NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 H 4.9702 8.2876 120.6549 56.0398 31.6899 171.7155 4 K 4.6580 8.2845 122.8297 54.3074 35.4987 170.1893 5 V 4.3654 8.1361 123.3429 61.6267 35.3044 175.2068 6 T 5.3780 8.1950 113.0320 60.2868 72.0816 174.1274 7 K 3.5170 8.8309 122.1227 59.7594 32.5198 178.2895 8 A 4.0344 8.0481 119.9291 55.3892 18.0628 178.5823 9 H 4.4406 8.2578 112.5374 57.1456 28.8046 176.5620 10 N 4.4306 8.4557 120.5898 55.8846 39.4345 174.1660 11 G 4.3893 7.9335 105.7804 45.4767 0.0000 171.9145 12 A 5.0684 7.9279 119.6927 50.4200 23.2050 177.5949 13 T 5.1803 8.3289 115.1243 62.2416 71.8829 173.1185 14 L 4.6745 9.7415 128.3391 54.2657 46.3276 174.1824 15 T 4.9388 8.3824 118.3730 62.0472 70.5511 174.4879 16 V 4.5868 8.2971 116.6454 59.5616 35.4863 174.9212 17 A 4.6839 8.5433 124.8315 50.6562 20.8483 176.6866 18 V 4.5195 8.4193 114.0860 59.1960 35.0672 173.6390 19 G 3.7443 8.8280 111.3061 46.6969 0.0000 175.3312 20 E 4.1384 7.6759 121.0534 56.4387 30.1996 176.3771 21 L 4.4061 7.1401 118.3557 54.3210 45.5304 173.7967 22 V 4.5541 8.5599 126.4077 61.4290 33.1806 174.0587 23 E 5.0628 9.3154 126.7014 54.6587 32.9648 175.5188 24 I 4.6100 9.1426 121.2162 59.8443 40.6156 173.8365 25 Q 4.7525 8.8974 129.1949 53.9853 31.7034 174.2194 26 L 4.5543 8.4834 125.6899 51.9410 44.7199 175.0827 27 P 5.0820 0.0000 0.0000 62.0328 31.2557 176.0689 28 S 4.5967 7.8910 115.1259 58.0315 62.2298 170.0357 29 N 4.2252 8.0302 115.6698 52.8673 35.2078 172.7460 30 P 4.3582 0.0000 0.0000 63.4385 32.5399 175.5223 31 T 3.9743 7.9521 114.6332 62.4752 68.3172 175.6623 32 T 4.1792 7.0930 110.5551 60.0504 69.3852 172.6706 33 G 3.6819 7.9053 118.2260 45.4882 0.0000 174.3116 34 F 4.5790 5.5180 118.6082 57.6026 39.5166 175.0832 35 A 5.0923 9.5332 123.3117 50.0425 23.2271 175.2270 36 W 4.7083 8.5958 119.7437 56.7391 29.7209 175.5481 37 Y 4.9259 8.9522 121.8768 56.1299 41.6520 175.7446 38 F 3.9140 9.6128 119.6493 58.4843 39.3651 175.9871 39 E 4.4330 8.4320 121.5493 55.2100 31.1284 176.5916 40 G 3.8556 9.0298 109.7899 47.2557 0.0000 174.2134 41 G 3.7940 7.5242 115.3070 44.7666 0.0000 172.7057 42 T 4.8390 7.6325 115.4194 61.3882 71.8651 173.0431 43 K 4.9802 8.7064 123.3058 55.0448 35.6507 175.3754 44 E 4.7647 7.5475 119.4740 54.1870 32.1997 174.8827 45 S 4.8209 9.1817 115.7820 55.7916 65.1824 171.8890 46 P 4.3887 0.0000 0.0000 63.5788 31.6996 175.7816 47 N 4.2940 8.6915 118.8100 54.3471 35.5699 173.7880 48 E 4.7694 7.9732 115.1037 55.1506 31.4666 174.3692 49 S 4.7862 8.5248 126.2099 59.4587 66.0263 177.9221 50 M 4.3506 8.3350 115.7179 56.4603 32.1300 175.7319 51 F 4.8545 7.7323 116.2716 56.0884 43.3332 173.9871 52 T 4.8485 8.7396 113.7857 62.5811 71.4471 171.8736 53 V 5.0143 8.4742 123.9929 59.9970 33.4958 174.9307 54 E 4.8727 9.5672 122.4866 54.5581 32.2171 174.3008 55 N 5.0710 8.4820 119.2487 50.7954 40.1177 174.0952 56 K 3.6184 8.3279 122.4243 55.6011 35.5434 174.2738 57 Y 4.9147 6.5645 123.2194 54.8239 40.5095 175.0673 58 F 4.8430 9.6964 123.1770 55.0238 42.0527 172.9272 59 P 4.9321 0.0000 0.0000 60.7760 30.9162 174.3425 60 P 4.4221 0.0000 0.0000 64.8259 31.6655 175.5092 61 D 4.7078 7.6123 114.8969 53.9257 43.9727 174.7597 62 S 4.6708 8.3766 110.0058 58.8756 64.9386 174.3844 63 K 4.6088 9.3188 116.1213 56.5555 33.3201 175.8906 64 L 4.5383 7.6330 119.2329 53.0765 45.5430 174.8664 65 L 4.9669 7.5420 123.8672 55.1036 45.4801 175.0082 66 G 3.7534 8.6496 118.3509 45.1971 0.0000 171.4555 67 A 3.8754 7.6007 123.9643 51.7195 18.0489 178.9397 68 G 4.1079 7.4526 104.6092 42.4584 0.0000 171.9406 69 G 3.9861 8.1665 109.5960 46.9981 0.0000 171.0188 70 T 5.0070 9.2872 114.9426 60.7958 71.0195 171.0602 71 E 4.7904 9.5591 129.1701 55.7532 31.4147 174.5650 72 H 5.3493 9.5448 122.5224 53.8822 32.8649 173.9618 73 F 4.8707 9.7842 119.2059 56.4107 42.4316 174.0726 74 H 5.1850 9.7784 123.4615 54.1533 30.6429 174.2223 75 V 4.5453 8.6063 124.7866 60.4188 33.5672 175.2124 76 