NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.1828 8.2985 121.4294 56.2569 31.7023 177.8733 3 A 3.9267 7.6569 120.1882 54.1051 18.2808 174.3721 4 V 3.6768 8.2178 117.9327 65.9268 32.1392 176.4549 5 K 3.9361 7.9931 117.8371 59.9694 31.9119 179.2415 6 T 4.0098 7.7723 116.6819 65.9280 68.3111 176.6704 7 F 4.1346 8.3831 122.5836 61.4447 39.4136 176.8205 8 N 4.3479 8.8486 116.7742 56.3691 38.3224 177.5377 9 S 4.1233 8.1871 115.5611 61.4821 62.8838 176.4321 10 E 3.9799 7.8284 121.2811 58.8086 29.6192 178.8314 11 L 3.5976 7.6571 120.5820 58.2955 42.1582 178.5898 12 Y 4.0129 8.2150 116.0272 60.0826 37.7845 177.7241 13 S 4.2650 7.8584 113.8109 60.4590 62.5345 175.5166 14 L 4.1447 7.6890 121.4583 58.3562 41.1164 178.5894 15 N 4.1950 7.8663 114.2783 54.7865 38.5608 175.9897 16 D 4.4196 7.8426 119.4508 54.0625 41.5774 175.6305 17 Y 4.8416 7.2205 116.6020 55.6906 41.1859 174.9742 18 K 4.2650 8.7276 124.7153 54.8717 32.8581 175.0726 19 P 4.5943 0.0000 0.0000 61.5663 31.9809 174.4245 20 P 4.4779 0.0000 0.0000 62.6624 31.9462 176.3386 21 I 3.9770 8.1955 121.9952 60.7173 38.0437 176.8820 22 S 4.2564 8.3020 119.4163 58.2896 64.7913 175.6722 23 K 3.8696 8.5476 122.7380 59.6756 31.8535 179.4347 24 A 3.9776 7.8609 120.4838 55.0369 18.3616 179.4786 25 K 3.7979 7.9831 118.1570 59.7216 32.2325 178.7450 26 M 4.0160 7.9815 118.5620 58.8881 32.0785 178.3022 27 T 3.8624 8.3579 116.2701 66.7677 68.6330 176.5930 28 Q 4.0234 8.2259 119.9291 59.0166 28.7547 178.9595 29 I 3.7206 7.8507 120.7353 64.6961 37.0752 178.7073 30 T 3.9419 8.1226 116.5092 66.6497 68.2400 176.9079 31 K 3.9650 8.5174 120.6116 59.5330 31.9363 179.2651 32 A 4.1062 8.3038 120.8241 54.9264 18.0778 179.5323 33 A 3.6189 8.1175 118.4332 55.3773 18.7367 179.6316 34 I 4.0175 7.9851 118.4277 64.5110 36.9939 178.4705 35 K 4.0433 8.3392 119.4330 59.2085 32.1180 177.2753 36 A 4.7870 7.7456 120.1628 52.5262 19.3934 179.1003 37 I 3.6445 7.5689 123.3833 65.5248 37.9913 177.0574 38 K 3.8664 8.0043 119.4791 58.3147 32.2240 177.3484 39 F 4.9441 8.0901 118.3283 57.1079 40.3206 177.5108 40 Y 4.1524 8.1058 120.1077 60.3062 37.4989 177.5114 41 K 3.5206 6.7517 119.5570 59.3912 32.0683 178.8377 42 H 4.1312 8.0212 116.0146 58.6374 28.7169 177.7894 43 V 3.4317 7.8740 120.0808 65.9620 31.2928 178.1994 44 V 3.2546 7.9155 118.1222 66.0051 31.2341 177.6574 45 Q 4.0001 8.1752 119.2483 59.3690 28.8095 178.5560 46 S 4.3329 8.4672 116.2619 61.6248 62.9274 176.8152 47 V 3.8033 8.2328 120.9566 66.2051 31.3840 177.9140 48 E 4.1558 8.7221 118.5040 59.5332 29.3479 179.5774 49 K 4.1121 8.5704 118.7525 59.1945 32.0644 179.1433 50 F 3.9934 8.5846 121.0917 61.5376 39.1148 177.3368 51 I 3.6759 7.9139 117.9220 64.2778 36.9044 177.9051 52 Q 4.0906 8.1473 119.7669 58.5221 29.0317 177.5881 53 K 4.4156 7.5057 116.3247 55.7017 33.5314 176.5846 54 C 4.1092 7.0378 113.8798 57.1032 30.3856 173.7111 55 K 4.1825 8.3349 119.7355 55.7888 32.6352 176.4088 56 P 4.2010 0.0000 0.0000 65.8682 30.9606 178.7174 57 E 3.9086 8.0525 114.5824 58.6389 29.5593 177.5471 58 Y 4.6076 7.7865 116.5011 57.7993 38.3116 177.4501 59 K 3.8726 7.7285 120.7493 59.4431 32.2073 179.0649 60 V 3.1344 7.5298 117.6651 65.4927 31.4515 175.7427 61 P 4.3087 0.0000 0.0000 65.8391 31.1890 178.5676 62 G 3.7252 8.5085 104.4346 47.7784 0.0000 175.3809 63 L 3.8654 7.9807 123.0554 58.1520 42.0544 178.7274 64 Y 4.5357 8.2593 117.0592 60.9262 37.6888 178.7873 65 V 3.6285 7.9258 119.3666 66.0243 31.5859 178.0816 66 I 3.4253 7.6894 119.4260 64.3393 36.9003 177.7562 67 D 4.7861 8.7107 119.2055 57.7215 41.0135 178.3368 68 S 4.1080 8.6350 113.8577 61.3851 62.3122 176.1830 69 I 3.5845 7.9147 122.4787 64.3753 36.8218 178.6323 70 V 3.6372 8.0842 119.3438 66.0766 31.3765 178.2755 71 R 3.9130 8.2239 117.9285 59.3137 29.8529 178.8509 72 Q 3.9889 8.3655 119.6078 59.1873 29.0206 178.2475 73 S 4.4467 8.5113 114.5354 61.5965 62.5086 176.2890 74 R 4.1496 8.3050 120.9691 59.5497 29.5570 178.5990 75 H 4.1176 8.1166 117.0718 59.2950 29.9827 176.8035 76 Q 3.8240 8.1640 120.3544 58.1063 28.9955 176.8884 77 F 4.6923 8.3603 116.6222 55.7005 41.0561 