NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.3261 8.3149 120.0050 56.4620 33.9327 175.5083 7 L 4.3052 8.3304 121.8936 53.2845 42.5018 174.5142 8 H 5.0570 9.0468 116.4461 54.1136 32.5570 172.4942 9 K 4.6010 8.6175 119.9401 55.9420 33.2292 175.9901 10 E 4.9985 9.2845 123.6848 53.6765 33.2229 173.9736 11 P 5.0268 0.0000 0.0000 63.3272 32.5062 174.7597 12 A 4.8578 8.3154 121.2620 51.5596 23.0555 175.5609 13 T 4.6341 8.6320 115.0906 61.3379 72.0307 174.0146 14 L 4.1218 8.7341 128.3546 55.8945 42.3760 175.3437 15 I 4.3651 8.4660 125.9787 61.8348 38.4798 175.4658 16 K 4.5849 7.5431 120.4793 55.3801 35.6626 173.8535 17 A 4.6089 8.6509 129.7448 51.7980 19.7898 176.8030 18 I 4.2851 8.2475 123.4267 62.6578 38.7262 175.2171 19 D 4.5645 7.4643 116.0216 52.8292 41.0744 174.3883 20 G 3.9611 9.2345 106.3696 47.6416 0.0000 173.8213 21 D 5.0461 8.2691 116.5446 52.8516 41.4170 175.3982 22 T 5.2378 8.1014 115.7849 62.4014 72.3490 173.4224 23 V 4.7951 8.8471 118.4215 59.5428 36.8944 174.0023 24 K 5.0903 9.4009 124.6862 54.9536 34.2577 175.1359 25 L 5.3350 9.1449 126.1051 53.2168 46.8070 174.8999 26 M 4.8837 9.4264 121.8021 54.5940 33.8542 174.1274 27 Y 5.0090 9.0634 127.8699 55.9300 41.9275 175.6110 28 K 3.6187 9.3240 127.5808 57.5558 29.7047 175.8089 29 G 3.9715 8.3334 102.2976 45.7535 0.0000 173.2015 30 Q 4.7996 8.0487 117.4753 53.1313 32.1378 172.7966 31 P 5.0002 0.0000 0.0000 63.4029 32.1694 175.4003 32 M 4.9321 9.2350 122.2369 54.1133 37.2514 173.8723 33 T 4.8597 8.3927 117.9480 62.6147 70.7422 173.7039 34 F 5.0924 9.6142 124.7972 55.5742 42.2529 174.2754 35 R 5.0891 9.1536 122.9375 54.1726 32.5304 174.9283 36 L 4.4143 8.5633 127.0822 54.7307 42.4635 177.3291 37 L 3.9993 8.6370 123.7088 55.3699 43.0159 177.3504 38 L 4.1460 8.7631 118.6942 54.6192 39.5491 173.9850 39 V 5.1150 7.3896 109.1301 59.9907 36.5015 174.7114 40 D 4.7638 8.8289 121.2252 53.5647 44.0078 174.3504 41 T 4.7008 8.7456 116.4405 59.6336 71.1911 172.8613 42 P 4.4829 0.0000 0.0000 62.4416 32.1562 176.2668 43 E 4.1672 10.0991 124.6874 56.6684 30.0510 177.2063 44 T 4.6918 8.3237 111.5198 60.9036 70.5783 174.0727 45 K 4.3638 9.0945 120.8753 58.1406 34.6130 176.5180 46 H 4.3405 8.2357 118.6536 54.8876 30.3499 174.0280 47 P 4.3705 0.0000 0.0000 64.8745 31.3483 176.2590 48 K 4.2247 8.0346 118.6046 56.6907 33.4071 178.1133 49 K 4.0189 9.1881 123.1258 55.5181 32.9209 177.7344 50 G 3.6312 7.5118 106.1104 47.2225 0.0000 176.6275 51 V 4.2015 8.1698 125.6678 61.3305 31.1263 175.3431 52 E 4.2475 9.0638 127.7781 55.4008 30.9460 176.3609 53 K 4.0611 8.2816 123.4223 58.1228 32.6342 176.8097 54 Y 4.3109 8.0483 122.8898 59.3870 36.0614 171.1149 55 G 3.6912 8.0520 107.4672 47.6281 0.0000 174.0292 56 P 4.2841 0.0000 0.0000 64.9970 31.4017 178.6573 57 E 4.0113 8.1928 116.7004 59.3171 29.4612 179.0668 58 A 4.0334 8.3802 121.0953 55.2055 18.4650 179.7677 59 S 4.0659 8.3258 113.4971 61.8312 62.9620 176.8476 60 A 4.0312 8.2635 123.4584 55.0871 18.1017 179.1916 61 F 3.8800 8.6295 119.4218 61.8273 39.5535 177.2358 62 T 3.9548 8.3494 115.1474 66.6266 68.2729 176.1189 63 K 3.9221 8.0382 121.2711 59.6288 32.2934 178.5210 64 K 3.8368 7.9131 119.5285 59.5955 31.8730 178.3496 65 M 3.8690 7.6540 117.1780 58.8743 32.5456 178.3620 66 V 3.8009 8.0242 112.6664 64.1956 31.5334 178.5020 67 E 4.1050 8.3526 117.9335 58.9501 29.4461 177.5213 68 N 4.5539 7.8549 113.3954 53.5605 39.1230 175.4036 69 A 4.4635 7.2180 120.3123 51.8632 19.1884 177.8488 70 K 4.2229 9.0685 120.3432 58.2847 32.7761 178.1912 71 K 4.7188 8.4023 117.4821 54.5007 36.2429 175.6618 72 I 4.9881 8.4064 124.3712 59.6069 40.3712 174.3637 73 E 5.1728 9.1734 124.5199 54.6685 33.9822 175.0548 74 V 4.6522 9.0646 115.3909 59.5273 35.3994 174.7324 75 E 4.9737 8.7157 124.2025 54.5374 32.2695 174.9312 76 F 4.6283 8.8187 125.7014 57.5105 40.1739 175.8871 77 D 4.9884 8.4775 120.5324 53.8500 43.0242 175.8050 78 K 4.4178 8.8468 116.3756 57.3683 33.4541 178.1107 79 G 4.7536 8.5561 109.3795 43.8666 0.0000 173.7434 80 Q 4.0439 