NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2276 8.3144 121.7898 56.1979 32.1459 173.8336 2 E 3.9955 8.1403 125.7390 53.5132 30.6351 175.0966 3 T 4.2177 8.6748 118.2325 61.1928 72.1474 175.1046 4 A 4.0003 8.4802 123.1835 55.1983 18.4467 179.7984 5 A 4.1242 8.0377 118.6155 55.4389 18.4324 179.6081 6 A 4.0116 8.2485 119.3180 55.0576 18.4362 179.7055 7 K 4.0791 8.4364 119.9620 59.0751 32.2163 178.6973 8 F 4.1415 8.4704 120.9145 61.4640 39.1548 176.9915 9 E 4.0461 8.4963 118.2268 59.3286 29.0315 179.3779 10 R 3.8903 8.0786 118.1089 59.6378 30.2915 178.3540 11 Q 3.9775 8.2489 116.9996 58.3065 28.9324 176.3962 12 H 4.9502 8.2009 113.5802 53.7952 31.5238 173.0682 13 M 4.7008 7.7062 118.9843 53.9236 33.7821 175.9239 14 D 4.5526 9.3438 123.0187 52.4032 42.9754 174.7912 15 S 4.8464 8.4384 119.5535 58.4193 63.2025 176.1376 16 S 4.3148 8.2325 116.4120 60.7136 62.4050 174.2520 17 T 4.6515 7.4866 112.3762 58.4718 70.7245 175.4536 18 S 4.1898 8.5765 117.9462 61.1583 63.2026 173.2991 19 A 4.1669 6.8701 118.1850 50.4584 22.0103 174.9164 20 A 3.5566 8.0461 121.1015 52.3163 18.2118 176.0869 21 S 4.5150 7.6231 115.9847 59.7028 66.4052 174.8862 22 S 4.3961 7.6595 114.3539 58.4812 64.0252 175.6429 23 S 4.4264 8.5097 116.7760 60.3686 62.9967 174.6057 24 N 4.8478 8.1410 118.2189 53.5215 38.6992 176.3826 25 Y 3.9806 8.0741 121.9442 60.9937 38.7280 177.4390 26 C 4.2656 8.4713 117.4464 60.1303 34.7078 175.7448 27 N 4.4106 8.2510 117.4773 56.4393 38.1556 177.0816 28 Q 3.8088 7.7364 120.3633 59.5715 29.3136 178.1173 29 M 3.6622 7.9077 120.0156 58.4438 31.7906 178.7903 30 M 4.0501 8.2099 119.3310 57.9766 32.1324 178.6913 31 K 3.9417 7.7982 119.8292 59.4480 32.2943 178.4922 32 S 4.4590 7.8158 111.1578 59.4509 63.3612 175.1191 33 R 4.4091 7.5044 120.9006 55.3158 30.1228 175.5738 34 N 4.2530 7.7977 114.2551 54.6268 36.7029 174.7587 35 L 4.5955 8.0428 116.0795 54.8858 41.9274 177.5880 36 T 5.0484 7.5707 106.8910 60.3172 69.3587 175.2661 37 K 4.1694 8.5395 123.8130 59.7978 32.3472 177.2585 38 D 4.9335 8.2243 114.5850 52.4339 41.4527 175.5886 39 R 3.8190 7.2428 114.4856 54.5665 32.3479 174.3363 40 C 4.8702 8.4551 116.4435 55.3699 40.5412 173.8616 41 K 4.1857 8.6138 127.6065 55.9892 32.2598 174.8825 42 P 4.7843 0.0000 0.0000 64.3150 32.6176 176.5829 43 V 4.9991 7.6044 117.6610 61.0543 34.4353 174.6046 44 N 4.6827 9.2404 125.6046 52.8226 42.9519 172.8984 45 T 4.7487 7.9978 122.4632 62.0431 70.9756 173.4093 46 F 5.0253 8.9946 124.5024 55.6359 42.3849 174.5494 47 V 4.3724 9.0350 123.7464 61.4573 32.8352 175.7605 48 H 5.1537 8.4008 129.1638 53.6453 26.2476 173.3193 49 E 4.7555 7.6482 118.6973 53.5323 34.6283 176.0417 50 S 4.3702 8.3870 114.5753 58.1999 64.9930 174.6904 51 L 3.9922 7.9518 122.1840 58.5465 41.8162 179.4591 52 A 3.9924 8.0069 120.0253 55.3759 18.1510 179.1736 53 D 4.3434 8.0786 116.3598 57.4392 41.1727 178.9499 54 V 3.8103 7.7468 118.3242 66.1111 31.7307 178.2397 55 Q 3.9424 8.4391 117.7435 58.6648 28.4397 178.4176 56 A 4.0306 8.1511 121.7172 54.7130 18.2153 179.6410 57 V 3.4114 7.7229 116.9747 66.0537 31.2820 177.0943 58 C 3.7804 7.7358 114.3992 58.3596 39.9211 174.2885 59 S 4.6234 7.5478 115.4796 58.3356 63.9710 174.0700 60 Q 4.0377 7.2735 121.2007 55.6205 29.7002 178.9194 61 K 4.3884 8.5211 135.0000 56.1481 32.6022 174.1815 62 N 4.3919 8.7864 127.4270 53.7706 39.7784 174.2990 63 V 4.5913 8.5576 118.0580 59.2773 36.8315 174.6827 64 A 4.2422 8.3784 124.9335 52.2582 19.0480 178.5467 65 C 4.7735 9.0318 119.5841 55.9598 41.2262 175.2707 66 K 3.8541 8.6855 120.9257 59.4729 31.5526 178.1421 