NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9903 8.0549 114.0162 61.8052 32.3408 173.8524 2 H 4.3503 8.5872 120.4795 56.3914 30.8007 172.8029 3 L 3.5491 8.0269 117.6504 55.0362 39.8093 174.5623 4 T 4.0638 8.8554 114.4531 60.9973 70.3782 173.0679 5 P 4.2095 0.0000 0.0000 65.7396 31.2260 178.6283 6 E 3.9393 8.0496 117.6598 59.2684 29.5629 178.2444 7 E 3.8421 8.0428 118.7374 59.1516 29.5707 178.8589 8 K 3.6746 8.2360 119.4925 59.8096 32.1141 178.6700 9 S 3.9804 7.8095 112.9868 61.4471 62.3880 176.0652 10 A 3.9671 7.9586 123.3716 55.0340 18.0986 179.6163 11 V 3.3030 7.9880 117.1446 66.3844 31.4656 178.4979 12 T 3.8938 7.9030 115.0648 66.5936 68.1297 176.3056 13 A 4.0318 7.8413 121.3428 55.4054 18.5647 179.2184 14 L 3.9258 8.1638 118.5501 57.9782 42.2570 178.8988 15 W 4.3959 8.6522 128.2899 60.1767 30.3379 178.0874 16 G 3.7465 8.0171 104.7422 47.0824 0.0000 174.3060 17 K 4.3984 7.9587 118.1404 56.2558 32.6559 176.9012 18 V 3.5902 7.1985 120.2777 62.0399 32.1937 175.0564 19 N 4.3873 8.3015 125.6232 52.8433 38.5706 175.6942 20 V 3.5852 8.2222 126.5369 65.4134 31.8231 176.3252 21 D 4.6980 8.4902 118.1139 54.8674 41.5836 176.8197 22 E 4.4599 7.9739 116.7935 57.1380 32.6218 177.9126 23 V 3.5521 7.8122 117.8336 65.9740 31.3756 177.9500 24 G 3.9687 8.2318 104.9151 48.1786 0.0000 175.3735 25 G 3.7229 8.1447 108.0815 47.5178 0.0000 175.3554 26 E 3.9560 8.2711 120.5471 58.9195 29.4047 179.2742 27 A 3.9284 8.2315 121.0305 55.1518 18.5574 179.3013 28 L 3.9994 8.1911 118.9613 58.3423 42.2549 179.4931 29 G 3.5581 8.2534 105.6264 47.9573 0.0000 175.9699 30 R 3.9561 8.2193 120.5426 58.3702 29.9257 178.8952 31 L 4.0306 7.9770 120.5640 58.3451 41.9511 179.1565 32 L 3.9647 7.8218 120.0816 56.8762 41.2073 179.5660 33 V 3.7001 7.2278 117.1619 65.4501 31.7008 177.9235 34 V 3.5429 7.9638 117.3709 64.1465 32.7708 175.6237 35 Y 4.0547 7.3735 116.8874 53.7310 37.8162 173.6852 36 P 4.3793 0.0000 0.0000 64.9671 31.3298 178.3687 37 W 4.3198 8.1707 115.6951 59.3750 27.5384 177.7529 38 T 4.4495 7.3927 109.9744 63.8752 68.2130 176.2443 39 Q 4.3464 8.4002 121.7575 58.6062 28.4604 178.0842 40 R 3.9015 7.9402 119.2401 58.6220 30.0384 176.8042 41 F 4.4791 7.6331 115.4475 57.4479 39.2974 175.5802 42 F 4.6106 8.0317 120.5199 56.8548 39.6975 176.9053 43 E 4.0411 8.4252 123.8087 59.1844 29.7254 177.8055 44 S 4.5600 8.1204 110.5205 59.0468 63.3288 174.5069 45 F 4.5176 8.3066 120.0988 58.0541 39.7468 175.3076 46 G 3.9209 7.5010 105.0826 43.7345 0.0000 172.3856 47 D 4.4640 8.6289 120.8773 54.8177 41.4918 177.0735 48 L 4.8972 8.3237 125.5533 54.5713 43.5787 177.7509 49 S 4.2786 8.4709 116.9243 60.5731 63.2834 174.5868 50 T 4.7373 7.4510 109.8017 58.4230 73.0087 172.8133 51 P 4.2049 0.0000 0.0000 65.8193 31.3383 178.7955 52 D 4.3209 8.0560 117.2058 57.0707 40.5510 178.4838 53 A 3.9674 7.8650 120.7088 55.1121 18.6894 179.4686 54 V 3.6401 7.9450 116.8416 66.6559 31.4404 178.2513 55 M 4.0495 8.2291 117.6902 57.7989 31.9514 177.6970 56 G 3.8358 7.7326 105.1316 45.3408 0.0000 173.7263 57 N 4.3836 7.9701 120.2187 52.8602 39.6582 173.2697 58 P 4.2051 0.0000 0.0000 65.8520 31.5250 178.7567 59 K 3.6682 7.9504 116.6636 59.1357 31.8077 179.4919 60 V 3.7939 8.1483 118.6138 65.8650 31.3535 178.3318 61 K 3.9361 8.2702 118.0820 59.4323 31.4768 179.1177 62 A 4.0022 8.4427 121.3563 55.6437 18.2941 179.2419 63 H 4.1678 8.8858 117.1702 59.2568 29.9411 177.7042 64 G 3.7577 8.5375 107.7794 47.3882 0.0000 175.6531 65 K 4.0311 7.9005 122.2351 59.3365 32.2084 179.0427 66 K 3.9951 7.5540 118.5269 59.4137 32.1104 179.3779 67 V 3.6713 7.8020 118.4541 66.1709 31.5268 177.8109 68 L 4.5087 8.6457 120.5033 58.2351 41.8453 179.2460 69 G 3.7122 8.3623 105.7432 47.7023 0.0000 175.6289 70 A 4.0110 8.1458 123.2521 54.8957 18.3378 179.8220 71 F 4.2309 8.4151 116.0262 60.8941 38.8048 178.0918 72 S 4.2534 8.3055 113.8919 61.5402 62.9947 176.3178 73 D 4.5499 8.2404 121.8253 57.3833 40.6067 178.7748 74 G 3.8558 7.9678 106.1092 48.1386 0.0000 175.5478 75 L 3.9133 7.8299 119.9381 57.1157 41.6804 178.6066 76 A 4.3106 7.5190 117.3294 52.6860 19.4115 176.9886 77 H 4.9562 8.0584 115.7303 54.4667 29.9246 175.3748 78 L 3.9650 8.1063 119.8328 57.4025 41.8152 