NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2950 8.2649 123.5793 52.0028 19.9447 177.1070 2 C 4.4723 8.4153 117.9719 56.0909 41.2397 172.5046 3 D 4.2814 9.4703 125.1688 56.7284 42.3271 176.4413 4 Y 4.9070 7.8796 115.2359 56.4865 42.6726 174.4941 5 T 4.8449 9.5735 121.0206 62.2904 71.5612 172.9293 6 C 4.7310 9.2001 126.1709 55.6742 41.4762 175.9043 7 G 3.7287 8.1897 118.4544 46.8659 0.0000 173.5216 8 S 4.5408 8.8443 119.1166 57.6757 63.7720 173.4415 9 N 4.3226 8.1735 120.9527 52.9778 38.9356 172.7767 10 C 5.0126 8.2331 123.2006 54.9732 46.4384 172.2826 11 Y 5.4024 8.9178 123.9067 56.3258 41.6620 175.3250 12 S 5.0894 9.1361 117.4769 56.8680 65.8686 175.3573 13 S 4.3478 9.1326 116.0420 61.8607 62.3589 177.3574 14 S 4.1533 8.0809 117.5292 61.5505 62.6238 176.1931 15 D 4.4019 7.9786 121.7555 57.3343 40.5358 179.0487 16 V 3.4156 7.6675 118.0891 66.1642 31.5620 178.1531 17 S 4.0754 8.3297 115.1815 61.9093 62.6397 176.9602 18 T 3.8309 8.0200 118.0548 66.5360 68.2474 176.6262 19 A 4.1927 7.9977 122.6739 55.2376 18.4150 179.3312 20 Q 3.7335 8.3964 118.2310 59.2337 29.0670 178.4169 21 A 3.7924 7.9889 121.4330 55.0497 18.4466 179.4656 22 A 3.8214 7.6988 118.8522 55.1631 18.4739 180.1416 23 G 2.2045 7.0363 104.0717 47.5626 0.0000 175.3535 24 Y 3.6282 7.4966 122.4865 59.7604 38.6652 177.9485 25 K 3.6934 7.7028 120.7201 59.3765 32.3389 178.7420 26 L 3.8557 7.3228 118.7191 57.9615 41.6177 178.9631 27 H 3.9639 7.9233 118.0536 59.3005 29.5313 177.1276 28 E 3.6333 7.5289 119.1324 59.2348 29.3705 178.4082 29 D 4.5324 7.8461 115.8761 53.7117 41.3265 176.3842 30 G 3.8260 7.6393 107.0903 46.9457 0.0000 173.2716 31 E 5.0125 8.1249 117.0765 54.3338 33.2366 175.7084 32 T 5.1938 8.3785 109.9516 60.4730 72.4751 173.2881 33 V 4.5792 9.3052 114.7970 60.8489 36.3915 176.7643 34 G 4.5870 9.0587 107.3724 45.6114 0.0000 174.7392 35 S 4.2476 8.5905 113.3157 60.5063 63.2876 174.8418 36 N 4.6528 8.2737 116.5702 52.0947 38.5600 175.0484 37 S 3.7193 7.4397 113.3182 59.5748 60.3757 170.3628 38 Y 5.0608 8.8329 120.1500 55.5535 40.4339 173.7580 39 P 5.6154 0.0000 0.0000 62.5729 33.1043 174.4271 40 H 5.2242 8.5807 114.9307 53.6724 32.6028 172.1567 41 K 4.1915 8.9238 120.4024 56.9988 32.6691 175.0549 42 Y 4.6433 8.3287 128.9787 56.0188 39.4365 175.3874 43 N 4.0539 8.1960 124.4495 53.6735 39.4465 174.4031 44 N 3.7512 6.0706 115.7578 54.4923 37.0101 175.2413 45 Y 4.3964 7.2746 115.7263 60.9822 38.5229 178.2130 46 E 3.8247 8.0220 118.4718 57.2526 29.6740 176.7331 47 G 3.6383 7.5568 106.1029 46.3721 0.0000 173.9895 48 F 4.2922 7.7173 117.8842 57.0919 39.5935 176.5704 49 D 4.6142 8.1081 124.9965 51.8257 38.0193 175.8081 50 F 4.6857 7.5185 124.4602 58.4695 39.9335 176.1730 51 S 4.4086 8.8290 119.4762 60.2496 63.1947 174.7795 52 V 4.5111 7.5709 112.3760 59.3659 33.7867 175.5627 53 S 4.4774 8.3427 117.6680 58.0874 63.4798 174.5521 54 S 3.2316 7.9412 117.7893 56.3115 63.9818 171.8898 55 P 4.0728 0.0000 0.0000 62.9434 32.4302 174.7720 56 Y 5.0469 7.7776 117.4858 56.5718 41.5770 174.2704 57 Y 5.0898 8.6399 119.1841 56.1186 41.9276 174.1469 58 E 5.0516 9.2296 121.6576 54.5423 32.5916 174.7157 59 W 5.3845 8.8251 131.3905 55.1215 34.4970 172.4228 60 P 4.3275 0.0000 0.0000 62.3044 31.4977 175.3670 61 I 4.3150 7.7875 123.4971 59.0887 40.3105 174.5903 62 L 4.7820 8.2926 128.8849 52.8416 43.4405 177.7425 63 S 4.4454 8.7630 117.3015 60.6895 63.2627 175.6568 64 S 4.1598 8.0219 115.2854 59.7320 63.0192 175.2526 65 G 4.0306 8.2409 109.1595 45.1241 0.0000 173.3914 66 D 4.6703 7.4023 118.5761 53.5363 41.7891 175.9222 67 V 4.1262 8.0302 120.7617 61.7285 32.5028 175.3269 68 Y 4.0760 8.7002 128.0593 58.3569 38.8143 175.8252 69 S 4.3875 8.3121 118.2624 57.0417 