NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4518 8.3001 120.3566 54.3449 34.5983 175.5056 2 A 4.5541 7.5815 120.2008 50.4982 21.7212 176.5301 3 L 4.0835 8.2628 117.6465 57.8863 42.9844 176.7908 4 K 3.8692 8.2855 119.4502 59.5809 31.7839 178.1033 5 R 3.9159 7.8218 118.9496 59.5557 30.0422 178.3693 6 I 3.6868 7.9066 119.3125 64.9020 37.1147 177.9707 7 H 4.4106 8.2557 118.4418 58.8573 29.7609 176.9257 8 K 3.9562 8.8761 121.9557 59.8155 32.0299 178.7595 9 E 4.1427 8.8128 119.1763 59.0087 28.7375 179.0868 10 L 3.9801 8.2061 120.4039 58.4169 42.2437 178.6812 11 N 4.5554 8.4537 117.0192 56.2373 38.3215 176.3709 12 D 4.3700 8.2932 119.8039 57.3082 41.3731 177.4935 13 L 4.5308 8.3350 117.4439 54.9615 41.3905 178.0374 14 A 4.5707 6.9326 123.6102 53.4827 19.8448 179.4208 15 R 3.9914 7.8519 115.2197 58.7989 30.3669 177.8479 16 D 4.8598 7.3811 120.1860 50.6820 38.8982 173.6138 17 P 4.5827 0.0000 0.0000 62.0079 32.8289 176.7473 18 P 4.4914 0.0000 0.0000 62.3867 32.2445 175.1352 19 A 4.0976 8.5167 122.5940 53.5773 18.7513 176.8684 20 Q 4.2489 9.1605 127.0675 56.7257 27.3793 173.5852 21 C 4.6643 7.8717 111.5274 58.1793 30.5829 173.1133 22 S 4.8596 9.6013 119.1405 56.7145 66.9696 173.1006 23 A 4.1920 10.0688 124.9180 51.2597 22.0533 176.4798 24 G 4.4496 8.0473 112.5606 46.1973 0.0000 171.6270 25 P 4.4709 0.0000 0.0000 62.0438 33.8957 176.5492 26 V 4.3046 8.0520 113.6444 59.3899 34.1101 176.5959 27 G 4.1294 8.4147 114.6853 46.6330 0.0000 175.2947 28 D 4.6503 8.9130 122.0726 54.7449 40.3485 175.9028 29 D 4.8555 7.5826 118.5747 52.5977 44.5073 175.6228 30 M 4.0141 8.6694 123.2090 58.3194 32.2109 177.4679 31 F 4.5578 8.9668 116.2129 57.9813 39.2854 174.4400 32 H 5.1863 7.9784 123.6512 53.7603 29.8007 171.7707 33 W 4.2644 8.7702 123.6224 55.7877 29.9984 176.0101 34 Q 4.4508 7.3815 127.6908 54.8084 26.4450 174.4152 35 A 4.3565 7.6960 124.5406 51.9247 21.2017 177.4018 36 T 5.1084 9.1433 115.4245 61.8207 70.7380 173.4378 37 I 5.0616 8.7089 125.0851 59.5177 41.5765 173.8251 38 M 5.0902 8.3252 125.9870 53.3611 34.6214 176.2027 39 G 4.2947 9.1584 110.0023 44.8092 0.0000 171.9692 40 P 4.8163 0.0000 0.0000 61.9966 32.9329 175.3053 41 N 4.7714 8.5542 113.9580 53.6339 38.3556 175.8316 42 D 4.5123 8.2161 118.1130 55.3920 40.2062 176.8577 43 S 4.7745 7.7777 114.1148 56.1184 64.9389 172.4614 44 P 4.5168 0.0000 0.0000 63.1042 30.2164 176.4398 45 Y 4.7081 7.6764 115.7142 57.0916 41.2804 176.1712 46 Q 4.6821 8.7650 122.5962 54.2918 30.3410 175.4331 47 G 3.8384 8.0864 107.8887 43.8714 0.0000 178.4417 48 G 3.5608 7.5407 110.5713 45.2005 0.0000 177.4002 49 V 3.8095 7.2142 120.4988 60.3722 31.6501 170.4894 50 F 4.9359 7.9054 125.0745 56.3782 41.0105 174.6378 51 F 5.3548 9.4164 124.2547 56.5507 40.6870 175.3308 52 L 4.3976 8.7577 123.4159 53.7804 42.2970 176.7047 53 T 4.9203 8.3701 116.1788 60.7713 69.5440 173.5504 54 I 4.5187 8.2038 128.7928 60.4956 39.0213 174.3465 55 H 5.0530 9.4131 128.4727 54.9185 31.0265 173.6619 56 F 5.3710 8.8434 126.0472 55.8289 40.8501 174.8221 57 P 4.4312 0.0000 0.0000 61.9302 33.4461 176.2913 58 T 3.9843 8.1857 113.4070 65.5802 68.8706 174.1982 59 D 5.2292 7.5833 120.6951 53.1361 41.9873 176.6492 60 Y 4.5417 8.5450 123.3716 60.6119 38.7139 176.4420 61 P 4.1420 0.0000 0.0000 62.4701 31.8272 177.3245 62 F 4.8885 8.1239 115.7247 58.5006 45.1314 175.1664 63 K 4.8606 8.9006 119.2229 53.4304 34.3697 174.2581 64 P 2.9700 0.0000 0.0000 61.6904 31.4536 174.6977 65 P 4.4532 0.0000 0.0000 62.6254 32.4170 176.7126 66 K 4.2986 9.0448 124.1429 55.3040 32.6815 175.7437 67 V 4.2132 