NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.6086 8.4293 116.1984 55.1510 30.4129 173.3592 2 C 4.0482 7.6611 114.0174 56.8746 30.0994 172.2024 3 D 4.5817 8.3432 118.6269 54.9379 40.2155 175.3656 4 L 4.0667 8.0242 120.4287 57.2466 42.2143 175.7487 5 P 4.5644 0.0000 0.0000 62.2781 32.3413 175.2633 6 C 4.3716 8.4532 112.9687 57.6043 30.8901 175.0379 7 G 3.9354 8.3008 107.5171 45.4858 0.0000 172.8104 8 V 4.3364 7.2766 118.9420 60.9853 32.8704 174.4364 9 Y 4.6949 8.1975 123.4945 56.7518 42.1312 174.3337 10 D 3.8681 7.9283 120.2088 51.6091 44.0514 174.4507 11 P 4.1489 0.0000 0.0000 64.3067 31.1989 178.0703 12 A 3.9821 8.5221 120.9043 55.0681 17.6671 179.6210 13 Q 3.7837 7.8928 116.4277 59.0560 28.7843 178.9089 14 A 4.0505 7.7801 121.1360 55.1152 18.4339 179.3906 15 R 3.8428 8.1165 117.2906 59.7042 30.1600 178.7174 16 I 3.6957 8.0951 119.9019 64.5234 37.0785 178.3133 17 E 3.9754 7.9638 118.4353 59.4040 29.3230 179.3208 18 A 4.0374 8.1611 120.7833 55.0947 18.2890 179.5775 19 E 3.9675 8.4497 117.6377 59.6095 29.4149 179.6980 20 S 4.1115 8.0368 115.3470 61.3782 62.8616 176.7140 21 V 3.5653 7.8458 121.0203 66.0207 31.3021 178.0381 22 K 4.1029 8.1777 118.9459 59.5073 32.1598 178.5284 23 A 4.2107 8.3154 121.3397 55.3455 18.2178 179.7335 24 I 3.7615 8.1841 118.6861 64.5386 37.2806 178.6357 25 Q 4.0168 8.0497 118.9986 59.0242 28.4711 178.7070 26 E 4.0230 8.3355 119.5475 59.4736 29.4634 179.6489 27 K 4.1912 8.1384 118.2603 59.7174 31.8903 179.3932 28 M 4.3946 8.2067 118.1893 58.2157 31.8787 178.3207 29 A 4.1405 7.8487 119.9324 54.8440 18.6472 178.9854 30 A 4.4461 7.5832 116.3295 52.3967 18.9549 176.7296 31 N 4.6958 7.7747 114.8197 51.9541 40.2429 173.1888 32 D 4.7624 8.6358 124.5296 53.1662 40.2268 176.6845 33 D 4.4089 8.5137 120.6034 54.6650 42.6085 176.3110 34 L 3.9369 8.6539 128.3557 58.9952 42.1876 179.0564 35 H 4.1997 8.2544 115.3715 58.7290 28.6614 177.5154 36 F 4.1738 8.7226 122.6175 61.3809 39.2854 177.2356 37 Q 4.0219 8.3946 117.7547 58.8763 28.3855 179.0881 38 I 3.6443 7.6903 120.7956 64.4598 37.1863 178.6815 39 R 3.8183 7.9695 118.6664 59.1953 29.7772 179.0650 40 A 3.7393 8.0015 120.9020 55.1117 18.2430 179.9287 41 T 3.7203 7.6729 114.2973 66.6570 68.6115 176.9653 42 V 3.5545 7.7912 120.1855 66.3136 31.5285 178.2203 43 I 4.0255 7.7930 120.7890 63.6008 36.8790 178.3841 44 K 3.9258 8.3271 120.9594 59.2773 32.0521 178.4660 45 E 3.9088 8.2531 119.7093 59.3667 29.2038 178.9282 46 Q 3.9717 7.8266 117.5146 59.1541 28.7677 178.9990 47 R 4.0347 8.2319 118.9284 58.9775 30.0473 178.9689 48 A 3.9830 8.2134 120.8765 55.0356 18.3593 179.2679 49 E 3.8757 8.1356 117.7186 59.4411 29.6760 179.0702 50 L 3.9421 8.0062 118.8397 57.6389 41.6454 179.2895 51 A 4.0598 8.2358 120.8337 55.2383 18.3493 179.8700 52 K 3.9476 8.2569 117.0228 59.6805 32.1027 179.0236 53 H 4.1274 8.3734 118.5639 59.7606 29.9110 177.0709 54 H 4.2636 8.3131 117.9794 58.8251 28.5007 177.8955 55 L 4.0960 8.0564 120.9006 57.8519 41.4720 179.0988 56 D 4.5544 8.6505 119.3132 57.5561 40.7686 179.1510 57 V 3.7711 7.9991 118.6158 65.9372 31.5046 178.0699 58 L 3.9599 7.9719 118.3393 57.5257 41.2635 179.3482 59 W 4.6189 8.4005 127.3603 60.6548 30.8182 177.8038 60 S 4.0181 8.8247 113.3193 60.5797 62.8949 175.1966 61 D 4.6992 8.3705 121.0002 55.9022 41.7335 177.4700 62 Y 3.4247 7.5627 118.4051 60.1274 39.0482 175.6262 63 F 3.9762 8.0031 118.4017 57.2223 39.5239 175.0896 64 K 4.6337 8.2241 123.3439 53.4687 35.3813 175.0856 65 P 4.4666 0.0000 0.0000 65.9678 31.0603 177.2225 66 P 4.2940 0.0000 0.0000 65.5918 31.1582 178.4497 67 H 4.3433 8.0211 115.4687 58.9533 28.4122 177.8757 68 F 4.2946 7.7544 117.7579 60.0342 38.7839 177.0490 69 E 4.1312 7.8795 118.5094 59.4898 29.6211 178.7219 70 S 4.2684 8.0419 113.7612 59.9794 64.0508 174.0110 71 Y 4.6333 7.9992 119.8686 54.7765 37.8733 174.1311 72 P 4.5769 0.0000 0.0000 64.5347 31.9540 177.9114 73 E 4.3453 8.1247 116.2932 57.0357 30.7647 177.8289 74 L 3.8953 8.0950 122.3642 58.6208 42.0033 178.3434 75 H 4.4613 8.3537 115.5061 59.4250 28.7030 177.6609 76 T 3.8013 7.9454 116.8369 66.4666 68.3460 176.1848 77 L 3.8646 8.1559 122.4878 58.2841 42.1526 179.3150 78 V 3.5674 7.8755 118.1302 65.8110 31.4265 177.4964 79 N 4.0677 8.0998 