NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 G 3.9945 8.3544 109.7486 44.9036 0.0000 173.3567 23 F 4.0092 8.6838 127.6424 57.7960 40.4910 173.0021 24 F 5.4208 8.1338 127.8070 56.8254 42.7282 172.7172 25 K 4.1683 8.3898 126.4935 54.6330 35.9532 174.1776 26 Q 4.8965 8.3103 127.2988 54.2264 31.1911 174.3703 27 L 4.9124 9.0326 125.6622 53.1721 45.7483 175.4590 28 T 4.9890 8.3244 118.1391 61.7479 70.9956 174.2954 29 L 4.3423 9.0319 127.1089 53.4492 42.5775 176.4805 30 P 4.2582 0.0000 0.0000 65.5315 31.3854 178.4800 31 S 4.1667 7.9637 111.9047 59.6129 63.2128 174.9006 32 G 4.1035 8.3995 109.4731 45.2975 0.0000 173.7900 33 Q 4.6714 7.9116 118.4471 55.7083 30.1916 175.7501 34 V 4.7875 8.7089 121.5875 61.1689 34.8427 174.4567 35 V 5.2491 9.0363 127.0663 61.3192 34.9112 174.1454 36 T 5.0993 9.1830 116.8802 59.8801 72.2586 172.9020 37 V 5.0638 8.6011 122.8468 61.4679 34.9743 174.3897 38 S 5.6410 9.1945 122.8599 56.8514 66.9040 173.5639 39 E 4.7368 9.3323 123.8961 55.8515 30.0439 177.1618 40 G 4.0598 8.7894 110.1012 45.8074 0.0000 173.1547 41 R 4.0963 8.6023 124.6581 57.2746 30.6765 176.9411 42 G 3.9659 8.8984 112.3701 45.6362 0.0000 173.3798 43 E 4.3342 7.6126 119.1485 54.7562 30.3815 174.6630 44 P 4.5039 0.0000 0.0000 62.3828 32.0747 177.7756 45 A 3.9436 8.5909 124.0013 55.2184 18.5531 179.2791 46 S 4.4006 8.0020 109.4295 60.3644 63.8955 173.6001 47 T 4.8094 6.5064 112.9311 60.6514 71.4344 174.6137 48 G 4.3910 6.6860 115.8202 46.0210 0.0000 174.2723 49 S 5.4162 9.8338 122.3731 56.6295 67.0149 171.0904 50 Y 5.5235 8.8467 117.5942 55.6315 41.7999 173.6458 51 D 5.4012 9.5753 119.6057 51.5888 43.2996 174.6292 52 V 4.9741 8.6274 119.8290 61.2514 34.3829 174.3916 53 R 5.0808 9.2316 126.6188 54.2984 33.6602 174.0555 54 L 5.1001 8.8383 125.8710 53.5431 44.6189 174.7001 55 Y 5.2121 9.1951 123.0623 56.0104 41.7995 176.7431 56 S 3.9798 9.3967 117.0038 59.1078 64.3427 175.7280 57 G 4.3223 8.7175 105.3101 45.2143 0.0000 174.0605 58 A 3.9692 8.2039 124.8059 54.0626 18.5781 178.0047 59 N 4.8480 7.9581 115.1682 51.2218 38.9640 173.3144 60 P 4.4776 0.0000 0.0000 65.2856 31.5939 178.0512 61 Q 4.0217 8.0638 115.4446 57.3359 29.4631 176.3111 62 F 4.8547 8.2945 117.1108 54.6934 39.1554 173.6267 63 P 4.2929 0.0000 0.0000 64.8764 31.7851 177.7360 64 L 3.9591 7.6308 115.2765 54.4152 41.7458 176.9746 65 D 4.6448 7.9855 119.7556 55.9032 41.2336 176.8410 66 Q 4.5417 7.8316 119.8783 53.3264 29.1169 172.6642 67 F 4.2340 8.6922 123.4816 57.9479 40.4988 173.7419 68 I 3.9676 7.0925 127.7651 61.9040 38.6525 175.1127 69 D 4.0647 6.2921 118.2789 53.7556 44.3924 173.6688 70 G 4.5937 8.4325 107.6076 45.2637 0.0000 172.3226 71 K 4.8684 9.0456 119.1392 54.3671 36.8828 175.5012 72 V 4.6609 8.3646 122.1369 61.1475 33.5783 174.6721 73 L 4.9075 8.4345 127.3534 51.8036 45.4886 174.2783 74 P 4.9510 0.0000 0.0000 62.8171 32.6597 175.6204 75 R 4.6201 8.8710 118.4112 54.5764 31.9790 174.8343 76 D 4.4288 9.5091 125.9073 50.2247 39.1385 175.5710 77 G 3.9333 7.3920 108.0993 44.2583 0.0000 170.2318 78 S 4.9829 8.3165 115.4282 56.1048 66.1360 174.0914 79 I 3.7373 8.5983 123.7328 62.0647 36.6069 175.8129 80 K 4.3086 9.0915 129.5766 58.3224 32.9038 176.1811 81 E 4.8706 7.4896 114.7385 55.7640 32.3773 174.0409 82 L 5.2589 8.6312 119.9827 53.0749 44.4614 176.1526 83 K 4.7265 9.0715 120.8503 54.5818 36.6966 175.4679 84 L 5.2463 8.5278 122.2071 53.2871 43.8182 175.8547 85 L 4.6667 8.5630 123.3658 52.8994 46.7769 175.7755 86 D 4.9319 8.5854 121.4960 53.4814 40.5719 175.7137 87 L 4.2242 9.0265 128.5400 55.8347 42.1052 177.7798 88 N 4.8509 8.1787 112.8691 52.0089 37.8824 174.8341 89 G 3.8422 8.6800 107.0594 46.7643 0.0000 173.9721 90 D 4.6042 7.9555 115.2429 52.4437 39.6088 177.3536 91 K 4.0554 8.7391 118.3438 56.8609 30.3795 175.5771 92 Q 4.8185 8.3555 119.1536 53.4048 31.2044 173.2502 93 P 4.5792 0.0000 0.0000 62.6845 32.6436 175.6629 94 E 4.5114 8.8745 122.2878 55.5295 31.7872 174.7590 95 L 4.9948 8.6893 124.0399 54.0791 44.0410 175.1912 96 I 4.9639 9.0060 127.1032 59.5164 40.4085 174.4916 97 V 4.3560 9.0127 127.6425 61.2123 33.4845 174.2876 98 V 4.6520 8.4260 128.9000 61.4262 33.3767 174.5567 99 V 4.7227 8.8843 127.9526 60.9928 34.4744 173.4896 100 E 5.0749 8.8632 128.5705 54.1262 31.7808 175.1839 101 S 4.5972 8.5193 121.3546 58.3338 62.8175 174.2665 102 A 4.2859 8.8122 127.6030 53.9019 20.2212 179.0140 103 