NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0728 8.0544 120.3787 62.8513 33.6378 174.0698 2 E 3.9135 8.0653 125.2285 55.5582 29.0184 175.7877 3 W 5.3169 8.3940 117.1332 55.2077 31.6376 175.5743 4 T 4.5848 8.7860 114.0501 60.5598 71.3292 175.6644 5 D 4.3983 8.6512 122.3622 57.5461 40.9054 178.9391 6 K 3.8425 8.1381 119.4196 59.8123 32.1506 178.2863 7 E 4.0740 8.0987 118.1196 59.5630 29.5485 179.5735 8 R 3.6987 8.0650 117.9678 59.1912 30.1462 179.0116 9 S 4.0526 8.5802 113.0347 61.4194 62.4524 176.1516 10 I 3.6613 7.7460 122.3034 64.5738 36.8648 178.3179 11 I 3.7752 7.6418 120.4911 64.5743 36.8791 178.4631 12 S 4.0547 7.8623 113.3308 61.2631 62.3402 175.6490 13 D 4.2858 8.5515 121.0502 57.4332 40.8216 178.0341 14 I 3.5802 7.9650 119.0263 64.7140 37.4588 178.2799 15 F 3.9787 8.6973 118.9960 60.2829 38.5117 177.8553 16 S 4.3037 8.5854 113.3319 60.6401 62.8001 175.1758 17 H 4.8097 7.4816 117.6350 54.4609 29.0714 174.1240 18 M 3.8031 7.4981 122.3449 55.4895 32.5204 176.8744 19 D 4.7063 8.0558 126.1629 52.5218 39.9666 175.5886 20 Y 4.0004 8.2267 122.4592 61.0265 37.9965 177.8134 21 D 4.4863 8.2992 117.9336 57.0742 41.3189 177.3522 22 D 4.4933 8.1124 118.4463 56.3733 41.4703 177.8029 23 I 3.8076 7.9091 120.0519 65.1378 37.3255 178.0119 24 G 3.8884 8.1044 104.8486 48.5985 0.0000 173.6004 25 P 4.3057 0.0000 0.0000 64.6509 31.6405 179.1106 26 K 3.9957 7.7353 115.8468 59.2240 31.9427 179.3650 27 A 3.9399 8.2110 121.2446 55.0472 18.3947 179.5313 28 L 3.9076 7.9122 119.1821 58.3152 41.7261 179.3231 29 S 4.0530 8.5427 114.7050 61.3153 62.8642 176.3867 30 R 3.7769 8.1087 122.4141 59.1272 29.7272 177.9855 31 C 3.9703 8.0482 118.4536 62.6136 31.4748 175.5998 32 L 3.8952 7.7247 121.6676 56.9046 40.8344 179.6817 33 I 3.7179 6.9617 118.2073 64.2033 37.4336 178.2261 34 V 3.4444 7.4098 117.6402 64.6108 32.8707 175.7745 35 Y 3.4755 7.2141 115.2952 54.2006 37.7313 174.4556 36 P 4.6244 0.0000 0.0000 64.0236 31.7929 178.2257 37 W 4.4070 7.6049 116.8514 59.5960 28.3926 178.0580 38 T 4.0716 7.9799 110.9613 64.3298 68.0753 175.7581 39 Q 4.5274 7.9483 120.0228 57.3329 28.4166 177.7008 40 R 3.9110 7.7023 119.8220 58.8973 29.9166 176.3603 41 H 4.5613 7.1818 112.4508 55.2015 29.0438 174.7689 42 F 4.0812 7.5427 118.6102 56.6979 39.3809 175.8084 43 S 4.3022 7.9839 117.4170 60.5659 62.7782 174.8648 44 G 4.2415 9.1973 113.9689 45.6317 0.0000 174.7671 45 F 4.1210 8.0466 117.7696 58.2886 39.3021 173.8431 46 G 3.8039 7.3032 105.1458 43.8228 0.0000 172.0828 47 N 4.7007 8.7112 117.9906 53.6605 39.2582 175.3632 48 L 4.8023 8.5578 124.2635 54.9078 42.7932 176.6332 49 Y 4.1553 8.2407 114.8917 58.6524 38.1920 175.8053 50 N 4.9887 7.9053 117.3086 50.1124 41.3702 174.4941 51 A 3.8952 8.6929 125.3848 55.9070 18.4737 179.9554 52 E 3.8659 8.3433 115.6383 59.6130 29.3912 179.4785 53 A 4.0516 8.0413 119.0903 55.1270 18.8990 179.3441 54 I 3.8204 7.6238 118.2342 64.5759 36.9756 178.7209 55 I 3.8284 7.8372 119.9295 64.1389 37.0615 178.0771 56 G 3.8917 7.9089 103.6532 44.4380 0.0000 173.0784 57 N 4.4990 7.6165 121.0647 52.9147 39.5089 175.6793 58 A 3.9951 8.6254 127.9397 55.1581 18.4279 179.0756 59 N 4.0999 8.4808 115.4507 56.0803 38.4258 177.8465 60 V 3.6954 8.0306 118.9898 65.9576 31.5289 177.3731 61 A 3.9827 8.2049 120.5488 55.4589 18.1902 179.4512 62 A 3.9842 8.2134 118.9764 55.7154 18.4287 179.4115 63 H 4.4272 8.8127 117.0278 59.1911 29.9269 177.7544 64 G 3.6307 8.4969 108.0849 47.6797 0.0000 175.8580 65 I 3.9536 7.6535 121.9514 63.7793 36.8975 178.1454 66 K 3.9364 