NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.5573 8.1749 117.3741 63.6968 70.1542 172.8862 2 T 4.6810 9.6166 122.3012 60.2490 72.3681 171.5280 3 T 5.2389 8.3995 115.9081 60.1134 72.5969 172.5201 4 L 4.9890 9.0242 123.2687 54.7616 44.8214 174.8134 5 A 5.5857 8.5082 118.5524 52.0489 22.0007 175.7439 6 F 5.0462 8.1059 116.7696 55.0982 41.9205 173.4431 7 R 5.1221 8.7923 120.9309 55.4255 31.6018 175.0993 8 F 4.9415 9.3963 119.7345 55.6345 41.2618 174.5302 9 Q 3.7165 9.0698 121.4835 59.4190 28.3981 177.8535 10 G 3.5527 5.7634 102.7585 45.2163 0.0000 172.4632 11 G 4.0543 6.2782 107.6468 43.9819 0.0000 176.4335 12 I 5.1795 8.4711 123.8639 59.2425 40.9194 173.2158 13 I 4.3125 7.9542 126.4231 59.3417 39.5892 174.7440 14 V 4.8726 8.2966 125.6413 61.0089 33.9659 174.3494 15 A 4.8666 8.8165 128.8186 50.3932 22.2828 175.0463 16 V 4.9687 8.2700 113.4920 60.1126 36.2852 175.0849 17 D 4.9138 8.2373 122.3329 52.9021 41.8353 177.1726 18 S 4.7484 8.2076 113.6549 58.5837 63.8097 173.2238 19 R 5.0012 8.7857 120.5941 55.9393 31.7059 175.2351 20 A 4.8450 8.9611 126.4647 50.4105 22.3746 175.0851 21 T 4.8586 8.6203 111.6009 59.8817 72.1665 174.0300 22 A 4.5480 9.6800 126.9673 49.8778 19.7604 178.0759 23 G 4.0332 8.9137 114.6986 46.6619 0.0000 173.2104 24 N 4.7427 9.0570 121.9826 52.4335 39.5611 174.1176 25 W 4.4857 7.9121 130.4988 56.3214 31.3778 175.2805 26 V 3.8410 7.5252 125.8151 61.4855 30.4859 175.2782 27 A 3.8788 8.3287 132.0829 54.7386 18.6236 177.4982 28 S 4.5421 7.3992 107.8439 57.4187 65.2443 174.0289 29 Q 4.7270 8.5856 122.7891 55.8360 29.6539 175.7389 30 T 4.6933 7.7527 108.7870 61.2123 68.7193 174.3982 31 V 3.9501 7.7828 121.7749 63.5075 32.8213 175.8284 32 K 4.3059 8.5942 127.0060 55.2823 32.2406 175.9102 33 K 4.4256 8.5090 124.1358 56.0461 33.5107 176.3480 34 V 4.6481 7.6114 120.5302 61.0799 33.3103 174.8482 35 I 3.9965 9.0617 130.6411 60.9572 38.2598 176.1528 36 E 4.6188 8.7699 127.7993 54.5010 28.1868 175.8866 37 I 3.8205 8.0585 123.7613 63.1858 37.6766 175.6299 38 N 4.4881 7.8886 114.5706 51.4832 39.9201 173.3135 39 P 4.1144 0.0000 0.0000 64.7685 31.3129 177.1880 40 F 4.7955 9.7912 115.1811 56.6991 41.0891 175.1193 41 L 5.2086 8.2190 120.7313 52.7915 44.8386 175.6240 42 L 5.1048 8.9942 121.7467 52.9939 46.0047 175.8031 43 G 5.0191 9.3264 108.1426 43.3326 0.0000 171.6851 44 T 5.1204 8.1015 111.9662 60.1593 71.2853 173.6899 45 M 4.6982 8.7758 123.4702 54.0200 33.7140 174.9663 46 A 4.6425 8.5377 127.4196 50.8508 23.3480 173.9407 47 G 4.2798 9.3577 107.8113 44.2447 0.0000 176.9404 48 G 3.8300 9.8057 118.7177 43.9922 0.0000 173.5150 49 A 3.9651 8.8917 127.6172 55.3705 18.3897 178.9292 50 A 3.9459 7.9891 118.0432 55.5058 18.5042 179.0879 51 D 4.4517 8.2097 116.6982 57.9978 40.8703 179.0584 52 C 4.2326 8.4135 116.9076 62.9431 28.2127 175.6776 53 Q 3.9928 8.4511 121.5338 59.3631 28.5600 178.4676 54 F 3.8106 8.7875 121.5572 61.2518 39.4863 177.3288 55 W 4.5652 8.3643 118.3382 59.4733 28.7183 178.2315 56 E 4.3078 8.7179 118.6939 58.9563 29.1767 179.1355 57 T 3.9078 7.8016 115.9080 66.2027 68.5364 176.4993 58 W 4.0420 8.2127 130.3829 60.2811 30.6159 177.5289 59 L 3.7481 8.4037 120.5638 58.1222 41.4957 179.0279 60 G 3.6913 7.8842 105.3909 48.2148 0.0000 175.6925 61 S 4.0660 7.6718 117.2330 61.3414 62.8685 176.9308 62 Q 3.7653 7.5442 120.6674 58.8768 28.2903 178.5493 63 C 4.1034 8.1494 118.1365 62.6569 28.2673 176.0458 64 R 3.8846 8.0629 120.3851 59.4188 29.7326 178.5994 65 L 3.9946 7.8696 118.8438 57.7659 41.4876 178.9987 66 H 4.0496 8.0045 118.0579 59.4752 29.7689 177.3249 67 E 4.1200 8.1763 120.2185 59.2831 28.9653 179.4079 68 L 4.0215 7.6060 118.3265 57.3557 41.7385 179.2192 69 R 4.0103 7.5864 117.7616 59.2430 30.2849 177.6124 70 E 4.2496 8.3896 114.9324 