NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.0705 8.3401 119.6578 55.7992 30.0298 175.5773 2 A 4.2551 7.8509 125.1666 49.6392 17.1448 171.9000 3 E 3.5338 8.7830 120.5353 56.9748 30.1275 179.6931 4 E 3.1796 7.8810 122.3389 56.8367 31.4108 176.6689 5 W 4.4181 7.2158 120.6087 59.6480 31.0217 175.7536 6 Y 4.9815 7.7953 123.6064 56.7310 36.8541 175.8687 7 F 3.8081 9.1995 124.4717 59.0142 40.0610 174.1841 8 G 3.8202 8.6085 103.3845 44.0571 0.0000 173.1893 9 K 5.0351 8.6817 115.2818 55.3106 31.9132 177.1318 10 I 4.0889 7.3551 112.3624 61.0125 39.3608 177.1744 11 T 4.2114 9.1716 115.5070 60.9276 70.8759 175.7162 12 R 3.8929 8.4684 121.0027 59.9263 30.0298 178.6788 13 R 4.1089 7.9509 117.0838 59.3333 29.7102 178.7310 14 E 3.9540 7.7488 118.0616 59.4808 29.3726 179.4346 15 S 4.0034 8.1768 113.1272 61.3002 62.4763 175.9875 16 E 3.9332 8.6714 121.7796 59.4563 28.9906 179.2267 17 R 4.0076 7.7369 117.6151 59.4154 30.1109 178.2574 18 L 4.1530 7.2827 117.5339 57.5665 41.9392 178.9876 19 L 4.1884 8.1723 119.2541 57.1857 41.6042 178.4106 20 L 4.4840 8.2876 118.4495 54.9627 41.7850 176.7641 21 N 4.7110 8.3147 117.7130 51.5501 39.0398 175.0246 22 P 4.5502 0.0000 0.0000 64.9424 31.5346 176.9406 23 E 4.2556 7.9877 113.9482 56.5305 30.2087 175.9621 24 N 4.6211 8.2556 119.2199 52.0324 39.5600 173.3138 25 P 4.4301 0.0000 0.0000 61.4595 32.7168 175.4445 26 R 4.2297 8.2280 120.3316 57.4259 30.4652 175.9750 27 G 4.0936 8.6177 111.9685 46.0668 0.0000 173.1656 28 T 5.1541 8.4504 118.3963 63.4917 69.2975 173.5264 29 F 6.1286 8.4640 120.7940 54.1015 42.1936 173.4439 30 L 4.9323 8.2720 116.1942 55.1147 42.9681 173.5155 31 V 5.1320 9.1836 121.7233 60.2625 33.4298 174.8405 32 R 4.9436 9.1042 122.7298 54.5350 32.6721 174.8700 33 E 4.4331 9.3656 122.8370 54.9788 30.9959 174.9990 34 S 4.6930 8.3210 123.6253 58.1424 62.3447 173.7765 35 E 4.2723 8.9400 124.9661 57.5545 30.3001 176.8693 36 T 4.1500 7.7373 112.5664 63.3034 68.0644 174.5013 37 T 4.4833 7.7342 117.1237 61.6740 70.0296 172.8549 38 K 4.2058 8.2820 125.4217 57.4293 32.7890 177.6886 39 G 3.9100 9.4472 109.9388 45.5839 0.0000 172.7225 40 A 4.9748 7.4904 119.2363 50.3180 23.0550 175.8360 41 Y 5.0312 9.0895 118.0049 56.3425 42.2155 174.4689 42 C 5.0004 9.2408 120.0845 57.9968 35.0679 172.9140 43 L 4.8030 8.7686 130.0707 54.5604 42.4194 174.8834 44 S 5.3254 9.3116 123.2127 56.6608 64.2178 173.0005 45 V 5.0091 8.7074 126.7837 60.0801 34.4938 175.1172 46 S 4.8178 9.4757 120.8565 57.8165 63.6220 173.7529 47 D 5.0660 9.1377 126.1295 53.4444 43.0786 175.6511 48 F 5.2222 8.4549 121.2207 57.0755 42.3739 173.1467 49 D 4.6736 8.2025 125.3548 51.5518 44.4573 176.1100 50 N 4.3803 8.2046 122.4382 52.2116 38.4465 173.8605 51 A 4.5175 7.0851 120.3073 52.4689 25.4931 177.6388 52 K 4.3075 8.0624 113.0934 55.4282 34.9312 177.5125 53 G 3.5757 8.0651 106.9632 44.2251 0.0000 171.7523 54 L 4.9369 8.5532 121.6129 54.7727 42.2843 176.4305 55 N 5.0035 9.1374 122.4264 50.8351 40.1134 173.6928 56 V 4.3021 8.4879 123.7128 62.0287 32.7432 174.8164 57 K 4.2484 9.3462 130.6781 55.2966 33.5079 175.2051 58 H 4.9630 8.6938 126.3556 55.1381 28.8419 174.4007 59 Y 4.5813 8.6268 121.5809 56.8837 40.0305 174.8960 60 K 4.7263 8.7814 122.1155 55.2256 34.6879 175.6998 61 I 4.5804 9.0333 126.7632 60.0641 37.7724 175.2959 62 R 4.4748 8.5676 126.9640 55.4784 31.7046 175.7242 63 K 5.0197 8.5130 120.8987 54.7922 33.8925 175.7304 64 L 4.5583 9.0030 125.6887 53.8563 42.8289 177.4940 65 D 4.2193 8.8607 121.9191 56.0362 41.7350 176.0333 66 S 4.7454 7.5922 114.5692 57.7652 63.3192 174.0851 67 G 4.3416 6.8231 110.0742 44.2222 0.0000 176.8549 68 G 4.1957 6.1260 108.5051 44.9959 0.0000 174.4956 69 F 5.5099 9.2472 125.0046 55.5821 41.6716 173.5992 70 Y 5.1491 8.7546 120.7511 56.2371 40.8774 175.8279 71 I 4.6336 8.0024 123.7796 62.7489 37.8659 175.9743 72 T 4.8764 7.6501 111.8262 60.3124 70.5067 173.4535 73 S 4.5707 