NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4142 8.2931 120.3216 55.5366 33.3971 174.7412 2 G 3.7658 8.1119 108.2019 45.1085 0.0000 171.4862 3 H 4.7785 9.5166 121.7174 55.9974 29.6191 173.6248 4 H 4.5470 7.4566 116.7360 56.7903 29.9302 175.6993 5 H 4.7171 7.6556 120.4991 55.2916 27.8411 177.8502 6 H 4.4946 7.6684 118.8459 56.0463 28.1770 172.4110 7 H 4.4865 7.9490 119.5919 54.4327 31.6704 172.8167 8 H 4.5351 8.7503 125.0751 56.5632 30.5531 174.8077 9 S 3.6633 8.3027 121.2286 59.9517 60.0118 173.0530 10 H 4.6154 8.0146 116.4559 54.3981 27.1575 173.4005 11 M 4.0891 7.9573 126.3156 55.8199 32.7261 177.8785 12 A 4.2372 8.2585 127.1772 51.8650 16.2663 174.6379 13 N 4.5939 8.1895 116.6620 52.4091 37.6737 177.2279 14 G 4.2029 8.0909 111.5945 44.5698 0.0000 170.7460 15 A 4.4193 7.6740 124.2230 50.4884 19.9308 175.4515 16 A 4.1459 8.1103 123.3221 52.3877 16.9748 178.9285 17 G 4.1322 8.5832 110.7216 46.7661 0.0000 173.8306 18 T 3.8167 7.7421 116.1540 66.5683 68.4413 175.0635 19 K 4.1566 7.9598 116.9217 57.0551 32.9915 176.7674 20 V 4.1523 7.8584 120.4107 61.2460 31.3068 174.0247 21 A 4.5092 7.8144 127.8067 52.1602 21.4217 175.5559 22 L 4.4988 8.0318 112.1909 53.6175 42.5447 178.8351 23 R 4.0836 7.8588 119.8519 58.3166 30.3121 177.6844 24 K 4.0726 8.2423 116.8359 59.2745 32.2296 175.9819 25 T 4.7770 7.4756 106.8014 59.7859 71.3910 171.6030 26 K 4.7680 8.1270 120.8823 56.0306 34.8141 174.0283 27 Q 4.6817 8.3883 114.3762 57.3721 35.4095 174.6676 28 A 4.2141 7.8058 119.4011 50.4783 22.1093 176.3916 29 A 3.9766 8.8077 127.1264 55.6065 18.6649 179.3613 30 E 4.0345 8.2383 114.1222 59.1298 29.6634 178.0428 31 K 4.1208 7.9386 118.4129 57.7363 32.9845 176.5879 32 I 3.8648 7.2154 119.7277 60.9808 37.1386 176.8414 33 S 4.1094 8.8657 122.7130 61.6322 62.4501 176.5727 34 A 3.9669 7.9413 122.9020 54.9816 17.8967 178.7401 35 D 4.3039 7.9838 115.4752 56.5259 41.3709 177.6301 36 K 4.3902 7.7731 118.9129 57.3283 32.4891 175.6556 37 I 3.5522 6.9290 119.3030 62.0031 36.7635 175.9823 38 S 4.6698 8.3189 121.8326 56.9143 65.4531 174.6261 39 K 3.4635 8.7818 126.6598 59.9188 31.7927 178.8588 40 E 3.9427 8.1871 116.7581 59.3408 29.4749 178.5546 41 A 3.9929 8.0196 121.2536 54.8314 18.4081 179.1396 42 L 3.8441 8.0486 118.6731 58.2982 42.1001 179.1064 43 L 3.9344 7.7220 118.6080 57.9132 41.4739 179.4263 44 E 3.9213 8.4294 118.6563 59.6584 28.9177 179.1982 45 C 3.9895 8.1376 116.5210 62.7354 28.1085 176.1188 46 A 3.7259 8.1490 122.5467 55.0371 17.9370 179.0807 47 D 4.4383 8.1677 118.1340 56.8243 41.0822 178.5271 48 L 3.9816 7.7001 119.3511 57.5904 41.4833 179.5252 49 L 3.9311 7.3482 118.7527 57.8480 40.3261 179.4374 50 S 4.0838 7.9962 114.1981 61.6711 62.5635 176.6365 51 S 4.0537 8.1371 116.2466 61.1410 62.0504 176.0752 52 A 3.9839 8.0965 122.0294 54.4951 18.1647 178.6496 53 L 4.2916 8.0814 116.0899 55.7052 42.0945 177.2958 54 T 4.4418 7.1689 105.8808 61.3113 70.6820 174.3034 55 E 4.4881 8.0659 120.2020 53.7601 31.0985 174.0759 56 P 4.3625 0.0000 0.0000 62.7706 31.6806 176.1697 57 V 4.5679 7.9146 115.5991 57.8054 36.0194 173.7411 58 P 4.5780 0.0000 0.0000 62.6198 33.2518 176.7443 59 N 4.2070 8.9482 118.8336 57.1189 38.8300 177.0458 60 S 4.0676 8.1139 113.8274 61.6110 62.4031 175.9192 61 Q 3.9402 7.9880 121.4539 59.0823 28.9191 177.6210 62 L 3.9420 7.8446 120.0188 57.9841 41.6666 179.7736 63 V 3.5517 7.9733 117.7948 66.1784 30.0040 177.6306 64 D 4.3366 8.1909 117.7754 57.6490 40.7988 178.3761 65 T 4.1832 7.9294 115.6559 66.5492 68.7796 176.8013 66 G 3.6722 8.2321 107.5625 47.5889 0.0000 175.1050 67 H 4.1769 8.6374 121.3191 59.4127 29.7866 177.2222 68 Q 4.1175 7.6570 118.0808 59.1209 28.4137 178.3335 69 L 3.8897 7.8574 120.8716 57.5081 41.4446 179.4912 70 L 4.0042 7.5820 118.0104 57.7236 41.5045 179.0398 71 D 4.3222 8.0725 117.4394 57.4983 41.2558 177.4066 72 Y 4.0355 8.2807 117.1205 61.4876 37.8624 178.7600 73 C 4.6024 8.7102 117.6190 63.3178 28.1424 176.4327 74 S 