55.0093 30.5124 176.3545 71 K 3.9059 7.6704 118.1901 56.2899 30.3013 174.7603 72 E 4.5188 7.6724 114.1090 54.9354 32.8221 174.6199 73 R 3.9204 8.7387 125.9205 56.8782 30.4415 175.6929 74 I 3.8723 8.4526 125.4257 60.5518 38.8126 176.2769 75 S 4.4426 8.2124 121.2057 57.9310 65.3790 175.5995 76 V 3.5534 8.2878 122.0019 65.8579 31.2989 178.1877 77 A 3.9613 7.9756 120.0291 55.2677 18.3287 179.3804 78 A 3.9367 8.0056 119.0171 54.9889 18.2827 179.7165 79 A 3.8972 8.2180 119.8080 55.3286 18.4085 180.0245 80 S 4.1080 8.1774 112.8508 61.5796 63.0320 176.6465 81 K 3.9764 8.1683 123.0521 58.7216 31.8404 179.0663 82 I 3.7758 7.7528 120.5883 64.2830 37.0703 178.0042 83 L 4.2130 7.8086 121.2777 58.2206 41.9565 178.8989 84 S 4.1187 8.4477 113.3812 61.6433 62.1567 175.9725 85 N 4.4310 8.4154 118.3078 55.9859 38.5080 177.0303 86 L 3.9796 8.0182 121.8770 58.1610 42.2476 178.9055 87 V 3.3796 7.7053 118.1548 66.4411 31.3630 177.3845 88 Y 4.1047 8.2240 118.8453 60.7433 38.3433 178.0412 89 Q 3.9083 7.9242 118.3392 58.3227 28.9817 177.2301 90 Y 4.3426 7.6472 115.9205 56.1212 38.1347 175.0909 91 K 3.7963 6.9177 121.9699 58.4336 32.4128 176.5861 92 G 3.9417 9.0144 114.4584 45.4156 0.0000 173.9288 93 A 4.0756 7.9896 121.5545 53.0103 18.6411 178.2224 94 G 4.1176 8.3731 102.6769 44.8885 0.0000 174.2145 95 L 4.1507 7.6534 119.1198 55.0003 42.1446 176.6710 96 S 4.6775 9.6658 116.2896 57.2956 65.2202 172.5568 97 M 5.0886 8.4962 122.7821 54.2831 33.6339 174.2464 98 G 4.2015 9.2283 109.6276 44.8027 0.0000 171.5405 99 T 5.0802 8.5478 119.0813 60.7322 71.3559 172.4409 100 M 4.6634 9.2304 126.1518 53.7084 34.5032 174.9234 101 I 4.7053 8.4680 125.0173 60.0965 38.8291 174.7633 102 C 4.8881 9.0714 125.9510 57.9381 30.8296 173.7004 103 G 4.5147 8.4194 108.8859 45.7264 0.0000 172.0937 104 Y 4.7628 8.6253 120.3070 56.1304 40.1568 174.9799 105 T 4.2478 8.6715 116.3677 61.6510 69.0359 174.3349 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 T 8.17 4.56 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 1.22 0.00 0.00 2 T 9.62 4.68 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 1.22 0.00 0.00 3 T 8.40 5.24 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 1.23 0.00 0.00 4 L 9.02 4.99 0.00 1.72 1.80 1.02 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 5 A 8.51 5.59 1.21 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 0.00 0.00 6 F 8.11 5.05 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 7 R 8.79 5.12 0.00 1.91 1.92 0.00 3.20 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 8 F 9.40 4.94 0.00 3.36 3.27 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 9 Q 9.07 3.72 0.00 2.02 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.33 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 10 G 5.76 3.55 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 0.00 0.00 0.00 11 G 6.28 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 0.00 0.00 0.00 12 I 8.47 5.18 1.88 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 1.31 0.62 0.91 0.00 0.00 13 I 7.95 4.31 0.56 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.63 0.72 0.00 0.00 14 V 8.30 4.87 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 0.85 0.00 0.00 0.90 0.00 0.00 15 A 8.82 4.87 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 16 V 8.27 4.97 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 0.77 0.00 0.00 0.93 0.00 0.00 17 D 8.24 4.91 0.00 2.78 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 18 S 8.21 4.75 0.00 4.08 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 19 R 8.79 5.00 0.00 1.86 1.96 0.00 3.16 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.48 0.00 20 A 8.96 4.