NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 A 4.3343 8.1227 123.5823 52.4410 19.9340 176.7365 4 C 4.7374 8.2271 120.7392 52.8339 44.0457 172.2105 5 A 4.2455 8.9971 127.1637 51.4332 21.2078 177.1467 6 M 3.9793 8.4438 119.8427 58.5920 32.2328 178.6476 7 L 3.9279 7.7536 118.7910 57.9017 42.0749 178.9151 8 E 3.9721 8.1109 117.9461 59.4508 29.2473 179.7604 9 R 3.6856 7.9294 117.6953 59.1951 30.2710 178.5259 10 A 3.9619 8.0121 120.6794 55.2715 18.2382 179.7062 11 K 3.8288 8.4028 118.1225 59.6405 32.2710 179.1175 12 V 3.0547 7.9135 118.7978 65.7443 31.2272 177.9603 13 K 3.9677 8.2903 118.3624 59.6683 31.9753 178.5841 14 D 4.5006 8.0958 118.9580 57.9387 40.7735 179.4479 15 E 4.0147 8.4327 118.4721 59.0835 29.3779 179.0192 16 W 4.6347 8.8871 128.5977 60.7166 30.6157 177.4514 17 A 4.0028 8.6597 120.8815 55.2818 17.5986 179.3163 18 K 3.8433 7.9244 116.0773 59.6894 32.3511 178.5832 19 A 4.0927 8.1983 119.8658 55.4318 18.6893 178.8008 20 Y 3.1252 7.6909 118.5529 59.0699 38.5139 177.5002 21 G 3.7567 7.3032 108.2081 44.9662 0.0000 172.0271 22 I 3.9876 8.0229 117.2012 62.2355 37.9666 176.3138 23 G 3.8294 7.0308 105.4929 46.2239 0.0000 173.9833 24 A 4.0040 8.0133 122.8852 53.8145 19.0954 179.5615 25 A 3.9805 7.8933 119.3563 55.1475 18.3814 179.9134 26 R 3.9894 7.4126 117.9606 58.8776 30.0563 178.9190 27 S 4.1315 8.0916 112.3973 61.3828 62.2784 175.6698 28 K 3.8344 7.9879 122.1162 59.6467 31.9024 178.0690 29 F 4.0976 8.7076 121.0981 61.3328 39.3218 176.9695 30 G 3.9289 8.8208 105.5779 48.3595 0.0000 175.0890 31 D 4.4750 8.4886 121.8243 56.7971 40.7796 178.9837 32 A 3.7593 8.0351 121.3026 54.9750 18.3464 179.0108 33 L 3.7284 7.6012 120.3755 57.5573 41.9938 179.4491 34 W 3.4382 7.9387 118.3661 59.2243 28.9665 178.4725 35 R 3.8874 7.8678 118.8658 59.4757 29.3963 178.2961 36 N 3.8528 7.6899 116.0337 56.0902 38.4855 177.2231 37 V 3.2825 7.1038 119.6773 66.2544 31.5233 177.8952 38 F 4.9240 8.1393 115.9350 59.5953 38.6109 177.0243 39 N 4.6572 7.7240 115.0611 55.5387 38.8790 176.6223 40 Y 4.6029 8.3579 117.9061 59.7793 39.3976 176.2345 41 A 4.7846 8.2312 122.5332 48.2688 19.0236 174.2183 42 P 4.9118 0.0000 0.0000 64.7800 31.5395 178.2175 43 N 4.4952 8.2367 115.1975 55.4469 38.5790 176.3613 44 A 4.3819 8.3019 121.7830 53.6562 18.4426 179.3912 45 R 2.8204 7.4836 117.1589 59.1344 29.9001 178.1270 46 D 4.3451 7.3783 116.1793 57.2455 40.7768 178.6514 47 I 3.7851 7.3633 119.6214 63.4012 37.2530 176.5151 48 F 4.8284 8.3641 118.1107 57.2791 39.4226 177.6915 49 E 4.1402 8.1520 120.9057 58.7695 29.8134 178.8992 50 S 4.2483 8.1227 115.0663 60.7721 62.9903 174.9686 51 V 4.3330 7.5230 113.3852 61.0867 32.4074 175.1936 52 N 4.1142 8.0633 114.5989 54.9166 37.2930 174.9511 53 S 3.7366 7.6896 110.1496 59.3906 64.2683 176.0728 54 K 3.8413 8.0243 120.9536 59.1794 31.9920 176.6692 55 D 4.6320 7.3605 121.1776 52.2704 40.2644 176.0884 56 M 3.9197 8.4465 124.3537 56.7889 32.3447 176.3136 57 A 4.7731 8.0426 119.3416 52.2752 20.1007 177.2547 58 S 4.4022 8.3581 114.0434 57.6148 65.0829 173.4591 59 P 4.2419 0.0000 0.0000 66.1852 30.7340 178.3329 60 E 3.9543 8.3031 117.7878 59.5449 29.4232 179.1224 61 F 4.2901 8.3478 120.2544 61.0806 39.4197 177.3944 62 K 3.8733 8.5430 118.3705 59.3277 31.8158 179.0417 63 A 3.9743 8.4383 121.4815 55.2976 18.1981 179.1019 64 H 3.9711 7.6924 116.7072 59.4883 29.8903 177.2165 65 I 3.2745 7.3208 121.6612 64.3776 36.8855 177.9869 66 A 4.0785 8.2040 121.5561 55.3705 18.1154 179.9546 67 R 3.9083 7.9121 116.5454 59.4017 30.2173 179.6862 68 V 3.7114 8.0558 119.3288 64.9331 31.3727 178.3547 69 L 4.2733 8.5807 120.2686 57.4852 41.4376 179.6765 70 G 3.9654 8.5880 105.9714 47.6558 0.0000 175.9774 71 G 3.5993 8.3904 108.1460 47.6656 0.0000 175.4301 72 L 3.8288 8.2977 122.8396 57.5264 41.6031 179.2085 73 D 4.1345 8.5332 117.9491 57.3763 41.0996 178.4022 74 R 3.9597 8.0789 115.8499 59.0539 29.4522 178.7068 75 V 3.6939 7.7975 119.0080 65.7535 31.6091 177.7912 76 I 3.4607 7.5476 119.8986 64.5091 36.7583 178.5797 77 S 4.1657 8.1162 113.4362 61.1192 62.8519 175.3391 78 M 4.3853 7.6635 120.8760 55.0358 31.7269 177.6353 79 L 3.9829 7.9097 121.5158 57.3653 41.8933 