NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.7675 8.3549 109.7321 45.0609 0.0000 173.0896 2 S 3.8757 7.7464 125.6513 56.6320 62.5565 172.3132 3 S 4.4620 8.2057 118.8473 57.3990 66.8479 172.5151 4 G 3.1209 8.0083 107.0952 45.6108 0.0000 172.8915 5 S 4.4500 7.7785 117.9922 59.9511 64.8016 175.5394 6 S 4.6343 7.8202 118.5561 56.9273 64.2730 173.7286 7 G 4.1677 8.1607 112.8973 43.3964 0.0000 170.2493 8 P 4.5757 0.0000 0.0000 62.2600 32.4143 175.5441 9 I 4.1036 7.9820 109.6186 60.5898 39.1921 175.7255 10 S 3.6533 7.7719 113.4654 59.0538 60.7855 170.7638 11 E 4.4453 7.8102 117.1215 55.8743 29.8695 177.2045 12 R 4.0935 7.9686 118.6663 58.7187 30.7891 178.1333 13 N 4.6642 7.8033 118.6597 52.0971 35.9097 175.3480 14 Q 3.9445 8.5247 125.3228 59.8849 29.3457 178.7416 15 D 4.3695 8.4202 117.0781 55.9746 39.2684 177.9018 16 A 4.1531 7.5394 120.3417 54.1345 18.9562 177.2842 17 T 5.0820 8.0089 112.8800 62.9985 70.6370 174.5298 18 V 4.7309 8.4701 116.9954 59.9585 35.2304 174.7097 19 Y 4.2952 9.1942 126.2478 56.4136 39.7027 174.1023 20 V 4.7069 7.7637 128.1943 61.6312 33.4564 174.9200 21 G 4.3527 9.3593 115.0300 45.0110 0.0000 172.4267 22 G 3.9580 8.9842 112.0462 45.8725 0.0000 172.9913 23 L 4.6749 8.2005 117.3676 52.7574 44.3164 177.2472 24 D 4.6772 8.5497 122.4774 53.4810 42.1750 176.4236 25 E 4.1015 8.9276 120.8619 59.5760 29.4814 178.5368 26 K 3.7247 8.3644 117.5017 58.9714 32.0551 177.3696 27 V 3.6960 7.1677 115.6581 63.4743 32.0077 175.0116 28 S 4.7493 8.3104 120.2481 56.6186 67.1314 174.9160 29 E 3.9142 8.7636 120.7497 59.4043 29.2206 177.6313 30 P 4.5666 0.0000 0.0000 63.7912 31.7947 177.2318 31 L 4.3210 7.8928 121.6421 58.0687 42.3065 178.2888 32 L 4.2124 7.4953 118.5471 58.1916 41.5446 178.4635 33 W 4.0790 8.5363 126.4139 61.5652 28.7478 177.1989 34 E 4.0777 8.3294 117.6201 59.4500 29.2852 178.9405 35 L 4.2885 8.1784 119.0559 57.8986 42.3124 178.2069 36 F 4.4569 9.1787 117.3760 59.0218 39.5602 177.8193 37 L 4.9198 8.8407 120.9645 57.6132 41.1613 179.4221 38 Q 4.0999 7.5314 115.6087 59.4766 28.4347 178.6511 39 A 4.3038 8.6917 122.0961 53.7575 18.9588 177.0261 40 G 4.0894 7.7555 103.4129 44.3578 0.0000 171.7390 41 P 5.2688 0.0000 0.0000 61.8566 29.2401 174.1879 42 V 2.9052 8.0551 125.3838 64.6635 31.5082 175.3949 43 V 3.7307 8.4539 129.0595 65.3567 31.7241 175.3120 44 N 3.4161 6.9389 116.7589 52.1876 42.2756 172.2700 45 T 4.8264 8.0330 113.0758 60.1306 71.4462 173.0879 46 H 4.9516 8.9750 123.4151 54.7775 33.1219 172.1447 47 M 4.8505 8.5583 124.7860 52.8356 35.3575 172.9481 48 P 4.3685 0.0000 0.0000 62.6374 32.6778 175.4442 49 K 4.6549 8.4688 123.8450 54.7555 33.7149 176.0037 50 D 4.6021 8.7205 124.7699 54.8252 42.0993 176.6618 51 R 4.3543 8.4784 115.3540 57.2837 31.0420 178.0290 52 V 3.8598 7.8560 111.1004 63.5095 32.0702 176.9839 53 T 4.1448 7.6517 108.2607 61.6803 69.5654 175.7929 54 G 4.1003 8.3930 108.2554 45.4657 0.0000 172.5867 55 Q 4.6236 7.4182 115.9974 53.5391 31.8206 173.7115 56 H 4.1846 8.4072 113.6786 55.7535 29.3680 174.8157 57 Q 4.4420 8.4002 120.8424 56.2541 28.7487 177.5328 58 G 4.2682 8.2327 111.4680 45.1723 0.0000 173.8050 59 Y 4.9844 7.3278 116.7736 55.2237 40.3051 175.4164 60 G 4.0451 8.2486 110.3614 45.8811 0.0000 170.9670 61 F 5.7519 8.2168 116.3269 57.3742 44.5279 174.1682 62 V 4.0524 8.1054 120.5113 60.8882 34.3504 174.1185 63 E 4.2551 8.4791 130.8691 55.0203 30.0300 176.0815 64 F 4.5203 8.6895 126.4105 56.6245 40.0151 176.3062 65 L 4.2011 8.4324 121.8774 57.7818 42.5325 177.5404 66 S 4.8296 8.6719 114.3618 56.1795 66.0931 174.2501 67 E 3.9165 9.1370 125.8112 59.6896 29.7476 178.6456 68 E 3.9282 8.5208 116.7229 60.0470 29.1261 178.5518 69 D 4.1456 7.9903 119.4578 57.3653 40.8538 178.4495 70 A 3.5853 8.0500 121.2575 54.5785 17.8478 178.7288 71 D 4.3207 8.0397 114.5273 