NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5243 8.2048 119.7503 54.9318 33.3854 174.8777 2 K 4.0494 8.4311 124.2184 55.8222 32.9351 175.7552 3 F 4.7480 8.9699 122.6726 55.8684 41.7064 176.6452 4 V 3.6670 9.4642 125.4477 66.4849 31.3086 177.7479 5 Y 4.1029 8.9885 119.3952 60.7245 38.4005 178.3417 6 K 4.1433 8.2012 118.7492 59.2747 32.2412 178.8946 7 E 4.1308 8.2653 118.1231 58.8546 29.5904 178.2045 8 E 4.3825 8.0472 115.2376 55.8640 30.4397 175.6219 9 H 4.7202 7.2118 116.7869 52.7881 31.2848 172.5801 10 P 4.4519 0.0000 0.0000 61.9612 33.1835 176.8226 11 F 4.0427 8.9982 123.3377 61.9563 39.2079 177.5005 12 E 3.9622 8.3634 117.9664 59.0395 29.5051 178.5180 13 K 4.0857 7.8614 120.7678 58.7951 32.2872 178.9536 14 R 4.0070 7.9727 118.4812 59.1411 29.9598 178.9122 15 R 4.1312 8.1389 120.4535 58.9003 29.5283 178.6056 16 S 4.1443 8.1168 114.0247 61.5316 62.8565 176.1665 17 E 4.1025 8.3889 122.9449 58.8967 29.4739 178.9947 18 G 3.4053 8.5770 106.0562 47.7915 0.0000 175.4436 19 E 3.7069 8.4491 121.3292 58.9368 29.3926 179.4530 20 K 3.8710 7.8806 119.0910 59.5203 32.2005 179.0074 21 I 3.7075 7.7764 120.1240 64.4434 37.1370 178.6939 22 R 3.8810 7.9427 119.1712 58.6007 29.5729 179.2369 23 K 3.9486 7.5974 118.2920 59.7687 32.8445 178.9918 24 K 3.8144 7.7999 120.1184 57.8415 33.5979 176.6254 25 Y 4.9276 7.9580 116.0486 55.4571 38.1860 174.2831 26 P 4.4934 0.0000 0.0000 64.3069 32.1379 177.6142 27 D 4.7545 8.0396 118.1335 54.0046 41.1425 175.3332 28 R 5.0600 7.9965 118.4994 54.2687 33.2241 175.4428 29 V 3.9887 8.6485 121.7253 60.2681 34.4858 172.5608 30 P 4.9575 0.0000 0.0000 62.1530 32.8624 175.0264 31 V 4.9638 9.1602 124.1274 60.9658 35.2158 173.8930 32 I 4.7866 8.4993 127.7544 59.4565 39.4857 174.5564 33 V 5.1490 8.8696 127.3764 61.3003 33.5406 174.5709 34 E 4.9727 9.4334 126.0431 54.4661 34.3310 174.3839 35 K 3.4896 8.3868 123.1513 55.0433 33.4260 176.3684 36 A 3.8144 8.4345 129.3950 51.9007 18.7148 176.7606 37 P 4.1106 0.0000 0.0000 65.4984 31.5628 177.8663 38 K 4.1183 7.8304 114.5224 57.2098 32.5303 177.0470 39 A 4.2464 7.6257 123.2307 52.4896 18.6612 177.8003 40 R 4.5242 8.4432 123.5029 56.5885 30.7069 175.4617 41 I 4.7051 7.4465 110.5948 58.2409 40.9328 174.7767 42 G 3.7721 8.6469 108.6770 46.2987 0.0000 172.6469 43 D 4.9069 8.4261 121.6969 52.6622 42.8750 175.4077 44 L 4.5978 8.3057 122.9467 53.3778 42.5964 176.5785 45 D 4.4087 8.5408 123.6824 55.0432 39.8912 175.6179 46 K 4.5187 7.7510 121.8024 53.4656 34.0130 176.1516 47 K 4.7294 8.5669 124.1595 57.3408 34.7828 175.5515 48 K 4.9579 7.8233 122.1485 54.8170 33.8111 174.9660 49 Y 4.6292 9.1575 124.6724 56.0679 41.9583 174.4808 50 L 4.9446 8.7136 125.5470 53.7638 43.0895 175.5651 51 V 4.4907 8.3699 119.8095 58.4786 35.0974 173.7977 52 P 4.7470 0.0000 0.0000 62.4988 31.7994 178.0168 53 S 4.0451 9.0165 119.4537 60.9929 62.9202 175.4786 54 D 4.6610 7.8170 117.6023 52.8985 40.0833 176.2739 55 L 4.1794 7.6697 124.1582 55.5231 42.7541 176.3441 56 T 4.7716 9.0460 116.7846 60.9436 71.3436 176.2019 57 V 3.8255 8.6498 122.3531 66.2649 31.5740 178.6703 58 G 3.8402 8.5025 105.7194 48.0591 0.0000 175.6719 59 Q 4.1234 8.3904 120.5179 58.7192 28.6860 178.6831 60 F 4.3823 8.7172 121.9057 61.4595 39.4160 176.4635 61 Y 4.0128 8.6394 116.9587 61.3172 37.7040 178.7768 62 F 4.1613 8.3733 121.1644 61.1771 39.4889 177.1290 63 L 3.9122 8.1699 118.5946 57.9933 41.4897 179.6838 64 I 3.4791 7.7064 120.0047 64.1215 36.8546 178.6097 65 R 