G 3.4538 8.3685 106.0666 46.7958 0.0000 176.1592 *106 S 4.1981 9.1143 117.8525 58.5470 64.6468 173.4472 107 Y 5.1908 8.3359 121.0489 56.3007 42.7613 174.1756 108 L 5.3980 9.3398 121.3816 53.1087 45.5522 175.7327 109 S 5.2529 8.8294 115.5023 57.0069 67.2339 172.3299 110 A 5.0801 8.6793 119.7184 51.1382 22.9147 175.0402 111 D 5.3937 9.0289 119.7683 52.3866 44.5286 175.0621 112 A 5.3233 8.6445 123.7479 50.2166 22.5898 175.1510 113 F 5.4314 9.1492 118.4121 55.8941 43.6792 174.4071 114 T 4.6308 9.0546 113.2785 61.2781 70.6418 173.7402 115 L 5.4176 8.2340 123.0339 53.3662 45.4721 175.2176 116 N 4.9611 8.6881 119.4437 52.2484 40.5345 174.1015 117 P 4.2412 0.0000 0.0000 65.8716 31.8101 178.2971 118 Q 4.1199 8.2774 115.8748 59.0072 28.8305 177.2246 119 E 4.3275 10.0598 115.6054 59.3002 31.4667 175.3205 120 G 3.9352 7.0652 105.7220 44.4206 0.0000 173.4978 121 L 5.1182 8.4383 127.0524 53.3520 43.6831 175.2353 122 D 5.0434 8.7882 124.5032 52.5476 45.8288 174.9464 123 S 4.3476 8.8585 117.3849 59.1824 63.0871 173.2333 124 F 4.6183 8.7837 126.7430 59.3450 40.6035 174.7242 125 N 4.5901 7.6503 114.2373 53.3206 42.4021 171.8940 126 H 5.3051 8.5367 120.4694 54.7316 33.0081 172.5599 127 V 4.6822 8.4820 117.6237 59.8407 35.9606 174.4015 128 E 4.7412 8.6472 118.7134 56.4587 31.9868 174.6587 129 G 3.6759 8.6412 106.1347 46.5210 0.0000 173.7807 130 L 4.4868 7.9850 119.2126 53.3606 42.7850 176.9069 131 A 4.3414 8.9005 125.1528 51.2986 18.9765 177.0413 132 P 4.2194 0.0000 0.0000 65.3437 31.4321 177.3862 133 N 4.6408 7.9115 112.6010 53.1140 38.0482 175.1869 134 E 4.0641 7.8386 119.1583 56.1752 30.3071 177.1052 135 D 4.5583 8.3976 120.8460 53.3974 41.3433 177.1102 136 V 3.6038 8.2000 127.6144 65.9617 31.5564 177.6853 137 I 3.7066 7.7584 119.1146 64.4726 36.8394 178.0798 138 Q 3.9763 8.3241 119.0321 58.9634 29.0031 177.6890 139 A 4.1438 8.0251 122.0294 55.1712 18.2149 179.6089 140 L 4.0551 7.8510 116.2831 57.2725 41.7623 179.1116 141 K 4.5067 7.6796 117.2169 56.6434 32.3557 176.6787 142 T 4.4466 6.9090 116.5780 60.9854 69.3463 173.0023 143 P 4.3864 0.0000 0.0000 62.8463 31.2886 176.3113 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 22 G 8.35 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 0.00 0.00 0.00 23 F 8.68 4.01 0.00 3.23 2.97 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 24 F 8.13 5.42 0.00 2.97 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 25 K 8.39 4.17 0.00 1.27 1.48 0.00 1.53 0.00 0.00 1.62 0.00 0.00 2.78 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.21 1.18 7.81 26 Q 8.31 4.90 0.00 1.86 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.50 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 27 L 9.03 4.91 0.00 1.56 1.49 0.93 0.40 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 28 T 8.32 4.99 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 29 L 9.03 4.34 0.00 1.72 1.59 0.98 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.26 0.00 2.04 2.11 0.00 3.68 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 2.07 0.00 31 S 7.96 4.17 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.40 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 0.00 0.00 0.00 33 Q 7.91 4.67 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.70 0.00 0.00 0.00 0.00 0.00 2.40 2.17 0.00 34 V 8.71 4.79 2.19 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 0.86 0.00 0.00 0.98 0.00 0.00 35 V 9.04 5.25 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 1.00 0.00 0.00 0.95 0.00 0.00 36 T 9.18 5.10 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 1.30 0.00 0.00 37 V 8.60 5.06 2.24 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 1.00 0.00 0.00 0.96 0.00 0.00 38 S 9.19 5.64 0.00 4.19 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 39 E 9.33 4.74 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 40 G 8.79 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 41 R 8.60 4.10 0.00 1.80 1.86 0.00 3.29 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 42 G 8.90 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 43 E 7.61 4.33 0.00 2.18 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 2.35 2.39 0.00 44 P 0.00 4.50 0.00 2.20 1.99 0.00 3.78 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 2.13 2.10 0.00 45 A 8.59 3.94 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 46 S 8.00 4.40 0.00 4.04 