NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.4080 8.1693 120.6391 55.0292 43.0992 175.6531 8 H 4.8693 8.1172 115.5417 53.2708 31.6850 171.2948 9 K 4.6740 9.2381 121.3479 56.0589 34.1904 177.3316 10 E 5.0112 9.1265 122.2570 53.7093 34.0130 173.4523 11 P 4.9599 0.0000 0.0000 63.1790 32.1893 175.1696 12 A 5.0185 8.7830 122.7424 50.9951 23.0777 175.2796 13 T 4.6388 8.4309 115.2770 61.2390 71.8095 173.9041 14 L 4.1957 8.6916 128.1332 55.9209 42.4134 175.2956 15 I 4.4007 8.5257 125.5950 62.1399 39.0189 175.8259 16 K 4.5994 7.5921 120.9749 55.1426 35.5880 174.3240 17 A 4.5246 8.7300 130.5105 52.0985 19.2580 176.9226 18 I 4.2590 8.0029 121.8601 62.1308 38.9770 174.9318 19 D 4.3915 7.4191 117.5233 53.5563 43.7719 176.3111 20 G 3.6782 8.9841 109.5358 47.8247 0.0000 174.0361 21 D 4.8896 8.0563 116.6415 53.0544 40.3394 175.3048 22 T 5.1899 7.7447 116.5329 62.4337 73.0034 173.3214 23 V 4.7458 8.8553 118.3724 59.5242 36.7283 174.0815 24 K 5.0811 9.3062 125.8318 55.0809 33.9500 175.2053 25 L 5.3144 9.1866 126.5425 53.1275 46.6854 175.2498 26 M 4.9203 9.2683 121.4616 54.8601 33.5041 174.1185 27 Y 5.0301 8.7459 128.0171 56.2232 41.8521 175.8051 28 K 3.6223 9.3095 126.6534 57.5006 29.8228 175.6292 29 G 3.9137 8.2906 102.6461 45.7680 0.0000 173.0304 30 Q 4.8015 7.9503 121.3691 52.9258 31.9158 173.0671 31 P 4.9489 0.0000 0.0000 63.5316 32.1445 175.2232 32 M 4.8827 9.5081 121.7416 54.1072 36.4697 173.5302 33 V 4.4350 8.3561 124.3937 62.1168 33.6570 174.3592 34 F 5.1354 9.4930 126.4237 55.6613 42.0499 174.0623 35 R 5.0127 8.9942 124.2951 54.5724 31.9534 175.2203 36 L 4.3586 8.6439 127.3258 54.4000 42.3995 177.3190 37 L 3.8999 8.7810 125.2895 56.0763 42.2659 178.1080 38 L 3.8740 8.8196 120.4064 55.0535 39.2989 174.0501 39 V 4.9496 7.2943 109.9612 59.5366 35.4232 174.9897 40 D 4.9923 9.0609 123.5665 52.9669 43.0547 175.5627 41 T 4.7526 8.3659 113.8749 59.2057 71.2472 173.1554 42 P 4.4679 0.0000 0.0000 62.8831 31.7746 175.4965 43 E 4.8952 10.0105 121.2881 54.9558 32.3103 177.0996 44 T 4.3078 8.2345 109.9004 62.4669 70.0619 175.7259 45 K 4.1219 7.9915 121.0607 57.8118 34.0355 176.0253 46 H 3.6770 8.6006 111.3335 56.9190 26.2569 172.8672 47 P 4.3868 0.0000 0.0000 62.7899 31.2215 173.0822 48 K 4.1402 7.6513 119.5216 55.1178 29.0632 176.7475 49 K 4.2767 7.9901 123.4059 56.4073 35.3117 178.6429 50 G 3.8469 8.8724 106.7708 45.0393 0.0000 175.9246 51 V 4.3633 8.4340 117.3116 60.4366 31.2535 173.5648 52 E 3.9140 7.9828 121.9280 55.7845 30.7541 177.4427 53 K 4.0506 8.2639 122.7728 58.0937 32.7076 176.8191 54 Y 4.6287 8.0217 122.2349 59.4561 36.0288 171.0569 55 G 3.7113 8.1952 107.4802 47.4573 0.0000 174.0070 56 P 4.2997 0.0000 0.0000 65.1377 31.4635 178.6630 57 E 4.0330 8.2042 116.6819 59.2608 29.4375 179.1039 58 A 4.0276 8.5235 121.4632 54.9554 18.5359 179.6501 59 S 4.0897 8.1868 111.5515 61.5925 62.4786 176.3021 60 A 4.0397 8.3933 123.8432 54.9161 18.0752 179.2894 61 F 3.9177 8.2590 119.0371 61.8732 39.4342 177.4238 62 T 3.9726 8.1162 115.2840 66.5191 68.1988 176.4892 63 K 3.9122 7.9932 121.1135 59.5105 32.2398 179.0390 64 K 3.9090 8.1515 118.8199 59.4761 31.7258 178.8443 65 M 3.8335 7.6308 117.2589 59.0161 32.2560 178.5152 66 V 3.7956 8.0484 112.4145 64.1335 31.5224 178.4456 67 E 4.0337 8.4657 118.0677 58.5221 29.3721 177.8872 68 N 4.6742 7.9702 114.0552 52.1825 39.3040 174.9801 69 A 4.5704 6.9398 123.9955 51.5039 19.6744 178.1562 70 K 4.2004 8.9075 120.6142 58.2304 32.7828 178.1080 71 K 4.6615 9.0633 118.4196 54.5231 35.8306 175.5681 72 I 5.0243 8.4213 125.1870 59.6259 39.8961 174.4712 73 E 5.2215 9.2835 125.2373 54.6721 33.7656 175.1363 74 V 4.6729 9.0888 115.6103 59.5681 35.2320 174.8316 75 E 4.9356 8.7590 123.8406 54.3833 32.0379 175.0214 76 F 4.6264 8.7893 125.7174 57.6906 40.0495 175.7222 77 D 4.9564 8.4247 120.7541 53.4322 43.2475 175.7642 78 K 4.3219 9.0894 117.1162 57.7712 33.1493 178.2627 79 G 4.1949 8.3567 111.2582 44.3771 0.0000 173.5545 80 Q 4.0766 8.6331 121.1589 56.8188 29.2225 176.6651 81 R 4.6278 8.4174 117.2793 56.5592 31.7017 