176.4838 78 G 4.1119 7.7166 106.9176 44.9087 0.0000 174.8795 79 Q 3.9768 8.6413 120.9181 58.7563 28.8441 177.8556 80 E 4.2185 8.0401 114.5826 57.3532 29.9818 177.0950 81 K 4.2407 7.6488 116.4058 56.3050 33.2522 176.2099 82 D 4.3037 7.6725 118.5924 55.0787 41.3131 176.6686 83 V 3.6387 7.8848 118.6057 62.7035 32.6813 178.5109 84 F 4.0867 8.6577 119.3588 60.3637 38.8452 177.3866 85 A 4.0480 8.5505 120.3204 54.9318 17.8983 177.8318 86 P 4.2673 0.0000 0.0000 65.7081 31.6658 178.5859 87 R 4.0898 7.9000 117.4117 59.5734 29.6363 178.5271 88 F 4.4831 8.9870 118.1505 60.6943 38.7339 177.7768 89 S 3.9911 8.6449 113.9801 61.2128 62.4418 176.1937 90 N 4.3916 7.8829 119.2377 56.1005 38.5921 176.2566 91 N 4.9600 7.4959 114.9127 53.1807 39.0641 176.6935 92 I 3.8629 7.6480 123.9650 64.1648 37.8922 178.1094 93 I 3.7749 7.7704 120.3617 64.4934 37.0406 178.3572 94 S 4.1919 8.1190 115.4317 61.8944 62.6679 176.5480 95 T 3.9285 8.2367 118.5043 67.0058 68.1903 176.6824 96 F 3.6921 8.7429 119.5482 60.1120 38.6615 177.4273 97 Q 4.1533 8.2934 118.8838 59.5167 29.0721 178.1564 98 N 4.4982 8.2662 117.2669 56.3220 38.4564 177.4045 99 L 3.8177 7.9432 120.7020 57.8345 41.4305 178.5531 100 Y 4.6308 7.8524 113.6575 59.1032 37.7675 176.1001 101 R 4.4499 7.4587 119.0528 56.2736 30.1426 176.4021 102 C 4.4215 7.4624 113.7510 56.5958 30.7272 171.5487 103 P 4.3513 0.0000 0.0000 62.4041 31.5076 177.9163 104 G 3.8196 8.8553 108.2692 48.1678 0.0000 175.3129 105 D 4.4925 7.9985 118.8763 55.2722 39.8998 177.1963 106 D 4.5775 8.2758 120.2560 55.1352 41.0668 178.1741 107 K 4.0366 7.7477 121.5262 59.5196 32.2531 178.7429 108 S 4.2044 8.0747 113.9840 61.2971 62.7671 176.5093 109 K 4.0676 7.8977 122.3557 59.1149 31.7144 179.4370 110 I 3.5686 7.5967 119.7598 64.3985 37.1988 178.3216 111 V 3.6313 7.6097 119.0382 65.8996 31.2608 177.7530 112 R 3.8280 7.9032 118.3109 59.5706 29.8258 178.5296 113 V 3.3456 7.3924 117.7015 65.9642 31.3682 177.9035 114 L 3.8577 7.7500 118.5478 57.8596 41.4050 179.2427 115 N 4.3625 8.6480 116.7472 56.4090 38.4929 177.5114 116 L 4.0817 8.0130 120.3771 57.4775 41.6601 179.4561 117 W 4.5664 8.6330 119.4646 59.9293 28.9180 178.3510 118 Q 4.0512 8.6489 119.7069 59.1113 28.3438 178.0179 119 K 3.9720 8.1201 119.4619 59.3056 32.3131 177.5104 120 N 4.7375 8.1579 113.1917 51.8687 39.1826 174.5259 121 N 4.2387 7.8906 116.6242 54.2802 36.9331 175.9726 122 V 3.5094 8.1291 118.8065 64.9416 32.0216 175.7056 123 F 4.8127 7.6402 115.5023 54.8850 42.5779 174.5131 124 K 4.2635 8.4097 123.2279 55.9433 32.9684 177.6652 125 S 4.1425 8.8313 117.5542 61.6095 61.8985 176.0915 126 E 4.0805 8.1412 117.9828 58.1558 29.8027 178.3914 127 I 4.0512 7.8287 121.5885 64.0719 37.6933 178.0232 128 I 3.7355 7.6571 120.0776 64.2832 36.9418 178.3429 129 Q 3.9879 8.4022 119.2486 58.6865 28.5439 177.1759 130 P 4.3115 0.0000 0.0000 65.4782 31.4046 178.6895 131 L 3.9419 7.4469 117.2919 57.7351 41.4868 179.5135 132 L 4.0511 8.1360 119.0855 57.8550 41.4636 179.1883 133 D 4.3590 8.5032 119.2556 57.7265 40.5401 178.8059 134 M 3.9200 8.0659 117.8628 58.1723 32.1761 178.3241 135 A 3.4276 7.6707 120.0344 54.9684 18.2341 179.3897 136 A 3.8704 7.9907 118.9558 55.4363 18.2312 179.7674 137 A 3.7790 7.9625 117.8838 54.6856 18.3801 179.7685 138 L 4.0475 7.3956 119.4537 58.6031 41.8769 177.6743 139 E 4.1508 7.3844 117.5170 56.0914 29.6816 178.2874 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 2 E 8.30 4.18 0.00 2.01 1.95 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 2.27 2.38 0.00 3 A 7.66 3.93 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 0.00 0.00 0.00 0.00 0.00 4 V 8.22 3.68 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 1.04 0.00 0.00 0.67 0.00 0.00 5 K 7.99 3.94 0.00 2.00 1.84 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.50 1.49 7.81 6 T 7.77 4.01 4.46 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 0.00 0.00 1.26 0.00 0.00 7 F 8.38 4.13 0.00 3.26 3.30 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 8 N 8.85 4.35 0.00 2.92 2.92 0.00 0.00 6.83 7.60 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 