NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 V 3.9952 8.0501 120.3886 62.1186 33.8480 174.8870 5 A 4.6886 7.1646 122.3512 49.3927 21.0125 175.2100 6 F 2.9904 8.5903 123.0247 59.3762 40.6327 174.2421 7 G 3.6036 7.3985 115.3281 45.0271 0.0000 173.6971 8 S 4.1166 7.2633 116.3411 58.3951 63.2905 175.5433 9 E 4.0329 8.7904 123.9456 58.6498 29.6053 177.4062 10 D 5.0348 7.7150 117.7715 52.5045 40.2152 177.6856 11 I 3.4699 7.5448 122.5441 65.1923 37.6159 177.0050 12 E 3.9676 8.0601 117.7226 59.0516 29.2413 178.6393 13 N 4.3123 7.8714 117.6319 56.8061 39.1448 176.6991 14 T 3.9940 7.6945 115.3222 66.7576 68.8608 176.1823 15 L 4.1271 7.8766 119.3159 56.2598 41.4032 178.8181 16 A 4.2466 7.6557 122.0579 54.9221 18.4123 178.7619 17 K 4.2902 7.9548 112.9350 58.6332 33.5897 177.4152 18 M 4.2838 7.6226 119.8380 55.7503 32.4786 176.4340 19 D 4.8571 10.2439 124.2675 52.0730 43.1532 176.8999 20 D 4.5562 8.7357 118.1869 57.7577 40.3783 179.1253 21 G 3.6869 8.2971 105.2939 48.3108 0.0000 175.6036 22 Q 4.1399 8.2480 120.6474 57.9100 28.7794 178.4671 23 L 3.9799 8.0643 121.8048 58.1296 41.9670 178.4685 24 D 4.6196 8.1428 117.3730 56.2103 40.8121 177.9503 25 G 3.7579 7.7075 105.0281 44.7486 0.0000 174.1847 26 L 3.8491 6.9547 120.8520 54.4371 42.0173 177.2108 27 A 4.1862 8.0562 123.4214 53.2731 18.9693 177.1501 28 F 5.1546 6.6953 109.7130 54.2521 41.4248 175.3995 29 G 4.1521 9.7142 107.3993 45.9164 0.0000 172.6254 30 A 5.5940 9.6338 125.1195 50.2475 22.5719 175.0103 31 I 5.0193 9.0256 123.3022 59.4692 41.2270 174.3117 32 Q 4.7163 8.9387 127.3732 54.1629 31.4646 174.2265 33 L 5.3813 9.0935 125.6795 53.0196 46.1957 176.0844 34 D 4.9339 8.7465 121.7402 52.0237 41.7057 177.1619 35 G 3.8150 9.1924 106.7333 49.0154 0.0000 174.0726 36 D 4.6824 8.4411 116.5285 54.4475 41.4026 177.0726 37 G 4.0765 9.0663 108.9680 45.5040 0.0000 173.0928 38 N 4.9085 8.7411 117.7621 52.6347 39.3657 174.3863 39 I 4.3668 8.5404 123.8004 61.5503 37.6597 176.4668 40 L 4.3179 9.2037 127.6942 56.3169 42.9487 177.2059 41 Q 4.7011 7.7211 115.3665 54.6436 33.7166 174.2069 42 Y 4.9584 8.4512 123.3118 56.9145 41.2995 174.0513 43 N 5.0123 8.8731 125.4005 51.8115 39.5751 176.1813 44 A 4.0238 9.1458 120.5292 55.4357 18.1554 179.7923 45 A 3.9592 7.9318 118.6572 55.2354 18.3683 179.3341 46 E 3.8927 8.3087 117.3813 59.4290 29.7351 178.6409 47 S 4.3885 8.1258 113.0902 61.8075 62.1887 175.9715 48 D 4.5035 8.0580 120.5433 57.3085 40.5692 178.5400 49 I 4.0347 7.4838 120.0773 63.9070 37.3983 177.6256 50 T 4.4106 8.1952 108.2185 61.2180 69.6086 175.8958 51 S 4.3133 8.6453 115.5848 58.1220 62.9324 169.9591 52 R 3.9110 7.5506 120.0686 56.2960 30.6169 176.1444 53 D 4.5816 8.4389 121.1052 52.9923 42.2673 174.6662 54 P 4.1068 0.0000 0.0000 65.9922 29.8717 178.2389 55 K 3.8526 8.2285 116.5505 60.6654 31.9284 178.8066 56 Q 4.2151 7.7474 117.5894 58.4820 28.8832 178.3871 57 V 3.7698 7.6237 112.6486 61.8094 31.8282 176.5421 58 I 3.8148 6.4205 118.8660 62.8652 37.3454 175.8265 59 G 4.0428 9.0691 113.9141 45.3843 0.0000 174.1871 60 K 4.1772 7.8697 118.7904 55.6786 33.1231 175.4177 61 N 4.9337 8.3625 119.6145 52.4978 39.8324 175.2963 62 F 3.8402 9.1005 129.1635 61.3899 39.5101 177.3325 63 F 3.9444 7.5929 116.9893 59.5544 39.0693 176.6826 64 K 4.0448 8.3459 121.0482 58.1653 32.4809 176.7538 65 D 4.6435 7.8127 116.1522 55.6991 42.6815 177.9923 66 V 3.5826 7.6040 116.7933 65.0795 32.3252 176.0153 67 A 4.3741 7.3665 121.5863 49.1937 18.3536 174.6480 68 P 4.0973 0.0000 0.0000 64.9142 31.8453 179.3547 69 C 4.2519 7.7659 