NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.1700 8.1749 117.3692 63.8896 70.7847 176.0076 3 T 3.0063 6.8051 114.8343 62.8685 63.8589 171.1031 4 F 4.4863 7.2085 120.8108 55.9555 40.5029 174.7400 5 R 4.4604 8.0804 119.2578 54.5118 33.0594 173.6981 6 F 5.1297 8.0448 119.4058 55.5191 41.6024 175.2876 7 C 3.8555 8.1370 117.6932 57.3702 31.0925 172.5261 8 R 4.6566 8.0988 118.3165 56.9442 31.0533 178.0389 9 D 4.1990 8.1259 113.3377 54.7479 41.7743 173.0358 10 C 4.5190 8.3744 115.0491 61.7422 30.8956 176.1839 11 N 4.2445 6.7869 117.0771 57.8522 36.1465 173.9473 12 N 4.8028 7.8120 125.7015 52.9546 39.7100 174.7187 13 M 4.5546 8.5530 126.0723 54.6684 34.4690 174.6671 14 L 5.7623 7.9038 121.6840 52.5323 44.5670 175.5297 15 Y 4.7684 9.1103 121.8647 55.9463 40.1548 173.5583 16 P 5.4173 0.0000 0.0000 62.9331 33.5510 174.7590 17 R 4.7672 8.9080 118.8324 55.3293 35.4575 173.2130 18 E 4.9179 8.5941 120.4030 54.6540 32.4857 175.4640 19 D 4.5991 8.9138 126.6972 52.6632 40.1500 176.9573 20 K 3.8493 8.5022 124.8688 59.4146 32.3433 178.5857 21 E 4.0290 8.1964 117.9921 58.5172 29.6294 177.0285 22 N 4.7607 8.0622 112.9147 52.0565 39.8392 173.8275 23 N 4.1427 8.0293 116.4590 52.4455 35.8369 172.9374 24 R 4.4798 7.0934 114.8993 55.3337 33.2698 174.2800 25 L 4.7343 8.1046 121.9221 53.7809 44.3088 175.0773 26 L 5.0566 8.2822 124.4305 53.2454 45.9497 176.6287 27 F 5.5253 8.7465 123.1842 57.3751 41.6351 173.5358 28 E 5.2835 8.4291 115.2375 56.7491 33.1605 174.0521 29 C 5.1552 8.9070 118.3232 57.6497 34.9858 174.3951 30 R 4.5967 8.3762 121.3518 56.4531 30.7603 176.4275 31 T 4.5038 8.1211 112.7525 65.1376 71.7169 174.2525 32 C 4.8263 7.4846 114.6202 58.0323 28.3332 175.3204 33 S 4.5871 8.7300 111.3070 57.8726 65.9380 172.8276 34 Y 4.1602 7.7622 121.7041 57.6812 39.2760 175.7782 35 V 4.9099 7.5706 121.9745 62.1616 34.6147 172.2543 36 E 5.0530 9.1349 126.2002 53.9789 32.8151 175.3996 37 E 4.4229 8.9850 119.5436 56.3030 30.5954 176.3159 38 A 3.6021 8.2763 123.4058 52.0776 18.1863 178.2132 39 G 3.7575 9.0794 112.6295 48.5121 0.0000 173.4609 40 S 4.6152 7.5128 111.1751 56.1782 64.9932 172.3538 41 P 4.3127 0.0000 0.0000 63.8941 31.3117 176.3791 42 L 4.2747 7.8197 122.0613 54.4707 40.9800 176.0137 43 V 4.0979 8.3907 126.6777 64.9996 32.1184 175.7738 44 Y 4.9836 7.6402 117.9301 55.9860 41.7455 173.5594 45 R 4.2903 7.6470 124.8757 54.7736 33.5123 173.5450 46 H 4.2524 8.5681 122.7342 56.8606 31.2222 171.9761 47 E 3.4743 7.9562 124.2118 56.3080 28.5286 173.0915 48 L 4.2050 8.1808 124.9285 56.6996 42.7111 178.3497 49 I 4.0460 7.2932 126.7007 60.7427 35.8702 175.9984 50 T 4.3140 7.9310 121.3822 63.2072 69.0796 174.8052 51 N 4.9666 8.4106 117.6972 52.4129 40.9804 173.9995 52 I 4.2707 7.7567 113.1175 60.4341 38.2824 175.0462 53 G 3.7477 9.1674 112.7484 45.2169 0.0000 175.0938 54 E 3.5260 7.5159 119.5681 59.3802 30.1447 177.7664 55 T 4.4998 7.1570 113.4148 62.0604 69.4308 173.6149 56 A 3.8178 7.8095 124.4552 52.8128 19.6410 179.4533 57 G 3.6208 8.0033 102.6357 47.0313 0.0000 175.2549 58 V 4.5298 7.7423 131.8775 60.6277 31.9865 175.5780 59 V 3.6246 7.6927 120.2881 63.2224 32.2471 175.9813 60 Q 4.1435 8.6948 124.1162 57.7755 28.8768 176.2763 61 D 4.7421 7.7709 115.7996 55.0109 41.7781 177.4961 62 I 3.7769 8.0312 119.6845 62.4723 37.9247 176.1017 63 G 3.9617 7.8429 106.9863 46.8591 0.0000 174.6135 64 S 4.3676 8.8345 114.3271 58.3706 63.3746 173.4108 65 D 4.6791 7.7689 121.8293 52.2804 41.1167 174.0376 66 P 4.4119 0.0000 0.0000 65.8903 31.4948 177.9240 67 T 3.9207 7.9225 107.7237 63.4957 68.7543 174.1511 68 L 4.3275 7.5342 121.9527 53.2130 43.0120 174.3976 69 P 4.7342 0.0000 0.0000 62.4245 33.2221 174.8909 70 R 6.0300 8.9516 119.0404 53.7240 33.1719 174.9667 71 S 4.8944 8.7057 115.7453 56.1966 67.1332 173.4705 72 D 4.7621 8.4724 118.1235 53.2682 39.7187 176.8159 73 R 4.3256 7.8169 119.6669 56.2241 31.4698 174.7540 74 E 5.4428 8.3797 115.9715 53.4767 30.6884 175.0504 75 C 2.9826 8.0640 116.5883 54.0267 42.3727 172.8517 76 P 3.9954 0.0000 0.0000 64.7548 31.0670 176.5508 77 K 4.2436 6.9756 116.0011 57.3317 34.6678 175.8108 78 C 3.8830 8.1430 113.3290 57.3549 41.5337 174.0120 79 H 3.8721 7.6906 114.0222 56.4923 27.0586 174.5121 80 S 4.4869 7.7245 116.2905 57.8425 64.3429 174.0020 81 R 5.0460 