NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5584 8.3049 120.5895 55.8011 33.3778 174.4263 2 H 5.2352 9.0886 123.5369 53.6058 32.4824 171.5161 3 A 5.0924 10.1183 124.7613 50.4548 21.6561 175.4642 4 L 5.1141 9.3895 123.7016 52.9696 44.4452 175.7832 5 V 4.7947 8.9178 123.9217 60.8912 34.5227 174.2222 6 Q 4.6434 8.9012 130.2425 56.2819 29.6380 175.9520 7 L 4.8025 9.0578 124.9894 54.4521 43.5431 176.7285 8 R 4.6652 8.0090 117.5314 53.6726 33.1739 175.7188 9 G 3.9471 8.6673 110.7375 45.8485 0.0000 172.4280 10 E 4.1870 8.4968 114.9627 57.2375 30.6041 176.6354 11 V 3.7319 7.5865 119.4229 64.3877 31.6847 175.6597 12 N 4.6065 9.0021 123.8494 53.4143 36.9071 174.3414 13 M 4.1769 7.5819 115.8845 54.4234 32.3189 176.3013 14 H 4.0013 8.5055 118.5282 56.3469 30.7775 176.2608 15 T 3.8158 8.5287 121.8492 66.8388 68.2959 176.7129 16 D 4.6485 8.1216 120.1309 56.0169 39.1620 178.6163 17 I 3.7527 7.3997 121.1979 64.2699 37.4712 177.5311 18 Q 3.8468 7.8311 120.3062 59.3030 28.7868 178.2282 19 D 4.3046 8.5429 120.1478 57.5457 40.8108 178.6988 20 T 3.7896 7.4992 115.9654 66.8805 68.4439 176.4478 21 L 3.9445 7.8717 120.5318 58.0495 41.5746 179.6262 22 E 3.8157 8.1855 118.4417 59.4664 29.1682 179.1931 23 M 4.2277 8.3458 118.2013 57.4506 31.9528 177.3358 24 L 4.5910 7.7116 118.2332 54.2939 42.5533 176.4073 25 N 4.2569 7.7336 113.6365 53.8228 36.8156 173.7381 26 I 4.4386 7.8738 112.3217 59.7410 38.7425 175.0501 27 H 4.8173 8.8642 120.4160 55.4455 30.0510 172.9704 28 H 4.8946 7.5277 115.8612 53.7978 32.6815 173.0423 29 V 3.7816 8.0603 121.3501 64.4391 31.9480 176.3265 30 N 4.5810 9.2656 122.2406 53.6231 37.3988 173.8794 31 H 4.8082 7.8808 116.1657 55.6562 30.2092 174.0149 32 C 5.9733 8.8456 121.4638 57.2344 35.2504 172.4340 33 T 4.9599 8.2520 116.6916 60.6786 71.2503 171.7890 34 L 5.1968 8.4036 124.8624 52.9077 43.6995 176.4103 35 V 4.0913 8.7356 123.1744 58.8724 34.3478 173.6263 36 P 4.5060 0.0000 0.0000 62.7013 32.2006 176.7951 37 E 4.2791 8.8372 123.2915 55.4956 28.3139 176.3732 38 T 4.7916 7.7882 119.3964 60.6398 73.7157 174.2103 39 D 4.3251 8.5443 121.5075 57.7682 40.5424 179.0589 40 A 3.9143 7.9516 120.6428 55.3251 18.3671 179.0326 41 Y 3.8498 7.8757 114.6876 60.6335 38.1635 177.8937 42 R 3.9674 8.7988 120.3485 59.5157 29.7294 178.9017 43 G 3.6745 8.3175 105.3875 47.7739 0.0000 175.6915 44 M 4.0758 7.4767 120.6720 58.5184 32.2739 179.2514 45 V 3.5925 7.8264 112.0677 63.8653 31.3252 178.5439 46 A 4.0034 7.7140 120.3813 54.9923 18.2795 179.2710 47 K 4.0732 7.6066 116.5099 59.0811 32.6070 178.3768 48 V 4.1135 7.6746 116.3224 63.0246 31.4573 176.8709 49 N 4.2569 7.6274 116.1988 57.5987 38.8603 174.7717 50 D 4.5706 8.1244 114.4782 54.6838 41.4073 176.2729 51 F 4.9901 8.7382 117.2518 56.7465 41.8243 174.2791 52 V 5.2857 7.8689 118.3809 60.0324 35.8225 173.6504 53 A 5.2517 9.2303 121.7205 50.2179 21.9373 175.3439 54 F 5.8667 7.7153 116.0982 55.0933 42.2716 173.6644 55 G 4.0124 8.1696 105.9662 46.4490 0.0000 170.7269 56 E 5.0691 8.0400 121.0633 54.2636 30.7266 174.0564 57 P 4.9848 0.0000 0.0000 61.9894 32.9544 176.4244 58 S 4.4552 8.8405 114.9656 57.7906 65.2946 174.5640 59 Q 3.8778 8.7048 123.9746 60.2338 28.6513 178.9070 60 E 3.8689 8.3301 117.9609 60.2909 29.5480 179.3041 61 T 3.8697 7.7668 113.6283 66.8797 68.7235 176.1495 62 L 3.8784 8.0621 121.7710 58.2414 41.6334 178.5653 63 E 3.9122 8.1636 118.4132 59.9909 29.4563 179.4246 64 T 3.8948 8.1961 115.7509 66.7589 68.3121 176.6790 65 V 3.5125 7.7258 119.6794 66.0436 31.7389 177.6921 66 L 3.9308 8.3293 118.8706 57.9541 41.2708 179.5940 67 A 4.0649 8.0804 119.3319 55.5409 18.5009 179.3522 68 T 3.9959 8.1435 110.5331 64.5609 67.5090 175.3997 69 R 4.4664 9.1962 116.0293 55.6716 