8.6445 122.2498 56.6704 29.1539 176.9421 81 R 4.5010 8.4144 118.0349 56.5348 31.0324 175.9577 82 T 5.0395 7.3044 107.0068 59.8137 72.1477 173.1534 83 D 4.7194 8.4625 123.1697 51.5780 41.5687 177.1624 84 K 3.8968 8.2380 117.1128 59.4834 32.5349 177.0502 85 Y 4.3395 7.9413 116.0165 57.6519 37.8817 176.1785 86 G 3.9034 8.0153 107.6539 45.6165 0.0000 174.1011 87 R 4.3066 8.2631 119.5973 55.2673 31.6485 176.3597 88 G 3.4902 8.7819 111.0365 46.0186 0.0000 172.5336 89 L 5.2137 8.9182 123.8168 52.4166 43.0968 175.5676 90 A 4.4726 8.2211 124.3929 51.0163 23.5042 173.5954 91 Y 4.8560 8.6178 116.8873 57.0221 39.7739 175.3577 92 I 4.8630 8.5839 124.7406 59.6790 40.2748 174.1405 93 Y 5.1513 9.0330 123.5725 56.0585 41.2768 174.6008 94 A 4.9290 8.9893 125.3998 50.1618 21.5496 176.1814 95 D 4.4059 9.7164 124.8584 56.0774 39.0113 175.3112 96 G 3.9195 8.3572 103.1046 45.8024 0.0000 173.4171 97 K 4.5186 7.9409 120.2469 54.4826 33.7063 175.4544 98 M 3.9610 8.5589 123.7498 54.9872 33.0345 176.7293 99 V 3.6217 8.5891 127.4104 66.1707 31.6160 177.4116 100 N 4.2695 8.1415 115.7330 56.5978 38.3942 176.8059 101 E 3.8836 8.0862 119.5567 59.0524 29.8570 178.0795 102 A 4.0472 8.0192 120.9181 55.4353 18.3424 179.5927 103 L 3.4587 7.8663 117.0631 57.8395 41.7363 179.9861 104 V 3.7103 7.4110 118.0302 66.1041 31.2694 178.0194 105 R 3.9218 8.1805 117.6125 59.1613 29.9767 177.5972 106 Q 4.2618 7.6532 114.8963 55.1464 29.2610 175.9224 107 G 3.8591 8.0266 108.7750 46.8966 0.0000 174.7245 108 L 4.4882 7.7799 117.3222 54.0765 42.4417 176.1802 109 A 4.7377 7.5020 119.1059 50.8389 22.4373 175.5978 110 K 4.9366 8.4748 117.7944 54.2984 36.1054 176.0161 111 V 4.3159 9.5757 123.6070 63.0769 32.1123 175.0903 112 A 4.3097 8.8161 128.0803 50.4759 23.3488 174.7833 113 Y 3.4266 7.4071 113.7545 59.0391 35.2300 173.5072 114 V 3.8032 7.1990 118.4189 62.2237 31.3677 173.8095 115 Y 4.8159 8.0692 125.3758 55.9330 39.2773 177.3501 116 K 3.9663 9.0104 124.4631 59.6995 32.5813 177.9735 117 T 4.1736 8.0455 112.6098 63.8050 68.0510 173.3447 118 N 5.5054 8.1846 117.7062 51.4992 38.7507 173.6354 119 N 5.2443 7.8045 113.5421 52.6484 38.9628 177.5983 120 T 3.8360 8.5263 118.2672 67.7763 68.7677 174.9363 121 H 4.8111 8.0306 116.1338 55.6550 29.1859 176.1670 122 E 3.9841 8.2717 122.8474 59.9107 29.2806 179.1759 123 Q 3.9738 8.0750 117.0767 59.1450 28.7228 178.0096 124 H 4.1467 8.2624 118.6936 59.5462 29.8176 177.1607 125 L 3.9848 8.1058 120.5704 57.7412 41.4395 179.7042 126 R 3.9016 8.2809 118.3242 59.0267 30.0068 179.2436 127 K 3.9546 8.1182 118.4042 59.5438 32.0322 179.6142 128 S 4.0792 7.7985 115.2908 61.4610 62.6727 176.2694 129 E 3.8986 8.4815 122.1531 59.2602 29.3007 178.7499 130 A 3.7261 7.9531 120.7683 54.9468 18.3923 179.4376 131 Q 3.7798 7.8667 117.3812 59.3268 29.1285 178.3329 132 A 4.0312 7.8933 121.7990 54.9101 18.3090 179.7671 133 K 3.3852 7.7809 117.1044 59.4248 31.8687 179.4381 134 K 3.8286 7.7774 118.3639 59.1291 32.1522 177.6489 135 E 4.2630 7.9750 115.8748 55.0678 30.6906 175.9435 136 K 4.1011 8.0148 118.6411 57.3260 30.4163 174.9890 137 L 4.5225 8.2573 118.3753 55.0181 45.0532 178.5526 138 N 3.4117 9.3028 118.5333 54.0561 38.2095 176.2221 139 I 3.2676 5.4200 124.6355 64.7225 37.6935 176.7188 140 W 4.8523 7.9094 117.6054 56.4834 29.0710 176.5164 141 S 4.7526 8.2326 119.4171 57.9667 62.6154 173.9428 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 6 K 8.31 4.33 0.00 1.92 1.91 0.00 1.55 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.49 7.81 7 L 8.33 4.31 0.00 1.82 1.75 1.08 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 8 H 9.05 5.06 0.00 3.12 3.26 0.00 5.71 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 9 K 8.62 4.60 0.00 1.57 1.66 0.00 1.37 0.00 0.00 1.33 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.07 1.25 7.81 10 E 9.28 5.00 0.00 2.03 2.03 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 2.38 2.31 0.00 11 P 0.00 5.03 0.00 2.10 2.07 0.00 3.85 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 