178.2885 79 D 4.7274 7.9253 116.1908 54.6288 41.6041 176.2706 80 N 4.9993 8.2392 119.8022 50.8228 39.4139 176.0238 81 L 4.0921 8.2180 119.8558 57.7086 41.6830 179.1146 82 K 4.0144 8.0207 117.4401 59.3436 32.3933 179.1040 83 G 3.6530 7.8671 105.5368 48.1804 0.0000 175.4817 84 T 3.6924 7.6289 117.6849 66.0994 68.8103 175.6191 85 F 4.4504 8.0123 116.4818 57.0115 39.3279 177.2977 86 A 3.9509 7.7470 122.7517 55.7999 18.0926 180.1329 87 T 3.7650 7.7467 113.1248 66.9472 68.6268 176.9124 88 L 4.0934 7.8975 120.2684 57.6906 41.5378 179.4306 89 S 4.1764 8.6547 114.9861 60.7636 62.4437 175.8353 90 E 3.8704 7.9970 121.8611 59.0507 29.3322 178.5538 91 L 3.9300 7.9569 120.3669 58.5895 42.1283 178.7668 92 H 4.2352 8.6379 116.5172 58.8300 28.2109 177.4988 93 C 4.5721 8.3800 120.1249 62.1832 28.0694 175.9207 94 D 4.4383 7.8319 118.5065 56.2457 41.0108 177.6659 95 K 4.2042 8.0704 118.5298 57.9798 32.9607 177.1151 96 L 4.3500 7.9012 116.0592 54.7362 42.2134 176.3022 97 H 4.4183 8.0954 113.5028 55.7410 26.0560 175.1770 98 V 3.7415 8.1371 119.9510 61.9554 31.5822 175.0373 99 D 4.2207 8.8435 127.0542 54.2585 41.7095 175.1062 100 P 3.6323 0.0000 0.0000 65.8964 31.3922 177.9520 101 E 3.8751 8.0154 117.1922 59.6212 29.3176 178.7737 102 N 4.4027 8.0521 116.0946 55.8292 38.5432 177.4095 103 F 4.5149 7.5942 119.7314 60.5317 38.9356 177.5899 104 R 3.9993 7.9956 117.9864 59.3156 29.8986 178.4665 105 L 3.8917 7.7260 118.5600 57.7203 41.5132 179.2127 106 L 4.1311 8.5121 120.8848 58.0600 42.0304 179.2845 107 G 3.6918 8.3367 105.8796 47.9422 0.0000 175.5223 108 N 4.4990 8.3229 118.9652 55.8094 38.5380 177.7744 109 V 3.6040 8.1792 120.1335 65.7200 31.5827 177.7070 110 L 3.8351 8.1734 120.3925 58.2728 41.9160 178.9962 111 V 3.5154 7.6506 117.8784 66.3098 31.3450 177.7634 112 C 4.0576 8.1905 116.4243 62.7276 28.0158 176.1472 113 V 3.5375 7.9837 120.1816 66.0262 31.1051 177.9285 114 L 3.8597 8.0737 118.7732 57.8440 41.3902 179.4944 115 A 3.6535 7.3987 120.4545 55.1179 17.9867 179.1856 116 H 4.1650 7.9401 116.2899 59.6004 29.9582 176.9155 117 H 4.0653 7.9067 117.1267 58.0927 28.9884 176.9729 118 F 4.5861 8.3636 117.9335 56.1003 39.5751 177.5375 119 G 3.7757 8.7429 108.2608 46.0562 0.0000 177.4673 120 K 3.9343 8.9812 125.0298 58.7984 32.0337 177.1936 121 E 4.0935 8.3522 119.1996 58.9100 30.1034 177.2194 122 F 4.5201 8.2190 123.1267 56.8111 37.9225 175.3903 123 T 4.0774 7.3822 114.9503 60.8684 71.0835 173.2254 124 P 4.1955 0.0000 0.0000 65.5810 31.4652 177.1761 125 P 4.2320 0.0000 0.0000 65.4813 31.3531 178.8005 126 V 3.4666 7.5304 117.1186 65.8193 31.3073 177.9201 127 Q 3.5814 7.9820 119.4037 59.0695 28.9674 177.7138 128 A 3.9843 8.3487 122.0052 55.4792 18.1602 179.5486 129 A 3.9798 7.8946 118.7435 55.5030 18.4798 179.5185 130 Y 3.9734 7.9002 114.8616 60.9428 37.9147 178.4585 131 Q 4.1649 8.6469 119.7946 58.6106 28.7278 178.7608 132 K 3.9687 7.7221 118.4669 59.3663 32.0962 179.5527 133 V 3.5626 7.5158 118.6586 66.1732 31.4372 178.5491 134 V 3.8697 8.1495 111.8118 64.0286 31.3894 178.5110 135 A 4.1265 8.1922 121.1581 54.8123 18.1964 179.7792 136 G 3.4774 8.0686 104.3091 47.9532 0.0000 175.7960 137 V 2.9511 7.7737 121.2604 65.2089 31.4084 177.7618 138 A 3.8662 7.9561 120.2008 55.5283 18.0554 179.4567 139 N 4.3857 8.5073 113.3758 56.2421 38.8273 177.3477 140 A 4.1042 8.2334 122.8000 55.1306 18.0687 179.7274 141 L 3.7132 8.1789 117.2634 56.6750 41.2641 178.4206 142 A 4.9607 7.4359 118.0391 52.0584 19.7754 176.9874 143 H 3.9862 8.0237 118.7034 59.1601 29.9739 177.1173 144 K 4.3369 7.4185 115.2858 56.8743 31.6442 177.1437 145 Y 5.0710 8.3760 114.3862 56.8611 38.5446 175.4552 146 H 4.3778 7.8514 120.1496 56.2131 29.9380 174.1111 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 V 8.05 3.