NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 R 4.2887 8.2393 119.7025 55.3673 31.4972 175.2372 10 P 4.3055 0.0000 0.0000 62.1930 32.1821 172.9880 11 E 4.2609 8.7078 117.7731 56.9875 30.9013 177.2630 12 I 4.4074 7.0264 117.6521 59.7016 40.9110 173.5002 13 V 4.3955 7.6572 118.7262 60.4221 35.6104 175.8136 14 G 4.2586 8.7354 107.5157 44.5276 0.0000 171.7244 15 P 4.6186 0.0000 0.0000 62.0979 32.0938 177.3417 16 E 4.3985 8.9256 118.8036 58.5971 29.6138 177.8415 17 K 4.7493 7.3618 116.3976 53.7757 35.0473 176.1777 18 V 3.3733 7.9359 122.4566 63.5260 32.1088 175.4911 19 Q 4.7128 8.4750 124.6871 53.4211 32.4557 174.8298 20 S 4.4223 8.6935 115.3119 58.3639 63.0931 172.8208 21 P 4.3203 0.0000 0.0000 63.6593 31.3292 175.9061 22 Y 4.5801 6.6606 116.9642 57.2308 38.5916 173.7084 23 P 4.7271 0.0000 0.0000 62.7552 32.9557 175.4866 24 I 4.3990 8.4780 122.6650 59.8673 39.3641 174.6599 25 R 5.0260 8.1773 126.3913 54.5634 32.0959 175.4621 26 F 5.0223 8.3849 116.5352 56.4588 41.6793 172.3185 27 E 5.2680 9.2073 116.4360 55.1758 32.6394 174.7179 28 G 4.4124 9.0455 107.0552 45.2712 0.0000 171.9017 29 K 4.9301 8.6281 122.4450 55.3868 34.3317 175.8362 30 V 4.4451 8.9074 127.6263 62.9207 32.3543 175.3157 31 V 5.0124 8.5003 120.6048 59.4562 35.2917 175.1749 32 H 4.7643 9.0364 119.0268 56.1333 30.3285 178.2802 33 G 4.3727 8.1108 108.6616 45.9413 0.0000 176.6613 34 F 4.8156 10.2482 119.9614 55.9775 39.3425 174.4429 35 G 3.0612 7.2659 112.7846 44.9009 0.0000 174.1866 36 R 3.8419 6.0369 122.1734 54.7998 29.0404 176.4230 37 G 4.0150 8.0542 114.2398 44.6836 0.0000 170.8077 38 S 4.1340 7.8107 119.4082 61.6570 63.4123 176.3144 39 K 3.7702 8.0351 121.8815 59.4774 31.9552 177.6568 40 E 4.1799 8.0627 118.4369 58.4343 29.4911 177.4599 41 L 4.4291 7.4315 116.0679 54.6269 41.6242 177.8907 42 G 3.9746 7.8730 107.4815 45.7508 0.0000 174.4262 43 I 4.5478 7.4570 111.6448 58.1022 37.1289 173.4139 44 P 4.5488 0.0000 0.0000 63.9110 32.1406 177.4738 45 T 4.9022 8.6483 113.8377 59.7144 71.6708 173.0429 46 A 4.4817 9.1761 127.1832 50.8766 20.7989 175.9121 47 N 4.9961 8.7771 120.5496 52.8612 40.2634 174.4008 48 I 4.7584 8.4086 124.6708 59.9212 38.9462 175.8251 49 S 4.2075 9.0079 121.5639 58.9099 62.6255 174.9988 50 E 4.0118 9.2899 125.8736 59.7800 28.8788 178.9463 51 D 4.4037 8.1416 117.9926 55.5279 39.5257 177.3832 52 A 4.3973 7.8989 121.0700 52.6125 19.5033 177.4203 53 I 4.0339 7.2987 108.8274 60.1263 39.0092 177.3007 54 Q 3.8671 7.8998 120.7446 59.6718 28.8485 178.6866 55 E 4.0406 7.9190 117.8418 58.8065 30.2013 177.8400 56 L 4.0078 7.8813 119.6642 57.2194 42.4442 177.1319 57 L 4.4473 7.7149 115.8754 54.0057 42.5023 177.9003 58 R 3.7346 7.3823 118.9576 59.1140 29.8726 176.7654 59 Y 4.8050 7.7052 111.9047 57.7087 38.3241 175.3414 60 R 4.6042 7.4955 118.9207 54.3824 31.7868 176.2998 61 D 4.5207 8.4706 120.5288 54.5742 41.3633 177.0299 62 S 4.4063 8.4178 119.0760 58.6278 64.1112 174.4476 63 G 3.7374 7.7450 108.3459 44.5627 0.0000 171.7822 64 V 4.9148 8.2119 121.0567 61.4785 33.8559 176.0737 65 Y 5.2209 9.4554 124.9920 56.1929 41.9461 174.0731 66 F 5.3535 9.0890 114.4485 54.9820 41.8684 174.9216 67 G 4.1249 7.3941 105.3315 46.7461 0.0000 171.0083 68 Y 5.4180 8.1592 119.6853 56.6201 42.5489 174.5547 69 A 5.2755 8.6669 120.4251 51.3734 23.3886 175.0837 70 M 5.5482 9.3524 119.8241 52.7194 35.9817 174.7045 71 V 4.5312 8.0949 122.8490 60.9448 35.1336 174.0413 72 Q 3.4738 9.4361 119.6841 57.1403 26.2856 174.3302 73 K 3.8614 8.3334 111.8888 57.0567 29.9036 175.5995 74 R 4.4349 7.8145 117.5943 54.2095 33.4562 174.6651 75 V 4.2984 7.5768 122.2239 61.2477 33.2860 174.8535 76 F 5.1664 8.8774 125.1652 54.9571 43.6941 172.6023 77 P 5.0426 0.0000 0.0000 63.5746 33.1787 174.4307 78 M 5.1158 8.4829 116.7512 54.9776 35.1147 173.5632 79 V 5.0720 8.4546 111.1024 59.9261 36.2915 