NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4256 8.3049 120.3289 55.3273 33.3084 173.9407 2 D 4.8659 8.1711 120.0005 50.9939 44.1935 173.9117 3 Y 4.0470 9.3562 122.0136 58.6487 39.8475 174.8317 4 C 4.3324 7.4405 123.9522 57.8150 29.1979 173.5258 5 N 4.6020 8.4579 122.7339 53.1915 38.8560 174.6116 6 K 4.7293 8.4288 120.2014 54.3504 35.9263 175.4731 7 K 4.7084 8.1560 118.8344 54.5400 35.5965 175.3920 8 H 4.0407 8.8443 118.8789 57.0691 30.0391 174.9679 9 T 4.0295 8.1200 122.8240 62.8691 69.0606 174.3282 10 A 4.1368 8.3905 129.0214 52.0042 18.9950 177.4556 11 E 4.3093 8.6113 122.2102 56.3892 30.3673 176.1625 12 E 4.8292 8.3408 118.7122 54.8836 33.5243 174.7143 13 Y 4.7875 8.4574 121.5789 55.7762 41.6505 174.6693 14 V 3.8986 7.6346 125.6376 60.5151 34.0153 174.3916 15 K 3.8347 8.0578 128.6950 55.7268 32.6649 176.3014 16 I 3.9856 8.1236 127.6652 60.3201 36.5708 174.7249 17 S 4.8731 7.9700 119.8881 56.0585 64.2840 174.8604 18 D 4.9313 8.6296 124.9930 56.9306 40.8875 178.4507 19 N 4.4326 7.9610 115.8432 55.7591 38.5494 175.6087 20 N 4.6910 7.9088 113.5757 53.8127 39.2727 174.7703 21 Y 4.5807 7.6950 117.1364 58.0697 38.4261 175.6283 22 V 4.7518 8.8580 116.5645 58.4634 36.4368 173.2634 23 P 4.8833 0.0000 0.0000 62.9818 31.6143 176.3575 24 F 4.5134 9.4241 128.1236 56.7378 40.6123 173.3542 25 P 4.1161 0.0000 0.0000 63.2230 31.0359 177.0153 26 E 4.0443 8.7634 120.3681 58.5263 29.7454 177.7060 27 A 3.8932 7.7206 121.1147 53.7965 18.7676 177.4964 28 F 4.9364 7.7982 113.6497 56.4470 41.1204 174.5373 29 S 5.1447 7.8521 111.6120 57.8650 65.5129 173.5297 30 D 4.8108 9.3243 120.3206 53.7928 44.4043 175.9226 31 G 4.2466 9.2063 110.2416 45.1285 0.0000 173.8524 32 G 3.9236 7.9574 107.9165 44.5410 0.0000 174.3590 33 I 4.2057 7.3928 120.6921 61.4923 38.8823 177.2501 34 T 5.5716 8.7990 116.8304 60.2060 72.4588 172.7186 35 W 5.7437 9.5796 118.9164 56.3157 32.5266 173.0485 36 Q 3.7638 8.1456 117.9566 53.8604 32.4865 174.2430 37 L 3.8561 5.6200 125.9261 54.2967 42.3118 175.8411 38 L 4.3330 8.3261 125.7656 56.3139 43.8539 176.4272 39 H 4.7474 7.6497 115.2859 55.2072 33.2864 172.7045 40 S 5.0075 8.2920 119.8226 56.9578 66.3271 174.0206 41 S 4.4807 9.0923 121.8233 55.8008 63.0692 173.1565 42 P 2.9700 0.0000 0.0000 64.4691 31.4454 178.0770 43 E 4.0583 7.8300 119.0917 59.1189 29.8961 177.5812 44 T 3.9739 7.6058 113.7143 64.7304 68.5239 175.5290 45 S 4.5382 8.9405 114.9781 57.6025 62.3812 167.9507 46 S 5.3278 7.7421 113.6094 58.1225 65.4018 172.8270 47 W 5.8213 9.1150 117.2043 55.9819 31.9047 173.5235 48 T 5.1466 9.4988 116.8754 62.2689 72.6312 172.9267 49 A 4.7415 8.4356 125.2280 51.1213 23.7527 174.5965 50 I 4.9393 8.0650 118.1238 59.3850 41.9037 174.1049 51 F 5.4805 9.0571 126.1103 55.7635 43.3378 173.5456 52 N 5.1727 9.2258 119.7041 51.7687 41.0090 173.3410 53 C 4.8918 8.3644 122.0020 56.9466 30.9776 172.4271 54 P 4.6845 0.0000 0.0000 61.8233 32.5177 175.9096 55 A 4.0591 8.3616 124.9559 53.8913 18.6656 178.4456 56 G 4.0076 9.0632 111.3644 45.1674 0.0000 173.6625 57 S 4.9097 7.5295 115.1296 57.9885 65.3934 172.9334 58 S 5.2739 8.7204 113.8586 58.9073 66.5195 173.3809 59 F 5.5292 8.7836 118.3044 55.4536 41.0140 175.9897 60 A 4.4736 9.1112 124.0635 51.9025 19.5024 177.7012 61 S 4.6925 8.8521 115.6822 59.6490 63.9610 173.4919 62 H 5.0973 8.7444 118.3622 54.6688 32.3360 172.1946 63 I 4.8538 8.3591 119.0806 59.7512 40.9857 174.7040 64 H 4.7036 8.8475 123.4494 54.8846 28.9865 176.2752 65 A 3.5793 8.6743 126.5812 54.4609 18.9378 176.7064 66 G 4.4522 8.0356 100.3463 42.9948 0.0000 170.6093 