175.6252 82 T 5.1819 7.7164 115.1007 61.7731 72.5505 173.3671 83 D 4.9368 8.5620 124.8162 51.6449 42.1449 177.0613 84 K 3.9195 8.6642 116.5364 59.2583 32.5774 176.9972 85 Y 4.3368 8.4742 116.8412 57.6926 37.9351 176.4058 86 G 3.9264 8.3310 108.2419 45.3474 0.0000 173.8530 87 R 4.3665 7.9612 119.0423 54.8807 31.8049 176.3374 88 G 3.5387 8.3098 110.7810 46.4401 0.0000 172.4021 89 L 5.3660 8.7454 123.2497 53.0565 43.3426 175.6061 90 A 4.5124 8.4197 124.9275 50.8144 23.7471 173.9385 91 Y 4.8342 8.7907 117.4656 57.1938 39.6136 175.1619 92 I 4.8620 8.8880 125.1759 59.6842 40.1075 174.1459 93 Y 5.1126 9.1064 123.8345 56.0432 41.2276 174.4209 94 A 4.8403 9.2261 125.9131 50.3511 21.4303 176.3191 95 D 4.3535 9.8486 125.8093 55.6398 38.8908 174.9901 96 G 4.0341 8.2464 106.3389 45.0438 0.0000 172.7243 97 K 4.5146 7.9086 120.0258 54.7557 33.8434 175.2750 98 M 4.0578 8.5129 123.3450 54.9304 32.9490 176.8410 99 V 3.6586 8.4610 127.5748 66.2795 31.3213 177.6811 100 N 4.3321 7.9584 115.6911 56.2366 38.3638 176.8717 101 E 3.8543 8.0239 119.9911 59.0929 29.8536 178.2455 102 A 3.9838 8.0474 120.8541 55.4064 18.3409 179.5922 103 L 3.3950 7.9063 117.2451 57.7665 41.6480 180.0412 104 V 3.7082 7.3584 117.7281 65.9692 31.2840 177.9369 105 R 3.8937 8.5185 118.1979 59.2643 29.9457 177.3294 106 Q 4.2537 7.8068 116.4867 55.5610 29.3831 175.8996 107 G 3.8659 7.9153 107.1799 47.2494 0.0000 174.5221 108 L 4.4966 7.7826 116.7045 53.9021 42.2799 176.1288 109 A 4.6588 7.4930 118.8390 50.9198 22.0618 176.1600 110 K 4.8216 8.6197 119.3226 54.4666 35.3826 176.0548 111 V 4.1445 9.3511 123.0217 63.0403 32.0215 176.1923 112 A 4.4772 8.7971 130.5461 51.0770 20.0706 176.0344 113 Y 3.9378 8.4903 119.2201 57.5059 39.4022 174.8716 114 V 3.9850 6.6952 125.7699 61.0034 33.5601 174.5139 115 Y 4.7142 8.0233 123.8827 55.8239 39.1328 175.4690 116 K 4.4669 8.5615 124.6322 56.0596 32.7460 175.0538 117 P 4.7986 0.0000 0.0000 63.2213 31.8358 177.0078 118 N 4.9222 8.0442 118.6925 52.3564 37.0044 175.3904 119 N 5.0860 7.7353 114.7814 53.1233 38.7604 177.8923 120 T 3.8207 8.7481 117.9422 67.8900 68.7245 175.2324 121 H 4.8094 7.8197 116.9783 55.8837 29.1292 176.9399 122 E 3.9127 8.1941 122.6322 59.5476 29.3764 178.6109 123 Q 3.9323 8.0204 118.9576 59.4661 29.2274 177.3631 124 H 4.2075 8.2460 118.7181 59.4358 29.8846 177.0520 125 L 3.9324 7.9051 120.5840 57.8567 41.4063 179.6840 126 R 4.0363 8.1316 118.0672 59.0256 29.8055 179.0826 127 K 3.9389 8.1429 119.5887 59.5756 32.2178 179.1833 128 S 4.1013 8.0744 115.5578 61.4147 62.6880 176.2637 129 E 3.9633 8.7108 122.3560 59.0515 29.3406 178.6419 130 A 3.7737 8.2633 121.3984 55.0197 18.2897 179.4758 131 Q 3.7812 7.8294 117.9603 59.2467 29.2950 178.0777 132 A 3.9895 8.0197 121.8052 55.2720 18.4915 179.8181 133 K 3.4625 7.7797 116.9192 59.0919 31.7175 179.5419 134 K 3.9622 7.7159 119.2357 58.7409 32.2001 177.8000 135 E 4.2787 8.1791 116.5986 55.0564 30.5190 175.8876 136 K 4.1285 7.4338 116.9888 55.9987 30.5244 175.2399 137 L 4.4010 7.9161 117.5651 55.0692 44.8380 177.8879 138 N 3.7658 9.4318 120.3816 54.1470 37.4573 176.5441 139 I 3.2286 5.4200 128.0292 64.0615 37.6131 176.8723 140 W 4.9433 8.0484 119.4803 56.3395 29.2204 176.5157 141 S 4.5008 7.8802 119.5108 58.5272 62.6932 173.9278 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 7 L 8.17 4.41 0.00 1.72 1.76 1.01 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 8 H 8.12 4.87 0.00 3.31 3.25 0.00 5.52 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 9 K 9.24 4.67 0.00 1.59 1.70 0.00 1.44 0.00 0.00 1.46 0.00 0.00 2.13 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.04 1.26 7.81 10 E 9.13 5.01 0.00 2.17 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 2.43 2.45 0.00 11 P 0.00 4.96 0.00 2.10 2.07 0.00 3.82 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 12 A 8.78 5.02 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 13 T 8.43 4.64 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 14 L 8.69 4.20 0.00 1.63 1.58 0.93 1.01 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 