NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.1999 8.2644 123.5865 49.8829 20.5933 177.2580 2 S 5.3968 7.3057 124.4179 56.8495 63.7889 174.8759 3 N 4.7188 8.7039 124.2748 53.0908 39.4080 175.2089 4 F 5.1027 8.0111 123.3853 58.1979 38.3168 173.9686 5 T 4.7292 7.5572 111.2561 59.3141 71.9080 174.6092 6 Q 4.6239 8.5028 120.7162 56.5293 29.4003 174.9321 7 F 4.9876 8.4460 114.2412 55.6815 42.4210 172.9118 8 V 4.2009 8.3430 118.7550 61.8455 31.4769 175.1586 9 L 4.0789 8.3970 131.0884 57.5096 42.6948 176.8987 10 V 4.1991 7.4084 121.1507 61.0950 33.5697 173.4580 11 D 5.1803 8.6504 128.2238 52.9678 41.9541 175.8702 12 N 4.9071 9.2253 127.2664 52.9925 39.8491 174.5462 13 G 3.6973 9.0892 101.8405 46.7838 0.0000 174.3758 14 G 3.9707 8.1469 113.2615 46.0312 0.0000 173.7659 15 T 3.7797 7.4659 121.0496 63.0637 66.8248 173.8858 16 G 3.8442 8.7390 118.2094 46.1208 0.0000 172.1456 17 D 4.6084 7.9328 117.9301 53.8573 42.1880 176.5060 18 V 4.0407 8.6609 121.8384 61.6799 33.0429 174.4191 19 T 4.8064 8.2262 124.9372 62.0690 70.3064 174.8276 20 V 4.4287 8.3468 124.6265 59.7693 34.3223 174.4159 21 A 5.3288 8.5459 125.8956 48.8221 22.4137 173.5965 22 P 4.3046 0.0000 0.0000 63.5385 31.0807 176.2004 23 S 4.6727 8.9761 115.3237 57.5315 64.9034 173.1124 24 N 4.6081 8.0319 116.7920 53.2076 41.7970 174.5343 25 F 5.0893 8.5092 123.8152 57.5445 40.2896 173.5465 26 A 4.1924 8.4040 123.1940 52.7377 18.4266 178.5995 27 N 4.1279 9.1826 119.8295 54.2197 35.6877 175.9582 28 G 2.9777 7.0320 104.4892 45.3940 0.0000 174.8238 29 V 3.9639 6.8589 120.7231 61.6177 32.1300 174.9716 30 A 4.3725 8.4474 130.9902 51.8215 19.5733 175.6610 31 E 5.3909 9.2169 122.1637 54.2411 33.5396 174.3136 32 W 5.4551 10.0507 125.8279 55.0385 32.9058 174.3405 33 I 5.3141 8.8447 123.6122 59.2754 41.4271 174.8264 34 S 4.7717 8.6728 122.8003 57.2464 64.6992 175.1701 35 S 4.4530 8.2790 115.5606 56.9152 60.3017 171.5619 36 N 5.0048 7.4941 119.8592 51.3328 43.2398 174.0266 37 S 4.3807 8.4392 113.2381 58.0984 63.8029 175.3520 38 R 4.1942 8.8017 123.0929 59.3801 30.0360 177.9948 39 S 4.2983 8.0715 111.2930 60.2667 63.3690 174.7527 40 Q 4.3700 8.3384 117.0249 55.2130 29.3459 175.2571 41 A 4.4598 7.7208 120.0221 51.8360 20.0744 176.3674 42 Y 4.5971 9.0873 117.4072 56.7241 39.7661 175.2027 43 K 5.3270 8.9013 124.9823 54.6818 36.0183 174.8627 44 V 5.2800 9.3021 125.8674 61.5811 35.1961 174.1633 45 T 5.5566 9.3071 116.9255 60.6338 72.8596 172.2200 46 C 5.7092 9.3622 121.9335 59.1377 35.6050 172.6980 47 S 4.9061 8.4768 117.7015 57.4851 65.8312 173.1788 48 V 4.6944 7.9044 120.2308 61.4123 34.6282 174.2858 49 R 4.4170 8.0891 121.1474 55.6579 33.3644 174.4090 50 Q 4.6763 8.4963 119.6474 54.3751 27.7801 175.9140 51 S 4.2428 8.5872 118.7954 60.6165 63.2307 174.3073 52 S 4.5421 7.4603 112.5129 56.5621 65.5615 173.0392 53 A 4.1769 8.5736 121.2487 53.8088 18.7433 177.8920 54 Q 4.4027 7.9802 115.6846 55.8009 31.1782 174.3716 55 N 5.5130 7.9393 113.5097 51.3720 42.7386 173.8605 56 R 4.7041 8.7954 119.5392 54.5568 33.9302 175.3444 57 K 4.9795 9.0756 122.0526 55.3669 35.6983 174.6804 58 Y 4.5052 9.1871 126.1239 57.7349 39.8478 174.8238 59 T 5.0626 9.1150 120.2336 62.0438 71.8850 172.8653 60 I 5.1167 8.7970 127.7054 59.3935 40.3940 175.1255 61 K 5.2028 9.1156 124.8808 54.6784 36.2570 175.4519 62 V 5.0153 9.1641 123.5058 61.1950 35.4817 173.8904 63 E 5.0446 9.4374 126.2065 54.5215 32.8731 174.7874 64 V 4.4095 8.2540 124.8338 60.1498 34.0220 173.0797 65 P 4.7451 0.0000 0.0000 62.2210 32.5908 175.5851 66 K 4.1382 8.7213 124.1666 56.3661 32.1895 176.6777 67 V 3.9756 8.6122 126.9194 64.4270 32.4363 175.8983 68 A 4.1991 8.1165 122.2878 53.9848 18.3496 176.6250 69 T 3.5597 8.7637 111.5287 62.4792 67.7650 