NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4215 8.3049 120.3507 55.9430 32.0979 174.2243 2 Q 4.4129 8.4226 123.5946 55.1357 29.4021 174.5100 3 D 4.9703 7.6775 118.8021 54.4499 43.5550 174.9493 4 T 4.9813 8.1436 109.0218 60.8966 72.2246 172.8126 5 I 4.6547 9.3564 123.3474 59.4899 40.4475 174.8354 6 F 5.5093 7.9287 120.8815 55.2029 41.5179 174.8138 7 L 4.6408 8.9308 118.9021 53.8829 45.6199 175.3292 8 K 4.9385 8.7964 123.0320 55.0512 35.5634 176.4270 9 G 3.8185 9.8107 109.9588 46.4399 0.0000 173.4920 10 M 3.9743 8.0984 120.0617 55.8473 32.9166 175.5751 11 R 4.9006 8.1572 123.4116 54.6862 31.7726 176.1221 12 F 4.9251 8.9579 122.2165 56.0323 43.3335 173.8440 13 Y 4.6497 8.5364 124.6530 55.5538 37.9344 174.4321 14 G 3.8712 8.2016 111.6749 43.7031 0.0000 170.2513 15 Y 4.8655 7.9586 116.6643 57.9553 38.6438 176.2260 16 H 4.9370 7.4980 117.6955 54.4937 30.3305 174.3562 17 G 4.2339 8.3945 107.8312 44.3559 0.0000 174.3505 18 A 4.0852 8.7903 126.1053 54.8732 17.7340 178.9294 19 L 4.2328 7.6754 116.7366 55.0461 43.8821 177.9709 20 S 4.8917 8.7950 119.1253 60.8190 63.1815 176.4418 21 A 4.0850 7.9782 123.9444 54.9507 17.9290 178.8389 22 E 3.9777 8.3108 117.0042 59.7726 29.5934 178.7407 23 N 5.3232 7.9008 117.0488 54.3611 37.1294 175.9902 24 E 4.2417 7.6074 121.2289 57.9215 30.2619 176.8424 25 I 4.6314 8.0624 117.9598 59.2276 39.5274 176.7001 26 G 3.4023 10.3169 108.5993 44.7568 0.0000 171.4380 27 Q 3.9883 7.1326 114.9394 55.3490 32.2733 172.8545 28 I 4.5397 7.9920 119.8929 60.7495 38.3981 175.7182 29 F 4.7903 9.5537 125.3815 55.7420 42.1036 174.7471 30 K 4.8878 9.0823 124.0481 54.7818 32.9821 174.8380 31 V 4.4781 9.1312 126.1389 62.4634 33.2915 174.3095 32 D 5.3741 9.4763 127.7800 52.8722 43.7749 175.1648 33 V 4.8583 8.9462 118.5172 59.8793 34.0930 175.2160 34 T 5.0830 9.1194 122.9924 61.7559 71.3087 173.0608 35 L 5.0848 9.2434 126.9907 52.8104 44.7406 175.5353 36 K 4.7642 9.5383 126.3051 54.4222 33.3946 175.2816 37 V 4.7656 8.1261 126.7927 61.1124 34.7350 174.0748 38 D 4.5815 8.9479 127.3166 55.3746 41.2492 176.9138 39 L 4.6484 8.3408 120.9096 54.3182 42.6161 178.6620 40 S 4.0909 7.9944 116.5209 61.7724 62.8354 175.6894 41 E 3.8416 8.2166 120.9070 59.2265 29.3420 178.1136 42 A 4.0668 8.1410 120.2074 55.5674 18.1833 179.8104 43 G 3.5047 8.4376 102.7090 47.6577 0.0000 175.6057 44 R 4.0639 8.1703 120.8982 59.8953 30.2056 177.9612 45 T 4.0710 8.2659 108.7970 61.3622 70.2912 174.5742 46 D 5.0440 9.5516 122.5537 53.2613 40.4931 175.8630 47 N 4.9466 8.5828 116.7538 51.7027 43.3944 176.6046 48 V 3.5954 8.7485 123.1179 64.9396 31.1937 177.7633 49 I 3.7458 7.7876 118.2277 62.6787 37.7769 175.3858 50 D 4.8585 8.4156 118.1284 55.1032 42.3738 176.0436 51 T 4.5300 8.3056 115.0118 60.6918 69.0763 172.5562 52 V 4.2157 8.1606 120.0054 60.6155 33.6339 175.0682 53 H 3.9126 9.0206 127.9654 56.6174 29.9670 174.5901 54 Y 4.3540 7.7735 127.6255 59.2985 37.8385 178.0313 55 G 3.6686 7.8613 107.9428 47.4640 0.0000 175.3019 56 E 4.1779 8.2838 121.6767 59.4335 29.7825 178.7765 57 V 3.6133 8.0511 117.8124 66.7397 31.1033 176.7658 58 F 4.2142 8.3327 119.7535 61.4663 39.0535 176.5709 59 E 3.6424 8.6563 116.9346 59.6605 29.2407 179.8287 60 E 3.9713 7.8732 117.7863 59.3990 30.0309 179.0319 61 V 3.5943 8.3250 118.6002 65.6395 31.6859 177.9536 62 K 2.6635 8.6581 120.6377 58.2535 31.7006 178.0055 63 S 4.4014 7.2653 111.9130 59.0868 63.2303 174.9520 64 I 4.1664 6.9270 122.7606 62.7147 38.5441 177.0391 65 M 4.0095 7.3666 117.9883 57.1460 32.3073 177.3735 66 E 4.4831 7.5704 115.6476 57.7839 30.5759 178.7038 67 G 3.9745 