9 S 8.19 4.12 0.00 4.06 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 10 E 7.83 3.98 0.00 1.95 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 2.46 2.46 0.00 11 L 7.66 3.60 0.00 0.76 1.32 0.19 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 8.21 4.01 0.00 3.14 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 13 S 7.86 4.27 0.00 4.13 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 14 L 7.69 4.14 0.00 1.63 1.73 0.50 0.41 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 15 N 7.87 4.20 0.00 2.78 2.79 0.00 0.00 7.03 8.14 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 16 D 7.84 4.42 0.00 2.01 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 17 Y 7.22 4.84 0.00 3.24 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 18 K 8.73 4.27 0.00 1.75 1.78 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.44 7.81 19 P 0.00 4.59 0.00 2.00 1.95 0.00 3.57 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.98 0.00 20 P 0.00 4.48 0.00 2.21 2.11 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 21 I 8.20 3.98 1.93 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.90 0.85 0.00 0.00 22 S 8.30 4.26 0.00 3.97 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 23 K 8.55 3.87 0.00 1.78 1.86 0.00 1.64 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.47 7.81 24 A 7.86 3.98 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 25 K 7.98 3.80 0.00 1.64 1.62 0.00 1.48 0.00 0.00 1.50 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.21 1.38 7.81 26 M 7.98 4.02 0.00 2.25 2.03 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.63 0.00 27 T 8.36 3.86 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 1.21 0.00 0.00 28 Q 8.23 4.02 0.00 2.19 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 29 I 7.85 3.72 2.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.95 0.93 0.00 0.00 30 T 8.12 3.94 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 1.25 0.00 0.00 31 K 8.52 3.97 0.00 1.86 1.91 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.68 7.81 32 A 8.30 4.11 1.63 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 0.00 0.00 33 A 8.12 3.62 1.11 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 0.00 0.00 34 I 7.99 4.02 1.98 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.58 1.25 0.00 0.00 35 K 8.34 4.04 0.00 1.87 2.16 0.00 1.87 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.57 1.56 7.81 36 A 7.75 4.79 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.57 3.64 2.08 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.55 0.82 0.00 0.00 38 K 8.00 3.87 0.00 1.49 1.08 0.00 1.54 0.00 0.00 1.03 0.00 0.00 2.85 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.61 1.19 7.81 39 F 8.09 4.94 0.00 3.17 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 40 Y 8.11 4.15 0.00 2.13 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 41 K 6.75 3.52 0.00 1.41 1.56 0.00 1.35 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.80 0.21 7.81 42 H 8.02 4.13 0.00 3.45 3.39 0.00 5.82 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 7.87 3.43 2.35 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 0.50 0.00 0.00 0.78 0.00 0.00 44 V 7.92 3.25 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 0.67 0.00 0.00 0.25 0.00 0.00 45 Q 8.18 4.00 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 46 S 8.47 4.33 0.00 4.46 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 0.00 47 V 8.23 3.80 2.69 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 1.30 0.00 0.00 1.39 0.00 0.00 48 E 8.72 4.16 0.00 2.33 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 2.56 2.77 0.00 49 K 8.57 4.11 0.00 2.17 2.02 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.70 7.81 50 F 8.58 3.99 0.00 2.93 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 51 I 7.91 3.68 2.07 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.97 0.85 0.00 0.00 52 Q 8.15 4.09 0.00 2.21 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 53 K 7.51 4.42 0.00 1.82 1.81 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.59 7.81 54 C 7.04 4.11 