NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3203 8.2644 123.5811 51.8105 19.9980 176.7061 3 R 3.9216 8.5568 120.7100 58.7548 31.6195 176.8857 4 R 3.9978 9.1503 115.9469 57.7808 29.9055 178.1113 5 R 4.1759 8.7413 119.4827 56.4839 31.5695 176.8221 6 R 3.8575 8.4074 118.5025 56.5552 30.4630 172.2484 7 A 3.7219 7.9084 128.6018 51.8760 18.7694 176.3644 8 E 4.6018 8.4409 122.0488 54.1261 31.5135 176.2918 9 V 3.6292 8.1790 122.8228 62.6667 32.1253 175.7505 10 R 3.9860 8.4583 127.6940 56.3446 30.6226 175.4542 11 Q 4.5027 8.3795 125.4314 54.8082 30.6607 174.3136 12 L 4.7899 8.0367 121.0971 52.7223 44.7420 175.8260 13 Q 4.3137 8.3685 121.8914 54.2691 29.7932 173.9933 14 P 4.3138 0.0000 0.0000 62.5884 32.1572 175.4181 15 D 4.6242 8.7456 120.1583 54.9606 41.6403 176.7072 16 L 4.5131 8.4925 120.1320 55.0948 43.2992 178.0859 17 V 3.9610 8.5256 116.7259 64.6060 32.1762 176.0532 18 Y 4.4082 9.2741 114.5250 56.8942 39.2371 175.8233 19 G 4.5101 8.3830 107.7916 45.1436 0.0000 171.6834 20 D 4.6282 7.6393 118.4482 52.2902 44.9519 175.9482 21 V 3.7961 8.7714 121.9378 63.9709 31.3475 178.1294 22 L 4.1381 8.5092 119.8706 57.8329 41.7592 178.7818 23 V 3.3705 8.1969 119.1178 65.3618 31.4682 177.4935 24 T 3.7180 7.8189 108.6363 65.2186 68.2229 175.0715 25 A 3.9413 8.2906 123.9138 55.2905 18.3109 178.8560 26 F 4.0595 7.9807 117.5591 61.6036 39.2009 177.2440 27 I 3.3371 7.3205 118.9357 64.7683 37.2889 177.5049 28 N 4.3085 8.7458 117.3097 56.5554 38.2103 177.3534 29 K 3.8738 8.0478 119.3732 59.8163 32.2069 179.1350 30 I 3.6926 7.6675 119.5910 62.9081 37.2184 176.6849 31 M 3.9054 7.6820 120.2553 55.5022 32.3456 175.2801 32 R 4.3338 8.4448 125.8185 56.6645 31.3374 174.1090 33 D 4.5917 8.7355 125.5919 54.7636 37.7026 175.1377 34 G 4.0024 8.1058 106.9970 46.2023 0.0000 174.6292 35 K 4.6021 7.7402 122.4136 59.3539 34.1456 180.6129 36 K 4.7318 7.7585 121.2468 58.9229 34.1260 176.8549 37 N 4.3723 8.5410 116.1111 56.7709 38.2422 176.8615 38 L 4.0550 8.8965 121.7522 57.6532 42.0616 178.8644 39 A 3.9469 7.8220 120.2466 55.2001 18.4103 178.9918 40 A 3.9562 9.3041 120.1884 55.9099 17.8240 179.6613 41 R 3.8706 8.3898 114.0134 59.9248 30.2075 178.9709 42 I 3.5590 7.9950 118.4297 64.9656 37.1274 177.4402 43 F 4.0854 7.9803 120.5897 62.3318 39.3666 176.8311 44 Y 3.9852 8.2463 115.6834 61.3422 37.6537 178.5224 45 D 4.4088 9.6305 119.6294 57.5384 40.8186 179.0944 46 A 4.0669 8.2829 121.6793 55.3384 18.2844 179.5097 47 C 4.0652 8.1168 115.6044 62.5471 27.9832 175.8614 48 K 4.2972 7.5093 116.7514 57.6548 31.5964 177.3452 49 I 4.5923 7.5752 120.2424 61.0654 38.3026 176.8441 50 I 4.2725 8.0095 121.5966 63.4190 38.1594 177.3629 51 Q 4.1552 8.1557 116.7224 59.7573 28.5602 178.6145 52 E 4.0907 8.1117 118.0981 59.1679 29.7610 178.8062 53 K 4.1554 7.8922 118.5973 57.2049 32.8602 177.0115 54 T 4.1111 7.4351 110.9598 61.5434 70.9031 173.2122 55 G 3.7495 8.8816 117.6080 46.1315 0.0000 173.4399 56 Q 4.3980 7.6050 118.4049 54.0549 30.2041 175.8310 57 E 4.1418 8.6046 120.2422 55.7284 30.0025 175.6880 58 P 4.1921 0.0000 0.0000 66.3782 30.9941 177.7596 59 L 3.8957 8.3526 120.2456 57.7718 41.8367 178.8729 60 K 4.0844 8.2783 119.1465 59.0115 32.0073 179.1903 61 V 3.5440 7.9320 118.8729 65.8239 31.5535 177.5995 62 F 4.0706 8.2145 119.9163 61.2671 39.3448 176.6181 63 K 3.6126 8.0909 119.0740 59.4822 31.9459 178.4584 64 Q 3.8025 8.2875 119.5113 59.1285 28.8697 177.5959 65 A 3.8590 8.2855 121.3564 55.7093 18.6560 179.1847 66 V 3.3645 7.4308 116.2036 66.0856 31.5451 177.3692 67 E 3.9026 8.1038 118.0708 59.6839 29.3339 178.5915 68 N 4.5763 8.4210 112.8074 54.5333 38.5140 175.5453 69 V 4.3650 8.1239 118.6913 62.1419 33.4253 174.8630 70 K 3.8014 7.5741 117.9995 55.9272 31.4920 174.7736 71 P 4.4561 0.0000 0.0000 62.4538 31.3593 177.2257 72 R 3.7926 8.6912 124.6868 59.4586 30.2103 176.2476 73 