177.2123 80 D 4.8472 7.7708 116.7780 52.8500 40.1480 177.1100 81 N 4.8965 8.1134 117.7011 52.0591 40.9361 174.1134 82 Q 3.9248 8.6643 122.4299 59.7216 28.9618 177.9669 83 A 3.6914 8.1577 118.0585 56.6078 18.3402 179.5060 84 T 3.7968 7.7415 111.0278 66.1498 69.0915 176.2694 85 L 3.8408 7.9114 122.3470 58.5723 42.0119 178.8092 86 D 4.2669 8.5450 118.3818 57.2849 40.7342 178.6323 87 A 3.9345 7.6021 120.9233 55.3474 18.3532 179.2187 88 D 4.2486 8.4781 116.8508 57.4722 41.2747 178.3705 89 L 3.9154 8.4656 119.7014 57.6595 41.6070 179.2309 90 A 3.9498 8.4563 121.0792 55.3574 18.4004 179.0751 91 H 4.0611 8.3412 116.7079 59.6141 30.0565 177.3975 92 L 4.0422 8.1622 120.8310 57.6553 41.3796 179.5083 93 K 4.0766 8.0278 120.9040 59.1766 31.9391 178.8929 94 S 4.1546 7.7785 114.0740 61.9345 62.7934 176.5642 95 Q 4.1095 7.8163 119.3263 58.4186 28.7803 177.3371 96 H 4.6678 8.0892 116.2813 56.9443 29.5810 176.8344 97 D 4.4259 8.6365 121.8171 57.0405 40.5735 177.2191 98 P 4.4176 0.0000 0.0000 65.0224 31.3853 177.4924 99 R 4.1796 7.8748 116.7272 55.6138 31.6576 176.3997 100 T 3.4621 7.3701 106.3092 62.5384 67.6996 171.0078 101 I 4.3571 7.2664 124.2852 59.9142 39.5469 175.4654 102 D 4.4535 8.6876 124.8304 53.5406 41.4497 174.9502 103 P 4.4821 0.0000 0.0000 65.7665 31.4594 178.4884 104 V 3.7412 8.2624 118.7463 66.0681 31.1602 177.5396 105 N 4.4800 8.8327 116.8404 56.3877 38.4103 177.1582 106 F 4.0719 8.6052 118.7446 59.7271 38.8699 177.8569 107 V 3.8219 8.1491 118.8034 65.7205 31.3643 177.8561 108 V 3.6514 7.9685 117.5814 66.1721 31.2298 177.1423 109 F 3.7040 8.4690 120.3139 61.4415 39.0641 176.6851 110 R 3.0094 7.9665 117.8743 59.4337 29.6295 178.1310 111 K 3.8506 8.1775 117.5570 59.5205 32.0240 178.7806 112 A 3.4996 8.3040 120.9379 55.1275 18.1540 179.3481 113 L 3.4527 8.0618 119.4632 58.1875 42.0394 179.0305 114 I 3.3185 7.6175 119.5181 64.5792 37.0897 177.6981 115 A 3.7476 7.8864 121.2172 55.5924 17.9849 179.4702 116 T 3.4705 7.8529 113.1930 66.6507 68.5189 177.0859 117 V 3.6906 8.0593 119.7600 65.8930 31.4760 177.8874 118 A 3.5485 7.0887 120.7779 54.9536 17.8721 179.8213 119 G 3.4812 8.0727 103.0711 47.7812 0.0000 175.1576 120 T 4.3083 7.2479 116.5042 65.4570 69.2868 176.6109 121 F 4.3001 8.8675 123.0740 59.9060 39.8443 174.5662 122 G 3.8788 8.3247 103.9481 43.8454 0.0000 174.8263 123 V 3.7931 8.3445 111.9057 63.7520 31.5232 177.6966 124 C 4.4139 8.2457 116.5120 61.4103 28.4315 173.6224 125 F 3.9502 8.4721 121.6422 59.1545 39.2483 175.6197 126 D 4.5509 8.1164 127.6405 52.2920 39.7702 176.5349 127 V 3.7335 8.1168 124.5325 65.3027 31.5988 175.2421 128 P 4.2430 0.0000 0.0000 66.0342 31.0997 177.8923 129 A 4.5587 8.7762 122.5451 53.8996 18.2235 179.7220 130 W 3.7260 8.2301 117.2063 59.9583 29.2542 178.7161 131 Q 4.3182 8.6156 118.3558 59.0285 28.0304 179.1637 132 G 3.6936 8.3747 108.2255 47.7647 0.0000 175.2463 133 C 4.3107 8.3235 119.6698 59.0760 40.6632 175.6596 134 Y 4.0418 8.6681 121.9709 60.7149 38.3028 177.7201 135 N 4.2504 8.3224 117.3870 56.3180 38.6920 177.2131 136 I 3.4347 7.3879 121.2660 64.4421 37.0437 178.5888 137 I 3.5436 7.1166 118.9069 64.1487 36.9565 178.1101 138 A 3.7074 7.4917 121.7338 54.9088 17.9146 179.3395 139 K 3.7763 8.3223 117.5879 59.8344 32.3671 178.7501 140 G 3.7373 7.5977 104.2903 47.9293 0.0000 175.0580 141 I 3.9620 7.7697 121.9337 62.8703 37.8840 176.4662 142 T 4.4223 7.9120 109.4141 66.1211 68.4652 177.6460 143 G 3.8845 6.2282 109.4646 47.0949 0.0000 174.6627 144 S 4.6363 7.2328 122.8082 58.1480 62.1631 174.7820 145 D 4.3181 8.3123 116.0275 54.8557 39.1408 176.7642 146 A 4.4912 9.2900 121.0981 51.9905 22.6431 176.2208 147 A 4.1666 7.9328 125.6042 53.0861 19.1343 176.6446 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 3 A 8.12 4.33 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 4 C 8.23 4.74 0.00 2.86 2.89 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 5 A 9.00 4.25 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 6 M 8.44 3.98 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.67 0.00 7 L 7.75 3.93 0.00 1.70 1.67 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.11 3.97 0.00 2.12 