NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8514 8.3549 109.7355 46.6824 0.0000 173.7440 2 S 3.5485 8.7779 121.9675 59.2835 60.7955 172.6055 3 S 4.1843 8.4350 118.1421 61.6204 64.0214 175.6422 4 G 3.6535 7.8563 106.8503 45.6034 0.0000 172.8472 5 S 4.3449 8.3384 114.5710 56.4662 62.3403 173.4729 6 S 4.3430 8.4577 123.4344 56.5749 62.6828 170.8942 7 G 3.7718 8.7656 123.0162 44.8502 0.0000 171.7221 8 N 4.0915 8.8623 123.0258 55.7279 37.1102 175.5163 9 V 4.0027 7.3808 118.5091 62.1737 32.2288 175.9565 10 R 4.3658 9.1260 127.6573 55.6200 32.0210 176.1454 11 V 4.4017 8.2795 122.8911 61.4942 31.6215 174.9751 12 I 4.2010 7.9276 128.9482 61.1688 38.0054 175.7095 13 T 4.7373 8.1775 115.2901 59.4802 71.5646 173.7214 14 D 4.7297 8.4840 118.2894 56.1168 40.8321 177.0643 15 E 4.7602 8.0615 117.1843 58.2136 31.8497 177.2884 16 N 4.1881 8.2991 116.9339 55.4863 38.8652 176.8392 17 W 4.4669 8.0826 119.0511 60.0708 28.0234 178.2572 18 R 2.6173 5.8400 118.8214 58.4465 29.2710 178.2760 19 E 3.6147 7.8284 118.3323 59.5673 29.1727 179.4913 20 L 2.8013 7.4120 117.6720 56.9671 41.5514 177.9492 21 L 4.2722 7.5251 117.5369 54.4775 41.3688 176.1992 22 E 4.4744 7.7128 118.6701 55.4490 33.2334 177.1661 23 G 3.9134 8.5185 113.3100 45.6544 0.0000 171.2791 24 D 5.1328 8.1930 117.9470 53.6180 42.9109 176.1512 25 W 5.1842 9.1603 122.2154 55.9124 34.2134 173.5001 26 M 5.1632 9.5431 125.8705 54.1801 33.2908 175.3025 27 I 5.1971 9.0009 125.0734 59.5870 40.8829 175.3092 28 E 4.8847 7.9386 119.5652 54.9106 32.2406 174.5483 29 F 4.3403 9.9510 125.9460 57.5017 40.1245 174.4761 30 Y 5.0627 7.9507 120.3413 54.9776 41.6986 174.4963 31 A 3.9879 8.1203 120.5741 49.4286 21.9036 175.5966 32 P 4.1840 0.0000 0.0000 65.0197 31.6504 177.5075 33 W 4.5251 6.5634 113.5179 57.0046 27.8399 175.4897 34 C 4.7604 7.3241 121.9035 57.9374 32.3168 172.2126 35 P 4.4435 0.0000 0.0000 65.5124 31.7103 178.0488 36 A 4.0084 8.3797 121.4603 54.9092 18.0574 178.6829 37 C 3.9229 7.5190 114.1427 63.1239 31.1042 175.7525 38 Q 4.1328 7.9183 118.7486 59.3897 26.8858 179.1930 39 N 4.4737 8.2666 117.3282 55.9589 38.6536 177.1309 40 L 4.3984 7.9310 121.1622 57.5772 42.2968 178.5424 41 Q 3.8051 8.4976 119.1280 58.5501 28.5737 178.0344 42 P 4.2616 0.0000 0.0000 66.1443 31.1055 177.9911 43 E 4.0949 7.7998 118.7909 58.8565 29.2591 179.4548 44 W 4.2673 9.0133 128.5577 60.4952 30.6571 177.7946 45 E 3.7791 7.8116 116.6817 59.8211 29.1695 179.4286 46 S 4.3438 8.2965 114.9529 61.4108 62.8502 176.6033 47 F 3.8607 7.6309 122.3003 61.0613 39.0330 176.9756 48 A 2.5800 6.6827 120.4111 54.4984 17.6073 179.1446 49 E 3.7134 6.7813 115.2835 59.1330 29.9731 178.7895 50 W 4.9023 7.3373 114.2316 57.2144 28.5937 177.7909 51 G 3.2475 6.8185 107.2575 48.6053 0.0000 175.2616 52 E 3.8884 7.7198 119.5488 58.4757 29.3941 179.0666 53 D 4.4180 7.9036 119.0573 56.9017 41.0599 177.3486 54 L 4.3995 7.8947 116.6047 53.7536 42.8650 175.8715 55 E 3.5930 8.4080 117.6172 56.0933 27.5874 175.0444 56 V 4.3588 7.4698 117.5512 60.6203 35.0809 175.6980 57 N 4.2934 7.9660 122.9769 52.5639 40.2037 174.1581 58 I 4.9723 7.7567 121.7280 59.5096 40.3067 174.3737 59 A 5.5851 9.6862 128.1064 50.0771 23.0299 174.4064 60 K 4.7478 9.1864 117.2538 55.3201 36.3063 175.7246 61 V 4.4112 7.8070 121.9469 61.0126 35.0208 173.4815 62 D 3.9828 8.1715 125.4797 51.9368 43.1794 176.3625 63 V 4.3949 7.3664 119.3940 62.0046 31.7547 177.3417 64 T 4.6170 7.4735 110.2833 61.9795 70.6301 174.4579 65 E 4.4578 8.1899 119.0405 56.4027 30.7327 176.0102 66 Q 4.5798 7.5779 118.6934 53.1050 28.2522 174.1434 67 P 4.4035 0.0000 0.0000 65.0408 32.3148 179.8882 68 G 3.7288 8.0306 107.4340 47.0640 0.0000 175.2435 69 L 4.1446 8.0257 121.8899 