NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5567 8.3049 120.5866 55.7388 33.2934 174.4012 2 H 5.1699 9.2642 123.5775 53.5382 32.7419 171.5477 3 A 5.0524 10.2868 125.1374 50.6314 21.3438 175.5972 4 L 5.0533 9.2969 123.8239 53.3049 44.2460 176.0570 5 V 4.8476 8.6996 123.1107 60.9793 34.8548 174.1119 6 Q 4.5955 8.8317 129.8752 56.2991 29.5433 175.9465 7 L 4.8243 8.9647 125.1406 54.4758 43.6197 176.8038 8 R 4.6472 8.0065 117.5419 53.6699 33.2155 175.4951 9 G 3.9400 8.7136 111.1568 45.7244 0.0000 172.6574 10 E 4.0877 8.5219 115.4431 57.7728 30.4073 177.1022 11 V 3.7443 7.6271 118.7640 64.4273 31.6859 175.9718 12 N 4.5142 8.9358 122.9017 53.7082 37.1768 174.3924 13 M 4.1525 7.6979 116.0710 54.4497 32.2465 176.4010 14 H 4.0040 8.6323 118.6867 56.7291 30.8012 176.5699 15 T 3.8643 8.4577 121.0428 66.7283 68.3239 176.9314 16 D 4.3455 8.0879 120.2393 55.8658 39.2714 178.5532 17 I 3.7098 7.4120 121.2423 64.1216 37.5354 177.4520 18 Q 3.8291 7.9302 120.3304 59.4837 28.7375 178.2633 19 D 4.3693 8.7678 120.0829 57.5386 40.7500 179.0506 20 T 3.8188 7.3478 115.9089 66.6833 68.4316 176.6509 21 L 3.9661 7.8364 120.8376 57.9866 41.6594 179.5853 22 E 3.8908 8.0992 118.5014 59.5050 29.1743 179.2088 23 M 4.2178 8.0601 118.1194 57.5831 31.9608 177.3521 24 L 4.5590 7.6853 118.0658 54.3201 42.4246 176.3491 25 N 4.2854 7.7271 113.6262 53.9296 36.7261 173.7634 26 I 4.5044 7.8925 111.8149 59.6522 39.1347 174.9166 27 H 4.8437 8.7965 119.3586 55.3320 30.5162 172.5841 28 H 4.8489 7.5326 115.7393 53.9538 32.6293 173.0783 29 V 3.7566 8.0425 121.4784 64.4507 31.6718 176.1566 30 N 4.5683 9.3732 122.5647 53.6642 37.2213 173.5269 31 H 4.8170 7.9092 116.2626 55.2475 30.4509 173.9075 32 C 5.9835 8.9860 122.3286 57.2590 34.8440 172.4411 33 T 5.0718 8.3218 117.4793 60.4103 71.4972 172.0414 34 L 5.1193 8.4746 124.5586 52.9032 43.8054 176.3121 35 V 4.0530 8.5937 124.5086 58.7000 33.8976 173.8617 36 P 4.4992 0.0000 0.0000 62.7937 32.2222 176.6156 37 E 4.3137 9.1026 123.2408 55.6280 28.4869 176.1374 38 T 4.7904 7.8878 119.8433 60.7250 73.7496 174.5276 39 D 4.3148 8.4737 120.5358 57.6037 40.4929 178.7790 40 A 3.9199 7.9241 120.7013 55.6396 18.5806 179.2533 41 Y 4.0430 7.8882 114.4085 60.6530 37.9449 178.4998 42 R 3.9466 8.2208 120.2915 59.4023 30.2902 178.4616 43 G 3.7753 8.0644 105.5245 48.2878 0.0000 175.3853 44 M 4.0375 7.6937 120.3655 58.3704 32.0544 179.4325 45 V 3.5445 7.6766 111.6857 64.0059 31.3187 178.5758 46 A 3.9674 7.7064 120.2497 54.9779 18.2956 179.3393 47 K 4.0456 7.7852 116.7736 58.9730 32.4890 178.4006 48 V 4.1229 7.6440 117.0159 63.7181 31.4953 177.4917 49 N 4.1645 7.7152 116.7511 57.2513 39.0709 174.7784 50 D 4.5386 8.0589 114.5957 54.9673 41.3982 176.2762 51 F 5.0543 8.8855 117.5637 56.7912 42.0027 174.2407 52 V 5.1251 7.8563 118.4679 60.1764 35.7886 173.5809 53 A 5.1679 9.0967 121.3832 50.3525 22.0535 175.4466 54 F 6.0410 8.3365 116.5697 54.1059 42.4763 173.8339 55 G 4.2435 8.1728 105.8010 46.2986 0.0000 170.3363 56 E 5.2057 8.0844 121.2061 53.9882 30.7819 173.9358 57 P 4.8455 0.0000 0.0000 62.1170 32.7961 176.5967 58 S 4.4422 8.9661 115.0819 57.6843 65.2712 174.7442 59 Q 3.9263 8.6810 124.0993 59.8743 28.6947 179.1337 60 E 3.9633 8.2321 118.4377 59.8786 29.5175 179.3436 61 T 3.8124 7.5240 114.8795 66.6745 68.5664 176.1236 62 L 3.9091 8.0351 122.0905 58.3012 41.9898 178.8018 63 E 3.9295 8.2460 118.2568 59.7852 29.4818 179.2829 64 T 3.8325 8.3292 115.8772 66.7397 68.0966 176.5813 65 V 3.5105 7.9206 119.8234 66.0671 31.5882 177.6596 66 L 4.0436 8.4508 118.6992 57.9335 41.2991 179.5542 67 A 4.0866 8.0756 119.2031 55.6584 18.4810 179.3805 68 T 4.0590 8.2544 110.4159 64.2906 67.4205 175.2422 69 R 4.5145 