8.6681 120.3494 59.2825 61.8908 174.7603 74 R 4.4002 7.4330 116.8698 56.3393 33.3222 175.4471 75 T 4.1758 7.6338 108.0733 60.2654 70.4355 174.3628 76 Q 4.6346 7.7084 124.1684 53.8563 32.2890 174.6114 77 F 4.9984 8.9289 120.4192 55.9514 42.5402 175.7512 78 S 4.7640 8.5951 118.4146 58.7151 63.0419 174.8524 79 S 5.0114 7.6539 115.8641 56.0419 68.0303 174.9030 80 L 3.2962 8.0762 123.9292 57.6354 41.2763 179.5392 81 Q 2.8366 7.5945 118.9044 58.9970 28.6254 177.9431 82 Q 3.6744 7.8372 119.8928 59.0504 28.8628 177.9422 83 L 2.9402 7.0317 121.0042 57.7954 42.1512 179.2759 84 V 3.1064 7.1215 111.8915 64.0207 31.1996 178.3085 85 A 3.8276 7.6590 120.6990 55.4085 18.0698 179.1765 86 Y 3.8880 7.2792 117.1566 61.0315 38.9549 177.3255 87 Y 4.8986 8.3241 118.1576 59.6685 37.6423 178.0601 88 S 4.4503 7.6422 115.4178 59.5011 62.4737 174.2403 89 K 4.0398 6.8676 120.6463 57.3703 33.2245 175.4573 90 H 4.5900 7.6222 121.6227 53.8056 30.6884 174.2033 91 A 3.5848 8.3297 131.2655 53.5239 18.1423 176.6046 92 D 4.2618 7.4386 116.4207 54.0270 40.7327 174.3724 93 G 3.8104 7.1436 106.9153 46.2534 0.0000 173.8875 94 L 4.1763 6.9689 118.0766 54.6008 42.0790 177.1528 95 C 4.3769 8.6812 118.0654 61.9930 28.5993 173.7520 96 H 4.8532 7.8189 118.3004 53.9277 32.5092 172.8149 97 R 4.0368 8.1535 122.8828 55.3373 30.4702 175.9873 98 L 3.7715 8.3787 120.6535 56.2345 41.3831 177.3719 99 T 4.4747 8.8045 120.3569 64.7695 69.8707 174.3988 100 N 5.2864 8.5459 117.8830 51.0529 41.0328 173.0975 101 V 3.5480 8.1741 120.4686 61.6187 33.0356 175.0551 102 C 4.1599 8.5730 127.9039 59.2558 31.7582 171.6174 103 P 4.4728 0.0000 0.0000 62.6906 31.8578 175.4382 104 T 4.6913 8.3053 115.5031 60.6692 69.7859 173.0579 105 S 4.7001 8.0463 115.5984 57.1497 63.0592 173.3544 106 K 4.0352 7.8607 124.3829 56.6609 32.4450 174.4363 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 Q 8.34 4.07 0.00 1.89 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.24 0.00 0.00 0.00 0.00 0.00 2.16 2.27 0.00 2 A 7.85 4.26 0.70 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 0.00 0.00 3 E 8.78 3.53 0.00 1.45 1.46 0.00 0.00 0.00 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 2.06 0.00 4 E 7.88 3.18 0.00 1.86 2.03 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 2.13 2.26 0.00 5 W 7.22 4.42 0.00 3.68 3.56 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 6 Y 7.80 4.98 0.00 2.04 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 0.00 0.00 0.00 7 F 9.20 3.81 0.00 2.99 3.16 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 8 G 8.61 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 9 K 8.68 5.04 0.00 1.90 1.91 0.00 1.19 0.00 0.00 2.43 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.40 7.81 10 I 7.36 4.09 1.90 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.64 1.03 0.00 0.00 11 T 9.17 4.21 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 1.28 0.00 0.00 12 R 8.47 3.89 0.00 1.88 1.97 0.00 3.08 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.73 0.00 13 R 7.95 4.11 0.00 1.86 1.96 0.00 3.57 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.67 0.00 14 E 7.75 3.95 0.00 2.13 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 2.32 0.00 15 S 8.18 4.00 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 16 E 8.67 3.93 0.00 2.15 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 2.37 2.56 0.00 17 R 7.74 4.01 0.00 1.80 2.14 0.00 3.30 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 18 L 7.28 4.15 0.00 1.69 1.61 0.81 0.91 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 19 L 8.17 4.19 0.00 1.64 1.69 0.87 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.29 4.48 0.00 1.73 1.70 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.31 4.71 0.00 2.73 2.74 0.00 0.00 7.33 8.91 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 22 P 0.00 4.55 0.00 2.03 2.14 0.00 3.67 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 