8.0081 117.3947 54.9448 30.1783 177.6725 82 E 4.6144 8.2291 118.5974 54.9297 32.9046 175.0763 83 N 6.0701 9.1114 120.4209 50.3203 42.2515 174.5225 84 V 5.6324 8.5922 120.3231 59.2884 34.0112 174.6464 85 F 4.9578 9.6147 121.1185 55.1813 40.3382 174.2545 86 F 4.6501 7.4838 110.8059 56.8216 40.5474 172.9023 87 Q 4.5699 8.5076 116.1732 53.8507 32.4809 174.6103 88 S 3.5232 8.4991 112.9968 59.1652 62.2172 174.5186 89 Q 3.8347 8.0360 125.2366 56.6444 28.6083 176.1556 90 Q 4.0690 7.1964 118.9872 55.2264 28.3016 176.7579 91 R 4.2383 8.1432 127.8797 55.9698 27.8160 176.0619 92 R 4.6532 7.2254 118.5331 54.0337 32.9172 175.6082 93 K 4.1197 8.2974 121.2906 59.3667 32.4312 179.2857 94 D 4.4552 8.0014 117.9499 55.7127 39.4389 177.0490 95 T 3.8713 7.1471 116.0360 64.0709 68.8786 173.9360 96 S 4.5876 8.3852 119.2775 58.2342 64.6208 173.5878 97 M 4.6975 8.2014 118.2870 54.8169 32.1954 176.6135 98 V 4.1961 7.7994 117.0893 62.1154 33.4669 174.3321 99 L 5.1440 8.2590 123.8600 52.8036 44.1761 175.3374 100 F 4.9004 9.0242 121.5109 56.0758 41.2058 175.0955 101 F 4.8669 9.4049 123.0528 55.8335 42.1150 175.1474 102 V 5.4265 7.7898 116.0554 60.2681 34.8899 174.0286 103 C 4.8325 8.9934 128.7623 59.6715 32.1616 173.7678 104 L 4.3328 8.6520 125.3814 55.3442 41.7959 177.2510 105 S 4.8508 8.5711 114.0708 55.8240 63.2262 174.1016 106 C 5.9978 8.6823 127.5865 58.6719 27.6322 174.9582 107 S 4.0460 7.6509 114.1698 59.4629 60.0434 168.5799 108 H 4.8176 8.1155 118.4300 55.3201 32.0722 173.6875 109 I 5.3353 7.9074 122.5894 58.5072 36.5848 174.5599 110 F 4.7567 8.7294 120.2075 56.1229 40.4901 176.1141 111 T 4.7014 8.2840 117.2679 62.0241 71.2041 173.9489 112 S 4.5824 8.2637 114.3728 58.4892 63.2576 174.7416 113 D 4.6371 8.0961 120.1380 54.1925 38.3541 176.9371 114 Q 4.1078 8.3151 122.0990 57.7281 29.1134 177.9561 115 K 4.1236 7.9449 116.2450 56.7676 32.5703 176.5511 116 N 4.2961 8.0878 114.8721 54.1654 36.1918 174.4273 117 K 4.1690 8.1483 122.4913 56.8236 32.1774 177.1776 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 2 T 8.17 4.17 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 1.33 0.00 0.00 3 T 6.81 3.01 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 1.05 0.00 0.00 4 F 7.21 4.49 0.00 2.76 2.99 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 5 R 8.08 4.46 0.00 1.71 1.75 0.00 3.22 0.00 0.00 3.73 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.53 0.00 6 F 8.04 5.13 0.00 3.04 2.89 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 0.00 0.00 0.00 7 C 8.14 3.86 0.00 1.83 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 8 R 8.10 4.66 0.00 2.06 2.05 0.00 3.40 0.00 0.00 3.59 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.28 0.00 9 D 8.13 4.20 0.00 2.91 2.70 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 0.00 0.00 0.00 0.00 10 C 8.37 4.52 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 11 N 6.79 4.24 0.00 2.81 2.87 0.00 0.00 6.93 7.67 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 12 N 7.81 4.80 0.00 2.67 2.33 0.00 0.00 7.00 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 13 M 8.55 4.55 0.00 1.94 1.76 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.94 0.00 14 L 7.90 5.76 0.00 1.36 1.54 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.11 4.77 0.00 2.90 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 16 P 0.00 5.42 0.00 2.23 2.57 0.00 3.89 0.00 0.00 3.82 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 17 R 8.91 4.77 0.00 1.78 1.85 0.00 3.19 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 18 E 8.59 4.92 0.00 1.93 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 2.16 2.25 0.00 19 D 8.91 4.60 0.00 2.69 2.54 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 0.00 0.00 0.00 0.00 20 K 8.50 3.85 0.00 1.78 1.86 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.44 7.81 21 E 8.20 4.03 0.00 1.92 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 2.29 2.34 0.00 22 N 8.06 4.76 0.00 2.96 2.79 0.00 0.00 7.02 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 23 N 8.03 4.14 0.00 2.87 2.85 0.00 0.00 6.76 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 24 R 7.09 4.48 0.00 1.79 1.94 0.00 2.92 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 25 L 8.10 4.73 0.00 1.69 1.39 0.89 