174.7910 80 M 5.3584 9.1383 121.8762 54.3014 36.0736 173.7116 81 S 5.3340 9.1415 122.0831 56.9886 65.5673 173.1365 82 V 4.7201 9.1377 124.8585 61.3819 34.0457 174.5363 83 G 3.7812 8.6879 114.9987 45.2261 0.0000 170.8160 84 W 5.4171 8.5214 119.0318 54.5019 32.4107 175.3365 85 N 4.5844 9.5744 123.2094 53.1617 38.8929 173.9628 86 P 4.1951 0.0000 0.0000 64.4010 31.8940 176.3847 87 Y 4.4145 7.7607 115.9984 58.7942 38.2718 174.9622 88 Y 4.7545 7.3482 116.7395 55.9178 42.0689 175.3911 89 K 4.0101 8.8437 124.7586 59.2145 32.6483 176.8795 90 N 4.2755 8.1619 116.3888 52.8134 38.3336 174.1766 91 K 3.5807 8.5444 123.6393 56.9144 32.2842 175.8614 92 L 4.8734 8.6182 126.0378 52.9162 44.6534 175.5783 93 R 4.3296 8.2698 127.7282 56.3187 30.9104 175.7054 94 S 4.8791 8.7550 118.5299 56.6873 67.0563 172.6741 95 A 5.2482 8.4121 122.4574 50.4872 22.7230 174.6393 96 E 5.2003 9.3396 119.9431 54.4813 33.1034 174.8010 97 V 4.8878 9.1483 123.5084 61.2958 34.8935 173.4188 98 H 5.1224 8.9704 127.3257 54.2826 32.0479 172.8032 99 L 4.5022 8.2759 126.3962 54.2365 42.2237 176.7396 100 I 3.8732 8.6318 126.2849 61.3957 37.8265 176.2021 101 E 3.7570 8.5912 126.1684 57.4890 27.0604 174.4567 102 R 4.5545 7.6305 116.2989 54.5448 32.1270 174.7674 103 Q 4.5156 9.5178 122.5835 52.8110 31.5145 175.5475 104 G 4.0288 8.1444 111.2427 44.9683 0.0000 171.0090 105 E 4.2512 8.1087 118.0004 55.3943 30.3914 176.0443 106 D 4.3657 8.2576 119.5203 54.3852 41.7616 176.1526 107 F 5.0375 6.7840 113.0696 56.2264 37.8845 174.4818 108 Y 4.2005 7.6650 117.5083 60.3676 38.5409 176.7518 109 E 3.9698 9.5125 121.9585 56.8287 28.1167 174.2089 110 E 4.6878 7.8049 119.1302 55.1101 31.9002 175.3376 111 I 4.4690 8.2810 123.5977 61.2123 38.1965 174.8262 112 M 4.7604 9.2368 127.7666 53.8693 34.6471 174.4837 113 R 5.0011 8.6161 124.6594 54.5663 32.8034 175.3529 114 V 4.8828 9.1113 123.4267 61.0736 35.0918 174.3850 115 I 4.8627 8.9714 127.2643 59.5711 40.4907 174.5284 116 V 4.3110 8.8812 128.8095 62.2060 32.3092 176.1916 117 L 4.3473 8.2057 126.6299 53.9106 43.6656 176.2540 118 G 2.8732 5.9088 105.2462 45.6387 0.0000 171.1406 119 Y 4.6237 7.7719 121.1078 56.2231 40.4207 175.5582 120 I 3.8745 8.1872 128.6763 62.0568 38.3788 175.9946 121 R 4.1203 6.1022 113.6957 54.4112 31.6691 172.2854 122 P 5.5075 0.0000 0.0000 61.0095 32.6014 175.5371 123 E 4.1693 8.5323 118.3661 56.2541 29.9405 176.7960 124 L 4.6142 8.1979 123.1000 52.7547 43.3962 176.2755 125 N 4.3526 8.6256 119.7405 52.8105 37.5608 174.0432 126 Y 4.1629 8.8718 123.3913 58.5147 38.8930 175.6803 127 A 4.4114 8.2118 130.3748 52.0729 20.0676 175.4068 128 G 3.5923 6.3828 104.9232 45.8342 0.0000 175.7546 129 L 3.9729 8.5079 119.5117 58.3078 42.1936 178.3315 130 D 4.3709 8.1311 118.3509 57.5439 40.6641 178.9946 131 K 3.8910 7.8391 119.2465 59.2255 32.3159 178.2972 132 L 3.9521 7.7186 120.3674 58.4338 42.0175 179.0565 133 I 3.6129 8.0660 119.9487 64.1999 36.9827 178.0897 134 E 3.8967 8.0116 120.0043 59.4945 29.4572 178.6094 135 D 4.3602 8.3068 119.1357 57.4420 40.8341 178.9588 136 I 3.8394 7.7828 120.3634 64.5900 37.0712 178.2246 137 H 4.2878 8.0546 117.0855 59.1609 28.4578 178.0234 138 T 3.8484 8.0440 117.5015 66.7656 68.2524 176.2739 139 D 4.3148 8.3334 121.0573 57.5572 40.7741 179.2384 140 I 3.6868 7.7937 120.0719 64.3344 37.1520 178.4056 141 R 3.8164 8.0353 119.5920 59.4926 29.8079 178.7682 142 V 3.8330 8.3379 119.4861 65.0881 31.4471 177.8984 143 A 3.2816 7.9386 120.6471 54.9616 18.0519 179.5269 144 L 3.8629 7.6185 116.0112 57.9959 42.0970 179.2658 145 N 4.3878 7.9599 116.2510 56.5562 38.0882 177.7239 146 S 3.8278 7.9174 116.5151 61.0278 62.4793 175.6187 147 M 4.5673 7.3113 118.6779 55.2669 32.0535 176.6162 148 D 4.5009 7.6122 119.3175 56.2023 41.9533 176.6683 149 R 4.2513 7.5495 119.3850 55.3541 31.0160 175.1851 150 P 4.3693 0.0000 0.0000 65.5952 