30.8833 175.5199 70 A 4.4166 7.5845 119.7415 51.7687 19.7010 177.4884 71 E 4.4898 8.0741 116.9728 53.9915 34.0768 173.4730 72 P 4.5323 0.0000 0.0000 62.0081 32.4670 177.5124 73 L 4.1162 8.5021 121.3425 57.6786 41.7541 177.8082 74 E 4.5784 7.8861 114.9174 56.1712 33.6557 175.8174 75 G 4.0913 8.7008 106.7378 45.4551 0.0000 173.3800 76 D 4.3197 8.9322 118.0601 57.1847 41.1283 177.3911 77 A 3.7574 7.1453 119.6908 50.2793 18.5429 176.3343 78 D 4.3507 8.5679 123.8866 54.0797 41.5896 177.1876 79 V 3.6212 7.8809 124.2034 61.5350 30.3340 174.8503 80 D 5.0195 8.1289 126.6143 50.6972 43.3576 176.2090 81 D 4.4551 8.6484 118.3761 57.8252 40.6904 178.7648 82 E 3.9464 8.3597 118.7805 59.1494 29.7166 178.2055 83 W 4.0139 9.1449 128.4766 60.6233 30.7619 177.6059 84 V 3.9884 8.8637 118.0673 66.3877 30.7046 177.8284 85 A 4.3533 8.4451 120.3083 54.7634 18.4438 178.9369 86 E 4.0657 8.4389 114.0301 57.8051 29.7672 177.1437 87 H 4.4852 7.8015 113.7847 55.0639 30.8868 172.9820 88 T 4.7837 8.1165 115.6415 61.3958 71.2830 174.2655 89 D 4.2172 8.7013 120.5317 56.1777 41.0213 176.2442 90 Y 4.4290 7.4539 118.0396 56.8030 39.9683 175.2609 91 D 4.7183 8.6214 118.5876 55.5428 42.7364 176.0942 92 D 4.7545 7.8527 116.3396 50.8492 42.4853 175.9273 93 I 3.7094 9.1799 121.2784 65.0910 36.9742 178.5410 94 S 4.4863 7.7558 116.4226 60.9541 62.4142 176.9193 95 G 3.8060 8.1360 107.0791 47.7891 0.0000 175.1693 96 L 3.0743 7.7844 122.1268 57.3993 42.1465 178.2774 97 A 3.9063 8.2972 121.0638 55.5257 18.2102 179.1330 98 F 4.0595 8.4092 118.5386 61.6795 39.2344 177.2476 99 A 3.9991 7.8929 121.4470 54.3921 18.0939 179.6487 100 L 3.9098 7.4765 116.9268 57.8989 41.6598 179.2127 101 L 3.8879 7.7062 118.0386 57.9081 41.4680 179.2816 102 S 4.1233 7.8284 111.4797 57.5806 63.5894 173.5852 103 E 3.6378 8.0961 121.4263 57.7610 27.2184 174.7121 104 E 4.3221 8.7848 118.2582 57.2829 30.8663 174.5460 105 T 5.1167 7.5324 110.1927 61.3335 70.5906 171.8520 106 T 4.7486 8.0930 112.8873 58.8971 73.1931 174.4491 107 L 4.0146 8.4370 120.8234 58.0118 41.3663 180.2564 108 R 4.2043 7.7995 118.7439 58.9731 30.3963 178.3988 109 E 3.6091 7.8687 118.1920 59.2515 29.1293 178.6247 110 Q 4.6626 7.8242 115.4311 55.1371 29.6836 175.8379 111 G 4.0836 9.0655 108.4200 46.5297 0.0000 173.7445 112 L 5.0045 8.4140 119.5453 51.9076 44.2259 176.2325 113 S 4.3032 8.5896 117.1762 57.8216 62.6414 173.4813 114 P 4.4431 0.0000 0.0000 64.3908 31.2799 175.9333 115 T 4.7227 7.6535 115.5452 61.7115 71.3113 174.1944 116 L 4.4597 9.2134 127.5471 53.1779 42.3148 175.4227 117 R 4.3582 8.2202 122.2989 55.8438 29.3151 176.4819 118 L 4.3573 8.2439 124.8171 54.6874 43.1049 175.4721 119 H 4.9589 8.7013 119.6930 53.8703 32.0897 172.8012 120 P 4.4610 0.0000 0.0000 61.6726 32.2371 174.3979 121 P 4.4254 0.0000 0.0000 63.1997 32.1297 175.8468 122 R 4.1901 8.5814 125.4386 57.4805 30.1944 177.2518 123 G 3.8391 8.7895 112.3773 44.2225 0.0000 174.3411 124 G 3.9545 8.0959 104.2440 45.8448 0.0000 172.4656 125 H 4.8390 7.8051 114.5136 53.9294 31.0374 175.1627 126 D 4.6527 9.6176 117.5230 54.7318 40.4626 177.4617 127 G 4.2750 8.1364 105.8503 46.0087 0.0000 174.6015 128 V 4.5807 7.9007 112.1016 61.1109 32.3121 176.6975 129 K 4.4829 8.0505 117.0199 56.1033 34.3154 176.0936 130 H 4.8649 7.5935 115.2972 52.3087 32.8841 171.4948 131 P 5.0668 0.0000 0.0000 62.0148 33.9916 177.3932 132 V 3.9130 7.7317 117.4439 65.8260 31.1939 178.1449 133 K 4.1412 8.0170 115.6753 58.4165 31.8932 177.6979 134 E 4.5526 7.9170 116.8589 55.6377 30.1269 176.5782 135 G 3.8497 8.7214 108.4300 45.1635 0.0000 174.2236 136 G 4.5196 8.3975 109.1106 43.8181 0.0000 174.3820 137 Q 4.5972 8.4143 119.8406 55.6530 29.1901 175.4851 138 L 4.6267 7.6373 116.3830 