57.8161 41.7140 179.5826 70 S 4.3848 7.9053 113.5061 61.9506 62.7839 177.1296 71 G 3.6370 8.0007 107.2057 47.2192 0.0000 175.8310 72 R 3.5863 7.9651 119.4648 58.0468 30.0714 177.2681 73 F 4.3560 7.6758 114.2922 55.8225 41.3449 174.7649 74 I 3.1406 7.3148 120.4874 62.2250 34.5465 174.5410 75 I 3.9032 7.6116 120.5314 60.9290 37.8735 175.9447 76 N 4.6964 8.9054 122.1143 53.5074 38.9768 174.8180 77 A 4.7797 7.7248 120.0105 50.1742 20.8941 175.8251 78 L 4.8416 8.0585 120.0345 52.2032 45.8508 174.3273 79 P 4.9522 0.0000 0.0000 63.0850 32.9145 175.7489 80 T 4.6601 8.3041 115.3379 62.7494 73.0180 172.9255 81 I 5.0535 8.6223 127.1022 59.9780 40.1609 174.1487 82 Y 5.1279 9.4522 123.3270 56.5797 41.8308 173.9421 83 H 5.2249 9.9783 125.0823 55.1992 31.6278 173.3372 84 C 4.3093 9.0460 128.4404 57.5834 33.0635 172.5511 85 K 4.3613 8.6188 129.8156 54.3011 33.6286 175.2657 86 D 4.1152 9.8008 129.5982 55.1106 40.2281 173.3166 87 G 3.9333 8.2070 106.1080 45.1362 0.0000 174.3475 88 E 4.1099 7.8851 120.0258 56.4171 30.3683 176.4319 89 F 5.1969 8.9367 124.0258 56.4610 41.4875 175.3632 90 R 5.0528 9.6768 121.7609 54.2849 33.8391 174.7446 91 R 3.8618 8.9189 125.1912 56.3556 30.8233 175.3535 92 Y 4.1598 8.4223 127.7572 57.1013 39.4288 175.7540 93 Q 4.2904 7.2232 123.2042 53.6570 29.0234 173.2341 94 G 3.7370 6.3295 108.6608 43.0956 0.0000 169.5912 95 P 4.3152 0.0000 0.0000 63.0322 31.7729 176.1263 96 R 3.4567 7.3997 116.2776 58.1187 27.7071 176.6213 97 T 4.6911 6.5140 107.7305 59.4206 72.8970 174.0707 98 K 4.5245 8.7195 124.8837 60.4885 32.3840 177.7578 99 K 3.7583 8.4965 118.8182 59.7443 31.9193 177.8748 100 D 4.4182 8.0542 117.0827 58.1664 40.7879 179.2898 101 F 4.2498 8.0945 116.3610 61.8548 39.2619 178.0731 102 I 2.3347 7.9899 116.9994 64.3055 36.8406 177.4223 103 N 4.1313 8.1160 116.2635 57.0718 38.5618 177.2288 104 F 4.4440 8.0789 121.0418 61.3821 39.7422 176.6004 105 I 4.2142 8.3633 118.8069 63.1234 37.5994 177.9897 106 S 4.1152 7.8662 114.7226 62.0986 63.1248 175.5131 107 D 4.5194 8.8837 117.9718 54.1721 40.5215 176.9891 108 K 4.3247 8.1621 117.9403 56.7294 30.3613 176.4857 109 E 4.0987 7.7109 121.9489 59.0016 29.9374 179.6715 110 W 4.7043 7.9198 115.5396 59.4424 28.0207 178.2188 111 K 3.7001 6.9474 118.1548 59.2955 31.3669 177.4103 112 S 4.6659 8.0277 113.6076 58.5929 62.8393 173.7520 113 I 4.6321 7.6403 120.7487 59.2538 39.9214 175.3269 114 E 4.1941 8.9072 125.1565 55.4341 29.5863 175.6434 115 P 4.9252 0.0000 0.0000 62.4765 32.8447 175.4161 116 V 4.6408 8.4952 111.0292 60.1289 34.8625 176.2706 117 S 5.0275 8.6681 116.9970 58.0863 62.8552 173.9090 118 S 4.6664 7.8968 107.6698 58.7323 63.7006 174.3242 119 W 4.0410 8.3367 131.1550 56.6273 31.8806 174.4518 120 F 5.0156 6.6612 123.7950 56.3108 37.8599 174.8481 121 S 4.1138 7.4400 115.8985 58.1851 64.1681 168.8084 122 G 4.0637 9.3290 118.4920 44.4934 0.0000 174.4576 123 P 4.5500 0.0000 0.0000 62.5862 29.9980 175.6298 124 S 4.4031 8.0617 120.6722 58.4522 63.5019 174.1735 125 S 4.7062 8.2213 122.2669 57.4885 63.5624 174.3074 126 G 3.7273 7.8382 114.6586 47.7504 0.0000 173.3919 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 G 8.35 3.85 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 0.00 0.00 0.00 2 S 8.78 3.55 0.00 4.05 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 3 S 8.43 4.18 0.00 3.85 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 4 G 7.86 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 5 S 8.34 4.34 0.00 3.77 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.46 4.34 0.00 3.82 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 7 G 8.77 3.77 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 0.00 0.00 0.00 8 N 8.86 4.09 