NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.4670 8.3916 118.1882 56.3642 31.0885 174.5669 2 W 5.2092 8.7453 127.9748 56.0943 33.6929 173.6890 3 T 3.4372 9.1962 122.2411 66.7141 68.7603 174.5224 4 G 2.3940 5.3800 106.4050 44.7050 0.0000 173.2378 5 D 4.5653 7.5651 120.1866 54.0373 42.0113 176.4003 6 A 4.7465 8.2347 123.5992 50.5531 15.9659 176.0305 7 R 4.6391 7.4231 119.4009 53.9353 35.4818 174.8422 8 D 4.2736 8.6387 120.5607 54.8714 41.5197 176.5600 9 G 3.8469 7.8368 109.3041 45.0450 0.0000 171.5786 10 M 5.4623 8.5791 115.6471 53.8217 34.4310 174.3460 11 F 4.9104 9.2070 119.5852 56.0852 41.7983 174.8419 12 S 4.7251 8.7557 119.6675 57.1252 65.1018 173.6513 13 G 3.7715 8.4035 107.4920 46.9062 0.0000 173.6843 14 V 4.4696 8.2771 119.5958 60.9380 34.0669 174.5850 15 V 4.3930 8.4136 128.0262 61.4696 33.0370 174.8116 16 I 4.3696 8.6100 129.6492 61.9853 36.7792 175.5717 17 T 4.7237 9.1756 118.1693 61.9007 70.9365 174.7677 18 Q 4.8378 8.1363 119.8317 54.0068 33.3585 174.0495 19 F 5.0025 8.6189 123.3647 56.8530 42.5736 173.1077 20 H 5.1634 9.2739 125.2359 54.7242 33.2772 171.7948 21 T 4.7779 8.2836 118.4223 60.8512 70.6472 173.5351 22 G 3.7658 7.5315 112.7195 46.1045 0.0000 171.5148 23 Q 5.1710 8.6354 120.7435 54.6602 32.5173 174.9827 24 I 4.4782 8.6972 123.8065 60.6413 41.3538 174.3335 25 D 4.0405 9.3576 126.4284 55.6434 39.2620 172.5029 26 N 4.2106 8.3394 109.6118 54.2008 37.8404 172.9274 27 K 4.4941 7.7549 115.4480 52.9843 35.1937 174.1444 28 P 4.9326 0.0000 0.0000 63.1138 32.7465 174.7807 29 Y 5.6838 8.6353 119.1205 55.8658 42.0445 173.5371 30 F 5.4743 9.5743 114.4078 55.5860 41.9396 172.8184 31 C 5.5010 9.6834 117.6173 55.1236 39.2462 173.0514 32 I 4.9722 8.5247 114.8846 59.0301 40.7191 173.8117 33 E 5.0869 8.9090 124.3209 54.5975 32.9531 174.8155 34 G 4.5729 8.9737 111.6994 44.6728 0.0000 171.2965 35 K 5.2863 8.6854 121.6871 54.4299 35.1684 176.2462 36 Q 4.7850 9.1207 123.9018 54.8745 29.7329 177.3539 37 S 4.2111 8.6300 114.5460 61.2757 62.8770 175.2073 38 A 4.0955 7.9366 121.5549 52.4123 18.2134 178.0934 39 G 3.9417 8.6428 104.8004 45.1628 0.0000 174.1458 40 S 4.3294 7.7567 115.4241 58.3150 63.4965 172.6564 41 S 5.3804 8.7434 120.7992 56.6290 65.2408 172.7726 42 I 4.2455 8.5223 124.5685 59.2919 41.2099 173.8578 43 S 5.3548 8.2976 124.0036 56.9067 65.8647 173.2598 44 A 4.8859 8.5152 123.2531 51.0341 23.0311 174.5203 45 C 5.2973 9.6946 118.6866 55.0934 38.4003 172.9636 46 S 5.3553 8.4655 117.0848 56.7113 65.0462 172.2435 47 M 5.1337 8.8760 125.9692 53.2234 35.1961 174.5622 48 K 3.9728 8.0395 127.7830 57.6465 32.7826 176.7279 49 N 4.2369 9.0038 121.3731 53.8277 36.0262 174.3245 50 S 4.4627 7.4763 113.1987 57.3692 63.2237 173.3839 51 S 3.8851 8.0832 113.7800 61.2807 62.8942 175.8551 52 V 3.6434 7.5710 121.6164 62.1508 32.1769 177.3084 53 W 4.9524 7.8000 118.0750 55.8761 29.7886 178.0365 54 G 4.0049 8.1911 109.9524 47.8007 0.0000 176.1244 55 A 4.1314 8.2485 122.2158 54.6266 18.6713 178.5335 56 S 4.8419 8.0627 109.4715 58.4270 63.2481 175.7229 57 F 4.7712 8.5622 127.4128 61.5626 39.1487 177.4540 58 S 3.9214 8.3019 113.1812 61.5367 63.0225 176.2423 59 T 3.8889 7.9466 118.8588 66.5646 68.2575 176.4975 60 L 4.1909 8.3429 120.9766 57.6330 41.6210 178.9305 61 Y 2.7543 8.1081 119.8395 60.3678 38.6944 177.8400 62 N 4.0574 8.0923 117.2876 56.3607 38.6056 177.2774 63 Q 3.6775 8.0139 120.6333 58.9863 29.1014 177.9617 64 A 4.2636 8.3823 122.3467 55.1293 18.5447 179.4105 65 L 3.7622 7.8104 119.0276 58.0199 42.0374 178.4402 66 Y 3.8941 7.8941 119.6397 60.8864 38.7178 178.3639 67 F 4.7018 8.4474 118.6754 60.6119 38.7723 177.1135 68 Y 4.2044 8.3399 118.9295 60.9968 38.6417 178.0856 69 T 3.8440 7.6395 115.8013 66.7512 68.6643 176.6580 70 T 3.9652 7.5052 110.5441 62.4594 68.9701 175.8902 71 G 3.8366 7.8742 108.2010 45.3655 0.0000 173.4052 72 Q 4.2520 7.4852 117.2898 55.0840 29.6098 174.3022 73 P 4.5984 0.0000 0.0000 62.8791 32.1165 175.9496 74 V 4.4560 9.0077 117.0136 59.5539 36.7130 173.9389 75 R 4.8345 8.7248 121.9921 54.9910 32.0674 174.7414 76 I 4.6326 8.5777 127.7330 60.1150 39.1652 174.2289 77 Y 5.0142 8.8510 126.2702 57.1394 39.3526 