8.8970 116.8261 55.3951 31.6668 175.0828 70 A 4.3338 7.7696 121.1415 51.7853 19.6277 177.3564 71 E 4.5631 7.9380 118.0404 53.7385 33.9786 173.5228 72 P 4.5485 0.0000 0.0000 62.1449 32.4345 177.0681 73 L 4.1500 8.3870 123.3696 57.8508 42.3428 177.0666 74 E 4.5526 8.0843 115.6910 56.6020 33.7495 175.5575 75 G 4.0268 8.7327 108.1193 45.0962 0.0000 173.2433 76 D 4.2558 8.9630 117.8384 57.4527 41.0363 177.7028 77 A 3.6898 7.0041 119.5317 50.2744 18.0079 176.2259 78 D 4.2974 8.5250 123.4221 54.1897 41.5183 177.0642 79 V 3.6681 7.9240 124.4033 61.3990 30.4402 174.0827 80 D 5.1061 8.1639 126.3436 50.6963 42.5724 176.8742 81 D 4.4592 8.9106 117.8852 57.9013 40.6235 178.6704 82 E 3.9217 8.3418 118.8247 59.1217 29.6902 178.2933 83 W 3.9185 9.1564 128.4998 60.5329 30.8148 177.6268 84 V 3.9325 8.8983 118.2379 66.3508 30.6734 177.9158 85 A 4.2430 8.3779 120.1930 54.8295 18.4845 179.1059 86 E 4.0149 8.3627 114.1037 58.0669 29.6065 177.3313 87 H 4.4441 7.7066 113.9905 55.2081 31.0297 173.1241 88 T 4.7471 8.0036 114.8562 61.4201 71.0857 173.7899 89 D 4.3402 8.7269 120.8816 56.8185 40.8119 176.7773 90 Y 4.2494 7.9683 116.9038 57.2368 39.1874 175.2455 91 D 4.6975 8.4383 119.2337 55.4183 42.2853 176.4713 92 D 4.6331 7.7458 117.4826 51.2099 43.0038 176.0082 93 I 3.7322 9.0152 120.8547 65.0500 36.9596 178.8325 94 S 4.2582 8.2687 115.2284 61.6051 62.5068 176.9121 95 G 3.7835 7.9003 107.2584 47.6620 0.0000 175.5491 96 L 3.0665 8.0260 122.4998 57.5546 42.1790 178.3902 97 A 3.8981 8.5853 121.3312 55.5106 18.2017 179.0247 98 F 4.0127 8.5255 118.5100 61.6717 39.2743 177.3220 99 A 4.1069 7.6272 121.4182 54.6377 18.1088 179.3093 100 L 3.7987 7.8448 117.5744 57.9698 41.5054 179.4805 101 L 3.8830 7.7025 118.2945 57.9431 41.8570 179.2669 102 S 4.1375 7.8408 111.4087 57.5243 63.5025 173.7193 103 E 3.7824 8.1434 121.3028 57.8177 27.3009 174.7487 104 E 4.3595 8.3302 118.2315 57.2787 31.0898 174.4908 105 T 5.2486 7.6207 110.2324 60.1468 70.6588 172.2019 106 T 4.7315 8.1011 111.7647 58.8934 73.1310 174.3310 107 L 3.9543 8.5456 121.5424 58.1711 41.3678 180.3322 108 R 4.2304 7.7807 118.6667 58.8941 30.4493 178.5045 109 E 3.5313 7.9306 118.0243 58.8648 29.1341 178.6127 110 Q 4.6668 7.5742 116.3369 54.7898 29.7333 175.3879 111 G 4.0521 9.3101 109.1303 46.9631 0.0000 173.7602 112 L 5.0497 8.4608 119.1570 51.8205 44.8986 176.4743 113 S 4.1637 8.7941 117.6422 57.8787 62.6217 173.3598 114 P 4.4134 0.0000 0.0000 64.1829 31.1559 175.8142 115 T 4.7127 7.7361 115.7921 61.7150 71.1678 174.0466 116 L 4.2617 9.1909 127.9821 53.4579 42.2668 175.8918 117 R 4.1564 8.2502 123.4052 55.5639 28.8274 176.5019 118 L 4.3560 8.2238 124.1818 54.6489 43.0846 175.2960 119 H 4.9257 8.3937 119.8128 53.8599 31.7980 172.7210 120 P 4.5064 0.0000 0.0000 61.8792 32.3324 174.4707 121 P 4.4154 0.0000 0.0000 62.8254 32.2904 175.9577 122 R 4.1044 8.7696 125.8870 57.7282 30.1170 177.3945 123 G 3.8241 8.8022 112.2433 44.1485 0.0000 173.7565 124 G 3.9737 8.1301 106.2155 45.5248 0.0000 172.9588 125 H 4.7751 7.8607 114.9758 54.1288 30.6692 175.2695 126 D 4.6642 9.6786 117.5804 54.6432 40.7456 177.2676 127 G 4.1833 7.9248 106.1810 45.7867 0.0000 174.7631 128 V 4.6924 7.9244 112.8909 61.0718 32.3219 176.7774 129 K 4.4757 8.0224 117.6451 55.9670 34.5873 176.2941 130 H 4.9500 7.6565 115.1003 52.3663 32.6935 172.0185 131 P 4.8139 0.0000 0.0000 61.7411 34.1706 176.9820 132 V 3.6113 8.0831 115.5789 66.4052 31.3556 178.3654 133 K 4.1561 8.0188 115.6381 58.1820 31.8807 177.1229 134 E 4.4473 7.9385 116.9752 55.8109 30.0609 176.8184 135 G 3.9255 8.6376 107.8253 45.3327 0.0000 175.0909 136 G 4.4514 8.1617 110.0593 44.2205 0.0000 174.4860 137 Q 4.4626 8.1851 124.3402 55.4864 