NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 D 4.4516 8.3531 120.5307 50.2882 42.8291 176.7457 5 G 3.9118 9.9961 107.2018 45.8995 0.0000 170.5888 6 G 4.1645 8.9088 106.8920 45.3735 0.0000 171.0831 7 Q 4.9833 8.7115 118.3113 55.6744 29.7861 176.8823 8 I 4.4599 8.5215 122.1788 59.6851 40.1802 173.9249 9 K 5.0105 9.0691 129.7789 54.3670 34.4174 175.6835 10 G 3.2611 9.2898 115.7934 45.9232 0.0000 174.6646 11 V 3.5585 8.2805 126.2919 65.8784 31.7955 177.7400 12 G 3.6023 7.6948 107.7593 47.9211 0.0000 174.5905 13 S 4.2054 7.8503 113.1269 57.9085 63.9294 175.1313 14 G 3.8720 8.1468 107.4213 45.8890 0.0000 173.0128 15 R 4.7893 7.8032 117.9499 54.3579 33.7960 174.3770 16 C 5.3882 9.0370 118.6565 55.2140 42.5238 173.1319 17 L 4.6436 8.9042 124.9471 55.5124 42.8197 175.3792 18 D 5.2284 9.1837 125.6394 52.6663 45.3011 174.1240 19 V 4.3234 8.6399 126.3819 61.2873 32.8728 173.6492 20 P 4.2200 0.0000 0.0000 64.4431 31.5737 176.2763 21 D 4.0639 9.0571 120.5144 54.5411 38.3223 173.2065 22 A 3.9558 7.8057 118.3320 51.7919 16.7129 178.6248 23 S 4.2322 7.8729 112.9813 60.3246 62.9616 173.7737 24 T 4.5090 8.1597 114.5263 61.3465 68.9950 173.7382 25 S 4.3766 7.9878 119.7653 57.8679 63.7872 173.6334 26 D 4.3675 8.4630 125.2585 56.3009 40.8946 177.6496 27 G 4.7268 9.1886 112.0406 45.0344 0.0000 173.5170 28 T 4.1685 7.7071 118.2564 63.2038 69.3200 173.9558 29 Q 4.6887 8.7454 128.5670 55.9690 30.1743 175.7507 30 L 4.5829 8.8530 126.1277 54.9352 43.6001 175.6064 31 Q 5.2448 8.8443 118.1299 54.8120 32.9824 173.5860 32 L 5.0722 9.0141 119.5077 54.2150 43.3667 176.1440 33 W 5.3664 9.1941 130.9944 55.7388 34.7745 173.2811 34 D 4.6470 8.1104 124.4718 55.1488 40.8203 176.5895 35 C 4.5095 8.8733 120.8848 57.4449 40.9233 172.5795 36 H 4.7169 8.1699 117.7422 55.4020 30.4323 173.2501 37 S 4.6195 8.6965 113.1784 58.1574 63.3849 174.5323 38 G 3.8499 8.1546 111.0501 45.9718 0.0000 175.1310 39 T 3.8858 8.4934 112.0207 64.0825 69.2411 175.5616 40 N 4.2893 8.2192 117.7483 53.7710 37.5318 175.5727 41 Q 4.7261 8.0503 116.5266 54.7779 30.3616 174.2949 42 Q 4.6413 7.5061 118.5980 54.1757 30.5939 174.5223 43 W 4.7592 9.1782 125.1363 54.6633 32.1071 174.6890 44 A 4.9960 9.0660 127.0970 50.1090 20.6939 175.3912 45 A 4.8839 8.7268 125.4966 51.7197 19.6792 176.8094 46 T 4.5934 8.4918 112.8179 59.7056 71.5704 175.6377 47 D 4.3376 8.7932 121.4488 57.3273 40.9316 177.6300 48 A 4.1080 7.9137 119.2485 52.6748 18.5923 177.9139 49 G 3.9345 8.3920 105.3897 45.2234 0.0000 173.5001 50 E 5.0903 7.8452 118.8464 54.8767 31.7513 175.6594 51 L 5.0635 8.6058 120.5772 53.4786 44.4165 175.6526 52 R 5.3125 9.2243 124.3894 54.4496 32.7039 176.0975 53 V 4.0874 8.0774 121.8575 59.5605 34.2106 175.7304 54 Y 3.4596 8.7555 118.1088 58.5296 35.5557 171.2645 55 G 4.2497 8.4214 110.6857 45.4779 0.0000 174.3899 56 D 4.9182 7.8703 115.1099 52.3135 40.5716 175.0233 57 K 4.9274 8.2516 119.3991 55.2073 35.6834 174.3137 58 C 5.4763 9.3092 121.5315 54.7898 40.9357 173.1361 59 L 4.6677 9.0583 125.7920 55.6320 42.8840 175.3348 60 D 5.3177 9.3456 125.2717 52.7450 44.8359 173.6423 61 A 4.8635 9.0212 128.7228 51.1862 18.7678 177.2748 62 A 4.0874 9.0979 125.7371 54.5703 19.1535 176.9304 63 G 4.0581 7.6894 101.9647 45.2959 0.0000 172.7544 64 T 4.4981 8.5043 109.0618 61.0026 69.5699 173.3766 65 S 4.7717 7.7940 117.0070 56.0634 65.5408 173.1614 66 N 4.6154 8.4509 118.4087 55.2962 38.4432 175.9164 67 G 4.4707 9.1983 111.8999 45.4117 0.0000 173.8528 68 S 4.2969 8.0157 116.7902 58.8191 64.0114 174.2466 69 K 4.4432 8.8228 123.4698 56.4779 33.5441 175.7884 70 V 4.9615 8.4161 123.7370 61.3638 