15 I 8.53 4.40 2.03 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 1.15 0.81 0.94 0.00 0.00 16 K 7.59 4.60 0.00 1.85 1.62 0.00 1.61 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.43 1.52 7.81 17 A 8.73 4.52 1.26 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 0.00 0.00 18 I 8.00 4.26 2.02 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 1.19 0.71 0.91 0.00 0.00 19 D 7.42 4.39 0.00 2.69 2.65 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 0.00 0.00 0.00 20 G 8.98 3.68 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 0.00 0.00 0.00 21 D 8.06 4.89 0.00 2.85 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 22 T 7.74 5.19 4.26 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 1.29 0.00 0.00 23 V 8.86 4.75 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 0.68 0.00 0.00 0.94 0.00 0.00 24 K 9.31 5.08 0.00 1.82 1.84 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.58 7.81 25 L 9.19 5.31 0.00 1.71 1.62 0.38 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.27 4.92 0.00 2.14 2.01 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 2.60 2.56 0.00 27 Y 8.75 5.03 0.00 3.33 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 28 K 9.31 3.62 0.00 1.51 1.62 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.03 0.28 7.81 29 G 8.29 3.91 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 0.00 0.00 0.00 30 Q 7.95 4.80 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.93 0.00 0.00 0.00 0.00 0.00 2.27 2.44 0.00 31 P 0.00 4.95 0.00 2.17 2.09 0.00 3.83 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 32 M 9.51 4.88 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.24 0.00 33 V 8.36 4.43 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 0.95 0.00 0.00 0.96 0.00 0.00 34 F 9.49 5.14 0.00 3.04 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 35 R 8.99 5.01 0.00 1.91 1.94 0.00 3.35 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 1.58 1.66 0.00 36 L 8.64 4.36 0.00 1.55 1.61 1.00 1.27 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 37 L 8.78 3.90 0.00 1.24 1.25 0.32 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.82 3.87 0.00 2.08 1.91 1.03 1.10 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 39 V 7.29 4.95 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 0.80 0.00 0.00 0.94 0.00 0.00 40 D 9.06 4.99 0.00 2.59 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 41 T 8.37 4.75 4.22 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 1.21 0.00 0.00 42 P 0.00 4.47 0.00 2.32 2.08 0.00 3.53 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.05 0.00 43 E 10.01 4.90 0.00 1.98 1.82 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 2.22 2.39 0.00 44 T 8.23 4.31 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 1.23 0.00 0.00 45 K 7.99 4.12 0.00 1.83 1.72 0.00 1.80 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.65 1.37 7.81 46 H 8.60 3.68 0.00 3.19 3.38 0.00 5.71 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.39 0.00 2.17 2.07 0.00 3.75 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 1.99 1.98 0.00 48 K 7.65 4.14 0.00 1.85 2.02 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.25 1.19 7.81 49 K 7.99 4.28 0.00 1.71 1.84 0.00 1.62 0.00 0.00 1.70 0.00 0.00 3.28 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.47 7.81 50 G 8.87 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 0.00 0.00 0.00 51 V 8.43 4.36 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 0.85 0.00 0.00 0.97 0.00 0.00 52 E 7.98 3.91 0.00 2.09 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 2.33 2.47 0.00 53 K 8.26 4.05 0.00 1.60 1.67 0.00 1.58 0.00 0.00 1.55 0.00 0.00 2.85 0.00 0.00 2.35 0.00 0.00 0.00 0.00 1.11 0.85 7.81 54 Y 8.02 4.63 0.00 3.17 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 55 G 8.20 3.71 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 0.00 0.00 0.00 56 P 0.00 4.30 0.00 2.16 2.11 0.00 3.58 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 57 E 8.20 4.03 0.00 2.37 