172.1319 70 Q 4.1351 8.2350 121.5230 56.9274 29.7967 175.9852 71 T 4.2685 8.4453 120.2477 60.8890 68.9432 173.0083 72 V 3.7043 8.1767 125.0770 64.7536 31.4721 176.5169 73 G 3.8395 9.7208 116.1904 45.3413 0.0000 173.1801 74 G 3.6868 8.0024 109.1433 44.4143 0.0000 173.6260 75 V 3.9313 7.9390 118.9746 61.2953 31.2373 174.6671 76 E 4.4573 8.3649 127.3760 54.3793 30.9360 175.7387 77 L 4.9954 8.2946 123.3133 51.9689 45.4234 174.6316 78 P 4.6481 0.0000 0.0000 62.1523 32.7352 177.5217 79 V 3.7686 8.5549 119.0074 66.2926 31.1356 178.2540 80 A 4.2153 8.1375 119.0107 54.6173 18.3453 178.5617 81 A 4.1696 7.9410 117.8256 53.1809 18.9973 177.9037 82 W 4.7540 7.8290 115.9572 56.2646 30.7717 175.5358 83 R 4.8958 7.9056 117.6684 54.7796 33.8322 174.4397 84 S 4.7609 8.7086 118.8767 56.9092 65.8721 172.6293 85 Y 5.1672 8.5562 120.4958 56.1025 40.4783 174.5939 86 L 4.7700 9.2527 126.6589 53.3097 44.9243 175.0830 87 S 4.9870 8.7025 119.7891 57.1357 64.7053 172.4186 88 M 4.6993 9.2489 127.8793 53.8285 34.3621 175.9572 89 K 4.9242 8.5089 120.7352 54.9292 35.9271 175.4342 90 L 4.6194 8.9771 128.5985 53.7028 43.9507 175.0344 91 T 4.9633 8.5336 123.5726 62.2531 70.1695 174.4414 92 I 4.6173 8.7011 126.8708 58.6476 40.9789 173.4736 93 P 5.4739 0.0000 0.0000 61.9798 32.2008 177.5237 94 I 3.7692 8.5314 115.7327 62.5527 37.4841 176.8710 95 F 4.4439 7.4372 118.6019 58.2728 39.4058 175.6193 96 A 4.2652 7.7397 125.0833 52.3138 18.4785 178.2943 97 T 4.3977 9.0356 115.0583 60.6883 71.6464 175.5813 98 N 4.3086 8.6248 117.7844 56.6391 38.4486 177.6582 99 S 4.1048 8.0341 115.7515 61.8599 63.1276 176.0466 100 D 4.4325 7.9135 120.9565 58.0398 40.6176 179.1357 101 C 4.1925 8.1896 116.8408 62.7133 28.0715 175.9371 102 E 3.9608 8.2733 120.3920 59.1730 28.9256 179.1703 103 L 3.9280 8.0264 120.3572 58.3156 42.3219 179.0998 104 I 3.6651 7.6602 119.5284 64.2533 36.9617 178.7200 105 V 3.5298 7.7708 119.1493 65.9232 31.4381 178.1697 106 K 4.2598 8.4354 119.4071 58.8538 31.8209 179.1676 107 A 3.9994 8.2360 121.1400 55.4844 18.1543 179.6660 108 M 4.0356 7.9377 116.7220 58.4716 31.8088 179.0956 109 Q 4.0918 8.2694 118.6066 58.8043 28.9032 178.9139 110 G 3.5595 8.2158 106.8633 47.4252 0.0000 175.2272 111 L 3.9385 7.7494 121.9568 57.9992 42.1795 178.4867 112 L 4.3879 7.2236 114.7312 53.5824 42.5261 177.0124 113 K 3.9729 7.2945 121.6668 55.9670 32.7600 175.5036 114 D 4.5130 8.4989 124.3216 56.0035 41.3748 175.7663 115 G 4.1088 8.9949 114.7560 45.8647 0.0000 174.2191 116 N 4.5643 7.9897 117.0632 51.9059 40.6206 173.9465 117 P 4.2676 0.0000 0.0000 65.7099 31.1219 178.5845 118 I 3.6724 7.7042 119.1407 63.4918 37.1574 176.5253 119 P 4.3145 0.0000 0.0000 65.9175 29.9376 178.4427 120 S 4.1617 8.1322 113.3228 60.6702 62.8688 176.4586 121 A 4.1845 7.8172 124.6405 55.0356 18.3568 179.5119 122 I 3.6464 7.6458 117.7437 64.5425 37.0865 178.3383 123 A 4.2790 8.0975 118.7542 53.5414 18.1249 177.6670 124 A 4.6129 6.9500 119.3189 51.0066 19.4987 175.8239 125 N 4.1861 7.9372 113.3280 55.9689 36.7113 173.8714 126 S 4.9109 8.2012 111.9663 56.7457 66.9755 173.2162 127 G 4.4682 8.3593 109.5319 44.9210 0.0000 172.1559 128 I 4.3372 8.1688 121.2125 60.4712 38.8331 175.2820 129 Y 4.3957 7.6788 120.4798 57.7365 37.2007 174.1908 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 A 8.26 4.20 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 2 S 7.31 5.40 0.00 3.99 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 3 N 8.70 4.72 0.00 2.99 2.98 0.00 0.00 6.24 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 4 F 8.01 5.10 0.00 2.67 2.85 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 5 T 7.56 4.73 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 1.31 0.00 0.00 6 Q 