67 P 4.4397 0.0000 0.0000 62.8210 32.5086 175.7944 68 G 4.2533 8.6518 108.7678 44.4739 0.0000 171.0582 69 E 5.1843 8.7475 122.1771 54.2592 33.1833 174.6152 70 Y 5.4887 8.0539 121.6121 55.1716 42.1411 174.6368 71 F 5.3769 9.8017 122.8722 56.6165 42.4446 173.7388 72 L 5.0257 9.7400 130.9414 54.9619 41.9635 176.9525 73 T 4.1449 8.5348 117.9509 62.9268 70.1331 175.1145 74 K 4.4499 7.8403 122.3056 55.8215 35.9888 176.6342 75 G 4.0800 9.7342 112.0547 45.1112 0.0000 171.8458 76 K 4.9001 8.2155 122.3002 55.1784 35.9968 176.4006 77 M 4.4980 8.7701 124.7983 53.9495 36.2575 173.2438 78 E 4.8939 8.7261 126.0066 54.9980 31.4868 175.3250 79 V 4.2995 8.5554 118.5791 59.8003 34.8190 176.2671 80 R 3.8478 9.5140 120.6111 57.2845 26.2646 178.0957 81 G 3.7966 8.0320 105.8459 44.5247 0.0000 175.3699 82 G 4.2003 7.7627 104.1913 44.9993 0.0000 174.4698 83 E 4.6263 8.3547 116.4885 58.1249 29.6334 178.4744 84 Q 4.1292 8.0966 120.0349 58.2328 29.2676 175.8878 85 E 4.5844 7.3142 115.0975 56.0477 30.2544 176.7701 86 G 3.9668 8.7116 105.0458 45.6939 0.0000 175.0786 87 G 4.3672 8.1408 108.4099 44.9514 0.0000 173.1475 88 S 4.9970 8.9962 117.9772 56.9914 67.5195 173.8007 89 T 4.8890 8.6197 118.9904 61.8292 70.4793 173.2208 90 A 4.6398 9.0337 129.8577 51.1617 20.5265 175.3441 91 Y 4.8995 8.0626 116.9056 55.7462 40.4607 175.8080 92 A 4.6747 8.6913 126.7941 51.4741 19.2448 175.0221 93 P 5.6016 0.0000 0.0000 61.5804 32.9137 175.3019 94 S 4.9011 8.8999 116.1647 57.6331 66.5930 171.8982 95 Y 5.2213 8.6641 120.9114 56.0426 41.9872 174.6673 96 G 3.1252 6.4414 109.3725 44.1540 0.0000 171.4522 97 F 4.9348 8.3542 125.4389 56.2545 41.3425 174.6280 98 E 4.4243 8.4217 128.0105 54.2580 30.9792 176.2311 99 S 4.2416 8.0230 119.7625 57.1673 65.0933 173.6387 100 S 4.3403 8.3993 115.2861 60.2619 62.1448 174.2413 101 G 3.9455 9.4917 117.1191 44.6022 0.0000 173.2901 102 A 3.9691 8.0537 123.1310 52.1122 19.4075 176.2548 103 L 4.5529 8.4569 125.1376 54.1448 43.5815 176.0656 104 H 4.7389 8.8289 125.3043 53.5117 28.5293 175.0589 105 G 3.6301 8.4975 111.5190 48.3776 0.0000 171.9864 106 K 4.7728 7.4193 116.1386 55.2450 33.7149 173.4777 107 T 3.9797 7.9416 118.1264 63.8433 69.8339 173.3095 108 F 5.0690 8.5977 128.1638 56.2312 43.1832 174.0602 109 F 4.6777 7.3995 123.1552 55.0003 40.2773 174.5285 110 P 4.2226 0.0000 0.0000 64.3461 31.5583 176.6654 111 V 4.5580 7.1386 115.8231 60.2145 35.2407 174.6174 112 E 4.1944 8.7533 124.8128 56.9772 30.1750 175.8652 113 S 4.8538 9.0190 121.8675 57.7160 68.5077 172.2470 114 Q 5.5695 9.1706 119.7539 56.1324 32.6417 173.1884 115 F 5.5479 8.6356 119.9203 55.7714 41.6984 172.2049 116 Y 5.1486 9.1743 122.5759 56.6229 41.2392 173.9747 117 M 5.2149 8.3141 124.3020 54.4694 36.5618 173.1084 118 T 4.6840 8.3268 115.6264 59.8098 71.6635 173.1405 119 F 4.9756 8.9897 122.9908 55.3920 42.6786 173.7483 120 L 4.7601 8.8057 124.7250 55.3442 43.8386 176.8253 121 G 4.0504 9.0574 114.8781 43.8286 0.0000 169.8098 122 P 5.1207 0.0000 0.0000 61.9790 34.1381 174.6006 123 L 4.7903 8.8163 120.3099 53.1175 43.8621 175.9684 124 N 5.1375 8.8409 123.2732 51.9937 39.5766 174.5281 125 F 4.8771 9.4544 124.9552 57.0598 40.2169 175.2178 126 I 5.1582 8.4562 117.1403 59.2237 40.4829 175.7064 127 D 4.7743 8.5893 123.0442 52.4256 41.5102 176.3353 128 D 4.3834 8.5968 117.2204 57.3328 41.2766 177.1940 129 N 4.5166 8.9568 115.0736 53.6527 38.9157 175.8888 130 G 4.0269 8.0125 106.4600 44.8943 0.0000 173.6862 131 K 4.1562 8.0888 119.8780 55.2697 32.8615 176.4180 132 V 4.0612 8.4504 123.9690 63.3252 31.4775 175.3149 133 I 