NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2186 8.3293 121.6998 55.7051 30.5236 175.5031 4 S 4.2397 8.2415 120.3002 57.8442 65.3104 174.5831 5 F 4.1338 10.1887 123.1346 60.4248 39.0930 179.6880 6 T 3.9182 8.2625 116.1179 66.6268 68.3003 176.5507 7 S 4.0887 7.9636 114.5727 61.3788 62.3388 176.1788 8 I 3.6443 7.6345 121.9066 64.2781 36.7616 178.2952 9 A 3.9932 8.2621 121.6706 55.1546 18.2341 179.1883 10 R 3.8874 8.0138 117.1425 59.9879 30.1680 178.5970 11 I 3.7679 7.7398 118.6403 64.4722 37.2319 178.8110 12 G 3.6559 8.3993 106.7626 47.9135 0.0000 175.5245 13 D 4.4097 8.9455 121.6775 57.1110 40.7403 178.0669 14 Y 4.0276 8.1148 120.1245 60.8988 38.5777 178.4428 15 I 3.7500 7.6589 119.1559 64.3239 37.3037 177.9224 16 L 4.0750 7.7244 120.1392 57.7960 41.9001 179.0432 17 K 4.1793 7.8971 117.9006 58.1023 32.4733 177.6312 18 S 4.0299 7.2072 115.3236 57.6433 62.3184 173.0416 19 P 4.3343 0.0000 0.0000 64.5372 29.8667 178.5789 20 V 3.6888 7.3557 117.3894 66.0971 31.5997 177.9243 21 L 4.2448 7.7152 118.1486 57.5067 40.2084 178.9559 22 S 4.2727 8.2458 113.6826 60.8569 62.4122 175.8640 23 K 4.2991 7.8403 117.3844 57.4812 32.8481 178.1823 24 L 4.1552 7.2446 118.0332 58.0209 42.3316 178.2220 25 C 4.2201 8.5665 116.8118 62.7357 28.2421 175.8971 26 V 3.5462 7.1210 119.3015 66.0730 30.8827 176.3723 27 P 4.2529 0.0000 0.0000 65.3419 31.0780 178.8838 28 V 3.6055 8.0389 117.2788 65.9419 31.4565 177.8896 29 A 4.0059 7.9928 120.0509 55.4174 18.0886 179.2197 30 N 4.3380 8.5886 115.2996 56.4177 38.5592 177.4984 31 Q 3.9907 7.8896 121.3099 58.8106 29.1439 177.8634 32 F 4.1453 8.4587 121.9337 61.5816 39.3077 177.1032 33 I 3.7237 7.9251 117.9894 64.6202 37.2977 177.8801 34 N 4.3536 7.9354 117.3750 56.0341 38.1763 177.5432 35 L 4.0083 7.7141 119.5175 57.2445 41.7077 178.7883 36 A 3.9575 7.4637 120.5128 53.8536 18.6514 178.9203 37 G 3.6396 7.4710 102.8526 46.0552 0.0000 174.8852 38 Y 4.1433 7.4534 119.3992 59.9088 37.7671 178.4916 39 K 4.1260 7.0575 119.8027 58.9829 32.2847 178.7728 40 K 2.6932 7.4374 117.7968 57.3687 31.6086 178.0211 41 L 4.5653 7.3288 117.9119 53.8359 42.0128 177.0161 42 G 3.9165 7.7481 107.1573 45.7254 0.0000 173.5407 43 L 4.8279 7.6643 118.0012 52.8725 43.8222 175.9227 44 K 4.8681 8.7899 120.3723 54.6193 34.4907 177.3813 45 F 3.3454 9.2204 124.3996 61.7879 38.9139 177.6557 46 D 4.0895 8.1819 117.3397 57.1562 40.2577 178.3136 47 D 4.3815 7.9432 118.8793 56.7766 40.8600 177.9106 48 L 4.0548 7.2138 117.7832 54.8254 42.0443 177.3917 49 I 3.5850 6.4507 120.5632 60.7574 37.4654 175.7335 50 A 4.0394 8.5677 128.8237 52.4234 18.4396 176.9852 51 E 4.3147 8.6319 120.5951 57.0406 31.0935 176.9380 52 E 4.3711 7.8967 121.2929 54.4903 28.0561 175.6638 53 N 4.8472 7.3619 117.2270 49.9905 41.7327 173.5367 54 P 4.2332 0.0000 0.0000 66.2628 31.2305 178.5155 55 I 3.6945 7.7812 119.0294 64.6195 37.1286 178.2580 56 M 4.1179 8.0124 118.5293 58.2555 31.6484 178.7280 57 Q 4.0375 7.8166 118.6662 58.8788 28.9978 178.6629 58 T 3.8378 8.0730 116.6457 66.4839 68.4160 176.3837 59 A 4.0043 7.9752 122.6067 55.4814 18.2196 179.8220 60 L 3.8843 7.6470 115.5317 57.4849 41.6646 179.3527 61 R 3.9986 7.3810 118.4788 58.9372 30.1170 178.0292 62 R 4.1267 7.5633 115.9958 56.2695 30.5215 176.7515 63 L 3.2491 6.5914 121.7901 53.8224 42.7694 175.5104 64 P 4.2954 0.0000 0.0000 62.7520 33.0917 176.7613 65 E 3.4712 8.6577 120.0861 60.0996 29.3041 179.8027 66 D 4.4436 7.9489 117.7941 57.3980 40.8488 178.6531 67 E 3.8563 7.9532 118.7440 59.1063 29.5448 179.0067 68 S 3.9956 7.7085 112.8733 61.6627 62.4346 175.9031 69 Y 4.3809 7.6526 119.1570 60.9971 37.5373 178.4451 70 A 4.0900 7.8968 121.9571 