8.2617 125.6085 62.1317 32.7973 175.1550 68 A 4.8712 9.0196 129.2794 49.8635 21.4507 175.0033 69 F 4.1064 9.3685 121.5991 59.4604 39.5990 176.8840 70 T 4.1979 8.8376 120.6152 66.3888 69.3570 175.5968 71 T 4.5782 8.1834 117.9249 62.4865 69.4428 175.0041 72 R 3.9922 9.2661 127.3349 56.5680 29.4271 174.8719 73 I 4.4442 7.6983 125.0568 59.0490 39.9344 175.6483 74 Y 3.6512 8.2741 128.2873 56.5042 37.0975 172.2410 75 H 5.5684 7.5828 121.8719 51.8206 32.7247 172.3444 76 P 4.0591 0.0000 0.0000 65.0815 31.1893 176.6553 77 N 4.6973 7.3933 112.5673 52.5552 38.9253 174.4671 78 I 4.4334 7.8496 119.4997 59.1118 39.0814 175.1420 79 N 4.3751 8.7725 123.8927 52.7617 39.0002 177.0661 80 S 4.2285 8.4262 117.3401 61.5339 62.9664 175.4731 81 N 4.4938 7.9319 115.2927 53.2500 37.7124 175.6378 82 G 4.1917 8.4512 107.5524 46.1592 0.0000 173.5008 83 S 4.3760 8.0897 116.6579 58.3449 62.5300 173.2130 84 I 4.8105 8.2428 125.5521 59.3095 39.8604 173.9317 85 C 4.7915 8.6059 125.4457 57.8196 30.4369 173.5290 86 L 4.4605 8.1857 124.2225 53.4860 43.0142 177.0991 87 D 4.3092 8.8618 123.0894 57.4587 41.2492 178.2036 88 I 4.0270 7.7495 109.4359 62.4873 37.8884 176.0753 89 L 4.4366 7.5612 120.0844 54.4527 42.0185 176.1254 90 R 4.1710 7.5859 119.8989 56.3944 31.3106 176.1043 91 S 3.6017 9.0851 119.1984 59.8406 59.8290 171.8308 92 Q 3.6340 8.0555 119.0973 56.8921 27.4983 172.0975 93 W 4.4985 8.2512 113.8311 57.1275 30.3109 173.1147 94 S 4.1774 9.1052 115.0561 58.7933 62.3284 173.5916 95 P 2.9700 0.0000 0.0000 61.6748 32.5499 174.8677 96 A 4.0696 7.3951 129.6288 49.7239 20.0094 176.5859 97 L 4.3163 6.9251 123.7061 53.1936 44.7326 176.2050 98 T 3.8944 8.1964 120.0998 62.1621 68.0409 174.5234 99 I 3.7641 8.9209 127.1575 63.9020 37.7561 178.5316 100 S 4.2041 7.8395 116.4502 61.6395 62.8100 176.5333 101 K 4.0048 7.9107 122.0124 59.3297 31.6888 179.0870 102 V 3.6749 7.6566 117.2521 66.0794 31.9414 177.5886 103 L 4.2416 8.5135 119.1553 57.8644 41.4800 179.5104 104 L 4.1094 8.4759 119.2934 57.8251 41.4252 179.7634 105 S 4.1839 7.9967 115.0215 61.5661 62.4741 176.7207 106 I 3.8272 7.5240 121.8809 64.3086 37.1359 177.9234 107 C 4.2978 7.9462 117.2766 63.0285 27.7236 176.2002 108 S 4.2165 8.3205 116.5760 60.9807 61.9836 175.7943 109 L 4.1003 7.6359 121.6183 56.3277 41.7217 178.1430 110 L 4.0216 7.5422 119.6228 57.2652 42.4780 176.1108 111 C 4.3250 7.4047 117.3986 59.2582 26.7580 170.1523 112 D 4.3199 8.8712 127.9293 53.0400 38.9299 171.6287 113 P 4.4510 0.0000 0.0000 61.5512 32.0128 174.9160 114 N 4.8896 8.5786 117.9971 51.5077 39.9864 173.3614 115 P 4.5037 0.0000 0.0000 64.4987 31.7444 175.9199 116 D 4.4267 8.0171 118.6349 53.5158 40.7876 175.4543 117 D 4.6228 8.4927 127.1871 52.7030 41.6609 172.9492 118 P 4.7310 0.0000 0.0000 62.6665 29.9613 176.7012 119 L 3.8917 7.6688 116.9365 57.2882 42.0129 176.1088 120 V 4.2350 7.5231 119.5460 60.2396 32.5062 174.2652 121 P 4.3479 0.0000 0.0000 65.1322 31.1876 177.9582 122 E 3.9088 8.1934 118.0469 59.8449 29.0755 179.4738 123 I 3.6755 7.6473 113.9250 62.8517 37.5058 177.5240 124 A 4.0104 7.6791 121.8520 54.3858 18.7131 179.5799 125 R 3.8728 8.6852 117.5102 59.3518 30.0759 179.2466 126 I 3.9224 7.8359 114.3367 63.6413 37.2842 177.7530 127 Y 3.9975 7.3739 120.0965 60.2963 38.6844 177.3683 128 K 3.7873 8.1760 120.1223 59.1745 32.3913 178.7533 129 T 4.0759 8.0115 110.2695 63.1252 68.9818 174.1556 130 D 4.6713 7.9338 121.5212 51.0716 44.9220 175.8655 131 R 4.0520 8.8354 125.9077 59.6771 30.2980 178.8851 132 E 4.0051 8.2610 117.8668 59.3380 29.2045 179.0767 133 K 3.8866 8.8694 