4.3234 8.4435 115.6476 61.2154 62.3716 176.6065 75 G 3.8193 7.7876 107.1977 47.4609 0.0000 175.1632 76 Y 4.1118 8.4579 122.6410 59.9151 38.7590 177.8557 77 V 3.2827 8.2763 120.8523 65.0156 31.1087 177.9457 78 D 4.3489 7.9471 116.5844 56.5249 41.1660 177.0106 79 C 4.2205 7.5898 118.0725 60.2539 31.5766 173.3643 80 I 3.6385 6.7346 122.1200 60.6060 36.8904 174.1064 81 P 4.1723 0.0000 0.0000 65.6697 31.5415 177.2434 82 Q 4.0505 7.9104 123.8219 55.5496 29.3883 176.2289 83 T 3.8894 8.5569 125.8661 66.5539 68.4863 176.4941 84 R 3.9768 8.0567 119.6446 59.5571 30.1651 178.5301 85 N 4.4174 8.1607 115.3815 56.3472 38.6849 177.1568 86 K 4.0154 8.4126 121.2594 59.4571 32.1137 178.6604 87 F 4.0469 8.7972 121.0283 61.3335 39.3508 177.1246 88 A 4.2354 8.4518 120.4041 55.0937 18.0437 179.4837 89 F 3.9885 8.8507 119.8581 61.3120 39.4181 177.5060 90 R 3.9182 8.0674 117.9911 59.2753 29.8344 178.7153 91 E 3.7423 7.9912 117.0325 59.3798 29.3642 178.8755 92 A 3.8505 7.5820 121.6877 54.8132 18.3464 179.7810 93 V 3.3584 7.5912 116.6148 66.2162 31.4148 178.4148 94 S 4.4818 8.1908 116.5573 61.0146 62.6206 176.8780 95 K 3.9694 8.3530 121.6975 59.0099 31.6603 179.2371 96 L 3.8819 7.9880 121.1046 57.9830 41.9518 178.7413 97 E 3.9284 8.3037 117.7859 59.5611 29.4310 178.9932 98 L 3.9532 7.5716 120.4416 57.4002 41.7220 179.5533 99 S 4.4468 7.9995 114.2744 60.7733 62.3246 176.2096 100 L 3.9892 8.2236 122.2762 57.8853 41.1389 179.5636 101 Q 4.0712 8.3016 117.8934 59.0029 28.4209 178.1889 102 E 4.0145 8.2637 119.7505 58.7918 29.8725 178.7463 103 L 3.9488 7.9967 121.6247 58.0394 41.9621 179.0094 104 Q 4.6219 7.6118 114.6555 58.5437 28.6481 177.8102 105 V 3.8874 7.2338 110.4062 62.6670 31.9767 176.9194 106 S 4.7022 7.8468 114.9721 58.1663 62.3422 175.4380 107 S 3.9488 7.5855 115.3303 60.5319 62.1385 174.4448 108 A 3.8788 7.5143 123.8343 52.2586 17.6010 178.0021 109 A 3.9227 7.8623 118.4982 53.0950 19.1633 177.8776 110 A 4.0242 7.9877 121.8312 52.5293 18.2572 177.8638 111 G 4.0966 7.5971 100.4530 43.8412 0.0000 172.2788 112 V 4.3442 7.2546 118.3739 60.0140 34.7437 172.7191 113 P 4.3078 0.0000 0.0000 64.0498 31.4912 176.7738 114 G 3.8979 8.8582 109.6425 45.7713 0.0000 173.8465 115 T 3.9691 7.6339 114.7723 64.3801 67.5894 173.7972 116 N 5.0990 7.7928 117.5879 50.1227 41.6843 173.6669 117 P 4.2898 0.0000 0.0000 65.8182 31.1465 178.6295 118 V 3.5813 7.9651 117.8273 66.2182 31.1380 177.6882 119 L 4.0104 7.9172 118.5291 57.9293 41.3583 179.2622 120 N 4.4051 8.3113 116.3647 56.0929 38.4967 177.2874 121 N 4.3026 8.0141 117.5478 56.1739 38.6401 177.0385 122 L 3.9204 8.2539 120.7304 57.8049 41.6982 179.1677 123 L 3.8885 7.7562 120.0119 58.3284 41.9602 178.7889 124 S 4.0567 8.2954 113.1168 61.7773 62.2317 176.0624 125 C 4.0808 8.0763 119.1425 62.7151 27.8685 176.2119 126 V 3.5083 8.0844 120.1968 66.0806 31.1128 177.9457 127 Q 3.9732 8.2398 117.9261 58.9340 28.5903 178.4731 128 E 3.8997 8.1204 120.0430 59.4008 29.5802 178.6222 129 I 3.5315 7.9897 120.3135 64.5330 37.2264 178.5102 130 S 4.1632 8.1249 114.7383 61.6553 62.9025 175.9828 131 D 4.4799 8.2925 121.8776 56.8487 40.7095 178.1810 132 V 3.6843 8.2011 118.4405 66.2490 31.5948 177.9735 133 V 3.8393 7.5677 116.9105 65.7981 31.4896 177.3473 134 Q 4.2603 7.8231 115.5902 57.0555 28.8379 176.7497 135 R 4.2823 7.6764 124.1227 56.4248 30.3518 175.9444 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 8.29 4.41 0.00 1.90 2.01 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.58 0.00 2 G 8.11 3.77 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 0.00 0.00 0.00 3 H 9.52 4.78 0.00 3.08 3.27 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 4 H 7.46 4.55 0.00 3.13 3.08 0.00 5.70 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 H 7.66 4.72 0.00 3.13 3.27 0.00 5.90 0.00 0.00 0.00 0.00 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 H 7.67 4.49 0.00 3.09 3.22 0.00 5.75 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 7 