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.94 0.00 0.00 2 H 8.59 4.35 0.00 3.18 3.27 0.00 5.85 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.03 3.55 0.00 1.65 1.67 0.84 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.86 4.06 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 1.24 0.00 0.00 5 P 0.00 4.21 0.00 2.16 2.13 0.00 3.58 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 6 E 8.05 3.94 0.00 2.01 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 2.38 0.00 7 E 8.04 3.84 0.00 2.16 1.86 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 2.27 2.27 0.00 8 K 8.24 3.67 0.00 1.76 1.79 0.00 1.60 0.00 0.00 1.53 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.40 7.81 9 S 7.81 3.98 0.00 4.01 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 10 A 7.96 3.97 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 11 V 7.99 3.30 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 0.48 0.00 0.00 0.45 0.00 0.00 12 T 7.90 3.89 4.41 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 1.26 0.00 0.00 13 A 7.84 4.03 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.16 3.93 0.00 1.92 1.86 0.28 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.65 4.40 0.00 3.75 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 16 G 8.02 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 0.00 0.00 0.00 17 K 7.96 4.40 0.00 2.25 2.09 0.00 1.79 0.00 0.00 1.79 0.00 0.00 3.16 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.60 7.81 18 V 7.20 3.59 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 -0.01 0.00 0.00 0.79 0.00 0.00 19 N 8.30 4.39 0.00 2.64 2.55 0.00 0.00 6.85 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 20 V 8.22 3.59 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 0.87 0.00 0.00 0.87 0.00 0.00 21 D 8.49 4.70 0.00 2.75 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 22 E 7.97 4.46 0.00 1.91 1.88 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 2.24 2.37 0.00 23 V 7.81 3.55 1.88 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 0.94 0.00 0.00 0.60 0.00 0.00 24 G 8.23 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 25 G 8.14 3.72 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 0.00 26 E 8.27 3.96 0.00 2.20 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 2.32 2.31 0.00 27 A 8.23 3.93 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 28 L 8.19 4.00 0.00 1.82 1.70 0.82 0.96 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 29 G 8.25 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.22 3.96 0.00 2.06 1.93 0.00 3.20 0.00 0.00 3.03 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 31 L 7.98 4.03 0.00 1.90 1.91 1.04 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.82 3.96 0.00 1.80 1.64 0.60 0.64 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 33 V 7.23 3.70 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 0.71 0.00 0.00 0.94 0.00 0.00 34 V 7.96 3.54 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 -0.07 0.00 0.00 0.71 0.00 0.00 35 Y 7.37 4.05 0.00 2.58 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 36 P 0.00 4.38 0.00 2.31 2.32 0.00 3.69 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.96 0.00 37 W 8.17 4.32 0.00 3.62 3.61 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 38 T 7.39 4.45 4.42 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 1.00 0.00 0.00 39 Q 8.40 4.35 0.00 2.33 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 40 R 7.94 3.90 0.00 1.82 1.75 0.00 3.15 0.00 0.00 2.99 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.52 0.00 41 F 7.63 4.48 0.00 2.35 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 0.00 0.00 0.00 0.00 42 F 8.03 4.61 0.00 2.88 2.45 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 43 E 8.43 4.04 0.00 2.01 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 2.42 2.34 0.00 44 S 8.12 4.56 0.00 4.16 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 45 F 8.31 4.52 0.00 3.29 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 7.50 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.63 4.46 0.00 2.65 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.32 4.90 0.00 1.64 1.59 1.00 0.99 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 49 S 8.47 4.28 0.00 4.02 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 50 T 7.45 4.74 4.23 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.15 2.10 0.00 3.58 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 2.08 2.14 0.00 52 D 8.06 4.32 0.00 2.67 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 53 A 7.87 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.95 