0.00 2.47 2.77 0.00 0.00 6.07 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 9 V 7.38 4.00 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 0.92 0.00 0.00 0.77 0.00 0.00 10 R 9.13 4.37 0.00 1.85 2.00 0.00 3.36 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 11 V 8.28 4.40 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 0.82 0.00 0.00 0.96 0.00 0.00 12 I 7.93 4.20 1.86 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 1.41 0.98 0.95 0.00 0.00 13 T 8.18 4.74 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 1.24 0.00 0.00 14 D 8.48 4.73 0.00 2.98 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 15 E 8.06 4.76 0.00 2.12 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 0.00 2.34 2.51 0.00 16 N 8.30 4.19 0.00 2.71 2.84 0.00 0.00 6.87 8.82 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 17 W 8.08 4.47 0.00 3.89 3.51 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 18 R 5.84 2.62 0.00 1.31 1.41 0.00 2.75 0.00 0.00 2.90 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 19 E 7.83 3.61 0.00 1.35 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 2.17 2.51 0.00 20 L 7.41 2.80 0.00 1.56 1.64 1.13 1.04 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 21 L 7.53 4.27 0.00 1.53 1.60 1.18 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 22 E 7.71 4.47 0.00 2.03 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 2.17 2.10 0.00 23 G 8.52 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 0.00 0.00 0.00 24 D 8.19 5.13 0.00 2.48 2.46 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 25 W 9.16 5.18 0.00 3.10 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 26 M 9.54 5.16 0.00 2.34 2.29 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.89 0.00 27 I 9.00 5.20 1.99 0.00 0.00 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 1.41 0.96 0.55 0.00 0.00 28 E 7.94 4.88 0.00 1.46 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 1.47 1.63 0.00 29 F 9.95 4.34 0.00 2.98 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 30 Y 7.95 5.06 0.00 2.94 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 A 8.12 3.99 -0.62 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 32 P 0.00 4.18 0.00 2.13 2.15 0.00 2.57 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.78 0.00 33 W 6.56 4.53 0.00 3.50 3.29 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 34 C 7.32 4.76 0.00 3.10 2.91 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 35 P 0.00 4.44 0.00 2.31 2.34 0.00 4.09 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 2.14 1.99 0.00 36 A 8.38 4.01 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 37 C 7.52 3.92 0.00 3.00 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 38 Q 7.92 4.13 0.00 2.32 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.65 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 39 N 8.27 4.47 0.00 2.90 2.89 0.00 0.00 6.61 6.32 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 40 L 7.93 4.40 0.00 1.81 1.79 1.23 0.76 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 41 Q 8.50 3.81 0.00 2.24 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 5.82 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 42 P 0.00 4.26 0.00 2.31 2.33 0.00 3.76 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.08 0.00 43 E 7.80 4.09 0.00 2.57 2.43 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 2.49 2.54 0.00 44 W 9.01 4.27 0.00 3.44 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 45 E 7.81 3.78 0.00 2.13 1.95 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 2.30 2.52 0.00 46 S 8.30 4.34 0.00 3.96 4.02 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 0.00 0.00 0.00 47 F 7.63 