7.7786 119.9168 59.5738 32.3646 178.5626 67 V 3.7782 7.9907 118.3380 65.9766 31.4543 177.3611 68 L 4.1043 7.9794 119.9491 59.0374 41.9503 178.8030 69 H 4.5241 8.6423 115.6653 58.7636 28.3611 177.7013 70 G 3.8747 8.1402 106.4409 46.9732 0.0000 174.9497 71 L 4.6181 8.4079 122.1349 55.9094 41.8825 178.6382 72 D 4.3288 8.2375 120.0653 57.3950 40.5964 178.8469 73 R 4.0062 8.0744 114.8090 59.0895 29.4225 178.7104 74 G 4.0445 8.1143 106.1685 47.6008 0.0000 175.6552 75 V 3.1057 7.5672 119.7311 65.7483 31.5304 178.1691 76 K 4.0949 7.9233 116.4370 58.0735 33.0942 177.0404 77 N 5.1388 7.6929 115.9822 52.4179 38.9220 175.8063 78 M 4.2824 7.9813 117.6245 57.9984 32.6095 177.7091 79 D 5.0200 8.0939 115.9212 54.4428 41.7856 175.7474 80 N 5.1557 8.1754 118.6344 52.3407 40.1025 176.3223 81 I 3.9024 8.5672 118.8474 64.2063 36.7871 177.1961 82 A 4.0618 8.1813 120.5013 55.2696 18.0319 179.3260 83 A 3.9809 7.9568 117.0888 55.6939 18.6266 179.2903 84 T 3.8542 7.8516 112.9995 66.9190 68.5508 175.7021 85 Y 4.2629 8.2516 116.2856 58.4030 38.2399 177.2699 86 A 4.0600 7.7100 122.4964 55.6819 18.5016 179.4595 87 D 4.2976 8.0250 116.4775 57.4786 41.0469 178.6402 88 L 4.0790 7.9245 120.4264 57.9524 42.1743 178.5452 89 S 4.4507 8.3892 114.9071 61.3918 62.3354 176.2961 90 T 3.7594 8.0700 118.2232 66.3587 68.0669 176.3970 91 L 3.8794 7.8385 121.8984 58.6197 42.1535 178.7779 92 H 4.1561 8.3576 116.0953 59.2878 28.1244 177.3242 93 S 3.6413 7.7950 115.0999 60.9927 61.8610 175.8150 94 E 4.0898 8.3899 122.3962 57.9072 29.6223 177.9991 95 K 4.2401 7.6317 116.5653 58.0730 33.3594 177.7602 96 L 4.0477 7.8911 117.3396 55.7139 41.7983 176.7666 97 H 4.3268 7.8039 112.8876 56.1168 25.9088 174.7199 98 V 3.7265 7.8922 119.0011 61.7801 32.2717 174.8079 99 D 4.2354 8.5764 126.9148 53.4072 41.0799 174.8269 100 P 2.9700 0.0000 0.0000 64.5906 31.4438 177.7733 101 D 4.2609 8.1187 118.7102 57.1200 40.9951 177.6369 102 N 4.4133 8.1096 117.2692 55.9183 38.3995 177.1961 103 F 4.5475 7.4860 119.6358 60.6589 39.0170 177.5702 104 K 3.9855 8.0584 118.6683 59.3853 32.0287 178.7001 105 L 3.8209 7.6568 118.9447 57.6125 41.4011 179.2802 106 L 4.0453 8.0750 120.2821 58.2434 41.9792 179.0733 107 S 4.1402 8.1021 115.1402 61.8357 62.8621 176.4135 108 D 4.4420 8.1941 121.4562 57.7258 40.5637 178.7613 109 C 4.2278 8.0107 116.8319 62.7120 28.0919 176.1879 110 I 3.7563 8.0691 121.7773 64.8130 36.7491 178.6371 111 T 4.1627 8.4131 116.8692 66.7335 68.4057 176.9135 112 I 3.6331 7.7178 121.6255 64.2145 37.2187 178.7512 113 V 3.4939 7.7352 119.1258 65.7872 31.3511 177.8331 114 L 3.6746 8.1813 120.2908 57.9803 41.9361 178.7544 115 A 3.0903 7.4651 120.4055 54.7712 17.9556 179.3946 116 A 3.9523 7.4618 117.7693 54.3513 18.4968 179.4151 117 K 4.0008 7.2954 117.2794 59.5207 32.8495 178.3337 118 M 4.2321 8.2557 117.4767 55.9865 32.5476 177.7095 119 G 3.7692 8.3645 109.0181 46.3593 0.0000 175.8080 120 H 4.1259 9.3041 117.3670 58.8535 28.7817 176.3787 121 A 4.0845 7.9374 121.1655 54.4870 18.7965 177.9472 122 F 4.4560 8.1518 121.0673 57.2328 37.9177 174.8657 123 T 4.1151 7.2258 115.4506 61.0455 71.4902 175.0639 124 A 3.9682 8.3508 122.2694 55.1556 18.3112 179.3784 125 E 3.9424 7.9734 117.4922 59.3855 29.7200 178.9819 126 T 3.7861 7.5074 115.6712 66.4796 68.4301 176.3235 127 Q 3.6685 7.6878 122.0063 59.0094 28.9263 178.8163 128 G 3.6415 7.8672 105.7501 48.0090 0.0000 175.5927 129 A 4.2510 7.9346 123.5406 54.4969 18.3180 179.5207 130 F 4.4328 8.7516 119.6481 61.7452 39.5138 177.4792 131 Q 3.9443 8.6283 118.0092 