3.7448 8.2004 119.3949 59.2531 29.9792 179.0892 66 K 3.7559 7.6568 119.0903 59.2548 31.8469 179.1553 67 R 4.0695 7.7224 118.2565 58.1943 29.9702 177.8929 68 I 4.0796 7.3253 110.2675 59.8583 38.6612 175.2322 69 H 4.0728 7.6836 113.7703 57.8200 26.2995 174.7659 70 L 4.6975 8.0271 117.6306 53.0226 44.6704 177.3769 71 R 4.3856 8.6012 121.3577 54.0975 32.1924 177.0714 72 A 3.8819 8.5506 121.3761 55.5648 18.0835 178.4671 73 E 4.1919 8.0458 110.5801 57.1278 30.2279 175.9916 74 D 4.8127 7.8039 120.3646 52.2916 42.7326 175.9944 75 A 3.9264 8.3035 125.3596 52.0175 19.1903 176.8033 76 L 4.5179 7.0817 122.8232 53.9998 45.3281 174.4105 77 F 5.1183 9.4507 124.6959 55.8346 43.3148 173.8293 78 F 5.6664 9.2545 122.0663 56.7111 40.8810 174.8409 79 F 5.2187 10.1798 121.9834 55.6851 42.6369 174.0961 80 V 4.5179 8.8382 123.6238 61.0729 34.0434 175.3174 81 N 4.2874 9.7210 127.4357 54.8702 36.0289 174.3579 82 N 4.5146 8.5381 109.0035 54.0110 36.8815 174.3382 83 V 4.3865 7.9973 118.6038 61.0372 33.3865 174.7028 84 I 4.7968 8.3935 127.3726 58.5873 37.5621 173.9645 85 P 4.6363 0.0000 0.0000 61.2291 32.5900 174.4172 86 P 4.5646 0.0000 0.0000 62.6865 32.1239 177.6508 87 T 4.2011 8.5415 110.3293 64.4313 68.9219 176.0315 88 S 4.2714 8.0328 114.8257 59.3007 63.8937 174.3123 89 A 4.3784 7.9099 125.5580 52.2059 19.0387 176.9805 90 T 4.7861 8.2584 111.2453 61.1477 71.7079 176.3571 91 M 4.2106 8.9314 122.3579 58.1986 31.8650 179.4979 92 G 3.6123 8.3292 106.5502 47.7708 0.0000 175.9101 93 Q 4.0502 8.2747 120.4716 58.5865 28.7311 178.4931 94 L 4.0066 8.0717 121.4073 58.2683 42.1592 178.3101 95 Y 3.9994 8.4351 119.8513 60.9704 38.5187 178.2189 96 Q 4.1444 8.2184 117.6792 59.0282 28.8953 178.0995 97 E 4.1151 8.1338 119.3946 58.5201 29.7377 176.8115 98 H 4.9149 7.9022 112.0268 54.8887 30.9624 173.2370 99 H 4.2198 7.8437 115.7127 55.5912 28.7953 175.2122 100 E 4.3656 8.7662 121.5698 55.4887 30.6097 177.0720 101 E 3.9586 8.5607 117.7326 57.6700 29.6311 177.2995 102 D 4.3258 8.1772 118.6080 52.7710 39.7348 177.0110 103 F 4.0166 7.5034 116.3396 58.6981 37.1888 174.5994 104 F 4.8806 8.5953 119.2823 55.8169 41.9178 174.2749 105 L 4.8294 8.5806 123.3394 53.8413 43.9390 174.5635 106 Y 4.7610 8.6098 123.6218 56.2358 39.9592 174.9439 107 I 4.8932 8.9846 125.3156 59.4964 40.2268 174.4943 108 A 5.6248 9.4650 129.2205 50.4441 21.7796 174.9809 109 Y 5.8147 8.7308 118.2739 55.8238 41.7434 174.4484 110 S 5.1291 9.7009 115.3998 57.9669 66.6531 173.7703 111 D 5.0114 9.0168 119.3343 53.1051 39.9860 175.9461 112 E 4.8661 8.3218 120.1165 54.8316 31.9022 175.8156 113 S 4.4334 8.1594 116.0428 58.8382 64.7193 175.9141 114 V 3.5690 7.4132 119.9286 63.5526 31.5533 175.7964 115 Y 4.9066 7.2634 116.7096 55.6202 39.6919 175.7163 116 G 3.6995 8.6074 112.4114 45.5890 0.0000 173.5938 117 L 4.1295 9.0557 120.8512 54.5223 41.8107 176.6378 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 8.20 4.52 0.00 1.87 2.01 0.00 0.00 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.22 0.00 2 K 8.43 4.05 0.00 1.83 1.74 0.00 1.82 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.46 7.81 3 F 8.97 4.75 0.00 3.18 3.22 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 4 V 9.46 3.67 2.42 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 1.06 0.00 0.00 0.99 0.00 0.00 5 Y 8.99 4.10 0.00 3.43 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 6 K 8.20 4.14 0.00 1.99 1.89 0.00 0.61 0.00 0.00 1.40 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.47 