NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9681 8.3549 109.7364 45.4804 0.0000 172.5933 2 L 4.4704 8.0414 118.7572 50.9697 43.6553 176.0282 3 S 4.5358 9.9014 119.4749 57.7965 66.4005 174.9125 4 D 4.6997 8.7501 121.3364 57.5923 40.4665 179.3707 5 G 3.6460 8.0637 105.7363 47.7687 0.0000 175.5544 6 E 3.9039 8.2122 121.0103 58.9478 29.4038 179.2786 7 W 4.3734 8.0647 118.9455 59.9457 29.0380 178.5602 8 Q 4.0968 8.2023 117.5267 59.1086 28.2568 178.8137 9 L 4.0128 7.7803 119.4585 57.7348 41.5887 179.6017 10 V 3.7053 7.8995 118.0677 66.2670 31.5812 178.0484 11 L 4.1439 8.3724 118.6800 57.8590 41.2702 179.1141 12 N 4.3518 8.3158 116.0538 56.7867 39.3142 176.7747 13 V 3.7561 8.0328 119.6753 65.7610 31.5538 177.6462 14 W 4.1012 8.7569 128.4247 60.3497 30.1812 177.8846 15 G 3.7556 7.9209 104.8410 47.8912 0.0000 175.4129 16 K 3.9742 7.7287 120.0728 59.1095 31.9473 179.6099 17 V 2.7572 7.0326 117.8690 65.7365 31.1160 177.7242 18 E 3.8457 7.7512 116.5929 58.5359 29.3335 178.3512 19 A 4.2419 7.3018 118.3036 52.8877 20.0332 177.3314 20 D 4.6037 7.8368 114.9260 52.4187 43.4773 175.8763 21 V 3.5767 7.7041 124.3022 66.0686 32.2638 176.8681 22 A 4.0690 8.0068 120.1415 54.8402 17.9210 179.6613 23 G 3.5822 7.9605 105.3403 47.8027 0.0000 175.7463 24 H 4.1519 8.1303 118.7513 58.1705 28.7234 178.0233 25 G 3.6338 8.2915 107.9128 47.8563 0.0000 175.2835 26 Q 3.8282 8.0062 122.3706 58.9485 29.0961 178.2695 27 E 3.8636 7.7147 119.1253 59.3078 29.4185 179.6216 28 V 3.4774 7.7466 118.1344 65.9972 31.5840 178.1308 29 L 3.3759 7.5613 118.5387 57.5733 41.3583 179.5516 30 I 3.6558 7.5925 119.7104 64.3606 36.9340 178.7030 31 R 3.8521 7.8321 118.8778 58.9760 29.8454 178.7668 32 L 3.9035 7.7470 120.0183 58.3722 42.0073 179.0998 33 F 4.6509 8.0515 118.0104 60.6208 38.5993 177.8501 34 K 4.1617 8.0966 117.4058 59.0717 32.1075 179.2430 35 G 3.7729 8.1995 105.1918 46.2946 0.0000 174.0291 36 H 4.8279 8.1767 117.8687 52.3259 30.4765 171.8787 37 P 4.6401 0.0000 0.0000 64.6050 31.1128 177.5527 38 E 4.1227 8.2339 116.3544 59.4478 29.3551 178.9592 39 T 4.1154 8.6306 110.8283 63.9489 68.8197 176.3815 40 L 3.6757 8.0174 124.2165 57.8746 41.7661 178.3619 41 E 3.9764 7.7602 115.6837 59.5530 29.3370 178.9416 42 K 4.3810 7.9652 117.2497 56.5962 32.3961 176.6530 43 F 4.5477 8.3196 119.5573 55.4643 40.0980 175.9086 44 D 4.3358 8.7667 126.6435 57.4406 40.7742 179.3672 45 S 4.0279 7.9029 111.5557 60.6641 62.7220 174.8146 46 F 5.2175 8.0113 117.1783 56.7287 40.1749 176.6713 47 K 4.1849 7.9765 120.0073 59.0064 32.4586 177.7711 48 H 4.4161 8.1966 114.3101 57.1147 29.0723 175.2036 49 L 4.2841 7.7352 121.6119 54.3623 41.6187 176.7831 50 K 4.3786 9.5461 123.8258 56.8850 33.1709 176.8102 51 S 4.6042 7.4112 112.8018 55.8452 66.8747 174.4315 52 E 3.8755 8.7363 122.6096 59.6919 29.1346 178.6383 53 D 4.2992 8.0192 118.3183 57.3722 40.6971 178.5124 54 E 3.9496 7.7077 117.6292 59.6511 29.2785 178.9709 55 M 4.1357 8.2596 118.9796 58.3951 31.8061 179.0603 56 K 3.9829 8.5773 117.6678 59.1120 32.2395 178.8672 57 A 4.3172 7.6161 120.1596 53.0299 18.5458 177.3658 58 S 4.1068 7.3969 112.5027 58.3046 62.8702 174.4308 59 E 3.9831 8.9149 129.3531 59.5339 29.5765 178.2451 60 D 4.5252 8.1482 118.4816 57.0002 40.9425 178.3217 61 L 3.6299 7.8146 120.8490 57.8298 42.0313 178.9500 62 K 3.9047 7.7594 119.6767 59.4292 32.2729 178.9631 63 K 4.0102 8.0181 118.5039 59.7339 31.9911 178.8746 64 H 4.3819 8.6118 118.6917 59.0903 29.8390 177.3674 65 G 3.6369 8.2012 107.6294 47.9454 0.0000 174.9692 66 N 4.2988 8.1374 119.8280 56.6655 38.9473 177.0142 67 T 3.8809 7.8237 116.6998 66.5237 68.5325 176.8259 68 V 3.5722 7.7259 120.0228 66.2406 31.5913 178.2184 69 L 4.2691 7.9643 118.5622 