NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9236 8.0549 120.2977 61.6016 32.5809 175.8273 2 H 4.2963 8.5673 120.5548 53.3941 27.1289 172.9011 3 L 4.8703 7.7445 123.3553 53.1749 44.7569 176.7699 4 T 4.4681 8.0734 109.9434 60.0605 71.8668 174.0798 5 P 4.1443 0.0000 0.0000 65.8111 31.0709 178.5843 6 E 3.9301 8.0452 117.0181 59.3192 29.8364 178.2579 7 E 4.0990 7.9187 118.4070 59.0377 29.4258 179.2042 8 K 3.8614 8.5056 119.2841 59.5917 31.7900 179.4833 9 S 4.1660 8.0514 113.5013 60.8166 63.0056 176.4110 10 A 3.9969 7.8773 124.4517 54.8955 18.3018 179.2162 11 V 3.5596 7.4615 116.5077 66.7754 31.3782 178.5037 12 T 4.0444 7.7327 114.9458 66.6087 68.1200 176.8019 13 A 4.0983 7.6366 121.1209 54.4864 18.4652 179.3542 14 L 3.8132 7.9329 119.4245 57.9578 42.1405 178.7813 15 W 4.3324 8.9509 128.8913 60.6600 30.5207 177.8895 16 G 3.5775 8.3890 104.7300 47.6798 0.0000 174.5398 17 K 4.6163 7.6017 117.5771 55.1667 32.4312 176.7362 18 V 3.5341 8.1421 121.9760 61.9433 31.1330 175.6541 19 N 4.4054 8.3489 127.6325 53.8760 36.6594 175.1609 20 V 3.8643 7.9174 119.8511 62.2920 31.6535 176.7420 21 D 4.9559 7.7355 118.4654 53.0243 39.5933 176.0521 22 E 4.5276 8.4531 116.9805 55.7826 31.9194 176.4266 23 V 3.8454 7.1447 118.3987 65.3414 31.6661 177.0461 24 G 3.9834 8.1320 106.5832 47.1979 0.0000 175.2023 25 G 3.6055 7.9480 107.8745 47.8496 0.0000 175.4918 26 E 4.0213 8.4121 121.7221 58.4652 29.5300 178.5235 27 A 3.9709 7.9113 120.9279 54.9811 18.4169 178.9519 28 L 3.9949 7.7935 117.4707 58.6553 42.5315 178.8181 29 G 3.6857 8.1410 104.8732 48.3374 0.0000 175.2339 30 R 3.8570 8.4649 119.6451 58.4533 30.2844 178.6541 31 L 4.0918 8.3070 120.2584 58.5895 41.9866 179.2129 32 L 4.0621 7.8366 118.8498 56.1592 41.2358 178.9536 33 V 3.8393 7.3162 116.8486 64.4686 32.2787 177.2232 34 V 3.5881 7.4320 117.0473 63.9417 32.9493 175.6494 35 Y 4.0140 7.5636 115.8752 54.0675 38.1672 173.7438 36 P 4.5843 0.0000 0.0000 64.5189 31.4200 177.8267 37 W 4.6916 8.3461 114.8851 59.4656 27.4427 177.9015 38 T 4.5121 7.4819 110.5096 64.3564 67.9633 176.4117 39 Q 4.2044 8.6174 121.5968 58.6070 28.3886 178.4437 40 R 3.8429 7.5144 118.4306 59.2418 30.0911 178.0941 41 F 4.1531 7.9862 116.4003 58.5075 40.1979 175.6639 42 F 4.6786 7.3827 115.7652 56.2287 38.8006 175.0766 43 E 4.1429 8.2072 123.0217 59.3691 30.5672 179.1968 44 S 4.7215 7.9345 113.7784 57.1408 61.7113 173.6118 45 F 4.6740 8.2676 116.5843 56.3842 42.4241 174.8775 46 G 4.0026 8.3131 105.2312 44.1746 0.0000 173.0387 47 D 4.6079 8.6346 122.5694 54.4251 41.9162 176.8923 48 L 4.8081 8.1879 124.0702 54.8976 43.5923 177.4998 49 S 4.3583 8.2655 115.6612 60.5413 63.5357 174.5986 50 T 4.6976 7.4395 110.4425 58.3574 72.7610 172.2296 51 P 4.1682 0.0000 0.0000 66.4051 31.3747 178.4658 52 D 4.3351 8.1344 116.3629 57.3483 40.5317 178.6805 53 A 3.9772 7.8859 119.7405 55.2483 18.5213 179.3847 54 V 3.6797 7.9051 115.7472 66.4468 31.7614 177.7510 55 M 4.2508 8.4485 118.9469 58.4319 31.7135 178.6064 56 G 4.0295 8.0492 103.6381 45.0185 0.0000 172.6682 57 N 4.4355 7.6219 121.0880 52.8413 38.9368 173.6427 58 P 4.2468 0.0000 0.0000 65.4630 31.2849 178.4925 59 K 4.1002 8.1038 117.0285 58.5124 32.0105 179.5361 60 V 3.5867 7.8670 118.4214 65.9493 31.4015 177.6758 61 K 3.8361 8.0054 116.7547 59.7235 32.3328 178.8089 62 A 4.1552 8.0815 120.6029 55.5282 18.4036 179.2546 63 H 4.4316 8.8448 117.2018 58.7526 29.6411 176.6087 64 G 4.0869 7.8848 105.9396 45.0296 0.0000 174.6296 65 K 4.4107 7.8808 122.3476 57.5932 33.1591 178.7044 66 K 3.9991 7.8491 119.4318 