H 7.95 4.49 0.00 3.02 3.14 0.00 5.94 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 8 H 8.75 4.54 0.00 3.07 3.21 0.00 6.07 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.30 3.66 0.00 3.99 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 10 H 8.01 4.62 0.00 3.20 3.33 0.00 5.72 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 M 7.96 4.09 0.00 2.01 2.03 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 2.57 2.50 0.00 12 A 8.26 4.24 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 13 N 8.19 4.59 0.00 2.82 2.87 0.00 0.00 6.29 6.99 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 14 G 8.09 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 15 A 7.67 4.42 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 16 A 8.11 4.15 1.28 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 0.00 0.00 17 G 8.58 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 18 T 7.74 3.82 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 1.21 0.00 0.00 19 K 7.96 4.16 0.00 1.84 1.91 0.00 1.41 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.48 7.81 20 V 7.86 4.15 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 0.80 0.00 0.00 0.94 0.00 0.00 21 A 7.81 4.51 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.03 4.50 0.00 1.71 1.67 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 23 R 7.86 4.08 0.00 1.77 1.96 0.00 3.25 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 1.61 1.65 0.00 24 K 8.24 4.07 0.00 1.78 1.87 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.38 7.81 25 T 7.48 4.78 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 1.21 0.00 0.00 26 K 8.13 4.77 0.00 1.74 1.79 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.35 1.33 7.81 27 Q 8.39 4.68 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.72 0.00 0.00 0.00 0.00 0.00 2.22 2.34 0.00 28 A 7.81 4.21 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 29 A 8.81 3.98 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.24 4.03 0.00 1.94 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 2.31 2.36 0.00 31 K 7.94 4.12 0.00 1.68 1.92 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.43 7.81 32 I 7.22 3.86 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.86 0.93 0.00 0.00 33 S 8.87 4.11 0.00 3.81 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 34 A 7.94 3.97 1.29 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 0.00 0.00 0.00 35 D 7.98 4.30 0.00 2.66 2.94 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 36 K 7.77 4.39 0.00 1.77 1.98 0.00 1.83 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.59 7.81 37 I 6.93 3.55 2.03 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.74 1.01 0.00 0.00 38 S 8.32 4.67 0.00 3.89 3.80 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 0.00 0.00 0.00 39 K 8.78 3.46 0.00 1.95 1.88 0.00 1.82 0.00 0.00 1.92 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.50 7.81 40 E 8.19 3.94 0.00 2.23 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 2.38 2.39 0.00 41 A 8.02 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.05 3.84 0.00 1.70 1.69 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 43 L 7.72 3.93 0.00 1.91 1.68 0.91 0.86 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 44 E 8.43 3.92 0.00 2.10 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 2.56 2.49 0.00 45 C 8.14 3.99 0.00 2.76 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 46 A 8.15 3.73 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 47 D 8.17 4.44 0.00 2.83 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 48 L 7.70 3.98 0.00 1.86 1.66 0.87 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.35 3.93 0.00 1.76 1.67 0.96 0.71 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 50 S 8.00 4.08 0.00 4.04 4.11 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 51 S 8.14 4.05 0.00 3.91 4.01 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 A 8.10 3.98 