57.7657 41.5162 179.7383 70 T 3.9359 8.3887 116.1762 66.5468 68.0317 176.4178 71 A 4.0007 7.9961 122.6656 55.2225 18.4303 179.5060 72 L 3.7895 8.0152 118.9364 58.0571 42.1305 179.2577 73 G 3.3464 8.4761 106.1168 47.6705 0.0000 175.8663 74 G 3.6028 7.6776 106.6049 47.5131 0.0000 175.6875 75 I 3.8585 7.2827 120.8501 64.1193 37.0786 178.4296 76 L 3.9539 7.6458 119.7945 57.8007 41.2025 179.7727 77 K 3.9118 7.6435 116.7644 58.5073 32.1840 178.5451 78 K 4.0488 7.7625 117.7067 55.3498 32.4819 176.6528 79 K 2.0000 8.4283 118.5243 56.4916 29.9668 174.9726 80 G 3.9307 7.9605 105.9199 45.9650 0.0000 174.1743 81 H 4.9123 7.3405 118.5007 55.7510 27.9988 175.0927 82 H 5.2387 7.3001 110.8059 54.5769 29.7983 176.0350 83 E 3.9536 8.6007 121.7446 60.2224 28.9301 179.0082 84 A 4.0042 7.9377 118.3796 55.3774 19.1461 179.0525 85 E 4.0627 8.1442 116.5591 59.3919 29.5557 178.9249 86 L 3.9329 8.0924 119.6732 57.2726 42.1941 178.9869 87 T 3.8817 7.8079 116.2473 66.2035 68.4137 174.4779 88 P 4.2754 0.0000 0.0000 65.9961 31.0675 178.0831 89 L 4.0194 7.5092 118.8135 57.8145 42.0102 178.7833 90 A 4.1897 8.4195 121.1387 55.2103 18.2397 179.5851 91 Q 3.9250 8.2691 116.7520 59.3134 28.8277 179.3698 92 S 3.9882 8.2884 115.2174 61.6862 63.0971 176.0989 93 H 4.2018 8.6479 119.5661 58.4903 28.2230 177.1192 94 A 2.5800 8.0616 123.5626 54.0270 17.9652 179.4180 95 T 3.9220 7.7556 107.4204 64.3514 69.1413 175.9603 96 K 3.9306 7.7588 121.5440 58.2864 32.5333 178.4964 97 H 4.1089 7.7469 122.1791 57.3283 29.9277 176.0753 98 K 3.2761 6.6622 112.9156 56.2257 29.1046 176.2958 99 I 4.3183 8.0229 119.1567 58.7909 37.9623 175.0536 100 P 4.7928 0.0000 0.0000 62.5884 31.9974 177.9590 101 V 3.7943 8.7381 113.1190 63.9506 31.2968 179.0220 102 K 3.9846 7.9253 118.3635 59.8731 32.3130 178.6384 103 Y 4.1083 7.7267 118.2489 60.8827 37.7251 178.1752 104 L 4.2057 7.9392 119.9803 57.8901 41.6827 179.3746 105 E 4.1170 7.9122 118.0917 59.1367 29.4778 179.1082 106 F 4.6076 7.9126 118.1825 60.7546 38.9949 177.5045 107 I 3.8983 8.1669 118.1974 63.8922 37.7705 178.0933 108 S 4.2246 8.2933 116.4739 61.5554 62.5748 176.2402 109 E 4.0335 8.4531 121.8824 59.1499 29.3486 178.6361 110 A 4.3714 8.0240 122.2557 54.5489 18.3815 179.5374 111 I 3.6309 7.8839 118.2740 64.7736 37.2180 178.6684 112 I 3.7599 7.8465 120.3738 64.5959 36.8255 178.5597 113 Q 4.0194 8.4017 119.0808 58.8573 28.4976 179.0896 114 V 3.5106 7.9665 119.3886 65.8927 31.5605 178.0830 115 L 3.7342 7.6168 118.6941 57.6738 41.0946 179.2456 116 Q 4.2189 7.7800 118.2316 59.3523 29.0860 178.3195 117 S 4.2288 7.9149 114.8219 61.6586 63.0420 176.4686 118 K 4.1043 8.2723 119.2554 57.6610 33.2544 176.8676 119 H 5.0475 8.4731 116.4066 53.7542 29.3544 172.9350 120 P 4.3782 0.0000 0.0000 65.8144 31.6014 178.4069 121 G 3.7556 8.1175 106.6008 47.4237 0.0000 173.7977 122 D 4.6934 8.0093 117.2048 54.6520 42.2998 177.1700 123 F 5.0527 8.0554 122.9060 58.2390 36.7533 174.9104 124 G 3.9077 7.6367 108.0128 43.6206 0.0000 170.7200 125 A 3.8746 8.4437 120.7404 55.4269 18.3328 179.7935 126 D 4.1947 7.9374 116.3788 57.5369 41.0392 178.8223 127 A 3.9679 7.7600 120.6780 55.1076 18.4171 179.3605 128 Q 3.4427 8.0682 117.0072 58.9106 28.7206 179.5274 129 G 3.4985 8.0050 106.3061 47.6586 0.0000 175.6487 130 A 3.8344 7.9306 123.3141 55.0285 18.3743 179.3954 131 M 4.0218 8.0964 116.7760 58.9254 32.2719 178.4399 132 S 4.1608 8.3473 113.3661 61.1384 62.5167 176.2887 133 K 3.9182 8.0802 121.3308 59.0766 31.7131 179.1695 134 A 3.8020 7.8778 121.1741 55.1394 18.2328 179.7567 135 L 4.0957 8.1712 117.6512 57.8579 41.6619 179.2837 136 E 3.9971 8.5367 119.5988 58.9346 29.4066 178.7002 137 L 3.9367 7.9730 120.5450 58.0420 42.2533 178.5462 