30.5497 175.8104 138 L 4.6765 7.8152 116.4229 54.4349 43.7537 177.2241 139 G 4.0281 8.4288 108.0168 43.8857 0.0000 172.4893 140 K 2.5705 7.8438 119.2295 56.3625 32.7223 176.4753 141 H 4.9759 8.2590 122.3493 53.6726 32.7743 172.9613 142 D 4.5945 8.4024 118.7258 54.3604 41.8584 178.2602 143 T 3.8032 8.5410 118.8464 66.1596 68.5433 176.5854 144 E 4.1353 8.1916 121.1646 58.7388 29.6475 178.8233 145 G 3.5610 7.8353 105.4865 47.7538 0.0000 175.6588 146 I 3.7404 8.7047 123.7764 64.1587 37.1275 178.0708 147 D 4.4054 7.9045 119.1920 57.5687 40.5701 178.6759 148 D 4.3506 7.9492 118.7140 57.4175 40.8901 178.5281 149 L 3.9383 7.6409 120.5839 58.1693 41.9196 178.5846 150 L 3.9642 8.1054 118.2316 58.2044 41.9864 179.3181 151 E 4.0939 8.8618 118.1179 59.4422 29.4417 179.3506 152 A 4.1873 8.5274 120.6144 54.1878 18.2731 178.4040 153 M 4.7219 7.7131 116.9466 55.1067 32.6575 176.2440 154 R 4.0706 7.7978 125.3067 56.6645 30.1724 176.0152 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 1.94 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 2.54 2.41 0.00 2 H 9.26 5.17 0.00 3.13 3.30 0.00 5.67 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 10.29 5.05 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 9.30 5.05 0.00 1.57 1.60 0.90 0.82 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 5 V 8.70 4.85 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 1.05 0.00 0.00 0.95 0.00 0.00 6 Q 8.83 4.60 0.00 2.25 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.39 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 7 L 8.96 4.82 0.00 1.58 1.67 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.01 4.65 0.00 2.07 2.02 0.00 3.12 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 9 G 8.71 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 0.00 0.00 0.00 10 E 8.52 4.09 0.00 2.27 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 2.30 2.26 0.00 11 V 7.63 3.74 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 0.81 0.00 0.00 0.93 0.00 0.00 12 N 8.94 4.51 0.00 2.95 3.00 0.00 0.00 7.13 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 7.70 4.15 0.00 1.79 1.04 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.44 0.00 14 H 8.63 4.00 0.00 3.15 3.49 0.00 5.62 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 15 T 8.46 3.86 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 1.25 0.00 0.00 16 D 8.09 4.35 0.00 2.84 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 7.41 3.71 1.85 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 1.53 0.54 0.79 0.00 0.00 18 Q 7.93 3.83 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 19 D 8.77 4.37 0.00 2.65 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 20 T 7.35 3.82 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 1.19 0.00 0.00 21 L 7.84 3.97 0.00 1.82 1.67 0.87 1.01 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 22 E 8.10 3.89 0.00 2.14 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 23 M 8.06 4.22 0.00 1.96 2.23 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.56 0.00 24 L 7.69 4.56 0.00 1.77 1.70 0.94 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 25 N 7.73 4.29 0.00 2.92 2.93 0.00 0.00 6.68 7.21 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 26 I 7.89 4.50 1.89 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 1.38 0.60 0.95 0.00 0.00 27 H 8.80 4.84 0.00 2.94 3.14 0.00 5.89 0.00 0.00 0.00 0.00 7.12 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 4.85 0.00 2.58 2.94 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 8.04 3.76 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 0.94 0.00 0.00 30 N 9.37 4.57 0.00 2.98 3.03 0.00 0.00 6.96 