NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4695 8.3049 120.3264 54.0007 33.4152 176.1911 2 K 4.1257 8.8023 116.6009 55.6238 37.2484 173.3996 3 L 4.0464 8.7195 125.1943 58.2644 43.1124 178.9320 4 S 4.4972 7.8451 111.4416 57.0321 61.0115 172.7399 5 D 4.4229 7.3976 119.3464 55.0326 45.0963 175.9570 6 L 3.7100 8.0948 118.7691 53.7195 41.6437 177.7076 7 R 3.5828 8.0508 120.0239 55.9070 30.6766 174.0273 8 P 4.9489 0.0000 0.0000 60.6972 33.3964 174.4405 9 N 4.4193 8.8100 116.6691 52.9855 36.6112 177.3843 10 P 3.3871 0.0000 0.0000 63.8407 33.7354 176.4108 11 G 3.8088 7.5393 110.8789 46.7161 0.0000 172.3391 12 A 4.2392 8.8224 125.7125 52.4053 16.5155 180.0109 13 N 4.5371 7.2078 108.3639 54.5384 39.0081 175.4108 14 K 3.7231 8.6923 118.3063 60.3058 32.8488 180.1508 15 R 2.5100 9.1452 111.0000 54.9269 32.6684 178.6948 16 R 3.5246 7.8372 110.5735 57.3258 27.1994 177.9846 17 K 4.4461 7.6794 121.3831 56.2705 33.4665 176.8742 18 R 4.6779 8.1208 121.1440 56.4140 29.9759 175.5469 19 V 4.1594 7.8265 122.3969 64.7644 34.9123 172.5236 20 G 4.6695 8.1825 107.8810 45.8504 0.0000 175.0874 21 R 4.3131 7.9270 125.6247 55.4234 30.0779 176.0043 22 G 3.9587 8.4909 114.0740 45.5689 0.0000 170.4435 23 P 4.3991 0.0000 0.0000 63.5794 33.0163 175.8379 24 G 3.9567 8.5211 100.0812 45.0586 0.0000 173.2916 25 S 5.5564 8.2696 122.1462 58.3805 63.4860 177.8663 26 G 3.9632 7.7282 112.1466 47.3900 0.0000 174.9923 27 H 4.6090 7.0986 116.6531 54.8638 27.5558 174.1713 28 G 4.8046 7.1724 110.7084 46.1897 0.0000 175.3627 29 K 3.6234 9.0560 120.5978 57.1282 33.7060 176.4367 30 T 3.7576 8.9214 117.4131 62.6034 69.8032 174.3190 31 A 3.6656 8.8532 124.5783 53.8254 15.9790 177.6992 32 T 3.3662 7.9713 111.5671 63.4030 66.6175 171.9566 33 R 4.0718 7.8780 117.4874 56.1696 30.3825 176.6066 34 G 3.5911 8.6245 102.5442 48.2229 0.0000 175.8263 35 H 3.0690 9.2537 118.6301 52.8913 30.9143 178.7712 36 K 3.5102 8.8693 127.7596 58.5920 32.6473 172.6537 37 G 3.9688 8.4960 109.1708 46.4027 0.0000 174.3439 38 Q 2.9670 8.4052 115.9716 57.8502 30.2256 175.6564 39 K 4.0840 7.8361 118.8252 59.3141 32.8857 178.5723 40 S 4.2618 8.0842 113.3394 60.9502 63.1845 174.8060 41 R 3.8720 7.2936 118.4689 55.8489 29.8205 175.7906 42 S 3.9957 8.5144 112.2957 61.2192 62.8826 177.0558 43 G 4.0599 7.4599 111.3361 49.1930 0.0000 172.4272 44 G 3.8574 7.2391 105.3395 43.7037 0.0000 171.6449 45 L 4.5731 8.0316 124.7660 52.8635 44.5084 176.6558 46 K 3.8512 8.4060 120.2872 59.2551 31.4793 175.4376 47 D 4.6644 7.1374 118.3360 53.4531 47.3800 174.0049 48 P 4.4178 0.0000 0.0000 64.9368 32.2671 182.0352 49 R 3.1500 7.0942 115.3755 55.9214 31.8423 176.0422 50 R 4.4907 7.8578 117.5525 56.0355 30.3800 175.9911 51 F 4.9664 8.8706 121.5045 56.7432 42.6871 174.8796 52 E 4.4023 7.2909 125.9290 56.5885 28.7152 177.3914 53 G 3.7529 8.2057 108.2302 45.1444 0.0000 172.7581 54 G 4.3877 8.3053 107.9644 45.2864 0.0000 174.2598 55 R 4.2889 8.1834 118.8283 55.2507 31.1214 178.2700 56 S 2.7900 6.6738 112.1051 55.7531 64.8863 171.2761 57 T 3.0165 8.5784 121.1736 61.8984 68.2431 173.7090 58 T 3.6927 7.6228 121.2976 64.1447 69.7092 174.1117 59 L 3.9499 7.2787 124.2352 56.1657 41.9653 175.5645 60 M 4.2028 8.1581 126.7387 55.8266 31.5148 176.2340 61 R 4.5606 8.8481 117.7309 54.6326 32.8505 173.6348 62 L 4.5129 7.4569 115.4976 53.3854 40.9622 171.5816 63 P 4.9108 0.0000 0.0000 62.0304 32.8734 174.4672 64 K 3.8569 8.6948 122.6625 56.6967 31.5791 175.5497 65 R 4.2422 8.0040 120.6614 57.8232 29.6467 175.7671 66 G 3.8651 7.2867 106.1774 45.0711 0.0000 170.7475 67 M 2.9434 8.5962 122.2442 55.5432 29.1682 175.9524 68 Q 4.4359 8.2413 118.7880 54.3223 30.4041 