59.2970 32.2121 178.9448 67 V 3.6348 8.3104 118.9712 65.9696 31.2599 177.7813 68 L 4.4847 8.1135 118.7667 58.2365 42.1689 178.7289 69 G 3.8393 8.3503 105.6970 47.6492 0.0000 175.6618 70 A 4.0502 8.2950 123.0587 54.9454 18.1500 179.7101 71 F 4.5043 7.9345 115.7338 60.5551 38.7245 177.7474 72 S 4.3169 8.1336 115.4353 61.5130 62.1818 176.0405 73 D 4.4827 8.2137 120.4596 56.9771 40.8076 178.1261 74 G 3.8769 7.7053 103.9768 47.0677 0.0000 175.3960 75 L 4.0566 7.4881 119.2353 56.8374 41.6703 178.4552 76 A 4.2994 7.9551 119.6129 53.3386 19.6677 177.2859 77 H 4.9080 7.8176 113.9792 55.3431 29.1004 176.2690 78 L 4.1166 7.8077 119.3152 57.1114 42.1870 178.7089 79 D 4.4431 8.0601 118.1728 57.1942 40.8890 176.6976 80 N 4.6662 7.7780 115.4838 52.8959 41.6997 173.6834 81 L 4.6972 8.3982 124.3924 54.9616 43.7250 178.6032 82 K 3.8898 8.3866 118.8001 59.6984 31.8082 179.1540 83 G 3.7472 7.9381 103.5454 47.5086 0.0000 175.2435 84 T 4.0617 7.3545 116.4997 65.1726 68.8533 175.1766 85 F 4.6147 7.6251 116.2218 56.4182 40.0555 176.6018 86 A 4.1697 7.9842 124.2780 54.9723 17.5644 180.0364 87 T 3.7889 7.7552 114.6645 66.5573 68.8456 175.7760 88 L 4.3578 7.6018 118.0477 55.4647 41.8442 178.8777 89 S 4.2662 7.8206 116.2162 60.8360 62.4512 175.9301 90 E 3.8565 7.6502 120.9518 58.8606 29.1388 179.0959 91 L 3.8570 7.5252 119.9973 58.5250 42.3172 178.8814 92 H 4.2329 7.9045 115.5040 59.6641 28.6096 177.0461 93 C 4.1252 8.1857 120.6963 61.8320 27.5776 175.7107 94 D 4.2218 7.5212 122.2428 56.8608 40.9540 178.7419 95 K 4.1429 7.9640 118.2989 58.7300 32.5057 178.5118 96 L 4.5004 7.8763 116.2331 53.6172 43.9440 176.2645 97 H 4.4583 7.8213 112.9671 55.4332 25.8038 173.3904 98 V 4.2687 8.0520 117.4427 60.4011 33.3283 174.9423 99 D 4.1644 8.6709 127.2675 53.6289 41.5294 175.0541 100 P 3.2963 0.0000 0.0000 65.7034 30.9226 177.9748 101 E 3.9215 7.9297 118.5470 58.7168 29.4423 178.3381 102 N 4.3454 7.9009 116.8704 56.1445 38.5362 177.2896 103 F 4.4551 7.2261 119.5703 60.3640 38.9885 177.7236 104 R 3.9583 7.9486 118.0393 59.3248 30.0829 178.3557 105 L 3.8307 7.7666 118.7688 57.6649 41.5859 179.2001 106 L 4.0936 8.1086 120.3218 58.1387 42.1708 178.9010 107 G 3.9360 8.3005 105.6545 48.4033 0.0000 175.2609 108 N 4.5779 8.2404 118.2174 55.3736 38.4340 178.0692 109 V 3.7150 7.7386 114.4313 63.9330 31.7080 177.8649 110 L 3.8742 7.9117 120.2628 58.4235 41.8669 179.2800 111 V 3.5099 7.6193 117.4066 66.3346 31.2300 177.7957 112 C 4.1594 7.8719 115.3280 62.4557 28.1689 176.1683 113 V 3.6009 7.8282 120.2610 65.8553 31.2231 177.7560 114 L 3.8634 8.0651 118.7939 58.0048 41.5798 179.3222 115 A 3.8680 6.7809 120.0922 55.4791 17.9689 179.1642 116 H 4.0149 7.5398 115.0705 59.6012 30.0144 176.8537 117 H 4.3628 7.6996 115.8584 58.4569 29.2816 177.1724 118 F 4.4867 8.6899 118.2258 57.0397 39.0929 177.6010 119 G 4.2336 8.6440 108.4899 46.0913 0.0000 176.9698 120 K 4.1818 8.9303 124.9720 57.8527 31.7837 176.7022 121 E 4.2986 8.4556 119.4617 57.2338 30.6788 176.1646 122 F 4.5936 8.0536 123.0337 57.4670 38.2696 175.0515 123 T 4.0782 7.2802 114.0758 60.9667 71.1720 172.9403 124 P 4.1400 0.0000 0.0000 65.3820 31.2048 176.9110 125 P 4.3664 0.0000 0.0000 64.8237 31.6814 178.5905 126 V 3.4924 7.1124 118.6110 65.9478 31.4537 177.5288 127 Q 3.5384 7.8268 119.4836 58.9403 28.8034 178.1566 128 A 3.9732 7.6493 121.0626 55.0875 18.3047 179.5674 129 A 3.9514 7.7281 119.1491 55.5804 18.1326 179.4674 130 Y 4.0622 7.8528 114.2063 60.6514 37.9565 178.8180 131 Q 4.1461 8.1980 119.7029 58.6972 28.6283 178.3933 132 K 