31.1905 178.4882 151 S 4.2058 8.3481 109.5001 61.4330 62.4291 175.4263 152 Y 4.4439 8.6552 119.6139 60.8814 37.6049 177.9194 153 S 5.1225 8.8205 116.1989 61.0742 62.8718 176.4148 154 S 4.1755 8.3288 117.6515 61.2498 62.6183 175.5116 155 Y 4.1490 8.3516 119.3954 59.2826 37.4348 177.1500 156 K 3.8425 7.8154 120.4195 57.6132 32.2044 176.9784 157 K 4.5829 7.4668 116.8710 56.3023 33.0189 175.6130 158 D 4.3800 7.9794 119.7164 53.7439 41.7540 175.5012 159 P 4.2923 0.0000 0.0000 65.7725 31.5148 178.2919 160 F 4.1321 8.2620 119.2159 60.7094 39.1964 175.5646 161 F 4.8353 8.3299 117.2520 57.5232 39.4164 175.6831 162 K 4.1478 8.5170 127.7929 56.4256 31.9116 175.8512 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 9 R 8.24 4.29 0.00 1.79 1.90 0.00 3.14 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 10 P 0.00 4.31 0.00 2.39 2.02 0.00 3.72 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.02 0.00 11 E 8.71 4.26 0.00 1.97 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 0.00 2.33 2.19 0.00 12 I 7.03 4.41 1.76 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 1.29 0.43 0.85 0.00 0.00 13 V 7.66 4.40 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 0.67 0.00 0.00 0.95 0.00 0.00 14 G 8.74 4.26 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 0.00 15 P 0.00 4.62 0.00 2.45 2.31 0.00 3.96 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.25 0.00 16 E 8.93 4.40 0.00 2.06 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 2.39 2.40 0.00 17 K 7.36 4.75 0.00 1.87 1.73 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.41 7.81 18 V 7.94 3.37 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 0.54 0.00 0.00 0.07 0.00 0.00 19 Q 8.48 4.71 0.00 2.21 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.71 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 20 S 8.69 4.42 0.00 3.87 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 21 P 0.00 4.32 0.00 1.92 1.96 0.00 2.87 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.59 0.00 22 Y 6.66 4.58 0.00 2.95 2.89 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 23 P 0.00 4.73 0.00 1.84 1.32 0.00 3.70 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.07 0.00 24 I 8.48 4.40 1.94 0.00 0.00 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 1.15 0.81 0.94 0.00 0.00 25 R 8.18 5.03 0.00 1.13 0.66 0.00 2.84 0.00 0.00 2.49 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.35 0.00 26 F 8.38 5.02 0.00 3.09 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 27 E 9.21 5.27 0.00 2.00 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 2.42 2.46 0.00 28 G 9.05 4.41 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 0.00 29 K 8.63 4.93 0.00 1.93 1.75 0.00 1.78 0.00 0.00 1.88 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.62 7.81 30 V 8.91 4.45 2.40 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 0.76 0.00 0.00 1.25 0.00 0.00 31 V 8.50 5.01 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 0.85 0.00 0.00 1.10 0.00 0.00 32 H 9.04 4.76 0.00 3.05 3.23 0.00 5.87 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 33 G 8.11 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 0.00 0.00 0.00 0.00 34 F 10.25 4.82 0.00 3.24 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 35 G 7.27 3.06 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 0.00 36 R 6.04 3.84 0.00 1.09 1.48 0.00 3.38 0.00 0.00 3.30 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 37 G 8.05 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 0.00 0.00 0.00 38 S 7.81 4.13 0.00 4.26 4.13 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 39 K 8.04 3.77 0.00 1.72 1.88 0.00 1.68 0.00 0.00 1.60 0.00 0.00 3.18 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.48 7.81 40 E 8.06 4.18 0.00 2.06 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 2.36 