0.00 2.55 1.71 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 55 K 8.33 4.18 0.00 2.07 1.81 0.00 1.86 0.00 0.00 1.89 0.00 0.00 2.91 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.56 1.51 7.81 56 P 0.00 4.20 0.00 2.10 2.22 0.00 3.58 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 2.09 2.13 0.00 57 E 8.05 3.91 0.00 1.81 1.88 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 1.76 1.47 0.00 58 Y 7.79 4.61 0.00 3.08 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 59 K 7.73 3.87 0.00 1.66 1.70 0.00 1.70 0.00 0.00 1.49 0.00 0.00 2.84 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.60 1.52 7.81 60 V 7.53 3.13 1.80 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 0.26 0.00 0.00 0.71 0.00 0.00 61 P 0.00 4.31 0.00 2.59 2.27 0.00 3.70 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.21 0.00 62 G 8.51 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 63 L 7.98 3.87 0.00 1.40 1.52 0.71 0.92 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 64 Y 8.26 4.54 0.00 3.13 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 65 V 7.93 3.63 2.29 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 1.15 0.00 0.00 0.88 0.00 0.00 66 I 7.69 3.43 2.10 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 0.83 0.66 0.42 0.00 0.00 67 D 8.71 4.79 0.00 3.07 3.03 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 68 S 8.63 4.11 0.00 3.98 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 69 I 7.91 3.58 2.05 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.68 0.15 0.00 0.00 70 V 8.08 3.64 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 0.78 0.00 0.00 1.02 0.00 0.00 71 R 8.22 3.91 0.00 1.94 2.00 0.00 3.38 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.89 0.00 72 Q 8.37 3.99 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 73 S 8.51 4.45 0.00 4.22 4.15 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 74 R 8.30 4.15 0.00 2.09 1.96 0.00 2.96 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.79 0.00 75 H 8.12 4.12 0.00 3.12 3.56 0.00 5.94 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 8.16 3.82 0.00 1.95 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.53 0.00 0.00 0.00 0.00 0.00 1.16 1.93 0.00 77 F 8.36 4.69 0.00 3.11 3.03 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 78 G 7.72 4.11 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 0.00 0.00 0.00 79 Q 8.64 3.98 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 80 E 8.04 4.22 0.00 1.93 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 2.27 2.25 0.00 81 K 7.65 4.24 0.00 1.97 1.82 0.00 1.75 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.35 7.81 82 D 7.67 4.30 0.00 2.70 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 83 V 7.88 3.64 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 0.40 0.00 0.00 -0.29 0.00 0.00 84 F 8.66 4.09 0.00 3.33 3.32 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 85 A 8.55 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 P 0.00 4.27 0.00 1.99 2.12 0.00 3.65 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.08 0.00 87 R 7.90 4.09 0.00 2.11 2.03 0.00 3.17 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 1.56 1.62 0.00 88 F 8.99 4.48 0.00 3.58 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 89 S 8.64 3.99 0.00 4.21 4.60 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 90 N 7.88 4.39 0.00 2.84 2.98 0.00 0.00 6.90 8.86 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 91 N 7.50 4.96 0.00 2.94 2.88 0.00 0.00 6.74 7.22 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 92 I 7.65 3.86 2.04 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.85 0.00 0.00 93 I 7.77 3.77 1.92 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.70 0.97 0.00 0.00 94 S 8.12 4.19 0.00 4.13 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 95 T 8.24 3.93 4.61 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 1.23 0.00 0.00 96 F 8.74 3.69 0.00 3.27 3.17 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 97 Q 8.29 4.15 0.00 2.28 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.96 