54.1225 43.9583 177.7107 139 G 3.9871 8.2575 107.8808 44.3809 0.0000 172.7656 140 K 2.7881 7.9360 119.4960 56.3293 32.9428 176.7073 141 H 4.9348 8.3331 122.2781 53.6312 32.8468 172.5298 142 D 4.5976 8.3945 118.2412 54.1674 41.9273 177.3384 143 T 4.2688 8.5635 121.0492 66.0242 68.4253 176.3070 144 E 4.1391 8.1840 120.9201 58.6321 29.4858 178.6022 145 G 3.6367 7.8522 105.5867 47.6229 0.0000 175.7653 146 I 3.7611 8.5690 122.6423 64.0227 37.0048 178.1499 147 D 4.3453 7.8123 119.6636 57.6178 40.7326 178.4963 148 D 4.2602 7.8885 118.7650 57.3381 40.5645 178.7297 149 L 3.9349 7.4260 119.2750 58.0562 42.5257 178.3487 150 L 4.1320 8.2102 119.2190 58.2362 41.8288 179.5196 151 E 3.9682 9.0270 118.9460 59.5186 29.3718 179.2974 152 A 4.1947 8.3547 120.0352 54.1531 18.3360 178.4413 153 M 4.6957 7.6985 116.2333 54.9256 32.5104 176.3531 154 R 4.0496 7.6116 125.0817 56.7806 30.1254 176.0991 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 4.56 0.00 1.96 2.02 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.56 0.00 2 H 9.09 5.24 0.00 3.12 3.24 0.00 5.66 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 3 A 10.12 5.09 1.23 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 0.00 0.00 0.00 4 L 9.39 5.11 0.00 1.70 1.60 0.91 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.92 4.79 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 1.04 0.00 0.00 0.94 0.00 0.00 6 Q 8.90 4.64 0.00 2.24 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.40 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 7 L 9.06 4.80 0.00 1.56 1.66 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.01 4.67 0.00 2.07 2.00 0.00 3.08 0.00 0.00 3.12 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 9 G 8.67 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 10 E 8.50 4.19 0.00 2.31 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 2.29 2.27 0.00 11 V 7.59 3.73 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 0.82 0.00 0.00 0.93 0.00 0.00 12 N 9.00 4.61 0.00 2.97 3.04 0.00 0.00 7.17 7.66 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 13 M 7.58 4.18 0.00 1.85 1.15 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.52 0.00 14 H 8.51 4.00 0.00 3.14 3.44 0.00 5.62 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 15 T 8.53 3.82 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 1.26 0.00 0.00 16 D 8.12 4.65 0.00 2.83 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 7.40 3.75 1.77 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.90 0.69 0.00 0.00 18 Q 7.83 3.85 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 19 D 8.54 4.30 0.00 2.63 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 20 T 7.50 3.79 4.36 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 1.19 0.00 0.00 21 L 7.87 3.94 0.00 1.79 1.67 0.87 0.74 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 22 E 8.19 3.82 0.00 2.06 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 2.12 2.41 0.00 23 M 8.35 4.23 0.00 1.91 2.22 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 2.81 2.56 0.00 24 L 7.71 4.59 0.00 1.75 1.70 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 25 N 7.73 4.26 0.00 2.91 2.93 0.00 0.00 6.73 7.58 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 26 I 7.87 4.44 1.90 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 1.39 0.69 0.99 0.00 0.00 27 H 8.86 4.82 0.00 2.91 3.17 0.00 5.88 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 H 7.53 4.89 0.00 2.54 2.93 0.00 5.62 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 29 V 8.06 3.78 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 0.82 0.00 0.00 0.99 0.00 0.00 30 N 9.27 4.58 0.00 3.00 3.03 0.00 0.00 7.03 8.70 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 31 H 7.88 4.81 0.00 3.30 3.23 0.00 5.57 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 C 8.85 5.97 0.00 2.99 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 33 T 8.25 4.96 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 1.27 0.00 0.00 34 L 8.40 5.20 0.00 1.48 1.49 0.