116.9710 56.5861 38.6940 176.7768 80 E 3.7834 8.3321 120.2427 59.0003 29.3932 179.1643 81 A 4.0657 7.5513 120.7993 55.4192 18.5346 180.2188 82 V 3.6270 7.7950 110.8533 64.3576 31.5602 179.0496 83 K 4.0137 8.1154 118.2421 59.1626 31.8328 179.2650 84 A 4.1082 8.3978 121.7387 55.0654 18.2747 179.7044 85 L 4.0289 7.9193 117.7092 57.9575 41.5159 179.8092 86 S 4.1377 8.1912 115.0585 61.4704 62.5013 176.5841 87 A 3.9911 7.9230 122.5332 55.0695 18.3991 179.2776 88 A 4.2405 7.9614 120.7082 54.5353 18.1733 179.9152 89 K 3.8991 7.9174 116.3122 59.4214 32.2252 178.4237 90 A 4.4121 7.4195 117.7162 51.4992 18.8774 176.7331 91 S 4.6577 7.3944 112.0712 57.1049 65.6330 173.8042 92 T 4.3542 8.3632 113.2130 61.2515 69.4009 173.7214 93 D 4.5586 8.3566 124.3289 53.0718 41.1945 175.0195 94 P 4.8493 0.0000 0.0000 64.7718 31.2283 178.3128 95 A 4.0528 8.4075 120.1447 55.0642 18.0611 179.7645 96 T 3.9448 8.3698 109.1469 64.9321 68.9158 177.1624 97 G 3.6091 8.1577 108.2832 47.5312 0.0000 175.2721 98 Q 3.9820 8.4245 122.3746 58.6915 29.1471 178.2325 99 K 3.7324 8.1512 120.6537 59.2456 32.1472 178.7015 100 A 4.1405 7.9187 120.7029 55.2265 18.3316 179.5820 101 L 3.9560 7.9353 117.5120 58.0005 41.5214 179.4765 102 D 4.3352 8.2011 119.0484 57.6281 40.6729 178.5414 103 Y 4.4048 7.7564 116.8588 61.2069 37.8932 178.4224 104 I 3.7580 8.2229 120.7538 64.4149 37.1808 178.3757 105 A 4.2587 8.2896 121.5992 55.1447 18.2839 179.7232 106 Q 4.0755 7.9480 116.9767 58.9818 28.8164 178.8069 107 I 3.7813 8.0447 121.1955 64.3008 37.1165 177.7975 108 D 4.4114 8.6907 119.3732 57.2602 41.0345 178.2687 109 K 4.0978 8.1884 120.0168 59.7728 32.2754 178.8847 110 I 3.5247 7.6953 119.6602 64.0148 36.6882 177.9474 111 F 3.9971 8.4869 120.9950 61.4360 39.5873 177.1926 112 W 4.2039 8.4292 118.1524 59.5367 28.9025 178.4873 113 E 4.1542 8.2793 119.2482 59.4551 28.6854 179.2050 114 T 4.0935 7.7719 108.6711 64.0468 68.9457 176.2640 115 K 4.1103 7.4606 119.9828 58.2672 32.2757 178.6407 116 K 4.2256 7.7439 117.8706 58.4245 32.2800 176.6621 117 A 4.2288 7.9291 125.3687 52.3207 18.6658 176.8334 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 H 8.43 4.61 0.00 3.25 3.24 0.00 5.48 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 2 C 7.66 4.05 0.00 3.09 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 3 D 8.34 4.58 0.00 2.87 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 4 L 8.02 4.07 0.00 1.59 1.74 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.56 0.00 2.28 2.08 0.00 3.80 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 6 C 8.45 4.37 0.00 3.02 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 7 G 8.30 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 8 V 7.28 4.34 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 0.85 0.00 0.00 0.93 0.00 0.00 9 Y 8.20 4.69 0.00 2.79 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 10 D 7.93 3.87 0.00 2.59 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 11 P 0.00 4.15 0.00 2.25 1.88 0.00 3.11 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.07 0.00 12 A 8.52 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 13 Q 7.89 3.78 0.00 1.83 1.58 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 2.22 2.35 0.00 14 A 7.78 4.05 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 15 R 8.12 3.84 0.00 1.89 2.06 0.00 3.16 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 16 I 8.10 3.70 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.50 0.91 0.00 0.00 17 E 7.96 3.98 0.00 2.18 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 2.57 2.56 0.00 18 A 8.16 4.04 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.45 3.97 0.00 2.21 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 2.34 2.50 0.00 20 S 8.04 4.11 0.00 4.09 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 21 V 7.85 3.57 2.27 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 1.00 0.00 0.00 0.96 0.00 0.00 22 K 8.18 4.10 0.00 1.88 1.79 0.00 1.76 0.00 0.00 1.65 0.00 0.00 3.16 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.60 7.81 23 A 8.32 4.21 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 24 I 8.18 3.76 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.71 0.90 0.00 0.00 25 Q 8.05 4.02 0.00 