1.57 7.81 7 E 8.27 4.13 0.00 2.13 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 2.34 2.61 0.00 8 E 8.05 4.38 0.00 2.00 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 2.45 2.05 0.00 9 H 7.21 4.72 0.00 2.78 3.01 0.00 5.86 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.45 0.00 2.19 2.00 0.00 3.62 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 2.11 2.13 0.00 11 F 9.00 4.04 0.00 3.15 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 12 E 8.36 3.96 0.00 2.28 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 2.43 2.46 0.00 13 K 7.86 4.09 0.00 1.92 1.87 0.00 1.72 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.47 7.81 14 R 7.97 4.01 0.00 1.94 2.14 0.00 3.30 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.77 0.00 15 R 8.14 4.13 0.00 0.93 1.80 0.00 3.33 0.00 0.00 3.59 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.49 0.00 16 S 8.12 4.14 0.00 4.12 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 17 E 8.39 4.10 0.00 2.23 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 2.48 2.44 0.00 18 G 8.58 3.41 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 0.00 19 E 8.45 3.71 0.00 2.13 1.92 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 1.85 2.72 0.00 20 K 7.88 3.87 0.00 1.81 2.01 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.41 7.81 21 I 7.78 3.71 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.69 0.91 0.00 0.00 22 R 7.94 3.88 0.00 1.64 1.75 0.00 3.05 0.00 0.00 2.55 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 23 K 7.60 3.95 0.00 1.79 2.00 0.00 1.51 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.29 7.81 24 K 7.80 3.81 0.00 1.38 1.03 0.00 1.25 0.00 0.00 1.40 0.00 0.00 2.81 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.30 0.87 7.81 25 Y 7.96 4.93 0.00 2.99 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 26 P 0.00 4.49 0.00 2.12 2.11 0.00 3.42 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.90 0.00 27 D 8.04 4.75 0.00 2.69 2.66 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 0.00 0.00 0.00 0.00 28 R 8.00 5.06 0.00 1.68 1.69 0.00 3.12 0.00 0.00 3.11 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 29 V 8.65 3.99 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 1.02 0.00 0.00 0.71 0.00 0.00 30 P 0.00 4.96 0.00 1.46 1.86 0.00 3.25 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.50 0.00 31 V 9.16 4.96 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 0.98 0.00 0.00 0.75 0.00 0.00 32 I 8.50 4.79 1.03 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 -0.21 0.83 0.00 0.00 33 V 8.87 5.15 2.27 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 0.88 0.00 0.00 0.91 0.00 0.00 34 E 9.43 4.97 0.00 1.72 1.66 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 0.00 2.39 2.61 0.00 35 K 8.39 3.49 0.00 1.22 1.43 0.00 1.86 0.00 0.00 1.90 0.00 0.00 2.75 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.09 0.72 7.81 36 A 8.43 3.81 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 37 P 0.00 4.11 0.00 1.99 2.07 0.00 3.56 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.01 0.00 38 K 7.83 4.12 0.00 1.72 1.84 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.39 7.81 39 A 7.63 4.25 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 40 R 8.44 4.52 0.00 1.84 1.97 0.00 3.32 0.00 0.00 3.39 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 41 I 7.45 4.71 1.97 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.88 0.98 