NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4056 8.3044 120.3468 53.9455 34.5171 175.2769 2 L 4.3953 7.5711 123.4680 50.8926 42.6407 173.7730 3 M 4.5134 7.3396 119.0790 51.5702 35.0478 175.2799 4 P 3.8776 0.0000 0.0000 64.6445 31.5991 176.4859 5 R 3.2657 8.0399 114.9626 55.1028 28.9976 174.5327 6 R 4.3550 5.8753 115.5020 56.3489 33.0250 174.1682 7 M 4.7995 7.9050 122.1442 54.4221 36.2756 174.3083 8 K 4.1916 8.3403 116.7858 56.7136 33.8149 176.5413 9 Y 4.9193 7.4095 115.4258 55.8614 41.0267 175.3267 10 R 4.1212 9.0130 125.6067 58.5121 30.5709 176.8584 11 K 4.4975 7.8686 116.1933 55.1275 35.0265 175.4189 12 Q 4.5831 8.3741 121.1923 53.7940 31.2640 176.1670 13 Q 4.3288 8.2403 115.8572 56.2565 29.1243 175.0652 14 R 4.6076 8.7856 115.1464 58.6388 31.8516 173.2218 15 G 3.9949 8.0616 112.1477 44.7029 0.0000 173.3112 16 R 4.3049 8.3943 122.4875 55.6772 31.4381 176.7887 17 L 4.4643 7.9473 123.0686 53.2420 40.1321 175.8282 18 K 4.0578 8.1783 118.1890 56.2468 32.4403 177.2563 19 G 3.7612 8.1945 113.0122 44.0533 0.0000 171.5386 20 A 3.6716 8.6362 120.6364 52.7396 18.4304 177.6947 21 T 4.0879 7.9977 106.8781 63.2179 70.7020 174.3083 22 K 3.9267 8.9155 127.6373 58.4850 32.2690 176.6753 23 G 3.7645 7.8826 105.5418 46.0626 0.0000 173.4455 24 G 3.7276 8.1638 104.6217 46.1451 0.0000 175.5025 25 D 4.2578 7.7836 120.8600 55.3086 40.0599 176.4617 26 Y 4.3660 6.8757 117.1440 55.3668 39.3041 174.8618 27 V 3.7277 9.5407 123.8328 66.1816 31.6506 178.7923 28 A 3.8848 8.5396 119.5401 53.1357 18.0910 177.2581 29 F 4.1734 8.8857 111.0625 58.5486 41.2599 175.0823 30 G 4.5080 8.0294 109.0823 44.3703 0.0000 171.9691 31 D 4.3173 9.2173 119.3035 57.0675 41.4072 176.1174 32 Y 5.5051 7.3670 115.0676 55.4666 41.9600 174.9025 33 G 4.7173 8.5645 109.6891 45.3042 0.0000 173.4615 34 L 5.6751 8.5429 115.3007 54.6988 43.0623 176.0961 35 V 4.1538 8.0064 122.3280 61.2046 33.1284 176.7835 36 A 4.6457 8.7455 126.1881 51.8743 19.1958 177.1165 37 L 4.7567 8.2620 115.4379 54.0262 44.0679 176.8006 38 E 4.7878 8.1108 113.5325 54.3522 31.6989 173.5126 39 P 4.5805 0.0000 0.0000 62.3823 32.6597 175.4098 40 A 4.8115 8.1921 128.1608 51.8044 22.9831 175.6431 41 W 5.1056 8.7537 121.5068 56.3264 30.1824 176.0160 42 I 4.7724 8.8963 125.5082 59.7640 40.0272 174.6207 43 T 4.8122 8.3982 113.4648 59.7642 71.0897 174.9757 44 A 3.8822 8.4203 125.9377 55.6169 18.1777 180.0416 45 Q 3.9584 8.1641 114.8319 60.3032 28.9550 179.0556 46 Q 4.1581 8.3049 117.9535 58.2868 28.7469 179.3816 47 I 3.3801 8.6185 117.4232 62.9856 37.5216 177.0912 48 E 3.8631 8.3974 119.6837 59.9654 29.2710 179.6574 49 A 4.0693 8.3349 120.2527 54.7291 17.7727 178.9436 50 A 4.3891 7.6986 118.1756 53.9154 19.2852 178.3758 51 R 4.1347 8.4816 115.3297 57.1753 30.0482 177.6264 52 V 3.7962 7.2691 116.0952 65.2617 32.3431 177.3703 53 A 3.9916 7.3320 120.8210 55.0665 18.1884 179.3994 54 M 3.5973 7.5041 115.9623 58.6168 32.4442 178.8917 55 V 3.8488 7.1145 118.8736 64.6103 31.4830 178.6532 56 R 3.8880 8.5778 119.1744 59.4618 29.9142 177.5392 57 H 3.8614 7.9353 113.2324 60.2259 30.5657 175.6953 58 F 4.6607 6.3579 117.3158 57.7357 37.3805 176.2124 59 R 4.5082 7.6597 115.5384 57.7639 31.1835 176.6360 60 R 3.7297 8.5885 117.2300 57.4001 26.9247 175.7764 61 G 3.4585 7.8575 106.4135 44.9331 0.0000 173.3053 62 G 3.6325 7.3663 108.1431 43.1385 0.0000 171.1660 63 K 3.5632 8.1753 122.5477 56.7942 30.9863 174.4696 64 I 4.5383 7.9740 123.0857 59.4799 39.5457 174.9027 65 F 4.8839 9.4183 126.7504 55.8530 41.0384 174.9557 66 I 4.4851 8.4517 118.8436 59.3329 37.6694 175.0964 67 R 4.4326 8.9247 126.6952 56.1944 30.3253 176.4514 68 I 4.6418 7.3265 111.6623 58.8780 40.6659 174.4316 69 F 4.5222 8.3524 122.5850 55.7793 41.9894 173.6689 70 P 4.7504 0.0000 0.0000 62.6791 29.0851 174.8456 71 D 5.2145 8.4795 124.4544 53.4597 40.9475 175.0804 72 K 4.5681 8.5101 121.5681 54.5274 34.0127 174.0253 73 P 4.1810 0.0000 0.0000 62.6643 32.7294 175.2963 74 Y 4.6832 8.3465 123.6643 56.0499 41.0582 174.7881 75 T 4.3167 8.0847 123.9228 63.4335 69.6524 175.2521 76 K 4.1465 8.0813 127.1842 55.2831 33.8402 175.4202 77 K 4.1065 8.5336 126.6474 55.7884 33.0298 175.6304 