112.5678 60.3708 29.9487 174.2129 70 T 4.2660 7.6961 109.7644 61.6474 68.7677 174.2666 71 D 4.9552 7.7899 123.2605 53.2695 39.5550 174.7294 72 S 4.7415 7.9474 117.8332 56.2022 65.9266 174.7938 73 P 4.3704 0.0000 0.0000 65.6754 31.1678 178.9409 74 E 3.9179 8.2696 116.2701 58.1567 29.2257 175.8088 75 F 4.3616 7.1862 118.5030 58.4953 42.5049 175.7293 76 Y 4.0994 8.8525 120.5363 60.6968 38.8953 179.0196 77 G 3.6613 8.4845 108.2282 47.2963 0.0000 175.8874 78 K 4.2837 7.9078 122.1442 58.0319 31.9839 179.1893 79 F 4.1557 8.4336 121.2425 61.3657 39.4134 177.3579 80 K 3.6266 7.9775 118.0135 59.2795 31.4984 179.2449 81 E 3.9546 8.0516 118.9998 59.2659 29.2908 179.6382 82 G 3.5634 8.0379 105.8107 47.6220 0.0000 175.8259 83 V 3.1225 7.1230 119.6129 65.5404 31.5034 177.6817 84 A 4.0650 7.5971 119.3262 55.1020 18.3122 179.3971 85 S 4.2800 8.2375 111.8926 59.2433 63.4232 175.6905 86 G 3.9512 8.6425 109.8067 45.5127 0.0000 173.0536 87 N 4.9871 7.6653 115.5046 51.9478 39.1176 174.6411 88 L 4.0444 7.8342 122.2521 55.7516 43.8658 175.9760 89 N 5.1071 8.6856 119.6587 53.7785 40.6938 172.8594 90 T 4.8756 8.7493 120.0276 60.8917 71.6158 171.9922 91 M 5.4104 8.6269 125.5861 53.7207 35.6507 174.5283 92 F 4.9755 8.2537 116.4596 56.0173 41.9709 172.8915 93 E 4.8669 8.9056 118.8402 56.3410 30.8916 175.0983 94 Y 4.8547 8.6700 122.1591 57.2366 43.2792 173.0876 95 T 4.7072 7.8645 118.6440 61.7550 71.5209 173.4942 96 F 5.3832 9.3379 126.3560 55.9679 40.6664 176.3977 97 D 4.8100 8.7979 121.1458 53.2545 40.5369 173.9566 98 Y 4.5394 8.2355 121.0411 57.6169 39.2291 175.0726 99 Q 3.2759 8.2400 127.5741 56.3309 26.4012 173.1719 100 M 4.5190 7.4425 110.2948 54.4785 33.5703 174.4074 101 T 3.9720 8.4250 117.2210 62.8802 69.1887 172.6080 102 P 4.5497 0.0000 0.0000 63.8834 32.0864 175.7769 103 T 4.6505 9.1771 121.0234 61.5713 72.4569 173.3922 104 K 4.6347 8.6632 126.2422 56.3468 33.7296 176.5675 105 V 4.9021 8.8336 117.2298 59.6326 37.1655 173.7815 106 K 4.8770 8.8636 122.6641 54.6829 34.8639 174.7907 107 V 4.9031 8.6532 126.8760 61.2932 34.7396 173.7722 108 H 5.2901 9.2737 126.2089 54.9079 32.8396 171.6066 109 M 5.1230 9.0304 126.2333 53.7463 34.5193 175.4061 110 K 5.2813 8.8236 123.7601 54.7322 36.2068 175.3036 111 K 4.5382 8.9208 127.1581 57.3196 33.4111 176.5491 112 A 4.7489 8.2997 123.9761 51.0661 20.0185 178.7083 113 L 4.0269 8.7348 119.2585 57.7546 41.8489 179.3310 114 S 4.0716 8.0978 111.9812 59.0974 62.8767 175.2165 115 G 3.8477 7.8275 108.3558 45.9966 0.0000 173.5929 116 D 4.8372 7.5906 116.6919 52.5080 40.6495 175.3102 117 S 4.7585 6.9744 113.7759 57.0323 67.2357 172.2053 118 Y 4.9779 8.9518 116.9380 56.1993 42.5478 174.4202 119 W 5.1303 9.1653 122.5216 55.1205 31.9803 175.4653 120 V 4.5432 8.6461 123.3105 61.2668 33.7346 174.0904 121 F 5.7638 9.0720 127.3459 56.0462 41.8016 175.1747 122 V 5.3226 9.3183 121.6251 61.4599 35.3709 173.9973 123 K 4.9215 8.5527 124.4310 55.2114 36.1266 175.8437 124 R 4.5101 8.4734 120.6018 56.4193 31.1675 177.1897 125 V 3.9336 7.9203 113.5199 61.7702 32.6934 175.5592 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 4 V 8.05 4.00 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 0.97 0.00 0.00 0.91 0.00 0.00 5 A 7.16 4.69 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 6 F 8.59 2.99 0.00 2.66 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 7 G 7.40 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 8 S 7.26 4.12 0.00 3.73 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.79 4.03 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.22 