7.9635 113.5946 44.9029 0.0000 173.8898 68 K 3.9512 8.6071 125.6885 55.8006 32.6413 177.0384 69 A 4.3165 8.4201 129.0766 52.9824 19.1634 175.8019 70 V 4.2213 7.7201 110.6074 61.5011 34.6674 172.6533 71 N 4.6696 7.9265 117.9646 55.4802 39.5223 175.4844 72 L 4.2611 7.4767 117.4418 54.6828 43.1057 178.6894 73 L 4.1780 8.3429 122.2467 57.7847 41.5424 179.6931 74 E 4.0159 8.2698 118.3187 59.7515 29.2301 178.1457 75 H 4.0685 8.1013 118.0345 59.1368 29.5626 176.9300 76 L 3.4086 8.0714 119.9639 58.0072 41.3617 179.6063 77 A 4.0252 8.0444 120.4232 54.8249 18.4803 179.2737 78 E 3.8627 8.4108 118.2483 59.3900 29.7707 178.9023 79 R 3.7633 8.5650 119.7795 59.5729 30.0975 178.5886 80 I 3.7345 7.4735 118.8703 64.1048 37.0260 178.0876 81 A 4.0049 8.7579 122.9079 55.1313 18.1048 179.2768 82 N 4.2044 8.7381 115.7353 56.8731 39.0626 176.8561 83 R 3.9093 7.9391 120.0829 59.9540 29.8196 178.4279 84 I 4.0348 7.7195 118.1139 64.1674 37.1981 177.8668 85 N 4.5713 7.8326 116.8213 56.8317 38.7421 176.9948 86 S 4.1962 8.5670 116.1712 61.4908 62.7940 175.8932 87 Q 4.1390 7.9385 123.1318 55.7820 28.5309 176.7010 88 Y 4.5687 7.8956 118.9277 56.7979 41.0967 175.0985 89 N 4.3055 8.8097 123.6204 54.8946 39.6364 176.2728 90 R 3.9655 7.9867 116.0540 58.9506 30.3322 176.6624 91 V 3.7863 7.1530 116.8095 62.8259 30.5428 175.6391 92 M 4.2835 9.0574 127.5613 57.8143 32.4107 175.9904 93 E 5.2362 8.1493 118.6801 54.5993 33.8382 173.9739 94 T 5.1589 9.5409 122.0394 61.7379 72.6432 172.9789 95 K 4.9644 9.6938 127.0565 54.8618 34.5150 175.1130 96 V 4.6318 8.2372 126.4653 61.0020 33.6790 174.4292 97 R 5.0050 8.8316 127.9704 54.5944 33.5507 173.9890 98 I 5.1237 8.3701 125.3252 60.0316 40.9107 174.3769 99 T 4.9387 8.5828 123.2968 61.8013 71.7485 174.0216 100 K 4.4358 9.7399 124.6819 54.5615 33.8278 176.8852 101 E 4.0393 8.7779 124.9538 58.0349 29.8458 177.5863 102 N 4.9739 7.5887 116.3092 51.9461 39.5246 172.9406 103 P 4.3896 0.0000 0.0000 61.5877 32.2489 174.8858 104 P 4.4253 0.0000 0.0000 62.7906 29.6608 175.2265 105 I 4.2159 7.8398 125.3933 59.5582 39.8653 173.0410 106 P 4.1570 0.0000 0.0000 64.2947 31.1326 175.9489 107 G 4.4425 7.9742 112.7826 44.5826 0.0000 170.4846 108 H 4.8861 8.0630 118.3119 54.1718 30.3178 174.5077 109 Y 4.6466 7.4933 118.9408 56.8624 39.5082 173.6197 110 D 4.3707 9.1061 120.7405 54.6307 41.5452 176.6658 111 G 4.4304 7.1396 110.7063 45.1741 0.0000 171.6937 112 V 4.5780 7.3164 113.0265 59.3781 36.6226 174.9157 113 G 4.3930 7.6920 106.2648 46.0399 0.0000 170.9835 114 I 4.8323 7.4904 114.2974 59.3306 41.9146 173.9928 115 E 4.9252 8.6528 122.2213 54.4265 32.5969 174.4218 116 I 4.7701 8.4774 118.3085 59.1501 41.5347 173.9327 117 V 4.6516 8.4676 123.7566 61.3089 33.5079 174.7258 118 R 4.9103 9.3614 126.7096 54.3288 33.9077 174.5052 119 E 5.1351 8.6554 118.9922 54.5741 32.7551 174.2565 120 N 4.9536 8.6737 118.5932 52.4549 40.3200 175.1133 121 K 4.2111 8.3836 122.8111 56.6677 33.0220 176.1173 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 4.42 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.63 0.00 2 Q 8.42 4.41 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.86 0.00 0.00 0.00 0.00 0.00 2.28 2.52 0.00 3 D 7.68 4.97 0.00 2.77 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 4 T 8.14 4.98 4.41 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 1.26 0.00 0.00 5 I 9.36 4.65 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.71 0.95 0.00 0.00 6 F 7.93 5.51 0.00 2.97 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 7 L 8.93 4.64 0.00 1.73 1.68 0.94 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.80 