NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 L 4.2814 8.1849 120.6166 54.7910 43.0887 175.7215 3 T 4.3803 8.3058 119.5105 59.7939 70.8733 172.0392 4 S 4.6843 9.2680 121.5258 56.9950 65.4016 173.8239 5 C 5.0196 8.3362 121.0392 53.9787 38.7729 171.8948 6 P 4.5547 0.0000 0.0000 61.4181 31.6412 174.3690 7 P 4.4141 0.0000 0.0000 64.6611 31.5533 177.2313 8 L 3.8855 8.7623 120.1596 54.4625 40.0696 174.3486 9 W 4.8777 7.7753 117.1527 55.2246 31.6235 175.5260 10 T 4.7507 9.2116 116.2977 60.5338 70.2141 173.0035 11 G 4.4520 8.8828 115.2844 45.1872 0.0000 173.1089 12 F 4.4527 9.3335 124.3987 57.6585 42.2125 173.9435 13 N 3.6721 9.0217 126.5756 54.6520 36.8628 174.6029 14 G 3.8842 8.4978 102.8627 44.6784 0.0000 173.9713 15 K 4.5592 7.8485 118.4359 54.3943 36.1187 174.2984 16 C 5.4247 8.1885 119.5966 55.3619 43.4480 172.9799 17 F 5.9028 9.4625 121.2153 56.2304 43.4302 173.8832 18 R 4.3368 8.7108 119.3722 54.9837 33.6020 173.2723 19 L 4.6396 7.9169 128.0640 53.9373 42.8988 175.3105 20 F 4.5880 8.3117 124.8682 56.2053 40.8336 176.5413 21 H 4.4948 8.9223 118.9984 56.7874 29.4362 175.6144 22 N 4.7513 8.0749 116.9766 52.7150 38.0859 174.0662 23 H 4.9622 8.9552 118.7236 55.6339 29.7925 174.6780 24 L 5.0708 9.2852 122.8356 52.5944 46.4057 176.0071 25 N 5.6423 8.6171 118.9999 52.1401 38.8903 175.7372 26 F 3.1840 9.0827 120.9207 61.3909 39.2616 176.8528 27 D 4.2641 8.0171 117.8952 57.4544 40.7059 178.3966 28 N 4.2759 7.9855 116.2556 55.7837 38.5505 177.2949 29 A 3.0802 7.6915 122.4112 54.7885 18.4631 178.9426 30 E 3.6402 7.3071 117.6442 59.4965 29.3321 178.5695 31 N 4.1254 7.7264 115.2209 56.5754 39.3982 176.1097 32 A 3.9917 7.7884 121.9970 55.6417 18.5027 179.0508 33 C 4.6934 8.2047 114.6531 60.1692 40.0646 175.9271 34 R 4.0205 7.6184 117.2148 57.4459 29.7476 177.8449 35 Q 4.0318 7.5728 117.2550 55.8402 29.3088 175.2494 36 F 4.8801 7.4529 119.9851 55.9163 41.1698 175.3771 37 G 4.2968 8.5889 110.0866 44.3659 0.0000 170.8288 38 L 5.0183 8.4130 119.9658 53.2067 45.2939 175.8120 39 A 5.2177 8.3561 125.7631 50.0451 22.4916 176.2065 40 S 4.2719 8.8590 115.8112 58.3116 63.6709 175.5728 41 C 4.2273 8.5725 119.4214 62.3354 28.0194 174.7749 42 S 4.4760 7.4754 112.7651 57.8254 62.9314 174.2621 43 G 4.0776 7.8946 110.5086 46.3231 0.0000 174.6714 44 D 4.3968 8.1401 120.7028 53.7045 41.3174 175.0997 45 E 4.3041 8.7505 125.6808 56.3646 30.0868 175.8221 46 L 4.5718 8.8339 126.4353 56.2339 43.5829 176.0966 47 A 4.6486 7.5572 118.1569 51.3594 22.9073 174.9848 48 T 4.8660 8.2044 114.6481 61.5830 72.2987 175.3890 49 G 3.9996 9.2247 111.8552 47.7249 0.0000 172.2693 50 H 4.8242 8.4974 113.9451 54.8910 33.6973 174.3645 51 L 4.4998 8.8041 121.7473 54.7122 42.3062 177.2265 52 A 4.4764 9.0700 125.1079 53.0152 19.3397 176.5975 53 S 3.1195 8.3770 115.4762 55.8791 65.7360 173.8435 54 I 4.5091 6.4550 120.6184 60.2694 40.1289 174.9954 55 H 5.2902 8.5423 120.3675 54.5812 30.3814 173.6601 56 S 4.2198 7.1839 112.3682 56.2677 66.1387 176.2825 57 A 3.8174 7.9253 124.7628 55.2651 18.0414 180.1130 58 E 3.9635 8.0136 116.8770 59.6504 29.7157 179.2234 59 S 3.9612 8.1695 115.2482 61.6106 62.8194 176.6901 60 Q 3.9446 7.9197 121.6319 59.0646 28.8741 177.9300 61 A 3.8326 8.0571 121.9128 54.8472 18.3558 179.4756 62 F 3.8456 7.7794 119.2337 61.3868 39.4072 177.4995 63 L 3.2736 7.6098 118.5849 57.6038 41.2003 179.5967 64 T 3.6682 7.7342 115.8446 66.6346 68.3452 176.3030 65 E 3.7560 7.9962 121.0845 58.8954 29.4107 178.6467 66 L 3.6834 7.2000 120.6230 57.7719 41.9460 179.1422 67 V 3.4244 7.5138 118.1780 65.8796 31.2701 178.2401 68 K 3.9259 7.8839 117.4571 59.6643 31.9863 178.7749 69 T 3.9749 8.0247 108.6231 64.1910 68.9272 175.6188 70 S 4.3800 7.5615 117.2978 