174.5917 78 Y 5.1897 8.6543 121.3813 55.1963 42.6076 173.7349 79 E 4.9522 8.8611 120.9618 53.5258 32.2243 173.4190 80 P 5.1793 0.0000 0.0000 63.2060 32.3670 176.6431 81 G 3.8797 8.5403 109.2141 46.2881 0.0000 175.0969 82 V 3.4650 7.5461 120.1312 64.8789 31.6802 176.4840 83 W 4.8901 7.3976 119.3791 56.1731 29.5003 176.2609 84 T 4.5018 8.5058 111.5107 61.1325 70.1083 173.8459 85 Y 4.2897 8.0007 123.8525 57.0214 39.3448 173.6313 86 P 4.1702 0.0000 0.0000 65.5108 31.5639 176.8970 87 P 4.0905 0.0000 0.0000 65.1344 31.0677 178.5693 88 F 3.9667 7.9024 119.3056 61.2542 39.2513 177.2146 89 V 3.8650 7.8084 116.6285 65.8380 31.3938 177.6125 90 K 4.0225 8.0919 118.4036 59.5853 32.1871 178.4453 91 A 4.1160 7.8614 119.6376 53.4891 18.4432 177.3527 92 L 4.2188 7.7362 112.9723 54.1305 43.8547 176.9027 93 T 4.2197 7.8412 113.2116 62.0856 70.8447 172.4253 94 S 4.9183 8.2437 118.9851 59.7207 65.0035 173.5896 95 N 5.0625 8.2468 119.9584 53.3110 39.3207 174.1394 96 A 5.0164 8.6632 126.7423 51.1930 20.2024 176.1021 97 L 4.4451 9.0133 125.6969 55.1313 42.1362 176.6915 98 V 3.7415 8.7116 125.3486 62.0999 33.7487 175.0029 99 G 4.0250 7.5265 106.1565 46.3840 0.0000 171.9328 100 L 5.9700 8.4831 118.4796 52.7965 45.9750 176.2294 101 S 5.1049 8.6646 116.8898 56.9888 67.6971 173.7673 102 T 4.2655 8.8997 113.2129 62.0470 70.1451 173.6341 103 C 5.4095 8.5114 119.9011 55.6462 42.7686 174.3914 104 T 4.0072 8.7223 113.5942 63.5999 68.9348 174.2505 105 T 4.7422 7.3776 110.4039 59.1848 72.0379 174.2641 106 S 4.0247 8.7185 115.1876 60.6760 62.9120 174.9613 107 T 4.3667 7.3433 108.3990 60.6919 70.4482 173.2226 108 E 4.5091 8.1766 124.1935 54.6394 30.3124 173.9028 109 C 5.4197 8.3408 122.4465 54.6934 44.4527 173.5916 110 F 4.6238 8.8691 124.7594 59.5388 39.7077 175.2912 111 G 3.5204 8.2235 113.1032 43.3619 0.0000 171.0813 112 P 4.5590 0.0000 0.0000 62.1816 32.3753 175.3232 113 D 4.4932 8.3836 119.5773 54.3692 41.7142 176.4512 114 R 4.4879 8.6035 123.5565 54.5038 31.1761 173.6302 115 K 4.5504 8.1054 125.9454 54.1817 36.0344 175.9550 116 K 4.2701 8.6598 126.9914 56.6904 32.2013 176.0807 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 E 8.39 4.47 0.00 1.86 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 1.69 1.47 0.00 2 W 8.75 5.21 0.00 3.40 3.38 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 3 T 9.20 3.44 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 0.15 0.00 0.00 4 G 5.38 2.39 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 0.00 5 D 7.57 4.57 0.00 2.74 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 6 A 8.23 4.75 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 7 R 7.42 4.64 0.00 1.62 1.77 0.00 3.25 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 8 D 8.64 4.27 0.00 2.49 2.47 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 9 G 7.84 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 10 M 8.58 5.46 0.00 1.62 1.57 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.57 0.00 11 F 9.21 4.91 0.00 2.88 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 12 S 8.76 4.73 0.00 3.72 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 G 8.40 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 V 8.28 4.47 2.20 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 0.95 0.00 0.00 1.13 0.00 0.00 15 V 8.41 4.39 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.96 0.00 0.00 16 I 8.61 4.37 2.14 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.77 1.21 0.00 0.00 17 T 9.18 4.72 4.33 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 1.34 0.00 0.00 18 Q 8.14 4.84 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.30 0.00 19 F 8.62 5.00 0.00 2.39 2.51 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 20 H 9.27 5.16 0.00 3.26 3.09 0.00 5.77 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.28 4.78 4.49 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 1.22 0.00 0.00 22 G 7.53 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 8.64 5.17 0.00 1.94 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.62 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 24 I 8.70 4.48 1.91 