64.5380 172.7051 70 G 3.9063 7.1608 105.9229 44.1255 0.0000 174.6868 71 G 3.7833 8.2827 107.4316 44.3656 0.0000 172.6004 72 S 4.2231 8.6190 114.5393 58.1201 62.6300 173.4268 73 P 4.1022 0.0000 0.0000 62.3798 31.9561 177.5487 74 G 3.7654 7.3892 106.8605 45.2481 0.0000 172.5857 75 A 4.6519 8.3824 118.0441 52.2441 20.9577 176.9326 76 D 5.4158 7.9612 115.5955 53.0266 43.4582 175.8552 77 R 4.8424 8.7989 119.8416 54.6353 35.2471 174.2610 78 V 4.4592 8.8855 115.1631 59.5469 34.5632 174.8929 79 V 4.6888 8.3615 125.3117 60.9585 33.6036 174.4198 80 F 5.5179 8.4063 122.1863 55.3046 42.1950 173.2645 81 N 5.5574 8.5367 116.4758 50.3559 39.8840 174.6967 82 E 4.2461 9.2263 118.1588 59.5458 29.7787 177.5442 83 N 4.7614 8.4333 113.9449 52.3708 38.6432 173.9831 84 N 3.6205 7.6968 114.9691 54.4698 37.9514 173.7676 85 Q 4.4664 8.1624 114.7760 53.5201 30.5306 175.1992 86 L 4.2642 8.3666 124.3569 54.8939 42.6236 176.2805 87 A 3.9887 8.9254 130.2675 52.4472 19.1788 177.0237 88 G 3.8885 6.2365 101.6743 46.4092 0.0000 171.3426 89 V 4.6462 7.3654 119.2010 60.7409 34.0065 174.3950 90 I 5.0361 8.1500 120.3074 59.5990 41.3955 173.9312 91 T 5.2656 8.9719 115.9056 61.5180 70.8324 174.1458 92 H 4.5505 9.1170 122.3498 57.1067 29.2901 176.0203 93 T 4.0469 7.7881 117.3320 65.0138 68.3213 174.5593 94 G 3.9244 9.2132 114.0583 45.2889 0.0000 172.4601 95 A 4.8339 7.5242 121.0875 49.6666 21.9277 177.0092 96 S 4.2921 8.6179 117.2653 59.7521 64.6706 175.2681 97 G 3.7398 8.0515 112.9084 47.3238 0.0000 173.5088 98 N 4.5798 8.7078 119.1556 52.7041 38.2856 174.4097 99 N 4.9172 7.9885 117.2188 52.9333 39.6294 173.7541 100 F 5.3430 8.8791 117.3524 56.1664 42.7001 175.2544 101 V 5.0413 8.9975 112.9485 59.7483 36.1202 175.0532 102 E 4.4001 8.7333 121.5466 56.2979 30.3879 177.2639 103 C 4.7673 8.7482 120.9481 56.6636 36.9370 174.1695 104 T 4.1479 8.4814 111.8943 61.9665 68.6681 174.5315 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 A 8.26 4.29 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 2 C 8.42 4.47 0.00 3.04 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 3 D 9.47 4.28 0.00 2.72 2.36 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 0.00 0.00 0.00 0.00 4 Y 7.88 4.91 0.00 3.02 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 5 T 9.57 4.84 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 1.25 0.00 0.00 6 C 9.20 4.73 0.00 3.12 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 7 G 8.19 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 8.84 4.54 0.00 3.95 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 9 N 8.17 4.32 0.00 2.87 2.28 0.00 0.00 6.41 7.29 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 10 C 8.23 5.01 0.00 2.84 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 11 Y 8.92 5.40 0.00 3.07 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 12 S 9.14 5.09 0.00 3.95 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 13 S 9.13 4.35 0.00 3.94 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 14 S 8.08 4.15 0.00 3.90 3.94 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 15 D 7.98 4.40 0.00 2.97 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 16 V 7.67 3.42 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 0.87 0.00 0.00 0.80 0.00 0.00 17 S 8.33 4.08 0.00 3.88 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 18 T 8.02 3.83 4.40 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 1.24 0.00 0.00 19 A 8.00 4.19 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 20 Q 8.40 3.73 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 1.96 2.16 0.00 21 A 7.99 3.79 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 22 A 7.70 3.82 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 