58.7126 28.4871 178.5264 132 K 3.9761 8.3246 120.7566 59.4468 32.3711 178.6459 133 F 4.5742 8.6276 120.8635 61.5571 39.3519 177.1503 134 L 3.5672 8.1108 118.7631 57.5595 41.3122 179.4025 135 A 3.8929 8.3341 121.2159 55.0477 18.2949 179.8945 136 V 3.5131 7.6403 116.9588 65.9050 31.4928 178.5587 137 V 3.0713 7.1188 117.7593 65.5010 31.1235 178.1911 138 V 3.3023 7.6021 118.1383 65.8295 31.1310 177.6657 139 S 4.0213 7.6456 111.4019 61.6295 62.4541 175.8251 140 A 4.1428 7.7651 123.0396 55.1815 17.9566 179.6082 141 L 4.0983 8.2085 117.8233 56.8086 41.2698 178.8293 142 G 4.3263 7.5721 103.6145 44.3854 0.0000 174.5274 143 K 4.2454 7.9706 120.8557 58.9358 33.1202 177.6684 144 Q 4.3650 8.1938 117.7402 55.8963 28.5667 174.6724 145 Y 4.2653 7.8038 116.0987 56.6842 38.6693 175.3793 146 H 4.5901 8.5575 121.1037 56.0572 29.8372 173.2513 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 V 8.05 4.07 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 0.92 0.00 0.00 0.90 0.00 0.00 2 E 8.07 3.91 0.00 1.84 1.12 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 2.05 2.15 0.00 3 W 8.39 5.32 0.00 3.38 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 4 T 8.79 4.58 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 1.26 0.00 0.00 5 D 8.65 4.40 0.00 2.74 2.79 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 6 K 8.14 3.84 0.00 1.85 1.86 0.00 2.33 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.56 7.81 7 E 8.10 4.07 0.00 2.54 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 0.00 2.55 2.52 0.00 8 R 8.07 3.70 0.00 1.95 1.92 0.00 3.15 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.64 0.00 9 S 8.58 4.05 0.00 3.91 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 10 I 7.75 3.66 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.63 0.94 0.00 0.00 11 I 7.64 3.78 1.59 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 1.54 0.50 0.28 0.00 0.00 12 S 7.86 4.05 0.00 3.99 4.01 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 0.00 0.00 0.00 13 D 8.55 4.29 0.00 2.89 2.82 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 14 I 7.97 3.58 1.81 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 1.34 0.59 0.32 0.00 0.00 15 F 8.70 3.98 0.00 3.15 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 16 S 8.59 4.30 0.00 3.94 4.10 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.48 4.81 0.00 3.07 3.29 0.00 5.85 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 M 7.50 3.80 0.00 1.34 1.39 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.04 0.00 19 D 8.06 4.71 0.00 2.78 2.46 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 20 Y 8.23 4.00 0.00 3.14 2.98 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 21 D 8.30 4.49 0.00 2.67 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 22 D 8.11 4.49 0.00 2.89 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.91 3.81 1.71 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.49 0.81 0.00 0.00 24 G 8.10 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 0.00 0.00 0.00 25 P 0.00 4.31 0.00 2.17 2.12 0.00 3.77 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 26 K 7.74 4.00 0.00 2.05 1.81 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.42 1.43 7.81 27 A 8.21 3.94 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 28 L 7.91 3.91 0.00 1.82 1.65 0.94 0.96 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 29 S 8.54 4.05 0.00 3.98 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 30 R 8.11 3.78 0.00 1.97 2.05 0.00 3.04 