2.30 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 26 E 8.34 4.02 0.00 2.22 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 2.34 2.51 0.00 27 K 8.14 4.19 0.00 2.22 2.16 0.00 1.81 0.00 0.00 1.82 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.52 1.71 7.81 28 M 8.21 4.39 0.00 2.04 2.32 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.50 0.00 29 A 7.85 4.14 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 30 A 7.58 4.45 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 31 N 7.77 4.70 0.00 2.32 2.38 0.00 0.00 7.16 9.28 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 32 D 8.64 4.76 0.00 2.85 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 33 D 8.51 4.41 0.00 2.84 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 34 L 8.65 3.94 0.00 1.78 1.61 0.89 1.00 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 35 H 8.25 4.20 0.00 3.47 3.39 0.00 5.87 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 36 F 8.72 4.17 0.00 3.18 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 37 Q 8.39 4.02 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.60 0.00 0.00 0.00 0.00 0.00 2.68 2.60 0.00 38 I 7.69 3.64 1.98 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 1.48 0.70 0.88 0.00 0.00 39 R 7.97 3.82 0.00 1.80 1.88 0.00 3.15 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.85 0.00 40 A 8.00 3.74 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 7.67 3.72 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 1.18 0.00 0.00 42 V 7.79 3.55 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 1.00 0.00 0.00 0.93 0.00 0.00 43 I 7.79 4.03 1.86 0.00 0.00 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 1.36 0.93 0.89 0.00 0.00 44 K 8.33 3.93 0.00 1.81 1.84 0.00 1.75 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.43 7.81 45 E 8.25 3.91 0.00 2.28 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 2.29 2.39 0.00 46 Q 7.83 3.97 0.00 2.30 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 47 R 8.23 4.03 0.00 1.83 2.11 0.00 3.29 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.79 0.00 48 A 8.21 3.98 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 49 E 8.14 3.88 0.00 2.21 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 0.00 2.29 2.39 0.00 50 L 8.01 3.94 0.00 1.91 1.70 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.24 4.06 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 52 K 8.26 3.95 0.00 1.98 1.87 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.45 1.61 7.81 53 H 8.37 4.13 0.00 3.23 3.44 0.00 5.78 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 54 H 8.31 4.26 0.00 3.36 3.29 0.00 5.67 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 55 L 8.06 4.10 0.00 1.89 1.76 0.95 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.65 4.55 0.00 2.87 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 57 V 8.00 3.77 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 1.26 0.00 0.00 0.87 0.00 0.00 58 L 7.97 3.96 0.00 2.10 1.73 0.82 0.29 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 59 W 8.40 4.62 0.00 3.46 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 60 S 8.82 4.02 0.00 4.05 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 0.00 61 D 8.37 4.70 0.00 3.00 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 62 Y 7.56 3.42 0.00 1.43 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 63 F 8.00 3.98 0.00 2.87 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 0.00 0.00 0.00 64 K 8.22 4.63 0.00 1.47 1.56 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.78 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.13 7.81 65 P 0.00 4.47 0.00 2.16 2.18 0.00 3.57 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.26 0.00 66 P 0.00 4.29 0.00 1.98 2.02 0.00 3.38 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 67 H 8.02 4.34 0.00 2.92 3.15 0.00 5.64 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 68 F 7.75 4.29 0.00 3.03 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 69 E 7.88 4.13 0.00 2.12 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 0.00 2.30 2.35 0.00 70 S 8.04 4.27 0.00 3.73 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 71 Y 8.00 4.63 0.00 2.97 