NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.1269 8.3344 116.7701 58.0144 64.8599 173.4418 5 V 3.9057 7.5673 120.8817 60.2861 31.6683 169.7031 6 V 4.1956 8.9145 128.4272 61.6547 34.0420 174.5200 7 K 4.7522 8.0573 122.7173 54.2959 35.5665 177.3725 8 S 4.1925 8.9105 117.9770 62.1188 62.7613 176.4295 9 E 4.3222 8.1688 113.3918 57.0349 29.2986 176.6247 10 D 4.6064 7.9010 118.8363 54.3710 41.5575 177.6278 11 Y 4.1618 7.5622 117.9900 60.1462 37.6721 178.0207 12 A 4.2124 7.2908 121.1348 53.5098 18.8710 176.9544 13 L 4.6852 7.4647 115.7060 52.0197 43.5828 174.8408 14 P 4.3784 0.0000 0.0000 63.2161 31.7724 175.6923 15 S 4.7820 8.1347 114.4057 56.5555 66.3458 172.4590 16 Y 4.3540 8.4648 121.7061 56.8063 39.3285 174.9513 17 V 4.2235 7.2030 119.0443 59.6467 35.3103 174.9102 18 D 4.5440 8.5120 124.4750 52.6655 40.6435 175.6890 19 R 4.4433 7.8344 123.9189 54.1537 33.0295 175.7247 20 R 3.5360 8.7225 124.8798 59.1561 30.1372 176.8879 21 D 4.8751 8.0054 113.5694 53.2960 40.4108 176.3098 22 Y 4.7805 8.1812 121.2166 55.2488 38.8283 173.3105 23 P 4.2458 0.0000 0.0000 65.0475 31.7718 177.2692 24 L 4.7032 6.7504 117.3775 51.5829 41.0112 174.2845 25 P 4.6158 0.0000 0.0000 62.3317 31.9055 176.7581 26 D 4.5836 8.6381 118.4950 56.6802 40.9657 176.8039 27 V 4.5253 7.3820 110.0145 59.3466 35.8667 174.2380 28 A 4.4140 8.2239 123.7439 51.4696 19.5712 177.0231 29 H 3.5392 8.1360 122.0577 58.3655 29.8133 175.6792 30 V 4.1203 7.5653 119.4749 60.8939 32.3641 174.8925 31 K 4.1832 8.5353 126.3295 57.0333 33.5585 175.9686 32 N 4.7698 7.9635 117.0233 51.5537 39.3444 173.7742 33 L 4.5627 8.1799 123.6241 53.1628 43.6555 177.6550 34 S 4.5221 8.1939 117.1712 57.0605 66.1693 174.8356 35 A 3.9692 8.4551 122.5722 55.6651 17.9706 179.7335 36 S 4.1047 8.0533 111.8736 61.7782 62.8377 176.6365 37 Q 3.9486 7.7050 120.5417 58.7229 28.2088 178.7385 38 K 3.9310 8.4959 119.5790 59.1222 31.9283 179.3833 39 A 3.9974 7.8827 120.9216 55.0410 18.3428 179.3771 40 L 3.9381 7.8271 118.9241 58.3054 41.9857 179.2708 41 K 4.1151 8.2208 117.0604 58.6285 32.1312 178.6827 42 E 4.2431 7.7553 119.0557 58.8127 29.7527 178.5809 43 K 3.9468 8.4987 120.0765 59.4014 31.9942 178.2543 44 E 4.2369 8.2493 118.5026 58.4894 29.6214 178.2330 45 K 4.2794 8.1781 117.0404 57.4748 32.4433 176.5431 46 A 4.5008 7.5331 122.2460 49.8771 20.9338 176.4656 47 S 3.9908 8.4333 113.0631 58.8032 62.6717 175.2105 48 W 4.6724 8.5613 126.7430 59.0848 29.1876 178.4226 49 S 4.3083 7.8055 114.6141 61.3586 62.3354 175.6478 50 S 4.3770 7.8847 114.9151 59.8843 62.9419 174.4956 51 L 4.2490 7.4612 121.1965 54.2142 42.0657 177.7038 52 S 4.5690 9.1125 119.0575 57.3477 65.6220 175.6018 53 I 3.6552 8.1290 121.8439 64.8538 36.8634 178.1565 54 D 4.5127 8.2295 118.9955 57.8019 40.5986 178.9868 55 E 4.0754 8.0164 118.3290 59.0445 29.5085 179.2940 56 K 3.9761 8.2720 118.9938 59.3486 31.9894 179.6318 57 V 3.6645 8.2922 119.1200 65.8641 31.2437 177.7437 58 E 3.9530 8.0168 118.2772 59.2432 29.3108 178.4808 59 L 4.1135 8.0711 119.1662 57.7575 41.5585 178.9271 60 Y 4.1901 7.8335 119.2163 60.7966 38.6850 177.7991 61 R 4.3794 8.1367 117.9850 57.4875 30.3479 178.2368 62 L 4.1896 7.3971 118.4755 57.0217 41.9921 178.7771 63 K 3.6819 7.6723 119.0031 57.3924 32.0189 176.3642 64 F 5.1733 7.5132 116.5233 55.3612 42.4852 175.4841 65 K 3.5576 8.8383 124.9875 58.3807 32.3586 176.7799 66 E 5.0125 8.3165 117.5850 54.1318 32.6954 176.7655 67 S 5.0675 8.9732 118.3731 57.0937 65.7297 175.4087 68 F 4.0087 8.9968 120.8035 60.7374 38.3497 177.8618 69 A 