119.3737 59.4447 32.4519 177.6625 134 Y 4.4281 7.6878 116.9622 58.9429 38.6015 177.5407 135 N 3.5334 8.2228 119.0775 55.8860 38.7679 177.3931 136 R 3.8055 7.8686 117.4553 59.3365 29.4729 178.6634 137 I 3.7526 7.4494 118.5273 62.9424 38.0102 177.4219 138 A 3.8487 7.9276 122.5352 55.1648 18.2169 179.9187 139 R 4.1292 7.4830 115.1801 58.4787 29.4386 178.7164 140 E 4.0231 7.6492 119.1234 58.8533 29.7355 178.4176 141 W 4.0859 8.8485 129.0281 60.7674 30.7040 178.0735 142 T 4.3850 8.4217 109.7511 64.7774 68.1021 176.2674 143 Q 4.0308 7.8118 121.1868 59.0253 29.0026 178.0779 144 K 4.0607 8.1860 118.2138 58.7850 32.0657 177.9297 145 Y 4.4677 7.9590 114.5694 57.0161 38.7459 176.6564 146 A 4.2269 7.6206 123.9007 51.0627 18.3983 177.6298 147 M 4.0920 8.0719 120.9847 55.8084 32.3998 176.5122 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 4.45 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.53 0.00 2 A 7.58 4.55 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.26 4.08 0.00 1.88 1.73 0.67 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.29 3.87 0.00 1.89 1.86 0.00 1.83 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.57 7.81 5 R 7.82 3.92 0.00 2.01 2.09 0.00 2.94 0.00 0.00 2.77 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.66 0.00 6 I 7.91 3.69 1.98 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.44 1.11 0.00 0.00 7 H 8.26 4.41 0.00 3.22 3.33 0.00 5.70 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.88 3.96 0.00 2.06 1.98 0.00 1.61 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.58 7.81 9 E 8.81 4.14 0.00 2.26 2.16 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 2.40 2.65 0.00 10 L 8.21 3.98 0.00 2.29 1.88 0.23 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.45 4.56 0.00 2.74 2.79 0.00 0.00 6.88 8.28 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 12 D 8.29 4.37 0.00 3.06 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 13 L 8.33 4.53 0.00 2.13 1.80 1.15 1.32 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 14 A 6.93 4.57 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 15 R 7.85 3.99 0.00 1.84 2.00 0.00 3.11 0.00 0.00 3.57 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 16 D 7.38 4.86 0.00 2.78 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 17 P 0.00 4.58 0.00 2.09 2.21 0.00 3.69 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.31 0.00 18 P 0.00 4.49 0.00 2.22 2.13 0.00 4.01 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.04 0.00 19 A 8.52 4.10 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 20 Q 9.16 4.25 0.00 2.36 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 7.06 0.00 0.00 0.00 0.00 0.00 2.45 2.37 0.00 21 C 7.87 4.66 0.00 3.10 3.05 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 22 S 9.60 4.86 0.00 3.69 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 10.07 4.19 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.05 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 25 P 0.00 4.47 0.00 1.98 2.09 0.00 3.55 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 1.97 0.00 26 V 8.05 4.30 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.88 0.00 0.00 27 G 8.41 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 28 D 8.91 4.65 0.00 2.80 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 29 D 7.58 4.86 0.00 2.76 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 30 M 8.67 4.01 0.00 1.76 1.91 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 31 F 8.97 4.56 0.00 3.30 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 32 H 7.98 5.19 0.00 3.20 3.15 0.00 5.60 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 8.77 4.26 0.00 2.97 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 7.38 4.45 0.00 1.76 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.96 0.00 0.00 0.00 0.00 0.00 1.93 1.99 0.00 35 A 7.70 4.36 1.41 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 0.00 0.00 0.00 36 T 9.14 5.11 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 0.92 0.00 0.00 37 I 8.71 5.06 2.