8.50 4.62 0.00 2.36 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 7 F 8.45 4.99 0.00 3.04 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.34 4.20 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 0.75 0.00 0.00 0.90 0.00 0.00 9 L 8.40 4.08 0.00 1.25 1.41 0.98 0.81 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 10 V 7.41 4.20 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.77 0.00 0.00 11 D 8.65 5.18 0.00 2.62 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 12 N 9.23 4.91 0.00 2.74 2.75 0.00 0.00 7.04 7.65 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 13 G 9.09 3.70 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 0.00 0.00 0.00 14 G 8.15 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 15 T 7.47 3.78 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 1.29 0.00 0.00 16 G 8.74 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 17 D 7.93 4.61 0.00 2.52 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 V 8.66 4.04 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 0.13 0.00 0.00 0.69 0.00 0.00 19 T 8.23 4.81 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 1.18 0.00 0.00 20 V 8.35 4.43 1.82 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 -0.32 0.00 0.00 0.99 0.00 0.00 21 A 8.55 5.33 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 22 P 0.00 4.30 0.00 0.96 0.49 0.00 3.66 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 1.64 1.59 0.00 23 S 8.98 4.67 0.00 3.82 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 24 N 8.03 4.61 0.00 2.94 2.71 0.00 0.00 6.57 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 25 F 8.51 5.09 0.00 3.13 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 26 A 8.40 4.19 1.30 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 0.00 0.00 27 N 9.18 4.13 0.00 2.78 2.84 0.00 0.00 7.12 7.65 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 28 G 7.03 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 6.86 3.96 2.11 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 0.91 0.00 0.00 0.90 0.00 0.00 30 A 8.45 4.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 9.22 5.39 0.00 2.12 1.84 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 2.37 2.40 0.00 32 W 10.05 5.46 0.00 3.45 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 33 I 8.84 5.31 1.97 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 1.36 1.57 0.96 0.00 0.00 34 S 8.67 4.77 0.00 3.96 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 35 S 8.28 4.45 0.00 3.85 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 36 N 7.49 5.00 0.00 2.73 2.70 0.00 0.00 7.27 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 37 S 8.44 4.38 0.00 3.98 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 38 R 8.80 4.19 0.00 1.83 2.11 0.00 3.40 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 39 S 8.07 4.30 0.00 3.95 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 8.34 4.37 0.00 1.93 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.99 0.00 0.00 0.00 0.00 0.00 2.15 2.16 0.00 41 A 7.72 4.46 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 Y 9.09 4.60 0.00 2.89 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 43 K 8.90 5.33 0.00 1.91 1.71 0.00 1.91 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.46 1.64 7.81 44 V 9.30 5.28 2.44 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 1.09 0.00 0.00 1.05 0.00 0.00 45 T 9.31 5.56 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 1.36 0.00 0.00 46 C 9.36 5.71 0.00 3.32 3.13 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 47 S 8.48 4.91 0.00 3.81 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.90 4.69 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 -0.04 0.00 0.00 0.24 0.00 0.00 49 R 8.09 4.42 0.00 1.76 1.88 0.00 2.76 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.53 0.00 50 Q 8.50 4.68 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 7.08 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 51 S 8.59 4.24 0.00 3.96 3.99 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 S 7.46 4.54 0.00 3.89 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.57 4.18 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 54 Q 7.98 4.40 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.73 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 55 N 7.94 5.51 0.00 2.66 2.65 0.00 0.00 6.70 7.18 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 56 R 8.80 4.70 0.00 1.73 1.75 0.00 2.99 0.00 0.00 3.05 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.48 0.00 57 K 9.08 4.98 0.00 1.73 1.58 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.58 7.81 58 Y 9.19 4.51 0.00 3.02 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 59 T 9.11 5.06 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 1.25 0.00 0.00 60 I 8.80 5.12 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.85 0.99 0.00 0.00 61 K 9.12 5.20 0.00 1.78 1.76 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.42 7.81 62 V 9.16 5.02 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 1.02 0.00 0.00 1.02 0.00 0.00 63 E 9.44 5.04 0.00 1.92 1.69 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 2.28 2.37 0.00 64 V 8.25 4.41 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 1.02 0.00 0.00 0.98 0.00 0.00 65 P 0.00 4.75 0.00 1.96 1.87 0.00 2.39 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.33 0.00 66 K 8.72 4.14 0.00 1.76 2.08 0.00 1.43 0.00 0.00 0.79 0.00 0.00 2.19 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.54 1.33 7.81 67 V 8.61 3.98 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.03 0.00 0.00 68 A 8.12 4.20 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 69 T 8.76 3.56 4.38 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 1.26 0.00 0.00 70 Q 8.23 4.14 0.00 2.32 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.98 6.93 0.00 0.00 0.00 0.00 0.00 2.29 2.15 0.00 71 T 8.45 4.27 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 1.15 0.00 0.00 72 V 8.18 3.70 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.92 0.00 0.00 73 G 9.72 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 74 G 8.00 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 75 V 7.94 3.93 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 0.82 0.00 0.00 0.89 0.00 0.00 76 E 8.36 4.46 0.00 1.16 1.12 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 1.65 1.82 0.00 77 L 8.29 5.00 0.00 1.64 1.60 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.65 0.00 2.28 2.22 0.00 3.81 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 2.13 1.99 0.00 79 V 8.55 3.77 2.18 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 1.16 0.00 0.00 0.99 0.00 0.00 80 A 8.14 4.22 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 81 A 7.94 4.17 1.19 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 0.00 0.00 82 W 7.83 4.75 0.00 3.31 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 83 R 7.91 4.90 0.00 1.46 1.27 0.00 3.34 0.00 0.00 3.30 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.84 0.00 84 S 8.71 4.76 0.00 3.63 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 85 Y 8.56 5.17 0.00 2.85 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 86 L 9.25 4.77 0.00 1.74 1.69 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 87 S 8.70 4.99 0.00 3.92 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 88 M 9.25 4.70 0.00 2.00 1.99 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 