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 2.36 2.40 0.00 9 R 7.93 3.69 0.00 1.95 1.87 0.00 3.09 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.91 0.00 10 A 8.01 3.96 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.40 3.83 0.00 1.85 1.89 0.00 1.63 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.42 7.81 12 V 7.91 3.05 1.63 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 -0.48 0.00 0.00 0.53 0.00 0.00 13 K 8.29 3.97 0.00 1.94 1.90 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.64 7.81 14 D 8.10 4.50 0.00 3.00 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 15 E 8.43 4.01 0.00 2.22 1.54 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 1.67 2.35 0.00 16 W 8.89 4.63 0.00 3.72 3.47 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 17 A 8.66 4.00 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 18 K 7.92 3.84 0.00 2.02 2.43 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.12 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.52 7.81 19 A 8.20 4.09 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 20 Y 7.69 3.13 0.00 1.43 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 0.00 0.00 0.00 0.00 21 G 7.30 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 22 I 8.02 3.99 1.79 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.56 0.84 0.00 0.00 23 G 7.03 3.83 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 0.00 24 A 8.01 4.00 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 25 A 7.89 3.98 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 26 R 7.41 3.99 0.00 1.82 1.79 0.00 2.21 0.00 0.00 2.68 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.41 0.00 27 S 8.09 4.13 0.00 3.91 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 28 K 7.99 3.83 0.00 1.90 2.05 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.47 7.81 29 F 8.71 4.10 0.00 3.25 3.33 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 30 G 8.82 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 31 D 8.49 4.47 0.00 2.91 2.76 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 32 A 8.04 3.76 1.15 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 0.00 0.00 33 L 7.60 3.73 0.00 0.93 1.44 0.08 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 34 W 7.94 3.44 0.00 3.37 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 35 R 7.87 3.89 0.00 1.94 2.00 0.00 3.04 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.67 0.00 36 N 7.69 3.85 0.00 2.46 1.89 0.00 0.00 6.67 7.83 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 37 V 7.10 3.28 1.60 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 1.02 0.00 0.00 -0.06 0.00 0.00 38 F 8.14 4.92 0.00 3.14 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 39 N 7.72 4.66 0.00 2.89 2.96 0.00 0.00 7.00 7.50 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 40 Y 8.36 4.60 0.00 3.03 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 8.23 4.78 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 42 P 0.00 4.91 0.00 2.29 2.40 0.00 3.94 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.98 0.00 43 N 8.24 4.50 0.00 2.88 2.93 0.00 0.00 7.06 7.54 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 44 A 8.30 4.38 1.69 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 45 R 7.48 2.82 0.00 1.30 1.58 0.00 2.76 0.00 0.00 2.90 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.50 0.00 46 D 7.38 4.35 0.00 2.76 2.70 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 0.00 0.00 0.00 47 I 7.36 3.79 1.77 0.00 0.00 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 1.47 0.53 0.38 0.00 0.00 48 F 8.36 4.83 0.00 3.24 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 49 E 8.15 4.14 0.00 2.12 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 0.00 2.33 2.31 0.00 50 S 8.12 4.25 0.00 3.88 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 51 V 7.52 4.33 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 0.67 0.00 0.00 1.12 0.00 0.00 52 N 8.06 4.11 0.00 2.93 2.83 0.00 0.00 7.02 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 53 S 7.69 3.74 0.00 3.66 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.02 3.84 0.00 