4.0777 8.0117 119.1011 55.1904 18.2514 179.1085 70 E 4.1114 8.4901 117.5234 59.6953 29.3501 179.4776 71 M 4.2975 8.3944 116.4774 58.1354 31.3926 177.4300 72 N 4.7076 7.9342 114.7826 52.0598 39.2156 175.5946 73 R 4.0987 6.9294 116.6960 56.3063 30.0612 176.2739 74 S 4.7197 8.3501 113.8667 57.1955 64.8673 173.1272 75 T 4.6737 8.2037 111.1146 60.3803 71.5728 173.2328 76 N 4.9477 8.3755 115.3986 53.4138 38.9382 177.2206 77 E 4.0234 8.2683 122.6500 58.8918 29.5767 178.3442 78 W 4.2948 8.4355 116.5846 59.6134 27.9132 178.1560 79 K 2.9294 6.1937 118.0264 59.1210 31.3397 179.4050 80 T 3.7191 7.4649 115.1922 66.5865 68.4186 176.5420 81 V 3.6002 7.8530 120.1217 66.1421 31.5789 178.1077 82 V 3.7456 8.7836 118.5893 66.1008 31.4627 178.1426 83 G 3.6613 8.2428 105.2783 47.8349 0.0000 175.4479 84 A 4.0660 8.2999 122.6899 54.7638 18.5731 179.3270 85 A 4.1958 8.3877 119.5658 55.9585 18.3214 179.8685 86 M 4.0876 8.2121 117.0241 58.3191 31.9406 178.7102 87 F 4.0186 7.9755 120.4713 61.4212 39.6580 177.3082 88 F 4.1255 8.5764 117.6574 60.3721 38.4624 177.8208 89 I 4.0303 7.9152 119.2418 64.0516 37.0643 178.3028 90 G 3.6518 8.2441 107.2899 47.5606 0.0000 175.6659 91 F 4.0122 8.1271 123.2208 61.3117 39.3469 177.3206 92 T 3.8466 8.0815 115.0012 66.5608 68.0819 176.3171 93 A 4.0046 7.6745 122.8073 54.9787 18.3317 179.6773 94 L 3.8664 7.7042 117.7006 57.6882 41.4873 179.7039 95 L 3.9109 7.3231 118.5986 57.7937 41.6901 179.3672 96 L 4.0881 8.0885 118.9641 57.6317 41.5427 179.6601 97 I 3.7239 8.0761 120.1954 64.0082 36.9899 178.0570 98 W 4.1639 8.3278 129.1641 60.5249 30.4556 177.1652 99 E 3.8630 8.7717 119.5224 59.5888 28.8125 178.9244 100 K 4.1333 7.9465 117.7675 59.7320 32.2928 177.8750 101 H 4.0664 7.9171 117.7896 58.1073 29.8710 175.7513 102 Y 4.3682 7.5190 115.4727 57.2514 39.2265 176.1958 103 V 3.9790 7.4670 118.4954 64.0748 33.3561 175.6471 104 Y 4.5811 7.4872 116.0029 57.5734 38.8713 175.8307 105 G 4.1377 8.3438 113.7316 43.9645 0.0000 171.4069 106 P 4.4802 0.0000 0.0000 62.0072 32.4951 175.6997 107 I 4.0922 7.7039 113.0380 58.7206 39.1478 173.6326 108 P 4.2777 0.0000 0.0000 63.0743 31.7731 177.4117 109 H 4.2667 8.6611 116.4047 58.0889 28.4639 176.9921 110 T 2.6796 7.1902 109.0651 62.7940 68.4692 174.5509 111 F 4.5606 7.5885 120.1852 57.4369 39.6712 176.4481 112 E 4.2084 8.1373 122.5258 55.8384 31.0104 176.9207 113 E 3.9673 9.0379 124.1289 59.7222 29.5797 179.0392 114 E 3.9172 8.2335 118.2755 59.0611 29.8693 177.9998 115 W 3.9335 8.3929 127.9047 60.5891 30.5769 177.6040 116 V 3.6377 8.3483 117.8980 66.1338 30.9713 177.4888 117 A 4.0325 8.0705 120.2532 55.3787 18.1873 179.8468 118 K 3.7805 7.9078 116.6264 59.6456 32.0537 179.4180 119 Q 3.9314 8.2715 120.1789 59.3171 28.8632 178.5812 120 T 3.9950 8.5573 117.2574 66.4743 68.5913 176.4076 121 K 3.5604 7.9589 121.4355 59.4111 32.2014 178.4359 122 R 3.7899 8.2485 119.2170 59.8857 29.9496 178.2073 123 M 4.0766 8.2358 118.3409 58.5843 31.8798 178.8393 124 L 4.0847 8.0849 119.0001 57.8840 41.4449 179.3262 125 D 4.4616 8.4402 118.6857 56.4664 40.8126 177.5296 126 M 4.3187 7.8811 115.1334 53.5766 32.9333 176.1397 127 K 4.1774 7.5086 117.3734 56.5568 30.1503 175.6144 128 V 3.5306 8.2619 118.8317 63.8819 33.0530 175.3146 129 A 3.8035 8.7537 130.6345 52.9015 15.5028 175.7283 130 P 4.5340 0.0000 0.0000 64.7742 32.7041 179.0789 131 I 4.0291 7.9229 119.3122 64.0646 37.4528 176.2153 132 Q 4.4962 8.1113 114.3388 57.4463 33.2100 175.8350 133 G 3.7644 7.8291 104.1964 48.2347 0.0000 173.2000 134 F 4.8912 8.4238 