3.86 0.00 2.71 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 A 6.68 2.58 0.66 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 49 E 6.78 3.71 0.00 2.03 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 2.23 2.38 0.00 50 W 7.34 4.90 0.00 3.62 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 6.82 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 0.00 0.00 0.00 52 E 7.72 3.89 0.00 2.03 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 2.29 2.25 0.00 53 D 7.90 4.42 0.00 2.91 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 54 L 7.89 4.40 0.00 1.92 1.83 0.71 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.41 3.59 0.00 2.10 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 2.16 2.19 0.00 56 V 7.47 4.36 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 0.90 0.00 0.00 0.95 0.00 0.00 57 N 7.97 4.29 0.00 1.44 1.66 0.00 0.00 5.19 6.99 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 58 I 7.76 4.97 1.16 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.10 0.23 0.00 0.00 59 A 9.69 5.59 1.44 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 0.00 0.00 60 K 9.19 4.75 0.00 2.03 1.97 0.00 1.30 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.52 7.81 61 V 7.81 4.41 1.15 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 0.70 0.00 0.00 0.52 0.00 0.00 62 D 8.17 3.98 0.00 2.57 2.35 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 63 V 7.37 4.39 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 0.91 0.00 0.00 0.98 0.00 0.00 64 T 7.47 4.62 4.33 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 1.30 0.00 0.00 65 E 8.19 4.46 0.00 1.94 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 2.23 2.25 0.00 66 Q 7.58 4.58 0.00 2.23 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.83 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 67 P 0.00 4.40 0.00 2.18 2.20 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 68 G 8.03 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 69 L 8.03 4.14 0.00 1.78 1.93 0.94 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 70 S 7.91 4.38 0.00 3.96 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 71 G 8.00 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 72 R 7.97 3.59 0.00 1.96 1.31 0.00 2.67 0.00 0.00 2.85 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 73 F 7.68 4.36 0.00 2.53 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 74 I 7.31 3.14 1.82 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 1.22 0.34 0.88 0.00 0.00 75 I 7.61 3.90 1.54 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 -0.36 0.75 0.00 0.00 76 N 8.91 4.70 0.00 2.78 2.90 0.00 0.00 6.14 7.28 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 77 A 7.72 4.78 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.06 4.84 0.00 1.72 1.61 1.14 1.19 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 79 P 0.00 4.95 0.00 2.10 2.11 0.00 3.44 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.88 0.00 80 T 8.30 4.66 4.37 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 1.37 0.00 0.00 81 I 8.62 5.05 2.02 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.96 1.14 0.00 0.00 82 Y 9.45 5.13 0.00 3.13 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 83 H 9.98 5.22 0.00 3.80 3.79 0.00 5.55 0.00 0.00 0.00 0.00 6.