55.1434 18.4695 179.5797 71 R 3.8067 8.4162 117.4926 59.4516 30.1069 178.5241 72 A 4.0187 8.0520 120.5513 55.4916 18.4585 179.0306 73 Y 4.2091 8.1396 118.0243 60.8619 38.8533 178.4173 74 R 3.6690 8.2094 119.1186 59.1480 30.1694 179.1095 75 I 3.6668 7.8989 119.6664 64.3553 37.1033 178.5982 76 I 3.7128 7.7023 120.6407 64.4488 36.9818 178.3965 77 R 3.7718 7.7918 119.2500 59.2549 29.6397 178.4478 78 A 3.8901 7.9189 120.4914 55.5077 18.4003 179.3061 79 H 4.0807 8.0604 114.7694 59.0467 28.5163 177.8982 80 Q 3.9558 7.9216 120.4532 59.3604 29.2125 178.1238 81 T 4.0604 7.8053 118.1063 65.9705 68.4725 176.0703 82 E 3.8705 8.3391 121.7619 59.4154 29.4278 179.0285 83 L 3.9101 7.8732 118.0787 58.3752 40.5068 178.3751 84 T 4.1183 7.7637 109.3722 61.3572 69.2010 174.3221 85 H 3.8567 8.1059 117.9945 57.6731 26.5580 173.3580 86 H 5.0958 8.1255 114.8678 54.1991 32.6552 172.1871 87 L 5.0178 8.1400 118.3640 52.9384 45.3105 176.8514 88 L 4.4506 8.3841 120.0312 54.0150 42.7630 175.6403 89 P 4.3647 0.0000 0.0000 62.5569 32.1930 177.9057 90 R 2.0000 8.5717 123.0522 58.8819 29.9727 177.7961 91 N 4.5159 7.7912 111.8767 53.9440 37.4736 174.9809 92 E 4.5903 8.2169 117.9109 56.0862 30.8731 176.4892 93 W 4.6544 7.6646 118.8777 56.5457 29.6776 175.9396 94 I 4.0202 8.2809 122.6645 61.2559 37.4207 176.3436 95 K 4.4147 9.0408 124.6110 55.3763 33.4553 177.8074 96 A 4.0881 8.7072 123.0816 55.8108 17.9018 180.3501 97 Q 4.1205 8.0401 115.1748 58.9985 28.9087 178.1065 98 E 4.2423 8.1147 119.0079 58.3637 30.9335 177.5166 99 D 4.8238 7.5543 118.2054 53.8065 39.3291 175.7080 100 V 4.2741 7.3605 120.1036 61.1641 32.6286 174.7358 101 P 4.7646 0.0000 0.0000 62.2466 29.3902 176.2874 102 Y 4.4616 7.9219 122.9606 60.0555 39.0511 177.7212 103 L 4.3650 7.4425 122.0655 56.4018 43.0853 177.8876 104 L 3.6385 7.4257 121.2286 57.8151 41.9342 177.2967 105 P 4.1079 0.0000 0.0000 66.1558 30.9660 177.8878 106 Y 4.0969 7.8272 116.3862 60.6648 37.7982 178.1272 107 I 3.6657 7.6007 120.3927 64.3805 37.2768 178.3382 108 L 4.0447 8.0072 119.9205 57.5425 41.4144 179.1755 109 E 3.8647 8.0985 118.7675 59.2793 29.5445 178.7405 110 A 4.0369 7.9963 120.7966 55.2737 18.4015 179.4680 111 E 3.9172 8.3758 116.8848 59.4008 29.4435 179.5112 112 A 3.9789 8.0836 120.6501 54.9884 18.4630 179.4449 113 A 3.9186 8.0755 119.1084 55.2501 18.4898 179.7147 114 A 3.8974 8.2600 119.4428 55.2687 18.4369 179.7306 115 K 3.8788 8.4555 118.6040 59.5044 32.2360 178.5085 116 E 4.0444 8.5562 119.9755 59.2849 29.5681 178.6323 117 K 3.9149 8.0028 119.6287 59.6140 31.9724 178.1278 118 D 4.3109 7.9823 117.2373 57.2729 41.2892 177.8454 119 E 4.1121 8.3500 119.2341 59.5807 29.0172 179.4167 120 L 4.0283 8.4844 119.2525 57.8656 41.4454 179.2798 121 D 4.5420 8.2953 117.7827 56.1530 40.7399 176.8437 122 N 4.9303 7.4362 114.9732 52.3845 39.3514 174.6236 123 I 3.7083 7.3131 112.4642 61.1853 37.8085 176.0330 124 E 4.4459 8.5012 124.1100 55.4059 30.7734 175.8951 125 V 4.3685 7.9756 112.3938 59.6564 34.8584 175.2393 126 S 4.6451 8.6224 118.9276 56.3437 63.7131 173.8012 127 K 4.1773 8.6187 126.1558 56.7311 31.9383 176.7655 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 3 Q 8.33 4.22 0.00 1.96 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.99 0.00 0.00 0.00 0.00 0.00 2.11 2.28 0.00 4 S 8.24 4.24 0.00 4.44 3.98 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 5 F 10.19 4.13 0.00 3.37 3.16 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 0.00 6 T 8.26 3.92 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 1.23 0.00 0.00 7 S 7.96 4.09 0.00 3.89 3.98 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 8 I 7.63 3.64 1.93 