2.58 2.52 0.00 89 K 8.51 4.92 0.00 1.60 1.72 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.39 7.81 90 L 8.98 4.62 0.00 1.79 1.63 0.92 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.53 4.96 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 92 I 8.70 4.62 1.95 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 1.27 0.94 0.95 0.00 0.00 93 P 0.00 5.47 0.00 2.20 2.13 0.00 3.92 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.13 0.00 94 I 8.53 3.77 1.57 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 -0.36 0.76 0.00 0.00 95 F 7.44 4.44 0.00 3.13 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 96 A 7.74 4.27 1.30 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 0.00 0.00 97 T 9.04 4.40 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 1.29 0.00 0.00 98 N 8.62 4.31 0.00 2.76 2.93 0.00 0.00 6.81 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 99 S 8.03 4.10 0.00 3.87 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 0.00 100 D 7.91 4.43 0.00 2.98 2.77 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 0.00 101 C 8.19 4.19 0.00 3.17 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 0.00 102 E 8.27 3.96 0.00 2.19 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 2.31 2.44 0.00 103 L 8.03 3.93 0.00 1.76 1.86 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 104 I 7.66 3.67 2.00 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 1.40 0.95 0.88 0.00 0.00 105 V 7.77 3.53 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 0.89 0.00 0.00 106 K 8.44 4.26 0.00 2.02 1.84 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.44 7.81 107 A 8.24 4.00 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 0.00 108 M 7.94 4.04 0.00 2.08 2.21 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 2.78 2.56 0.00 109 Q 8.27 4.09 0.00 2.24 2.12 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 2.34 2.63 0.00 110 G 8.22 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 0.00 111 L 7.75 3.94 0.00 1.73 1.92 0.92 0.91 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 0.00 112 L 7.22 4.39 0.00 1.62 1.68 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 113 K 7.29 3.97 0.00 1.94 1.78 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.38 7.81 114 D 8.50 4.51 0.00 2.65 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 8.99 4.11 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 0.00 116 N 7.99 4.56 0.00 2.89 2.73 0.00 0.00 6.55 7.75 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 0.00 117 P 0.00 4.27 0.00 2.20 2.27 0.00 3.84 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.91 0.00 118 I 7.70 3.67 1.87 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 1.68 1.36 0.91 0.00 0.00 119 P 0.00 4.31 0.00 2.26 2.31 0.00 3.74 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 120 S 8.13 4.16 0.00 4.12 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 0.00 121 A 7.82 4.18 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 0.00 122 I 7.65 3.65 2.02 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 1.47 1.21 0.92 0.00 0.00 123 A 8.10 4.28 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 0.00 124 A 6.95 4.61 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 N 7.94 4.19 0.00 2.88 2.88 0.00 0.00 6.65 7.44 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 0.00 126 S 8.20 4.91 0.00 4.05 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 0.00 127 G 8.36 4.47 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 0.00 0.00 0.00 128 I 8.17 4.34 1.88 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 1.48 0.89 0.86 0.00 0.00 129 Y 7.68 4.40 0.00 3.05 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