NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 R 4.3929 8.2393 117.2890 54.8805 31.9133 174.6155 13 L 4.5284 7.4598 118.4761 49.9308 43.0255 174.1817 14 P 4.4491 0.0000 0.0000 61.8824 32.7320 176.6063 15 P 4.2998 0.0000 0.0000 64.8033 31.3433 177.7413 16 E 4.1500 7.8695 114.8040 57.6082 30.2799 177.3676 17 V 2.0000 6.8182 113.8912 60.6875 31.9250 174.9082 18 N 4.9820 7.5917 121.0875 51.7553 42.3560 174.0638 19 R 4.1890 8.5867 122.0846 58.5834 31.5888 175.7585 20 I 4.9934 8.2597 120.5146 59.7870 39.2672 174.8824 21 L 5.2633 9.1623 126.6065 53.1956 45.0079 174.9209 22 M 4.8219 9.5513 123.4075 53.9648 34.4972 174.4032 23 I 4.9655 8.7868 127.2731 59.6816 40.1554 175.0220 24 R 4.7987 8.9107 124.5914 54.4984 34.5808 174.5053 25 N 4.2070 8.7763 115.6190 54.6838 37.1049 174.5178 26 L 4.2503 8.2476 116.2719 53.4180 42.4485 175.8934 27 P 4.3363 0.0000 0.0000 62.7232 31.9846 176.4370 28 Y 4.6204 8.4884 119.6689 61.0324 37.9657 177.0439 29 K 4.5489 7.8937 117.3859 56.3965 32.8140 176.1095 30 I 4.3153 7.7531 119.2989 60.4547 39.0672 175.8308 31 T 4.3910 8.8571 118.3195 60.6067 71.3177 175.6996 32 A 4.0472 8.5732 123.7384 55.6621 18.3435 179.1825 33 E 3.9415 8.4263 116.9881 60.0925 29.4691 178.8405 34 E 4.0586 8.4664 117.9721 59.7210 29.4799 179.1596 35 M 4.2280 8.2006 118.5540 59.0203 32.0274 178.3871 36 Y 4.0455 8.2131 116.4960 61.0338 37.6610 178.4232 37 D 4.3589 8.7297 119.3266 57.4565 41.1981 178.3416 38 I 3.5322 7.9151 119.0394 64.6067 37.3891 178.1903 39 F 4.6122 8.7779 118.7185 59.9717 38.9856 178.2895 40 G 3.8106 8.5533 105.3795 46.9663 0.0000 175.3404 41 K 3.7297 7.2895 121.7673 59.4900 32.0448 177.1900 42 Y 4.5067 8.4112 113.9088 56.9527 38.4147 174.3496 43 G 4.6946 7.6862 105.2331 42.8919 0.0000 171.7552 44 P 4.3255 0.0000 0.0000 63.6977 32.0344 174.7993 45 I 4.4783 8.2544 123.6171 60.0424 38.1259 175.5753 46 R 4.2705 9.3952 129.1711 58.1317 30.4079 175.9325 47 Q 4.6556 7.3881 113.9840 55.8385 31.8511 172.1570 48 I 4.8376 8.1399 119.0713 59.8065 40.4509 175.2953 49 R 4.6618 9.0494 126.7086 54.6106 32.5203 175.5838 50 V 4.5585 8.1715 121.7615 60.5573 34.3273 175.3423 51 G 3.8518 8.7599 115.9756 46.5103 0.0000 172.9205 52 N 5.1029 8.7851 119.7267 52.1644 38.9754 173.7504 53 T 4.6782 7.6785 108.5793 59.1291 71.6764 173.0298 54 P 4.1639 0.0000 0.0000 66.0819 31.2746 177.8633 55 E 4.2345 8.1359 114.6469 58.0009 29.7953 177.2304 56 T 4.5480 8.3496 107.7171 60.6874 70.4659 174.1935 57 R 4.1492 8.0142 120.5935 58.3927 30.4798 176.5212 58 G 4.1431 9.4702 110.9505 44.9401 0.0000 172.6360 59 T 5.0333 7.5815 109.3020 60.3311 72.0939 173.0535 60 A 4.7593 8.1593 121.6865 51.3767 23.4506 174.7844 61 Y 5.1478 8.8774 117.4582 56.0943 41.2628 175.2062 62 V 4.4960 8.3838 124.1764 59.7115 34.1824 174.6678 63 V 4.5981 9.0068 125.8582 61.3419 33.3271 174.1534 64 Y 4.6505 8.6899 125.8905 57.0343 38.3762 176.0108 65 E 4.2203 9.1412 122.1744 58.6478 31.0511 176.7152 66 D 5.0108 8.0726 118.3223 51.4273 44.2745 175.9978 67 I 3.6906 8.2983 125.5161 64.0289 37.9275 178.1013 68 F 4.2948 7.9787 118.5181 60.3372 38.7237 177.0780 69 D 4.3271 8.6827 118.3745 57.3182 40.6505 178.2808 70 A 3.0628 7.4853 121.1103 55.1358 18.3422 179.4738 71 K 4.5876 8.1606 119.1331 59.1512 32.2046 178.4557 72 N 4.2193 8.3132 116.9384 56.6653 38.8881 176.7115 73 A 2.6066 7.8539 122.5255 54.8810 18.1670 179.1775 74 C 3.8369 7.9844 117.2539 62.3848 31.2850 175.5364 75 D 4.3327 7.5285 119.1929 57.8877 40.5815 178.2587 76 H 4.2889 7.8255 114.8520 57.7480 28.9820 176.9170 77 L 4.4663 7.7941 119.7536 54.0530 42.0902 176.2044 78 S 4.1771 7.1669 114.0520 59.7888 62.2404 174.1737 79 G 4.0630 9.2862 116.7574 45.4423 0.0000 172.7016 80 F 4.3207 8.2659 123.3931 57.4711 39.9331 173.9377 81 N 4.3696 7.7484 127.0057 52.8560 39.4854 174.3448 82 V 4.2992 7.9130 124.4847 60.9912 35.6698 176.1129 83 C 3.9239 8.2924 119.7513 61.4492 27.4637 174.1673 84 N 5.0335 8.8215 121.5633 53.0414 38.9749 173.8066 85 R 4.7765 7.7939 112.9420 54.9627 33.5878 173.5689 86 Y 4.6514 8.7463 119.1754 56.9620 38.8999 175.4831 87 L 4.1919 8.8994 125.5599 54.9026 43.4126 176.3520 88 V 4.5207 8.5730 123.4210 61.6741 32.9888 174.8587 89 V 4.9871 8.4252 120.9849 59.6105 34.2746 