12 A 8.32 4.86 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 13 T 8.63 4.63 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 1.23 0.00 0.00 14 L 8.73 4.12 0.00 1.63 1.58 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.47 4.37 2.06 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 1.15 0.86 0.94 0.00 0.00 16 K 7.54 4.58 0.00 1.82 1.61 0.00 1.72 0.00 0.00 1.84 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.44 7.81 17 A 8.65 4.61 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 18 I 8.25 4.29 2.06 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 1.36 0.68 0.91 0.00 0.00 19 D 7.46 4.56 0.00 2.75 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 20 G 9.23 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.27 5.05 0.00 2.79 2.86 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 22 T 8.10 5.24 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 1.26 0.00 0.00 23 V 8.85 4.80 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 0.73 0.00 0.00 0.95 0.00 0.00 24 K 9.40 5.09 0.00 1.82 1.70 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.56 7.81 25 L 9.14 5.34 0.00 1.77 1.54 0.29 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.43 4.88 0.00 2.15 1.99 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 2.58 2.55 0.00 27 Y 9.06 5.01 0.00 3.31 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 28 K 9.32 3.62 0.00 1.34 1.60 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.09 0.56 7.81 29 G 8.33 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 8.05 4.80 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.95 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 31 P 0.00 5.00 0.00 2.14 2.15 0.00 3.77 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 32 M 9.23 4.93 0.00 1.68 2.09 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.52 0.00 33 T 8.39 4.86 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 1.22 0.00 0.00 34 F 9.61 5.09 0.00 2.91 2.88 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 35 R 9.15 5.09 0.00 1.85 1.75 0.00 3.36 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.60 0.00 36 L 8.56 4.41 0.00 1.61 1.61 0.98 0.83 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 37 L 8.64 4.00 0.00 0.87 1.27 0.22 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.76 4.15 0.00 2.00 1.82 1.17 1.17 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 39 V 7.39 5.12 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 0.78 0.00 0.00 0.97 0.00 0.00 40 D 8.83 4.76 0.00 2.87 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 41 T 8.75 4.70 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 1.20 0.00 0.00 42 P 0.00 4.48 0.00 2.17 2.02 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.04 0.00 43 E 10.10 4.17 0.00 1.99 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 2.32 2.36 0.00 44 T 8.32 4.69 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 1.20 0.00 0.00 45 K 9.09 4.36 0.00 1.78 1.84 0.00 1.59 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.36 7.81 46 H 8.24 4.34 0.00 3.13 3.13 0.00 5.69 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.37 0.00 2.20 2.16 0.00 3.47 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.84 0.00 48 K 8.03 4.22 0.00 2.04 2.04 0.00 1.35 0.00 0.00 1.49 0.00 0.00 2.45 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.22 1.32 7.81 49 K 9.19 4.02 0.00 1.92 2.00 0.00 1.88 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.29 1.42 7.81 50 G 7.51 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 51 V 8.17 4.20 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 0.80 0.00 0.00 0.92 0.00 0.00 52 E 9.06 4.25 0.00 1.94 1.83 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 2.31 2.25 0.00 53 K 8.28 4.06 0.00 1.63 1.60 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.45 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.44 1.08 7.81 54 Y 8.05 4.31 0.00 3.20 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 55 G 8.05 