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.58 1.20 0.00 0.00 38 M 8.33 5.09 0.00 1.93 1.98 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 39 G 9.16 4.29 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 0.00 40 P 0.00 4.82 0.00 2.50 2.17 0.00 3.98 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.04 0.00 41 N 8.55 4.77 0.00 2.88 3.01 0.00 0.00 5.98 8.08 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 42 D 8.22 4.51 0.00 2.86 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 S 7.78 4.77 0.00 4.18 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 0.00 44 P 0.00 4.52 0.00 1.86 1.87 0.00 3.66 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.68 0.00 45 Y 7.68 4.71 0.00 3.05 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 46 Q 8.76 4.68 0.00 2.31 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.91 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 47 G 8.09 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 48 G 7.54 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 49 V 7.21 3.81 1.80 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 0.46 0.00 0.00 0.23 0.00 0.00 50 F 7.91 4.94 0.00 3.16 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 F 9.42 5.35 0.00 2.99 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.76 4.40 0.00 0.93 0.13 0.91 0.74 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 53 T 8.37 4.92 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 0.92 0.00 0.00 54 I 8.20 4.52 1.73 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 1.30 0.98 1.10 0.00 0.00 55 H 9.41 5.05 0.00 3.09 3.24 0.00 5.59 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.84 5.37 0.00 3.19 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 57 P 0.00 4.43 0.00 2.28 2.16 0.00 3.64 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 2.10 2.10 0.00 58 T 8.19 3.98 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 1.20 0.00 0.00 59 D 7.58 5.23 0.00 2.88 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 60 Y 8.54 4.54 0.00 3.11 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 61 P 0.00 4.14 0.00 1.45 1.66 0.00 3.82 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 62 F 8.12 4.89 0.00 3.25 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 63 K 8.90 4.86 0.00 1.88 1.73 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.58 7.81 64 P 0.00 2.97 0.00 1.70 1.33 0.00 3.57 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.52 0.00 65 P 0.00 4.45 0.00 2.05 2.43 0.00 2.93 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.23 0.00 66 K 9.04 4.30 0.00 1.89 1.80 0.00 1.53 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.40 7.81 67 V 8.26 4.21 2.31 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 0.82 0.00 0.00 1.03 0.00 0.00 68 A 9.02 4.87 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 F 9.37 4.11 0.00 3.18 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 70 T 8.84 4.20 4.42 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 1.24 0.00 0.00 71 T 8.18 4.58 4.78 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 