4.4612 8.4357 120.8423 60.6968 38.9180 175.6113 134 A 4.2620 7.5925 120.7112 51.5745 22.4172 175.0983 135 S 4.8612 9.0684 118.8837 57.0327 63.3678 173.3411 136 I 3.9918 8.7540 129.9654 60.0457 38.3511 175.2277 137 G 3.9577 8.6663 120.0138 43.0030 0.0000 172.1469 138 W 3.4849 8.4316 115.2207 59.6269 27.7544 177.9367 139 A 2.9441 5.8000 120.7840 54.3075 17.6610 179.3487 140 E 3.6745 7.3797 116.3954 59.2103 29.5931 179.2032 141 A 3.8940 7.7597 121.3222 55.1235 18.3077 179.5126 142 Q 4.1976 8.4495 118.7176 59.1881 29.1449 178.6184 143 G 3.5635 8.0379 106.6424 47.7785 0.0000 175.6164 144 A 4.0909 8.0769 123.3080 54.3797 18.1246 179.6750 145 W 4.2221 8.1924 126.3364 60.7712 30.9468 178.0738 146 L 3.8616 8.2551 117.8325 57.4043 41.0927 178.9577 147 A 4.0869 7.7979 120.0613 54.9636 19.4758 179.4603 148 T 4.2275 7.3285 107.1359 60.9834 67.0009 174.7126 149 K 3.5832 7.4235 125.2920 57.2902 32.2900 175.9853 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 4.43 0.00 2.03 2.08 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 2.51 2.58 0.00 2 D 8.17 4.87 0.00 2.75 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.36 4.05 0.00 2.93 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 4 C 7.44 4.33 0.00 2.68 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 5 N 8.46 4.60 0.00 2.72 2.81 0.00 0.00 6.95 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 6 K 8.43 4.73 0.00 1.72 1.66 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.29 7.81 7 K 8.16 4.71 0.00 1.83 1.76 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.29 1.40 7.81 8 H 8.84 4.04 0.00 3.14 3.28 0.00 5.73 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 T 8.12 4.03 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 10 A 8.39 4.14 1.26 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 11 E 8.61 4.31 0.00 1.99 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 2.35 2.43 0.00 12 E 8.34 4.83 0.00 1.92 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 0.00 2.23 2.30 0.00 13 Y 8.46 4.79 0.00 2.83 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 14 V 7.63 3.90 1.90 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 0.67 0.00 0.00 0.82 0.00 0.00 15 K 8.06 3.83 0.00 1.63 1.59 0.00 1.74 0.00 0.00 1.83 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.50 7.81 16 I 8.12 3.99 1.86 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 1.18 0.60 0.89 0.00 0.00 17 S 7.97 4.87 0.00 3.83 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 18 D 8.63 4.93 0.00 2.82 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 19 N 7.96 4.43 0.00 2.74 2.90 0.00 0.00 6.94 7.88 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 20 N 7.91 4.69 0.00 2.79 3.02 0.00 0.00 7.03 7.51 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 21 Y 7.69 4.58 0.00 2.90 2.97 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 22 V 8.86 4.75 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 0.62 0.00 0.00 1.06 0.00 0.00 23 P 0.00 4.88 0.00 2.04 2.10 0.00 3.77 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 2.09 2.18 0.00 24 F 9.42 4.51 0.00 3.13 3.09 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 0.00 0.00 0.00 0.00 25 P 0.00 4.12 0.00 2.21 2.04 0.00 2.20 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.29 0.00 26 E 8.76 4.04 0.00 2.08 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 2.24 2.25 0.00 27 A 7.72 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 F 7.80 4.94 0.00 2.89 2.57 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 29 S 7.85 5.14 0.00 3.88 