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 26 L 8.28 5.06 0.00 1.60 1.50 0.92 0.86 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 27 F 8.75 5.53 0.00 3.14 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 28 E 8.43 5.28 0.00 2.25 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 0.00 2.41 2.26 0.00 29 C 8.91 5.16 0.00 2.96 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 30 R 8.38 4.60 0.00 1.35 1.63 0.00 2.21 0.00 0.00 2.74 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.14 0.00 31 T 8.12 4.50 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 1.20 0.00 0.00 32 C 7.48 4.83 0.00 3.13 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 33 S 8.73 4.59 0.00 3.85 3.88 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 34 Y 7.76 4.16 0.00 2.99 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 35 V 7.57 4.91 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 0.90 0.00 0.00 1.10 0.00 0.00 36 E 9.13 5.05 0.00 2.22 2.59 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 0.00 2.53 2.51 0.00 37 E 8.98 4.42 0.00 1.98 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 2.35 0.00 38 A 8.28 3.60 1.09 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 0.00 0.00 39 G 9.08 3.76 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 0.00 0.00 0.00 40 S 7.51 4.62 0.00 3.83 3.75 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 41 P 0.00 4.31 0.00 2.23 2.16 0.00 3.83 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 42 L 7.82 4.27 0.00 1.66 1.72 0.95 0.81 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 43 V 8.39 4.10 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 1.00 0.00 0.00 1.10 0.00 0.00 44 Y 7.64 4.98 0.00 2.86 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.65 4.29 0.00 1.62 1.55 0.00 3.20 0.00 0.00 3.08 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.45 0.00 46 H 8.57 4.25 0.00 2.95 3.22 0.00 6.13 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 47 E 7.96 3.47 0.00 2.01 1.83 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 2.15 2.26 0.00 48 L 8.18 4.20 0.00 1.66 1.65 0.95 0.93 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 49 I 7.29 4.05 1.86 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 0.47 0.91 0.00 0.00 50 T 7.93 4.31 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 1.25 0.00 0.00 51 N 8.41 4.97 0.00 2.77 2.79 0.00 0.00 6.60 7.32 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 52 I 7.76 4.27 1.85 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 0.53 0.90 0.00 0.00 53 G 9.17 3.75 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 0.00 0.00 0.00 54 E 7.52 3.53 0.00 2.10 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 0.00 2.40 2.45 0.00 55 T 7.16 4.50 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 1.47 0.00 0.00 56 A 7.81 3.82 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 57 G 8.00 3.62 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 0.00 58 V 7.74 4.53 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 0.95 0.00 0.00 1.16 0.00 0.00 59 V 7.69 3.62 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 0.95 0.00 0.00 60 Q 8.69 4.14 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 61 D 7.77 4.74 0.00 2.75 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 I 8.03 3.78 2.00 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 1.27 0.82 0.97 0.00 0.00 63 G 7.84 3.96 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 0.00 0.00 0.00 64 S 8.83 4.37 0.00 3.90 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 65 D 7.77 4.68 0.00 2.66 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 66 P 0.00 4.41 0.00 2.21 2.17 0.00 3.83 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 1.98 1.95 0.00 67 T 7.92 3.92 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 1.20 0.00 0.00 68 L 7.53 4.33 0.00 1.81 1.56 1.