4.0946 7.7904 118.1359 59.2862 32.0468 178.9086 133 V 3.5765 7.5912 118.7055 66.2912 31.3621 178.1139 134 V 3.7316 7.9318 116.7486 65.8446 31.3684 178.1247 135 A 4.1166 8.0086 120.3093 55.3244 18.3475 179.8410 136 G 3.5907 7.8827 103.6289 47.2258 0.0000 176.3959 137 V 3.2538 7.7766 120.3637 65.9783 31.4189 177.9102 138 A 3.9907 8.2541 119.2880 55.1819 18.3831 179.2068 139 N 4.4798 7.9859 114.9250 56.5148 38.7074 177.3332 140 A 3.9775 7.6283 121.9303 55.3004 17.9495 179.6497 141 L 3.6567 7.6029 116.9787 56.8295 41.5116 178.5763 142 A 4.9280 7.5889 118.8115 52.3300 19.4636 177.9511 143 H 4.1398 7.9787 120.2301 59.5705 29.6753 177.5265 144 K 4.0043 8.1079 119.6148 58.8009 32.1684 177.8168 145 Y 4.4642 7.5927 116.6726 60.6739 38.2229 175.4993 146 H 4.5880 7.7949 120.6971 56.0793 28.7602 175.0004 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 V 8.05 3.92 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 0.87 0.00 0.00 1.00 0.00 0.00 2 H 8.57 4.30 0.00 3.19 3.34 0.00 5.84 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.74 4.87 0.00 1.85 1.56 0.81 0.68 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 4 T 8.07 4.47 4.22 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 1.20 0.00 0.00 5 P 0.00 4.14 0.00 2.16 2.14 0.00 3.58 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 2.10 2.14 0.00 6 E 8.05 3.93 0.00 1.92 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 2.27 2.44 0.00 7 E 7.92 4.10 0.00 2.11 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 2.28 2.31 0.00 8 K 8.51 3.86 0.00 1.86 1.82 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.54 7.81 9 S 8.05 4.17 0.00 4.09 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 10 A 7.88 4.00 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 11 V 7.46 3.56 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 0.66 0.00 0.00 0.53 0.00 0.00 12 T 7.73 4.04 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 1.28 0.00 0.00 13 A 7.64 4.10 1.37 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 0.00 0.00 0.00 14 L 7.93 3.81 0.00 1.93 2.16 0.42 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.95 4.33 0.00 3.73 3.19 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 16 G 8.39 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.60 4.62 0.00 2.20 2.04 0.00 1.81 0.00 0.00 1.82 0.00 0.00 3.33 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.53 7.81 18 V 8.14 3.53 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 -0.08 0.00 0.00 0.51 0.00 0.00 19 N 8.35 4.41 0.00 2.59 2.56 0.00 0.00 6.91 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 20 V 7.92 3.86 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 0.78 0.00 0.00 0.96 0.00 0.00 21 D 7.74 4.96 0.00 2.80 2.71 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 0.00 0.00 0.00 22 E 8.45 4.53 0.00 1.82 1.83 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 2.18 2.21 0.00 23 V 7.14 3.85 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 0.97 0.00 0.00 0.80 0.00 0.00 24 G 8.13 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 0.00 0.00 0.00 25 G 7.95 3.61 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 0.00 26 E 8.41 4.02 0.00 2.11 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 2.25 2.27 0.00 27 A 7.91 3.97 1.37 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 0.00 0.00 0.00 28 L 7.79 3.99 0.00 1.69 1.68 0.86 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.14 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 30 R 8.46 3.86 0.00 2.10 1.98 0.00 3.20 0.00 