57.8871 41.0271 178.7157 72 Y 3.8466 8.1236 119.3278 60.4674 38.7018 177.6568 73 A 3.9530 7.9061 121.6255 54.5622 18.4623 179.1267 74 I 3.9500 8.1006 117.4235 62.9788 37.3331 177.5911 75 K 4.1918 7.5048 118.2886 58.0582 33.1304 177.9302 76 I 4.1817 7.0954 113.1015 62.4704 38.4099 176.8710 77 M 4.2484 8.1792 117.9438 55.0040 31.5604 174.9352 78 D 4.7206 7.7270 120.3113 53.9292 42.3402 176.4153 79 M 3.5958 8.6495 124.6497 55.9597 29.6116 177.1586 80 I 3.9512 7.0222 115.7169 61.4049 37.8491 175.8478 81 K 4.8686 8.1850 123.0036 54.6157 31.4675 175.0784 82 L 4.1168 7.9777 124.4769 54.7933 44.3035 176.7559 83 Y 3.7737 8.3425 120.7420 60.2510 35.2750 174.1808 84 G 3.9538 7.6958 110.7659 45.0457 0.0000 173.0480 85 K 4.1740 8.0258 112.5391 55.1668 37.5363 175.0972 86 P 5.6927 0.0000 0.0000 61.6798 29.0818 175.8074 87 I 4.2812 7.9258 123.3343 62.1216 39.4347 174.8322 88 R 4.7353 8.8015 121.1947 54.7915 33.4262 173.7621 89 V 5.6640 8.5175 124.8957 60.4072 34.7342 173.9298 90 N 4.8516 8.6763 121.3436 51.4962 40.5699 173.5603 91 K 4.2212 8.7913 119.6187 57.2495 32.4793 177.2947 92 A 4.3568 8.5757 127.1066 55.3617 18.0607 179.0737 93 S 4.1606 8.4201 109.4176 61.2499 63.7610 174.8151 94 A 4.7028 7.8888 124.9968 52.5516 17.5194 177.0232 95 H 4.6401 8.1365 118.0423 56.9505 32.0919 174.7174 96 N 5.0332 7.5762 113.8136 50.7531 42.0090 174.0762 97 K 4.1001 8.6139 123.2262 56.4668 32.7412 175.6198 98 N 4.7333 8.2051 122.0462 52.9841 41.5980 173.3342 99 L 4.7841 8.2295 122.6777 53.2207 45.6782 176.0583 100 S 4.6206 8.5061 116.1721 57.6334 66.0844 175.6379 101 G 4.2540 8.2067 111.7867 44.2609 0.0000 171.5181 102 P 4.5168 0.0000 0.0000 63.6606 32.0215 177.0999 103 S 3.9876 7.3403 113.8117 58.3121 63.0643 174.3431 104 S 4.2372 8.8118 121.3175 58.8651 63.7521 174.3544 105 G 4.2498 8.0516 113.2531 45.7820 0.0000 173.0057 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 3.77 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 2 S 7.75 3.88 0.00 3.94 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 3 S 8.21 4.46 0.00 3.92 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 4 G 8.01 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 7.78 4.45 0.00 3.86 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 6 S 7.82 4.63 0.00 3.81 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 7 G 8.16 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 0.00 0.00 0.00 0.00 8 P 0.00 4.58 0.00 2.17 2.10 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 9 I 7.98 4.10 1.75 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.65 0.85 0.00 0.00 10 S 7.77 3.65 0.00 3.89 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 E 7.81 4.45 0.00 1.91 1.75 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 2.07 2.11 0.00 12 R 7.97 4.09 0.00 1.81 1.94 0.00 3.40 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 13 N 7.80 4.66 0.00 2.88 2.99 0.00 0.00 5.96 7.52 0.00 0.00 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 Q 8.52 3.94 0.00 2.29 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.87 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 15 D 8.42 4.37 0.00 2.84 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 16 A 7.54 4.15 1.44 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 0.00 0.00 17 T 8.01 5.08 4.44 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 1.35 0.00 0.00 18 V 8.47 4.73 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 1.11 0.00 0.00 1.09 0.00 0.00 19 Y 9.19 4.30 0.00 3.23 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 20 V 7.76 4.71 1.92 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 0.95 0.00 0.00 0.92 0.00 0.00 21 G 9.36 4.35 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 22 G 8.98 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.20 4.67 0.00 