NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 R 4.3683 8.2549 120.8720 55.9930 31.9533 175.0699 4 T 4.7791 7.4756 112.2897 58.7643 72.0977 171.0992 5 P 4.7019 0.0000 0.0000 63.0877 32.5240 175.5028 6 K 4.7113 9.4585 122.9782 55.2450 34.6017 175.5397 7 I 5.1719 8.1831 122.1182 59.8728 41.3376 174.7444 8 Q 4.7372 9.2720 124.1979 54.2380 32.5729 174.2034 9 V 5.1000 8.5407 123.8070 61.5547 34.0366 173.8721 10 Y 5.3340 8.5260 124.5051 56.9964 41.7247 172.7170 11 S 5.1106 9.0501 113.7706 56.7022 65.0766 174.2960 12 R 4.0988 8.9583 122.8974 59.7950 29.6900 176.1843 13 H 5.1161 8.6335 114.5316 52.8495 31.7201 172.2820 14 P 4.2066 0.0000 0.0000 62.7724 31.2744 176.4019 15 A 4.0478 8.8439 126.0795 52.9192 18.7880 176.4507 16 E 4.4297 8.6795 122.9057 54.5815 31.2948 173.8226 17 N 4.3916 8.8600 123.6098 55.4626 39.0278 174.0084 18 G 4.1337 8.8096 112.8500 45.8672 0.0000 174.4624 19 K 4.1342 7.9343 118.8635 55.7501 32.6843 177.0289 20 S 4.2324 8.1888 117.6099 59.0550 63.7793 173.6305 21 N 4.8666 7.8998 119.2914 53.5336 42.5852 172.7314 22 F 5.0445 8.8651 114.4510 55.9683 44.0770 173.5325 23 L 4.1436 8.5652 124.3569 53.3632 43.5801 174.6777 24 N 5.2460 8.4944 124.6293 51.7092 41.3768 173.5471 25 C 5.2820 9.4195 123.0023 55.0901 46.0895 172.4633 26 Y 4.9629 9.2719 130.0401 56.8188 39.1849 173.9534 27 V 4.9093 8.4304 127.8966 61.7112 33.8223 174.9629 28 S 5.3554 8.7219 121.0725 58.7918 66.8508 174.8624 29 G 4.1787 8.9563 105.7787 47.0365 0.0000 173.1073 30 F 5.1004 7.4595 113.6711 55.1896 40.5718 173.7891 31 H 5.0298 8.4994 117.8986 54.8475 32.5192 172.3689 32 P 4.5374 0.0000 0.0000 62.0850 33.0157 175.6897 33 S 3.8291 8.2647 111.8143 61.4068 63.0913 174.8051 34 D 4.3690 7.8057 120.1247 54.7258 40.9338 175.3765 35 I 4.4019 7.7910 121.7594 59.9538 41.3004 172.8475 36 E 4.5640 8.9409 127.8420 54.3094 32.3260 174.7056 37 V 4.5100 8.1690 126.0926 61.2076 34.0837 173.9813 38 D 4.9820 9.0369 128.2259 52.3895 44.3960 175.1543 39 L 4.9346 8.3612 122.1812 53.7397 43.5951 175.6640 40 L 5.2498 8.7914 122.8014 52.9607 45.7934 175.8735 41 K 4.4686 8.3016 121.6358 54.6858 34.4966 175.8181 42 N 4.1586 10.0086 128.2553 54.1505 36.5439 176.2953 43 G 3.9702 8.4413 106.5216 45.4766 0.0000 173.9267 44 E 4.2490 8.0238 120.7150 54.8229 29.9624 175.4979 45 R 4.2912 8.6661 124.7333 57.1350 30.4903 175.8976 46 I 4.0789 8.8435 128.3399 61.2888 37.8638 176.1939 47 E 4.1749 8.7120 126.2259 55.6520 30.9752 175.6907 48 K 3.6817 8.6565 116.8168 56.7078 27.9657 176.4381 49 V 4.4761 7.1878 116.7673 61.4557 35.3017 174.7191 50 E 4.6451 8.3639 126.8543 55.0143 32.6164 174.2428 51 H 5.9448 8.0821 114.7499 53.6776 31.3775 173.4462 52 S 4.5180 8.6595 114.9745 58.0152 64.1246 173.4869 53 D 4.4815 8.4971 120.5850 53.8266 41.2034 176.3674 54 L 4.1167 8.2888 125.4400 55.8432 43.1000 175.6689 55 S 4.6132 8.0924 119.1280 57.6601 66.5177 172.0231 56 F 5.2823 7.3212 114.9444 55.6161 40.7442 174.3340 57 S 4.5858 8.9446 116.8288 57.1044 64.0446 175.3205 58 K 3.5018 8.6213 122.3106 59.8790 31.5505 177.1243 59 D 4.3111 7.7225 113.9169 53.5739 39.1932 176.8677 60 W 3.5324 7.7280 119.2667 56.7752 27.7138 174.3436 61 S 4.4391 8.0092 114.2941 57.9864 64.4163 174.4478 62 F 5.1314 8.5799 121.7507 56.5722 41.0402 173.7657 63 Y 5.3209 7.8854 113.3969 57.0401 40.4933 173.2202 64 L 5.1279 9.2313 120.8338 53.4192 47.3125 174.6206 65 L 5.1645 8.8958 123.7512 53.8890 44.6239 174.5717 66 Y 5.3621 8.9832 124.5528 56.9084 40.3139 174.6112 67 Y 5.8006 8.0533 120.2546 56.6998 42.5070 173.2170 68 T 4.5751 8.2140 110.0252 61.0550 70.4362 172.2322 69 E 3.8125 9.0866 127.5710 56.6860 30.4583 175.9677 70 F 4.5371 7.7429 114.6876 56.7221 41.6868 173.2039 71 T 4.6064 8.5477 116.7841 59.6751 70.1810 172.1740 72 P 4.6421 0.0000 0.0000 63.4199 33.0269 175.6935 73 T 5.0175 8.5389 115.5451 61.6916 72.5993 174.5819 74 E 3.9438 9.0128 126.9956 58.8967 29.7289 177.9532 75 K 4.3502 7.8703 115.5651 57.8515 33.9008 176.7589 76 D 4.4910 7.7904 118.6648 54.1138 41.5471 175.2175 77 E 4.9325 8.2219 120.8068 54.8309 33.3012 174.4924 78 Y 5.9804 9.0307 119.0596 55.5450 42.7024 174.1952 79 A 4.9939 8.4759 122.4405 51.0649 23.9513 174.9085 80 C 5.2670 9.7102 118.0605 55.1293 44.5870 172.6591 81 R 5.0927 9.1010 127.5182 54.5432 32.0954 174.7008 82 V 4.8383 9.1202 126.0437 61.0134 34.8300 173.5154 83 N 5.2826 8.9582 126.1363 52.3383 42.1261 172.3885 84 H 5.0201 8.4204 122.7294 54.9778 32.9314 174.6775 85 V 3.8313 8.3208 122.6035 64.2890 31.1975 176.9203 86 T 4.4693 8.0623 108.6239 61.0571 68.8149 173.7170 87 L 4.7454 8.1481 124.0703 52.8829 43.5108 177.7519 88 S 3.9590 8.7541 118.8782 61.0469 63.0984 173.8960 89 Q 4.5506 