NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3142 8.2493 123.5832 51.9898 19.9011 176.4406 3 E 4.2601 8.5227 121.1338 54.7013 31.1266 172.7750 4 E 4.2124 8.3525 120.3821 56.3677 31.5561 178.1108 5 T 4.3932 8.0903 112.6086 59.9992 71.1919 175.2678 6 I 3.7177 8.1243 120.2526 64.2909 37.5238 177.4088 7 F 4.3846 8.1875 118.6882 60.4867 38.5846 177.6552 8 S 4.1889 8.0831 114.5907 61.6731 62.5973 176.8881 9 K 4.0405 8.0260 120.5773 59.2102 31.7791 179.4699 10 I 3.5021 7.4731 119.8024 64.3533 36.7792 178.3038 11 I 3.6489 7.6242 119.4744 64.5538 37.1198 178.1710 12 R 4.1181 7.8235 115.4969 56.0567 30.2098 176.6665 13 R 3.8678 7.6138 116.7968 57.4010 27.8257 177.4316 14 E 4.1967 8.3450 119.5709 57.8656 29.9575 177.1568 15 I 4.6824 7.2420 110.2791 57.6518 40.7111 173.2893 16 P 4.3975 0.0000 0.0000 63.3197 31.8327 175.5138 17 S 4.4672 7.7815 113.5505 58.4266 66.6194 176.1617 18 D 4.6065 8.0534 122.7187 53.2100 39.4196 173.5706 19 I 4.5978 7.7466 122.6770 60.7385 37.9865 176.2793 20 V 4.3102 8.6442 118.7721 62.1878 33.0901 175.6461 21 Y 4.7180 7.7387 120.1201 56.5860 42.1410 172.9880 22 Q 5.0917 7.6260 126.2678 55.2017 32.2997 173.2760 23 D 4.6805 8.6986 125.0916 52.3404 42.0343 174.5279 24 D 4.5036 8.9186 117.0765 57.2041 41.2033 176.9392 25 L 4.7053 8.8146 118.6583 55.3020 44.3267 177.1549 26 V 5.1314 8.0807 109.7724 59.8593 36.4686 174.8154 27 T 5.2323 9.1005 118.6157 61.8328 72.4703 172.8831 28 A 5.2426 9.3846 127.3731 50.1192 22.2339 174.9908 29 F 5.3491 8.2625 116.1638 54.9637 41.9237 174.2420 30 R 4.4039 8.5957 119.9035 56.0507 30.5201 176.4942 31 D 4.3557 8.5159 123.3883 54.1607 41.7106 176.5237 32 I 3.9399 8.3846 125.5184 63.2672 38.5755 176.0929 33 S 4.7065 8.3218 116.0238 55.5083 62.8814 171.2900 34 P 4.4344 0.0000 0.0000 62.9878 31.9659 177.4241 35 Q 4.4668 8.9392 118.5001 55.9259 29.6893 174.9083 36 A 4.7056 7.4399 119.1880 49.9391 22.2139 174.4194 37 P 4.3456 0.0000 0.0000 65.1578 31.7777 177.1369 38 T 4.5652 8.2571 115.7362 61.9477 70.9253 173.7034 39 H 4.9808 8.7330 126.2438 55.1077 32.4755 171.4064 40 I 4.7998 8.8505 126.6392 59.2350 40.8554 174.6215 41 L 4.7278 8.3360 126.2769 53.1752 43.7056 175.4635 42 I 4.8782 8.5682 124.8877 59.3964 39.7869 174.7214 43 I 5.1011 8.7331 120.5756 58.1588 40.8050 173.2160 44 P 4.9441 0.0000 0.0000 63.0093 32.2213 176.8337 45 N 4.6421 9.2071 119.3019 55.4925 39.0982 175.5650 46 I 4.1843 7.0302 116.8058 59.4839 38.3336 175.2857 47 L 3.7041 8.4634 126.7868 55.0720 42.1557 176.3151 48 I 4.4330 7.8356 126.8830 58.8104 39.3481 174.4822 49 P 4.8396 0.0000 0.0000 64.6488 31.5211 176.6662 50 T 4.7783 8.0409 106.1940 59.4009 72.1844 174.8414 51 V 3.6106 8.2664 120.5169 65.7659 31.6136 177.4099 52 N 4.5193 7.9074 115.9608 55.3636 38.3588 175.2074 53 D 4.8064 7.9201 116.8929 53.9432 41.3204 177.0929 54 V 4.0417 7.3640 113.0893 61.3477 32.3059 175.1970 55 S 4.6000 8.3917 115.0155 55.8347 66.2933 174.4015 56 A 3.9748 8.7775 121.2887 55.5259 17.5578 179.3775 57 E 3.9997 8.0552 113.9826 59.0184 29.8842 177.8726 58 H 4.7314 8.0777 116.3074 56.3109 29.0785 176.7385 59 E 3.9717 8.1358 121.9640 59.4450 29.1896 178.9023 60 Q 3.9366 8.0904 118.9339 59.0815 29.2073 177.9514 61 A 4.0157 7.9720 121.4020 55.1416 18.5665 179.4877 62 L 4.0886 8.3747 117.9692 57.7818 41.7067 179.9278 63 G 3.6424 8.4166 106.0755 47.8195 0.0000 175.7383 64 R 4.0450 8.2342 122.6456 58.7709 30.0089 178.3923 65 M 4.0089 7.9768 118.7040 58.4533 31.9395 178.8138 66 I 3.7882 7.3875 119.2934 64.4432 37.2043 178.5489 67 T 3.8698 7.9277 110.7208 64.7706 68.4256 176.7673 68 V 3.1745 8.1122 121.2900 65.3665 31.3726 177.7750 69 A 3.7896 7.8297 120.4356 55.0405 18.3095 179.4064 70 A 3.8552 7.9371 119.1625 55.1397 18.4735 179.7606 71 K 3.8224 7.8749 118.0748 59.7467 32.1829 179.1673 72 I 3.8034 7.9145 120.1691 64.1545 37.0096 178.0531 73 A 3.6598 8.0023 122.1023 55.0832 18.1391 179.2955 74 E 3.8429 7.9174 117.2370 59.6926 29.5563 179.2037 75 Q 4.0596 7.7776 116.4881 58.5566 28.8257 177.7733 76 E 4.2758 8.1962 117.8582 56.0827 29.7515 177.0569 77 G 3.8917 7.7463 106.9435 46.4799 0.0000 174.3037 78 I 4.3872 7.6903 110.7437 59.9848 38.5624 177.2130 79 A 