NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2024 8.3049 118.1895 54.1899 33.1045 172.2316 2 K 3.6741 8.1259 123.7323 56.3140 31.7550 172.5103 3 K 5.1251 9.8924 127.3480 54.8244 35.8889 174.5438 4 I 5.1440 8.8221 126.0786 59.4240 40.8182 174.0614 5 L 5.1062 9.0477 128.3853 53.2640 44.6717 174.5352 6 L 5.1068 9.3024 129.2594 53.7650 43.7924 174.8444 7 L 5.5347 9.3870 126.6668 53.0739 45.0615 175.2733 8 N 5.3548 9.2244 120.3517 51.7594 42.2535 174.9260 9 G 4.2741 9.0645 113.9143 43.7040 0.0000 170.7351 10 P 4.2868 0.0000 0.0000 64.5780 31.4454 176.6140 11 N 4.4144 9.6906 117.2657 53.7263 37.8440 176.3662 12 L 4.0655 7.4674 118.8605 57.2470 41.8061 178.7990 13 N 4.4590 7.9818 114.6896 55.1163 37.6242 175.6232 14 M 4.2016 8.0194 118.4313 55.9304 32.5877 175.8677 15 L 4.1202 7.6897 122.6999 56.7278 42.3818 177.6366 16 G 4.2514 8.9621 112.6552 46.4340 0.0000 173.6491 17 K 4.2988 7.9421 119.1782 57.1413 33.3348 177.2899 18 R 4.1422 7.8458 118.2258 55.4664 30.5168 175.7955 19 E 3.9208 8.9685 124.8475 58.5672 29.7702 175.4152 20 P 4.1868 0.0000 0.0000 62.6521 30.0626 175.1794 21 H 4.3732 7.8321 120.3000 56.0022 29.3597 174.9450 22 I 4.1004 8.4606 121.7482 62.8710 38.8698 176.1529 23 Y 4.3834 9.4433 114.9026 58.3143 39.1244 176.0047 24 G 4.2715 8.0299 105.0442 43.0549 0.0000 173.4393 25 S 4.1362 8.2059 114.2552 60.5352 62.4120 174.4086 26 Q 4.1452 8.1061 122.0604 56.5526 29.3755 175.3454 27 T 4.9524 8.5592 116.5941 58.8967 72.5989 175.3797 28 L 3.7848 8.1389 121.7105 58.2292 41.9035 178.5708 29 S 4.1433 7.7947 113.9009 60.8509 62.2414 175.6699 30 D 4.2714 7.7858 121.1843 57.4661 40.4704 178.9408 31 I 3.5372 7.3857 119.7691 64.1526 36.6303 178.2795 32 E 3.6120 7.9209 119.4165 59.4494 29.1321 179.5045 33 Q 3.9177 7.9613 118.1255 59.0990 28.7505 178.3174 34 H 4.0245 8.3397 119.4127 59.3758 29.9192 177.3649 35 L 4.0403 8.2086 121.0945 57.7288 41.4405 179.3187 36 Q 4.0392 8.2299 119.6056 59.2901 29.0442 178.2357 37 Q 4.0217 8.3488 119.3835 58.9552 28.5205 178.7678 38 S 4.0472 8.0729 113.9648 61.2054 62.4207 176.0245 39 A 4.0770 8.1504 123.4773 55.4081 18.0945 179.6477 40 Q 4.7434 8.5200 117.6494 58.7188 28.5856 178.9084 41 A 4.0535 8.0715 120.6038 54.5716 18.3887 178.6160 42 Q 4.5291 7.6061 114.4791 55.3724 29.0838 175.9705 43 G 3.7397 8.4351 108.2145 46.4779 0.0000 173.1494 44 Y 4.8398 8.1513 115.4953 55.8133 42.3355 174.4968 45 E 5.0369 8.5175 119.3895 55.0244 32.1717 175.1433 46 L 5.2215 8.3699 124.2678 53.9258 45.2245 174.8692 47 D 5.1648 9.2142 126.1841 52.8979 43.8066 174.9213 48 Y 5.4929 7.6502 117.5304 55.8978 41.5304 174.0773 49 F 5.0260 9.1296 121.3999 57.5008 43.4499 172.5877 50 Q 5.3530 7.6544 124.3509 53.8817 32.0628 173.4179 51 A 4.3910 8.2291 124.5971 51.2006 22.1577 175.5926 52 N 4.7729 8.7869 115.8584 52.9991 39.3267 175.8138 53 G 4.5132 7.6876 104.3857 42.1484 0.0000 173.7595 54 E 3.8174 8.6299 120.9510 59.0385 29.4497 179.3081 55 E 3.8680 8.1092 118.8359 59.4084 29.8857 178.8875 56 S 4.2014 8.0831 114.5460 61.6891 63.0445 176.6058 57 L 4.2196 7.9736 121.1974 58.0118 41.3463 179.6747 58 I 3.6041 8.2792 120.0697 64.3710 36.9672 178.2957 59 N 4.2105 8.3024 117.5534 56.2031 38.0994 177.4892 60 R 4.0879 7.3684 120.3269 58.7101 30.4586 178.3770 61 I 3.8306 7.7356 119.7309 64.7092 37.2308 178.1139 62 H 4.2717 8.3332 117.2212 59.0222 28.3841 177.9027 63 Q 4.1013 8.2388 119.3981 58.3482 28.4957 177.9716 64 A 4.4584 7.8000 122.0885 51.6951 18.5959 177.0525 65 F 4.4254 7.3554 119.6701 60.0771 39.6456 175.2691 66 Q 3.4237 8.6448 124.7190 56.2337 