33.8089 174.5987 71 Q 5.3544 9.3124 125.3390 54.5546 32.9176 173.7297 72 I 4.9916 8.5074 112.7083 60.7896 39.8242 174.2195 73 Y 5.0466 8.5762 122.3823 57.2016 42.7112 173.7434 74 S 4.5856 8.4669 120.9213 59.2517 63.5959 173.9410 75 C 4.8661 8.9636 122.0810 56.9190 40.5971 173.6816 76 W 5.0244 9.1159 118.1139 55.9323 29.7526 175.9002 77 G 3.7344 8.1903 107.4622 45.1434 0.0000 174.0956 78 G 2.3574 5.3800 108.2196 44.4888 0.0000 174.7993 79 D 4.2052 8.1527 119.9475 56.3424 41.1749 177.8747 80 N 4.3575 7.8387 115.1840 53.7892 37.7042 175.5785 81 Q 5.0745 7.5831 117.5471 54.8729 30.5430 174.7459 82 K 4.8064 7.2665 119.0097 54.4041 35.2147 175.2029 83 W 5.4165 8.8773 123.1182 55.0103 33.1474 174.6767 84 R 4.1821 9.3872 126.1393 55.8887 30.7382 175.3568 85 L 4.9402 8.5328 127.6671 53.4357 41.2191 176.2529 86 N 4.6883 8.9556 121.7674 52.3653 39.4659 177.0500 87 S 4.2302 8.5475 115.0877 61.0053 63.3293 174.6897 88 D 4.6013 8.1178 119.1240 53.1903 39.4064 177.2560 89 G 4.0347 8.2378 109.6950 45.3924 0.0000 174.0129 90 S 4.9397 8.2228 114.9953 57.7841 64.7815 173.9052 91 V 4.5748 8.6124 121.2422 61.4656 34.0345 173.7018 92 V 4.8394 8.7699 129.0868 60.7019 33.6621 175.1509 93 G 3.1574 9.0840 116.4967 46.1470 0.0000 174.5656 94 V 3.5021 7.9210 125.6926 65.9432 31.8755 177.2073 95 Q 3.9994 7.4363 119.5997 58.7607 28.9560 177.1962 96 S 4.2013 7.8520 110.7228 58.3605 63.8094 175.0326 97 G 3.8497 8.1406 107.3176 45.8209 0.0000 172.8678 98 L 4.7978 7.6266 119.2982 53.0139 44.9110 174.9209 99 C 5.2449 8.8680 118.4566 55.6859 38.9329 173.2035 100 L 4.6329 8.9788 125.6076 55.6905 42.7746 175.3695 101 D 5.2107 9.1971 125.2644 52.6180 45.1580 173.8242 102 A 4.6950 9.0133 128.3512 51.2015 19.7250 177.0833 103 V 3.3571 8.8226 123.3160 64.9643 31.9171 176.4760 104 G 3.6510 9.1056 113.9113 46.1632 0.0000 172.5683 105 N 4.0812 7.8367 114.8669 53.8675 37.9463 174.6311 106 G 3.8454 7.9230 104.2284 45.1203 0.0000 174.4711 107 T 4.3886 8.1652 108.8448 60.8064 70.7851 174.3673 108 A 4.1545 7.6529 125.2870 51.1444 19.2980 176.1934 109 N 4.1576 8.2272 116.6176 55.4140 38.6491 175.9636 110 G 4.5052 9.3113 111.6805 44.8907 0.0000 173.7081 111 T 3.9944 7.7737 117.7164 64.0437 69.3607 174.2988 112 L 4.8684 8.6947 125.9604 54.5886 43.9986 175.4805 113 I 5.1321 8.3295 120.7857 59.8313 40.3323 175.1397 114 Q 5.2012 9.1306 123.4363 54.8394 32.9521 173.3467 115 L 5.1349 8.7863 118.7512 54.4434 43.5353 175.7210 116 Y 5.0914 9.0415 121.8072 56.3165 42.8684 173.6363 117 T 3.9144 7.3363 120.6735 64.0684 69.1085 173.2845 118 C 4.4761 8.8927 123.9922 57.7397 39.0098 173.6835 119 S 4.5422 8.3189 117.7202 57.4646 64.7597 173.7964 120 N 4.3023 8.6106 116.4676 54.2515 37.3386 174.3996 121 G 3.8067 7.3554 105.3031 44.5757 0.0000 175.8007 122 S 3.9612 8.4860 115.7375 60.6519 63.4450 175.3874 123 N 4.3302 7.9698 116.8725 53.3896 37.0982 175.3376 124 Q 5.0381 8.0490 116.5550 54.7014 31.1766 174.6372 125 R 4.8851 7.3193 118.6957 54.1156 33.2376 174.8746 126 W 5.4843 8.8814 122.2921 55.2476 33.0282 174.5892 127 T 4.7659 9.2049 118.4633 60.0422 70.3224 173.4966 128 R 4.4035 8.7607 126.1254 56.4845 31.2866 176.6338 129 T 4.1476 8.3235 114.5815 62.2888 67.5141 174.1012 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 4 D 8.35 4.45 0.00 2.67 2.59 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 5 G 10.00 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 6 G 8.91 4.16 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 0.00 7 Q 8.71 4.98 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.43 2.29 0.00 8 I 8.52 4.46 1.60 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.73 