23 E 7.99 4.26 0.00 2.05 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 0.00 2.24 2.31 0.00 24 N 8.26 4.62 0.00 2.80 2.78 0.00 0.00 7.17 8.19 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 25 P 0.00 4.43 0.00 2.20 2.12 0.00 3.69 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 1.94 0.00 26 R 8.23 4.23 0.00 1.85 1.84 0.00 3.20 0.00 0.00 3.53 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.60 0.00 27 G 8.62 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 0.00 0.00 0.00 28 T 8.45 5.15 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 1.21 0.00 0.00 29 F 8.46 6.13 0.00 3.11 3.16 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 30 L 8.27 4.93 0.00 1.74 1.60 0.04 0.42 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 31 V 9.18 5.13 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 1.22 0.00 0.00 0.96 0.00 0.00 32 R 9.10 4.94 0.00 2.14 2.16 0.00 2.81 0.00 0.00 3.34 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.64 0.00 33 E 9.37 4.43 0.00 2.35 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 0.00 2.09 1.57 0.00 34 S 8.32 4.69 0.00 3.94 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.94 4.27 0.00 2.10 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 0.00 2.23 2.28 0.00 36 T 7.74 4.15 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 1.20 0.00 0.00 37 T 7.73 4.48 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 1.21 0.00 0.00 38 K 8.28 4.21 0.00 1.74 1.73 0.00 1.93 0.00 0.00 1.89 0.00 0.00 2.81 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.38 7.81 39 G 9.45 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 40 A 7.49 4.97 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 41 Y 9.09 5.03 0.00 2.93 2.93 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 42 C 9.24 5.00 0.00 3.00 2.83 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 43 L 8.77 4.80 0.00 1.77 1.66 1.03 0.92 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 44 S 9.31 5.33 0.00 3.97 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 45 V 8.71 5.01 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 0.98 0.00 0.00 1.08 0.00 0.00 46 S 9.48 4.82 0.00 3.80 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 47 D 9.14 5.07 0.00 2.92 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 48 F 8.45 5.22 0.00 2.93 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 49 D 8.20 4.67 0.00 2.41 2.34 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 50 N 8.20 4.38 0.00 2.64 2.73 0.00 0.00 6.89 7.99 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 51 A 7.09 4.52 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 52 K 8.06 4.31 0.00 1.61 1.77 0.00 1.90 0.00 0.00 1.67 0.00 0.00 2.77 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.31 7.81 53 G 8.07 3.58 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 0.00 0.00 0.00 54 L 8.55 4.94 0.00 1.62 1.75 1.14 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 55 N 9.14 5.00 0.00 2.78 2.87 0.00 0.00 6.35 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 56 V 8.49 4.30 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 0.62 0.00 0.00 0.92 0.00 0.00 57 K 9.35 4.25 0.00 1.89 1.70 0.00 1.81 0.00 0.00 1.58 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.86 1.18 7.81 58 H 8.69 4.96 0.00 3.02 3.27 0.00 5.74 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.63 4.58 0.00 3.23 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 60 K 8.78 4.73 0.00 1.71 1.74 0.00 1.72 0.00 0.00 1.84 0.00 0.00 2.83 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.42 7.81 61 I 9.03 4.58 2.06 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.78 1.01 0.00 0.00 62 R 8.57 4.47 0.00 0.72 1.59 0.00 2.61 0.00 0.00 3.06 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.35 0.00 63 K 8.51 5.02 0.00 1.81 1.70 0.00 2.21 0.00 0.00 2.02 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.07 