26.0121 173.4003 67 N 4.9654 8.2009 113.4696 51.9275 38.8988 173.9248 68 T 4.7611 7.8563 115.4251 62.0848 70.9729 173.3920 69 D 4.8928 8.9204 124.9161 55.3145 42.5073 176.5346 70 F 4.8793 8.0130 119.0901 56.8916 43.2509 172.7852 71 I 5.1734 8.3172 125.2170 59.6084 40.8059 174.4619 72 I 5.1463 9.0112 127.2595 59.7158 39.6742 174.4410 73 I 5.1200 8.9964 127.4140 59.2399 41.6533 173.5759 74 N 5.5489 9.5207 128.5889 50.3777 40.0271 172.9121 75 P 4.5570 0.0000 0.0000 62.4993 33.0318 178.0256 76 G 3.7232 8.4876 108.8061 46.3405 0.0000 175.8095 77 A 4.1958 8.3905 121.7829 54.9354 18.7291 179.4093 78 F 4.8854 7.9051 114.2054 60.1664 38.7691 177.3461 79 T 3.9727 8.1222 113.4916 65.0653 66.8801 175.2656 80 H 4.9462 8.1851 117.1584 57.0528 29.1461 175.9752 81 T 4.6892 8.0781 108.1635 61.4511 70.7751 174.6886 82 S 4.3863 8.4182 117.6842 57.0364 61.3707 174.1634 83 V 3.3452 7.6088 127.8707 64.9989 31.5377 177.1214 84 A 3.8638 7.6798 120.4192 55.1970 18.2547 179.5280 85 I 3.6093 7.7958 118.3971 64.1142 37.1399 178.4820 86 R 3.8598 7.7037 119.4289 59.8179 29.9502 178.4477 87 D 4.3833 8.3604 118.3081 56.9308 40.5717 178.7481 88 A 3.9776 7.7563 121.5385 55.1035 17.3963 179.6584 89 L 3.8643 7.9100 117.5512 57.9354 41.5096 179.8268 90 L 4.3251 8.0637 118.7617 57.6615 41.3033 179.3979 91 A 3.9188 7.9422 120.0665 54.6988 18.3983 179.2110 92 V 3.7188 7.4637 108.0097 60.6365 32.5659 176.0807 93 S 3.7560 7.5304 114.3312 59.8250 60.9364 172.5470 94 I 4.4738 7.0625 119.8398 58.6169 39.1555 174.6181 95 P 4.4915 0.0000 0.0000 62.8005 32.4947 175.3318 96 F 5.6114 7.9814 116.3650 54.7109 42.0871 172.6480 97 I 4.8935 8.6174 119.1706 59.2586 41.1678 173.4168 98 E 5.1814 8.9986 130.2500 55.1693 31.4017 174.8248 99 V 4.8749 8.7422 126.0056 61.4800 35.4167 173.8470 100 H 4.9619 8.8684 122.9063 54.1863 32.8126 174.3060 101 L 3.9470 8.7779 123.3094 57.7212 42.3595 177.9294 102 S 4.7346 8.0183 111.1117 56.9697 64.7882 173.2281 103 N 4.6275 8.3655 119.3402 52.3235 37.8122 175.8652 104 V 3.6711 8.1844 120.0876 64.0595 31.7815 177.3357 105 H 4.5521 8.3393 115.2691 56.8680 28.9244 175.6119 106 A 4.6777 7.9159 121.7990 51.7717 19.5071 177.5898 107 R 4.6544 7.2323 117.2856 56.6469 31.5613 175.8218 108 E 3.9667 8.1350 122.6314 56.4813 30.3916 175.9565 109 P 4.0803 0.0000 0.0000 65.6061 31.9021 178.8228 110 F 4.3484 7.8385 112.3236 59.2209 37.8876 176.5003 111 R 3.8203 7.0208 118.8432 56.9961 29.9889 176.9811 112 H 4.5116 8.0471 115.5415 57.5455 29.1156 174.8610 113 H 4.8100 7.5319 118.1084 54.4391 31.1207 173.9040 114 S 4.8702 7.7497 118.6757 57.1706 65.3479 173.0659 115 Y 4.7650 8.9711 122.9608 57.9867 38.4840 176.2375 116 L 4.8285 8.2980 120.6998 56.1775 44.3741 178.7400 117 S 4.2643 8.4650 114.5260 61.7859 62.7965 176.3257 118 D 4.4205 8.1635 117.3899 55.3010 39.3316 177.0063 119 V 4.1901 7.7154 111.1497 60.8917 32.5254 175.7707 120 A 2.8461 7.2809 123.3524 50.7945 19.1017 177.7309 121 K 4.0594 8.3866 122.3490 59.5466 33.0281 176.8155 122 G 4.0367 7.4029 104.6200 45.5907 0.0000 172.1285 123 V 5.1261 8.1102 118.5720 61.0883 35.0982 174.5197 124 I 4.7153 8.8198 127.1849 59.6244 40.3958 174.1537 125 C 5.2001 8.7815 121.5218 57.7757 32.1204 174.6505 126 G 3.9971 9.2137 110.7800 45.4943 0.0000 173.6150 127 L 4.5220 7.7693 118.1737 53.7187 42.5910 178.5919 128 G 3.7763 8.1468 108.6291 45.9140 0.0000 175.0222 129 A 4.2084 8.5493 118.9609 55.3193 18.2856 179.9329 130 K 3.9106 8.1344 116.7261 59.4261 31.9967 179.2572 131 G 3.6719 8.0216 106.0939 48.0946 0.0000 175.3344 132 Y 4.1378 7.7991 118.8225 