NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5235 8.3049 120.3328 55.5972 33.5013 174.1735 2 M 4.9134 8.2320 119.0540 53.9821 35.4776 174.3534 3 N 4.8554 8.3166 113.6989 51.0217 40.6406 172.2169 4 E 4.5576 7.3968 119.3941 55.3070 32.8817 174.6576 5 K 4.7547 7.4878 123.7272 55.5271 37.3312 174.8431 6 I 4.6750 7.9020 119.9570 60.3621 42.1263 173.5072 7 L 5.2810 8.9697 126.6990 53.4042 45.6596 175.1565 8 I 5.1163 8.9808 125.3070 59.5795 41.0872 174.6946 9 V 4.6861 9.3466 126.4442 62.4791 34.7306 175.5500 10 D 4.1961 9.4339 126.2361 55.4117 41.6963 173.2118 11 D 4.6060 8.8384 115.8890 54.2289 39.8210 173.1980 12 Q 4.2231 7.6857 115.7709 57.4554 28.3701 176.2321 13 Y 4.3934 8.6448 124.7420 57.3744 38.9620 175.2410 14 G 4.0898 8.8353 106.6281 44.9260 0.0000 175.9844 15 I 3.8381 7.7717 120.5057 63.4305 37.6747 177.7324 16 R 3.9793 8.0541 116.6375 59.5492 28.8428 178.9381 17 I 3.6871 7.7077 119.7818 63.9108 36.9270 177.4451 18 L 4.2171 7.3087 121.2275 58.5801 41.8310 179.2781 19 L 3.9196 7.8785 118.6674 58.3255 39.9247 178.4201 20 N 4.3789 7.9712 118.5242 56.6038 38.9415 176.1725 21 E 4.0548 9.2112 121.9143 59.5509 29.2611 179.0808 22 V 3.4498 7.2174 117.0066 65.9946 31.6532 178.0951 23 F 4.4909 8.1207 117.5063 60.4986 38.8102 177.3956 24 N 4.3557 9.5234 117.6281 56.4446 38.5450 176.9245 25 K 4.0009 7.9072 119.5343 59.2759 32.1423 178.2086 26 E 4.1152 6.8346 117.1847 56.3528 29.6270 177.2680 27 G 4.1047 7.8840 106.5285 44.9723 0.0000 173.3480 28 Y 4.6753 7.3430 116.8195 57.5895 38.5768 175.5956 29 Q 4.6118 8.7885 124.0955 55.3968 30.3098 174.3533 30 T 5.5857 8.5681 116.1443 59.2166 71.9539 172.7251 31 F 4.7583 8.6825 123.8318 56.8031 43.6711 172.8255 32 Q 5.9537 8.9648 119.1673 53.3588 31.8870 174.4259 33 A 4.9212 8.4717 121.2160 49.8457 23.5955 175.3898 34 A 4.5307 8.8993 119.1890 50.4034 19.2025 175.2736 35 N 4.1290 7.5165 117.6487 53.5699 42.5051 176.1041 36 G 3.5336 7.8633 104.9820 47.9063 0.0000 175.2632 37 L 3.9062 7.8851 122.8830 58.0442 42.0804 178.9686 38 Q 4.0329 8.2795 116.8021 59.1855 28.4810 179.0755 39 A 4.1663 7.5314 120.9724 54.4323 18.5774 179.6332 40 L 3.8895 8.2729 118.1307 57.9084 41.7188 179.2480 41 D 4.2485 8.4428 118.2491 57.5505 41.3120 178.4113 42 I 3.7749 7.6522 119.9268 63.6996 36.8944 178.6613 43 V 3.5118 7.7661 119.9891 66.4769 31.2399 178.2541 44 T 3.8667 7.3987 114.3803 66.0320 68.3172 176.4717 45 K 3.9237 8.1826 121.3783 59.4018 32.3608 177.9570 46 E 4.1497 7.7799 115.0446 56.5743 31.1504 177.1982 47 R 3.5267 7.6137 115.5251 56.6375 28.4070 173.7019 48 P 4.4281 0.0000 0.0000 63.5053 32.7318 176.4662 49 D 4.7088 7.7595 117.3095 54.2049 41.3154 176.3359 50 L 4.2848 7.0599 118.5574 54.1938 45.5659 173.3344 51 V 4.8824 7.9001 123.8430 61.0322 35.5056 173.6399 52 L 5.0330 9.4765 129.7581 53.2351 44.5720 174.7865 53 L 5.6558 9.0028 127.7810 52.2621 46.0369 174.1490 54 D 4.9784 8.5663 123.9266 52.7689 42.3649 175.4511 55 M 3.8975 8.5321 126.3198 58.1162 32.4220 175.3240 56 K 4.0001 7.9562 126.6435 56.9095 32.1455 175.9504 57 I 4.7042 7.8678 125.9204 58.6927 41.1578 173.4205 58 P 4.2489 0.0000 0.0000 63.5038 31.7651 173.6148 59 G 3.4268 8.8729 115.4040 45.9520 0.0000 168.2853 60 M 2.8666 8.2995 127.7481 54.3660 29.6071 175.8216 61 D 4.5053 8.4100 124.1276 53.2962 39.9777 178.0623 62 G 3.8433 8.3143 103.8455 45.4648 0.0000 175.5740 63 I 3.7509 7.7486 122.4892 64.4825 36.6369 177.6067 64 E 3.9364 7.9904 118.2028 59.4021 29.7557 178.1040 65 I 3.6329 7.8488 118.8140 65.1064 37.1188 177.9149 66 L 3.6038 8.6186 119.6233 58.1840 41.4420 179.7524 67 K 3.9719 7.5615 118.2282 59.4393 32.0328 179.3854 68 R 3.6910 9.3638 118.8000 59.5789 29.8344 178.9534 69 M 