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.07 0.56 0.00 0.00 25 D 9.36 4.04 0.00 2.63 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 26 N 8.34 4.21 0.00 2.83 2.81 0.00 0.00 7.03 6.68 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 27 K 7.75 4.49 0.00 1.88 1.63 0.00 1.63 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.26 1.45 7.81 28 P 0.00 4.93 0.00 1.97 2.08 0.00 3.45 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 1.53 1.80 0.00 29 Y 8.64 5.68 0.00 3.10 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 30 F 9.57 5.47 0.00 3.35 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 31 C 9.68 5.50 0.00 2.83 2.93 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 32 I 8.52 4.97 1.88 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.73 0.64 0.00 0.00 33 E 8.91 5.09 0.00 1.99 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 2.14 2.34 0.00 34 G 8.97 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 K 8.69 5.29 0.00 1.71 1.71 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.14 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.55 7.81 36 Q 9.12 4.79 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.76 0.00 0.00 0.00 0.00 0.00 2.50 2.39 0.00 37 S 8.63 4.21 0.00 3.96 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 38 A 7.94 4.10 1.27 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 0.00 0.00 39 G 8.64 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 0.00 0.00 0.00 40 S 7.76 4.33 0.00 3.92 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 41 S 8.74 5.38 0.00 3.90 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 8.52 4.25 0.67 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.65 0.84 0.00 0.00 43 S 8.30 5.35 0.00 3.63 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.52 4.89 1.20 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 0.00 0.00 45 C 9.69 5.30 0.00 3.02 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 46 S 8.47 5.36 0.00 3.79 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 47 M 8.88 5.13 0.00 1.89 1.15 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 48 K 8.04 3.97 0.00 0.79 1.14 0.00 1.62 0.00 0.00 1.49 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.38 7.81 49 N 9.00 4.24 0.00 2.88 2.91 0.00 0.00 7.06 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 50 S 7.48 4.46 0.00 4.44 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 51 S 8.08 3.89 0.00 3.93 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 52 V 7.57 3.64 1.71 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 0.45 0.00 0.00 -0.33 0.00 0.00 53 W 7.80 4.95 0.00 3.50 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 54 G 8.19 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 55 A 8.25 4.13 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 56 S 8.06 4.84 0.00 4.25 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 F 8.56 4.77 0.00 3.43 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 58 S 8.30 3.92 0.00 4.15 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 0.00 59 T 7.95 3.89 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 1.26 0.00 0.00 60 L 8.34 4.19 0.00 2.08 2.13 1.08 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 61 Y 8.11 2.75 0.00 2.21 2.66 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 62 N 8.09 4.06 0.00 2.89 2.77 0.00 0.00 6.75 7.03 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 63 Q 8.01 3.68 0.00 2.25 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.14 0.00 64 A 8.38 4.26 1.62 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 0.00 0.00 65 L 7.81 3.76 0.00 1.04 1.23 0.13 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 7.89 3.89 0.00 3.04 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 67 F 8.45 4.70 0.00 3.27 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 68 Y 8.34 4.20 0.00 3.20 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 T 7.64 3.84 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 1.08 0.00 0.00 70 T 7.51 3.97 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 0.69 0.00 0.00 71 G 7.87 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 0.00 0.00 