1.77 0.00 0.00 72 R 9.27 3.99 0.00 1.97 2.00 0.00 3.66 0.00 0.00 3.36 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 73 I 7.70 4.44 1.35 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.74 0.29 0.00 0.00 74 Y 8.27 3.65 0.00 2.59 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 75 H 7.58 5.57 0.00 2.88 2.79 0.00 5.79 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.06 0.00 1.48 1.86 0.00 3.28 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.62 0.00 77 N 7.39 4.70 0.00 2.54 2.69 0.00 0.00 6.64 7.50 0.00 0.00 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 I 7.85 4.43 1.53 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.47 0.35 0.00 0.00 79 N 8.77 4.38 0.00 2.71 2.77 0.00 0.00 6.60 7.81 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 80 S 8.43 4.23 0.00 3.79 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 81 N 7.93 4.49 0.00 2.85 2.94 0.00 0.00 6.29 7.00 0.00 0.00 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 8.45 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 0.00 0.00 0.00 83 S 8.09 4.38 0.00 3.98 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 I 8.24 4.81 1.94 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 1.62 0.84 1.29 0.00 0.00 85 C 8.61 4.79 0.00 2.95 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 86 L 8.19 4.46 0.00 1.66 1.59 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.86 4.31 0.00 2.75 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 I 7.75 4.03 1.97 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.80 0.95 0.00 0.00 89 L 7.56 4.44 0.00 1.72 1.57 1.01 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 90 R 7.59 4.17 0.00 1.95 1.92 0.00 3.39 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 91 S 9.09 3.60 0.00 4.08 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 92 Q 8.06 3.63 0.00 2.28 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 93 W 8.25 4.50 0.00 3.40 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 94 S 9.11 4.18 0.00 3.59 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 95 P 0.00 2.97 0.00 2.02 1.94 0.00 3.44 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 2.04 2.16 0.00 96 A 7.40 4.07 0.78 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 0.00 0.00 97 L 6.93 4.32 0.00 0.78 0.53 0.79 1.15 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 98 T 8.20 3.89 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 1.17 0.00 0.00 99 I 8.92 3.76 1.58 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.77 0.75 0.00 0.00 100 S 7.84 4.20 0.00 3.88 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 0.00 101 K 7.91 4.00 0.00 1.83 1.92 0.00 1.54 0.00 0.00 1.57 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.52 7.81 102 V 7.66 3.67 2.30 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 0.99 0.00 0.00 1.19 0.00 0.00 103 L 8.51 4.24 0.00 1.93 1.82 1.32 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.48 4.11 0.00 1.89 1.75 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.00 4.18 0.00 4.13 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 0.00 106 I 7.52 3.83 2.05 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.74 1.00 0.00 0.00 107 C 7.95 4.30 0.00 3.15 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 0.00 108 S 8.32 4.22 0.00 3.99 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 0.00 109 L 7.64 4.10 0.00 1.88 1.75 0.91 0.86 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 0.00 110 L 7.54 4.02 0.00 1.85 1.59 0.32 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.40 