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 2.53 2.50 0.00 58 A 8.52 4.03 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 59 S 8.19 4.09 0.00 3.99 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 0.00 60 A 8.39 4.04 1.39 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 61 F 8.26 3.92 0.00 3.33 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 62 T 8.12 3.97 4.31 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 1.25 0.00 0.00 63 K 7.99 3.91 0.00 1.87 2.05 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.61 7.81 64 K 8.15 3.91 0.00 1.65 1.74 0.00 1.72 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.54 7.81 65 M 7.63 3.83 0.00 2.07 1.81 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 2.53 2.55 0.00 66 V 8.05 3.80 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 0.74 0.00 0.00 1.02 0.00 0.00 67 E 8.47 4.03 0.00 1.92 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 2.34 2.56 0.00 68 N 7.97 4.67 0.00 2.75 2.80 0.00 0.00 6.96 6.86 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 69 A 6.94 4.57 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 70 K 8.91 4.20 0.00 1.83 1.87 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.50 7.81 71 K 9.06 4.66 0.00 1.72 1.66 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.38 7.81 72 I 8.42 5.02 2.01 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 1.33 0.87 0.85 0.00 0.00 73 E 9.28 5.22 0.00 1.87 1.85 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 2.21 2.26 0.00 74 V 9.09 4.67 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 -0.06 0.00 0.00 0.52 0.00 0.00 75 E 8.76 4.94 0.00 2.28 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 0.00 2.47 2.55 0.00 76 F 8.79 4.63 0.00 2.98 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 77 D 8.42 4.96 0.00 2.66 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 78 K 9.09 4.32 0.00 1.79 1.88 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.44 7.81 79 G 8.36 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 8.63 4.08 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 81 R 8.42 4.63 0.00 1.49 1.43 0.00 2.62 0.00 0.00 2.28 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 82 T 7.72 5.18 4.19 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 0.00 0.00 1.19 0.00 0.00 83 D 8.56 4.94 0.00 2.83 2.85 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 84 K 8.66 3.92 0.00 1.61 1.80 0.00 1.25 0.00 0.00 1.52 0.00 0.00 2.68 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.09 0.36 7.81 85 Y 8.47 4.34 0.00 3.09 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 86 G 8.33 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 0.00 0.00 0.00 87 R 7.96 4.37 0.00 2.01 1.90 0.00 3.15 0.00 0.00 3.33 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 88 G 8.31 3.54 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 0.00 0.00 0.00 89 L 8.75 5.37 0.00 1.58 1.61 0.94 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.42 4.51 0.91 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 0.00 0.00 91 Y 8.79 4.83 0.00 2.98 2.65 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 0.00 0.00 0.00 92 I 8.89 4.86 1.78 0.00 0.00 0.45 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 0.97 0.81 0.00 0.00 93 Y 9.11 5.11 0.00 2.79 2.81 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 0.00 0.00 0.00 94 A 9.23 4.84 1.19 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 0.00 0.00 0.00 0.00 0.00 95 D 9.85 4.35 0.00 2.73 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 96 G 8.25 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 0.00 0.00 0.00 97 K 7.91 4.51 0.00 2.04 1.76 0.00 1.58 0.00 0.00 1.87 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.43 7.81 98 M 8.51 4.06 0.00 1.89 1.63 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 2.43 0.00 99 V 8.46 3.66 2.04 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 1.04 0.00 0.00 0.95 0.00 0.00 100 N 7.96 4.33 0.00 2.87 2.89 0.00 0.00 6.78 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 0.00 101 E 8.02 