1.72 7.81 64 L 9.00 4.56 0.00 1.61 1.52 0.59 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.86 4.22 0.00 2.62 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 66 S 7.59 4.75 0.00 3.79 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 67 G 6.82 4.34 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 0.00 68 G 6.13 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 69 F 9.25 5.51 0.00 2.98 2.87 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 70 Y 8.75 5.15 0.00 3.41 2.95 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 0.00 0.00 0.00 71 I 8.00 4.63 2.11 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 1.31 0.90 0.97 0.00 0.00 72 T 7.65 4.88 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 1.28 0.00 0.00 73 S 8.67 4.57 0.00 3.96 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 74 R 7.43 4.40 0.00 1.83 1.78 0.00 3.19 0.00 0.00 3.26 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 75 T 7.63 4.18 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 0.96 0.00 0.00 76 Q 7.71 4.63 0.00 1.72 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.52 6.24 0.00 0.00 0.00 0.00 0.00 2.00 2.12 0.00 77 F 8.93 5.00 0.00 3.01 2.95 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 0.00 0.00 0.00 78 S 8.60 4.76 0.00 3.89 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 79 S 7.65 5.01 0.00 3.85 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 80 L 8.08 3.30 0.00 1.38 1.01 -0.30 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 7.59 2.84 0.00 2.37 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.77 0.00 0.00 0.00 0.00 0.00 2.53 2.41 0.00 82 Q 7.84 3.67 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 83 L 7.03 2.94 0.00 1.51 1.36 0.76 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 84 V 7.12 3.11 1.68 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 0.33 0.00 0.00 -0.22 0.00 0.00 85 A 7.66 3.83 1.25 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 0.00 0.00 0.00 86 Y 7.28 3.89 0.00 2.82 2.77 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 87 Y 8.32 4.90 0.00 2.76 2.80 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 88 S 7.64 4.45 0.00 3.87 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 89 K 6.87 4.04 0.00 1.62 1.61 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.19 1.23 7.81 90 H 7.62 4.59 0.00 2.67 2.29 0.00 5.66 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 91 A 8.33 3.58 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 92 D 7.44 4.26 0.00 2.41 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 0.00 0.00 0.00 93 G 7.14 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 0.00 0.00 0.00 94 L 6.97 4.18 0.00 1.53 1.71 0.80 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 95 C 8.68 4.38 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 96 H 7.82 4.85 0.00 3.06 3.17 0.00 5.92 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 R 8.15 4.04 0.00 1.97 1.86 0.00 2.95 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.55 0.00 98 L 8.38 3.77 0.00 1.18 0.13 0.26 0.15 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 99 T 8.80 4.47 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 1.29 0.00 0.00 100 N 8.55 5.29 0.00 2.77 2.92 0.00 0.00 6.73 7.07 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 0.00 101 V 8.17 3.55 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 0.63 0.00 0.00 0.75 0.00 0.00 102 C 8.57 4.16 0.00 2.84 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 0.00 103 P 0.00 4.47 0.00 2.24 2.05 0.00 3.77 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 1.99 1.95 0.00 104 T 8.31 4.69 4.55 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 1.20 0.00 0.00 105 S 8.05 4.70 0.00 3.81 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 0.00 106 K 7.86 4.04 0.00 1.73 1.59 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.31 1.36 7.81