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.62 4.86 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 1.11 0.00 0.00 22 A 9.68 4.55 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 23 G 8.91 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 24 N 9.06 4.74 0.00 2.79 2.91 0.00 0.00 6.70 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 25 W 7.91 4.49 0.00 3.36 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 26 V 7.53 3.84 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 0.66 0.00 0.00 0.77 0.00 0.00 27 A 8.33 3.88 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 28 S 7.40 4.54 0.00 3.78 3.60 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 29 Q 8.59 4.73 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.29 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 30 T 7.75 4.69 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 1.19 0.00 0.00 31 V 7.78 3.95 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 0.76 0.00 0.00 0.95 0.00 0.00 32 K 8.59 4.31 0.00 1.66 1.77 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.52 7.81 33 K 8.51 4.43 0.00 1.71 1.82 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.76 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.43 7.81 34 V 7.61 4.65 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 0.83 0.00 0.00 0.94 0.00 0.00 35 I 9.06 4.00 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.82 0.94 0.00 0.00 36 E 8.77 4.62 0.00 1.95 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 2.27 2.32 0.00 37 I 8.06 3.82 2.02 0.00 0.00 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 1.50 0.77 0.93 0.00 0.00 38 N 7.89 4.49 0.00 2.89 2.91 0.00 0.00 7.06 7.84 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 39 P 0.00 4.11 0.00 1.60 1.83 0.00 3.68 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 1.99 2.05 0.00 40 F 9.79 4.80 0.00 2.93 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 41 L 8.22 5.21 0.00 1.64 1.57 0.94 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.99 5.10 0.00 1.57 1.52 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 43 G 9.33 5.02 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 0.00 0.00 0.00 44 T 8.10 5.12 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 1.23 0.00 0.00 45 M 8.78 4.70 0.00 2.03 2.03 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 2.55 2.49 0.00 46 A 8.54 4.64 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 47 G 9.36 4.28 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 0.00 48 G 9.81 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 49 A 8.89 3.97 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 50 A 7.99 3.95 1.29 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 0.00 0.00 51 D 8.21 4.45 0.00 2.97 2.90 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 52 C 8.41 4.23 0.00 3.02 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 53 Q 8.45 3.99 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 54 F 8.79 3.81 0.00 3.01 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 55 W 8.36 4.57 0.00 3.72 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 56 E 8.72 4.31 0.00 2.33 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 0.00 2.44 2.51 0.00 57 T 7.80 3.91 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 1.13 0.00 0.00 58 W 8.21 4.04 0.00 3.06 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 59 L 8.40 3.75 0.00 2.16 1.91 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 60 G 7.88 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.67 4.07 0.00 3.83 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 62 Q 7.54 3.77 0.00 1.71 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 63 C 8.15 4.10 0.00 3.07 2.94 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 64 R 8.06 3.88 0.00 1.90 2.04 