67 N 4.5570 8.0939 113.3380 52.7126 37.6488 175.8709 68 G 3.9324 8.3912 108.7699 45.5592 0.0000 174.1819 69 Q 4.2628 8.7027 119.5023 56.2175 29.2510 176.2357 70 T 4.6861 8.2672 107.9995 61.6362 69.3044 173.8208 71 N 5.0799 8.0991 117.7801 53.9932 38.6022 174.6523 72 C 5.3578 7.4734 114.8934 56.7573 44.6830 172.6700 73 Y 5.0538 8.7683 117.8493 56.5479 42.3525 173.8947 74 Q 4.9932 9.0021 125.9685 54.2483 30.9720 174.9215 75 S 4.4914 9.0905 122.3824 58.6205 63.1621 174.3483 76 Y 4.5350 9.2428 121.6583 60.8119 37.9389 176.7297 77 S 5.0431 7.8526 114.0808 56.7285 64.9042 174.7296 78 T 4.0735 8.3371 112.6002 62.5067 69.4475 173.2241 79 M 5.0130 8.9023 121.6714 53.3941 37.1606 174.5685 80 S 4.9161 9.3679 117.4705 58.1142 63.5168 173.0714 81 I 5.1381 9.0541 120.6136 59.4113 41.5330 174.2229 82 T 4.9607 8.9437 120.0382 62.0182 71.1974 172.9105 83 D 5.0307 9.4738 127.2410 53.2093 42.8197 174.7249 84 C 5.4014 9.2224 122.1278 55.2408 43.8321 172.9254 85 R 5.1494 8.8261 123.7917 54.0904 32.9587 174.0232 86 E 4.0922 9.8845 128.8907 56.8487 30.7588 176.9116 87 T 4.2754 8.0591 116.2622 60.6773 69.9573 175.0594 88 G 3.6877 8.4434 110.3734 48.5812 0.0000 175.1597 89 S 4.2377 7.8583 114.1006 59.8281 63.3317 174.2730 90 S 4.0769 7.4886 115.8701 57.9040 62.5572 173.0861 91 K 4.5041 8.3571 128.1913 54.1917 34.5876 174.3588 92 Y 4.3662 8.7750 126.8376 57.8933 38.9689 174.8931 93 P 3.1575 0.0000 0.0000 63.1793 32.1134 176.7101 94 N 4.6340 7.3301 118.0365 51.8545 36.9841 173.9650 95 C 4.4450 8.0276 118.0100 56.9263 37.4323 173.2017 96 A 4.9911 8.1573 123.1872 50.9237 22.4245 174.9047 97 Y 4.9511 9.0263 119.0207 56.0582 42.0065 175.2354 98 K 4.5587 9.0125 122.1833 55.7171 34.2367 175.6571 99 T 4.8983 8.5535 121.1481 62.4348 70.1908 174.1381 100 T 4.6411 8.9488 123.2166 61.7395 71.8450 172.9506 101 Q 4.9121 8.7406 127.0739 55.2261 30.7311 174.1289 102 A 4.7267 8.8086 125.3077 50.9822 23.3685 174.8688 103 N 5.4168 8.7010 115.5961 51.7173 41.7385 174.0181 104 K 4.6396 8.9785 122.3520 54.9561 37.5943 175.6417 105 H 4.8864 9.4001 119.7418 55.8275 30.1493 174.7669 106 I 4.8161 8.4934 114.8914 59.3239 40.7564 174.4710 107 I 4.9035 8.2364 124.3814 59.7326 40.1037 174.9729 108 V 4.7896 8.6259 119.9315 59.2495 35.5705 174.7794 109 A 4.8773 8.7621 125.9078 51.5195 20.1474 175.7398 110 C 5.0697 8.4906 118.9392 55.2504 39.7706 173.0659 111 E 4.5543 8.8191 121.6960 56.4590 33.7593 175.5015 112 G 3.8338 9.4991 110.4478 44.6252 0.0000 171.6763 113 N 4.9794 8.1885 116.4094 50.8164 40.3368 172.4674 114 P 4.3649 0.0000 0.0000 62.7510 32.0793 176.1275 115 Y 4.8867 8.2281 121.6021 56.4192 38.3335 174.4459 116 V 4.4550 7.8849 119.0791 58.1053 36.5232 173.3539 117 P 4.3855 0.0000 0.0000 62.9334 30.9785 176.9551 118 V 4.3747 8.9778 116.9971 61.5591 34.0280 175.3692 119 H 5.0179 7.8333 119.4466 54.7553 33.5440 171.9564 120 F 4.6951 8.7096 127.7874 57.3715 39.1697 174.6898 121 D 4.5533 8.7204 127.2475 56.4600 41.7293 175.6551 122 A 4.6481 6.6939 117.3023 51.4094 22.7340 174.4135 123 S 5.1420 8.7455 112.8360 56.7020 66.1377 174.5509 124 V 4.1057 9.0008 121.8492 63.1731 31.7863 174.9523 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 K 8.31 4.23 0.00 1.74 1.84 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.14 4.00 0.00 2.13 1.81 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 2.39 2.38 0.00 3 T 8.67 4.22 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 1.22 0.00 0.00 4 A 8.48 4.00 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 5 A 8.04 4.12 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 