138 F 4.0815 8.2642 120.5430 61.5270 39.2830 177.2897 139 R 3.4939 8.3876 117.8355 59.1412 29.9660 178.6736 140 N 4.2092 8.3983 116.6325 56.6637 38.5493 177.2498 141 D 4.3670 8.2953 120.1299 57.1057 40.7264 178.8133 142 M 3.6427 7.4949 119.2652 58.2759 32.0160 178.6021 143 A 3.6475 7.7180 120.5494 54.9404 18.1082 179.5678 144 A 3.9576 7.7727 119.0355 55.0339 18.4427 179.7957 145 K 3.9808 7.7858 117.8847 59.7277 32.2355 178.6269 146 Y 4.4541 8.4764 117.7291 61.0338 37.7196 178.6097 147 K 3.8930 8.1930 118.7322 59.1836 32.8237 178.5801 148 E 4.0469 7.8312 119.3736 58.4182 29.6786 177.7942 149 L 4.3223 7.7832 117.5410 55.2587 41.8844 177.3630 150 G 3.8491 7.7061 107.0379 45.8711 0.0000 173.0237 151 F 4.6251 9.4328 122.6107 57.3013 40.2524 177.6339 152 Q 3.2600 6.5380 126.2411 56.7383 28.8535 177.3570 153 G 3.7629 10.5630 113.3321 46.9015 0.0000 173.3015 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 G 8.35 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 2 L 8.04 4.47 0.00 0.83 0.69 0.60 -0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.90 4.54 0.00 4.01 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 4 D 8.75 4.70 0.00 2.77 2.85 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 G 8.06 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 0.00 0.00 0.00 6 E 8.21 3.90 0.00 2.01 1.70 0.00 0.00 0.00 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 2.26 0.00 7 W 8.06 4.37 0.00 3.63 3.25 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 0.00 8 Q 8.20 4.10 0.00 2.30 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.65 2.61 0.00 9 L 7.78 4.01 0.00 1.86 1.75 0.91 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.90 3.71 2.47 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 1.25 0.00 0.00 0.83 0.00 0.00 11 L 8.37 4.14 0.00 1.92 1.80 0.96 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 12 N 8.32 4.35 0.00 3.05 2.94 0.00 0.00 7.22 8.53 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 13 V 8.03 3.76 2.28 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 1.07 0.00 0.00 1.13 0.00 0.00 14 W 8.76 4.10 0.00 3.64 3.19 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 0.00 15 G 7.92 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 16 K 7.73 3.97 0.00 1.77 1.41 0.00 1.56 0.00 0.00 1.46 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.36 7.81 17 V 7.03 2.76 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 0.01 0.00 0.00 18 E 7.75 3.85 0.00 2.04 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 2.44 2.49 0.00 19 A 7.30 4.24 1.25 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 0.00 0.00 0.00 20 D 7.84 4.60 0.00 2.69 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 21 V 7.70 3.58 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 1.09 0.00 0.00 0.92 0.00 0.00 22 A 8.01 4.07 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 23 G 7.96 3.58 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 0.00 0.00 0.00 24 H 8.13 4.15 0.00 3.12 3.21 0.00 5.83 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 25 G 8.29 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 26 Q 8.01 3.83 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.73 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 27 E 7.71 3.86 0.00 2.15 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 0.00 2.24 2.36 0.00 28 V 7.75 3.48 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 0.98 0.00 0.00 0.93 0.00 0.00 29 L 7.56 3.38 0.00 1.57 1.00 0.83 0.57 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 30 I 7.59 3.66 1.77 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 1.47 0.70 0.87 0.00 0.00 31 R 7.83 3.85 0.00 1.91 1.93 0.00 3.08 