0.00 3.01 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 31 L 8.31 4.09 0.00 1.77 1.82 0.99 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.84 4.06 0.00 1.86 1.65 0.87 0.33 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 33 V 7.32 3.84 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 0.78 0.00 0.00 0.92 0.00 0.00 34 V 7.43 3.59 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 0.10 0.00 0.00 0.75 0.00 0.00 35 Y 7.56 4.01 0.00 2.61 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 36 P 0.00 4.58 0.00 2.23 2.12 0.00 3.85 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 2.13 1.95 0.00 37 W 8.35 4.69 0.00 3.58 3.56 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 38 T 7.48 4.51 4.43 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 1.12 0.00 0.00 39 Q 8.62 4.20 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.83 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 40 R 7.51 3.84 0.00 1.73 1.50 0.00 3.09 0.00 0.00 2.96 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.52 0.00 41 F 7.99 4.15 0.00 2.66 2.52 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 42 F 7.38 4.68 0.00 2.67 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 0.00 0.00 0.00 43 E 8.21 4.14 0.00 1.99 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 2.32 2.46 0.00 44 S 7.93 4.72 0.00 4.06 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 45 F 8.27 4.67 0.00 3.22 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 46 G 8.31 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 47 D 8.63 4.61 0.00 2.65 2.59 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 48 L 8.19 4.81 0.00 1.64 1.59 1.05 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.27 4.36 0.00 4.01 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 50 T 7.44 4.70 4.41 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 1.20 0.00 0.00 51 P 0.00 4.17 0.00 2.14 2.12 0.00 3.59 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 2.09 2.17 0.00 52 D 8.13 4.34 0.00 2.75 2.71 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 0.00 0.00 0.00 53 A 7.89 3.98 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 54 V 7.91 3.68 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 0.82 0.00 0.00 0.97 0.00 0.00 55 M 8.45 4.25 0.00 2.02 2.18 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.89 0.00 56 G 8.05 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 0.00 0.00 0.00 57 N 7.62 4.44 0.00 2.92 2.86 0.00 0.00 7.12 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 58 P 0.00 4.25 0.00 2.18 2.09 0.00 3.64 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 59 K 8.10 4.10 0.00 1.90 1.55 0.00 0.95 0.00 0.00 0.97 0.00 0.00 2.67 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.27 1.30 7.81 60 V 7.87 3.59 2.33 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 1.08 0.00 0.00 0.94 0.00 0.00 61 K 8.01 3.84 0.00 1.97 1.89 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.49 7.81 62 A 8.08 4.16 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 63 H 8.84 4.43 0.00 3.63 3.43 0.00 5.58 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 7.88 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 65 K 7.88 4.41 0.00 1.94 1.87 0.00 1.68 0.00 0.00 1.58 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.70 7.81 66 K 7.85 4.00 0.00 1.83 1.73 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.50 7.81 67 V 8.31 3.63 2.28 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 1.10 0.00 0.00 1.03 0.00 0.00 68 L 8.11 4.48 0.00 