6 A 8.25 4.01 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 7 K 8.44 4.08 0.00 2.02 2.05 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.32 7.81 8 F 8.47 4.14 0.00 3.24 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 9 E 8.50 4.05 0.00 2.31 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 2.50 2.68 0.00 10 R 8.08 3.89 0.00 1.88 2.11 0.00 3.40 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 11 Q 8.25 3.98 0.00 1.65 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.47 0.00 0.00 0.00 0.00 0.00 2.25 2.42 0.00 12 H 8.20 4.95 0.00 1.94 2.66 0.00 5.61 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 13 M 7.71 4.70 0.00 1.89 2.17 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 2.71 2.64 0.00 14 D 9.34 4.55 0.00 2.61 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.44 4.85 0.00 3.92 3.88 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 16 S 8.23 4.31 0.00 4.02 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 17 T 7.49 4.65 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 1.23 0.00 0.00 18 S 8.58 4.19 0.00 3.98 4.03 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 0.00 0.00 0.00 19 A 6.87 4.17 1.10 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 20 A 8.05 3.56 0.99 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 0.00 0.00 21 S 7.62 4.52 0.00 3.83 3.73 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 22 S 7.66 4.40 0.00 4.03 4.02 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 23 S 8.51 4.43 0.00 3.91 3.99 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 24 N 8.14 4.85 0.00 2.82 2.83 0.00 0.00 6.52 7.09 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 25 Y 8.07 3.98 0.00 3.14 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 26 C 8.47 4.27 0.00 3.19 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 27 N 8.25 4.41 0.00 2.90 2.93 0.00 0.00 6.73 7.31 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 28 Q 7.74 3.81 0.00 1.95 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.23 2.43 0.00 29 M 7.91 3.66 0.00 0.87 1.22 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.37 0.00 30 M 8.21 4.05 0.00 1.65 1.81 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.42 0.00 31 K 7.80 3.94 0.00 1.87 1.90 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.45 7.81 32 S 7.82 4.46 0.00 3.99 3.87 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 33 R 7.50 4.41 0.00 1.91 2.10 0.00 3.62 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.90 0.00 34 N 7.80 4.25 0.00 2.91 2.91 0.00 0.00 6.81 7.61 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 35 L 8.04 4.60 0.00 1.66 1.63 0.79 0.40 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 36 T 7.57 5.05 4.42 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 1.43 0.00 0.00 37 K 8.54 4.17 0.00 1.96 1.91 0.00 1.80 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.45 1.39 7.81 38 D 8.22 4.93 0.00 2.65 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 39 R 7.24 3.82 0.00 1.79 1.78 0.00 2.88 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 40 C 8.46 4.87 0.00 3.06 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 41 K 8.61 4.19 0.00 1.80 1.82 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.41 7.81 42 P 0.00 4.78 0.00 2.15 2.10 0.00 3.90 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 2.12 2.10 0.00 43 V 7.60 5.00 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 0.78 0.00 0.00 0.97 0.00 0.00 44 N 9.24 4.68 0.00 2.60 2.23 0.00 0.00 6.77 6.84 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 