M 4.7071 7.2477 113.7393 54.2433 36.5043 173.1689 74 E 4.9367 8.4121 118.4581 55.0063 34.1298 174.1216 75 V 5.0194 8.4244 112.6645 59.7168 33.4471 175.7295 76 R 4.7109 8.9038 123.9406 54.0569 33.2007 175.7341 77 S 4.1655 8.8132 118.4513 58.8967 62.8932 172.8471 78 R 4.1399 7.4162 118.1528 55.7551 33.7185 172.9116 79 R 4.6098 8.3401 124.6529 55.1986 32.1339 174.8291 80 V 4.1145 8.3351 121.9823 62.4934 35.5574 174.9385 81 G 4.4242 7.4642 116.6621 46.5460 0.0000 170.5700 82 G 4.1334 10.2946 114.0645 45.6615 0.0000 172.5758 83 A 4.3109 6.9534 119.3368 51.4811 21.8168 173.8399 84 N 5.0713 8.5790 116.7500 51.8796 38.9786 174.6600 85 Y 4.4627 7.8572 121.8804 57.3710 39.9408 175.1247 86 Q 4.6388 8.6636 122.5640 54.5047 29.4828 175.3808 87 V 4.1324 8.2684 124.8887 61.9830 32.9717 172.8773 88 P 5.4415 0.0000 0.0000 61.7797 33.2493 174.2803 89 M 4.8356 8.9991 118.8931 53.9915 35.0159 173.8810 90 E 4.0885 8.8156 119.7768 56.8798 30.1625 177.3733 91 V 4.2602 7.8582 118.6704 60.4837 33.7928 174.9123 92 S 4.2591 8.6824 122.4013 57.2775 64.0526 172.4061 93 P 4.1517 0.0000 0.0000 66.6327 30.7987 178.3059 94 R 4.1643 8.0636 116.8058 59.5920 29.9366 178.6006 95 R 3.8647 7.8404 117.4018 59.4123 30.1737 178.0202 96 Q 3.9036 8.1353 118.0673 59.0679 28.6772 178.5109 97 Q 3.8538 9.0008 121.0827 59.8940 29.0624 178.7054 98 S 3.9857 7.7663 115.1260 62.5290 62.7896 176.2791 99 L 3.0168 8.6392 120.3816 58.4259 41.2342 179.5447 100 A 3.7073 8.3273 117.5581 55.2044 18.6470 179.4544 101 L 3.9786 8.3825 115.3459 58.2501 42.1655 179.4242 102 R 3.7808 8.3791 118.1539 59.3443 29.8083 178.1199 103 W 4.7386 8.3917 118.1287 60.3163 29.3251 178.1378 104 L 4.0996 8.3765 118.5018 58.2375 41.1726 179.5254 105 V 3.5646 7.9358 116.9155 66.5219 31.2724 177.7842 106 Q 3.9874 7.9360 115.8562 59.1710 28.9159 178.6244 107 A 4.1686 8.7451 121.3270 56.1974 18.2999 178.7577 108 A 3.9510 8.5788 117.9534 56.3665 18.1171 179.1951 109 N 3.7011 8.5377 116.0614 56.1727 38.9815 177.3225 110 Q 4.1914 8.0229 118.3636 57.2612 29.0806 176.7636 111 R 4.1424 8.1445 119.8348 55.7970 30.5736 174.6431 112 P 4.6355 0.0000 0.0000 62.7086 31.8431 175.9164 113 E 4.0682 7.9564 119.7702 56.5947 29.8690 176.8127 114 R 4.0252 8.8332 123.5202 59.3459 30.0731 177.6411 115 R 4.2865 7.7256 115.3823 55.5199 31.4681 177.0965 116 A 3.9604 8.4326 120.3351 54.5505 18.9787 179.5718 117 A 3.9204 7.9364 118.8353 55.5380 18.4342 179.8012 118 V 3.4826 7.8177 110.1284 65.0426 31.5534 178.4521 119 R 3.9478 7.4788 116.9477 59.5208 29.8733 178.8172 120 I 3.8266 8.0277 118.8111 64.5717 37.4139 177.7198 121 A 4.0050 9.0749 119.4389 54.7584 17.8219 179.0502 122 H 4.0051 7.7155 115.7372 58.0512 29.7248 176.3671 123 E 3.9655 8.6005 121.0931 59.6177 29.3940 179.0148 124 L 4.0096 8.3017 118.8947 58.2886 41.6584 179.0390 125 M 3.9861 7.8806 118.2078 58.8251 31.7253 178.1655 126 D 4.6281 8.2782 118.1317 57.8925 40.9144 178.6621 127 A 4.3324 7.8789 119.2385 55.4497 18.4180 178.8456 128 A 4.1602 8.3945 118.2413 55.8776 18.5430 179.0226 129 E 3.9913 8.8284 117.4550 58.3863 30.5881 175.9201 130 G 3.1032 8.1629 110.5252 44.1565 0.0000 173.3132 131 K 4.3432 7.1154 110.0157 54.8569 33.6849 175.3598 132 G 4.2328 7.5841 105.6048 43.6369 0.0000 173.4227 133 G 3.8722 7.9530 103.6709 48.0360 0.0000 175.7430 134 A 3.9457 8.0930 122.1484 55.0049 18.5841 179.5481 135 V 3.4637 7.7275 115.8898 66.1683 31.5605 178.2473 136 K 3.8670 8.3827 118.2220 59.5263 31.8920 179.5312 137 K 3.0773 8.3787 118.5697 58.4478 31.6855 179.0971 138 K 3.3871 7.9582 120.6612 58.8935 32.4169 178.0622 139 E 4.2976 8.4283 120.4411 58.9965 29.4221 178.6378 140 D 4.2034 8.7657 118.6674 57.5567 40.9562 178.2848 141 V 3.5380 6.9282 117.3930 66.3882 31.6859 177.5846 142 E 4.0804 8.3555 118.0669 59.5938 28.8710 179.1640 143 R 3.8622 8.4342 118.0539 59.9201 29.6483 178.5635 144 