0.00 0.00 42 G 8.65 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 43 D 8.43 4.91 0.00 2.69 2.62 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 44 L 8.31 4.60 0.00 1.91 1.74 1.09 1.08 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 45 D 8.54 4.41 0.00 2.78 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 46 K 7.75 4.52 0.00 1.45 1.67 0.00 1.58 0.00 0.00 1.47 0.00 0.00 2.82 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.30 0.96 7.81 47 K 8.57 4.73 0.00 2.24 2.16 0.00 1.83 0.00 0.00 1.99 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.38 7.81 48 K 7.82 4.96 0.00 1.59 1.63 0.00 1.93 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.47 7.81 49 Y 9.16 4.63 0.00 3.00 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 50 L 8.71 4.94 0.00 1.56 1.51 0.84 0.74 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 51 V 8.37 4.49 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 0.58 0.00 0.00 0.69 0.00 0.00 52 P 0.00 4.75 0.00 2.08 1.97 0.00 3.59 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.05 0.00 53 S 9.02 4.05 0.00 3.94 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 54 D 7.82 4.66 0.00 2.79 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 55 L 7.67 4.18 0.00 1.81 1.64 1.06 0.86 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 56 T 9.05 4.77 4.44 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 57 V 8.65 3.83 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 1.33 0.00 0.00 1.06 0.00 0.00 58 G 8.50 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 0.00 0.00 0.00 59 Q 8.39 4.12 0.00 2.38 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 60 F 8.72 4.38 0.00 3.03 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 61 Y 8.64 4.01 0.00 3.27 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 62 F 8.37 4.16 0.00 3.10 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 63 L 8.17 3.91 0.00 1.77 1.68 1.11 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 64 I 7.71 3.48 1.68 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.27 0.55 0.00 0.00 65 R 8.20 3.74 0.00 1.71 1.99 0.00 3.03 0.00 0.00 2.96 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.64 0.00 66 K 7.66 3.76 0.00 1.33 1.68 0.00 1.28 0.00 0.00 1.33 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.31 1.32 7.81 67 R 7.72 4.07 0.00 1.89 1.95 0.00 3.35 0.00 0.00 3.38 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 68 I 7.33 4.08 1.84 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.50 0.88 0.00 0.00 69 H 7.68 4.07 0.00 3.35 3.35 0.00 5.61 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 8.03 4.70 0.00 1.48 1.45 0.88 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.60 4.39 0.00 1.96 1.90 0.00 3.22 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.51 0.00 72 A 8.55 3.88 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 73 E 8.05 4.19 0.00 2.06 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 2.24 2.25 0.00 74 D 7.80 4.81 0.00 2.67 2.57 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 75 A 8.30 3.93 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 76 L 7.08 4.52 0.00 1.44 1.20 1.08 0.51 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 77 F 9.45 5.12 0.00 3.17 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 78 F 9.25 5.67 0.00 2.76 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 79 F 10.18 5.22 0.00 3.24 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 