1.71 1.86 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.34 7.81 55 D 7.36 4.63 0.00 2.72 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 M 8.45 3.92 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.74 0.00 57 A 8.04 4.77 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 58 S 8.36 4.40 0.00 4.24 4.22 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 59 P 0.00 4.24 0.00 2.30 2.38 0.00 3.75 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 60 E 8.30 3.95 0.00 2.15 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 2.44 2.48 0.00 61 F 8.35 4.29 0.00 3.36 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 62 K 8.54 3.87 0.00 1.96 1.85 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.53 7.81 63 A 8.44 3.97 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 H 7.69 3.97 0.00 3.08 2.99 0.00 5.81 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 65 I 7.32 3.27 1.83 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 -0.36 1.06 0.00 0.00 66 A 8.20 4.08 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 67 R 7.91 3.91 0.00 2.06 2.02 0.00 3.18 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.82 0.00 68 V 8.06 3.71 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1.25 0.00 0.00 69 L 8.58 4.27 0.00 2.11 1.91 1.32 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 70 G 8.59 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 71 G 8.39 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 72 L 8.30 3.83 0.00 1.87 1.28 1.14 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.53 4.13 0.00 3.02 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 74 R 8.08 3.96 0.00 2.02 2.11 0.00 3.16 0.00 0.00 3.18 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.72 0.00 75 V 7.80 3.69 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 0.91 0.00 0.00 0.95 0.00 0.00 76 I 7.55 3.46 1.40 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.27 0.66 0.00 0.00 77 S 8.12 4.17 0.00 4.04 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 0.00 78 M 7.66 4.39 0.00 2.03 2.26 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.79 0.00 79 L 7.91 3.98 0.00 1.60 1.64 0.72 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 80 D 7.77 4.85 0.00 2.75 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 81 N 8.11 4.90 0.00 2.74 2.76 0.00 0.00 7.21 7.47 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 82 Q 8.66 3.92 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.47 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 83 A 8.16 3.69 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 84 T 7.74 3.80 4.22 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 1.19 0.00 0.00 85 L 7.91 3.84 0.00 1.96 1.87 0.88 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 86 D 8.55 4.27 0.00 2.86 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 87 A 7.60 3.93 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 88 D 8.48 4.25 0.00 2.84 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 89 L 8.47 3.92 0.00 1.84 1.63 0.88 0.65 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 90 A 8.46 3.95 1.35 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 91 H 8.34 4.06 0.00 3.34 3.55 0.00 5.80 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 92 L 8.16 4.04 0.00 1.90 1.72 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 93 K 8.03 4.08 0.00 2.00 1.96 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.50 7.81 94 S 7.78 4.15 0.00 4.04 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 95 Q 7.82 4.11 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.48 0.00 96 H 8.09 4.67 0.00 3.27 3.44 0.00 5.84 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 D 8.64 4.43 0.00 2.74 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 98 P 0.00 4.42 0.00 2.21 2.18 0.00 3.67 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 1.98 2.04 0.00 99 R 7.87 4.18 0.00 1.97 2.00 0.00 3.33 0.00 0.00 3.23 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 100 T 7.37 3.46 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 0.00 101 I 7.27 4.36 2.09 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.69 