M 3.8007 8.1507 117.7881 58.6301 32.0782 177.3765 145 A 4.4008 7.5698 117.4606 52.4172 21.1716 175.8303 146 E 3.9255 8.8862 121.2773 57.9728 28.0020 177.1918 147 A 4.0799 7.3658 119.8575 54.8561 18.7612 177.9079 148 N 4.7292 7.5279 112.7939 53.2398 39.0224 177.0553 149 R 3.8454 8.3989 122.1899 59.7853 29.6182 177.2020 150 A 3.7063 7.8228 118.6750 56.2010 18.5831 178.4416 151 Y 4.0777 7.0305 111.8803 59.1627 38.0628 178.1784 152 A 4.2267 8.0677 123.4197 54.9734 18.1785 178.8164 153 H 4.7458 7.6330 111.8250 56.3948 28.1275 175.4142 154 Y 5.1584 8.4759 115.1758 59.6773 39.2694 178.6515 155 R 3.8715 8.7255 121.9747 57.9783 30.6080 176.3119 156 W 4.1854 8.0139 119.0445 56.8912 30.2152 174.1049 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 2 A 8.26 4.32 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 3 R 8.56 3.92 0.00 1.87 1.96 0.00 3.25 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 4 R 9.15 4.00 0.00 1.83 1.70 0.00 3.26 0.00 0.00 3.22 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 5 R 8.74 4.18 0.00 1.77 1.86 0.00 3.24 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 6 R 8.41 3.86 0.00 1.75 1.93 0.00 3.33 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 7 A 7.91 3.72 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 8 E 8.44 4.60 0.00 1.95 1.86 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 2.22 2.26 0.00 9 V 8.18 3.63 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 0.74 0.00 0.00 0.91 0.00 0.00 10 R 8.46 3.99 0.00 1.80 1.80 0.00 3.26 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 11 Q 8.38 4.50 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.57 0.00 0.00 0.00 0.00 0.00 2.28 2.43 0.00 12 L 8.04 4.79 0.00 1.64 1.53 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.37 4.31 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 14 P 0.00 4.31 0.00 2.11 2.03 0.00 3.77 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 15 D 8.75 4.62 0.00 2.96 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 16 L 8.49 4.51 0.00 1.69 1.70 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.53 3.96 2.63 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 0.52 0.00 0.00 0.22 0.00 0.00 18 Y 9.27 4.41 0.00 3.07 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 19 G 8.38 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 20 D 7.64 4.63 0.00 2.75 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 21 V 8.77 3.80 2.09 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 1.10 0.00 0.00 0.95 0.00 0.00 22 L 8.51 4.14 0.00 1.78 2.02 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.20 3.37 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 0.44 0.00 0.00 0.87 0.00 0.00 24 T 7.82 3.72 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 1.33 0.00 0.00 25 A 8.29 3.94 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 26 F 7.98 4.06 0.00 3.28 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 27 I 7.32 3.34 1.80 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 -0.04 0.83 0.00 0.00 28 N 8.75 4.31 0.00 2.89 2.80 0.00 0.00 7.05 7.52 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 29 K 8.05 3.87 0.00 1.59 1.75 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.63 1.62 7.81 30 I 7.67 3.69 1.79 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.34 0.78 0.00 0.00 31 M 7.68 3.91 0.00 2.02 1.93 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 2.63 2.45 0.00 32 R 8.44 4.33 0.00 1.73 1.77 0.00 3.29 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.58 0.00 33 D 8.74 4.59 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 34 G 8.11 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 35 K 7.74 4.60 0.00 1.76 1.73 0.00 1.69 0.00 0.00 1.92 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.60 7.81 36 K 7.76 4.73 0.00 1.81 1.77 0.00 1.77 0.00 