4.0070 8.5667 118.8545 58.4339 32.4731 178.6873 70 K 4.2987 7.9834 119.9794 59.5695 32.7398 179.2715 71 V 3.6356 8.3543 119.3389 65.4773 31.3256 177.8986 72 I 3.9007 7.7695 119.4893 63.2420 37.1919 175.9351 73 D 4.7487 7.4998 117.4715 53.1391 44.9250 175.4243 74 E 4.5577 8.7121 118.9726 56.3496 29.8961 175.9877 75 N 4.6918 7.8244 116.6154 53.6718 39.9160 174.4064 76 I 3.8323 7.5555 118.3823 61.2166 38.5436 174.3555 77 R 4.6683 8.5137 127.8674 54.5201 32.0631 174.3978 78 V 4.8760 8.1392 124.8949 60.1682 35.4152 173.9830 79 I 4.5047 8.7881 123.4530 59.6258 39.8143 174.8024 80 I 5.3969 7.5314 118.2415 59.1141 40.3858 174.4763 81 M 5.4083 8.0577 121.9958 54.4032 36.1943 174.0412 82 T 4.4376 9.2157 116.1831 61.0450 71.8400 171.9702 83 A 4.3638 8.2251 128.7509 51.4548 19.4962 178.0183 84 Y 4.6725 8.0514 119.5060 57.2808 36.4869 176.0675 85 G 3.9283 7.7323 108.4113 46.3637 0.0000 173.1839 86 E 4.6538 7.4545 119.0100 55.3422 29.6958 177.8149 87 L 3.9264 8.0260 121.3986 59.3226 42.0198 178.0528 88 D 4.7275 8.2453 117.1723 57.9479 40.8811 178.3405 89 M 3.9456 8.1566 117.8496 58.8933 32.1851 177.9790 90 I 3.9517 7.7072 119.2906 63.9203 37.4672 177.8827 91 Q 4.0595 9.0273 119.6233 58.9032 28.5405 178.0273 92 E 3.8931 8.0227 120.1915 59.7185 29.6338 178.9671 93 S 4.0790 8.2609 114.1144 61.6054 62.5328 176.6140 94 K 3.9454 8.5326 123.1055 59.5526 31.9353 178.6509 95 E 4.0864 8.0627 116.1614 58.3542 29.6247 178.0547 96 L 4.1073 7.9004 118.7313 55.8975 41.9377 177.7747 97 G 3.9218 8.2205 106.8047 45.3918 0.0000 173.6333 98 A 4.2670 7.7412 121.9571 51.2536 19.2167 179.2562 99 L 4.0876 7.9969 118.6361 57.3708 42.0920 177.2856 100 T 3.9386 6.8197 109.7687 62.4067 71.5850 170.3111 101 H 4.9430 8.4222 117.7333 54.8866 32.3952 173.2189 102 F 5.4771 8.8808 122.1030 56.0117 41.8313 174.6386 103 A 5.6217 8.7003 122.1062 50.4875 20.6009 178.4009 104 K 4.1033 8.3701 120.5267 58.5923 32.5798 176.1448 105 P 4.1164 0.0000 0.0000 61.7948 29.8006 175.0819 106 F 4.9702 7.1633 119.3145 54.7378 41.4120 174.7129 107 D 5.0120 8.2118 120.1298 52.2268 44.6142 176.9005 108 I 3.5382 8.1969 125.7509 64.2238 37.9293 177.3592 109 D 4.3737 8.1346 117.2944 57.8103 41.1019 178.0435 110 E 4.0924 7.8982 118.2123 59.4381 29.5808 179.1724 111 I 3.7468 7.4479 119.2075 63.9012 37.0181 178.4482 112 R 4.0358 8.4115 119.1758 58.3026 29.7134 178.4535 113 D 4.2868 8.0234 118.3909 57.2379 41.3918 178.0220 114 A 4.1027 7.9909 120.8297 55.2257 18.3536 179.6568 115 V 3.6856 8.1460 116.9051 66.0132 31.5123 177.9437 116 K 3.8696 8.1456 118.8726 57.6010 32.1577 177.8192 117 K 4.2504 8.1387 119.0980 58.3833 32.5526 177.0322 118 Y 4.1561 8.3729 119.0086 58.2143 39.2264 175.3406 119 L 4.8301 8.3032 120.1546 52.1956 44.7032 174.8935 120 P 4.7057 0.0000 0.0000 62.4130 29.9262 175.5003 121 L 4.5570 7.4048 118.5880 55.0649 43.4504 178.0332 122 K 4.5715 8.1836 119.2683 54.6597 31.8752 174.3803 123 S 4.6588 7.8247 115.0015 55.7083 64.4247 173.2337 124 N 4.3687 8.8710 123.8975 54.2948 38.4875 174.1889 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 M 8.30 4.52 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.60 0.00 2 M 8.23 4.91 0.00 2.42 2.22 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 3.00 0.00 3 N 8.32 4.86 0.00 2.61 2.63 0.00 0.00 6.56 7.65 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 4 E 7.40 4.56 0.00 1.16 1.12 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 1.47 1.49 0.00 5 K 7.49 4.75 0.00 1.57 1.54 0.00 1.72 0.00 0.00 2.02 0.00 0.00 3.03 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.61 1.40 7.81 6 I 7.90 4.67 1.22 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 0.82 -0.05 0.99 0.00 0.00 