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 31 C 8.05 3.97 0.00 3.15 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 32 L 7.72 3.90 0.00 1.73 1.55 0.52 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 33 I 6.96 3.72 1.74 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.38 0.81 0.00 0.00 34 V 7.41 3.44 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 0.08 0.00 0.00 0.73 0.00 0.00 35 Y 7.21 3.48 0.00 2.50 1.43 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 0.00 36 P 0.00 4.62 0.00 2.30 2.27 0.00 3.63 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 2.27 1.92 0.00 37 W 7.60 4.41 0.00 3.58 3.44 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 0.00 38 T 7.98 4.07 4.35 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 1.18 0.00 0.00 39 Q 7.95 4.53 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.76 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 40 R 7.70 3.91 0.00 1.91 1.83 0.00 3.21 0.00 0.00 3.19 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.55 0.00 41 H 7.18 4.56 0.00 2.36 2.85 0.00 5.65 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.54 4.08 0.00 2.79 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 0.00 0.00 0.00 0.00 43 S 7.98 4.30 0.00 3.87 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 44 G 9.20 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 0.00 0.00 0.00 0.00 45 F 8.05 4.12 0.00 3.17 3.23 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 46 G 7.30 3.80 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 0.00 0.00 0.00 47 N 8.71 4.70 0.00 2.76 2.83 0.00 0.00 6.63 7.78 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 48 L 8.56 4.80 0.00 1.49 1.52 0.92 0.97 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 49 Y 8.24 4.16 0.00 3.20 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 50 N 7.91 4.99 0.00 2.97 2.92 0.00 0.00 6.03 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 51 A 8.69 3.90 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 52 E 8.34 3.87 0.00 2.19 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 2.40 2.33 0.00 53 A 8.04 4.05 1.43 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 0.00 0.00 0.00 54 I 7.62 3.82 1.93 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 1.47 1.08 0.82 0.00 0.00 55 I 7.84 3.83 1.85 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 1.42 0.53 0.89 0.00 0.00 56 G 7.91 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 0.00 0.00 0.00 57 N 7.62 4.50 0.00 2.95 2.73 0.00 0.00 6.99 7.55 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 58 A 8.63 4.00 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 59 N 8.48 4.10 0.00 2.44 1.84 0.00 0.00 6.54 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 60 V 8.03 3.70 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 1.03 0.00 0.00 1.00 0.00 0.00 61 A 8.20 3.98 1.38 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 0.00 0.00 0.00 62 A 8.21 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.81 4.43 0.00 3.68 3.63 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.50 3.63 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 0.00 65 I 7.65 3.95 1.95 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 1.66 1.09 1.04 0.00 0.00 66 K 7.78 3.94 0.00 1.98 2.01 0.00 1.92 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.51 7.81 67 V 7.99 3.78 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 1.03 0.00 0.00 0.97 0.00 0.00 68 L 7.98 4.10 0.00 2.05 1.89 1.01 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 