45 T 8.00 4.75 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 0.83 0.00 0.00 46 F 8.99 5.03 0.00 2.94 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 47 V 9.03 4.37 2.16 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 1.08 0.00 0.00 1.07 0.00 0.00 48 H 8.40 5.15 0.00 3.21 3.42 0.00 5.64 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.65 4.76 0.00 1.96 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 2.27 2.29 0.00 50 S 8.39 4.37 0.00 4.07 4.02 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 51 L 7.95 3.99 0.00 1.83 1.75 1.02 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.01 3.99 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 53 D 8.08 4.34 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 54 V 7.75 3.81 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 1.25 0.00 0.00 1.06 0.00 0.00 55 Q 8.44 3.94 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 56 A 8.15 4.03 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 57 V 7.72 3.41 2.12 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 1.10 0.00 0.00 0.96 0.00 0.00 58 C 7.74 3.78 0.00 2.93 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 59 S 7.55 4.62 0.00 3.88 3.80 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 60 Q 7.27 4.04 0.00 1.57 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.92 0.00 0.00 0.00 0.00 0.00 1.64 2.11 0.00 61 K 8.52 4.39 0.00 2.05 1.86 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.52 7.81 62 N 8.79 4.39 0.00 2.84 2.69 0.00 0.00 7.00 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 63 V 8.56 4.59 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 0.67 0.00 0.00 0.80 0.00 0.00 64 A 8.38 4.24 1.19 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 0.00 0.00 0.00 65 C 9.03 4.77 0.00 3.10 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 66 K 8.69 3.85 0.00 1.78 1.88 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.13 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.73 7.81 67 N 8.09 4.56 0.00 2.78 2.89 0.00 0.00 6.21 7.00 0.00 0.00 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 G 8.39 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 69 Q 8.70 4.26 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.28 0.00 70 T 8.27 4.69 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 1.18 0.00 0.00 71 N 8.10 5.08 0.00 3.08 3.16 0.00 0.00 6.02 7.68 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 72 C 7.47 5.36 0.00 2.99 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 73 Y 8.77 5.05 0.00 2.81 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 74 Q 9.00 4.99 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 75 S 9.09 4.49 0.00 3.90 3.87 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 76 Y 9.24 4.54 0.00 3.04 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 77 S 7.85 5.04 0.00 3.82 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 78 T 8.34 4.07 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 1.00 0.00 0.00 79 M 8.90 5.01 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 80 S 9.37 4.92 0.00 3.94 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 81 I 9.05 5.14 1.94 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 1.43 0.69 1.06 0.00 0.00 82 T 8.94 4.96 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 1.15 0.00 0.00 83 D 9.47 5.03 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 84 C 9.22 5.40 0.00 2.84 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 85 R 8.83 5.15 0.00 1.98 1.80 0.00 3.20 0.00 0.00 3.12 