117.4676 59.0342 41.9800 178.0090 135 S 4.3199 9.2258 114.7622 61.5573 62.6863 176.6500 136 A 4.3028 8.2230 121.9504 54.2737 18.4108 178.4892 137 K 4.3764 8.1902 115.9779 55.4127 32.5481 175.6793 138 W 4.6522 7.8291 130.1803 55.2465 32.4282 174.8879 139 D 4.3893 7.5618 125.8102 52.9437 39.9578 176.5002 140 Y 4.1392 8.3266 125.6282 60.9358 38.4321 177.8418 141 D 4.4899 8.2327 118.7703 57.3580 41.1259 177.8303 142 K 3.9250 7.7352 115.4940 56.6794 32.7435 176.4836 143 N 3.8512 7.2121 116.6811 52.7952 37.3825 171.7992 144 E 3.7404 5.9000 115.8325 54.4987 33.1965 176.5883 145 W 4.4369 8.2002 120.8459 56.3217 29.7949 176.4765 146 K 3.7692 8.7018 124.2298 56.8733 32.1788 177.2738 147 K 4.1402 8.5617 123.0489 56.7414 32.0739 176.8519 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 4 S 8.33 4.13 0.00 3.78 3.92 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 5 V 7.57 3.91 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 0.74 0.00 0.00 0.91 0.00 0.00 6 V 8.91 4.20 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 0.90 0.00 0.00 0.96 0.00 0.00 7 K 8.06 4.75 0.00 1.95 1.64 0.00 1.73 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.41 7.81 8 S 8.91 4.19 0.00 3.92 4.01 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 0.00 0.00 0.00 0.00 9 E 8.17 4.32 0.00 1.97 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 0.00 2.26 2.25 0.00 10 D 7.90 4.61 0.00 3.06 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 11 Y 7.56 4.16 0.00 2.90 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 A 7.29 4.21 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.46 4.69 0.00 1.72 1.58 0.86 1.26 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 14 P 0.00 4.38 0.00 2.06 2.04 0.00 3.62 0.00 0.00 3.71 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 S 8.13 4.78 0.00 3.97 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 16 Y 8.46 4.35 0.00 2.99 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.20 4.22 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 0.71 0.00 0.00 0.85 0.00 0.00 18 D 8.51 4.54 0.00 2.69 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 19 R 7.83 4.44 0.00 1.71 1.73 0.00 3.36 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 1.54 1.58 0.00 20 R 8.72 3.54 0.00 1.84 2.13 0.00 3.55 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.54 0.00 21 D 8.01 4.88 0.00 2.84 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 22 Y 8.18 4.78 0.00 2.90 2.77 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 23 P 0.00 4.25 0.00 2.32 2.42 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.05 0.00 24 L 6.75 4.70 0.00 1.61 1.69 0.95 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.62 0.00 2.14 1.79 0.00 3.87 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 2.05 0.00 26 D 8.64 4.58 0.00 2.74 2.79 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 27 V 7.38 4.53 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 0.76 0.00 0.00 1.05 0.00 0.00 28 A 8.22 4.41 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 H 8.14 3.54 0.00 2.29 3.24 0.00 5.89 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 30 V 7.57 4.12 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 0.82 0.00 0.00 0.74 0.00 0.00 31 K 8.54 4.18 0.00 1.86 1.87 0.00 1.57 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.29 1.40 7.81 32 N 7.96 4.77 0.00 2.67 2.77 0.00 0.00 6.88 7.85 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 33 L 8.18 4.56 0.00 1.61 1.56 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.19 