175.1062 90 L 4.8447 8.8700 124.2676 52.6756 46.3064 175.7752 91 Y 4.5343 8.3748 118.5473 58.0609 39.1346 175.1538 92 Y 4.5916 9.2423 124.3927 58.2882 40.5792 175.1710 93 N 4.6304 7.4758 122.3689 51.1197 41.5018 174.4968 94 A 4.0962 8.7593 129.8526 54.6467 18.6622 178.4098 95 N 4.4280 8.6885 115.4763 56.9768 38.8470 176.9671 96 R 3.8551 8.1806 119.3434 59.5493 29.9139 178.0899 97 A 4.0625 8.0265 119.4067 53.6851 18.3861 177.7099 98 F 4.9930 7.6019 116.1600 57.4175 39.7031 177.3729 99 Q 4.1699 8.0351 121.6767 59.2496 28.6259 178.7472 100 K 4.2901 7.9690 113.2230 57.4683 32.1570 176.7235 101 M 4.3191 7.5807 119.4011 54.5382 33.0230 176.1492 102 D 4.4760 8.7875 125.9124 53.9706 40.8271 177.6215 103 T 3.8577 8.5803 113.8525 65.0973 68.6620 175.8587 104 K 4.0733 7.9065 121.4545 59.2520 32.1011 178.9248 105 K 4.6952 8.0784 119.0209 57.9983 31.8599 178.8742 106 K 3.6537 7.7841 120.3361 59.7029 32.0375 178.0471 107 E 3.9122 7.8159 118.5243 59.7148 29.3993 179.1219 108 E 3.8899 7.5828 117.7797 59.6579 29.5477 179.3396 109 Q 3.7620 7.7545 118.4961 59.1372 29.1322 177.9482 110 L 3.9271 8.0041 120.3906 57.8743 41.7004 179.5160 111 K 3.9966 8.6902 119.6236 58.8730 32.0844 178.4740 112 L 3.8766 8.4118 121.5158 58.1429 41.9474 179.1150 113 L 4.0489 8.2568 119.0696 57.8692 41.5053 179.5281 114 K 4.2314 7.8320 120.2834 58.4332 31.7732 178.5581 115 E 4.0852 7.9110 118.1778 58.8094 29.9086 178.5947 116 K 3.8804 7.9764 117.1785 59.0917 32.4530 177.8260 117 Y 4.7109 7.7225 114.0782 56.8844 38.4808 177.2946 118 G 4.0682 8.3299 106.8019 46.6161 0.0000 174.3360 119 I 3.9523 7.4926 113.7961 60.1542 38.3366 175.2001 120 N 4.4935 8.6503 121.4031 54.2370 39.3104 174.5512 121 T 4.4188 8.2841 118.0222 62.3171 68.6048 174.5438 122 D 4.5029 7.8120 120.8723 53.8229 41.3510 174.6237 123 P 4.3991 0.0000 0.0000 62.0005 31.9138 175.6415 124 P 4.5292 0.0000 0.0000 63.2926 28.6839 176.3146 125 K 4.1211 8.0544 126.8143 57.2355 32.1328 176.1663 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 12 R 8.24 4.39 0.00 2.09 2.11 0.00 3.05 0.00 0.00 3.27 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 13 L 7.46 4.53 0.00 1.73 1.70 0.78 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.45 0.00 2.53 2.23 0.00 3.68 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 2.02 2.00 0.00 15 P 0.00 4.30 0.00 2.03 2.13 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 16 E 7.87 4.15 0.00 2.06 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 0.00 2.11 2.33 0.00 17 V 6.82 2.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.69 0.00 0.00 18 N 7.59 4.98 0.00 2.81 2.84 0.00 0.00 7.07 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.59 4.19 0.00 1.94 1.93 0.00 3.23 0.00 0.00 3.31 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.74 0.00 20 I 8.26 4.99 1.84 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.51 0.87 0.00 0.00 21 L 9.16 5.26 0.00 1.87 1.59 0.92 0.61 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 22 M 9.55 4.82 0.00 1.95 2.03 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.07 0.00 23 I 8.79 4.97 1.80 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 1.13 0.67 1.17 0.00 0.00 24 R 8.91 4.80 0.00 1.64 1.75 0.00 3.22 0.00 0.00 3.05 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.47 0.00 25 N 8.78 4.21 0.00 2.83 2.92 0.00 0.00 7.05 7.78 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 26 L 8.25 4.25 0.00 1.79 1.65 1.00 0.98 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 27 P 0.00 4.34 0.00 2.06 1.97 0.00 3.73 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 2.04 2.08 0.00 28 Y 8.49 4.62 0.00 2.93 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 29 K 7.89 4.55 0.00 1.79 1.86 0.00 1.78 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.52 7.81 30 I 7.75 4.32 2.03 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 1.54 1.10 0.97 0.00 0.00 31 T 8.86 4.39 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 1.24 0.00 0.00 32 A 8.57 4.05 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 33 E 8.43 3.94 0.00 2.13 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 0.00 2.43 2.56 0.00 34 E 8.47 4.06 0.00 2.29 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 