78 P 4.5055 0.0000 0.0000 62.1988 32.4300 176.0482 79 L 4.2371 8.2423 117.9807 55.7104 42.2097 178.5566 80 E 3.9281 8.9005 117.7248 57.4992 28.4597 175.4702 81 V 3.8038 7.8436 117.7090 61.5803 32.0032 175.5805 82 R 4.4613 7.9695 119.8235 54.7233 31.9809 175.9362 83 M 4.1434 8.1985 118.4667 56.6451 32.6085 176.6549 84 G 3.6782 8.5529 107.9245 45.3026 0.0000 172.0913 85 K 3.5755 8.9207 112.9405 57.4380 28.6272 176.3938 86 G 3.9026 7.9888 107.4560 44.2871 0.0000 173.1064 87 K 4.2111 8.2490 118.8597 56.0591 33.5913 173.9832 88 G 4.3202 8.2002 105.6648 45.3185 0.0000 172.8206 89 N 4.9581 8.5363 116.4809 52.1098 41.3931 174.2472 90 V 4.3921 8.1246 120.2936 61.7607 32.1417 175.2157 91 E 4.5577 8.7475 126.6381 56.8041 31.3509 175.7398 92 G 4.3644 7.6020 104.1505 45.4843 0.0000 171.3646 93 Y 5.3082 8.6665 116.7795 56.2817 41.8320 175.2947 94 V 4.6771 8.7739 114.0513 59.9236 37.1597 173.7684 95 A 4.9611 8.7490 122.6162 50.1471 21.8085 175.8382 96 V 4.1204 8.2988 121.9763 62.6218 32.8941 175.5646 97 V 4.4952 8.7490 126.3519 61.3472 34.4578 174.2378 98 K 5.0258 8.5850 125.9676 53.5032 35.8882 173.6299 99 P 4.1587 0.0000 0.0000 64.8425 31.9443 176.2162 100 G 4.1499 9.4967 114.9273 45.7653 0.0000 173.9619 101 R 3.9181 7.0741 119.0798 56.3246 31.3613 175.3725 102 V 4.4465 8.6547 125.5547 61.5880 32.1308 175.2556 103 M 4.0489 8.7483 127.6419 57.7516 33.0377 176.3355 104 F 6.1219 8.3690 115.4977 55.0531 43.5479 173.6584 105 E 5.3682 8.7223 115.9864 56.0619 32.5085 174.3614 106 V 5.2553 9.4139 114.1207 59.9000 36.0181 174.3629 107 A 5.0542 8.1043 123.2940 49.3084 23.1027 177.1151 108 G 3.6430 7.8912 104.9842 46.8339 0.0000 174.5450 109 V 4.2924 6.8779 119.5816 60.6559 35.5682 174.0047 110 T 4.0831 8.2312 118.5055 61.4309 68.1227 174.7481 111 E 4.3642 9.2355 127.5211 60.2506 27.8251 179.2434 112 E 3.9772 8.1403 119.9332 58.9164 29.6492 178.7902 113 Q 3.9597 8.6846 118.2627 58.8720 28.8021 178.3318 114 A 4.2418 8.2809 121.0212 55.9377 18.4858 179.6017 115 M 3.7597 7.9398 115.8329 57.6248 32.5166 177.5099 116 E 4.4617 7.6812 115.7286 57.5051 31.3513 177.3968 117 A 4.1366 8.0549 118.8988 54.8578 18.4488 178.7570 118 L 4.0782 8.5997 118.5472 56.7864 41.7719 179.9709 119 R 3.7114 7.0710 117.5849 59.0678 31.2466 178.0475 120 I 3.6047 7.5926 119.3401 64.5903 37.1440 178.1587 121 A 4.0041 8.6281 122.1984 54.9758 18.0264 179.7668 122 G 3.5606 7.6741 104.2943 48.4464 0.0000 175.4443 123 H 4.0095 7.4293 116.0580 58.5395 28.8098 177.2377 124 K 4.2075 7.7941 117.2543 56.3256 32.5981 176.6662 125 L 4.7830 8.0275 121.7159 52.0267 43.6100 175.5916 126 P 4.5332 0.0000 0.0000 64.1547 31.2864 175.4112 127 I 4.6161 7.2631 111.1366 59.7974 40.5176 174.2048 128 K 4.6635 8.0546 118.9383 56.3790 33.1393 176.4797 129 T 4.9645 8.1514 111.4789 60.5262 72.3749 172.4442 130 K 4.7287 8.9558 121.9873 54.8825 36.0518 174.8446 131 I 4.9441 8.3397 125.0080 60.0223 39.3152 175.2670 132 V 4.1698 8.0519 116.5240 60.4026 35.7695 175.4478 133 R 3.9308 8.8227 122.9443 55.0776 29.7578 174.5332 134 R 3.1891 5.8400 127.8519 55.4628 34.6773 173.1887 135 D 4.6786 6.7919 131.0119 54.1244 45.8262 178.4994 136 A 4.3662 9.6848 125.4621 53.8028 18.3899 179.4656 137 Y 4.3368 10.7931 118.4233 62.2276 38.6532 176.4774 138 D 4.2245 7.5831 116.7604 54.3268 40.9238 176.5547 139 E 4.4485 8.5914 125.0309 55.8522 30.0822 175.0289 140 A 4.7162 7.7385 118.5356 50.0903 21.4190 177.8491 141 Q 4.2452 8.3824 117.3033 56.0759 29.2324 176.0223 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 M 8.30 4.41 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 2 L 7.57 4.40 0.00 1.51 1.34 0.57 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 3 M 7.34 4.51 0.00 1.60 0.85 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 2.34 2.36 0.00 4 P 0.00 3.88 0.00 2.16 2.32 0.00 2.71 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 1.78 2.02 0.00 5 R 8.04 3.27 0.00 1.96 2.16 0.00 3.07 0.00 0.00 3.19 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.54 0.00 6 R 5.88 4.36 0.00 1.91 2.04 0.00 3.26 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.45 0.00 7 M 7.90 4.80 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.59 