60.9152 37.8624 178.2158 133 D 4.3731 7.8026 119.4125 57.6092 40.8888 178.2953 134 Y 4.4012 7.5384 117.0420 61.0115 37.7773 178.2988 135 A 4.1166 8.3118 121.8511 55.1260 18.4607 179.4839 136 L 3.8848 8.2063 118.8666 58.2614 42.1919 178.5946 137 D 4.2855 8.2552 118.0392 57.3613 41.1329 178.1137 138 F 4.1327 8.8540 122.4576 60.5320 39.4344 176.8318 139 A 2.5800 8.0738 120.7656 54.8540 17.9946 179.7145 140 I 3.1335 7.4637 118.4199 64.2264 36.7332 178.8182 141 S 3.9870 7.7449 115.1416 61.5026 62.5699 176.5157 142 E 3.7460 7.6847 122.1438 58.9306 29.0541 179.3016 143 L 4.0366 7.6765 119.1153 57.8464 41.4629 179.5079 144 Q 4.1332 8.1695 117.3840 58.7260 28.6778 178.6906 145 K 4.1108 7.5959 118.5767 58.2228 32.0599 177.0199 146 I 4.0761 7.8079 125.0438 61.2745 37.3210 175.2600 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 4.20 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.55 0.00 2 K 8.13 3.67 0.00 2.19 2.00 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.52 7.81 3 K 9.89 5.13 0.00 1.86 1.83 0.00 1.60 0.00 0.00 1.87 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.45 7.81 4 I 8.82 5.14 1.95 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.62 1.06 0.00 0.00 5 L 9.05 5.11 0.00 1.79 1.58 1.03 0.72 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 6 L 9.30 5.11 0.00 1.88 1.81 1.06 0.34 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 7 L 9.39 5.53 0.00 1.64 1.64 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 8 N 9.22 5.35 0.00 2.59 2.66 0.00 0.00 6.56 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 9 G 9.06 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 10 P 0.00 4.29 0.00 1.83 1.62 0.00 3.79 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.44 0.00 11 N 9.69 4.41 0.00 2.87 3.00 0.00 0.00 6.82 6.58 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 12 L 7.47 4.07 0.00 1.76 1.68 0.93 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 13 N 7.98 4.46 0.00 2.78 3.07 0.00 0.00 6.08 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 M 8.02 4.20 0.00 2.10 2.30 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.60 0.00 15 L 7.69 4.12 0.00 1.84 1.52 0.81 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.96 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 17 K 7.94 4.30 0.00 1.86 1.86 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.65 1.52 7.81 18 R 7.85 4.14 0.00 1.81 1.88 0.00 3.24 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 19 E 8.97 3.92 0.00 1.88 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 2.28 2.34 0.00 20 P 0.00 4.19 0.00 2.16 2.04 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 21 H 7.83 4.37 0.00 3.23 3.38 0.00 5.68 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 22 I 8.46 4.10 1.69 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 1.29 0.73 0.10 0.00 0.00 23 Y 9.44 4.38 0.00 2.97 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.03 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 25 S 8.21 4.14 0.00 3.84 3.91 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 26 Q 8.11 4.15 0.00 2.11 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.48 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 27 T 8.56 4.95 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 1.24 0.00 0.00 28 L 8.14 3.78 0.00 1.85 1.61 0.75 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 29 S 7.79 4.14 0.00 3.84 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 30 D 7.79 4.27 0.00 2.79 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 