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 65 L 7.87 3.99 0.00 1.92 1.66 0.90 1.01 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 66 H 8.00 4.05 0.00 3.24 3.48 0.00 5.78 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 67 E 8.18 4.12 0.00 2.18 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 2.56 2.55 0.00 68 L 7.61 4.02 0.00 1.78 1.70 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 69 R 7.59 4.01 0.00 2.00 1.86 0.00 3.28 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 70 E 8.39 4.25 0.00 1.73 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 2.12 2.24 0.00 71 K 7.67 3.91 0.00 1.73 1.80 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.33 7.81 72 E 7.67 4.52 0.00 1.86 1.81 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 2.10 2.18 0.00 73 R 8.74 3.92 0.00 1.57 1.69 0.00 2.36 0.00 0.00 2.78 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.41 0.00 74 I 8.45 3.87 1.74 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.55 0.89 0.00 0.00 75 S 8.21 4.44 0.00 4.08 3.95 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 76 V 8.29 3.55 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 1.05 0.00 0.00 0.99 0.00 0.00 77 A 7.98 3.96 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 78 A 8.01 3.94 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 79 A 8.22 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.18 4.11 0.00 4.10 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 0.00 81 K 8.17 3.98 0.00 2.03 1.85 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.47 7.81 82 I 7.75 3.78 2.08 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.59 0.96 0.00 0.00 83 L 7.81 4.21 0.00 1.87 1.93 1.14 1.08 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 84 S 8.45 4.12 0.00 4.03 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 85 N 8.42 4.43 0.00 2.86 2.92 0.00 0.00 7.05 7.43 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 86 L 8.02 3.98 0.00 1.83 1.71 -0.85 0.48 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 87 V 7.71 3.38 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 0.96 0.00 0.00 0.79 0.00 0.00 88 Y 8.22 4.10 0.00 3.12 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 89 Q 7.92 3.91 0.00 2.05 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.67 0.00 0.00 0.00 0.00 0.00 2.61 2.46 0.00 90 Y 7.65 4.34 0.00 2.99 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 91 K 6.92 3.80 0.00 1.50 1.41 0.00 1.76 0.00 0.00 1.46 0.00 0.00 3.13 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.37 7.81 92 G 9.01 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 0.00 0.00 0.00 93 A 7.99 4.08 1.45 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 0.00 0.00 94 G 8.37 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 0.00 0.00 0.00 0.00 95 L 7.65 4.15 0.00 1.61 1.59 0.54 0.73 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 96 S 9.67 4.68 0.00 3.80 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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 8.50 5.09 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.56 0.00 98 G 9.23 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 99 T 8.55 5.08 4.30 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 1.27 0.00 0.00 100 M 9.23 4.66 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.55 0.00 101 I 8.47 4.71 1.90 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 1.39 0.87 0.94 0.00 0.00 102 C 9.07 4.89 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 0.00 103 G 8.42 4.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 Y 8.63 4.76 0.00 2.90 2.75 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 0.00 105 T 8.67 4.25 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 1.21 0.00 0.00