3.64 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 1.01 0.00 0.00 0.95 0.00 0.00 55 M 8.23 4.05 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.79 0.00 56 G 7.73 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 57 N 7.97 4.38 0.00 3.03 2.85 0.00 0.00 7.12 7.85 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 58 P 0.00 4.21 0.00 2.14 2.06 0.00 3.63 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 59 K 7.95 3.67 0.00 1.46 0.74 0.00 1.28 0.00 0.00 1.49 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.24 7.81 60 V 8.15 3.79 2.29 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 1.09 0.00 0.00 1.09 0.00 0.00 61 K 8.27 3.94 0.00 1.96 1.83 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.67 7.81 62 A 8.44 4.00 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 63 H 8.89 4.17 0.00 3.56 3.65 0.00 5.79 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 64 G 8.54 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 65 K 7.90 4.03 0.00 1.81 2.00 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.73 7.81 66 K 7.55 4.00 0.00 1.86 1.86 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.48 7.81 67 V 7.80 3.67 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 1.32 0.00 0.00 1.10 0.00 0.00 68 L 8.65 4.51 0.00 1.99 1.95 1.04 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.36 3.71 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 0.00 0.00 0.00 70 A 8.15 4.01 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 71 F 8.42 4.23 0.00 3.56 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 72 S 8.31 4.25 0.00 4.22 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 73 D 8.24 4.55 0.00 2.81 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 74 G 7.97 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.83 3.91 0.00 1.59 1.55 -0.59 0.40 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 76 A 7.52 4.31 1.14 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 0.00 0.00 77 H 8.06 4.96 0.00 3.10 3.15 0.00 5.63 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.11 3.97 0.00 1.59 1.70 0.82 1.12 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 79 D 7.93 4.73 0.00 2.64 2.69 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 80 N 8.24 5.00 0.00 2.71 2.63 0.00 0.00 7.13 7.51 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 81 L 8.22 4.09 0.00 1.77 1.85 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.02 4.01 0.00 1.67 1.73 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.35 1.48 7.81 83 G 7.87 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 84 T 7.63 3.69 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 0.55 0.00 0.00 85 F 8.01 4.45 0.00 3.05 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 86 A 7.75 3.95 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 87 T 7.75 3.76 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 1.20 0.00 0.00 88 L 7.90 4.09 0.00 1.89 1.75 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.65 4.18 0.00 3.85 4.04 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 90 E 8.00 3.87 0.00 2.18 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 0.00 2.44 2.44 0.00 91 L 7.96 3.93 0.00 1.82 1.84 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.64 4.24 0.00 3.34 3.68 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.38 4.57 0.00 2.79 2.45 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 94 D 7.83 4.44 0.00 2.98 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 95 K 8.07 4.20 0.00 1.68 1.93 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.42 7.81 96 L 7.90 4.35 0.00 1.79 1.73 0.76 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.10 4.42 0.00 3.44 3.48 0.00 5.77 0.00 0.00 0.00 0.00 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.14 3.74 2.12 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 0.37 0.00 0.00 0.08 0.00 0.00 99 D 8.84 4.22 0.00 2.75 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 0.00 0.00 0.00 0.00 100 P 0.00 3.63 0.00 2.03 2.17 0.00 3.33 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.87 0.00 101 E 8.02 3.88 0.00 2.03 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 2.26 2.38 