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.54 0.87 0.00 0.00 9 A 8.26 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 10 R 8.01 3.89 0.00 2.03 2.10 0.00 3.09 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 11 I 7.74 3.77 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.88 0.88 0.00 0.00 12 G 8.40 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.95 4.41 0.00 2.80 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 14 Y 8.11 4.03 0.00 3.17 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.66 3.75 2.05 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 1.52 0.94 0.92 0.00 0.00 16 L 7.72 4.07 0.00 1.89 1.69 0.92 0.60 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 17 K 7.90 4.18 0.00 1.65 1.76 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.55 7.81 18 S 7.21 4.03 0.00 3.49 3.50 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 19 P 0.00 4.33 0.00 2.03 2.07 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 1.99 2.10 0.00 20 V 7.36 3.69 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 1.02 0.00 0.00 0.90 0.00 0.00 21 L 7.72 4.24 0.00 1.68 1.70 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.25 4.27 0.00 4.14 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 K 7.84 4.30 0.00 1.77 1.84 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.47 7.81 24 L 7.24 4.16 0.00 1.58 1.87 0.92 0.95 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 25 C 8.57 4.22 0.00 2.94 2.92 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 26 V 7.12 3.55 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 1.13 0.00 0.00 0.97 0.00 0.00 27 P 0.00 4.25 0.00 2.20 2.09 0.00 3.77 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 2.28 2.14 0.00 28 V 8.04 3.61 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 1.08 0.00 0.00 0.96 0.00 0.00 29 A 7.99 4.01 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 30 N 8.59 4.34 0.00 3.01 2.91 0.00 0.00 6.66 7.54 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 31 Q 7.89 3.99 0.00 2.26 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 32 F 8.46 4.15 0.00 3.11 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 33 I 7.93 3.72 1.93 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 1.73 1.02 0.90 0.00 0.00 34 N 7.94 4.35 0.00 2.78 2.80 0.00 0.00 6.98 6.59 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 35 L 7.71 4.01 0.00 1.66 1.62 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.46 3.96 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 37 G 7.47 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 38 Y 7.45 4.14 0.00 3.19 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 39 K 7.06 4.13 0.00 1.41 1.86 0.00 1.84 0.00 0.00 1.78 0.00 0.00 2.59 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 0.75 7.81 40 K 7.44 2.69 0.00 1.43 1.13 0.00 1.17 0.00 0.00 1.17 0.00 0.00 2.56 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.30 0.21 7.81 41 L 7.33 4.57 0.00 1.72 1.65 0.85 0.88 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 42 G 7.75 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 7.66 4.83 0.00 1.90 1.61 0.89 0.85 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 44 K 8.79 4.87 0.00 2.12 1.92 0.00 1.81 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.46 7.81 45 F 9.22 3.35 0.00 2.94 3.08 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 46 D 8.18 4.09 0.00 2.42 2.03 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 47 D 7.94 4.38 0.00 2.71 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 48 L 7.21 4.05 0.00 1.13 1.34 0.77 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 49 I 6.45 3.58 1.75 