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 86 E 9.88 4.09 0.00 2.09 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 2.07 1.75 0.00 87 T 8.06 4.28 4.21 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 1.22 0.00 0.00 88 G 8.44 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 89 S 7.86 4.24 0.00 3.85 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 90 S 7.49 4.08 0.00 3.76 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 91 K 8.36 4.50 0.00 1.77 1.60 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.41 7.81 92 Y 8.78 4.37 0.00 3.05 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 93 P 0.00 3.16 0.00 1.81 1.41 0.00 3.67 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.76 0.00 94 N 7.33 4.63 0.00 2.71 2.77 0.00 0.00 6.96 7.21 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 95 C 8.03 4.45 0.00 3.14 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 96 A 8.16 4.99 1.13 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 0.00 0.00 97 Y 9.03 4.95 0.00 3.07 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 98 K 9.01 4.56 0.00 1.77 1.76 0.00 1.89 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.43 7.81 99 T 8.55 4.90 4.32 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 1.26 0.00 0.00 100 T 8.95 4.64 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 1.23 0.00 0.00 101 Q 8.74 4.91 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.22 2.38 0.00 102 A 8.81 4.73 1.22 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 0.00 0.00 0.00 103 N 8.70 5.42 0.00 2.61 2.71 0.00 0.00 6.57 7.41 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 0.00 104 K 8.98 4.64 0.00 1.72 1.84 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.45 7.81 105 H 9.40 4.89 0.00 3.06 3.35 0.00 5.58 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.49 4.82 1.73 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.92 1.14 0.00 0.00 107 I 8.24 4.90 1.68 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 1.15 0.73 0.84 0.00 0.00 108 V 8.63 4.79 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 0.74 0.00 0.00 0.82 0.00 0.00 109 A 8.76 4.88 1.22 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 0.00 0.00 0.00 110 C 8.49 5.07 0.00 2.06 1.77 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 0.00 111 E 8.82 4.55 0.00 1.94 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 0.00 2.24 2.31 0.00 112 G 9.50 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 0.00 0.00 0.00 113 N 8.19 4.98 0.00 2.63 2.71 0.00 0.00 6.89 7.69 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 0.00 114 P 0.00 4.36 0.00 2.23 2.05 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.23 4.89 0.00 2.90 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 0.00 116 V 7.88 4.45 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 0.64 0.00 0.00 0.89 0.00 0.00 117 P 0.00 4.39 0.00 0.49 1.16 0.00 3.36 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 118 V 8.98 4.37 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 0.63 0.00 0.00 0.96 0.00 0.00 119 H 7.83 5.02 0.00 3.24 3.10 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.71 4.70 0.00 2.73 2.61 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 0.00 121 D 8.72 4.55 0.00 2.62 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 0.00 122 A 6.69 4.65 1.17 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 0.00 123 S 8.75 5.14 0.00 4.07 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 0.00 124 V 9.00 4.11 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 0.97 0.00 0.00 0.92 0.00 0.00