23 G 7.04 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 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 7.50 3.63 0.00 2.24 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 25 K 7.70 3.69 0.00 1.83 1.76 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.38 7.81 26 L 7.32 3.86 0.00 1.63 1.81 0.81 1.11 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 27 H 7.92 3.96 0.00 3.13 3.17 0.00 5.79 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 28 E 7.53 3.63 0.00 1.85 1.77 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 1.74 1.57 0.00 29 D 7.85 4.53 0.00 2.57 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 30 G 7.64 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.12 5.01 0.00 1.81 1.84 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 2.21 2.37 0.00 32 T 8.38 5.19 4.38 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 1.30 0.00 0.00 33 V 9.31 4.58 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 0.87 0.00 0.00 1.56 0.00 0.00 34 G 9.06 4.59 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 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.59 4.25 0.00 4.04 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 36 N 8.27 4.65 0.00 2.60 2.64 0.00 0.00 7.06 7.57 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 37 S 7.44 3.72 0.00 3.95 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 38 Y 8.83 5.06 0.00 3.11 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 39 P 0.00 5.62 0.00 2.31 2.48 0.00 3.67 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 40 H 8.58 5.22 0.00 3.22 3.62 0.00 5.48 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.92 4.19 0.00 1.78 1.72 0.00 1.62 0.00 0.00 1.53 0.00 0.00 2.50 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.22 1.15 7.81 42 Y 8.33 4.64 0.00 2.88 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 43 N 8.20 4.05 0.00 1.44 2.18 0.00 0.00 7.11 8.00 0.00 0.00 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 N 6.07 3.75 0.00 3.10 2.84 0.00 0.00 7.23 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 45 Y 7.27 4.40 0.00 2.97 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 46 E 8.02 3.82 0.00 1.22 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 2.52 2.33 0.00 47 G 7.56 3.64 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 0.00 0.00 0.00 48 F 7.72 4.29 0.00 1.72 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 0.00 0.00 0.00 49 D 8.11 4.61 0.00 2.77 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 50 F 7.52 4.69 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 51 S 8.83 4.41 0.00 3.94 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 52 V 7.57 4.51 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 0.78 0.00 0.00 1.06 0.00 0.00 53 S 8.34 4.48 0.00 3.87 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 54 S 7.94 3.23 0.00 3.37 3.10 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 55 P 0.00 4.07 0.00 1.68 2.02 0.00 3.60 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.02 0.00 56 Y 7.78 5.05 0.00 3.12 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 57 Y 8.64 5.09 0.00 1.64 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 E 9.23 5.05 0.00 1.82 1.86 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 2.46 2.37 0.00 59 W 8.83 5.38 0.00 3.67 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 60 P 0.00 4.33 0.00 0.73 1.23 0.00 2.20 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 61 I 7.79 4.32 1.58 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.65 0.38 0.00 0.00 62 L 8.29 4.78 0.00 1.89 1.59 1.04 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.76 4.45 0.00 3.93 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 