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 98 N 8.27 4.50 0.00 2.96 2.82 0.00 0.00 7.07 6.67 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 99 L 7.94 3.82 0.00 1.13 1.13 -0.39 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 100 Y 7.85 4.63 0.00 3.00 2.91 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 0.00 101 R 7.46 4.45 0.00 1.93 1.94 0.00 3.17 0.00 0.00 3.29 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.80 0.00 102 C 7.46 4.42 0.00 2.96 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 0.00 103 P 0.00 4.35 0.00 2.32 1.98 0.00 3.69 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 104 G 8.86 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 0.00 105 D 8.00 4.49 0.00 2.83 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 0.00 106 D 8.28 4.58 0.00 2.91 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 0.00 107 K 7.75 4.04 0.00 1.85 1.94 0.00 1.64 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.58 7.81 108 S 8.07 4.20 0.00 4.10 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 0.00 109 K 7.90 4.07 0.00 1.85 1.92 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.47 7.81 110 I 7.60 3.57 2.07 0.00 0.00 0.54 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 0.60 0.74 0.00 0.00 111 V 7.61 3.63 2.12 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 0.92 0.00 0.00 1.03 0.00 0.00 112 R 7.90 3.83 0.00 2.14 2.07 0.00 3.17 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 113 V 7.39 3.35 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 -0.04 0.00 0.00 1.00 0.00 0.00 114 L 7.75 3.86 0.00 1.88 1.71 0.96 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.65 4.36 0.00 2.92 2.89 0.00 0.00 7.06 6.78 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 0.00 116 L 8.01 4.08 0.00 1.86 1.80 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 117 W 8.63 4.57 0.00 3.61 3.34 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 0.00 118 Q 8.65 4.05 0.00 2.31 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.78 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 119 K 8.12 3.97 0.00 1.92 2.04 0.00 1.90 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.67 7.81 120 N 8.16 4.74 0.00 2.95 2.87 0.00 0.00 7.20 7.35 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 0.00 121 N 7.89 4.24 0.00 2.80 2.87 0.00 0.00 6.85 9.02 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 0.00 122 V 8.13 3.51 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 -0.14 0.00 0.00 0.95 0.00 0.00 123 F 7.64 4.81 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 0.00 124 K 8.41 4.26 0.00 1.87 1.72 0.00 1.65 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.51 7.81 125 S 8.83 4.14 0.00 3.96 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 0.00 126 E 8.14 4.08 0.00 2.18 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 0.00 2.30 2.42 0.00 127 I 7.83 4.05 2.09 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.23 0.71 0.00 0.00 128 I 7.66 3.74 1.95 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.07 0.99 0.00 0.00 129 Q 8.40 3.99 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.70 2.57 0.00 130 P 0.00 4.31 0.00 2.13 2.10 0.00 3.67 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.18 0.00 131 L 7.45 3.94 0.00 1.79 1.27 0.21 0.20 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 0.00 132 L 8.14 4.05 0.00 1.87 1.72 0.99 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 133 D 8.50 4.36 0.00 2.84 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 0.00 134 M 8.07 3.92 0.00 1.97 2.43 0.00 0.00 0.00 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.59 0.00 135 A 7.67 3.43 1.40 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 0.00 0.00 0.00 136 A 7.99 3.87 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 0.00 137 A 7.96 3.78 1.28 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 0.00 138 L 7.40 4.05 0.00 1.64 1.65 0.75 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 139 E 7.38 4.15 0.00 1.83 1.72 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 2.26 2.12 0.00