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 31 H 7.91 4.82 0.00 3.26 3.21 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 8.99 5.98 0.00 2.95 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 8.32 5.07 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 1.24 0.00 0.00 34 L 8.47 5.12 0.00 1.46 1.49 0.87 0.81 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 35 V 8.59 4.05 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 0.81 0.00 0.00 0.38 0.00 0.00 36 P 0.00 4.50 0.00 1.77 1.93 0.00 2.27 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.92 0.00 37 E 9.10 4.31 0.00 1.89 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 2.20 2.19 0.00 38 T 7.89 4.79 4.51 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 0.00 0.00 0.00 1.26 0.00 0.00 39 D 8.47 4.31 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 7.92 3.92 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 41 Y 7.89 4.04 0.00 3.12 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 42 R 8.22 3.95 0.00 2.23 1.97 0.00 3.16 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 43 G 8.06 3.78 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 0.00 44 M 7.69 4.04 0.00 2.07 2.26 0.00 0.00 0.00 0.00 0.00 1.51 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 7.68 3.54 1.51 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 0.69 0.00 0.00 0.56 0.00 0.00 46 A 7.71 3.97 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 47 K 7.79 4.05 0.00 1.85 2.04 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.45 7.81 48 V 7.64 4.12 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 1.12 0.00 0.00 0.96 0.00 0.00 49 N 7.72 4.16 0.00 2.99 2.97 0.00 0.00 7.16 8.57 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 50 D 8.06 4.54 0.00 2.14 2.23 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 51 F 8.89 5.05 0.00 2.97 3.01 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 52 V 7.86 5.13 2.20 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 0.95 0.00 0.00 1.12 0.00 0.00 53 A 9.10 5.17 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 54 F 8.34 6.04 0.00 3.16 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 55 G 8.17 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 0.00 0.00 0.00 0.00 56 E 8.08 5.21 0.00 2.09 1.88 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 2.31 2.27 0.00 57 P 0.00 4.85 0.00 2.22 2.03 0.00 3.81 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 1.97 1.94 0.00 58 S 8.97 4.44 0.00 4.09 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 59 Q 8.68 3.93 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.89 0.00 0.00 0.00 0.00 0.00 2.51 2.75 0.00 60 E 8.23 3.96 0.00 2.06 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 2.42 2.43 0.00 61 T 7.52 3.81 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 1.25 0.00 0.00 62 L 8.04 3.91 0.00 1.73 1.84 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 63 E 8.25 3.93 0.00 2.20 2.00 0.00 0.00 0.00 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 2.48 0.00 64 T 8.33 3.83 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 1.21 0.00 0.00 65 V 7.92 3.51 2.20 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 1.01 0.00 0.00 0.92 0.00 0.00 66 L 8.45 4.04 0.00 1.90 1.70 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 67 A 8.08 4.09 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 68 T 8.25 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 1.31 0.00 0.00 69 R 8.90 4.51 0.00 1.75 1.81 0.00 3.61 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.66 0.00 70 A 7.77 4.33 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 71 E 7.94 4.56 0.00 1.75 1.64 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 