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 0.63 0.00 0.00 0.60 0.00 0.00 106 D 8.10 4.46 0.00 2.75 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 D 8.61 4.30 0.00 2.82 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 D 8.67 4.35 0.00 2.79 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 0.00 109 T 7.65 3.66 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 0.55 0.00 0.00 110 Q 8.18 3.90 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.78 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 111 E 8.57 4.01 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 112 A 7.99 4.11 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 0.00 113 I 7.91 3.73 1.99 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.89 0.98 0.00 0.00 114 A 8.27 3.61 1.03 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 0.00 115 D 8.43 4.49 0.00 3.04 3.07 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 0.00 116 W 8.59 4.27 0.00 3.62 3.27 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 0.00 117 L 7.92 3.64 0.00 1.70 1.62 0.93 0.72 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 0.00 118 Y 8.14 4.35 0.00 3.18 2.95 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 0.00 119 W 8.65 4.21 0.00 3.73 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 0.00 120 L 7.37 3.33 0.00 0.47 1.23 0.47 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 121 A 7.64 3.97 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 0.00 122 R 8.14 3.97 0.00 1.81 1.94 0.00 3.42 0.00 0.00 3.21 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.48 0.00 123 G 6.09 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 0.00 0.00 0.00 124 Y 7.70 4.28 0.00 2.64 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 0.00 125 K 7.07 4.04 0.00 1.42 1.91 0.00 1.59 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.28 0.95 7.81 126 F 7.52 4.30 0.00 3.19 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