7.2123 116.5300 53.8166 31.2084 171.9190 90 P 4.4438 0.0000 0.0000 63.1287 31.9262 175.3501 91 K 4.4549 9.0277 126.3756 55.1073 33.8734 174.9902 92 I 5.1285 8.4124 127.8774 59.4527 39.8185 175.1322 93 V 4.6698 8.7776 126.7828 59.6274 34.3518 174.8097 94 K 5.0776 8.5390 121.9128 54.8229 34.9189 175.7125 95 W 4.5263 9.4420 133.5691 57.7032 31.5413 174.7811 96 D 4.4391 8.3915 126.3320 51.9241 42.5522 176.4202 97 R 3.8079 7.6601 123.2673 58.3887 29.6867 176.8885 98 D 4.6989 8.1448 117.4775 54.7719 41.1018 176.3088 99 M 4.3811 7.9865 125.0483 55.5914 33.0665 174.8790 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 R 8.25 4.37 0.00 1.81 2.06 0.00 3.23 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.77 0.00 4 T 7.48 4.78 4.28 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 1.23 0.00 0.00 5 P 0.00 4.70 0.00 1.93 1.82 0.00 3.74 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.81 0.00 6 K 9.46 4.71 0.00 1.85 1.80 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.46 7.81 7 I 8.18 5.17 1.91 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.59 0.96 0.00 0.00 8 Q 9.27 4.74 0.00 2.32 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 9 V 8.54 5.10 2.29 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 1.02 0.00 0.00 1.03 0.00 0.00 10 Y 8.53 5.33 0.00 3.19 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 9.05 5.11 0.00 4.27 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 12 R 8.96 4.10 0.00 1.88 2.09 0.00 2.98 0.00 0.00 2.99 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.44 0.00 13 H 8.63 5.12 0.00 3.24 3.23 0.00 5.73 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.21 0.00 2.10 2.12 0.00 3.81 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 15 A 8.84 4.05 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.68 4.43 0.00 1.98 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 2.28 2.34 0.00 17 N 8.86 4.39 0.00 2.81 2.82 0.00 0.00 7.29 7.90 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 18 G 8.81 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.93 4.13 0.00 1.90 1.69 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.60 7.81 20 S 8.19 4.23 0.00 3.78 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 7.90 4.87 0.00 2.42 2.47 0.00 0.00 7.16 7.37 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 22 F 8.87 5.04 0.00 2.94 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.57 4.14 0.00 0.27 0.67 -0.08 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.49 5.25 0.00 1.44 2.17 0.00 0.00 5.97 7.84 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 25 C 9.42 5.28 0.00 2.91 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 26 Y 9.27 4.96 0.00 3.37 3.18 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 27 V 8.43 4.91 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 0.86 0.00 0.00 0.86 0.00 0.00 28 S 8.72 5.36 0.00 3.86 3.48 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 0.00 29 G 8.96 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 30 F 7.46 5.10 0.00 3.10 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 31 H 8.50 5.03 0.00 3.22 3.30 0.00 5.73 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 32 P 0.00 4.54 0.00 2.20 2.14 0.00 3.93 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 33 S 8.26 3.83 0.00 3.35 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 34 D 7.81 4.37 0.00 2.64 2.64 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 35 I 7.79 4.40 1.71 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.45 0.89 0.00 0.00 36 E 8.94 4.56 0.00 2.11 1.65 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 2.13 2.16 0.00 37 V 8.17 4.51 0.67 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 0.18 0.00 0.00 0.45 0.00 0.00 38 D 9.04 4.98 0.00 2.50 2.46 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 39 L 8.36 4.93 0.00 1.60 1.53 0.89 0.47 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 40 L 8.79 5.25 0.00 1.60 1.54 0.92 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.30 4.47 0.00 1.90 1.63 0.00 1.99 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.15 0.92 7.81 42 N 10.01 4.16 0.00 2.78 2.82 0.00 0.00 7.07 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.44 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 44 E 8.02 4.25 0.00 2.08 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 2.28 2.37 0.00 45 R 8.67 4.29 0.00 1.81 1.87 0.00 3.39 0.00 0.00 3.40 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 46 I 8.84 4.08 1.87 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 1.29 0.85 0.93 0.00 0.00 47 E 8.71 4.17 0.00 1.85 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 