4.52 0.00 4.03 4.01 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 0.00 0.00 0.00 0.00 35 A 8.46 3.97 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 36 S 8.05 4.10 0.00 4.06 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 0.00 37 Q 7.71 3.95 0.00 2.44 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 38 K 8.50 3.93 0.00 1.76 1.86 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.74 7.81 39 A 7.88 4.00 1.41 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 0.00 0.00 0.00 40 L 7.83 3.94 0.00 1.92 1.87 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.22 4.12 0.00 1.76 1.87 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.61 1.61 7.81 42 E 7.76 4.24 0.00 2.18 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 2.57 2.46 0.00 43 K 8.50 3.95 0.00 1.81 2.00 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 44 E 8.25 4.24 0.00 2.15 2.23 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 2.56 2.30 0.00 45 K 8.18 4.28 0.00 1.92 1.89 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.54 1.77 7.81 46 A 7.53 4.50 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 47 S 8.43 3.99 0.00 3.82 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 48 W 8.56 4.67 0.00 3.42 3.11 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 49 S 7.81 4.31 0.00 3.84 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 S 7.88 4.38 0.00 4.02 3.95 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 51 L 7.46 4.25 0.00 1.96 1.64 0.98 1.13 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 52 S 9.11 4.57 0.00 4.04 4.06 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 53 I 8.13 3.66 1.87 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 1.64 0.82 0.90 0.00 0.00 54 D 8.23 4.51 0.00 2.72 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 55 E 8.02 4.08 0.00 2.25 1.99 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 2.33 2.35 0.00 56 K 8.27 3.98 0.00 1.95 1.81 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.95 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.42 1.73 7.81 57 V 8.29 3.66 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 1.12 0.00 0.00 0.91 0.00 0.00 58 E 8.02 3.95 0.00 2.18 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 0.00 2.33 2.36 0.00 59 L 8.07 4.11 0.00 1.95 1.66 0.84 0.47 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 60 Y 7.83 4.19 0.00 3.05 3.15 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 61 R 8.14 4.38 0.00 1.86 2.01 0.00 3.43 0.00 0.00 3.33 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.76 0.00 62 L 7.40 4.19 0.00 1.77 1.62 0.89 0.73 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 63 K 7.67 3.68 0.00 1.56 1.48 0.00 1.13 0.00 0.00 1.47 0.00 0.00 2.83 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.54 0.21 7.81 64 F 7.51 5.17 0.00 2.42 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 65 K 8.84 3.56 0.00 1.10 2.09 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.18 7.81 66 E 8.32 5.01 0.00 2.25 1.84 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 2.26 2.23 0.00 67 S 8.97 5.07 0.00 4.10 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 68 F 9.00 4.01 0.00 3.04 3.15 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 69 A 8.01 4.08 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 70 E 8.49 4.11 0.00 2.30 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 2.36 2.35 0.00 71 M 8.39 4.30 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.58 0.00 72 N 7.93 4.71 0.00 