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 56 P 0.00 4.28 0.00 2.16 2.11 0.00 3.52 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 57 E 8.19 4.01 0.00 2.37 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 2.52 0.00 58 A 8.38 4.03 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 59 S 8.33 4.07 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 60 A 8.26 4.03 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 61 F 8.63 3.88 0.00 3.21 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 62 T 8.35 3.95 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 1.31 0.00 0.00 63 K 8.04 3.92 0.00 1.97 1.98 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.54 7.81 64 K 7.91 3.84 0.00 1.93 1.75 0.00 1.61 0.00 0.00 1.38 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.38 7.81 65 M 7.65 3.87 0.00 2.08 1.77 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 2.52 2.54 0.00 66 V 8.02 3.80 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 0.89 0.00 0.00 1.01 0.00 0.00 67 E 8.35 4.11 0.00 1.98 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 0.00 2.34 2.38 0.00 68 N 7.85 4.55 0.00 2.81 2.82 0.00 0.00 6.99 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 69 A 7.22 4.46 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 70 K 9.07 4.22 0.00 1.93 1.87 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.40 7.81 71 K 8.40 4.72 0.00 1.83 1.65 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.38 7.81 72 I 8.41 4.99 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.25 0.85 0.00 0.00 73 E 9.17 5.17 0.00 1.92 1.77 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 2.20 2.25 0.00 74 V 9.06 4.65 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 -0.06 0.00 0.00 0.55 0.00 0.00 75 E 8.72 4.97 0.00 2.16 2.13 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 2.48 2.52 0.00 76 F 8.82 4.63 0.00 3.08 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 77 D 8.48 4.99 0.00 2.74 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 78 K 8.85 4.42 0.00 1.80 1.89 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.46 7.81 79 G 8.56 4.75 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 0.00 0.00 0.00 80 Q 8.64 4.04 0.00 2.11 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.24 0.00 81 R 8.41 4.50 0.00 1.61 1.42 0.00 2.70 0.00 0.00 2.27 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.58 0.00 82 T 7.30 5.04 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 1.12 0.00 0.00 83 D 8.46 4.72 0.00 2.87 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 84 K 8.24 3.90 0.00 1.56 1.74 0.00 1.22 0.00 0.00 1.47 0.00 0.00 2.89 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.86 0.23 7.81 85 Y 7.94 4.34 0.00 3.11 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 86 G 8.02 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 0.00 0.00 0.00 87 R 8.26 4.31 0.00 2.08 1.80 0.00 3.10 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 88 G 8.78 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.92 5.21 0.00 1.59 1.63 0.91 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.22 4.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.62 4.86 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 92 I 8.58 4.86 1.77 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.56 0.87 0.00 0.00 93 Y 9.03 5.15 0.00 2.91 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 94 A 8.99 4.93 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 95 D 9.72 4.41 0.00 2.80 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 96 G 8.36 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.94 4.52 0.00 2.09 1.77 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.38 7.81 98 M 8.56 3.96 0.00 1.95 1.68 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.50 0.00 99 V 8.59 3.62 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 1.04 0.00 0.00 0.95 0.00 0.00 100 N 8.14 4.27 0.00 2.90 2.94 0.00 0.00 6.74 7.66 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 0.00 