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 47 T 6.51 4.81 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 48 G 6.69 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 0.00 0.00 0.00 0.00 49 S 9.83 5.42 0.00 3.85 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 50 Y 8.85 5.52 0.00 3.19 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 51 D 9.58 5.40 0.00 2.78 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 52 V 8.63 4.97 1.73 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 0.83 0.00 0.00 0.73 0.00 0.00 53 R 9.23 5.08 0.00 2.01 1.85 0.00 3.42 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 54 L 8.84 5.10 0.00 1.58 1.39 0.98 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 55 Y 9.20 5.21 0.00 2.87 2.96 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 56 S 9.40 3.98 0.00 3.92 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 57 G 8.72 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 0.00 0.00 0.00 0.00 58 A 8.20 3.97 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 59 N 7.96 4.85 0.00 2.80 2.91 0.00 0.00 7.22 7.71 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 60 P 0.00 4.48 0.00 2.08 2.11 0.00 3.77 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 61 Q 8.06 4.02 0.00 1.77 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 7.22 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 62 F 8.29 4.85 0.00 2.97 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 P 0.00 4.29 0.00 1.95 2.09 0.00 3.61 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.07 0.00 64 L 7.63 3.96 0.00 1.45 1.17 0.86 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 65 D 7.99 4.64 0.00 2.97 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 66 Q 7.83 4.54 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 7.09 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 67 F 8.69 4.23 0.00 3.01 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 68 I 7.09 3.97 1.62 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 0.98 0.75 0.71 0.00 0.00 69 D 6.29 4.06 0.00 2.48 2.21 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 70 G 8.43 4.59 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 0.00 0.00 0.00 71 K 9.05 4.87 0.00 1.56 1.63 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.37 1.35 7.81 72 V 8.36 4.66 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 0.82 0.00 0.00 0.92 0.00 0.00 73 L 8.43 4.91 0.00 0.49 1.22 0.82 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.95 0.00 2.08 2.04 0.00 3.63 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 75 R 8.87 4.62 0.00 1.97 2.39 0.00 2.96 0.00 0.00 3.24 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.68 0.00 76 D 9.51 4.43 0.00 2.72 2.67 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 0.00 0.00 0.00 0.00 77 G 7.39 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 78 S 8.32 4.98 0.00 3.89 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 0.00 79 I 8.60 3.74 0.91 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.31 -0.02 0.00 0.00 80 K 9.09 4.31 0.00 1.68 1.88 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.38 7.81 81 E 7.49 4.87 0.00 2.04 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 2.17 2.25 0.00 82 L 8.63 5.26 0.00 1.57 1.62 1.02 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 83 K 9.07 4.73 0.00 1.64 1.64 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.34 1.38 7.81 84 L 8.53 5.25 0.00 1.48 1.57 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 85 L 8.56 4.67 0.00 1.52 1.45 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 86 D 8.59 4.93 0.00 2.58 2.58 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 0.00 0.00 0.00 0.00 87 L 9.03 4.22 0.00 0.97 1.52 0.73 0.94 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 88 N 8.18 4.85 0.00 2.91 3.15 0.00 0.00 6.08 7.00 0.00 0.00 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 8.68 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 0.00 0.00 0.00 90 D 7.96 4.60 0.00 2.83 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 91 K 8.74 4.06 0.00 1.92 2.04 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.39 7.81 92 Q 8.36 4.82 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.01 0.00 0.00 0.00 0.00 0.00 2.28 2.54 0.00 93 P 0.00 4.58 0.00 2.04 2.02 0.00 3.48 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.10 0.00 