4.2547 8.1465 124.5874 55.8143 18.5792 179.0589 80 E 4.1606 8.2910 113.7662 59.8127 29.8664 178.2725 81 D 4.3271 8.1225 116.9450 57.8374 41.0049 175.2654 82 G 3.7183 7.8057 103.1937 44.1732 0.0000 171.5889 83 Y 4.7758 7.0394 115.3628 56.5058 40.1945 173.2237 84 R 4.7053 8.8724 120.4047 54.4959 33.4924 173.9014 85 L 5.3297 8.5788 124.7379 53.1372 44.2023 175.8882 86 I 4.6978 8.7134 123.6695 59.7701 41.3762 174.0886 87 M 5.0968 8.7635 125.5856 53.6169 34.5742 174.7152 88 N 4.8994 8.7672 121.0013 51.7449 40.3931 174.4259 89 T 4.6776 7.9782 118.4465 62.7513 71.9460 174.9552 90 N 4.7201 9.0021 123.6187 52.3475 38.7752 174.4268 91 R 3.9986 8.5072 116.3432 60.5762 30.4087 179.4124 92 H 4.3681 8.2791 113.8041 58.4348 28.8431 176.5710 93 G 3.6935 7.7708 105.9113 46.0686 0.0000 174.5463 94 G 3.8419 7.9124 107.4972 45.7871 0.0000 173.3551 95 Q 3.9563 8.0659 120.9214 56.0193 29.3707 175.6110 96 E 4.4824 8.7637 123.9219 56.7900 31.5332 176.2841 97 V 4.0953 7.3908 117.8853 61.2891 33.2469 175.9211 98 Y 4.2233 8.2459 129.0433 56.6018 36.8132 175.0832 99 H 4.9754 7.4398 118.3466 54.2016 33.3259 172.6143 100 I 4.1116 8.6140 121.9068 61.9175 38.0062 175.0861 101 H 4.9851 8.3556 117.2157 55.0429 31.1823 172.1713 102 M 4.7082 8.8571 121.2720 54.3060 34.5344 174.2671 103 H 4.9662 9.4707 124.0424 55.1033 30.6498 173.8606 104 L 5.0019 9.2265 126.4136 53.5327 43.6946 174.9105 105 L 5.1326 8.4982 126.6914 53.2742 45.1642 176.4951 106 G 4.0856 8.8123 108.8219 46.2587 0.0000 173.7836 107 G 4.1842 10.3797 108.2276 44.8605 0.0000 173.2954 108 R 4.3974 7.1743 112.8706 54.4967 31.4261 172.5891 109 P 4.2424 0.0000 0.0000 63.4094 31.5256 176.7227 110 L 4.1601 8.5903 121.9174 54.2977 42.3593 178.1481 111 G 3.8920 7.7517 107.8148 43.5853 0.0000 171.0338 112 P 4.1838 0.0000 0.0000 63.1745 31.7292 176.3644 113 M 4.1815 8.7012 121.7390 57.8970 32.5002 176.3353 114 L 4.7849 7.4173 115.3222 52.2630 45.7447 176.0379 115 A 4.1782 8.4237 123.9457 52.7170 19.1217 177.5502 116 H 4.5834 8.2715 115.7794 56.0349 28.9930 175.5542 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 2 A 8.25 4.31 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 3 E 8.52 4.26 0.00 2.17 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 2.23 2.40 0.00 4 E 8.35 4.21 0.00 2.00 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 2.35 2.31 0.00 5 T 8.09 4.39 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 1.15 0.00 0.00 6 I 8.12 3.72 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.33 0.95 0.00 0.00 7 F 8.19 4.38 0.00 2.99 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 8 S 8.08 4.19 0.00 4.09 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 9 K 8.03 4.04 0.00 1.93 1.83 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.74 1.53 7.81 10 I 7.47 3.50 1.60 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.63 -0.00 0.00 0.00 11 I 7.62 3.65 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 1.55 0.54 0.99 0.00 0.00 12 R 7.82 4.12 0.00 1.77 1.96 0.00 3.40 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 13 R 7.61 3.87 0.00 1.96 2.01 0.00 3.13 0.00 0.00 3.19 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.71 0.00 14 E 8.35 4.20 0.00 1.93 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 2.23 0.00 15 I 7.24 4.68 1.84 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 1.42 0.59 0.89 0.00 0.00 16 P 0.00 4.40 0.00 2.18 2.07 0.00 3.77 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 17 S 7.78 4.47 0.00 3.60 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.05 4.61 0.00 2.73 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 19 I 7.75 4.60 1.87 0.00 0.00 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 1.43 0.61 1.05 0.00 0.00 20 V 8.64 4.31 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 0.70 0.00 0.00 0.99 0.00 0.00 21 Y 7.74 4.72 0.00 3.07 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 22 Q 7.63 5.09 0.00 2.01 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.48 0.00 0.00 0.00 0.00 0.00 2.19 2.51 0.00 23 D 8.70 4.68 0.00 2.74 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.92 4.50 0.00 2.72 2.80 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 