1.06 0.00 0.00 102 D 8.69 4.45 0.00 2.76 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 0.00 103 P 0.00 4.48 0.00 2.29 2.30 0.00 3.81 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.99 0.00 104 V 8.26 3.74 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 1.10 0.00 0.00 1.08 0.00 0.00 105 N 8.83 4.48 0.00 3.10 2.99 0.00 0.00 6.94 7.67 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 0.00 106 F 8.61 4.07 0.00 3.45 3.29 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 0.00 107 V 8.15 3.82 2.41 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 1.07 0.00 0.00 1.07 0.00 0.00 108 V 7.97 3.65 2.41 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 1.24 0.00 0.00 1.04 0.00 0.00 109 F 8.47 3.70 0.00 3.14 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 0.00 110 R 7.97 3.01 0.00 1.48 2.05 0.00 3.31 0.00 0.00 3.63 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.15 0.00 111 K 8.18 3.85 0.00 2.12 1.89 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.75 1.61 7.81 112 A 8.30 3.50 0.75 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 0.00 113 L 8.06 3.45 0.00 1.30 1.55 1.02 1.39 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 0.00 114 I 7.62 3.32 1.97 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.68 0.81 0.00 0.00 115 A 7.89 3.75 1.23 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 0.00 0.00 116 T 7.85 3.47 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 0.19 0.00 0.00 117 V 8.06 3.69 1.54 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 0.84 0.00 0.00 1.14 0.00 0.00 118 A 7.09 3.55 0.45 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 0.00 119 G 8.07 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 T 7.25 4.31 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 1.32 0.00 0.00 121 F 8.87 4.30 0.00 3.09 3.21 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 0.00 122 G 8.32 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 0.00 123 V 8.34 3.79 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.97 0.00 0.00 124 C 8.25 4.41 0.00 3.70 3.28 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 0.00 125 F 8.47 3.95 0.00 3.17 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 0.00 126 D 8.12 4.55 0.00 2.64 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 0.00 127 V 8.12 3.73 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 1.25 0.00 0.00 1.22 0.00 0.00 128 P 0.00 4.24 0.00 2.31 2.32 0.00 3.74 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.05 0.00 129 A 8.78 4.56 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 0.00 130 W 8.23 3.73 0.00 3.49 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.62 4.32 0.00 2.30 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.52 2.82 0.00 132 G 8.37 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 0.00 133 C 8.32 4.31 0.00 2.80 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 0.00 134 Y 8.67 4.04 0.00 3.30 3.32 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 0.00 135 N 8.32 4.25 0.00 3.06 3.18 0.00 0.00 7.01 7.29 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 0.00 136 I 7.39 3.43 1.91 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.22 0.83 0.00 0.00 137 I 7.12 3.54 1.67 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.58 0.75 0.00 0.00 138 A 7.49 3.71 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 0.00 139 K 8.32 3.78 0.00 1.67 1.99 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.44 7.81 140 G 7.60 3.74 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 0.00 0.00 0.00 141 I 7.77 3.96 1.52 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 1.48 1.20 0.68 0.00 0.00 142 T 7.91 4.42 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 0.32 0.00 0.00 143 G 6.23 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 0.00 144 S 7.23 4.64 0.00 3.93 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 0.00 145 D 8.31 4.32 0.00 2.84 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 0.00 146 A 9.29 4.49 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 0.00 147 A 7.93 4.17 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