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 53 L 8.08 4.29 0.00 1.59 1.70 0.98 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 54 T 7.17 4.44 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 55 E 8.07 4.49 0.00 2.07 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 2.38 2.25 0.00 56 P 0.00 4.36 0.00 2.06 2.04 0.00 3.63 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 2.02 2.10 0.00 57 V 7.91 4.57 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 0.69 0.00 0.00 1.01 0.00 0.00 58 P 0.00 4.58 0.00 2.25 2.17 0.00 3.84 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 59 N 8.95 4.21 0.00 2.88 2.86 0.00 0.00 6.96 6.85 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 60 S 8.11 4.07 0.00 3.92 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 61 Q 7.99 3.94 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.64 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 62 L 7.84 3.94 0.00 1.93 1.70 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.97 3.55 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 1.05 0.00 0.00 0.99 0.00 0.00 64 D 8.19 4.34 0.00 2.88 2.69 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 65 T 7.93 4.18 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 1.17 0.00 0.00 66 G 8.23 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 67 H 8.64 4.18 0.00 3.35 3.54 0.00 5.59 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 68 Q 7.66 4.12 0.00 2.40 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.47 0.00 0.00 0.00 0.00 0.00 2.50 2.14 0.00 69 L 7.86 3.89 0.00 1.84 1.70 0.77 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 70 L 7.58 4.00 0.00 1.85 1.71 0.90 0.84 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 71 D 8.07 4.32 0.00 2.82 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 72 Y 8.28 4.04 0.00 3.23 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 73 C 8.71 4.60 0.00 3.08 3.20 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 0.00 0.00 0.00 74 S 8.44 4.32 0.00 3.90 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 75 G 7.79 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 76 Y 8.46 4.11 0.00 3.18 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 77 V 8.28 3.28 2.47 0.00 0.00 0.00 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 1.06 0.00 0.00 78 D 7.95 4.35 0.00 2.65 2.69 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 79 C 7.59 4.22 0.00 2.72 2.50 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 80 I 6.73 3.64 1.83 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.49 0.92 0.00 0.00 81 P 0.00 4.17 0.00 2.15 2.13 0.00 3.69 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.91 0.00 82 Q 7.91 4.05 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.92 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 83 T 8.56 3.89 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 1.26 0.00 0.00 84 R 8.06 3.98 0.00 1.85 2.03 0.00 3.29 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.69 0.00 85 N 8.16 4.42 0.00 3.00 2.94 0.00 0.00 6.77 7.64 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 86 K 8.41 4.02 0.00 1.82 2.04 0.00 1.63 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.59 7.81 87 F 8.80 4.05 0.00 3.30 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 88 A 8.45 4.24 1.50 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 89 F 8.85 3.99 0.00 3.32 3.26 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 0.00 90 R 8.07 3.92 0.00 1.75 1.76 0.00 3.43 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.76 0.00 91 E 7.99 3.74 0.00 2.08 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 2.38 2.26 0.00 92 A 7.58 3.85 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 93 V 7.59 3.36 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 1.07 0.00 0.00 0.64 0.00 0.00 94 S 8.19 4.48 0.00 3.97 3.84 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 95 K 8.35 3.97 0.00 1.89 1.81 0.00 1.63 