7 L 8.97 5.28 0.00 1.69 1.46 1.01 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.98 5.12 1.92 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 1.17 0.72 0.95 0.00 0.00 9 V 9.35 4.69 2.10 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 1.14 0.00 0.00 0.96 0.00 0.00 10 D 9.43 4.20 0.00 2.97 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 11 D 8.84 4.61 0.00 2.90 2.82 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 12 Q 7.69 4.22 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.11 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 13 Y 8.64 4.39 0.00 3.07 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 14 G 8.84 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 15 I 7.77 3.84 1.97 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.14 0.89 0.00 0.00 16 R 8.05 3.98 0.00 2.06 2.24 0.00 2.98 0.00 0.00 3.36 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 17 I 7.71 3.69 1.87 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 1.51 0.82 0.90 0.00 0.00 18 L 7.31 4.22 0.00 1.59 1.80 0.92 0.54 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 19 L 7.88 3.92 0.00 1.82 1.80 1.06 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 20 N 7.97 4.38 0.00 3.16 2.95 0.00 0.00 6.64 7.64 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 21 E 9.21 4.05 0.00 1.92 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 2.27 2.30 0.00 22 V 7.22 3.45 1.78 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 0.64 0.00 0.00 0.85 0.00 0.00 23 F 8.12 4.49 0.00 3.31 3.24 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 24 N 9.52 4.36 0.00 3.11 2.78 0.00 0.00 7.08 6.63 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 25 K 7.91 4.00 0.00 1.94 1.78 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.59 7.81 26 E 6.83 4.12 0.00 1.16 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 2.06 2.12 0.00 27 G 7.88 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 28 Y 7.34 4.68 0.00 2.94 2.92 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 29 Q 8.79 4.61 0.00 2.20 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.87 0.00 0.00 0.00 0.00 0.00 2.50 2.43 0.00 30 T 8.57 5.59 4.36 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 1.34 0.00 0.00 31 F 8.68 4.76 0.00 3.10 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 32 Q 8.96 5.95 0.00 1.92 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.55 0.00 0.00 0.00 0.00 0.00 2.26 2.16 0.00 33 A 8.47 4.92 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 34 A 8.90 4.53 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 35 N 7.52 4.13 0.00 2.93 2.83 0.00 0.00 6.90 8.26 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 36 G 7.86 3.53 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 0.00 0.00 0.00 37 L 7.89 3.91 0.00 1.72 1.69 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 8.28 4.03 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.69 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 39 A 7.53 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 40 L 8.27 3.89 0.00 1.75 1.71 0.91 0.91 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 41 D 8.44 4.25 0.00 2.72 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 42 I 7.65 3.77 1.94 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.75 0.95 0.00 0.00 43 V 7.77 3.51 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 0.95 0.00 0.00 0.88 0.00 0.00 44 T 7.40 3.87 4.19 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 1.17 0.00 0.00 45 K 8.18 3.92 0.00 1.75 1.52 0.00 1.46 0.00 0.00 1.41 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.49 7.81 46 E 7.78 4.15 0.00 2.06 