0.00 10 D 7.71 5.03 0.00 2.75 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 11 I 7.54 3.47 1.58 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.52 0.76 0.00 0.00 12 E 8.06 3.97 0.00 2.41 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 2.41 2.39 0.00 13 N 7.87 4.31 0.00 2.76 3.02 0.00 0.00 7.22 7.38 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 14 T 7.69 3.99 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 1.17 0.00 0.00 15 L 7.88 4.13 0.00 1.38 1.25 0.77 0.23 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 16 A 7.66 4.25 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 17 K 7.95 4.29 0.00 1.88 1.98 0.00 1.50 0.00 0.00 1.74 0.00 0.00 3.12 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.54 7.81 18 M 7.62 4.28 0.00 2.05 2.15 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 2.65 2.50 0.00 19 D 10.24 4.86 0.00 2.98 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 20 D 8.74 4.56 0.00 2.74 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 21 G 8.30 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Q 8.25 4.14 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.85 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 23 L 8.06 3.98 0.00 2.06 1.83 1.06 1.32 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 24 D 8.14 4.62 0.00 2.87 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 25 G 7.71 3.76 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 0.00 0.00 0.00 26 L 6.95 3.85 0.00 1.12 0.31 0.62 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.06 4.19 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 28 F 6.70 5.15 0.00 3.42 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 29 G 9.71 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 0.00 0.00 0.00 30 A 9.63 5.59 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.03 5.02 1.63 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 0.65 0.56 0.85 0.00 0.00 32 Q 8.94 4.72 0.00 1.45 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.71 0.00 0.00 0.00 0.00 0.00 1.69 1.16 0.00 33 L 9.09 5.38 0.00 1.69 1.53 0.22 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 34 D 8.75 4.93 0.00 2.91 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 35 G 9.19 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 8.44 4.68 0.00 2.88 2.83 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 37 G 9.07 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 N 8.74 4.91 0.00 3.09 2.76 0.00 0.00 7.05 8.34 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 39 I 8.54 4.37 2.03 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.90 1.03 0.00 0.00 40 L 9.20 4.32 0.00 1.44 1.64 0.84 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 7.72 4.70 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.79 0.00 0.00 0.00 0.00 0.00 2.48 2.30 0.00 42 Y 8.45 4.96 0.00 2.94 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 43 N 8.87 5.01 0.00 3.02 2.99 0.00 0.00 6.47 8.01 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 44 A 9.15 4.02 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 45 A 7.93 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 46 E 8.31 3.89 0.00 1.94 1.53 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 0.00 1.47 2.15 0.00 47 S 8.13 4.39 0.00 4.20 4.16 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 48 D 8.06 4.50 0.00 2.93 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 49 I 7.48 4.03 2.14 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.69 1.08 