59.7088 63.9900 174.1000 71 L 4.9010 7.5219 120.2183 53.2699 42.1066 176.4778 72 P 4.2691 0.0000 0.0000 65.7243 31.9054 177.4492 73 D 4.5515 7.9994 116.3219 55.3076 41.1260 176.6917 74 L 4.3006 7.5447 118.1144 55.3370 42.4134 176.5620 75 I 3.5767 7.8105 119.2931 62.1113 37.1675 175.3929 76 T 4.4818 8.3885 117.4804 60.3397 70.9648 175.3289 77 G 4.2035 8.6270 109.6033 45.9521 0.0000 174.3561 78 G 4.1091 7.8133 107.5424 46.4830 0.0000 176.8109 79 W 4.7361 9.2273 123.2142 58.2316 30.8906 175.7787 80 A 4.5268 8.1923 121.4830 51.4348 19.2915 175.0194 81 P 4.6757 0.0000 0.0000 62.4338 33.1503 175.0499 82 Q 5.3417 8.0314 121.4682 54.0992 30.5332 175.3490 83 V 4.4647 7.7682 121.5663 61.2309 35.0174 173.9366 84 Y 5.2469 9.2216 126.4479 58.5413 39.2802 175.1924 85 I 4.9311 8.7462 115.6888 58.4426 42.0543 175.4391 86 G 4.5364 9.4172 106.9513 47.1687 0.0000 172.7534 87 M 4.1737 8.2772 121.3740 54.3976 33.6091 174.9138 88 K 4.6314 8.7915 125.8708 54.5132 35.1613 175.0759 89 V 4.5265 8.1003 125.7262 60.7944 33.0862 173.9598 90 G 4.3401 8.9984 123.3502 46.4808 0.0000 176.8938 91 S 4.3269 8.9517 119.2721 60.6110 63.4017 173.8375 92 T 4.7344 7.4177 108.9516 59.2402 71.6694 174.6407 93 N 4.2597 8.6439 119.4950 56.2558 38.6312 177.0624 94 S 4.2330 7.8761 111.3603 60.6231 63.6119 174.4363 95 D 4.6882 7.8014 121.9971 53.3607 39.6753 173.6317 96 Q 5.2513 8.2912 120.1721 53.9997 31.3530 174.6833 97 T 4.7549 8.7118 113.0780 59.7697 73.0906 172.6217 98 W 5.6718 8.7624 121.1934 54.4420 31.7660 177.2311 99 T 4.1647 9.0763 113.8104 64.9305 68.5312 175.4159 100 D 3.9692 8.1715 119.8963 54.0338 39.3235 177.1532 101 G 3.9435 8.2631 108.2727 45.7890 0.0000 173.7350 102 S 4.5424 8.5637 115.2728 57.3633 64.0750 173.5401 103 S 4.6696 8.3697 114.9610 57.4742 63.8718 174.9433 104 V 4.3851 8.4079 123.4649 62.2261 29.7979 174.8342 105 D 5.0794 8.8771 122.1181 52.5188 40.2728 175.6595 106 Y 4.7712 8.1385 120.3833 56.1033 41.3006 173.8668 107 D 4.3599 8.5628 127.3231 53.3474 40.9462 175.3940 108 G 2.4050 5.9619 114.3726 44.0050 0.0000 171.7008 109 W 4.7561 6.9120 119.3674 56.1349 29.7682 176.5544 110 V 3.8677 9.0319 124.4738 62.7652 32.3279 175.4184 111 S 4.3179 8.5418 122.5682 59.7386 62.7573 173.4831 112 G 4.1774 9.2461 112.1650 45.5815 0.0000 173.5905 113 E 4.4534 8.1196 118.6887 53.9708 31.0663 174.1661 114 P 4.2761 0.0000 0.0000 62.5816 32.1502 175.9901 115 N 4.9131 8.8605 114.8444 52.9140 38.8895 174.2696 116 N 4.8780 8.4271 115.2439 53.1354 39.4204 174.8495 117 G 3.7551 7.7627 107.9551 44.1199 0.0000 171.9770 118 P 4.5099 0.0000 0.0000 62.7463 32.4974 175.0404 119 N 4.2222 8.3831 112.8333 53.9635 36.0083 173.9215 120 S 4.5906 7.3847 112.7556 56.9841 66.7280 173.4294 121 R 4.6432 8.6592 117.3613 54.3233 34.3315 175.4433 122 G 4.2918 9.1172 109.3952 46.2215 0.0000 172.5820 123 A 5.1754 8.9484 123.1394 50.0652 23.4942 175.5721 124 I 4.4416 8.8855 122.3838 61.4433 38.5468 175.2373 125 A 4.9090 8.9200 129.3909 50.5114 19.3754 176.4320 126 A 4.3114 8.9795 121.8409 53.1756 19.5243 177.7441 127 G 3.8495 8.3687 104.0946 46.1038 0.0000 174.7749 128 D 4.4412 8.7806 120.3170 57.2848 40.6775 177.8391 129 Y 4.1292 8.1139 119.9135 59.5346 39.1101 176.8663 130 S 4.2708 7.9763 111.2795 56.7727 64.8822 174.5129 131 R 3.8559 9.1931 118.8466 57.1650 27.9048 176.5710 132 G 3.9101 8.4891 108.3218 45.3899 0.0000 175.0649 133 F 4.4772 7.4867 117.3129 57.1939 40.5222 174.7494 134 W 5.3525 8.9268 120.9451 56.7037 30.3253 175.7618 135 A 5.6880 9.3170 125.7213 50.4386 21.7283 174.9434 136 D 5.7668 8.9680 118.9473 52.0001 41.8703 175.8235 137 V 4.5233 8.6718 113.5024 59.6332 37.2485 173.9393 138 Y 3.9045 8.3310 119.0883 57.8965 38.4050 178.1160 139 S 4.2397 9.0560 