2.39 0.00 41 L 7.43 4.43 0.00 1.83 1.68 0.95 0.92 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 42 G 7.87 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 0.00 0.00 0.00 43 I 7.46 4.55 1.80 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.75 0.83 0.00 0.00 44 P 0.00 4.55 0.00 2.04 2.07 0.00 3.80 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 2.05 1.97 0.00 45 T 8.65 4.90 4.30 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 1.31 0.00 0.00 46 A 9.18 4.48 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 47 N 8.78 5.00 0.00 3.06 2.86 0.00 0.00 7.10 7.43 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 48 I 8.41 4.76 2.00 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 1.41 0.55 1.11 0.00 0.00 49 S 9.01 4.21 0.00 4.10 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 50 E 9.29 4.01 0.00 2.22 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 0.00 2.38 2.38 0.00 51 D 8.14 4.40 0.00 2.86 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 52 A 7.90 4.40 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 53 I 7.30 4.03 1.55 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 1.20 0.78 0.45 0.00 0.00 54 Q 7.90 3.87 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.96 0.00 0.00 0.00 0.00 0.00 2.60 2.30 0.00 55 E 7.92 4.04 0.00 1.89 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 2.30 2.37 0.00 56 L 7.88 4.01 0.00 1.49 1.42 0.86 0.71 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 57 L 7.71 4.45 0.00 1.56 1.37 0.62 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 58 R 7.38 3.73 0.00 1.94 1.56 0.00 2.83 0.00 0.00 2.91 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.43 0.00 59 Y 7.71 4.80 0.00 3.01 2.92 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 60 R 7.50 4.60 0.00 1.84 1.88 0.00 3.29 0.00 0.00 3.21 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 61 D 8.47 4.52 0.00 2.32 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 8.42 4.41 0.00 3.98 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 63 G 7.75 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 64 V 8.21 4.91 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 0.93 0.00 0.00 0.90 0.00 0.00 65 Y 9.46 5.22 0.00 2.96 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 66 F 9.09 5.35 0.00 3.10 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 67 G 7.39 4.12 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 0.00 0.00 0.00 68 Y 8.16 5.42 0.00 3.38 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 69 A 8.67 5.28 1.25 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 70 M 9.35 5.55 0.00 1.90 1.24 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 2.49 2.15 0.00 71 V 8.09 4.53 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 -0.24 0.00 0.00 0.57 0.00 0.00 72 Q 9.44 3.47 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.67 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 73 K 8.33 3.86 0.00 1.86 1.85 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.28 1.41 7.81 74 R 7.81 4.43 0.00 1.69 1.11 0.00 3.13 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.48 0.00 75 V 7.58 4.30 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.25 0.00 0.00 76 F 8.88 5.17 0.00 2.96 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 77 P 0.00 5.04 0.00 2.12 2.28 0.00 3.98 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.09 0.00 78 M 8.48 5.12 0.00 2.20 2.33 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 2.60 2.62 0.00 79 V 8.45 5.07 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 0.79 0.00 0.00 1.01 0.00 0.00 80 M 9.14 5.36 0.00 2.19 1.95 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.61 0.00 81 S 9.14 5.33 0.00 3.86 3.80 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 82 V 9.14 4.72 2.27 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 