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.74 4.09 1.81 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 0.91 0.00 0.00 0.47 0.00 0.00 36 P 0.00 4.51 0.00 1.77 1.91 0.00 2.20 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.89 0.00 37 E 8.84 4.28 0.00 1.90 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 2.06 2.18 0.00 38 T 7.79 4.79 4.48 0.00 0.00 0.00 0.00 0.00 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 39 D 8.54 4.33 0.00 2.68 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 40 A 7.95 3.91 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Y 7.88 3.85 0.00 3.12 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 42 R 8.80 3.97 0.00 2.25 1.98 0.00 3.13 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 43 G 8.32 3.67 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 44 M 7.48 4.08 0.00 2.08 2.29 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.51 0.00 45 V 7.83 3.59 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.61 0.00 0.00 46 A 7.71 4.00 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 47 K 7.61 4.07 0.00 1.90 2.03 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.46 7.81 48 V 7.67 4.11 2.21 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 1.03 0.00 0.00 0.93 0.00 0.00 49 N 7.63 4.26 0.00 2.97 3.03 0.00 0.00 7.11 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 50 D 8.12 4.57 0.00 2.20 2.21 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 51 F 8.74 4.99 0.00 3.03 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 52 V 7.87 5.29 2.22 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 0.98 0.00 0.00 1.11 0.00 0.00 53 A 9.23 5.25 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 54 F 7.72 5.87 0.00 3.19 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 55 G 8.17 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 56 E 8.04 5.07 0.00 2.17 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 2.34 2.42 0.00 57 P 0.00 4.98 0.00 2.21 2.03 0.00 3.82 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 58 S 8.84 4.46 0.00 4.10 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 59 Q 8.70 3.88 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.50 2.72 0.00 60 E 8.33 3.87 0.00 2.05 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 2.43 2.45 0.00 61 T 7.77 3.87 4.40 0.00 0.00 0.00 0.00 0.00 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 62 L 8.06 3.88 0.00 1.74 1.83 0.89 0.80 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 63 E 8.16 3.91 0.00 2.27 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 2.35 2.39 0.00 64 T 8.20 3.89 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 65 V 7.73 3.51 2.24 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 1.01 0.00 0.00 0.92 0.00 0.00 66 L 8.33 3.93 0.00 1.88 1.69 0.88 1.04 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 67 A 8.08 4.06 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 68 T 8.14 4.00 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 1.37 0.00 0.00 69 R 9.20 4.47 0.00 1.77 1.83 0.00 3.59 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 70 A 7.58 4.42 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 E 8.07 4.49 0.00 1.76 1.66 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 2.18 2.23 0.00 72 P 0.00 4.53 0.00 2.40 2.18 0.00 3.64 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.52 