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 C 9.05 4.31 0.00 2.55 2.65 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 85 K 8.62 4.36 0.00 1.10 1.16 0.00 0.79 0.00 0.00 0.61 0.00 0.00 2.63 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.93 1.09 7.81 86 D 9.80 4.12 0.00 2.69 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.21 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 E 7.89 4.11 0.00 2.06 1.94 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 2.38 2.29 0.00 89 F 8.94 5.20 0.00 3.11 3.23 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 90 R 9.68 5.05 0.00 2.04 2.15 0.00 3.58 0.00 0.00 3.68 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.79 0.00 91 R 8.92 3.86 0.00 1.63 1.80 0.00 3.11 0.00 0.00 3.03 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.30 0.00 92 Y 8.42 4.16 0.00 2.94 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 93 Q 7.22 4.29 0.00 1.81 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.53 0.00 0.00 0.00 0.00 0.00 2.14 2.37 0.00 94 G 6.33 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.32 0.00 2.14 2.13 0.00 3.86 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 96 R 7.40 3.46 0.00 2.10 2.20 0.00 3.20 0.00 0.00 3.42 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.80 0.00 97 T 6.51 4.69 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 1.21 0.00 0.00 98 K 8.72 4.52 0.00 2.07 2.06 0.00 1.97 0.00 0.00 1.92 0.00 0.00 3.08 0.00 0.00 3.37 0.00 0.00 0.00 0.00 2.09 1.90 7.81 99 K 8.50 3.76 0.00 1.87 1.75 0.00 1.79 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.53 7.81 100 D 8.05 4.42 0.00 2.92 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 0.00 101 F 8.09 4.25 0.00 3.49 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 0.00 102 I 7.99 2.33 1.72 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 -0.36 0.52 0.00 0.00 103 N 8.12 4.13 0.00 3.00 2.91 0.00 0.00 6.84 7.99 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 0.00 104 F 8.08 4.44 0.00 3.29 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 0.00 105 I 8.36 4.21 2.22 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.52 1.08 0.00 0.00 106 S 7.87 4.12 0.00 3.78 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 0.00 107 D 8.88 4.52 0.00 2.79 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.16 4.32 0.00 1.52 1.04 0.00 1.65 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.81 1.79 7.81 109 E 7.71 4.10 0.00 2.28 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 110 W 7.92 4.70 0.00 3.54 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 0.00 111 K 6.95 3.70 0.00 1.18 1.56 0.00 1.29 0.00 0.00 1.42 0.00 0.00 2.87 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.30 0.21 7.81 112 S 8.03 4.67 0.00 3.93 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 I 7.64 4.63 2.34 0.00 0.00 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 1.39 0.90 1.13 0.00 0.00 114 E 8.91 4.19 0.00 2.03 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 2.38 2.35 0.00 115 P 0.00 4.93 0.00 2.33 2.28 0.00 3.82 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 116 V 8.50 4.64 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.25 0.00 0.00 117 S 8.67 5.03 0.00 4.02 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 0.00 118 S 7.90 4.67 0.00 3.86 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 0.00 119 W 8.34 4.04 0.00 3.18 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 0.00 120 F 6.66 5.02 0.00 2.97 3.07 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 0.00 121 S 7.44 4.11 0.00 2.72 2.90 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 0.00 122 G 9.33 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 0.00 0.00 0.00 123 P 0.00 4.55 0.00 2.23 2.16 0.00 4.01 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.03 0.00 124 S 8.06 4.40 0.00 3.83 3.77 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 0.00 125 S 8.22 4.71 0.00 3.97 3.89 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 0.00 0.00 0.00 126 G 7.84 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