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 30 D 9.32 4.81 0.00 2.75 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 31 G 9.21 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 0.00 0.00 0.00 32 G 7.96 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 0.00 0.00 0.00 33 I 7.39 4.21 1.83 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.47 0.82 0.00 0.00 34 T 8.80 5.57 4.52 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 1.33 0.00 0.00 35 W 9.58 5.74 0.00 3.10 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 36 Q 8.15 3.76 0.00 1.27 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.99 0.00 0.00 0.00 0.00 0.00 2.00 1.16 0.00 37 L 5.62 3.86 0.00 0.35 0.13 1.18 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.33 4.33 0.00 1.56 1.60 0.97 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 39 H 7.65 4.75 0.00 3.15 3.10 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.29 5.01 0.00 3.73 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 41 S 9.09 4.48 0.00 3.85 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 42 P 0.00 2.97 0.00 1.71 0.87 0.00 3.43 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 43 E 7.83 4.06 0.00 1.86 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 0.00 2.25 2.29 0.00 44 T 7.61 3.97 4.24 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 1.25 0.00 0.00 45 S 8.94 4.54 0.00 4.04 4.32 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 46 S 7.74 5.33 0.00 4.12 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 47 W 9.11 5.82 0.00 3.71 3.32 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 48 T 9.50 5.15 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 0.87 0.00 0.00 49 A 8.44 4.74 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 50 I 8.06 4.94 1.91 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 1.36 1.72 0.71 0.00 0.00 51 F 9.06 5.48 0.00 2.31 2.80 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 52 N 9.23 5.17 0.00 2.38 2.51 0.00 0.00 6.77 7.28 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 53 C 8.36 4.89 0.00 1.96 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 0.00 0.00 0.00 54 P 0.00 4.68 0.00 2.02 1.93 0.00 3.49 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.01 0.00 55 A 8.36 4.06 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 56 G 9.06 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 57 S 7.53 4.91 0.00 3.99 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 58 S 8.72 5.27 0.00 4.14 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 0.00 59 F 8.78 5.53 0.00 3.10 3.21 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 60 A 9.11 4.47 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 61 S 8.85 4.69 0.00 3.90 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 62 H 8.74 5.10 0.00 2.50 2.14 0.00 5.20 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 8.36 4.85 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.71 0.90 0.00 0.00 64 H 8.85 4.70 0.00 2.99 3.42 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 65 A 8.67 3.58 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 66 G 8.04 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.44 0.00 2.12 2.19 0.00 3.68 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.07 0.00 68 G 8.65 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 0.00 0.00 0.00 69 E 8.75 5.18 0.00 1.96 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 2.52 2.39 0.00 70 Y 8.05 5.49 0.00 3.30 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 71 F 9.80 5.38 