0.00 8 K 8.34 4.19 0.00 1.22 1.01 0.00 1.57 0.00 0.00 1.55 0.00 0.00 2.40 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.14 1.25 7.81 9 Y 7.41 4.92 0.00 2.96 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 10 R 9.01 4.12 0.00 1.82 2.01 0.00 3.23 0.00 0.00 3.30 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 11 K 7.87 4.50 0.00 1.82 1.68 0.00 1.58 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.42 7.81 12 Q 8.37 4.58 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.96 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 13 Q 8.24 4.33 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.88 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 14 R 8.79 4.61 0.00 1.89 2.17 0.00 3.38 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.72 0.00 15 G 8.06 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 0.00 0.00 0.00 16 R 8.39 4.30 0.00 1.79 1.85 0.00 3.22 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 17 L 7.95 4.46 0.00 1.69 1.69 1.09 1.30 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 18 K 8.18 4.06 0.00 1.76 1.79 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.39 7.81 19 G 8.19 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 20 A 8.64 3.67 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 21 T 8.00 4.09 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 22 K 8.92 3.93 0.00 1.73 1.88 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.46 7.81 23 G 7.88 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 24 G 8.16 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 D 7.78 4.26 0.00 2.70 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 26 Y 6.88 4.37 0.00 3.08 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 27 V 9.54 3.73 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 1.21 0.00 0.00 1.14 0.00 0.00 28 A 8.54 3.88 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 0.00 0.00 0.00 0.00 0.00 29 F 8.89 4.17 0.00 2.62 1.75 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 30 G 8.03 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 31 D 9.22 4.32 0.00 2.35 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 0.00 0.00 0.00 32 Y 7.37 5.51 0.00 2.99 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 33 G 8.56 4.72 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 0.00 0.00 0.00 34 L 8.54 5.68 0.00 1.76 1.87 1.02 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.01 4.15 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 0.80 0.00 0.00 1.07 0.00 0.00 36 A 8.75 4.65 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 37 L 8.26 4.76 0.00 1.73 1.66 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.11 4.79 0.00 1.92 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.30 0.00 39 P 0.00 4.58 0.00 1.96 2.21 0.00 3.81 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 2.05 2.16 0.00 40 A 8.19 4.81 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 41 W 8.75 5.11 0.00 3.12 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 42 I 8.90 4.77 1.91 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.75 1.02 0.00 0.00 43 T 8.40 4.81 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 44 A 8.42 3.88 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 45 Q 8.16 3.96 0.00 2.02 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.06 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 46 Q 8.30 4.16 0.00 2.40 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.44 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 47 I 8.62 3.38 1.86 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.76 0.97 0.00 0.00 48 E 8.40 3.86 0.00 2.05 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 2.40 0.00 49 A 8.33 4.07 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 50 A 7.70 4.39 1.20 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 0.00 0.00 0.00 51 R 8.48 4.13 0.00 2.02 2.22 0.00 3.27 0.00 0.00 3.29 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 52 V 7.27 3.80 2.18 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 0.95 0.00 0.00 0.95 0.00 0.00 53 A 7.33 3.99 