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.73 0.00 1.64 1.82 0.00 3.44 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.92 0.00 70 R 8.95 6.03 0.00 1.76 1.92 0.00 3.43 0.00 0.00 4.01 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.42 0.00 71 S 8.71 4.89 0.00 3.79 3.57 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.47 4.76 0.00 2.79 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 73 R 7.82 4.33 0.00 1.88 1.86 0.00 2.62 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 74 E 8.38 5.44 0.00 1.99 1.87 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 2.11 2.13 0.00 75 C 8.06 2.98 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 76 P 0.00 4.00 0.00 1.91 2.05 0.00 3.22 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.93 0.00 77 K 6.98 4.24 0.00 1.78 1.59 0.00 1.48 0.00 0.00 1.58 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.21 1.14 7.81 78 C 8.14 3.88 0.00 3.18 3.29 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 79 H 7.69 3.87 0.00 3.23 3.28 0.00 5.65 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 7.72 4.49 0.00 3.78 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 81 R 8.01 5.05 0.00 1.65 1.88 0.00 3.20 0.00 0.00 2.68 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.44 0.00 82 E 8.23 4.61 0.00 1.89 1.87 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 2.32 2.35 0.00 83 N 9.11 6.07 0.00 2.85 2.96 0.00 0.00 6.34 7.56 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 84 V 8.59 5.63 2.13 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 0.93 0.00 0.00 0.95 0.00 0.00 85 F 9.61 4.96 0.00 2.47 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 0.00 0.00 0.00 86 F 7.48 4.65 0.00 2.81 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 87 Q 8.51 4.57 0.00 1.94 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 88 S 8.50 3.52 0.00 3.71 3.72 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 89 Q 8.04 3.83 0.00 2.08 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.97 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 90 Q 7.20 4.07 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 7.48 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 91 R 8.14 4.24 0.00 1.79 1.84 0.00 3.30 0.00 0.00 3.06 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.49 0.00 92 R 7.23 4.65 0.00 1.70 1.75 0.00 3.21 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.59 0.00 93 K 8.30 4.12 0.00 1.85 1.80 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.41 7.81 94 D 8.00 4.46 0.00 2.78 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 95 T 7.15 3.87 4.33 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 1.20 0.00 0.00 96 S 8.39 4.59 0.00 4.02 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 97 M 8.20 4.70 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 98 V 7.80 4.20 2.24 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 0.96 0.00 0.00 1.05 0.00 0.00 99 L 8.26 5.14 0.00 1.18 1.31 0.93 1.36 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 0.00 100 F 9.02 4.90 0.00 3.22 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 0.00 101 F 9.40 4.87 0.00 1.51 2.56 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 0.00 102 V 7.79 5.43 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 1.36 0.00 0.00 0.88 0.00 0.00 103 C 8.99 4.83 0.00 3.10 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 0.00 104 L 8.65 4.33 0.00 1.65 1.73 0.99 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.57 4.85 0.00 3.81 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 0.00 106 C 8.68 6.00 0.00 3.18 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 0.00 107 S 7.65 4.05 0.00 4.12 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 0.00 108 H 8.12 4.82 0.00 3.25 3.21 0.00 5.80 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 7.91 5.34 1.90 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.96 1.08 0.00 0.00 110 F 8.73 4.76 0.00 3.09 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 0.00 111 T 8.28 4.70 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 1.12 0.00 0.00 112 S 8.26 4.58 0.00 4.26 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 0.00 113 D 8.10 4.64 0.00 2.71 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 0.00 114 Q 8.32 4.11 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 7.06 0.00 0.00 0.00 0.00 0.00 2.36 2.72 0.00 115 K 7.94 4.12 0.00 1.75 1.86 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.46 7.81 116 N 8.09 4.30 0.00 2.88 2.95 0.00 0.00 7.02 7.22 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 0.00 117 K 8.15 4.17 0.00 1.75 1.73 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.43 7.81