1.67 1.61 0.88 1.08 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 24 D 8.55 4.68 0.00 2.89 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 25 E 8.93 4.10 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 26 K 8.36 3.72 0.00 0.94 0.74 0.00 1.48 0.00 0.00 0.64 0.00 0.00 2.68 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.02 1.12 7.81 27 V 7.17 3.70 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 0.77 0.00 0.00 1.15 0.00 0.00 28 S 8.31 4.75 0.00 3.88 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 29 E 8.76 3.91 0.00 2.05 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 2.41 2.29 0.00 30 P 0.00 4.57 0.00 2.18 2.18 0.00 3.69 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 31 L 7.89 4.32 0.00 1.85 1.99 1.06 1.28 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 32 L 7.50 4.21 0.00 1.68 1.44 0.78 0.90 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 33 W 8.54 4.08 0.00 3.46 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 E 8.33 4.08 0.00 2.11 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 2.44 2.43 0.00 35 L 8.18 4.29 0.00 1.78 2.21 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 36 F 9.18 4.46 0.00 3.31 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.84 4.92 0.00 2.01 1.90 1.01 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 7.53 4.10 0.00 2.28 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.95 0.00 0.00 0.00 0.00 0.00 2.54 2.53 0.00 39 A 8.69 4.30 1.45 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 40 G 7.76 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 0.00 0.00 0.00 41 P 0.00 5.27 0.00 2.23 2.32 0.00 4.18 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 2.28 2.04 0.00 42 V 8.06 2.91 1.74 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 -0.68 0.00 0.00 0.63 0.00 0.00 43 V 8.45 3.73 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.98 0.00 0.00 44 N 6.94 3.42 0.00 2.65 2.50 0.00 0.00 6.52 7.14 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 45 T 8.03 4.83 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 46 H 8.97 4.95 0.00 3.14 3.16 0.00 5.73 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 M 8.56 4.85 0.00 1.78 1.87 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 48 P 0.00 4.37 0.00 2.05 2.21 0.00 3.49 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 2.05 0.00 49 K 8.47 4.65 0.00 1.64 1.64 0.00 1.75 0.00 0.00 1.62 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.35 7.81 50 D 8.72 4.60 0.00 2.91 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 R 8.48 4.35 0.00 1.94 2.03 0.00 3.09 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 52 V 7.86 3.86 2.08 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 0.84 0.00 0.00 0.97 0.00 0.00 53 T 7.65 4.14 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 1.20 0.00 0.00 54 G 8.39 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Q 7.42 4.62 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.75 0.00 0.00 0.00 0.00 0.00 2.23 2.20 0.00 56 H 8.41 4.18 0.00 3.27 3.41 0.00 5.64 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 8.40 4.44 0.00 1.54 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 5.66 0.00 0.00 0.00 0.00 0.00 2.37 2.24 0.00 58 G 8.23 4.27 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 0.00 59 Y 7.33 4.98 0.00 3.01 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.25 4.05 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 0.00 0.00 0.00 61 F 8.22 5.75 0.00 2.94 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 62 V 8.11 4.05 1.53 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 -0.05 0.00 0.00 -0.47 0.00 0.00 63 E 8.48 4.26 0.00 1.99 1.74 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 2.21 2.27 0.00 64 F 8.69 4.52 0.00 3.23 