25 L 8.81 4.71 0.00 1.62 1.72 0.96 0.73 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 26 V 8.08 5.13 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 0.80 0.00 0.00 1.14 0.00 0.00 27 T 9.10 5.23 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 1.31 0.00 0.00 28 A 9.38 5.24 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 29 F 8.26 5.35 0.00 3.07 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 30 R 8.60 4.40 0.00 1.77 1.91 0.00 3.29 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 31 D 8.52 4.36 0.00 2.27 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 0.00 0.00 0.00 32 I 8.38 3.94 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.96 0.97 0.00 0.00 33 S 8.32 4.71 0.00 3.85 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 34 P 0.00 4.43 0.00 2.35 2.08 0.00 3.75 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 2.01 2.00 0.00 35 Q 8.94 4.47 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.56 0.00 36 A 7.44 4.71 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 37 P 0.00 4.35 0.00 2.06 2.14 0.00 3.86 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 2.17 2.12 0.00 38 T 8.26 4.57 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 1.22 0.00 0.00 39 H 8.73 4.98 0.00 3.29 3.10 0.00 5.62 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 I 8.85 4.80 1.78 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 1.16 0.66 0.80 0.00 0.00 41 L 8.34 4.73 0.00 0.27 0.90 0.67 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 42 I 8.57 4.88 1.78 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 1.15 0.71 0.90 0.00 0.00 43 I 8.73 5.10 2.11 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.98 0.79 0.00 0.00 44 P 0.00 4.94 0.00 2.18 2.25 0.00 4.02 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.03 0.00 45 N 9.21 4.64 0.00 2.66 2.97 0.00 0.00 6.94 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 46 I 7.03 4.18 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.83 0.93 0.00 0.00 47 L 8.46 3.70 0.00 1.60 1.60 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 48 I 7.84 4.43 1.81 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.65 0.91 0.00 0.00 49 P 0.00 4.84 0.00 2.26 2.21 0.00 3.84 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 50 T 8.04 4.78 4.31 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 1.52 0.00 0.00 51 V 8.27 3.61 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 0.99 0.00 0.00 0.93 0.00 0.00 52 N 7.91 4.52 0.00 2.75 2.89 0.00 0.00 6.92 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 53 D 7.92 4.81 0.00 2.78 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 54 V 7.36 4.04 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 0.68 0.00 0.00 0.99 0.00 0.00 55 S 8.39 4.60 0.00 3.93 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 56 A 8.78 3.97 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 57 E 8.06 4.00 0.00 2.08 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 2.03 2.13 0.00 58 H 8.08 4.73 0.00 3.29 3.35 0.00 5.62 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 59 E 8.14 3.97 0.00 2.13 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 0.00 2.35 2.41 0.00 60 Q 8.09 3.94 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 61 A 7.97 4.02 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 62 L 8.37 4.09 0.00 1.85 1.74 0.96 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 63 G 8.42 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 64 R 8.23 4.04 0.00 2.03 2.14 0.00 3.47 0.00 0.00 3.