3.85 0.00 1.88 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 2.23 2.05 0.00 102 A 8.05 3.98 1.61 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 0.00 0.00 103 L 7.91 3.39 0.00 1.81 1.58 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.36 3.71 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 1.06 0.00 0.00 0.97 0.00 0.00 105 R 8.52 3.89 0.00 2.02 2.09 0.00 3.34 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 106 Q 7.81 4.25 0.00 1.98 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.16 0.00 0.00 0.00 0.00 0.00 2.16 2.28 0.00 107 G 7.92 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 0.00 108 L 7.78 4.50 0.00 1.28 1.47 0.52 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.49 4.66 1.12 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 0.00 0.00 110 K 8.62 4.82 0.00 1.78 2.05 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.61 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.18 1.29 7.81 111 V 9.35 4.14 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 0.76 0.00 0.00 0.95 0.00 0.00 112 A 8.80 4.48 1.27 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 0.00 0.00 113 Y 8.49 3.94 0.00 2.84 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 0.00 114 V 6.70 3.99 1.74 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 0.80 0.00 0.00 0.83 0.00 0.00 115 Y 8.02 4.71 0.00 3.13 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 0.00 116 K 8.56 4.47 0.00 1.78 1.78 0.00 1.99 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.43 7.81 117 P 0.00 4.80 0.00 2.20 2.15 0.00 3.79 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 2.06 2.00 0.00 118 N 8.04 4.92 0.00 2.96 2.87 0.00 0.00 6.63 7.51 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 0.00 119 N 7.74 5.09 0.00 2.85 2.95 0.00 0.00 6.11 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 0.00 120 T 8.75 3.82 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 1.11 0.00 0.00 121 H 7.82 4.81 0.00 2.82 3.10 0.00 5.63 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.19 3.91 0.00 2.16 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 2.29 2.30 0.00 123 Q 8.02 3.93 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.65 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 124 H 8.25 4.21 0.00 3.20 3.39 0.00 5.74 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 0.00 125 L 7.91 3.93 0.00 2.11 1.70 0.85 1.02 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 0.00 126 R 8.13 4.04 0.00 1.97 1.95 0.00 3.09 0.00 0.00 3.06 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.84 0.00 127 K 8.14 3.94 0.00 1.80 2.05 0.00 1.93 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.62 7.81 128 S 8.07 4.10 0.00 3.97 3.86 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 0.00 129 E 8.71 3.96 0.00 2.08 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 2.19 2.57 0.00 130 A 8.26 3.77 1.27 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 0.00 0.00 131 Q 7.83 3.78 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 132 A 8.02 3.99 1.53 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 0.00 0.00 0.00 0.00 0.00 0.00 133 K 7.78 3.46 0.00 1.42 1.16 0.00 1.16 0.00 0.00 0.95 0.00 0.00 2.34 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.49 7.81 134 K 7.72 3.96 0.00 1.72 1.96 0.00 1.62 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.48 7.81 135 E 8.18 4.28 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 2.29 2.50 0.00 136 K 7.43 4.13 0.00 1.92 2.01 0.00 1.69 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.63 1.36 7.81 137 L 7.92 4.40 0.00 1.79 1.66 0.93 0.63 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 0.00 138 N 9.43 3.77 0.00 2.65 1.67 0.00 0.00 7.15 7.27 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 0.00 139 I 5.42 3.23 0.72 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.23 0.12 0.00 0.00 140 W 8.05 4.94 0.00 3.52 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 0.00 141 S 7.88 4.50 0.00 4.07 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