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.17 1.04 0.00 0.00 50 A 8.57 4.04 1.24 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 51 E 8.63 4.31 0.00 2.07 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 2.21 2.31 0.00 52 E 7.90 4.37 0.00 1.96 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 2.31 2.35 0.00 53 N 7.36 4.85 0.00 2.88 2.87 0.00 0.00 5.84 7.76 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 54 P 0.00 4.23 0.00 2.29 2.36 0.00 3.72 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 2.09 2.07 0.00 55 I 7.78 3.69 1.91 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 1.67 1.18 0.94 0.00 0.00 56 M 8.01 4.12 0.00 2.01 2.20 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.60 0.00 57 Q 7.82 4.04 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.82 0.00 0.00 0.00 0.00 0.00 2.57 2.53 0.00 58 T 8.07 3.84 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 1.22 0.00 0.00 59 A 7.98 4.00 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 60 L 7.65 3.88 0.00 1.60 1.70 0.91 0.97 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 61 R 7.38 4.00 0.00 1.89 2.09 0.00 3.23 0.00 0.00 3.20 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 62 R 7.56 4.13 0.00 1.76 1.88 0.00 3.28 0.00 0.00 3.35 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 63 L 6.59 3.25 0.00 1.34 1.51 0.93 0.98 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 64 P 0.00 4.30 0.00 2.26 2.17 0.00 3.61 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 65 E 8.66 3.47 0.00 1.91 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 0.00 2.18 2.33 0.00 66 D 7.95 4.44 0.00 2.67 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 67 E 7.95 3.86 0.00 2.01 1.78 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 2.34 2.30 0.00 68 S 7.71 4.00 0.00 3.73 3.61 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 69 Y 7.65 4.38 0.00 3.07 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 70 A 7.90 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 71 R 8.42 3.81 0.00 1.93 2.07 0.00 3.20 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.98 0.00 72 A 8.05 4.02 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 Y 8.14 4.21 0.00 3.09 3.16 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 0.00 74 R 8.21 3.67 0.00 2.03 1.92 0.00 3.43 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.89 0.00 75 I 7.90 3.67 1.88 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 1.49 0.77 0.95 0.00 0.00 76 I 7.70 3.71 1.89 0.00 0.00 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 1.44 0.81 0.94 0.00 0.00 77 R 7.79 3.77 0.00 1.28 1.75 0.00 2.89 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.46 0.00 78 A 7.92 3.89 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 79 H 8.06 4.08 0.00 3.42 3.33 0.00 5.82 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 80 Q 7.92 3.96 0.00 2.05 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.96 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 81 T 7.81 4.06 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 1.26 0.00 0.00 82 E 8.34 3.87 0.00 2.11 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 0.00 2.29 2.35 0.00 83 L 7.87 3.91 0.00 1.78 1.76 0.90 0.86 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 84 T 7.76 4.12 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 1.24 0.00 0.00 85 H 8.11 3.86 0.00 3.40 3.49 0.00 5.60 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 86 H 8.13 5.10 0.00 3.05 3.25 0.00 5.83 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 8.14 5.02 0.00 1.62 1.64 0.94 0.85 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 88 L 8.38 