4.94 0.00 1.59 1.76 0.00 1.68 0.00 0.00 1.24 0.00 0.00 2.58 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.30 1.47 7.81 9 G 9.81 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 10 M 8.10 3.97 0.00 1.90 2.40 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.96 0.00 11 R 8.16 4.90 0.00 1.59 1.83 0.00 3.09 0.00 0.00 3.19 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.92 0.00 12 F 8.96 4.93 0.00 2.98 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 13 Y 8.54 4.65 0.00 3.04 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 14 G 8.20 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 0.00 0.00 0.00 15 Y 7.96 4.87 0.00 3.05 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 16 H 7.50 4.94 0.00 3.24 3.27 0.00 5.68 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 G 8.39 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 0.00 0.00 0.00 0.00 18 A 8.79 4.09 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 19 L 7.68 4.23 0.00 1.78 1.77 0.93 0.84 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 20 S 8.79 4.89 0.00 4.11 4.12 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 21 A 7.98 4.08 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 22 E 8.31 3.98 0.00 2.22 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 2.41 0.00 23 N 7.90 5.32 0.00 3.23 3.36 0.00 0.00 6.20 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 24 E 7.61 4.24 0.00 2.30 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 2.33 2.37 0.00 25 I 8.06 4.63 2.06 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 1.56 0.88 1.01 0.00 0.00 26 G 10.32 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 0.00 0.00 0.00 27 Q 7.13 3.99 0.00 1.90 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.88 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 28 I 7.99 4.54 1.81 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.86 0.94 0.00 0.00 29 F 9.55 4.79 0.00 3.02 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 30 K 9.08 4.89 0.00 1.69 1.76 0.00 1.70 0.00 0.00 1.55 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.34 7.81 31 V 9.13 4.48 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 1.06 0.00 0.00 1.16 0.00 0.00 32 D 9.48 5.37 0.00 2.59 2.58 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 0.00 0.00 0.00 0.00 33 V 8.95 4.86 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 0.78 0.00 0.00 1.01 0.00 0.00 34 T 9.12 5.08 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 1.31 0.00 0.00 35 L 9.24 5.08 0.00 1.51 1.52 0.79 0.55 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 36 K 9.54 4.76 0.00 1.73 1.76 0.00 1.68 0.00 0.00 1.85 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.56 1.23 7.81 37 V 8.13 4.77 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 0.91 0.00 0.00 0.96 0.00 0.00 38 D 8.95 4.58 0.00 2.71 2.63 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 39 L 8.34 4.65 0.00 1.71 1.65 0.98 0.78 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 40 S 7.99 4.09 0.00 3.87 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 41 E 8.22 3.84 0.00 2.08 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 2.38 2.45 0.00 42 A 8.14 4.07 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 0.00 0.00 0.00 0.00 0.00 43 G 8.44 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 0.00 0.00 0.00 44 R 8.17 4.06 0.00 1.98 2.17 0.00 3.26 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 45 T 8.27 4.07 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 1.30 0.00 0.00 46 D 9.55 5.04 0.00 2.67 