T 4.7587 8.9465 123.9016 62.0770 69.5495 174.0853 77 V 5.0387 8.3553 125.2462 60.0139 34.8423 175.1012 78 K 4.2161 7.7541 120.5601 55.5780 33.6240 175.3777 79 A 4.0463 8.0644 123.0892 50.8789 21.8061 174.2586 80 A 4.5153 8.2075 126.1789 52.6868 18.0781 176.3389 81 G 4.1851 8.9341 107.5852 46.8489 0.0000 170.4049 82 T 4.9285 8.4392 116.8408 62.0466 70.3970 174.0817 83 H 4.7820 9.6948 127.3345 54.7855 31.2724 173.4651 84 A 4.8691 8.7500 129.0249 50.6296 20.2183 176.4218 85 V 4.1868 8.7511 124.3500 62.3520 32.8108 174.7452 86 N 5.7643 8.6893 126.3695 51.0687 39.8062 174.0814 87 L 4.6003 8.3531 124.3984 53.2179 44.3341 175.6865 88 T 4.9910 9.2295 121.5583 62.4540 70.6129 173.6642 89 Y 5.0171 9.0482 129.8059 56.5019 38.0876 173.8268 90 M 4.8190 8.8305 123.8760 52.3432 37.7369 174.6483 91 R 3.9199 8.7571 118.3481 55.0073 29.8663 176.0468 92 P 4.1757 0.0000 0.0000 65.0741 31.0656 177.1118 93 W 4.5914 7.3433 113.2284 56.9581 28.5592 175.2647 94 T 3.9476 7.9802 117.9409 61.8296 74.3751 170.1870 95 G 3.4811 7.6635 123.9488 43.8818 0.0000 170.7342 96 P 4.1262 0.0000 0.0000 62.5372 31.8009 178.0477 97 S 4.1304 8.8169 119.5759 61.3480 62.8779 174.8622 98 H 4.8401 7.8834 111.8427 54.9288 28.9718 173.0609 99 D 4.5453 7.7271 117.3721 54.2193 41.8924 175.7484 100 S 3.7349 7.1801 114.0974 57.7833 64.4201 173.8331 101 E 4.3374 7.9027 125.4603 55.8138 31.7509 174.4359 102 R 5.3135 8.3143 119.0236 55.3716 32.9823 173.6478 103 F 4.9477 10.3168 128.5977 57.3712 42.3409 175.3280 104 T 4.6639 7.2367 120.9005 62.9083 71.9739 172.6382 105 V 4.2156 6.7895 126.6205 59.9416 34.2986 174.6129 106 Y 5.0487 8.8398 122.9975 56.4722 39.0339 174.5223 107 L 5.9129 8.9731 124.7323 52.6958 44.6629 175.6138 108 K 4.6633 8.6062 121.5848 55.0584 33.9922 174.4392 109 A 4.9765 8.6814 130.6002 50.3281 21.3074 176.5676 110 N 4.9350 8.3641 118.5014 52.6907 39.8665 174.4073 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 3 H 8.29 4.97 0.00 3.28 3.26 0.00 5.77 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.28 4.66 0.00 1.72 1.62 0.00 1.56 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.26 1.47 7.81 5 V 8.14 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 1.05 0.00 0.00 0.76 0.00 0.00 6 T 8.20 5.38 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 1.13 0.00 0.00 7 K 8.83 3.52 0.00 1.72 1.83 0.00 1.57 0.00 0.00 1.64 0.00 0.00 3.61 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.55 1.56 7.81 8 A 8.05 4.03 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 9 H 8.26 4.44 0.00 3.47 3.50 0.00 5.88 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 10 N 8.46 4.43 0.00 3.04 2.93 0.00 0.00 6.99 8.24 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 11 G 7.93 4.39 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 0.00 12 A 7.93 5.07 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 13 T 8.33 5.18 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 1.21 0.00 0.00 14 L 9.74 4.67 0.00 1.72 1.45 0.94 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 15 T 8.38 4.94 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 1.20 0.00 0.00 16 V 8.30 4.59 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 0.39 0.00 0.00 1.03 0.00 0.00 17 A 8.54 4.68 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 18 V 8.42 4.52 2.25 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 0.79 0.00 0.00 0.96 0.00 0.00 19 G 8.83 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 20 E 7.68 4.14 0.00 2.00 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 2.34 2.32 0.00 21 L 7.14 4.41 0.00 1.60 1.47 0.99 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 22 V 8.56 4.55 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 1.02 0.00 0.00 1.04 0.00 0.00 23 E 9.32 5.06 0.00 1.77 1.76 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 2.22 2.13 0.00 24 I 9.14 4.61 1.93 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 1.12 1.29 0.52 0.00 0.00 25 