0.69 0.00 0.00 9 K 9.07 5.01 0.00 1.88 1.81 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.54 7.81 10 G 9.29 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 0.00 0.00 0.00 11 V 8.28 3.56 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 0.67 0.00 0.00 0.86 0.00 0.00 12 G 7.69 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 0.00 0.00 0.00 13 S 7.85 4.21 0.00 4.09 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 14 G 8.15 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 15 R 7.80 4.79 0.00 1.76 2.03 0.00 3.28 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 16 C 9.04 5.39 0.00 3.06 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 17 L 8.90 4.64 0.00 1.39 1.28 0.41 -0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 18 D 9.18 5.23 0.00 2.99 2.74 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 19 V 8.64 4.32 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 1.08 0.00 0.00 0.92 0.00 0.00 20 P 0.00 4.22 0.00 2.22 1.97 0.00 3.87 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.18 0.00 21 D 9.06 4.06 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 22 A 7.81 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 23 S 7.87 4.23 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 24 T 8.16 4.51 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 0.53 0.00 0.00 25 S 7.99 4.38 0.00 3.92 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 26 D 8.46 4.37 0.00 2.43 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 0.00 0.00 0.00 0.00 27 G 9.19 4.73 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 28 T 7.71 4.17 4.32 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 1.26 0.00 0.00 29 Q 8.75 4.69 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 7.05 0.00 0.00 0.00 0.00 0.00 2.40 2.67 0.00 30 L 8.85 4.58 0.00 1.57 1.54 1.24 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 31 Q 8.84 5.24 0.00 2.35 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.92 0.00 0.00 0.00 0.00 0.00 2.57 2.58 0.00 32 L 9.01 5.07 0.00 1.69 1.69 0.93 1.10 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 33 W 9.19 5.37 0.00 3.51 3.15 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 0.00 0.00 0.00 34 D 8.11 4.65 0.00 2.63 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 35 C 8.87 4.51 0.00 3.00 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 36 H 8.17 4.72 0.00 3.24 3.37 0.00 5.53 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 S 8.70 4.62 0.00 4.02 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 38 G 8.15 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 39 T 8.49 3.89 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 1.23 0.00 0.00 40 N 8.22 4.29 0.00 2.99 3.22 0.00 0.00 6.06 7.24 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 41 Q 8.05 4.73 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.81 0.00 0.00 0.00 0.00 0.00 2.51 2.28 0.00 42 Q 7.51 4.64 0.00 1.77 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 43 W 9.18 4.76 0.00 3.17 3.02 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 44 A 9.07 5.00 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 45 A 8.73 4.88 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 46 T 8.49 4.59 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 1.28 0.00 0.00 47 D 8.79 4.34 0.00 2.69 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 48 A 7.91 4.11 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 49 G 8.39 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 50 E 7.85 5.09 0.00 2.05 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 