69 H 8.64 4.52 0.00 3.48 3.32 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 8.14 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 71 L 8.41 4.62 0.00 2.27 2.13 1.30 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.24 4.33 0.00 2.81 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 73 R 8.07 4.01 0.00 1.78 1.96 0.00 2.30 0.00 0.00 2.85 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.88 0.00 74 G 8.11 4.04 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 0.00 0.00 0.00 75 V 7.57 3.11 1.87 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 0.52 0.00 0.00 -0.52 0.00 0.00 76 K 7.92 4.09 0.00 1.73 1.81 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.42 1.59 7.81 77 N 7.69 5.14 0.00 2.88 2.75 0.00 0.00 6.88 7.75 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 78 M 7.98 4.28 0.00 1.57 1.91 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.16 0.00 79 D 8.09 5.02 0.00 2.74 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 80 N 8.18 5.16 0.00 2.80 2.71 0.00 0.00 7.11 7.58 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 81 I 8.57 3.90 2.05 0.00 0.00 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 1.87 0.95 1.06 0.00 0.00 82 A 8.18 4.06 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 83 A 7.96 3.98 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 84 T 7.85 3.85 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 0.84 0.00 0.00 85 Y 8.25 4.26 0.00 3.17 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 86 A 7.71 4.06 1.44 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 0.00 0.00 0.00 87 D 8.03 4.30 0.00 2.77 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 88 L 7.92 4.08 0.00 1.91 1.87 0.99 1.03 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 89 S 8.39 4.45 0.00 4.18 4.04 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 90 T 8.07 3.76 4.37 0.00 0.00 0.00 0.00 0.00 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 91 L 7.84 3.88 0.00 1.87 1.87 0.90 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.36 4.16 0.00 3.61 3.77 0.00 5.87 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 93 S 7.80 3.64 0.00 2.72 3.42 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 0.00 0.00 0.00 0.00 94 E 8.39 4.09 0.00 1.91 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 2.29 2.23 0.00 95 K 7.63 4.24 0.00 1.67 1.80 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.31 1.39 7.81 96 L 7.89 4.05 0.00 1.76 1.63 0.75 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.80 4.33 0.00 3.38 3.43 0.00 5.74 0.00 0.00 0.00 0.00 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.89 3.73 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 0.52 0.00 0.00 0.73 0.00 0.00 99 D 8.58 4.24 0.00 2.68 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 2.97 0.00 1.89 1.50 0.00 3.36 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.01 0.00 101 D 8.12 4.26 0.00 2.73 2.64 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 0.00 0.00 0.00 0.00 102 N 8.11 4.41 0.00 2.77 2.87 0.00 0.00 6.86 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 0.00 103 F 7.49 4.55 0.00 3.12 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 0.00 104 K 8.06 3.99 0.00 1.81 1.94 0.00 1.70 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.52 7.81 105 L 7.66 3.82 0.00 1.77 1.30 0.81 0.18 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 0.00 106 L 8.08 4.05 0.00 1.88 1.90 0.98 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 107 S 