2.30 2.28 0.00 48 K 8.66 3.68 0.00 1.91 1.91 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.41 7.81 49 V 7.19 4.48 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 0.86 0.00 0.00 0.99 0.00 0.00 50 E 8.36 4.65 0.00 1.16 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 2.08 2.03 0.00 51 H 8.08 5.94 0.00 2.06 2.01 0.00 5.33 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.66 4.52 0.00 3.97 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 53 D 8.50 4.48 0.00 2.68 2.64 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 54 L 8.29 4.12 0.00 1.63 1.59 0.82 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.09 4.61 0.00 3.48 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 56 F 7.32 5.28 0.00 2.80 2.35 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 57 S 8.94 4.59 0.00 4.17 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 58 K 8.62 3.50 0.00 1.59 1.73 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.25 1.25 7.81 59 D 7.72 4.31 0.00 2.81 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 60 W 7.73 3.53 0.00 3.31 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 61 S 8.01 4.44 0.00 3.89 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 62 F 8.58 5.13 0.00 1.51 2.55 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 63 Y 7.89 5.32 0.00 2.89 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 64 L 9.23 5.13 0.00 1.94 1.67 1.18 0.75 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 65 L 8.90 5.16 0.00 2.10 1.70 1.15 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 8.98 5.36 0.00 3.00 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 67 Y 8.05 5.80 0.00 3.09 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 68 T 8.21 4.58 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 69 E 9.09 3.81 0.00 1.72 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 0.00 2.33 2.35 0.00 70 F 7.74 4.54 0.00 2.69 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 T 8.55 4.61 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 72 P 0.00 4.64 0.00 2.31 2.10 0.00 3.50 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.83 0.00 73 T 8.54 5.02 4.44 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 1.28 0.00 0.00 74 E 9.01 3.94 0.00 1.95 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 2.33 2.37 0.00 75 K 7.87 4.35 0.00 1.90 1.93 0.00 1.64 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.46 7.81 76 D 7.79 4.49 0.00 2.81 2.38 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 0.00 0.00 0.00 0.00 77 E 8.22 4.93 0.00 1.81 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 78 Y 9.03 5.98 0.00 3.06 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 79 A 8.48 4.99 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 80 C 9.71 5.27 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 81 R 9.10 5.09 0.00 1.84 1.71 0.00 3.18 0.00 0.00 3.05 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.50 0.00 82 V 9.12 4.84 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 0.83 0.00 0.00 0.77 0.00 0.00 83 N 8.96 5.28 0.00 2.68 2.62 0.00 0.00 6.31 7.44 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 84 H 8.42 5.02 0.00 3.08 3.00 0.00 5.73 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.32 3.83 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 0.67 0.00 0.00 0.92 0.00 0.00 86 T 8.06 4.47 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 87 L 8.15 4.75 0.00 1.79 1.81 0.94 0.79 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 88 S 8.75 3.96 0.00 3.98 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Q 7.21 4.55 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.85 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 90 P 0.00 4.44 0.00 2.07 2.09 0.00 3.74 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 1.97 1.95 0.00 91 K 9.03 4.45 0.00 1.83 1.68 0.00 1.57 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.41 7.81 92 I 8.41 5.13 1.88 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 1.39 0.79 0.92 0.00 0.00 93 V 8.78 4.67 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 0.88 0.00 0.00 1.01 0.00 0.00 94 K 8.54 5.08 0.00 1.86 1.90 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.45 7.81 95 W 9.44 4.53 0.00 3.37 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 96 D 8.39 4.44 0.00 2.58 2.39 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 97 R 7.66 3.81 0.00 1.91 1.33 0.00 3.02 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.50 0.00 98 D 8.14 4.70 0.00 2.75 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 99 M 7.99 4.38 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00