176.6088 69 G 4.1316 8.1014 103.8172 45.6573 0.0000 172.6938 70 Q 4.7489 7.5878 117.4456 53.7876 32.2394 178.2745 71 V 3.3888 7.9488 118.7952 64.4482 32.1707 175.9784 72 P 4.2888 0.0000 0.0000 64.1000 31.8552 174.8584 73 G 3.8252 7.9560 103.4515 44.1569 0.0000 172.0165 74 E 4.2854 8.6283 122.6729 54.5848 30.5634 176.7099 75 I 3.8155 8.2294 120.3490 59.8636 37.5352 175.5844 76 K 3.9883 8.6312 127.7992 56.4307 31.6445 175.8599 77 R 4.6861 8.1475 122.7690 52.8695 31.9993 173.6929 78 P 4.1444 0.0000 0.0000 63.6922 31.3505 175.4670 79 R 4.6231 8.2538 118.1724 54.9236 31.7306 175.0197 80 Y 4.7553 8.4290 117.9846 56.3744 40.7009 174.8695 81 Q 4.3596 9.3708 127.4175 54.6480 30.2443 174.5708 82 G 4.7067 8.6546 114.9889 44.8065 0.0000 172.7464 83 V 4.4455 8.1524 123.2271 59.4112 33.9452 174.2251 84 N 4.6621 8.9023 123.3775 53.7975 39.6409 175.7135 85 L 4.4582 8.6801 121.1684 56.0827 41.3435 178.8859 86 K 3.9668 7.8139 119.9302 60.2673 32.6826 178.2835 87 D 4.5349 8.0168 118.0018 55.0155 39.9960 177.0698 88 L 4.0396 7.6540 121.1894 57.5970 42.1122 176.6514 89 A 4.3164 7.8706 122.5426 52.0816 17.8807 176.0777 90 R 4.5856 8.3471 122.0409 56.9375 31.6776 175.0424 91 F 4.7146 8.2038 113.9811 55.6948 38.3792 173.8482 92 E 4.0690 8.3949 126.2608 56.1574 29.9713 174.9522 93 G 3.5921 8.2712 113.1313 43.4082 0.0000 173.8303 94 E 6.3000 6.8965 128.6801 55.1052 30.3403 175.6254 95 V 3.7623 6.8639 116.3189 61.7734 33.2967 175.9871 96 T 5.1660 8.1489 113.3669 60.2970 72.5256 170.6670 97 P 4.4926 0.0000 0.0000 63.6410 31.9753 175.2454 98 E 4.0629 9.2379 123.6209 57.7533 29.3940 175.9717 99 L 3.9938 7.7421 118.4984 58.2486 42.3997 178.8804 100 L 4.1357 8.2673 119.4852 57.8589 41.3460 180.0983 101 V 4.5234 7.5905 118.6456 64.4958 31.8092 177.9400 102 R 4.0224 8.2230 117.1157 57.1988 29.8582 176.9883 103 A 4.4841 7.2267 118.5104 53.2606 20.1961 176.9144 104 G 3.9748 7.4168 107.0528 45.4339 0.0000 172.6287 105 L 4.8185 7.1082 119.7035 53.5200 44.2819 173.8115 106 L 3.7916 8.2329 119.7375 51.8387 41.2620 173.9279 107 K 3.5771 7.8366 115.9967 58.9431 28.3529 176.1591 108 K 4.1768 8.1060 112.3002 57.1401 30.6455 175.9857 109 G 3.7487 8.2410 107.3808 48.6750 0.0000 174.2419 110 Y 3.1977 8.7267 120.2513 60.4702 40.3437 171.9055 111 R 2.5100 6.4079 116.8291 53.5951 27.1599 174.1223 112 L 4.9359 7.5056 125.2278 53.2692 44.5270 174.9133 113 K 5.3702 9.4920 127.5738 53.3278 34.7539 174.9399 114 I 4.2648 7.7891 122.3438 59.6663 38.7816 173.4964 115 L 4.5835 8.3101 128.3945 53.7428 44.0449 179.4891 116 G 3.6936 8.8171 105.0548 46.2109 0.0000 169.4432 117 E 4.4432 8.2388 117.9963 55.0092 32.3084 174.1715 118 G 3.8027 9.2039 107.4127 47.3741 0.0000 173.7651 119 E 3.5313 7.4712 123.6264 54.8245 26.4122 177.0997 120 A 3.9955 8.4152 126.9327 51.9769 18.5194 177.4708 121 K 4.1382 8.4187 122.4776 56.0129 32.7425 175.9437 122 P 4.7694 0.0000 0.0000 62.5895 30.6447 175.0811 123 L 4.3815 7.7489 123.2699 54.8419 43.2097 174.1314 124 K 5.0228 8.6877 122.8334 55.6516 33.0612 175.6388 125 V 5.1959 8.4138 127.5596 59.2980 33.7560 174.7932 126 V 5.0436 8.6770 126.0944 61.4295 32.7553 173.8508 127 A 4.9674 8.5571 131.9950 51.2343 21.8967 174.6343 128 H 4.8260 8.6049 108.5975 56.9129 31.7085 174.8006 129 A 4.7331 7.4662 116.7855 50.9788 22.2133 175.2558 130 F 5.1715 8.7913 118.2515 55.2608 42.7265 175.3256 131 S 4.1980 8.5007 117.2259 57.8575 63.1030 174.8653 132 K 3.6258 9.0068 128.2344 60.0212 31.6727 178.7248 133 S 4.1388 8.0127 112.2333 61.4929 62.3975 175.9164 134 A 4.0978 7.9474 122.8595 54.8758 17.8888 179.1361 135 L 4.0047 8.6047 119.5885 58.2598 42.4073 178.8581 136 E 4.0491 7.9578 117.1331 