2.17 2.21 0.00 72 P 0.00 4.55 0.00 2.20 2.07 0.00 3.58 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.34 0.00 73 L 8.39 4.15 0.00 1.72 1.74 0.94 0.99 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 74 E 8.08 4.55 0.00 2.01 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 0.00 2.26 2.27 0.00 75 G 8.73 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 76 D 8.96 4.26 0.00 2.68 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 77 A 7.00 3.69 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 78 D 8.53 4.30 0.00 2.69 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 7.92 3.67 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 0.69 0.00 0.00 0.20 0.00 0.00 80 D 8.16 5.11 0.00 2.97 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 8.91 4.46 0.00 2.76 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 82 E 8.34 3.92 0.00 2.07 2.20 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 2.42 2.39 0.00 83 W 9.16 3.92 0.00 3.65 3.46 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 84 V 8.90 3.93 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 0.95 0.00 0.00 1.15 0.00 0.00 85 A 8.38 4.24 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 E 8.36 4.01 0.00 1.55 1.75 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 2.25 2.50 0.00 87 H 7.71 4.44 0.00 1.82 2.28 0.00 5.61 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 8.00 4.75 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 1.56 0.00 0.00 89 D 8.73 4.34 0.00 2.10 2.41 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 90 Y 7.97 4.25 0.00 3.21 3.03 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 91 D 8.44 4.70 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 7.75 4.63 0.00 3.22 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 93 I 9.02 3.73 1.91 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 1.57 0.92 0.93 0.00 0.00 94 S 8.27 4.26 0.00 4.10 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 95 G 7.90 3.78 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 0.00 96 L 8.03 3.07 0.00 1.73 1.80 0.47 0.89 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 97 A 8.59 3.90 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 98 F 8.53 4.01 0.00 3.26 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 99 A 7.63 4.11 1.21 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 0.00 0.00 100 L 7.84 3.80 0.00 1.77 1.62 0.85 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.70 3.88 0.00 1.51 1.60 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 102 S 7.84 4.14 0.00 3.81 3.40 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 0.00 103 E 8.14 3.78 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 2.16 2.30 0.00 104 E 8.33 4.36 0.00 1.90 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 0.00 2.36 2.35 0.00 105 T 7.62 5.25 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 1.13 0.00 0.00 106 T 8.10 4.73 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 8.55 3.95 0.00 1.69 1.76 0.88 0.84 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 0.00 108 R 7.78 4.23 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 7.93 3.53 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 2.41 0.00 110 Q 7.57 4.67 0.00 2.07 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.66 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 111 G 9.31 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 0.00 112 L 8.46 5.05 0.00 1.79 1.47 0.89 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.79 4.16 0.00 3.77 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 0.00 114 P 0.00 4.41 0.00 2.09 2.09 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 