0.00 3.26 3.14 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 0.00 72 L 9.74 5.03 0.00 2.04 1.84 1.18 0.94 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 73 T 8.53 4.14 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 0.40 0.00 0.00 74 K 7.84 4.45 0.00 1.80 1.70 0.00 1.73 0.00 0.00 1.94 0.00 0.00 2.80 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.41 1.45 7.81 75 G 9.73 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 76 K 8.22 4.90 0.00 1.48 1.48 0.00 1.61 0.00 0.00 1.43 0.00 0.00 2.13 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.05 0.81 7.81 77 M 8.77 4.50 0.00 1.74 1.63 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.93 0.00 78 E 8.73 4.89 0.00 1.88 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 2.17 2.22 0.00 79 V 8.56 4.30 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 0.35 0.00 0.00 0.95 0.00 0.00 80 R 9.51 3.85 0.00 1.99 1.97 0.00 3.12 0.00 0.00 3.35 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.62 0.00 81 G 8.03 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 82 G 7.76 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 0.00 0.00 0.00 0.00 83 E 8.35 4.63 0.00 2.14 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 0.00 2.34 2.40 0.00 84 Q 8.10 4.13 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.54 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 85 E 7.31 4.58 0.00 2.01 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 2.20 2.18 0.00 86 G 8.71 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 87 G 8.14 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 88 S 9.00 5.00 0.00 3.74 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 89 T 8.62 4.89 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 1.01 0.00 0.00 90 A 9.03 4.64 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 91 Y 8.06 4.90 0.00 2.92 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 A 8.69 4.67 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 5.60 0.00 2.40 2.28 0.00 3.49 0.00 0.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.92 0.00 94 S 8.90 4.90 0.00 4.06 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 95 Y 8.66 5.22 0.00 2.82 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 96 G 6.44 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 0.00 0.00 0.00 97 F 8.35 4.93 0.00 2.94 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 98 E 8.42 4.42 0.00 1.59 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 2.22 2.41 0.00 99 S 8.02 4.24 0.00 3.92 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 0.00 100 S 8.40 4.34 0.00 3.86 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 0.00 101 G 9.49 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 0.00 102 A 8.05 3.97 1.15 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 0.00 103 L 8.46 4.55 0.00 1.60 1.56 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 104 H 8.83 4.74 0.00 2.63 3.03 0.00 5.70 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 0.00 105 G 8.50 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 0.00 0.00 0.00 106 K 7.42 4.77 0.00 1.70 1.67 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 1.49 7.81 107 T 7.94 3.98 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 0.81 0.00 0.00 108 F 8.60 5.07 0.00 3.13 2.71 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 0.00 109 F 7.40 4.68 0.00 2.78 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 0.00 110 P 0.00 4.22 0.00 2.02 2.22 0.00 3.57 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.22 0.00 111 V 