59.4387 29.2474 179.2433 137 K 3.9662 7.6949 118.2773 59.3999 32.1621 178.4264 138 L 4.2407 7.5947 117.0211 56.8951 40.7916 178.5244 139 K 3.3092 7.9960 119.9782 58.1549 32.8323 177.1428 140 A 4.7143 6.9066 121.1544 50.5201 18.2187 175.3504 141 A 4.3677 7.4507 131.3879 53.1319 22.9335 177.6335 142 G 3.9012 8.8629 101.3789 46.1291 0.0000 173.3857 143 G 4.0714 8.1401 107.7176 45.1945 0.0000 173.0465 144 E 5.6084 8.0393 112.1137 54.8161 30.0585 173.1847 145 P 4.2612 0.0000 0.0000 63.9841 32.7332 177.6790 146 V 4.5362 8.1433 124.7908 61.0722 32.7252 174.5924 147 L 4.8255 8.5855 119.0779 56.2661 40.1367 174.1965 148 L 4.4031 7.3515 116.8193 57.3365 42.4925 172.3132 149 E 4.6667 7.8056 113.5916 56.9860 32.3420 175.7189 150 A 4.3301 8.7397 121.4869 52.8423 19.3338 176.4835 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 4.47 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 2 K 8.80 4.13 0.00 1.77 1.67 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.52 7.81 3 L 8.72 4.05 0.00 1.70 1.75 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 4 S 7.85 4.50 0.00 3.97 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 5 D 7.40 4.42 0.00 2.59 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 6 L 8.09 3.71 0.00 1.74 1.53 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 7 R 8.05 3.58 0.00 2.03 1.97 0.00 2.99 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.59 0.00 8 P 0.00 4.95 0.00 2.17 2.05 0.00 3.75 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 1.88 1.91 0.00 9 N 8.81 4.42 0.00 2.97 2.97 0.00 0.00 6.15 7.76 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 10 P 0.00 3.39 0.00 2.27 2.29 0.00 3.60 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 11 G 7.54 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 12 A 8.82 4.24 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 13 N 7.21 4.54 0.00 2.65 2.85 0.00 0.00 7.24 6.56 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 14 K 8.69 3.72 0.00 1.75 1.86 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.41 7.81 15 R 9.15 2.51 0.00 1.89 2.04 0.00 3.36 0.00 0.00 3.22 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 16 R 7.84 3.52 0.00 2.04 2.19 0.00 3.44 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 17 K 7.68 4.45 0.00 1.74 1.77 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.47 7.81 18 R 8.12 4.68 0.00 1.76 1.54 0.00 3.15 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 19 V 7.83 4.16 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 0.66 0.00 0.00 0.96 0.00 0.00 20 G 8.18 4.67 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 0.00 0.00 0.00 21 R 7.93 4.31 0.00 1.94 1.76 0.00 3.19 0.00 0.00 3.34 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 22 G 8.49 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 23 P 0.00 4.40 0.00 2.18 2.11 0.00 3.91 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 24 G 8.52 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 25 S 8.27 5.56 0.00 3.98 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 26 G 7.73 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 27 H 7.10 4.61 0.00 3.21 3.27 0.00 5.60 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 G 7.17 4.80 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 0.00 29 K 9.06 3.62 0.00 1.80 1.83 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.34 1.41 7.81 30 T 8.92 3.76 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 1.06 0.00 0.00 31 A 8.85 3.67 1.35 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 0.00 0.00 0.00 32 T 7.97 3.37 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 1.18 0.00 0.00 33 R 