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 32 L 7.75 3.90 0.00 1.68 1.41 1.03 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.05 4.65 0.00 3.03 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 34 K 8.10 4.16 0.00 1.76 1.84 0.00 1.85 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.58 7.81 35 G 8.20 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 36 H 8.18 4.83 0.00 2.92 2.88 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.64 0.00 2.16 2.11 0.00 3.83 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 2.10 2.10 0.00 38 E 8.23 4.12 0.00 2.30 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 2.48 2.59 0.00 39 T 8.63 4.12 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 0.82 0.00 0.00 40 L 8.02 3.68 0.00 1.54 1.82 -0.01 0.42 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 41 E 7.76 3.98 0.00 2.24 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 2.40 2.45 0.00 42 K 7.97 4.38 0.00 1.45 1.83 0.00 2.13 0.00 0.00 1.98 0.00 0.00 3.22 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.67 1.83 7.81 43 F 8.32 4.55 0.00 3.13 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 44 D 8.77 4.34 0.00 2.63 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 45 S 7.90 4.03 0.00 3.19 3.75 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 46 F 8.01 5.22 0.00 2.91 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 47 K 7.98 4.18 0.00 1.89 2.05 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.76 1.34 7.81 48 H 8.20 4.42 0.00 3.30 3.47 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.74 4.28 0.00 1.60 1.59 0.90 0.86 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 50 K 9.55 4.38 0.00 1.67 1.82 0.00 1.72 0.00 0.00 1.93 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.49 7.81 51 S 7.41 4.60 0.00 3.98 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.74 3.88 0.00 2.04 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 2.35 2.38 0.00 53 D 8.02 4.30 0.00 2.78 2.68 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 54 E 7.71 3.95 0.00 2.03 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 2.31 2.32 0.00 55 M 8.26 4.14 0.00 2.01 2.21 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.55 0.00 56 K 8.58 3.98 0.00 1.77 1.84 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.75 7.81 57 A 7.62 4.32 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 58 S 7.40 4.11 0.00 3.87 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 59 E 8.91 3.98 0.00 2.09 1.94 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 2.42 2.42 0.00 60 D 8.15 4.53 0.00 3.01 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 61 L 7.81 3.63 0.00 1.30 1.46 0.66 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.76 3.90 0.00 1.79 1.90 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.45 7.81 63 K 8.02 4.01 0.00 2.09 1.91 0.00 1.76 0.00 0.00 1.61 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.71 7.81 64 H 8.61 4.38 0.00 3.69 3.51 0.00 5.80 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 65 G 8.20 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 66 N 8.14 4.30 0.00 2.79 3.02 0.00 0.00 7.29 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 67 T 7.82 3.88 4.40 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 1.26 0.00 0.00 68 V 7.73 3.57 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 1.08 0.00 0.00 0.98 0.00 0.00 69 L 7.96 4.27 0.00 1.82 1.89 0.84 0.91 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 70 T 8.39 3.94 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 71 A 8.00 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.02 3.79 0.00 1.61 1.63 0.14 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.48 