0.00 0.00 50 T 8.20 4.41 4.36 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 1.47 0.00 0.00 51 S 8.65 4.31 0.00 4.16 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 52 R 7.55 3.91 0.00 1.91 1.63 0.00 3.19 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 53 D 8.44 4.58 0.00 2.71 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 54 P 0.00 4.11 0.00 2.25 2.43 0.00 3.70 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.40 0.00 55 K 8.23 3.85 0.00 2.01 2.10 0.00 1.36 0.00 0.00 1.80 0.00 0.00 3.32 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.94 7.81 56 Q 7.75 4.22 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.99 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 57 V 7.62 3.77 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 0.49 0.00 0.00 0.21 0.00 0.00 58 I 6.42 3.81 1.85 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 0.75 0.97 0.00 0.00 59 G 9.07 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 0.00 0.00 0.00 60 K 7.87 4.18 0.00 1.95 1.67 0.00 1.70 0.00 0.00 1.50 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.32 7.81 61 N 8.36 4.93 0.00 2.71 2.64 0.00 0.00 6.53 7.71 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 62 F 9.10 3.84 0.00 2.76 2.25 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 63 F 7.59 3.94 0.00 2.44 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.35 4.04 0.00 1.65 1.74 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.34 7.81 65 D 7.81 4.64 0.00 2.70 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 66 V 7.60 3.58 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 0.65 0.00 0.00 0.82 0.00 0.00 67 A 7.37 4.37 -0.18 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 68 P 0.00 4.10 0.00 1.84 1.90 0.00 3.42 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.44 0.00 69 C 7.77 4.25 0.00 3.22 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 70 T 7.70 4.27 2.83 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 0.63 0.00 0.00 71 D 7.79 4.96 0.00 2.72 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 72 S 7.95 4.74 0.00 4.30 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 4.37 0.00 2.22 2.13 0.00 3.67 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 74 E 8.27 3.92 0.00 2.22 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 2.43 2.40 0.00 75 F 7.19 4.36 0.00 2.56 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 76 Y 8.85 4.10 0.00 2.94 3.10 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 77 G 8.48 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.91 4.28 0.00 1.85 1.84 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.78 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.58 1.35 7.81 79 F 8.43 4.16 0.00 3.43 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 80 K 7.98 3.63 0.00 1.68 1.60 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.07 0.95 7.81 81 E 8.05 3.95 0.00 2.08 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.52 0.00 82 G 8.04 3.56 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 0.00 0.00 0.00 83 V 7.12 3.12 1.73 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 0.58 0.00 0.00 -0.64 0.00 0.00 84 A 7.60 4.07 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 85 S 8.24 4.28 0.00 4.00 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 86 G 8.64 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 87 N 7.67 4.99 0.00 2.61 2.70 0.00 0.00 7.04 8.86 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 88 L 7.83 4.04 0.00 1.84 1.75 0.97 