117.8791 60.4520 63.3121 174.8193 140 N 4.7283 8.0520 117.7882 53.5769 39.5650 174.3203 141 N 4.3409 8.0706 116.3807 54.1224 39.7936 173.8669 142 N 4.9589 8.5019 120.7541 52.3160 39.5211 174.2754 143 F 5.4073 9.0208 122.0039 55.1722 43.8254 174.9592 144 K 5.0104 8.4734 119.6067 57.1796 33.5858 175.3613 145 Y 5.5466 7.9711 117.2920 56.4238 42.1504 173.4591 146 I 5.0490 8.6110 120.5614 59.9090 40.2431 174.4189 147 C 5.6454 9.6552 125.2272 55.7441 41.0448 172.6493 148 Q 5.3542 9.2993 120.1839 54.4414 30.9939 175.2048 149 L 4.3814 7.9789 121.3454 53.3921 42.9524 174.8376 150 P 4.1470 0.0000 0.0000 63.2252 31.7947 175.8697 151 C 4.1976 8.5936 125.6450 59.1062 32.0863 172.9749 152 V 4.4732 7.8266 119.0439 60.3523 35.2496 173.1977 153 H 4.7992 7.8805 116.6436 53.9000 31.6585 172.4498 154 Y 4.4798 8.2894 117.9794 57.6901 38.6140 175.1956 155 T 4.5819 8.4711 113.5205 60.2948 70.3080 174.1986 156 L 4.4761 8.4937 125.2922 54.1005 42.1708 176.3795 157 E 4.1300 8.2318 122.6975 56.8682 29.1884 176.8411 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 L 8.18 4.28 0.00 1.61 1.66 0.90 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.31 4.38 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 1.17 0.00 0.00 4 S 9.27 4.68 0.00 3.94 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 5 C 8.34 5.02 0.00 3.00 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 6 P 0.00 4.55 0.00 2.13 1.92 0.00 3.34 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.91 0.00 7 P 0.00 4.41 0.00 2.11 2.06 0.00 3.78 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.18 0.00 8 L 8.76 3.89 0.00 1.83 1.67 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 9 W 7.78 4.88 0.00 3.32 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 10 T 9.21 4.75 4.36 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 1.54 0.00 0.00 11 G 8.88 4.45 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 12 F 9.33 4.45 0.00 1.51 2.43 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 13 N 9.02 3.67 0.00 1.91 2.74 0.00 0.00 7.34 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.50 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 0.00 0.00 0.00 15 K 7.85 4.56 0.00 1.89 1.03 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.17 1.30 7.81 16 C 8.19 5.42 0.00 2.55 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 17 F 9.46 5.90 0.00 3.22 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.71 4.34 0.00 0.67 0.66 0.00 2.21 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.63 0.00 19 L 7.92 4.64 0.00 1.42 1.23 0.76 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.31 4.59 0.00 1.65 2.61 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 0.00 21 H 8.92 4.49 0.00 3.14 3.37 0.00 5.70 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 N 8.07 4.75 0.00 2.98 2.94 0.00 0.00 6.08 7.90 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 23 H 8.96 4.96 0.00 3.13 3.47 0.00 5.84 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 9.29 5.07 0.00 1.42 1.40 0.76 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.62 5.64 0.00 3.12 3.00 0.00 0.00 6.36 8.12 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 26 F 9.08 3.18 0.00 2.50 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 27 D 8.02 4.26 0.00 2.71 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 N 7.99 4.28 0.00 2.67 2.76 0.00 0.00 7.02 7.09 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 29 A 7.69 3.