Q 8.90 4.75 0.00 2.03 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.59 0.00 0.00 0.00 0.00 0.00 1.83 1.53 0.00 26 L 8.48 4.55 0.00 1.13 0.50 -0.48 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 5.08 0.00 2.22 2.20 0.00 3.58 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.84 0.00 28 S 7.89 4.60 0.00 4.16 4.11 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 0.00 0.00 0.00 29 N 8.03 4.23 0.00 3.25 3.04 0.00 0.00 7.36 8.20 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 30 P 0.00 4.36 0.00 2.11 2.30 0.00 3.92 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.22 0.00 31 T 7.95 3.97 4.14 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 0.00 0.00 0.00 1.08 0.00 0.00 32 T 7.09 4.18 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 0.56 0.00 0.00 33 G 7.91 3.68 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 0.00 0.00 0.00 34 F 5.52 4.58 0.00 2.03 2.44 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 35 A 9.53 5.09 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 36 W 8.60 4.71 0.00 3.05 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 37 Y 8.95 4.93 0.00 2.95 3.03 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 38 F 9.61 3.91 0.00 3.32 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.43 4.43 0.00 2.10 2.14 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 0.00 2.30 2.27 0.00 40 G 9.03 3.86 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 0.00 0.00 0.00 41 G 7.52 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 0.00 0.00 0.00 42 T 7.63 4.84 4.29 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 1.24 0.00 0.00 43 K 8.71 4.98 0.00 2.72 2.38 0.00 1.77 0.00 0.00 1.93 0.00 0.00 3.04 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.58 1.73 7.81 44 E 7.55 4.76 0.00 1.87 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 1.53 1.94 0.00 45 S 9.18 4.82 0.00 4.03 4.12 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 46 P 0.00 4.39 0.00 2.00 1.96 0.00 3.63 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.93 0.00 47 N 8.69 4.29 0.00 2.89 2.95 0.00 0.00 7.04 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 48 E 7.97 4.77 0.00 2.30 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 0.00 2.37 2.30 0.00 49 S 8.52 4.79 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 50 M 8.33 4.35 0.00 2.27 2.40 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.65 0.00 51 F 7.73 4.85 0.00 2.96 3.27 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 52 T 8.74 4.85 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 1.20 0.00 0.00 53 V 8.47 5.01 2.25 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 0.91 0.00 0.00 1.24 0.00 0.00 54 E 9.57 4.87 0.00 1.94 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 55 N 8.48 5.07 0.00 2.13 2.59 0.00 0.00 6.34 7.39 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 56 K 8.33 3.62 0.00 1.54 1.58 0.00 0.77 0.00 0.00 1.43 0.00 0.00 2.29 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.27 1.09 7.81 57 Y 6.56 4.91 0.00 2.83 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 58 F 9.70 4.84 0.00 3.06 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 59 P 0.00 4.93 0.00 2.25 2.21 0.00 3.65 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.20 0.00 60 P 0.00 4.42 0.00 2.19 2.24 0.00 3.74 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 61 D 7.61 4.71 0.00 2.63 2.56 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 0.00 0.00 0.00 0.00 62 S 8.38 4.67 0.00 3.85 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 63 K 9.32 4.61 0.00 1.79 1.83 0.00 1.64 0.00 0.00 2.04 0.00 0.00 2.75 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.50 7.81 64 L 7.63 4.54 0.00 1.56 1.48 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.54 4.97 0.00 1.71 1.59 0.99 1.06 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 66 G 8.65 3.75 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 0.00 