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 2.52 2.39 0.00 47 R 7.61 3.53 0.00 1.96 2.40 0.00 3.03 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 48 P 0.00 4.43 0.00 2.32 2.04 0.00 3.74 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 1.93 1.96 0.00 49 D 7.76 4.71 0.00 2.53 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 50 L 7.06 4.28 0.00 1.52 1.29 0.55 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 51 V 7.90 4.88 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 0.89 0.00 0.00 0.92 0.00 0.00 52 L 9.48 5.03 0.00 1.71 1.64 0.90 -0.57 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 53 L 9.00 5.66 0.00 1.70 1.42 0.93 1.27 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 54 D 8.57 4.98 0.00 2.76 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 55 M 8.53 3.90 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.66 0.00 56 K 7.96 4.00 0.00 1.72 1.82 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.44 7.81 57 I 7.87 4.70 1.94 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 1.63 0.95 0.93 0.00 0.00 58 P 0.00 4.25 0.00 2.19 2.08 0.00 3.86 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 59 G 8.87 3.43 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 0.00 60 M 8.30 2.87 0.00 2.18 2.17 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 2.46 2.51 0.00 61 D 8.41 4.51 0.00 2.80 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 62 G 8.31 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 63 I 7.75 3.75 2.02 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 1.63 0.82 0.91 0.00 0.00 64 E 7.99 3.94 0.00 1.97 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 2.37 2.33 0.00 65 I 7.85 3.63 1.87 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 1.64 1.19 0.91 0.00 0.00 66 L 8.62 3.60 0.00 1.69 1.73 0.91 0.81 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 67 K 7.56 3.97 0.00 1.92 1.78 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.56 7.81 68 R 9.36 3.69 0.00 1.96 1.99 0.00 3.14 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 69 M 8.57 4.01 0.00 1.91 2.33 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 2.63 2.55 0.00 70 K 7.98 4.30 0.00 2.04 2.14 0.00 1.48 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.61 7.81 71 V 8.35 3.64 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 0.94 0.00 0.00 0.92 0.00 0.00 72 I 7.77 3.90 2.16 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 1.65 0.91 0.90 0.00 0.00 73 D 7.50 4.75 0.00 2.68 2.48 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 74 E 8.71 4.56 0.00 2.07 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 0.00 2.21 2.28 0.00 75 N 7.82 4.69 0.00 2.67 2.85 0.00 0.00 7.08 7.96 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 76 I 7.56 3.83 1.85 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 1.27 0.90 1.00 0.00 0.00 77 R 8.51 4.67 0.00 1.79 1.66 0.00 2.38 0.00 0.00 2.37 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.32 0.00 78 V 8.14 4.88 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 0.83 0.00 0.00 0.94 0.00 0.00 79 I 8.79 4.50 1.81 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.63 0.70 0.00 0.00 80 I 7.53 5.40 1.87 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 1.27 0.91 0.89 0.00 0.00 81 M 8.06 5.41 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.56 0.00 82 T 9.22 4.44 4.28 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 1.32 0.00 0.00 83 A 8.23 4.36 1.02 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 0.00 0.00 84 Y 8.05 4.67 0.00 3.11 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 85 G 7.73 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 86 E 7.45 