0.00 72 Q 7.49 4.25 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.77 0.00 0.00 0.00 0.00 0.00 2.47 2.20 0.00 73 P 0.00 4.60 0.00 1.92 2.00 0.00 3.58 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 2.00 2.09 0.00 74 V 9.01 4.46 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 -0.37 0.00 0.00 0.86 0.00 0.00 75 R 8.72 4.83 0.00 1.75 1.69 0.00 2.70 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 0.75 1.37 0.00 76 I 8.58 4.63 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.76 0.93 0.00 0.00 77 Y 8.85 5.01 0.00 2.97 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 Y 8.65 5.19 0.00 3.02 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 79 E 8.86 4.95 0.00 1.81 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 2.19 2.23 0.00 80 P 0.00 5.18 0.00 2.18 2.29 0.00 3.52 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.93 0.00 81 G 8.54 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 7.55 3.46 1.27 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 -0.33 0.00 0.00 0.83 0.00 0.00 83 W 7.40 4.89 0.00 3.45 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 84 T 8.51 4.50 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 1.25 0.00 0.00 85 Y 8.00 4.29 0.00 3.01 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 86 P 0.00 4.17 0.00 1.98 2.01 0.00 3.30 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 87 P 0.00 4.09 0.00 2.01 1.99 0.00 2.20 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.86 0.00 88 F 7.90 3.97 0.00 3.37 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 89 V 7.81 3.86 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 0.92 0.00 0.00 1.19 0.00 0.00 90 K 8.09 4.02 0.00 1.84 1.91 0.00 1.81 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.42 7.81 91 A 7.86 4.12 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 92 L 7.74 4.22 0.00 1.11 1.14 0.01 0.93 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 93 T 7.84 4.22 4.21 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 1.32 0.00 0.00 94 S 8.24 4.92 0.00 4.09 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 0.00 95 N 8.25 5.06 0.00 2.81 2.80 0.00 0.00 6.71 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 96 A 8.66 5.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 9.01 4.45 0.00 1.58 1.57 1.08 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.71 3.74 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 -0.36 0.00 0.00 -0.55 0.00 0.00 99 G 7.53 4.02 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 0.00 0.00 0.00 100 L 8.48 5.97 0.00 1.79 1.97 1.21 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 101 S 8.66 5.10 0.00 3.89 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 0.00 102 T 8.90 4.27 4.31 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 1.54 0.00 0.00 103 C 8.51 5.41 0.00 2.92 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 0.00 104 T 8.72 4.01 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 1.22 0.00 0.00 105 T 7.38 4.74 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 1.21 0.00 0.00 106 S 8.72 4.02 0.00 3.97 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 T 7.34 4.37 4.20 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 1.16 0.00 0.00 108 E 8.18 4.51 0.00 2.03 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 2.26 2.28 0.00 109 C 8.34 5.42 0.00 2.94 3.12 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 0.00 110 F 8.87 4.62 0.00 2.92 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 0.00 111 G 8.22 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 P 0.00 4.56 0.00 1.74 2.01 0.00 3.64 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.64 0.00 113 D 8.38 4.49 0.00 2.57 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 0.00 114 R 8.60 4.49 0.00 2.09 1.79 0.00 3.17 0.00 0.00 3.31 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 115 K 8.11 4.55 0.00 1.80 1.54 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.75 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.29 1.33 7.81 116 K 8.66 4.27 0.00 1.71 1.65 0.00 1.86 0.00 0.00 1.73 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.42 7.81