0.00 1.84 0.00 0.00 2.90 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.54 7.81 37 N 8.54 4.37 0.00 2.79 2.92 0.00 0.00 6.67 6.74 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 38 L 8.90 4.06 0.00 1.72 1.80 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 39 A 7.82 3.95 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 40 A 9.30 3.96 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.39 3.87 0.00 2.06 2.01 0.00 3.21 0.00 0.00 3.21 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.94 0.00 42 I 8.00 3.56 2.07 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 1.43 0.86 0.94 0.00 0.00 43 F 7.98 4.09 0.00 2.71 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 44 Y 8.25 3.99 0.00 3.28 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 45 D 9.63 4.41 0.00 2.99 2.76 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 46 A 8.28 4.07 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 47 C 8.12 4.07 0.00 3.06 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 48 K 7.51 4.30 0.00 2.00 1.88 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.52 7.81 49 I 7.58 4.59 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.89 0.94 0.00 0.00 50 I 8.01 4.27 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.92 0.96 0.00 0.00 51 Q 8.16 4.16 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.09 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 52 E 8.11 4.09 0.00 1.95 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 2.32 2.35 0.00 53 K 7.89 4.16 0.00 1.73 1.86 0.00 1.79 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.49 7.81 54 T 7.44 4.11 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 1.25 0.00 0.00 55 G 8.88 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 56 Q 7.60 4.40 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.89 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 57 E 8.60 4.14 0.00 2.09 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 2.43 2.33 0.00 58 P 0.00 4.19 0.00 2.28 2.39 0.00 3.84 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.26 0.00 59 L 8.35 3.90 0.00 2.17 1.96 1.06 0.53 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 60 K 8.28 4.08 0.00 1.98 1.93 0.00 1.60 0.00 0.00 1.60 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.50 7.81 61 V 7.93 3.54 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 0.95 0.00 0.00 1.06 0.00 0.00 62 F 8.21 4.07 0.00 3.06 3.16 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 0.00 63 K 8.09 3.61 0.00 1.98 2.07 0.00 1.49 0.00 0.00 1.55 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.47 7.81 64 Q 8.29 3.80 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.42 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 65 A 8.29 3.86 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 66 V 7.43 3.36 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 0.65 0.00 0.00 0.23 0.00 0.00 67 E 8.10 3.90 0.00 2.09 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 0.00 2.29 2.41 0.00 68 N 8.42 4.58 0.00 2.84 2.85 0.00 0.00 6.77 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 69 V 8.12 4.36 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 1.23 0.00 0.00 1.09 0.00 0.00 70 K 7.57 3.80 0.00 1.92 2.12 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.43 1.36 7.81 71 P 0.00 4.46 0.00 2.47 2.73 0.00 3.73 0.00 0.00 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.27 0.00 72 R 8.69 3.79 0.00 1.80 2.05 0.00 3.34 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 73 M 7.25 4.71 0.00 1.87 1.93 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 2.55 2.65 0.00 74 E 8.41 4.94 0.00 2.22 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 2.26 2.36 0.00 75 V 8.42 5.02 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 0.79 0.00 0.00 0.99 0.00 0.00 76 R 8.90 4.71 0.00 1.90 1.95 0.00 3.24 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 77 S 8.81 4.17 0.00 3.89 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 78 R 7.42 4.14 0.00 1.59 1.69 0.00 2.46 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.06 0.00 79 R 8.34 4.61 0.00 1.68 1.61 0.00 3.31 0.00 0.00 3.