8.10 4.14 0.00 4.10 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 0.00 108 D 8.19 4.44 0.00 3.03 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 0.00 109 C 8.01 4.23 0.00 3.17 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 0.00 110 I 8.07 3.76 2.14 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 1.59 0.77 1.19 0.00 0.00 111 T 8.41 4.16 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 112 I 7.72 3.63 1.94 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 1.73 1.30 0.86 0.00 0.00 113 V 7.74 3.49 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 0.91 0.00 0.00 0.90 0.00 0.00 114 L 8.18 3.67 0.00 1.49 1.24 0.56 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.47 3.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.46 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 0.00 117 K 7.30 4.00 0.00 1.66 1.82 0.00 1.62 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.41 7.81 118 M 8.26 4.23 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.47 0.00 119 G 8.36 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 0.00 120 H 9.30 4.13 0.00 3.11 3.45 0.00 5.90 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 A 7.94 4.08 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 0.00 122 F 8.15 4.46 0.00 2.86 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 0.00 123 T 7.23 4.12 4.19 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 1.27 0.00 0.00 124 A 8.35 3.97 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 0.00 125 E 7.97 3.94 0.00 2.02 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 2.36 2.39 0.00 126 T 7.51 3.79 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 1.09 0.00 0.00 127 Q 7.69 3.67 0.00 1.36 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.75 0.00 128 G 7.87 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.93 4.25 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 0.00 130 F 8.75 4.43 0.00 3.38 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 0.00 131 Q 8.63 3.94 0.00 2.31 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.57 0.00 0.00 0.00 0.00 0.00 2.50 2.73 0.00 132 K 8.32 3.98 0.00 1.99 2.25 0.00 1.61 0.00 0.00 1.82 0.00 0.00 2.13 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.63 1.42 7.81 133 F 8.63 4.57 0.00 3.23 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 0.00 134 L 8.11 3.57 0.00 1.46 1.50 0.64 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 135 A 8.33 3.89 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 0.00 136 V 7.64 3.51 2.20 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 1.07 0.00 0.00 0.97 0.00 0.00 137 V 7.12 3.07 1.48 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 0.15 0.00 0.00 0.06 0.00 0.00 138 V 7.60 3.30 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 0.95 0.00 0.00 0.87 0.00 0.00 139 S 7.65 4.02 0.00 4.05 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 0.00 140 A 7.77 4.14 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 0.00 141 L 8.21 4.10 0.00 1.38 1.09 -0.05 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 142 G 7.57 4.33 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 0.00 143 K 7.97 4.25 0.00 1.92 1.99 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.54 1.47 7.81 144 Q 8.19 4.36 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.69 0.00 145 Y 7.80 4.27 0.00 2.90 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 0.00 146 H 8.56 4.59 0.00 3.09 3.14 0.00 5.93 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00