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 89 N 8.69 5.11 0.00 2.76 2.72 0.00 0.00 6.92 7.70 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 90 T 8.75 4.88 4.34 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 1.40 0.00 0.00 91 M 8.63 5.41 0.00 1.90 1.90 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.56 0.00 92 F 8.25 4.98 0.00 3.16 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 93 E 8.91 4.87 0.00 1.99 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 2.29 0.00 94 Y 8.67 4.85 0.00 3.32 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 95 T 7.86 4.71 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 1.30 0.00 0.00 96 F 9.34 5.38 0.00 3.03 2.94 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 97 D 8.80 4.81 0.00 2.79 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 98 Y 8.24 4.54 0.00 2.83 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 99 Q 8.24 3.28 0.00 1.74 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 1.73 1.16 0.00 100 M 7.44 4.52 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.72 0.00 101 T 8.43 3.97 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 0.00 102 P 0.00 4.55 0.00 1.96 2.06 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.18 0.00 103 T 9.18 4.65 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 1.23 0.00 0.00 104 K 8.66 4.63 0.00 1.68 1.69 0.00 1.60 0.00 0.00 1.80 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.46 7.81 105 V 8.83 4.90 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 0.55 0.00 0.00 0.23 0.00 0.00 106 K 8.86 4.88 0.00 1.61 1.28 0.00 1.62 0.00 0.00 1.67 0.00 0.00 2.54 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.40 1.30 7.81 107 V 8.65 4.90 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 0.52 0.00 0.00 0.91 0.00 0.00 108 H 9.27 5.29 0.00 2.86 2.86 0.00 5.63 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 M 9.03 5.12 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.61 0.00 110 K 8.82 5.28 0.00 1.80 1.73 0.00 1.78 0.00 0.00 1.93 0.00 0.00 3.11 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.56 7.81 111 K 8.92 4.54 0.00 1.85 1.99 0.00 1.99 0.00 0.00 1.80 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.62 7.81 112 A 8.30 4.75 1.11 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 0.00 0.00 113 L 8.73 4.03 0.00 1.70 1.78 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 114 S 8.10 4.07 0.00 4.05 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 0.00 115 G 7.83 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 0.00 0.00 0.00 116 D 7.59 4.84 0.00 2.70 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 0.00 117 S 6.97 4.76 0.00 3.50 3.72 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 0.00 118 Y 8.95 4.98 0.00 3.30 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 0.00 119 W 9.17 5.13 0.00 2.84 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 0.00 120 V 8.65 4.54 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 1.17 0.00 0.00 0.82 0.00 0.00 121 F 9.07 5.76 0.00 2.84 2.73 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 0.00 0.00 0.00 0.00 122 V 9.32 5.32 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 1.34 0.00 0.00 123 K 8.55 4.92 0.00 1.65 1.49 0.00 1.01 0.00 0.00 0.75 0.00 0.00 2.15 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.30 0.94 7.81 124 R 8.47 4.51 0.00 1.68 1.87 0.00 3.15 0.00 0.00 3.22 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 125 V 7.92 3.93 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 0.90 0.00 0.00