2.90 2.92 0.00 0.00 7.06 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 R 6.93 4.10 0.00 1.99 1.97 0.00 3.07 0.00 0.00 3.30 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.60 0.00 74 S 8.35 4.72 0.00 4.03 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 75 T 8.20 4.67 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 1.25 0.00 0.00 76 N 8.38 4.95 0.00 2.75 2.74 0.00 0.00 6.44 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 77 E 8.27 4.02 0.00 2.07 2.02 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 2.41 2.38 0.00 78 W 8.44 4.29 0.00 3.71 3.35 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 79 K 6.19 2.93 0.00 1.54 1.35 0.00 1.35 0.00 0.00 1.28 0.00 0.00 2.91 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.46 3.72 4.30 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 0.00 0.00 0.00 1.16 0.00 0.00 81 V 7.85 3.60 2.31 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 1.15 0.00 0.00 1.01 0.00 0.00 82 V 8.78 3.75 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 1.08 0.00 0.00 1.18 0.00 0.00 83 G 8.24 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 A 8.30 4.07 1.48 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 85 A 8.39 4.20 1.51 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 86 M 8.21 4.09 0.00 2.14 2.34 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 2.92 2.60 0.00 87 F 7.98 4.02 0.00 3.01 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 88 F 8.58 4.13 0.00 3.40 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 89 I 7.92 4.03 2.05 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.71 0.94 0.00 0.00 90 G 8.24 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 8.13 4.01 0.00 2.52 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 92 T 8.08 3.85 4.44 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 1.23 0.00 0.00 93 A 7.67 4.00 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 94 L 7.70 3.87 0.00 1.38 1.51 0.86 0.34 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 95 L 7.32 3.91 0.00 1.82 1.65 0.92 0.26 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 96 L 8.09 4.09 0.00 1.85 1.76 0.94 0.82 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 I 8.08 3.72 2.06 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.12 0.93 0.00 0.00 98 W 8.33 4.16 0.00 3.51 3.44 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 99 E 8.77 3.86 0.00 2.35 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 0.00 1.89 2.28 0.00 100 K 7.95 4.13 0.00 1.90 1.86 0.00 1.83 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.48 7.81 101 H 7.92 4.07 0.00 2.99 3.16 0.00 5.95 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 7.52 4.37 0.00 1.43 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 0.00 0.00 0.00 0.00 103 V 7.47 3.98 1.73 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 0.53 0.00 0.00 0.66 0.00 0.00 104 Y 7.49 4.58 0.00 2.98 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 0.00 105 G 8.34 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 0.00 0.00 0.00 0.00 106 P 0.00 4.48 0.00 2.15 2.01 0.00 3.73 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 1.94 1.92 0.00 107 I 7.70 4.09 1.45 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.48 0.61 0.00 0.00 108 P 0.00 4.28 0.00 2.36 1.97 0.00 3.56 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 2.17 2.09 0.00 109 H 8.66 4.27 0.00 3.41 3.48 0.00 5.65 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.19 2.68 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 