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.44 0.00 80 V 8.34 4.11 1.49 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 0.53 0.00 0.00 0.41 0.00 0.00 81 G 7.46 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 0.00 0.00 0.00 0.00 82 G 10.29 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 0.00 0.00 0.00 83 A 6.95 4.31 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 84 N 8.58 5.07 0.00 2.56 2.82 0.00 0.00 6.88 7.46 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 85 Y 7.86 4.46 0.00 2.62 2.36 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 86 Q 8.66 4.64 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.95 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 87 V 8.27 4.13 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 1.23 0.00 0.00 1.08 0.00 0.00 88 P 0.00 5.44 0.00 2.15 2.07 0.00 3.94 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 89 M 9.00 4.84 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.67 0.00 90 E 8.82 4.09 0.00 1.99 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 2.35 2.37 0.00 91 V 7.86 4.26 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 0.76 0.00 0.00 1.03 0.00 0.00 92 S 8.68 4.26 0.00 3.91 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 93 P 0.00 4.15 0.00 2.27 2.32 0.00 3.78 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 94 R 8.06 4.16 0.00 1.84 2.02 0.00 3.10 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 95 R 7.84 3.86 0.00 1.84 1.97 0.00 3.19 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 96 Q 8.14 3.90 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.49 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 97 Q 9.00 3.85 0.00 1.98 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.71 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 98 S 7.77 3.99 0.00 3.98 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 99 L 8.64 3.02 0.00 1.12 0.13 0.84 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.33 3.71 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 0.00 101 L 8.38 3.98 0.00 1.89 1.90 0.93 0.90 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 0.00 102 R 8.38 3.78 0.00 1.79 1.68 0.00 3.12 0.00 0.00 3.15 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 103 W 8.39 4.74 0.00 3.65 3.12 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 0.00 104 L 8.38 4.10 0.00 2.33 2.17 1.01 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.94 3.56 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 0.99 0.00 0.00 0.67 0.00 0.00 106 Q 7.94 3.99 0.00 2.34 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.60 0.00 0.00 0.00 0.00 0.00 2.46 2.68 0.00 107 A 8.75 4.17 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 0.00 108 A 8.58 3.95 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 0.00 109 N 8.54 3.70 0.00 2.86 2.94 0.00 0.00 7.23 7.15 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 0.00 110 Q 8.02 4.19 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.93 0.00 0.00 0.00 0.00 0.00 2.41 2.68 0.00 111 R 8.14 4.14 0.00 2.02 1.89 0.00 3.20 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.61 0.00 112 P 0.00 4.64 0.00 2.18 2.15 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 113 E 7.96 4.07 0.00 1.96 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 2.32 2.22 0.00 114 R 8.83 4.03 0.00 1.80 2.00 0.00 3.37 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 115 R 7.73 4.29 0.00 1.86 1.84 0.00 3.12 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 116 A 8.43 