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 65 L 8.43 4.20 0.00 1.91 1.78 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 66 S 8.67 4.83 0.00 4.05 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 67 E 9.14 3.92 0.00 2.01 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 2.40 2.46 0.00 68 E 8.52 3.93 0.00 2.23 2.23 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 2.36 2.41 0.00 69 D 7.99 4.15 0.00 2.72 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 0.00 0.00 0.00 0.00 70 A 8.05 3.59 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 71 D 8.04 4.32 0.00 2.79 2.83 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 72 Y 8.12 3.85 0.00 3.11 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 73 A 7.91 3.95 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 74 I 8.10 3.95 1.99 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 1.69 0.80 0.94 0.00 0.00 75 K 7.50 4.19 0.00 1.80 1.92 0.00 1.14 0.00 0.00 0.67 0.00 0.00 2.83 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.27 1.16 7.81 76 I 7.10 4.18 1.81 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.79 0.79 0.00 0.00 77 M 8.18 4.25 0.00 1.58 2.10 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 1.51 2.47 0.00 78 D 7.73 4.72 0.00 2.84 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 M 8.65 3.60 0.00 2.20 2.14 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 2.49 2.50 0.00 80 I 7.02 3.95 1.84 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.49 0.87 0.00 0.00 81 K 8.18 4.87 0.00 1.69 1.72 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.37 7.81 82 L 7.98 4.12 0.00 1.53 1.43 0.15 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 8.34 3.77 0.00 3.14 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 84 G 7.70 3.95 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 0.00 0.00 0.00 85 K 8.03 4.17 0.00 1.92 1.74 0.00 1.73 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.36 7.81 86 P 0.00 5.69 0.00 2.08 2.10 0.00 3.41 0.00 0.00 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.82 0.00 87 I 7.93 4.28 1.93 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 1.41 1.11 1.10 0.00 0.00 88 R 8.80 4.74 0.00 1.96 1.91 0.00 3.09 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 89 V 8.52 5.66 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 0.79 0.00 0.00 1.14 0.00 0.00 90 N 8.68 4.85 0.00 2.83 2.84 0.00 0.00 6.22 7.18 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 91 K 8.79 4.22 0.00 1.75 1.88 0.00 1.75 0.00 0.00 2.00 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.59 1.45 7.81 92 A 8.58 4.36 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 93 S 8.42 4.16 0.00 4.05 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.89 4.70 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 95 H 8.14 4.64 0.00 3.31 3.32 0.00 5.65 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 96 N 7.58 5.03 0.00 2.50 2.68 0.00 0.00 7.07 7.53 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 97 K 8.61 4.10 0.00 1.71 1.73 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.37 7.81 98 N 8.21 4.73 0.00 2.67 2.62 0.00 0.00 6.99 7.78 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 99 L 8.23 4.78 0.00 1.61 1.50 0.92 0.82 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 0.00 100 S 8.51 4.62 0.00 3.93 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 G 8.21 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 0.00 0.00 0.00 0.00 102 P 0.00 4.52 0.00 2.19 2.17 0.00 3.81 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 103 S 7.34 3.99 0.00 3.80 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 S 8.81 4.24 0.00 4.02 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 0.00 105 G 8.05 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 0.00 0.00 0.00 0.00