2.32 2.14 0.00 51 L 8.61 5.06 0.00 1.31 1.52 0.36 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 52 R 9.22 5.31 0.00 1.76 1.82 0.00 3.09 0.00 0.00 3.45 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 53 V 8.08 4.09 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 0.00 0.00 0.22 0.00 0.00 -0.64 0.00 0.00 54 Y 8.76 3.46 0.00 3.25 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 55 G 8.42 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 0.00 0.00 0.00 0.00 56 D 7.87 4.92 0.00 2.75 2.72 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 57 K 8.25 4.93 0.00 1.90 1.82 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.49 1.75 7.81 58 C 9.31 5.48 0.00 3.11 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 59 L 9.06 4.67 0.00 1.62 1.36 0.27 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 60 D 9.35 5.32 0.00 3.07 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 61 A 9.02 4.86 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 62 A 9.10 4.09 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 63 G 7.69 4.06 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 0.00 0.00 0.00 64 T 8.50 4.50 4.21 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 1.20 0.00 0.00 65 S 7.79 4.77 0.00 4.02 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 66 N 8.45 4.62 0.00 2.70 2.88 0.00 0.00 7.10 7.65 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 67 G 9.20 4.47 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 0.00 68 S 8.02 4.30 0.00 3.93 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 69 K 8.82 4.44 0.00 1.77 1.79 0.00 1.68 0.00 0.00 1.89 0.00 0.00 2.83 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.58 1.49 7.81 70 V 8.42 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 0.88 0.00 0.00 1.08 0.00 0.00 71 Q 9.31 5.35 0.00 2.33 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.63 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 72 I 8.51 4.99 2.02 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.96 1.10 0.00 0.00 73 Y 8.58 5.05 0.00 3.19 3.04 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 0.00 0.00 0.00 74 S 8.47 4.59 0.00 3.94 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 75 C 8.96 4.87 0.00 3.05 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 76 W 9.12 5.02 0.00 3.50 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 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 78 G 5.38 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 0.00 0.00 0.00 79 D 8.15 4.21 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 80 N 7.84 4.36 0.00 2.94 3.19 0.00 0.00 6.11 7.83 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 81 Q 7.58 5.07 0.00 1.87 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.80 0.00 0.00 0.00 0.00 0.00 2.37 1.91 0.00 82 K 7.27 4.81 0.00 1.42 1.53 0.00 1.46 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.42 1.40 7.81 83 W 8.88 5.42 0.00 3.03 3.02 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 84 R 9.39 4.18 0.00 1.85 1.85 0.00 3.08 0.00 0.00 3.18 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 85 L 8.53 4.94 0.00 1.59 1.65 0.94 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.96 4.69 0.00 3.06 2.79 0.00 0.00 6.67 7.28 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 87 S 8.55 4.23 0.00 3.99 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 88 D 8.12 4.60 0.00 2.80 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 89 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 90 S 8.22 4.94 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 91 V 