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 7.31 3.64 0.00 1.59 1.82 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 2.25 2.31 0.00 31 N 7.73 4.13 0.00 2.87 2.72 0.00 0.00 7.23 7.27 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 32 A 7.79 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 C 8.20 4.69 0.00 3.20 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 34 R 7.62 4.02 0.00 1.91 1.90 0.00 3.10 0.00 0.00 3.18 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 35 Q 7.57 4.03 0.00 1.34 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.61 0.00 0.00 0.00 0.00 0.00 2.44 2.30 0.00 36 F 7.45 4.88 0.00 3.07 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 37 G 8.59 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 0.00 0.00 0.00 0.00 38 L 8.41 5.02 0.00 1.62 1.41 0.86 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.36 5.22 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.86 4.27 0.00 4.02 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 41 C 8.57 4.23 0.00 2.99 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 S 7.48 4.48 0.00 3.96 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 43 G 7.89 4.08 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 0.00 0.00 0.00 44 D 8.14 4.40 0.00 2.71 2.60 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 45 E 8.75 4.30 0.00 1.89 1.85 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 2.27 2.37 0.00 46 L 8.83 4.57 0.00 1.49 1.67 0.90 0.70 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 47 A 7.56 4.65 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 48 T 8.20 4.87 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 1.17 0.00 0.00 49 G 9.22 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 0.00 0.00 0.00 50 H 8.50 4.82 0.00 3.17 3.18 0.00 5.67 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 8.80 4.50 0.00 1.62 1.76 0.28 0.87 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 52 A 9.07 4.48 1.50 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 0.00 0.00 53 S 8.38 3.12 0.00 2.72 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 54 I 6.46 4.51 2.29 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.49 1.21 0.00 0.00 55 H 8.54 5.29 0.00 3.12 3.35 0.00 5.93 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 7.18 4.22 0.00 4.06 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 57 A 7.93 3.82 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 58 E 8.01 3.96 0.00 2.23 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 2.49 2.53 0.00 59 S 8.17 3.96 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 60 Q 7.92 3.94 0.00 2.40 2.22 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 2.57 2.28 0.00 61 A 8.06 3.83 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 62 F 7.78 3.85 0.00 2.10 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.61 3.27 0.00 1.51 1.42 0.69 -0.19 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 64 T 7.73 3.67 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 65 E 8.00 3.76 0.00 2.04 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 2.21 2.22 0.00 66 L 7.20 3.68 0.00 1.05 1.25 0.73 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 67 V 7.51 3.42 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 0.87 0.00 0.00 0.84 0.00 0.00 68 K 7.88 3.93 0.00 1.65 1.78 0.00 1.67 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.45 7.81 69 T 8.02 3.97 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 1.17 0.00 0.00 70 S 7.56 4.38 0.00 3.75 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 71 L 7.52 4.90 0.00 1.81 1.52 0.89 1.26 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 72 P 0.00 4.27 0.00 2.15 2.15 0.00 3.73 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 73 D 8.00 4.55 0.00 2.68 2.75 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 74 L 7.54 4.30 0.00 1.76 1.71 0.93 0.80 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 75 I 7.81 3.58 