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 0.00 0.00 0.00 74 G 7.68 3.60 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 0.00 0.00 0.00 75 I 7.28 3.86 1.87 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.49 0.90 0.00 0.00 76 L 7.65 3.95 0.00 1.14 1.52 -0.20 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.64 3.91 0.00 1.75 1.80 0.00 1.85 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.45 1.39 7.81 78 K 7.76 4.05 0.00 1.65 1.77 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.62 1.83 7.81 79 K 8.43 2.00 0.00 1.11 0.74 0.00 1.42 0.00 0.00 1.36 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.34 0.74 7.81 80 G 7.96 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 81 H 7.34 4.91 0.00 3.20 3.24 0.00 5.63 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.30 5.24 0.00 3.27 3.43 0.00 5.67 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.60 3.95 0.00 2.09 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 0.00 2.43 2.49 0.00 84 A 7.94 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 85 E 8.14 4.06 0.00 2.24 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 2.39 2.43 0.00 86 L 8.09 3.93 0.00 1.80 1.74 0.75 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.81 3.88 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 1.27 0.00 0.00 88 P 0.00 4.28 0.00 2.29 2.34 0.00 3.64 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.06 0.00 89 L 7.51 4.02 0.00 1.84 1.87 1.01 0.97 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 90 A 8.42 4.19 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 91 Q 8.27 3.92 0.00 2.41 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 92 S 8.29 3.99 0.00 3.87 4.09 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 93 H 8.65 4.20 0.00 3.52 3.57 0.00 5.81 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 94 A 8.06 2.58 0.93 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 95 T 7.76 3.92 4.14 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 1.12 0.00 0.00 96 K 7.76 3.93 0.00 1.61 1.20 0.00 1.58 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.27 7.81 97 H 7.75 4.11 0.00 2.95 3.18 0.00 5.81 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 6.66 3.28 0.00 1.86 1.81 0.00 1.56 0.00 0.00 1.49 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.28 1.41 7.81 99 I 8.02 4.32 2.09 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 1.39 0.95 1.22 0.00 0.00 100 P 0.00 4.79 0.00 1.97 2.00 0.00 3.36 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 0.73 1.38 0.00 101 V 8.74 3.79 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 1.00 0.00 0.00 0.85 0.00 0.00 102 K 7.93 3.98 0.00 1.46 1.91 0.00 1.54 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.34 1.44 7.81 103 Y 7.73 4.11 0.00 3.25 3.15 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 0.00 104 L 7.94 4.21 0.00 1.86 1.82 0.67 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 105 E 7.91 4.12 0.00 2.00 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 2.37 2.46 0.00 106 F 7.91 4.61 0.00 3.19 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 0.00 107 I 8.17 3.90 2.02 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.38 1.14 0.00 0.00 108 S 8.29 4.22 0.00 4.17 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 0.00 109 E 8.45 4.03 0.00 2.16 2.34 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 2.39 2.40 0.00 110 A 8.02 4.37 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 0.00 111 I 7.88 3.63 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.57 1.03 0.00 0.00 112 I 7.85 3.76 2.10 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.71 1.18 0.00 0.00 113 Q 8.40 4.02 0.00 2.25 