7.14 4.56 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 0.78 0.00 0.00 0.94 0.00 0.00 112 E 8.75 4.19 0.00 1.99 1.83 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 2.23 2.29 0.00 113 S 9.02 4.85 0.00 3.71 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 0.00 114 Q 9.17 5.57 0.00 2.07 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.72 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 115 F 8.64 5.55 0.00 3.28 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 0.00 116 Y 9.17 5.15 0.00 3.14 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 0.00 117 M 8.31 5.21 0.00 2.04 2.07 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 2.17 0.81 0.00 118 T 8.33 4.68 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 1.15 0.00 0.00 119 F 8.99 4.98 0.00 1.60 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 0.00 120 L 8.81 4.76 0.00 1.84 1.72 1.02 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 121 G 9.06 4.05 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 0.00 0.00 0.00 122 P 0.00 5.12 0.00 2.15 2.22 0.00 3.76 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.03 0.00 123 L 8.82 4.79 0.00 1.42 1.08 0.56 0.43 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 0.00 124 N 8.84 5.14 0.00 2.59 2.78 0.00 0.00 6.60 8.92 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 0.00 125 F 9.45 4.88 0.00 3.31 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 0.00 126 I 8.46 5.16 1.91 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 1.32 0.71 0.99 0.00 0.00 127 D 8.59 4.77 0.00 2.93 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 0.00 128 D 8.60 4.38 0.00 2.67 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 0.00 129 N 8.96 4.52 0.00 2.82 2.85 0.00 0.00 7.30 8.09 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 0.00 130 G 8.01 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 0.00 131 K 8.09 4.16 0.00 2.28 1.76 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.38 7.81 132 V 8.45 4.06 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 0.89 0.00 0.00 0.95 0.00 0.00 133 I 8.44 4.46 1.91 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 1.44 0.95 1.00 0.00 0.00 134 A 7.59 4.26 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 0.00 135 S 9.07 4.86 0.00 3.89 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 0.00 136 I 8.75 3.99 1.90 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 1.18 0.16 0.55 0.00 0.00 137 G 8.67 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 0.00 138 W 8.43 3.48 0.00 3.57 3.33 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 0.00 139 A 5.80 2.94 0.11 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 0.00 140 E 7.38 3.67 0.00 1.90 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 0.00 2.30 2.22 0.00 141 A 7.76 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 Q 8.45 4.20 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 143 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 0.00 144 A 8.08 4.09 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 W 8.19 4.22 0.00 3.39 3.36 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 0.00 146 L 8.26 3.86 0.00 1.63 1.68 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 147 A 7.80 4.09 1.36 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 0.00 0.00 0.00 148 T 7.33 4.23 4.24 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 1.28 0.00 0.00 149 K 7.42 3.58 0.00 1.75 1.55 0.00 0.96 0.00 0.00 1.37 0.00 0.00 2.92 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.24 1.24 7.81