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 72 P 0.00 4.58 0.00 2.19 2.22 0.00 3.52 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 73 E 8.12 4.35 0.00 2.18 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 0.00 2.38 2.29 0.00 74 L 8.09 3.90 0.00 1.80 1.88 0.53 -0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.35 4.46 0.00 3.27 3.35 0.00 5.68 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 76 T 7.95 3.80 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 1.16 0.00 0.00 77 L 8.16 3.86 0.00 1.81 1.80 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 78 V 7.88 3.57 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 0.94 0.00 0.00 1.14 0.00 0.00 79 N 8.10 4.07 0.00 2.71 2.74 0.00 0.00 7.19 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 80 E 8.33 3.78 0.00 1.30 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 2.16 2.36 0.00 81 A 7.55 4.07 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 7.79 3.63 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 0.91 0.00 0.00 0.85 0.00 0.00 83 K 8.12 4.01 0.00 1.97 1.83 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.46 7.81 84 A 8.40 4.11 1.58 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 85 L 7.92 4.03 0.00 1.92 1.74 0.97 0.92 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 86 S 8.19 4.14 0.00 4.04 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 87 A 7.92 3.99 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 88 A 7.96 4.24 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 89 K 7.92 3.90 0.00 1.97 2.01 0.00 1.69 0.00 0.00 1.96 0.00 0.00 3.21 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.64 7.81 90 A 7.42 4.41 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 91 S 7.39 4.66 0.00 3.80 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 92 T 8.36 4.35 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 1.21 0.00 0.00 93 D 8.36 4.56 0.00 2.68 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 94 P 0.00 4.85 0.00 2.20 2.11 0.00 3.93 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 95 A 8.41 4.05 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.37 3.94 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 97 G 8.16 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 0.00 0.00 0.00 98 Q 8.42 3.98 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 99 K 8.15 3.73 0.00 1.95 1.89 0.00 1.34 0.00 0.00 1.54 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.40 1.20 7.81 100 A 7.92 4.14 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 0.00 101 L 7.94 3.96 0.00 1.90 1.73 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.20 4.34 0.00 2.52 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 0.00 103 Y 7.76 4.40 0.00 3.22 2.88 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 0.00 104 I 8.22 3.76 2.06 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 1.51 0.71 0.94 0.00 0.00 105 A 8.29 4.26 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 0.00 106 Q 7.95 4.08 0.00 2.34 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.76 0.00 0.00 0.00 0.00 0.00 2.45 2.64 0.00 107 I 8.04 3.78 2.09 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.71 1.07 0.00 0.00 108 D 8.69 4.41 0.00 2.93 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.19 4.10 0.00 1.98 2.05 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.18 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.58 7.81 110 I 7.70 3.52 1.82 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.74 -0.15 0.00 0.00 111 F 8.49 4.00 0.00 2.85 3.01 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 0.00 112 W 8.43 4.20 0.00 3.54 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 0.00 113 E 8.28 4.15 0.00 2.28 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 0.00 2.45 2.61 0.00 114 T 7.77 4.09 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 115 K 7.46 4.11 0.00 2.10 2.00 0.00 1.62 0.00 0.00 1.46 0.00 0.00 2.13 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.65 1.05 7.81 116 K 7.74 4.23 0.00 1.96 1.91 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.13 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.77 7.81 117 A 7.93 4.23 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