0.00 0.00 1.52 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.59 7.81 96 L 7.99 3.88 0.00 1.77 1.77 0.86 0.88 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 97 E 8.30 3.93 0.00 2.21 2.18 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 2.48 2.38 0.00 98 L 7.57 3.95 0.00 1.65 1.75 0.92 0.79 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 99 S 8.00 4.45 0.00 3.97 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 0.00 100 L 8.22 3.99 0.00 1.86 1.70 0.91 0.90 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 0.00 101 Q 8.30 4.07 0.00 2.28 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.82 0.00 0.00 0.00 0.00 0.00 2.57 2.36 0.00 102 E 8.26 4.01 0.00 2.23 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 2.49 2.30 0.00 103 L 8.00 3.95 0.00 1.90 1.89 0.91 0.51 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 0.00 104 Q 7.61 4.62 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.71 0.00 0.00 0.00 0.00 0.00 2.53 2.28 0.00 105 V 7.23 3.89 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 0.82 0.00 0.00 0.99 0.00 0.00 106 S 7.85 4.70 0.00 3.91 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 0.00 107 S 7.59 3.95 0.00 4.05 4.09 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 0.00 108 A 7.51 3.88 1.33 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 0.00 0.00 109 A 7.86 3.92 1.29 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 0.00 0.00 0.00 110 A 7.99 4.02 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 G 7.60 4.10 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 0.00 112 V 7.25 4.34 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 1.13 0.00 0.00 0.93 0.00 0.00 113 P 0.00 4.31 0.00 2.21 2.04 0.00 3.89 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 1.98 1.96 0.00 114 G 8.86 3.90 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 0.00 0.00 0.00 115 T 7.63 3.97 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 1.25 0.00 0.00 116 N 7.79 5.10 0.00 2.73 2.64 0.00 0.00 6.84 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 0.00 117 P 0.00 4.29 0.00 2.25 2.31 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 118 V 7.97 3.58 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 1.19 0.00 0.00 0.96 0.00 0.00 119 L 7.92 4.01 0.00 1.74 1.69 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 120 N 8.31 4.41 0.00 2.87 2.85 0.00 0.00 7.02 6.25 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 0.00 121 N 8.01 4.30 0.00 2.97 2.85 0.00 0.00 7.14 6.73 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 0.00 122 L 8.25 3.92 0.00 1.83 1.69 0.90 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 123 L 7.76 3.89 0.00 1.86 1.86 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 124 S 8.30 4.06 0.00 3.89 4.04 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 0.00 125 C 8.08 4.08 0.00 3.12 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 0.00 126 V 8.08 3.51 2.17 0.00 0.00 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 0.95 0.00 0.00 127 Q 8.24 3.97 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.56 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 128 E 8.12 3.90 0.00 2.15 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 0.00 2.27 2.38 0.00 129 I 7.99 3.53 1.88 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 1.13 0.59 0.67 0.00 0.00 130 S 8.12 4.16 0.00 4.06 4.11 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 0.00 131 D 8.29 4.48 0.00 2.93 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 0.00 132 V 8.20 3.68 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.11 0.00 0.00 133 V 7.57 3.84 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 0.88 0.00 0.00 1.16 0.00 0.00 134 Q 7.82 4.26 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.77 0.00 0.00 0.00 0.00 0.00 2.41 2.66 0.00 135 R 7.68 4.28 0.00 2.05 1.88 0.00 3.26 0.00 0.00 3.31 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.97 0.00