101 E 8.09 3.88 0.00 1.97 2.04 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 2.26 2.17 0.00 102 A 8.02 4.05 1.62 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 0.00 0.00 103 L 7.87 3.46 0.00 1.83 1.61 1.01 0.78 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 0.00 104 V 7.41 3.71 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 1.09 0.00 0.00 0.98 0.00 0.00 105 R 8.18 3.92 0.00 1.98 2.07 0.00 3.33 0.00 0.00 3.20 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 106 Q 7.65 4.26 0.00 1.75 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.34 0.00 0.00 0.00 0.00 0.00 2.34 1.98 0.00 107 G 8.03 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 0.00 0.00 0.00 108 L 7.78 4.49 0.00 1.20 1.52 0.52 0.61 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 0.00 109 A 7.50 4.74 1.17 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 0.00 0.00 110 K 8.47 4.94 0.00 1.73 1.93 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.13 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.11 1.19 7.81 111 V 9.58 4.32 2.10 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 0.72 0.00 0.00 0.96 0.00 0.00 112 A 8.82 4.31 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Y 7.41 3.43 0.00 3.13 2.92 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 0.00 0.00 0.00 114 V 7.20 3.80 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 0.80 0.00 0.00 0.94 0.00 0.00 115 Y 8.07 4.82 0.00 3.12 2.83 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 0.00 116 K 9.01 3.97 0.00 1.79 1.96 0.00 1.68 0.00 0.00 1.67 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.56 7.81 117 T 8.05 4.17 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 1.38 0.00 0.00 118 N 8.18 5.51 0.00 2.84 2.78 0.00 0.00 6.75 7.95 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 0.00 119 N 7.80 5.24 0.00 2.87 3.22 0.00 0.00 6.09 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 0.00 120 T 8.53 3.84 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 1.07 0.00 0.00 121 H 8.03 4.81 0.00 2.85 3.14 0.00 5.65 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.27 3.98 0.00 2.23 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 2.34 2.41 0.00 123 Q 8.08 3.97 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.65 0.00 0.00 0.00 0.00 0.00 2.47 2.37 0.00 124 H 8.26 4.15 0.00 3.21 3.50 0.00 5.87 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 0.00 125 L 8.11 3.98 0.00 1.78 1.71 1.06 0.79 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 0.00 126 R 8.28 3.90 0.00 2.03 1.94 0.00 3.12 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 127 K 8.12 3.95 0.00 1.96 1.82 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.70 7.81 128 S 7.80 4.08 0.00 3.86 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 0.00 129 E 8.48 3.90 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 2.10 2.50 0.00 130 A 7.95 3.73 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 0.00 131 Q 7.87 3.78 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 132 A 7.89 4.03 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 0.00 133 K 7.78 3.39 0.00 1.57 1.47 0.00 0.79 0.00 0.00 1.05 0.00 0.00 2.57 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.30 0.21 7.81 134 K 7.78 3.83 0.00 1.82 2.02 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.44 7.81 135 E 7.97 4.26 0.00 1.99 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 2.29 2.49 0.00 136 K 8.01 4.10 0.00 2.03 1.89 0.00 1.54 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.45 7.81 137 L 8.26 4.52 0.00 1.75 1.53 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 138 N 9.30 3.41 0.00 2.51 1.42 0.00 0.00 7.09 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 0.00 139 I 5.42 3.27 1.07 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 0.99 -0.05 -0.66 0.00 0.00 140 W 7.91 4.85 0.00 3.25 3.13 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 0.00 141 S 8.23 4.75 0.00 3.96 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