31 I 7.39 3.54 1.66 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.71 0.26 0.00 0.00 32 E 7.92 3.61 0.00 1.59 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 1.94 2.14 0.00 33 Q 7.96 3.92 0.00 1.97 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 34 H 8.34 4.02 0.00 3.19 3.41 0.00 5.59 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 35 L 8.21 4.04 0.00 1.92 1.71 0.99 1.02 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 36 Q 8.23 4.04 0.00 2.38 2.30 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 2.54 2.65 0.00 37 Q 8.35 4.02 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 38 S 8.07 4.05 0.00 3.86 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 39 A 8.15 4.08 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 40 Q 8.52 4.74 0.00 2.30 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.50 2.43 0.00 41 A 8.07 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 42 Q 7.61 4.53 0.00 2.37 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.26 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 43 G 8.44 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 0.00 0.00 0.00 44 Y 8.15 4.84 0.00 3.08 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 45 E 8.52 5.04 0.00 2.03 1.89 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 2.27 2.26 0.00 46 L 8.37 5.22 0.00 1.68 1.58 1.05 1.34 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 47 D 9.21 5.16 0.00 2.67 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 48 Y 7.65 5.49 0.00 2.87 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 49 F 9.13 5.03 0.00 3.14 2.94 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 50 Q 7.65 5.35 0.00 1.93 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.50 0.00 0.00 0.00 0.00 0.00 2.24 2.05 0.00 51 A 8.23 4.39 1.15 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 0.00 0.00 52 N 8.79 4.77 0.00 2.72 2.81 0.00 0.00 6.65 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 53 G 7.69 4.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 8.63 3.82 0.00 1.82 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 0.00 1.59 1.47 0.00 55 E 8.11 3.87 0.00 2.01 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 2.38 2.39 0.00 56 S 8.08 4.20 0.00 4.07 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 57 L 7.97 4.22 0.00 1.80 1.81 1.28 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 58 I 8.28 3.60 1.82 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.62 0.61 0.00 0.00 59 N 8.30 4.21 0.00 2.85 2.79 0.00 0.00 6.65 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 60 R 7.37 4.09 0.00 0.82 1.77 0.00 2.94 0.00 0.00 2.25 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.33 0.00 61 I 7.74 3.83 1.92 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 1.47 1.04 0.91 0.00 0.00 62 H 8.33 4.27 0.00 3.28 3.28 0.00 5.64 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 63 Q 8.24 4.10 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.65 0.00 64 A 7.80 4.46 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 65 F 7.36 4.43 0.00 2.99 3.10 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 66 Q 8.64 3.42 0.00 1.87 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 1.28 1.16 0.00 67 N 8.20 4.97 0.00 2.88 2.94 0.00 0.00 6.77 7.38 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 68 T 7.86 4.76 4.38 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 1.28 0.00 0.00 69 D 8.92 4.89 0.00 2.74 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 70 F 8.01 4.88 0.00 3.10 