2.38 2.41 0.00 35 M 8.20 4.23 0.00 1.88 2.25 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.91 0.00 36 Y 8.21 4.05 0.00 3.29 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 37 D 8.73 4.36 0.00 3.00 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 38 I 7.92 3.53 1.96 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.78 0.40 0.00 0.00 39 F 8.78 4.61 0.00 3.10 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 40 G 8.55 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 41 K 7.29 3.73 0.00 1.63 1.23 0.00 1.39 0.00 0.00 0.61 0.00 0.00 2.66 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.99 1.23 7.81 42 Y 8.41 4.51 0.00 3.13 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 7.69 4.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.33 0.00 2.18 2.28 0.00 3.97 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 2.18 2.10 0.00 45 I 8.25 4.48 2.11 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.01 0.80 0.00 0.00 46 R 9.40 4.27 0.00 1.87 1.91 0.00 3.27 0.00 0.00 3.08 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.55 0.00 47 Q 7.39 4.66 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.64 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 48 I 8.14 4.84 1.54 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.18 0.66 0.00 0.00 49 R 9.05 4.66 0.00 1.86 1.87 0.00 3.01 0.00 0.00 3.08 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 50 V 8.17 4.56 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.88 0.00 0.00 51 G 8.76 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 52 N 8.79 5.10 0.00 2.76 2.83 0.00 0.00 6.00 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 53 T 7.68 4.68 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 1.21 0.00 0.00 54 P 0.00 4.16 0.00 2.05 2.16 0.00 3.66 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 2.02 2.10 0.00 55 E 8.14 4.23 0.00 1.97 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 2.32 2.30 0.00 56 T 8.35 4.55 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 1.23 0.00 0.00 57 R 8.01 4.15 0.00 1.69 1.64 0.00 2.98 0.00 0.00 3.12 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.51 0.00 58 G 9.47 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 0.00 0.00 0.00 59 T 7.58 5.03 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 1.16 0.00 0.00 60 A 8.16 4.76 1.10 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 0.00 0.00 61 Y 8.88 5.15 0.00 2.78 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 62 V 8.38 4.50 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.49 0.00 0.00 63 V 9.01 4.60 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 0.94 0.00 0.00 0.83 0.00 0.00 64 Y 8.69 4.65 0.00 3.11 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 65 E 9.14 4.22 0.00 1.99 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 0.00 2.51 2.45 0.00 66 D 8.07 5.01 0.00 2.78 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 67 I 8.30 3.69 1.70 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.30 0.28 0.00 0.00 68 F 7.98 4.29 0.00 3.44 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 69 D 8.68 4.33 0.00 2.94 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.49 3.06 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 71 K 8.16 4.59 0.00 1.95 2.08 0.00 1.85 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.60 1.54 7.81 72 N 8.31 4.22 0.00 3.00 2.93 0.00 0.00 7.11 7.95 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 73 A 7.85 2.61 1.04 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 0.00 0.00 74 C 7.98 3.84 0.00 2.63 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 D 7.53 4.33 0.00 2.92 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 76 H 7.83 4.29 0.00 2.51 3.23 0.00 5.83 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 7.79 4.47 0.00 1.60 1.59 0.57 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 78 S 7.17 4.18 0.00 3.84 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 79 G 9.29 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 0.00 0.00 0.00 80 F 8.27 4.32 0.00 3.20 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 81 N 7.75 4.37 0.00 1.80 2.06 0.00 0.00 6.90 