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 M 7.50 3.60 0.00 1.95 1.82 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.23 0.00 55 V 7.11 3.85 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 0.78 0.00 0.00 0.96 0.00 0.00 56 R 8.58 3.89 0.00 1.85 2.00 0.00 3.15 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 57 H 7.94 3.86 0.00 2.95 3.04 0.00 5.77 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 6.36 4.66 0.00 3.13 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 59 R 7.66 4.51 0.00 2.03 2.17 0.00 3.24 0.00 0.00 3.11 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 60 R 8.59 3.73 0.00 1.98 2.01 0.00 3.21 0.00 0.00 3.24 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 61 G 7.86 3.46 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 0.00 62 G 7.37 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.18 3.56 0.00 1.79 1.39 0.00 1.80 0.00 0.00 1.86 0.00 0.00 3.29 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.04 1.34 7.81 64 I 7.97 4.54 1.87 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 1.53 0.75 1.00 0.00 0.00 65 F 9.42 4.88 0.00 3.18 2.88 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 66 I 8.45 4.49 1.72 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.58 0.94 0.00 0.00 67 R 8.92 4.43 0.00 1.78 1.87 0.00 3.16 0.00 0.00 3.36 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.58 0.00 68 I 7.33 4.64 1.79 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.44 0.80 0.00 0.00 69 F 8.35 4.52 0.00 2.92 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.75 0.00 2.17 1.96 0.00 2.41 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.50 0.00 71 D 8.48 5.21 0.00 2.63 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 72 K 8.51 4.57 0.00 1.61 1.45 0.00 0.94 0.00 0.00 0.61 0.00 0.00 2.75 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.07 1.21 7.81 73 P 0.00 4.18 0.00 1.90 1.94 0.00 3.63 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 2.16 0.00 74 Y 8.35 4.68 0.00 2.92 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 75 T 8.08 4.32 4.07 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 0.00 0.00 1.09 0.00 0.00 76 K 8.08 4.15 0.00 1.55 1.58 0.00 1.90 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.39 7.81 77 K 8.53 4.11 0.00 1.65 1.72 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.45 7.81 78 P 0.00 4.51 0.00 2.03 2.03 0.00 3.66 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 2.09 0.00 79 L 8.24 4.24 0.00 1.75 1.58 0.93 0.89 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 80 E 8.90 3.93 0.00 2.08 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 2.34 0.00 81 V 7.84 3.80 2.08 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 0.75 0.00 0.00 0.92 0.00 0.00 82 R 7.97 4.46 0.00 1.81 1.92 0.00 3.20 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 83 M 8.20 4.14 0.00 2.00 1.98 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 2.59 2.47 0.00 84 G 8.55 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 85 K 8.92 3.58 0.00 1.92 1.92 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.36 7.81 86 G 7.99 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 0.00 0.00 0.00 87 K 8.25 4.21 0.00 1.71 1.74 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.41 7.81 88 G 8.20 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 N 8.54 4.96 0.00 2.95 2.72 0.00 0.00 6.39 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 90 V 8.12 4.39 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 0.50 0.00 0.00 0.89 0.00 0.00 91 E 8.75 4.56 0.00 2.12 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 2.23 2.39 0.00 92 G 7.60 4.36 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 0.00 93 Y 8.67 5.31 0.00 2.94 3.01 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 94 V 8.77 4.68 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 0.59 0.00 0.00 0.40 0.00 0.00 95 A 8.75 4.96 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 V 8.30 4.12 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 0.96 0.00 0.00 0.80 0.00 0.00 97 V 8.75 4.50 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 0.95 0.00 0.00 0.94 0.00 