115 T 7.74 4.71 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 116 L 9.19 4.26 0.00 1.53 1.59 0.89 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.25 4.16 0.00 1.62 1.84 0.00 3.20 0.00 0.00 3.18 7.09 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 8.22 4.36 0.00 1.67 1.90 0.93 0.89 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 0.00 119 H 8.39 4.93 0.00 3.14 3.16 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 4.51 0.00 1.89 1.92 0.00 3.03 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 2.01 0.00 121 P 0.00 4.42 0.00 2.12 2.24 0.00 3.67 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 2.01 1.95 0.00 122 R 8.77 4.10 0.00 1.78 1.93 0.00 3.12 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.60 0.00 123 G 8.80 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 0.00 0.00 0.00 124 G 8.13 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 0.00 125 H 7.86 4.78 0.00 3.52 3.49 0.00 5.47 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 9.68 4.66 0.00 2.81 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 7.92 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 V 7.92 4.69 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 0.94 0.00 0.00 129 K 8.02 4.48 0.00 1.51 1.56 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.25 1.36 7.81 130 H 7.66 4.95 0.00 3.10 3.19 0.00 5.62 0.00 0.00 0.00 0.00 6.58 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 4.81 0.00 2.23 2.20 0.00 4.06 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 2.05 1.86 0.00 132 V 8.08 3.61 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 0.91 0.00 0.00 0.64 0.00 0.00 133 K 8.02 4.16 0.00 1.73 1.84 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.50 7.81 134 E 7.94 4.45 0.00 1.91 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 2.16 2.24 0.00 135 G 8.64 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 0.00 0.00 0.00 136 G 8.16 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 0.00 137 Q 8.19 4.46 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.67 0.00 0.00 0.00 0.00 0.00 2.26 2.40 0.00 138 L 7.82 4.68 0.00 1.70 1.52 0.88 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.43 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 0.00 140 K 7.84 2.57 0.00 1.39 1.48 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.75 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.19 1.02 7.81 141 H 8.26 4.98 0.00 2.93 3.12 0.00 5.72 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 D 8.40 4.59 0.00 2.56 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 0.00 143 T 8.54 3.80 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 1.30 0.00 0.00 144 E 8.19 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 2.46 2.37 0.00 145 G 7.84 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 0.00 146 I 8.70 3.74 2.03 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.71 0.96 0.00 0.00 147 D 7.90 4.41 0.00 2.99 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 0.00 148 D 7.95 4.35 0.00 2.90 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 7.64 3.94 0.00 1.74 1.84 0.97 0.63 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 0.00 150 L 8.11 3.96 0.00 1.79 1.75 0.92 0.96 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 8.86 4.09 0.00 2.26 2.00 0.00 0.00 0.00 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 2.33 0.00 152 A 8.53 4.19 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 0.00 153 M 7.71 4.72 0.00 2.28 2.06 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 2.74 2.57 0.00 154 R 7.80 4.07 0.00 1.78 2.05 0.00 3.42 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 1.62 1.70 0.00