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 82 V 7.91 4.30 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 0.74 0.00 0.00 0.94 0.00 0.00 83 C 8.29 3.92 0.00 3.05 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 0.00 0.00 0.00 84 N 8.82 5.03 0.00 2.62 2.74 0.00 0.00 6.54 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 85 R 7.79 4.78 0.00 1.84 1.95 0.00 2.69 0.00 0.00 3.39 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.73 0.00 86 Y 8.75 4.65 0.00 2.76 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 87 L 8.90 4.19 0.00 1.72 1.69 1.06 0.72 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 88 V 8.57 4.52 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 0.76 0.00 0.00 0.94 0.00 0.00 89 V 8.43 4.99 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.88 0.00 0.00 90 L 8.87 4.84 0.00 1.53 1.51 0.91 0.82 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 91 Y 8.37 4.53 0.00 3.07 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 92 Y 9.24 4.59 0.00 3.21 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 93 N 7.48 4.63 0.00 2.65 2.46 0.00 0.00 6.90 8.27 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 94 A 8.76 4.10 1.55 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 0.00 0.00 95 N 8.69 4.43 0.00 2.95 2.89 0.00 0.00 6.85 7.42 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 96 R 8.18 3.86 0.00 1.86 1.93 0.00 3.20 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.69 0.00 97 A 8.03 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 F 7.60 4.99 0.00 3.17 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 99 Q 8.04 4.17 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.19 6.91 0.00 0.00 0.00 0.00 0.00 2.40 2.60 0.00 100 K 7.97 4.29 0.00 1.78 1.89 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.45 7.81 101 M 7.58 4.32 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.55 0.00 102 D 8.79 4.48 0.00 2.95 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 0.00 103 T 8.58 3.86 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 1.22 0.00 0.00 104 K 7.91 4.07 0.00 1.81 1.83 0.00 1.72 0.00 0.00 1.81 0.00 0.00 3.13 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.46 7.81 105 K 8.08 4.70 0.00 2.24 1.83 0.00 2.01 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.63 1.34 7.81 106 K 7.78 3.65 0.00 1.98 1.88 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.47 1.76 7.81 107 E 7.82 3.91 0.00 1.93 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 2.55 2.51 0.00 108 E 7.58 3.89 0.00 1.99 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 2.30 2.34 0.00 109 Q 7.75 3.76 0.00 1.81 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 1.16 1.98 0.00 110 L 8.00 3.93 0.00 1.83 1.70 0.93 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 111 K 8.69 4.00 0.00 1.95 1.75 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.63 1.42 7.81 112 L 8.41 3.88 0.00 1.71 1.75 0.83 0.44 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 0.00 113 L 8.26 4.05 0.00 1.91 1.82 1.10 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 114 K 7.83 4.23 0.00 1.92 1.80 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.36 7.81 115 E 7.91 4.09 0.00 2.07 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 0.00 2.27 2.30 0.00 116 K 7.98 3.88 0.00 1.29 0.74 0.00 1.48 0.00 0.00 1.39 0.00 0.00 2.94 0.00 0.00 2.32 0.00 0.00 0.00 0.00 1.18 1.23 7.81 117 Y 7.72 4.71 0.00 3.03 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 G 8.33 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 0.00 0.00 0.00 119 I 7.49 3.95 1.97 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 1.29 0.80 1.00 0.00 0.00 120 N 8.65 4.49 0.00 2.73 2.80 0.00 0.00 6.88 7.70 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 0.00 121 T 8.28 4.42 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 1.22 0.00 0.00 122 D 7.81 4.50 0.00 2.85 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 P 0.00 4.40 0.00 2.04 2.00 0.00 3.69 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 124 P 0.00 4.53 0.00 2.18 2.09 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 125 K 8.05 4.12 0.00 1.81 1.72 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.48 7.81