94 E 8.87 4.51 0.00 1.90 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 0.00 1.54 2.21 0.00 95 L 8.69 4.99 0.00 1.84 1.71 1.02 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 96 I 9.01 4.96 1.88 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 1.11 0.53 0.92 0.00 0.00 97 V 9.01 4.36 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 0.23 0.00 0.00 0.98 0.00 0.00 98 V 8.43 4.65 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 0.84 0.00 0.00 0.91 0.00 0.00 99 V 8.88 4.72 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.86 0.00 0.00 100 E 8.86 5.07 0.00 2.04 1.76 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 2.21 2.22 0.00 101 S 8.52 4.60 0.00 4.05 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 0.00 102 A 8.81 4.29 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 0.00 103 G 8.37 3.45 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 0.00 *106 S 9.11 4.20 0.00 3.59 3.78 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 0.00 107 Y 8.34 5.19 0.00 2.93 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 0.00 108 L 9.34 5.40 0.00 1.54 1.53 0.98 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.83 5.25 0.00 3.97 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 0.00 110 A 8.68 5.08 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 0.00 111 D 9.03 5.39 0.00 2.86 2.31 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 0.00 112 A 8.64 5.32 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 0.00 113 F 9.15 5.43 0.00 2.97 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 0.00 114 T 9.05 4.63 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 1.37 0.00 0.00 115 L 8.23 5.42 0.00 1.49 1.57 0.94 1.09 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 0.00 116 N 8.69 4.96 0.00 2.83 2.87 0.00 0.00 6.86 7.76 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 0.00 117 P 0.00 4.24 0.00 2.06 2.15 0.00 3.69 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 118 Q 8.28 4.12 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 119 E 10.06 4.33 0.00 2.01 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 2.45 2.40 0.00 120 G 7.07 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 L 8.44 5.12 0.00 1.51 1.68 0.86 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.79 5.04 0.00 2.68 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 S 8.86 4.35 0.00 3.76 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 0.00 124 F 8.78 4.62 0.00 2.95 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 0.00 125 N 7.65 4.59 0.00 2.53 2.65 0.00 0.00 6.48 7.89 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 0.00 126 H 8.54 5.31 0.00 3.06 3.06 0.00 5.92 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 0.00 127 V 8.48 4.68 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 0.67 0.00 0.00 0.89 0.00 0.00 128 E 8.65 4.74 0.00 2.01 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 0.00 2.17 2.27 0.00 129 G 8.64 3.68 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 0.00 0.00 0.00 130 L 7.99 4.49 0.00 1.98 1.63 0.92 0.72 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 0.00 131 A 8.90 4.34 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 0.00 132 P 0.00 4.22 0.00 2.01 2.11 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.00 0.00 133 N 7.91 4.64 0.00 2.79 2.91 0.00 0.00 6.06 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 0.00 134 E 7.84 4.06 0.00 2.10 1.93 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 2.35 2.26 0.00 135 D 8.40 4.56 0.00 2.71 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 0.00 136 V 8.20 3.60 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 1.01 0.00 0.00 0.93 0.00 0.00 137 I 7.76 3.71 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.15 0.91 0.00 0.00 138 Q 8.32 3.98 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 139 A 8.03 4.14 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 0.00 140 L 7.85 4.06 0.00 1.86 1.88 0.97 1.00 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 0.00 141 K 7.68 4.51 0.00 1.88 1.91 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.70 1.67 7.81 142 T 6.91 4.45 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 143 P 0.00 4.39 0.00 2.02 1.94 0.00 3.71 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 * Residues marked with a * may have inaccurate shift predictions.