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.58 0.00 65 M 7.98 4.01 0.00 2.09 2.28 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.59 0.00 66 I 7.39 3.79 1.98 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.83 0.92 0.00 0.00 67 T 7.93 3.87 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 1.25 0.00 0.00 68 V 8.11 3.17 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 0.38 0.00 0.00 0.34 0.00 0.00 69 A 7.83 3.79 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 70 A 7.94 3.86 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 71 K 7.87 3.82 0.00 1.76 1.80 0.00 1.61 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.47 7.81 72 I 7.91 3.80 1.70 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 1.40 0.47 0.81 0.00 0.00 73 A 8.00 3.66 0.61 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 74 E 7.92 3.84 0.00 2.06 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 2.29 2.35 0.00 75 Q 7.78 4.06 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.69 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 76 E 8.20 4.28 0.00 1.97 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 2.40 2.38 0.00 77 G 7.75 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 0.00 0.00 0.00 78 I 7.69 4.39 2.09 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 1.29 1.21 0.98 0.00 0.00 79 A 8.15 4.25 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 80 E 8.29 4.16 0.00 1.99 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 2.34 2.29 0.00 81 D 8.12 4.33 0.00 2.70 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 82 G 7.81 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 83 Y 7.04 4.78 0.00 3.06 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 84 R 8.87 4.71 0.00 1.85 1.77 0.00 3.03 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.55 0.00 85 L 8.58 5.33 0.00 1.57 1.58 1.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.71 4.70 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.78 0.92 0.00 0.00 87 M 8.76 5.10 0.00 1.82 1.93 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 2.47 2.63 0.00 88 N 8.77 4.90 0.00 2.66 2.76 0.00 0.00 6.91 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 89 T 7.98 4.68 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 1.25 0.00 0.00 90 N 9.00 4.72 0.00 2.96 2.90 0.00 0.00 6.51 6.99 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 91 R 8.51 4.00 0.00 1.89 1.94 0.00 3.21 0.00 0.00 3.37 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.71 0.00 92 H 8.28 4.37 0.00 3.15 3.36 0.00 5.94 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 7.77 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 94 G 7.91 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 95 Q 8.07 3.96 0.00 2.06 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.05 6.70 0.00 0.00 0.00 0.00 0.00 1.24 1.96 0.00 96 E 8.76 4.48 0.00 1.98 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 2.25 2.49 0.00 97 V 7.39 4.10 1.67 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 -0.25 0.00 0.00 0.69 0.00 0.00 98 Y 8.25 4.22 0.00 3.16 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 99 H 7.44 4.98 0.00 3.07 3.13 0.00 5.76 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.61 4.11 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.77 0.98 0.00 0.00 101 H 8.36 4.99 0.00 3.08 3.39 0.00 5.50 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 0.00 102 M 8.86 4.71 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.49 0.00 103 H 9.47 4.97 0.00 3.05 3.20 0.00 5.65 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 9.23 5.00 0.00 1.63 1.58 0.68 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.50 5.13 0.00 1.58 1.47 0.84 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 106 G 8.81 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 0.00 107 G 10.38 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 0.00 0.00 0.00 108 R 7.17 4.40 0.00 1.87 1.86 0.00 3.06 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.55 0.00 109 P 0.00 4.24 0.00 2.06 2.05 0.00 3.67 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 2.03 2.12 0.00 110 L 8.59 4.16 0.00 1.62 1.69 0.99 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 111 G 7.75 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 0.00 0.00 0.00 112 P 0.00 4.18 0.00 2.03 2.02 0.00 3.68 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 113 M 8.70 4.18 0.00 1.95 2.07 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 114 L 7.42 4.78 0.00 1.57 1.45 0.89 0.75 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 0.00 115 A 8.42 4.18 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 0.00 116 H 8.27 4.58 0.00 3.15 3.19 0.00 5.75 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