4.45 0.00 1.89 1.78 0.99 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.36 0.00 2.06 1.95 0.00 3.86 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 2.14 2.16 0.00 90 R 8.57 2.00 0.00 1.31 0.90 0.00 2.41 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 1.27 0.00 91 N 7.79 4.52 0.00 2.75 2.83 0.00 0.00 5.90 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 92 E 8.22 4.59 0.00 2.17 2.12 0.00 0.00 0.00 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 2.28 0.00 93 W 7.66 4.65 0.00 3.38 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 94 I 8.28 4.02 1.96 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 1.44 0.99 1.03 0.00 0.00 95 K 9.04 4.41 0.00 2.02 1.91 0.00 1.86 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.45 7.81 96 A 8.71 4.09 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 8.04 4.12 0.00 2.06 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.07 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 98 E 8.11 4.24 0.00 2.19 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 0.00 2.39 2.37 0.00 99 D 7.55 4.82 0.00 2.87 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 V 7.36 4.27 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 1.07 0.00 0.00 101 P 0.00 4.76 0.00 2.26 2.24 0.00 3.82 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 102 Y 7.92 4.46 0.00 3.32 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 7.44 4.37 0.00 0.92 1.38 0.89 0.22 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 0.00 104 L 7.43 3.64 0.00 1.84 1.75 0.86 0.86 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 0.00 105 P 0.00 4.11 0.00 1.85 2.11 0.00 3.65 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 1.75 1.91 0.00 106 Y 7.83 4.10 0.00 3.21 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 7.60 3.67 1.65 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.92 0.69 0.00 0.00 108 L 8.01 4.04 0.00 1.65 1.71 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.10 3.86 0.00 2.12 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 2.32 2.32 0.00 110 A 8.00 4.04 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 0.00 111 E 8.38 3.92 0.00 2.22 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 2.39 2.56 0.00 112 A 8.08 3.98 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 0.00 113 A 8.08 3.92 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 A 8.26 3.90 1.40 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 0.00 0.00 115 K 8.46 3.88 0.00 1.92 2.01 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.59 7.81 116 E 8.56 4.04 0.00 2.13 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 2.31 2.32 0.00 117 K 8.00 3.91 0.00 1.89 1.94 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.62 1.46 7.81 118 D 7.98 4.31 0.00 2.71 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 0.00 119 E 8.35 4.11 0.00 2.32 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 2.33 2.35 0.00 120 L 8.48 4.03 0.00 1.63 1.72 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.30 4.54 0.00 2.65 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 0.00 122 N 7.44 4.93 0.00 2.62 2.79 0.00 0.00 6.99 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 0.00 123 I 7.31 3.71 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.52 0.98 0.00 0.00 124 E 8.50 4.45 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 125 V 7.98 4.37 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 0.71 0.00 0.00 0.93 0.00 0.00 126 S 8.62 4.65 0.00 3.80 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 0.00 127 K 8.62 4.18 0.00 1.76 1.70 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.42 1.49 7.81