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.49 0.00 114 V 7.97 3.51 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 0.93 0.00 0.00 0.88 0.00 0.00 115 L 7.62 3.73 0.00 0.73 0.49 0.67 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 7.78 4.22 0.00 2.34 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.95 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 117 S 7.91 4.23 0.00 3.92 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 0.00 118 K 8.27 4.10 0.00 1.28 1.51 0.00 1.39 0.00 0.00 1.38 0.00 0.00 2.85 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.28 1.50 7.81 119 H 8.47 5.05 0.00 3.15 3.20 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.38 0.00 2.20 2.34 0.00 3.83 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 121 G 8.12 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 0.00 122 D 8.01 4.69 0.00 2.74 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 0.00 123 F 8.06 5.05 0.00 3.07 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 0.00 124 G 7.64 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 0.00 125 A 8.44 3.87 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 0.00 126 D 7.94 4.19 0.00 2.64 2.68 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 0.00 127 A 7.76 3.97 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 0.00 128 Q 8.07 3.44 0.00 1.89 1.92 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 1.49 1.45 0.00 129 G 8.01 3.50 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 0.00 130 A 7.93 3.83 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 0.00 131 M 8.10 4.02 0.00 2.45 2.39 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.86 0.00 132 S 8.35 4.16 0.00 3.96 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 K 8.08 3.92 0.00 1.92 1.66 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.38 7.81 134 A 7.88 3.80 1.20 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 0.00 135 L 8.17 4.10 0.00 1.77 1.83 1.01 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.54 4.00 0.00 2.05 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 0.00 2.31 2.32 0.00 137 L 7.97 3.94 0.00 1.86 2.00 1.00 1.19 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 0.00 138 F 8.26 4.08 0.00 3.21 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 0.00 139 R 8.39 3.49 0.00 1.99 1.87 0.00 3.18 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.99 0.00 140 N 8.40 4.21 0.00 2.81 2.84 0.00 0.00 7.07 7.62 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 0.00 141 D 8.30 4.37 0.00 2.68 2.68 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 0.00 142 M 7.49 3.64 0.00 1.37 1.59 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.84 0.00 143 A 7.72 3.65 1.24 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 0.00 144 A 7.77 3.96 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 0.00 145 K 7.79 3.98 0.00 2.10 1.94 0.00 1.53 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.55 7.81 146 Y 8.48 4.45 0.00 3.27 3.27 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 0.00 147 K 8.19 3.89 0.00 2.02 2.17 0.00 1.31 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.67 1.47 7.81 148 E 7.83 4.05 0.00 2.01 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 0.00 2.35 2.36 0.00 149 L 7.78 4.32 0.00 1.99 1.73 1.02 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.71 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 0.00 151 F 9.43 4.63 0.00 2.82 2.85 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 0.00 152 Q 6.54 3.26 0.00 1.81 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.84 0.00 0.00 0.00 0.00 0.00 1.69 1.16 0.00 153 G 10.56 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