80 V 8.84 4.52 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 1.09 0.00 0.00 0.98 0.00 0.00 81 N 9.72 4.29 0.00 2.81 2.87 0.00 0.00 7.19 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 82 N 8.54 4.51 0.00 2.95 3.02 0.00 0.00 6.97 7.68 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 83 V 8.00 4.39 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 1.13 0.00 0.00 1.02 0.00 0.00 84 I 8.39 4.80 1.77 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 1.28 0.96 0.00 0.00 85 P 0.00 4.64 0.00 2.27 2.12 0.00 3.98 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.05 0.00 86 P 0.00 4.56 0.00 2.29 2.26 0.00 3.77 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.00 0.00 87 T 8.54 4.20 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 1.24 0.00 0.00 88 S 8.03 4.27 0.00 4.03 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 89 A 7.91 4.38 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 90 T 8.26 4.79 4.45 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 1.22 0.00 0.00 91 M 8.93 4.21 0.00 1.85 2.04 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.77 0.00 92 G 8.33 3.61 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 0.00 93 Q 8.27 4.05 0.00 2.28 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 94 L 8.07 4.01 0.00 1.94 1.89 1.04 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 95 Y 8.44 4.00 0.00 3.07 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 96 Q 8.22 4.14 0.00 2.27 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.79 0.00 0.00 0.00 0.00 0.00 2.58 2.77 0.00 97 E 8.13 4.12 0.00 1.91 1.96 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 1.57 2.14 0.00 98 H 7.90 4.91 0.00 3.30 3.20 0.00 5.72 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 H 7.84 4.22 0.00 2.67 2.15 0.00 5.74 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 0.00 100 E 8.77 4.37 0.00 2.44 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 2.31 2.43 0.00 101 E 8.56 3.96 0.00 2.07 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 2.26 2.19 0.00 102 D 8.18 4.33 0.00 2.75 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 0.00 103 F 7.50 4.02 0.00 3.30 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 0.00 104 F 8.60 4.88 0.00 3.15 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.58 4.83 0.00 1.91 1.69 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 8.61 4.76 0.00 2.60 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 0.00 0.00 0.00 107 I 8.98 4.89 1.81 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.00 0.51 0.00 0.00 108 A 9.47 5.62 1.35 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 0.00 109 Y 8.73 5.81 0.00 3.47 3.33 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 0.00 110 S 9.70 5.13 0.00 3.98 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 0.00 111 D 9.02 5.01 0.00 2.93 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 0.00 112 E 8.32 4.87 0.00 2.08 1.91 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 2.31 2.31 0.00 113 S 8.16 4.43 0.00 3.21 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 0.00 114 V 7.41 3.57 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 -0.87 0.00 0.00 0.65 0.00 0.00 115 Y 7.26 4.91 0.00 2.96 2.73 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 0.00 116 G 8.61 3.70 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 0.00 117 L 9.06 4.13 0.00 1.48 1.38 0.64 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00