0.00 73 L 8.50 4.12 0.00 1.79 1.79 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 74 E 7.89 4.58 0.00 1.98 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 2.26 2.27 0.00 75 G 8.70 4.09 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 0.00 0.00 0.00 76 D 8.93 4.32 0.00 2.69 2.74 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 77 A 7.15 3.76 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 78 D 8.57 4.35 0.00 2.70 2.59 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 79 V 7.88 3.62 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 0.64 0.00 0.00 0.14 0.00 0.00 80 D 8.13 5.02 0.00 3.01 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 81 D 8.65 4.46 0.00 2.75 2.84 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 82 E 8.36 3.95 0.00 2.07 2.26 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 2.41 2.39 0.00 83 W 9.14 4.01 0.00 3.57 3.41 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 84 V 8.86 3.99 2.42 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 1.08 0.00 0.00 1.13 0.00 0.00 85 A 8.45 4.35 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 86 E 8.44 4.07 0.00 1.56 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.46 0.00 87 H 7.80 4.49 0.00 1.97 2.36 0.00 5.60 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 T 8.12 4.78 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 89 D 8.70 4.22 0.00 1.93 2.37 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 90 Y 7.45 4.43 0.00 3.26 3.04 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 0.00 91 D 8.62 4.72 0.00 2.69 2.72 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 92 D 7.85 4.75 0.00 3.18 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 93 I 9.18 3.71 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.54 0.92 0.00 0.00 94 S 7.76 4.49 0.00 4.07 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 95 G 8.14 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 96 L 7.78 3.07 0.00 1.67 1.76 0.53 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.30 3.91 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 98 F 8.41 4.06 0.00 3.16 3.28 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 99 A 7.89 4.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 L 7.48 3.91 0.00 1.76 1.63 0.84 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.71 3.89 0.00 1.52 1.61 0.91 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 102 S 7.83 4.12 0.00 3.77 3.35 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 0.00 103 E 8.10 3.64 0.00 1.98 1.95 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 2.23 2.31 0.00 104 E 8.78 4.32 0.00 1.86 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 0.00 2.35 2.35 0.00 105 T 7.53 5.12 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 1.25 0.00 0.00 106 T 8.09 4.75 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 1.20 0.00 0.00 107 L 8.44 4.01 0.00 1.69 1.75 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 108 R 7.80 4.20 0.00 1.88 2.00 0.00 3.46 0.00 0.00 3.32 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.59 0.00 109 E 7.87 3.61 0.00 2.18 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 0.00 2.38 2.42 0.00 110 Q 7.82 4.66 0.00 2.18 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.63 0.00 0.00 0.00 0.00 0.00 2.63 2.66 0.00 111 G 9.07 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 0.00 112 L 8.41 5.00 0.00 1.79 1.47 0.84 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.59 4.30 0.00 3.80 3.67 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 0.00 114 P 0.00 4.44 0.00 2.09 2.10 0.00 3.67 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 2.04 2.12 0.00 115 T 7.65 4.72 