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 71 I 8.32 5.17 1.92 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 1.29 0.95 1.01 0.00 0.00 72 I 9.01 5.15 2.08 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.98 1.15 0.00 0.00 73 I 9.00 5.12 1.91 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 1.25 1.93 1.01 0.00 0.00 74 N 9.52 5.55 0.00 2.83 3.02 0.00 0.00 6.84 8.53 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 75 P 0.00 4.56 0.00 2.41 2.36 0.00 3.77 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.05 0.00 76 G 8.49 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 77 A 8.39 4.20 1.31 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 0.00 0.00 0.00 78 F 7.91 4.89 0.00 3.33 3.02 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 79 T 8.12 3.97 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 0.93 0.00 0.00 80 H 8.19 4.95 0.00 3.45 3.49 0.00 5.65 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 81 T 8.08 4.69 4.37 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 1.36 0.00 0.00 82 S 8.42 4.39 0.00 3.59 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 83 V 7.61 3.35 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 0.89 0.00 0.00 -0.10 0.00 0.00 84 A 7.68 3.86 1.23 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 0.00 0.00 85 I 7.80 3.61 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.47 0.84 0.00 0.00 86 R 7.70 3.86 0.00 2.01 2.14 0.00 3.28 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 1.68 1.88 0.00 87 D 8.36 4.38 0.00 2.78 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 88 A 7.76 3.98 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 89 L 7.91 3.86 0.00 1.68 1.49 0.06 0.19 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 90 L 8.06 4.33 0.00 1.84 1.73 0.96 0.86 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 91 A 7.94 3.92 1.24 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 0.00 0.00 92 V 7.46 3.72 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 0.82 0.00 0.00 1.06 0.00 0.00 93 S 7.53 3.76 0.00 4.06 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 94 I 7.06 4.47 1.91 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 1.37 0.92 0.90 0.00 0.00 95 P 0.00 4.49 0.00 1.59 1.86 0.00 3.65 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.08 0.00 96 F 7.98 5.61 0.00 3.10 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 97 I 8.62 4.89 2.24 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 1.30 1.67 1.27 0.00 0.00 98 E 9.00 5.18 0.00 2.33 1.87 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 2.29 2.33 0.00 99 V 8.74 4.87 1.79 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 0.31 0.00 0.00 0.87 0.00 0.00 100 H 8.87 4.96 0.00 3.04 3.08 0.00 5.67 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 0.00 101 L 8.78 3.95 0.00 1.38 1.15 0.44 0.66 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 0.00 102 S 8.02 4.73 0.00 4.05 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 0.00 103 N 8.37 4.63 0.00 2.77 2.78 0.00 0.00 6.88 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 0.00 104 V 8.18 3.67 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 0.56 0.00 0.00 0.65 0.00 0.00 105 H 8.34 4.55 0.00 3.31 3.37 0.00 5.64 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 0.00 106 A 7.92 4.68 1.26 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 0.00 0.00 0.00 107 R 7.23 4.65 0.00 1.56 1.53 0.00 3.19 0.00 0.00 3.14 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.66 0.00 108 E 8.13 3.97 