0.11 0.00 0.00 111 F 7.59 4.56 0.00 2.92 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 0.00 112 E 8.14 4.21 0.00 2.29 1.99 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 2.40 2.38 0.00 113 E 9.04 3.97 0.00 2.09 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 2.45 2.46 0.00 114 E 8.23 3.92 0.00 2.14 2.02 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 2.38 2.39 0.00 115 W 8.39 3.93 0.00 3.63 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 0.00 116 V 8.35 3.64 2.37 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 1.04 0.00 0.00 1.12 0.00 0.00 117 A 8.07 4.03 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.91 3.78 0.00 1.64 1.58 0.00 1.39 0.00 0.00 1.30 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.45 7.81 119 Q 8.27 3.93 0.00 2.11 2.29 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 2.36 2.45 0.00 120 T 8.56 4.00 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 121 K 7.96 3.56 0.00 1.69 1.84 0.00 1.36 0.00 0.00 1.47 0.00 0.00 2.91 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.32 1.46 7.81 122 R 8.25 3.79 0.00 1.76 2.04 0.00 3.07 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 123 M 8.24 4.08 0.00 2.17 2.44 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.53 0.00 124 L 8.08 4.08 0.00 1.59 1.31 -0.99 0.37 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 0.00 125 D 8.44 4.46 0.00 2.69 2.69 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 0.00 126 M 7.88 4.32 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.84 0.00 127 K 7.51 4.18 0.00 1.84 1.88 0.00 1.50 0.00 0.00 1.19 0.00 0.00 2.46 0.00 0.00 2.28 0.00 0.00 0.00 0.00 1.54 1.23 7.81 128 V 8.26 3.53 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 0.97 0.00 0.00 0.96 0.00 0.00 129 A 8.75 3.80 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 0.00 130 P 0.00 4.53 0.00 2.24 2.25 0.00 3.83 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 2.03 2.02 0.00 131 I 7.92 4.03 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.44 0.94 0.00 0.00 132 Q 8.11 4.50 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 133 G 7.83 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 F 8.42 4.89 0.00 3.13 3.33 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 0.00 135 S 9.23 4.32 0.00 4.15 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 0.00 136 A 8.22 4.30 1.48 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 0.00 137 K 8.19 4.38 0.00 2.15 1.95 0.00 1.78 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.52 7.81 138 W 7.83 4.65 0.00 2.74 2.66 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 0.00 0.00 0.00 0.00 139 D 7.56 4.39 0.00 2.32 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 0.00 0.00 0.00 140 Y 8.33 4.14 0.00 3.14 3.13 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 0.00 141 D 8.23 4.49 0.00 2.64 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 0.00 142 K 7.74 3.93 0.00 1.46 1.78 0.00 1.91 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.27 7.81 143 N 7.21 3.85 0.00 2.74 2.73 0.00 0.00 6.98 9.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 E 5.90 3.74 0.00 1.73 1.66 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 0.00 1.80 1.88 0.00 145 W 8.20 4.44 0.00 3.16 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 0.00 146 K 8.70 3.77 0.00 1.76 1.78 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.41 1.47 7.81 147 K 8.56 4.14 0.00 1.72 1.70 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.39 7.81