0.00 102 N 8.05 4.40 0.00 2.67 2.83 0.00 0.00 6.95 7.61 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 0.00 103 F 7.59 4.51 0.00 3.15 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 0.00 104 R 8.00 4.00 0.00 1.92 2.13 0.00 3.25 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 105 L 7.73 3.89 0.00 1.68 1.15 0.52 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.51 4.13 0.00 1.85 1.84 1.02 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.34 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 0.00 108 N 8.32 4.50 0.00 2.84 2.95 0.00 0.00 6.66 7.77 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 0.00 109 V 8.18 3.60 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 1.09 0.00 0.00 1.22 0.00 0.00 110 L 8.17 3.84 0.00 1.68 1.72 0.84 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.65 3.52 2.33 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 1.22 0.00 0.00 1.09 0.00 0.00 112 C 8.19 4.06 0.00 3.19 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 0.00 113 V 7.98 3.54 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 0.99 0.00 0.00 0.94 0.00 0.00 114 L 8.07 3.86 0.00 1.14 1.11 0.51 0.73 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 0.00 115 A 7.40 3.65 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 0.00 116 H 7.94 4.17 0.00 3.18 3.43 0.00 5.77 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.91 4.07 0.00 2.71 2.59 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.36 4.59 0.00 3.20 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 0.00 119 G 8.74 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 0.00 0.00 0.00 120 K 8.98 3.93 0.00 1.77 1.92 0.00 1.82 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.48 7.81 121 E 8.35 4.09 0.00 2.35 2.22 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 2.40 2.34 0.00 122 F 8.22 4.52 0.00 3.08 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 0.00 123 T 7.38 4.08 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 1.28 0.00 0.00 124 P 0.00 4.20 0.00 2.16 2.15 0.00 3.59 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 125 P 0.00 4.23 0.00 2.10 2.06 0.00 3.49 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.53 3.47 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 0.73 0.00 0.00 0.85 0.00 0.00 127 Q 7.98 3.58 0.00 1.89 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.49 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 128 A 8.35 3.98 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 0.00 129 A 7.89 3.98 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 0.00 130 Y 7.90 3.97 0.00 3.38 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 0.00 131 Q 8.65 4.16 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.81 0.00 0.00 0.00 0.00 0.00 2.69 2.61 0.00 132 K 7.72 3.97 0.00 2.03 1.80 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.60 7.81 133 V 7.52 3.56 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 1.03 0.00 0.00 0.78 0.00 0.00 134 V 8.15 3.87 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 0.82 0.00 0.00 1.10 0.00 0.00 135 A 8.19 4.13 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 0.00 136 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 0.00 137 V 7.77 2.95 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 -0.31 0.00 0.00 0.87 0.00 0.00 138 A 7.96 3.87 1.48 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 0.00 139 N 8.51 4.39 0.00 2.87 2.93 0.00 0.00 7.10 7.21 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 0.00 140 A 8.23 4.10 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 0.00 141 L 8.18 3.71 0.00 0.98 0.28 0.13 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.44 4.96 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 0.00 0.00 0.00 0.00 0.00 143 H 8.02 3.99 0.00 3.22 3.33 0.00 5.59 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 0.00 144 K 7.42 4.34 0.00 1.34 1.52 0.00 1.68 0.00 0.00 1.66 0.00 0.00 3.19 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.37 1.54 7.81 145 Y 8.38 5.07 0.00 3.10 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 0.00 146 H 7.85 4.38 0.00 3.00 3.08 0.00 5.93 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00