0.00 0.00 67 A 7.60 3.88 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 68 G 7.45 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.17 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 0.00 0.00 0.00 70 T 9.29 5.01 4.56 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 0.00 0.00 0.00 1.28 0.00 0.00 71 E 9.56 4.79 0.00 1.97 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 2.42 2.38 0.00 72 H 9.54 5.35 0.00 2.84 3.14 0.00 5.57 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 F 9.78 4.87 0.00 2.96 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 74 H 9.78 5.19 0.00 3.13 3.24 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 75 V 8.61 4.55 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 1.05 0.00 0.00 1.08 0.00 0.00 76 T 8.95 4.76 4.29 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 1.46 0.00 0.00 77 V 8.36 5.04 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 0.74 0.00 0.00 1.03 0.00 0.00 78 K 7.75 4.22 0.00 1.65 1.54 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.00 1.07 7.81 79 A 8.06 4.05 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 80 A 8.21 4.52 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 81 G 8.93 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 0.00 0.00 0.00 0.00 82 T 8.44 4.93 4.29 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 1.30 0.00 0.00 83 H 9.69 4.78 0.00 3.21 3.31 0.00 5.56 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 84 A 8.75 4.87 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.75 4.19 2.14 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 0.88 0.00 0.00 0.84 0.00 0.00 86 N 8.69 5.76 0.00 2.67 2.74 0.00 0.00 6.99 7.58 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 87 L 8.35 4.60 0.00 1.62 1.49 0.03 -1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 88 T 9.23 4.99 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 1.19 0.00 0.00 89 Y 9.05 5.02 0.00 1.43 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 0.00 0.00 0.00 0.00 90 M 8.83 4.82 0.00 1.78 1.77 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.34 0.00 91 R 8.76 3.92 0.00 1.47 0.66 0.00 3.33 0.00 0.00 3.18 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.28 0.00 92 P 0.00 4.18 0.00 2.31 2.34 0.00 3.39 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 2.47 2.25 0.00 93 W 7.34 4.59 0.00 3.40 3.34 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 94 T 7.98 3.95 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 0.92 0.00 0.00 95 G 7.66 3.48 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 0.00 0.00 0.00 96 P 0.00 4.13 0.00 1.99 1.94 0.00 3.56 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.17 0.00 97 S 8.82 4.13 0.00 3.85 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 98 H 7.88 4.84 0.00 3.12 3.27 0.00 5.68 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 D 7.73 4.55 0.00 2.39 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 S 7.18 3.73 0.00 3.49 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 0.00 101 E 7.90 4.34 0.00 1.92 1.71 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 2.41 2.30 0.00 102 R 8.31 5.31 0.00 1.85 1.78 0.00 3.29 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 103 F 10.32 4.95 0.00 2.50 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 0.00 104 T 7.24 4.66 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 0.38 0.00 0.00 105 V 6.79 4.22 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 0.94 0.00 0.00 106 Y 8.84 5.05 0.00 2.98 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 0.00 107 L 8.97 5.91 0.00 1.60 1.70 0.97 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.61 4.66 0.00 1.90 1.73 0.00 1.60 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.70 7.81 109 A 8.68 4.98 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 0.00 110 N 8.36 4.94 0.00 2.68 2.62 0.00 0.00 7.70 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00