8.61 4.57 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 0.81 0.00 0.00 0.85 0.00 0.00 92 V 8.77 4.84 2.14 0.00 0.00 0.00 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 1.05 0.00 0.00 93 G 9.08 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 0.00 0.00 0.00 94 V 7.92 3.50 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 0.63 0.00 0.00 0.82 0.00 0.00 95 Q 7.44 4.00 0.00 1.91 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.70 0.00 0.00 0.00 0.00 0.00 2.30 2.23 0.00 96 S 7.85 4.20 0.00 3.96 3.88 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 97 G 8.14 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 98 L 7.63 4.80 0.00 1.65 1.74 0.94 0.77 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 99 C 8.87 5.24 0.00 3.20 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 0.00 100 L 8.98 4.63 0.00 1.62 1.42 0.28 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 101 D 9.20 5.21 0.00 3.05 2.72 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 0.00 102 A 9.01 4.69 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 0.00 103 V 8.82 3.36 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 0.94 0.00 0.00 1.07 0.00 0.00 104 G 9.11 3.65 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 0.00 0.00 0.00 105 N 7.84 4.08 0.00 2.69 2.80 0.00 0.00 7.02 7.87 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 0.00 106 G 7.92 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 0.00 107 T 8.17 4.39 4.17 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 1.14 0.00 0.00 108 A 7.65 4.15 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 0.00 109 N 8.23 4.16 0.00 2.14 1.43 0.00 0.00 7.16 7.65 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 0.00 110 G 9.31 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 0.00 111 T 7.77 3.99 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 1.25 0.00 0.00 112 L 8.69 4.87 0.00 1.66 1.64 1.02 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 113 I 8.33 5.13 1.84 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.28 0.83 0.00 0.00 114 Q 9.13 5.20 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.87 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 115 L 8.79 5.13 0.00 1.71 1.70 0.98 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 116 Y 9.04 5.09 0.00 3.13 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 0.00 117 T 7.34 3.91 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 1.13 0.00 0.00 118 C 8.89 4.48 0.00 2.99 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 0.00 119 S 8.32 4.54 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 0.00 120 N 8.61 4.30 0.00 2.82 2.86 0.00 0.00 7.09 7.98 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 0.00 121 G 7.36 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 0.00 122 S 8.49 3.96 0.00 3.89 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 0.00 123 N 7.97 4.33 0.00 2.78 3.09 0.00 0.00 6.06 7.40 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 0.00 124 Q 8.05 5.04 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 6.80 0.00 0.00 0.00 0.00 0.00 2.45 2.15 0.00 125 R 7.32 4.89 0.00 1.53 1.68 0.00 3.13 0.00 0.00 3.51 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 126 W 8.88 5.48 0.00 3.04 2.99 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 0.00 127 T 9.20 4.77 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 1.27 0.00 0.00 128 R 8.76 4.40 0.00 1.76 1.88 0.00 3.43 0.00 0.00 3.28 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 129 T 8.32 4.15 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 1.25 0.00 0.00