7.88 4.07 0.00 1.90 1.95 0.00 3.35 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.84 0.00 34 G 8.62 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 35 H 9.25 3.07 0.00 3.20 3.42 0.00 6.03 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.87 3.51 0.00 2.11 1.74 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.39 1.43 7.81 37 G 8.50 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 38 Q 8.41 2.97 0.00 2.18 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.41 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 39 K 7.84 4.08 0.00 1.77 1.84 0.00 1.84 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.44 7.81 40 S 8.08 4.26 0.00 4.06 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 41 R 7.29 3.87 0.00 2.09 1.92 0.00 3.31 0.00 0.00 3.09 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 42 S 8.51 4.00 0.00 3.81 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 43 G 7.46 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 0.00 0.00 0.00 44 G 7.24 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 0.00 0.00 0.00 45 L 8.03 4.57 0.00 1.58 1.59 0.97 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.41 3.85 0.00 1.30 1.41 0.00 1.41 0.00 0.00 1.12 0.00 0.00 2.80 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.30 0.80 7.81 47 D 7.14 4.66 0.00 2.60 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 0.00 0.00 0.00 0.00 48 P 0.00 4.42 0.00 2.32 2.32 0.00 3.83 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 2.05 2.00 0.00 49 R 7.09 3.15 0.00 2.10 2.09 0.00 3.21 0.00 0.00 3.29 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 50 R 7.86 4.49 0.00 1.96 2.04 0.00 3.03 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 51 F 8.87 4.97 0.00 2.88 2.99 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 0.00 0.00 0.00 52 E 7.29 4.40 0.00 1.95 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 2.27 2.04 0.00 53 G 8.21 3.75 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 0.00 0.00 0.00 54 G 8.31 4.39 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 55 R 8.18 4.29 0.00 1.71 1.71 0.00 3.30 0.00 0.00 3.16 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.52 0.00 56 S 6.67 2.79 0.00 3.91 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 57 T 8.58 3.02 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 1.22 0.00 0.00 58 T 7.62 3.69 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 1.18 0.00 0.00 59 L 7.28 3.95 0.00 1.66 1.53 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 60 M 8.16 4.20 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.60 0.00 61 R 8.85 4.56 0.00 1.73 1.88 0.00 3.36 0.00 0.00 3.45 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.57 0.00 62 L 7.46 4.51 0.00 1.84 1.87 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 63 P 0.00 4.91 0.00 2.18 2.07 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.96 0.00 64 K 8.69 3.86 0.00 1.85 2.13 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.25 1.20 7.81 65 R 8.00 4.24 0.00 1.77 1.90 0.00 3.28 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 66 G 7.29 3.87 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 67 M 8.60 2.94 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.61 0.00 68 Q 8.24 4.44 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.55 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 69 G 8.10 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 0.00 0.00 0.00 70 Q 7.59 4.75 0.00 2.13 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.53 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 71 V 7.95 3.39 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 