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.70 0.89 0.00 0.00 76 T 8.39 4.48 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 77 G 8.63 4.20 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 0.00 0.00 0.00 78 G 7.81 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 W 9.23 4.74 0.00 3.29 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.19 4.53 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 81 P 0.00 4.68 0.00 2.02 2.12 0.00 3.65 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 1.99 1.95 0.00 82 Q 8.03 5.34 0.00 0.93 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.73 0.00 0.00 0.00 0.00 0.00 2.24 1.90 0.00 83 V 7.77 4.46 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 1.12 0.00 0.00 0.81 0.00 0.00 84 Y 9.22 5.25 0.00 3.23 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 85 I 8.75 4.93 2.13 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.85 0.94 0.00 0.00 86 G 9.42 4.54 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 0.00 0.00 0.00 87 M 8.28 4.17 0.00 1.77 0.85 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.26 0.00 88 K 8.79 4.63 0.00 1.75 1.57 0.00 1.88 0.00 0.00 1.65 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.16 1.14 7.81 89 V 8.10 4.53 1.96 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 0.79 0.00 0.00 0.87 0.00 0.00 90 G 9.00 4.34 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 0.00 91 S 8.95 4.33 0.00 3.85 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 92 T 7.42 4.73 4.20 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 1.18 0.00 0.00 93 N 8.64 4.26 0.00 2.63 2.76 0.00 0.00 6.96 7.57 0.00 0.00 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 S 7.88 4.23 0.00 3.97 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 D 7.80 4.69 0.00 2.75 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 96 Q 8.29 5.25 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 97 T 8.71 4.75 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 1.22 0.00 0.00 98 W 8.76 5.67 0.00 3.39 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 99 T 9.08 4.16 4.50 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 1.45 0.00 0.00 100 D 8.17 3.97 0.00 2.77 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 0.00 101 G 8.26 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 0.00 102 S 8.56 4.54 0.00 4.01 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 0.00 103 S 8.37 4.67 0.00 4.15 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.41 4.39 2.18 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 0.98 0.00 0.00 0.82 0.00 0.00 105 D 8.88 5.08 0.00 2.92 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 0.00 106 Y 8.14 4.77 0.00 3.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 D 8.56 4.36 0.00 2.67 2.44 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 0.00 108 G 5.96 2.40 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 0.00 109 W 6.91 4.76 0.00 3.14 3.24 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 0.00 110 V 9.03 3.87 2.53 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 1.11 0.00 0.00 1.27 0.00 0.00 111 S 8.54 4.32 0.00 3.91 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 9.25 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 0.00 0.00 0.00 113 E 8.12 4.45 0.00 2.33 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 2.68 2.99 0.00 114 P 0.00 4.28 0.00 1.71 1.24 0.00 2.88 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.48 0.00 115 N 8.86 4.91 0.00 2.76 2.99 0.00 0.00 6.73 8.05 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 0.00 116 N 8.43 4.88 0.00 2.57 2.58 0.00 0.00 6.87 7.23 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 0.00 117 G 7.76 3.76 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 0.00 118 P 0.00 4.51 0.00 2.15 2.18 0.00 3.89 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 1.96 1.96 0.00 119 N 8.38 4.22 0.00 2.88 2.88 0.00 0.00 6.88 7.59 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 0.00 120 S 7.38 4.59 0.00 3.77 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 0.00 121 R 8.66 4.64 0.00 1.69 1.22 0.00 2.21 0.00 0.00 2.