64 S 8.02 4.16 0.00 4.03 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 65 G 8.24 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 66 D 7.40 4.67 0.00 2.72 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 67 V 8.03 4.13 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 1.08 0.00 0.00 1.03 0.00 0.00 68 Y 8.70 4.08 0.00 2.45 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 0.00 0.00 0.00 69 S 8.31 4.39 0.00 3.87 3.81 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 70 G 7.16 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 71 G 8.28 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 0.00 0.00 0.00 72 S 8.62 4.22 0.00 3.89 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 73 P 0.00 4.10 0.00 1.62 1.39 0.00 3.95 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.01 0.00 74 G 7.39 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 75 A 8.38 4.65 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 76 D 7.96 5.42 0.00 2.79 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 77 R 8.80 4.84 0.00 1.28 1.47 0.00 3.09 0.00 0.00 2.83 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 78 V 8.89 4.46 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 0.55 0.00 0.00 1.21 0.00 0.00 79 V 8.36 4.69 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.17 0.00 0.00 80 F 8.41 5.52 0.00 3.22 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 81 N 8.54 5.56 0.00 3.03 3.18 0.00 0.00 6.53 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 82 E 9.23 4.25 0.00 2.09 2.15 0.00 0.00 0.00 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 2.55 0.00 83 N 8.43 4.76 0.00 3.00 2.80 0.00 0.00 6.85 8.00 0.00 0.00 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 N 7.70 3.62 0.00 1.44 2.25 0.00 0.00 7.00 7.08 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 85 Q 8.16 4.47 0.00 2.33 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.78 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 86 L 8.37 4.26 0.00 1.53 1.55 0.83 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 87 A 8.93 3.99 0.35 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 0.00 0.00 88 G 6.24 3.89 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 0.00 0.00 0.00 89 V 7.37 4.65 1.70 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 0.92 0.00 0.00 -0.04 0.00 0.00 90 I 8.15 5.04 1.81 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.25 0.43 0.00 0.00 91 T 8.97 5.27 4.38 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 1.39 0.00 0.00 92 H 9.12 4.55 0.00 3.21 3.19 0.00 5.69 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 T 7.79 4.05 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 1.24 0.00 0.00 94 G 9.21 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 0.00 0.00 0.00 95 A 7.52 4.83 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 96 S 8.62 4.29 0.00 3.90 3.79 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 97 G 8.05 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.71 4.58 0.00 2.68 2.77 0.00 0.00 6.80 8.00 0.00 0.00 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 N 7.99 4.92 0.00 2.93 2.82 0.00 0.00 6.80 7.49 0.00 0.00 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 F 8.88 5.34 0.00 3.26 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 0.00 101 V 9.00 5.04 2.21 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 0.90 0.00 0.00 1.07 0.00 0.00 102 E 8.73 4.40 0.00 1.75 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 0.00 1.54 1.47 0.00 103 C 8.75 4.77 0.00 2.96 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 0.00 104 T 8.48 4.15 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 1.24 0.00 0.00