4.65 0.00 2.27 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 2.18 2.31 0.00 87 L 8.03 3.93 0.00 1.73 1.82 0.99 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 88 D 8.25 4.73 0.00 2.78 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 89 M 8.16 3.95 0.00 2.15 2.02 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 2.58 2.70 0.00 90 I 7.71 3.95 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 1.66 0.99 0.74 0.00 0.00 91 Q 9.03 4.06 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.72 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 92 E 8.02 3.89 0.00 2.05 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 0.00 2.31 2.34 0.00 93 S 8.26 4.08 0.00 4.16 4.13 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 0.00 0.00 0.00 94 K 8.53 3.95 0.00 1.96 1.86 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.72 7.81 95 E 8.06 4.09 0.00 2.00 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 2.33 2.28 0.00 96 L 7.90 4.11 0.00 1.78 1.73 1.01 1.37 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 97 G 8.22 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 98 A 7.74 4.27 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 99 L 8.00 4.09 0.00 1.54 1.63 0.49 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 100 T 6.82 3.94 4.13 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 0.00 0.00 0.52 0.00 0.00 101 H 8.42 4.94 0.00 3.01 3.12 0.00 5.92 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 F 8.88 5.48 0.00 3.09 3.09 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 0.00 103 A 8.70 5.62 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 0.00 104 K 8.37 4.10 0.00 1.62 1.54 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.32 1.41 7.81 105 P 0.00 4.12 0.00 2.09 1.98 0.00 3.60 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.93 0.00 106 F 7.16 4.97 0.00 2.79 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 0.00 107 D 8.21 5.01 0.00 2.69 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 0.00 108 I 8.20 3.54 1.82 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.89 0.83 0.00 0.00 109 D 8.13 4.37 0.00 2.66 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.90 4.09 0.00 1.99 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 0.00 2.36 2.43 0.00 111 I 7.45 3.75 1.81 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 -0.22 0.95 0.00 0.00 112 R 8.41 4.04 0.00 1.98 1.97 0.00 3.05 0.00 0.00 2.95 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 113 D 8.02 4.29 0.00 3.03 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 0.00 114 A 7.99 4.10 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 0.00 115 V 8.15 3.69 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 1.28 0.00 0.00 1.20 0.00 0.00 116 K 8.15 3.87 0.00 1.92 1.93 0.00 1.72 0.00 0.00 1.52 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.40 7.81 117 K 8.14 4.25 0.00 1.91 2.03 0.00 1.94 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.60 7.81 118 Y 8.37 4.16 0.00 3.21 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 0.00 119 L 8.30 4.83 0.00 1.81 1.70 1.08 1.19 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 0.00 120 P 0.00 4.71 0.00 2.20 2.12 0.00 3.90 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 1.96 1.98 0.00 121 L 7.40 4.56 0.00 1.81 1.79 1.20 1.17 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 0.00 122 K 8.18 4.57 0.00 1.72 1.71 0.00 1.81 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.43 7.81 123 S 7.82 4.66 0.00 3.86 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 0.00 124 N 8.87 4.37 0.00 2.68 2.72 0.00 0.00 6.91 7.56 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