0.71 0.00 0.00 0.93 0.00 0.00 72 P 0.00 4.29 0.00 2.06 2.16 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 73 G 7.96 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 0.00 0.00 0.00 74 E 8.63 4.29 0.00 1.91 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 2.23 2.34 0.00 75 I 8.23 3.82 1.88 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 1.30 0.99 0.91 0.00 0.00 76 K 8.63 3.99 0.00 1.71 1.79 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.38 7.81 77 R 8.15 4.69 0.00 1.94 1.86 0.00 3.14 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 78 P 0.00 4.14 0.00 1.99 2.16 0.00 3.78 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 79 R 8.25 4.62 0.00 1.82 1.94 0.00 2.95 0.00 0.00 3.16 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.77 0.00 80 Y 8.43 4.76 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 81 Q 9.37 4.36 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.96 0.00 0.00 0.00 0.00 0.00 2.30 2.56 0.00 82 G 8.65 4.71 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 83 V 8.15 4.45 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 0.78 0.00 0.00 1.01 0.00 0.00 84 N 8.90 4.66 0.00 2.94 2.96 0.00 0.00 6.81 6.74 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 85 L 8.68 4.46 0.00 1.84 1.91 0.97 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 86 K 7.81 3.97 0.00 1.90 2.30 0.00 1.61 0.00 0.00 2.03 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.40 7.81 87 D 8.02 4.53 0.00 2.85 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 88 L 7.65 4.04 0.00 1.70 1.83 0.90 1.41 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 89 A 7.87 4.32 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.35 4.59 0.00 1.97 2.13 0.00 3.03 0.00 0.00 3.53 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.56 0.00 91 F 8.20 4.71 0.00 3.16 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 92 E 8.39 4.07 0.00 1.98 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 2.28 2.30 0.00 93 G 8.27 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 94 E 6.90 6.30 0.00 2.00 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 2.03 2.07 0.00 95 V 6.86 3.76 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 -0.24 0.00 0.00 0.81 0.00 0.00 96 T 8.15 5.17 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 1.25 0.00 0.00 97 P 0.00 4.49 0.00 1.98 2.09 0.00 3.76 0.00 0.00 3.96 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 98 E 9.24 4.06 0.00 2.25 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 2.27 2.37 0.00 99 L 7.74 3.99 0.00 1.87 1.92 1.07 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 100 L 8.27 4.14 0.00 1.83 1.76 1.09 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 101 V 7.59 4.52 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 0.96 0.00 0.00 1.00 0.00 0.00 102 R 8.22 4.02 0.00 1.91 2.22 0.00 3.39 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 103 A 7.23 4.48 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 0.00 104 G 7.42 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 0.00 105 L 7.11 4.82 0.00 1.74 1.60 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.23 3.79 0.00 1.83 1.69 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.00 0.00 107 K 7.84 3.58 0.00 2.01 1.93 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.45 7.81 108 K 8.11 4.18 0.00 1.82 1.83 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.42 7.81 109 G 8.24 3.75 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 0.00 0.00 0.00 110 Y 8.73 3.20 0.00 2.77 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 0.00 111 R 6.41 2.51 0.00 1.53 1.04 0.00 2.72 0.00 0.00 