1.97 1.99 1.01 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.35 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 70 A 8.30 4.05 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 71 F 7.93 4.50 0.00 3.43 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 72 S 8.13 4.32 0.00 4.20 4.17 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 73 D 8.21 4.48 0.00 2.67 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 G 7.71 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 0.00 0.00 0.00 75 L 7.49 4.06 0.00 1.59 1.51 -0.51 0.44 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 76 A 7.96 4.30 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 77 H 7.82 4.91 0.00 3.20 3.26 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 78 L 7.81 4.12 0.00 1.59 1.69 0.83 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 79 D 8.06 4.44 0.00 2.65 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 80 N 7.78 4.67 0.00 2.60 2.65 0.00 0.00 7.10 7.51 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 81 L 8.40 4.70 0.00 1.74 1.72 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.39 3.89 0.00 1.77 1.78 0.00 1.62 0.00 0.00 1.92 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.48 7.81 83 G 7.94 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 84 T 7.35 4.06 4.16 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 0.00 0.00 0.00 0.92 0.00 0.00 85 F 7.63 4.61 0.00 3.25 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 86 A 7.98 4.17 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 87 T 7.76 3.79 4.15 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 1.16 0.00 0.00 88 L 7.60 4.36 0.00 1.87 1.81 1.02 0.61 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 89 S 7.82 4.27 0.00 4.09 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 90 E 7.65 3.86 0.00 1.95 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 2.26 2.24 0.00 91 L 7.53 3.86 0.00 1.63 1.58 0.67 0.96 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 92 H 7.90 4.23 0.00 3.35 3.53 0.00 5.86 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 93 C 8.19 4.13 0.00 2.63 1.85 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 94 D 7.52 4.22 0.00 2.68 2.67 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 95 K 7.96 4.14 0.00 1.94 1.84 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.67 7.81 96 L 7.88 4.50 0.00 1.88 1.79 0.81 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.82 4.46 0.00 3.38 3.42 0.00 5.72 0.00 0.00 0.00 0.00 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.05 4.27 2.19 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 0.25 0.00 0.00 0.56 0.00 0.00 99 D 8.67 4.16 0.00 2.64 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 0.00 100 P 0.00 3.30 0.00 2.26 2.48 0.00 3.33 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.67 0.00 101 E 7.93 3.92 0.00 1.96 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 2.25 2.35 0.00 102 N 7.90 4.35 0.00 2.57 2.73 0.00 0.00 6.84 7.75 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 0.00 103 F 7.23 4.46 0.00 3.06 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 0.00 104 R 7.95 3.96 0.00 1.91 2.09 0.00 3.20 0.00 0.00 3.63 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 105 L 7.77 3.83 0.00 1.63 1.03 0.63 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.11 4.09 0.00 1.84 1.88 1.05 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.30 3.94 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 0.00 108 N 8.24 4.58 0.00 2.99 2.95 