0.88 0.00 0.00 0.89 0.00 0.00 83 G 8.69 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 84 W 8.52 5.42 0.00 3.13 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 85 N 9.57 4.58 0.00 2.85 2.89 0.00 0.00 7.00 7.57 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 86 P 0.00 4.20 0.00 1.80 1.88 0.00 3.37 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 1.32 0.00 87 Y 7.76 4.41 0.00 3.14 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 88 Y 7.35 4.75 0.00 3.09 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 89 K 8.84 4.01 0.00 1.70 1.85 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.49 7.81 90 N 8.16 4.28 0.00 2.79 2.79 0.00 0.00 6.88 7.61 0.00 0.00 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 K 8.54 3.58 0.00 1.49 1.06 0.00 1.36 0.00 0.00 0.87 0.00 0.00 2.47 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.77 1.15 7.81 92 L 8.62 4.87 0.00 1.88 1.62 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.27 4.33 0.00 1.67 1.74 0.00 2.57 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.24 0.00 94 S 8.75 4.88 0.00 3.90 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 95 A 8.41 5.25 1.21 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 0.00 0.00 96 E 9.34 5.20 0.00 2.08 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 2.35 2.28 0.00 97 V 9.15 4.89 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 1.05 0.00 0.00 1.04 0.00 0.00 98 H 8.97 5.12 0.00 3.32 3.18 0.00 5.83 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.28 4.50 0.00 1.18 1.04 0.42 0.91 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 0.00 100 I 8.63 3.87 2.08 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 1.26 0.41 0.95 0.00 0.00 101 E 8.59 3.76 0.00 2.15 2.04 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 2.25 2.31 0.00 102 R 7.63 4.55 0.00 0.67 1.36 0.00 2.21 0.00 0.00 2.91 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.03 0.00 103 Q 9.52 4.52 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 104 G 8.14 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 0.00 105 E 8.11 4.25 0.00 2.12 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 0.00 2.32 2.39 0.00 106 D 8.26 4.37 0.00 2.65 2.33 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 0.00 107 F 6.78 5.04 0.00 3.15 3.34 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 0.00 108 Y 7.67 4.20 0.00 2.99 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 0.00 109 E 9.51 3.97 0.00 2.18 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 2.34 2.48 0.00 110 E 7.80 4.69 0.00 2.14 1.91 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 2.54 2.60 0.00 111 I 8.28 4.47 1.87 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 1.27 0.77 0.92 0.00 0.00 112 M 9.24 4.76 0.00 2.08 1.88 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.44 0.00 113 R 8.62 5.00 0.00 1.77 1.47 0.00 2.62 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.33 0.00 114 V 9.11 4.88 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 0.88 0.00 0.00 0.71 0.00 0.00 115 I 8.97 4.86 2.12 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.50 0.81 0.00 0.00 116 V 8.88 4.31 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 0.97 0.00 0.00 1.03 0.00 0.00 117 L 8.21 4.35 0.00 1.17 1.50 1.20 -0.02 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 0.00 118 G 5.91 2.87 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 0.00 0.00 0.00 119 Y 7.77 4.62 0.00 3.01 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 0.00 120 I 8.19 3.87 1.80 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 1.29 0.87 0.76 0.00 0.00 121 R 6.10 4.12 0.00 1.81 1.81 0.00 2.89 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.42 0.00 122 P 0.00 5.51 0.00 2.29 2.27 0.00 3.33 0.00 0.00 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 