4.33 0.00 3.16 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 0.00 112 D 8.87 4.32 0.00 2.91 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 0.00 113 P 0.00 4.45 0.00 0.98 1.55 0.00 3.47 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 2.00 0.00 114 N 8.58 4.89 0.00 2.55 2.61 0.00 0.00 7.24 7.52 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 0.00 115 P 0.00 4.50 0.00 2.13 2.17 0.00 3.79 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 2.10 2.33 0.00 116 D 8.02 4.43 0.00 2.72 2.61 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 0.00 0.00 0.00 0.00 117 D 8.49 4.62 0.00 2.78 2.61 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 0.00 0.00 0.00 0.00 118 P 0.00 4.73 0.00 2.24 1.24 0.00 3.85 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.83 0.00 119 L 7.67 3.89 0.00 1.54 1.99 0.90 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.52 4.23 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 0.85 0.00 0.00 0.87 0.00 0.00 121 P 0.00 4.35 0.00 2.27 2.42 0.00 3.75 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 122 E 8.19 3.91 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 123 I 7.65 3.68 1.63 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.74 0.37 0.00 0.00 124 A 7.68 4.01 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 0.00 125 R 8.69 3.87 0.00 1.93 1.98 0.00 3.28 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.76 0.00 126 I 7.84 3.92 1.97 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 1.02 0.00 0.00 127 Y 7.37 4.00 0.00 2.52 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 0.00 128 K 8.18 3.79 0.00 1.80 2.00 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.14 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.42 7.81 129 T 8.01 4.08 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 1.19 0.00 0.00 130 D 7.93 4.67 0.00 2.70 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.84 4.05 0.00 1.90 2.09 0.00 3.31 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 132 E 8.26 4.01 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 133 K 8.87 3.89 0.00 1.81 2.10 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.11 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.51 1.48 7.81 134 Y 7.69 4.43 0.00 3.18 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 0.00 135 N 8.22 3.53 0.00 2.72 2.69 0.00 0.00 6.93 7.69 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 0.00 136 R 7.87 3.81 0.00 1.97 2.11 0.00 2.73 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.55 0.00 137 I 7.45 3.75 1.62 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.23 0.54 0.00 0.00 138 A 7.93 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 7.48 4.13 0.00 2.01 2.07 0.00 2.96 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.47 0.00 140 E 7.65 4.02 0.00 2.26 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 2.33 2.40 0.00 141 W 8.85 4.09 0.00 3.55 3.11 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 0.00 142 T 8.42 4.38 4.63 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 1.42 0.00 0.00 143 Q 7.81 4.03 0.00 2.35 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.84 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 144 K 8.19 4.06 0.00 1.65 1.69 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.69 1.54 7.81 145 Y 7.96 4.47 0.00 3.26 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 0.00 146 A 7.62 4.23 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 0.00 147 M 8.07 4.09 0.00 1.94 1.92 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00