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 47 N 8.58 4.95 0.00 2.91 2.63 0.00 0.00 6.79 7.81 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 48 V 8.75 3.60 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 0.76 0.00 0.00 0.93 0.00 0.00 49 I 7.79 3.75 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 1.41 0.69 0.91 0.00 0.00 50 D 8.42 4.86 0.00 2.65 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 51 T 8.31 4.53 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 1.19 0.00 0.00 52 V 8.16 4.22 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 0.45 0.00 0.00 0.94 0.00 0.00 53 H 9.02 3.91 0.00 3.27 3.41 0.00 5.92 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 7.77 4.35 0.00 3.09 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 7.86 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 56 E 8.28 4.18 0.00 2.49 2.19 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 2.52 2.51 0.00 57 V 8.05 3.61 2.31 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 0.96 0.00 0.00 0.83 0.00 0.00 58 F 8.33 4.21 0.00 3.19 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 59 E 8.66 3.64 0.00 2.36 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 2.59 2.67 0.00 60 E 7.87 3.97 0.00 2.18 2.07 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 2.65 2.62 0.00 61 V 8.33 3.59 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 0.94 0.00 0.00 0.96 0.00 0.00 62 K 8.66 2.66 0.00 0.85 1.50 0.00 1.87 0.00 0.00 1.58 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.21 1.62 7.81 63 S 7.27 4.40 0.00 3.99 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 0.00 64 I 6.93 4.17 1.77 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.81 0.83 0.00 0.00 65 M 7.37 4.01 0.00 1.79 1.30 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.28 0.00 66 E 7.57 4.48 0.00 2.07 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 2.42 2.40 0.00 67 G 7.96 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 68 K 8.61 3.95 0.00 1.73 1.74 0.00 1.83 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.38 7.81 69 A 8.42 4.32 1.32 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 0.00 0.00 0.00 70 V 7.72 4.22 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 0.43 0.00 0.00 0.95 0.00 0.00 71 N 7.93 4.67 0.00 2.70 2.74 0.00 0.00 6.85 7.85 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 72 L 7.48 4.26 0.00 1.78 1.62 0.94 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.34 4.18 0.00 1.78 1.81 0.94 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.27 4.02 0.00 2.07 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 2.42 2.45 0.00 75 H 8.10 4.07 0.00 3.28 3.52 0.00 5.81 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 8.07 3.41 0.00 1.92 1.63 0.60 0.40 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 77 A 8.04 4.03 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 0.00 0.00 0.00 0.00 0.00 78 E 8.41 3.86 0.00 2.16 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 2.29 2.33 0.00 79 R 8.56 3.76 0.00 1.68 1.77 0.00 3.11 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 80 I 7.47 3.73 1.94 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.78 0.88 0.00 0.00 81 A 8.76 4.00 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 82 N 8.74 4.20 0.00 2.81 2.82 0.00 0.00 6.83 8.29 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 83 R 7.94 3.91 0.00 2.03 1.99 0.00 3.21 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 84 I 7.72 4.03 1.96 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 1.69 0.91 0.81 0.00 0.00 85 N 7.83 4.57 