3.96 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 0.00 117 A 7.94 3.92 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 0.00 118 V 7.82 3.48 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 0.85 0.00 0.00 0.90 0.00 0.00 119 R 7.48 3.95 0.00 1.95 2.11 0.00 3.40 0.00 0.00 3.30 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 2.02 0.00 120 I 8.03 3.83 2.00 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 1.74 1.00 1.27 0.00 0.00 121 A 9.07 4.01 1.28 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 0.00 0.00 0.00 122 H 7.72 4.01 0.00 3.16 3.41 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 0.00 123 E 8.60 3.97 0.00 2.18 2.36 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 2.63 2.55 0.00 124 L 8.30 4.01 0.00 2.14 1.76 1.05 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 125 M 7.88 3.99 0.00 2.09 2.29 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 2.66 2.62 0.00 126 D 8.28 4.63 0.00 2.75 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 0.00 127 A 7.88 4.33 1.40 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 0.00 0.00 128 A 8.39 4.16 1.47 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 0.00 0.00 129 E 8.83 3.99 0.00 2.01 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 0.00 2.32 2.33 0.00 130 G 8.16 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 0.00 0.00 0.00 131 K 7.12 4.34 0.00 1.80 1.81 0.00 1.54 0.00 0.00 1.71 0.00 0.00 3.25 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.20 1.32 7.81 132 G 7.58 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 0.00 133 G 7.95 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 0.00 0.00 0.00 134 A 8.09 3.95 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 0.00 135 V 7.73 3.46 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 1.05 0.00 0.00 0.95 0.00 0.00 136 K 8.38 3.87 0.00 1.85 1.75 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.59 7.81 137 K 8.38 3.08 0.00 1.50 0.92 0.00 1.55 0.00 0.00 1.32 0.00 0.00 2.39 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.26 1.49 7.81 138 K 7.96 3.39 0.00 1.76 1.88 0.00 1.83 0.00 0.00 1.67 0.00 0.00 3.14 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.63 1.69 7.81 139 E 8.43 4.30 0.00 2.09 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 2.42 0.00 140 D 8.77 4.20 0.00 2.63 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 0.00 141 V 6.93 3.54 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 1.03 0.00 0.00 0.83 0.00 0.00 142 E 8.36 4.08 0.00 2.25 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 2.35 2.60 0.00 143 R 8.43 3.86 0.00 1.91 1.99 0.00 3.13 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.90 0.00 144 M 8.15 3.80 0.00 2.04 2.37 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 2.64 2.74 0.00 145 A 7.57 4.40 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 0.00 146 E 8.89 3.93 0.00 2.17 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 2.29 2.23 0.00 147 A 7.37 4.08 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 0.00 148 N 7.53 4.73 0.00 2.99 2.86 0.00 0.00 6.50 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 R 8.40 3.85 0.00 2.02 1.85 0.00 3.25 0.00 0.00 3.13 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 150 A 7.82 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 7.03 4.08 0.00 3.11 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 0.00 152 A 8.07 4.23 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 0.00 153 H 7.63 4.75 0.00 3.45 3.36 0.00 5.50 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 8.48 5.16 0.00 3.03 2.76 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 0.00 155 R 8.73 3.87 0.00 1.94 2.10 0.00 3.39 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.96 0.00 156 W 8.01 4.19 0.00 3.58 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