0.00 0.00 7.10 7.59 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 0.00 109 V 7.74 3.71 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 1.01 0.00 0.00 1.14 0.00 0.00 110 L 7.91 3.87 0.00 1.71 1.74 0.93 0.48 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 0.00 111 V 7.62 3.51 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 1.25 0.00 0.00 1.09 0.00 0.00 112 C 7.87 4.16 0.00 3.19 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 0.00 113 V 7.83 3.60 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 0.97 0.00 0.00 0.91 0.00 0.00 114 L 8.07 3.86 0.00 0.55 1.36 0.39 0.69 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 0.00 115 A 6.78 3.87 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 0.00 116 H 7.54 4.01 0.00 3.18 3.29 0.00 5.75 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 0.00 117 H 7.70 4.36 0.00 2.79 2.88 0.00 5.77 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 0.00 118 F 8.69 4.49 0.00 3.28 3.14 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 0.00 119 G 8.64 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 0.00 0.00 0.00 120 K 8.93 4.18 0.00 1.80 1.92 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.40 7.81 121 E 8.46 4.30 0.00 2.01 2.39 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 2.31 2.29 0.00 122 F 8.05 4.59 0.00 3.12 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 0.00 123 T 7.28 4.08 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 0.00 124 P 0.00 4.14 0.00 2.13 2.13 0.00 3.55 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 125 P 0.00 4.37 0.00 2.21 2.26 0.00 3.55 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 126 V 7.11 3.49 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 0.85 0.00 0.00 0.88 0.00 0.00 127 Q 7.83 3.54 0.00 1.51 1.95 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 2.35 2.48 0.00 128 A 7.65 3.97 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 0.00 0.00 0.00 0.00 0.00 129 A 7.73 3.95 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 0.00 130 Y 7.85 4.06 0.00 3.38 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 0.00 131 Q 8.20 4.15 0.00 2.31 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.68 2.59 0.00 132 K 7.79 4.09 0.00 1.95 1.83 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.44 7.81 133 V 7.59 3.58 2.28 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 0.95 0.00 0.00 0.72 0.00 0.00 134 V 7.93 3.73 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 0.87 0.00 0.00 0.91 0.00 0.00 135 A 8.01 4.12 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.88 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 0.00 0.00 0.00 137 V 7.78 3.25 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 1.07 0.00 0.00 138 A 8.25 3.99 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.99 4.48 0.00 2.88 2.90 0.00 0.00 6.78 7.37 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 0.00 140 A 7.63 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 0.00 141 L 7.60 3.66 0.00 1.05 0.27 0.54 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.59 4.93 1.61 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 0.00 143 H 7.98 4.14 0.00 3.26 3.40 0.00 5.79 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.11 4.00 0.00 1.66 1.62 0.00 1.84 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.52 7.81 145 Y 7.59 4.46 0.00 3.29 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 0.00 146 H 7.79 4.59 0.00 3.37 3.25 0.00 5.70 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