123 E 8.53 4.17 0.00 2.05 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 2.35 2.47 0.00 124 L 8.20 4.61 0.00 1.65 1.60 0.96 1.05 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 0.00 125 N 8.63 4.35 0.00 2.86 2.88 0.00 0.00 6.00 7.55 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 0.00 126 Y 8.87 4.16 0.00 2.87 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.21 4.41 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 0.00 128 G 6.38 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 0.00 129 L 8.51 3.97 0.00 1.85 1.69 0.99 1.18 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 0.00 130 D 8.13 4.37 0.00 2.72 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 0.00 131 K 7.84 3.89 0.00 1.68 1.69 0.00 1.79 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.37 7.81 132 L 7.72 3.95 0.00 2.09 1.96 1.02 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 133 I 8.07 3.61 1.99 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.74 0.82 0.00 0.00 134 E 8.01 3.90 0.00 2.14 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 2.29 2.35 0.00 135 D 8.31 4.36 0.00 2.89 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 0.00 136 I 7.78 3.84 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.04 0.84 0.00 0.00 137 H 8.05 4.29 0.00 3.34 3.29 0.00 5.62 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 0.00 138 T 8.04 3.85 4.35 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 1.17 0.00 0.00 139 D 8.33 4.31 0.00 2.88 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 0.00 140 I 7.79 3.69 2.04 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 1.44 0.51 0.92 0.00 0.00 141 R 8.04 3.82 0.00 1.94 2.03 0.00 3.06 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 142 V 8.34 3.83 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 1.11 0.00 0.00 0.94 0.00 0.00 143 A 7.94 3.28 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 0.00 144 L 7.62 3.86 0.00 1.70 1.72 0.92 0.95 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 0.00 145 N 7.96 4.39 0.00 2.85 2.74 0.00 0.00 7.07 7.16 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 0.00 146 S 7.92 3.83 0.00 2.87 3.06 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 0.00 147 M 7.31 4.57 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.81 0.00 148 D 7.61 4.50 0.00 2.86 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 0.00 149 R 7.55 4.25 0.00 1.87 2.00 0.00 3.26 0.00 0.00 3.12 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.55 0.00 150 P 0.00 4.37 0.00 2.23 2.19 0.00 3.99 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 2.18 2.10 0.00 151 S 8.35 4.21 0.00 3.96 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 0.00 152 Y 8.66 4.44 0.00 3.48 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 0.00 153 S 8.82 5.12 0.00 4.18 4.55 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 0.00 154 S 8.33 4.18 0.00 3.97 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 0.00 155 Y 8.35 4.15 0.00 3.56 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 0.00 156 K 7.82 3.84 0.00 1.12 1.57 0.00 1.54 0.00 0.00 1.54 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.12 0.80 7.81 157 K 7.47 4.58 0.00 1.72 1.73 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.30 1.26 7.81 158 D 7.98 4.38 0.00 2.94 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 0.00 0.00 0.00 0.00 159 P 0.00 4.29 0.00 2.23 2.12 0.00 3.63 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 2.10 2.08 0.00 160 F 8.26 4.13 0.00 2.77 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 F 8.33 4.84 0.00 3.19 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 0.00 162 K 8.52 4.15 0.00 1.68 1.76 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.16 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.41 7.81