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.24 0.00 122 G 9.12 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 0.00 0.00 0.00 0.00 123 A 8.95 5.18 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 0.00 124 I 8.89 4.44 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 1.47 0.55 0.93 0.00 0.00 125 A 8.92 4.91 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 0.00 0.00 0.00 0.00 0.00 126 A 8.98 4.31 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 0.00 127 G 8.37 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 8.78 4.44 0.00 2.57 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 0.00 129 Y 8.11 4.13 0.00 2.90 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 7.98 4.27 0.00 4.08 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 R 9.19 3.86 0.00 2.08 2.02 0.00 3.27 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 132 G 8.49 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 F 7.49 4.48 0.00 3.24 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 0.00 134 W 8.93 5.35 0.00 2.96 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 0.00 135 A 9.32 5.69 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 D 8.97 5.77 0.00 2.69 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 0.00 137 V 8.67 4.52 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.26 0.00 0.00 138 Y 8.33 3.90 0.00 3.39 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 0.00 139 S 9.06 4.24 0.00 4.02 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 0.00 140 N 8.05 4.73 0.00 2.72 2.94 0.00 0.00 7.04 7.79 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 0.00 141 N 8.07 4.34 0.00 2.40 1.45 0.00 0.00 6.86 6.96 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 0.00 142 N 8.50 4.96 0.00 2.64 2.90 0.00 0.00 6.79 7.45 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 0.00 143 F 9.02 5.41 0.00 2.56 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.47 5.01 0.00 1.64 1.79 0.00 1.60 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.56 1.25 7.81 145 Y 7.97 5.55 0.00 3.19 3.24 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 0.00 146 I 8.61 5.05 1.97 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 1.14 0.72 1.05 0.00 0.00 147 C 9.66 5.65 0.00 3.36 3.46 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 0.00 148 Q 9.30 5.35 0.00 1.73 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.94 0.00 0.00 0.00 0.00 0.00 2.46 2.26 0.00 149 L 7.98 4.38 0.00 1.20 1.30 -0.05 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 150 P 0.00 4.15 0.00 1.84 2.00 0.00 3.52 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 151 C 8.59 4.20 0.00 2.85 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 0.00 152 V 7.83 4.47 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 0.65 0.00 0.00 0.74 0.00 0.00 153 H 7.88 4.80 0.00 3.16 3.15 0.00 5.52 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 8.29 4.48 0.00 3.01 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 0.00 155 T 8.47 4.58 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 1.26 0.00 0.00 156 L 8.49 4.48 0.00 1.67 1.73 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 157 E 8.23 4.13 0.00 2.08 1.98 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 2.30 2.34 0.00