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 2.37 2.26 0.00 109 P 0.00 4.08 0.00 2.18 2.12 0.00 3.52 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.04 0.00 110 F 7.84 4.35 0.00 3.15 3.31 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 0.00 111 R 7.02 3.82 0.00 1.59 1.85 0.00 2.87 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.54 0.00 112 H 8.05 4.51 0.00 3.32 3.34 0.00 5.66 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 0.00 113 H 7.53 4.81 0.00 3.22 3.15 0.00 5.70 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 0.00 114 S 7.75 4.87 0.00 3.82 3.63 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 0.00 0.00 0.00 0.00 115 Y 8.97 4.76 0.00 3.08 2.94 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 0.00 116 L 8.30 4.83 0.00 1.84 1.93 1.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.47 4.26 0.00 3.90 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 0.00 118 D 8.16 4.42 0.00 2.80 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 V 7.72 4.19 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 0.77 0.00 0.00 1.28 0.00 0.00 120 A 7.28 2.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 K 8.39 4.06 0.00 1.75 2.08 0.00 1.81 0.00 0.00 1.83 0.00 0.00 3.13 0.00 0.00 3.30 0.00 0.00 0.00 0.00 2.00 1.73 7.81 122 G 7.40 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 0.00 0.00 0.00 123 V 8.11 5.13 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 0.96 0.00 0.00 0.93 0.00 0.00 124 I 8.82 4.72 1.85 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 1.24 0.72 0.97 0.00 0.00 125 C 8.78 5.20 0.00 2.92 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 0.00 126 G 9.21 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 L 7.77 4.52 0.00 1.74 1.84 1.06 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.15 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 0.00 129 A 8.55 4.21 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 0.00 130 K 8.13 3.91 0.00 1.90 1.39 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.45 7.81 131 G 8.02 3.67 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 0.00 0.00 0.00 132 Y 7.80 4.14 0.00 3.12 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 0.00 133 D 7.80 4.37 0.00 2.41 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 0.00 134 Y 7.54 4.40 0.00 3.15 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 0.00 135 A 8.31 4.12 1.52 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 0.00 0.00 0.00 0.00 0.00 0.00 136 L 8.21 3.88 0.00 1.83 1.89 0.88 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 0.00 137 D 8.26 4.29 0.00 2.85 2.95 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 0.00 138 F 8.85 4.13 0.00 3.21 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 0.00 139 A 8.07 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 I 7.46 3.13 1.75 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 0.41 0.35 0.70 0.00 0.00 141 S 7.74 3.99 0.00 3.93 4.08 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 0.00 0.00 0.00 0.00 142 E 7.68 3.75 0.00 1.61 1.90 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 1.47 1.85 0.00 143 L 7.68 4.04 0.00 1.82 1.84 0.89 0.84 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 0.00 144 Q 8.17 4.13 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.97 0.00 0.00 0.00 0.00 0.00 2.50 2.68 0.00 145 K 7.60 4.11 0.00 1.88 1.86 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.66 7.81 146 I 7.81 4.08 2.04 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 1.18 0.59 0.93 0.00 0.00