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 1.14 0.00 0.00 116 L 9.21 4.46 0.00 1.52 1.58 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.22 4.36 0.00 1.63 1.86 0.00 3.21 0.00 0.00 3.17 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.50 0.00 118 L 8.24 4.36 0.00 1.64 1.87 0.93 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 119 H 8.70 4.96 0.00 3.08 3.32 0.00 5.96 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.46 0.00 1.85 1.90 0.00 3.02 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.00 0.00 121 P 0.00 4.43 0.00 2.11 2.24 0.00 3.66 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 2.00 1.96 0.00 122 R 8.58 4.19 0.00 1.83 1.94 0.00 3.13 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.61 0.00 123 G 8.79 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 0.00 0.00 0.00 124 G 8.10 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 0.00 125 H 7.81 4.84 0.00 3.56 3.48 0.00 5.47 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 9.62 4.65 0.00 2.70 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 0.00 127 G 8.14 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 V 7.90 4.58 2.04 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 0.76 0.00 0.00 0.95 0.00 0.00 129 K 8.05 4.48 0.00 1.59 1.58 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.26 1.37 7.81 130 H 7.59 4.86 0.00 3.09 3.18 0.00 5.61 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 5.07 0.00 2.22 2.18 0.00 3.90 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.00 0.00 132 V 7.73 3.91 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 1.22 0.00 0.00 0.67 0.00 0.00 133 K 8.02 4.14 0.00 1.73 1.84 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.49 7.81 134 E 7.92 4.55 0.00 2.01 1.92 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 2.19 2.32 0.00 135 G 8.72 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 8.40 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 0.00 0.00 0.00 0.00 137 Q 8.41 4.60 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.72 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 138 L 7.64 4.63 0.00 1.69 1.50 0.82 0.90 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 0.00 139 G 8.26 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 0.00 0.00 0.00 140 K 7.94 2.79 0.00 1.42 1.48 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.74 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.20 1.08 7.81 141 H 8.33 4.93 0.00 2.88 3.09 0.00 5.72 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 D 8.39 4.60 0.00 2.70 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 0.00 143 T 8.56 4.27 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 1.29 0.00 0.00 144 E 8.18 4.14 0.00 2.03 1.92 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 2.36 2.36 0.00 145 G 7.85 3.64 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 0.00 0.00 0.00 146 I 8.57 3.76 2.02 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.84 0.96 0.00 0.00 147 D 7.81 4.35 0.00 2.92 2.72 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 0.00 148 D 7.89 4.26 0.00 2.70 2.73 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 0.00 149 L 7.43 3.93 0.00 1.64 1.82 0.96 0.92 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 0.00 150 L 8.21 4.13 0.00 1.87 1.72 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 151 E 9.03 3.97 0.00 2.14 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 2.33 2.34 0.00 152 A 8.35 4.19 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 0.00 153 M 7.70 4.70 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.56 0.00 154 R 7.61 4.05 0.00 1.80 2.05 0.00 3.43 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00