0.00 98 K 8.59 5.03 0.00 1.92 1.68 0.00 1.76 0.00 0.00 2.01 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.47 7.81 99 P 0.00 4.16 0.00 2.08 2.00 0.00 3.57 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 100 G 9.50 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 0.00 0.00 0.00 0.00 101 R 7.07 3.92 0.00 2.05 1.90 0.00 3.20 0.00 0.00 3.06 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 102 V 8.65 4.45 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 0.97 0.00 0.00 1.09 0.00 0.00 103 M 8.75 4.05 0.00 1.68 1.76 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.56 0.00 104 F 8.37 6.12 0.00 2.97 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 0.00 105 E 8.72 5.37 0.00 2.28 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 2.51 2.53 0.00 106 V 9.41 5.26 2.38 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 1.05 0.00 0.00 1.21 0.00 0.00 107 A 8.10 5.05 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 0.00 108 G 7.89 3.64 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 0.00 0.00 0.00 109 V 6.88 4.29 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 0.89 0.00 0.00 0.15 0.00 0.00 110 T 8.23 4.08 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 1.21 0.00 0.00 111 E 9.24 4.36 0.00 2.67 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 2.46 2.50 0.00 112 E 8.14 3.98 0.00 2.05 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 2.41 0.00 113 Q 8.68 3.96 0.00 2.32 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 114 A 8.28 4.24 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 M 7.94 3.76 0.00 2.01 2.53 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 116 E 7.68 4.46 0.00 2.04 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 2.34 2.41 0.00 117 A 8.05 4.14 1.07 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 0.00 0.00 0.00 0.00 0.00 118 L 8.60 4.08 0.00 1.70 1.63 1.13 1.03 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 0.00 119 R 7.07 3.71 0.00 1.84 2.04 0.00 3.19 0.00 0.00 3.31 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 120 I 7.59 3.60 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.18 0.86 0.00 0.00 121 A 8.63 4.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.67 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 0.00 0.00 0.00 123 H 7.43 4.01 0.00 3.36 3.33 0.00 5.66 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 0.00 124 K 7.79 4.21 0.00 1.84 1.81 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.60 1.54 7.81 125 L 8.03 4.78 0.00 1.88 1.59 1.11 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.53 0.00 2.20 2.19 0.00 3.76 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 2.03 2.11 0.00 127 I 7.26 4.62 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.76 0.98 0.00 0.00 128 K 8.05 4.66 0.00 1.69 1.78 0.00 1.71 0.00 0.00 1.77 0.00 0.00 2.79 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.73 1.50 7.81 129 T 8.15 4.96 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 1.25 0.00 0.00 130 K 8.96 4.73 0.00 1.84 1.65 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.40 7.81 131 I 8.34 4.94 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.72 0.94 0.00 0.00 132 V 8.05 4.17 2.26 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 1.07 0.00 0.00 1.12 0.00 0.00 133 R 8.82 3.93 0.00 1.75 1.98 0.00 3.24 0.00 0.00 3.23 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.76 0.00 134 R 5.84 3.19 0.00 1.93 1.92 0.00 3.32 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.63 0.00 135 D 6.79 4.68 0.00 2.80 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 0.00 0.00 0.00 136 A 9.68 4.37 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 0.00 137 Y 10.79 4.34 0.00 2.89 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 0.00 138 D 7.58 4.22 0.00 2.67 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 0.00 139 E 8.59 4.45 0.00 1.63 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.24 0.00 140 A 7.74 4.72 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 0.00 141 Q 8.38 4.25 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.60 0.00 0.00 0.00 0.00 0.00 2.23 2.24 0.00