0.00 2.95 2.91 0.00 0.00 7.07 8.31 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 86 S 8.57 4.20 0.00 4.01 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 87 Q 7.94 4.14 0.00 1.78 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.69 0.00 0.00 0.00 0.00 0.00 2.35 2.70 0.00 88 Y 7.90 4.57 0.00 3.09 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 89 N 8.81 4.31 0.00 2.68 2.85 0.00 0.00 7.28 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 90 R 7.99 3.97 0.00 1.90 2.02 0.00 3.42 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 91 V 7.15 3.79 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.90 0.00 0.00 92 M 9.06 4.28 0.00 2.04 2.25 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.51 0.00 93 E 8.15 5.24 0.00 2.01 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 2.30 2.39 0.00 94 T 9.54 5.16 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 95 K 9.69 4.96 0.00 1.74 1.74 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.41 7.81 96 V 8.24 4.63 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 0.94 0.00 0.00 1.00 0.00 0.00 97 R 8.83 5.00 0.00 1.93 1.74 0.00 3.37 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.71 0.00 98 I 8.37 5.12 1.97 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.07 1.17 0.00 0.00 99 T 8.58 4.94 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 1.29 0.00 0.00 100 K 9.74 4.44 0.00 1.64 1.50 0.00 1.50 0.00 0.00 1.52 0.00 0.00 2.56 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.51 1.12 7.81 101 E 8.78 4.04 0.00 1.81 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 2.24 2.24 0.00 102 N 7.59 4.97 0.00 2.66 2.69 0.00 0.00 6.96 8.02 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 0.00 103 P 0.00 4.39 0.00 2.17 2.00 0.00 3.97 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 2.16 2.10 0.00 104 P 0.00 4.43 0.00 2.20 2.15 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 105 I 7.84 4.22 1.71 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.45 0.73 0.00 0.00 106 P 0.00 4.16 0.00 2.03 2.05 0.00 3.74 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 2.03 2.10 0.00 107 G 7.97 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 0.00 0.00 0.00 0.00 108 H 8.06 4.89 0.00 3.16 3.28 0.00 5.95 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 Y 7.49 4.65 0.00 3.06 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 0.00 110 D 9.11 4.37 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 0.00 111 G 7.14 4.43 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 0.00 112 V 7.32 4.58 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 0.75 0.00 0.00 1.07 0.00 0.00 113 G 7.69 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 0.00 0.00 0.00 0.00 114 I 7.49 4.83 1.88 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 1.25 0.82 0.92 0.00 0.00 115 E 8.65 4.93 0.00 1.95 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 2.18 2.29 0.00 116 I 8.48 4.77 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 1.27 1.01 0.92 0.00 0.00 117 V 8.47 4.65 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 0.93 0.00 0.00 0.94 0.00 0.00 118 R 9.36 4.91 0.00 1.68 1.77 0.00 3.30 0.00 0.00 3.22 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 119 E 8.66 5.14 0.00 1.95 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 2.17 2.27 0.00 120 N 8.67 4.95 0.00 3.13 2.76 0.00 0.00 6.99 6.29 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 0.00 121 K 8.38 4.21 0.00 1.72 1.64 0.00 1.86 0.00 0.00 1.75 0.00 0.00 3.14 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.33 1.45 7.81