2.94 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.48 0.00 112 L 7.51 4.94 0.00 1.64 1.49 0.82 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 113 K 9.49 5.37 0.00 1.83 1.64 0.00 1.56 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.24 1.13 7.81 114 I 7.79 4.26 1.76 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.80 0.51 0.00 0.00 115 L 8.31 4.58 0.00 1.64 0.86 0.92 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 116 G 8.82 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 0.00 117 E 8.24 4.44 0.00 2.15 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 2.25 2.34 0.00 118 G 9.20 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 0.00 0.00 0.00 119 E 7.47 3.53 0.00 2.02 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 2.30 2.31 0.00 120 A 8.42 4.00 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 0.00 121 K 8.42 4.14 0.00 1.73 1.74 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.13 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.49 7.81 122 P 0.00 4.77 0.00 2.06 2.13 0.00 3.79 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 1.97 1.95 0.00 123 L 7.75 4.38 0.00 1.56 1.58 0.79 0.51 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 0.00 124 K 8.69 5.02 0.00 1.85 1.73 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.29 7.81 125 V 8.41 5.20 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 0.87 0.00 0.00 0.99 0.00 0.00 126 V 8.68 5.04 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 1.34 0.00 0.00 0.96 0.00 0.00 127 A 8.56 4.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 H 8.60 4.83 0.00 3.36 3.57 0.00 5.70 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 0.00 129 A 7.47 4.73 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 0.00 130 F 8.79 5.17 0.00 2.81 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 0.00 131 S 8.50 4.20 0.00 3.81 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 0.00 132 K 9.01 3.63 0.00 1.86 1.83 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.53 7.81 133 S 8.01 4.14 0.00 3.94 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 0.00 134 A 7.95 4.10 1.52 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 0.00 135 L 8.60 4.00 0.00 1.80 1.88 0.83 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 136 E 7.96 4.05 0.00 2.34 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 2.32 2.38 0.00 137 K 7.69 3.97 0.00 1.98 1.91 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.65 7.81 138 L 7.59 4.24 0.00 1.95 1.92 0.89 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 139 K 8.00 3.31 0.00 1.81 2.02 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.41 7.81 140 A 6.91 4.71 1.24 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 0.00 0.00 141 A 7.45 4.37 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 0.00 142 G 8.86 3.90 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 0.00 0.00 0.00 143 G 8.14 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 0.00 0.00 0.00 144 E 8.04 5.61 0.00 1.82 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 0.00 1.78 1.95 0.00 145 P 0.00 4.26 0.00 2.12 2.05 0.00 3.62 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 146 V 8.14 4.54 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 0.76 0.00 0.00 1.08 0.00 0.00 147 L 8.59 4.83 0.00 1.75 1.95 0.97 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 148 L 7.35 4.40 0.00 1.68 1.64 0.84 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 149 E 7.81 4.67 0.00 2.04 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 0.00 2.06 2.12 0.00 150 A 8.74 4.33 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