NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 V 4.1562 8.0549 117.8392 60.5994 32.8174 174.3203 11 F 4.7037 8.5361 122.9164 53.9026 43.3432 172.3342 12 A 4.4955 9.2071 125.6183 51.9878 20.0643 175.9989 13 A 4.7948 8.7074 124.5644 50.6107 20.9321 175.8788 14 E 4.3048 9.1840 124.1158 58.4416 30.4637 176.2827 15 S 4.5382 7.4779 111.3230 57.5518 66.4881 172.8526 16 I 4.3132 8.0497 121.2293 60.4994 37.5667 175.8336 17 I 4.1968 8.4511 128.0141 63.1381 38.2794 175.8996 18 K 4.8332 7.3323 118.5314 55.3018 36.9408 174.7701 19 R 5.2583 8.7775 121.1174 54.7630 33.1081 174.4338 20 R 4.7032 9.2857 120.0032 54.6518 33.6492 173.5927 21 I 4.7735 8.2528 123.1147 60.5439 38.6993 176.3805 22 R 4.4505 8.6060 127.4966 56.0943 33.9821 172.1379 23 K 3.6129 8.5162 124.5049 55.3318 30.3696 173.0168 24 G 4.0677 8.6539 107.8553 47.2671 0.0000 172.6611 25 R 4.6710 7.8050 118.0944 53.9984 34.3156 173.9911 26 I 4.6248 7.9921 120.1682 60.5584 38.8033 174.8722 27 E 5.0155 9.0910 125.8668 54.6749 33.7706 174.3148 28 Y 5.1674 8.9154 119.9026 56.0605 41.8412 174.6880 29 L 3.8195 8.6042 126.6229 54.2651 43.2333 175.4791 30 V 4.0555 8.3561 128.0883 60.9752 33.2060 174.7383 31 K 4.1745 8.2243 130.5189 54.7131 32.9526 175.6694 32 W 4.6722 8.4011 128.4963 55.9171 30.3472 176.2448 33 K 4.4041 8.8144 125.9394 56.2822 32.4396 177.7599 34 G 4.0758 8.5100 116.0045 43.9421 0.0000 172.9094 35 W 4.6842 8.7680 120.4261 54.9638 31.3903 176.8938 36 A 4.1683 9.0210 126.6206 53.2631 18.5666 179.3060 37 I 3.8224 8.7091 119.0071 62.8710 35.6286 177.9249 38 K 3.9145 8.0950 118.0813 60.0629 32.2030 177.1112 39 Y 4.5572 7.8819 114.7326 58.0503 38.1362 175.6509 40 S 5.0292 8.4429 117.8415 58.7822 64.1346 173.6158 41 T 4.7135 8.2979 112.6517 59.3903 72.3136 172.9005 42 W 4.9176 8.7731 123.6990 56.8981 29.8216 175.4786 43 E 5.0261 9.4650 124.6152 53.4721 33.0347 174.1367 44 P 4.6072 0.0000 0.0000 62.5070 32.2936 176.9165 45 E 4.2770 8.6606 121.1534 59.3971 29.6722 178.9516 46 E 4.1688 8.1865 115.2683 58.6047 29.7311 177.2385 47 N 4.5637 8.3204 116.2196 54.3354 38.8799 175.6595 48 I 4.1065 7.4976 120.0089 60.3238 35.9056 175.3654 49 L 4.1131 8.3331 125.9624 56.2558 42.4512 177.0316 50 D 4.7576 7.8194 119.0550 52.4943 41.8857 176.7745 51 S 4.3294 8.5428 122.0975 60.4581 63.2220 176.2107 52 R 3.8945 8.4847 122.5855 58.9876 29.6699 178.7016 53 L 3.9172 7.7272 118.8833 57.8487 41.5682 179.6249 54 I 3.5907 7.5373 118.8911 64.0788 37.2703 177.8968 55 A 3.9648 8.1658 121.6494 55.4369 17.9863 179.6385 56 A 3.9532 7.8448 117.5173 55.0403 18.4897 179.2900 57 F 4.3014 7.7972 117.8765 61.5706 39.6818 176.8865 58 E 3.8767 8.3692 117.7270 57.5467 29.2765 177.6729 59 Q 4.2983 7.7042 122.5889 55.1755 29.6233 178.3941 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 10 V 8.05 4.16 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 0.94 0.00 0.00 0.93 0.00 0.00 11 F 8.54 4.70 0.00 2.67 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 12 A 9.21 4.50 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 13 A 8.71 4.79 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 9.18 4.30 0.00 1.98 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 2.27 2.26 0.00 15 S 7.48 4.54 0.00 3.86 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 16 I 8.05 4.31 1.56 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.27 0.13 0.00 0.00 17 I 8.45 4.20 1.62 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 1.12 0.42 0.85 0.00 0.00 18 K 7.33 4.83 0.00 1.60 1.90 0.00 1.78 0.00 0.00 1.97 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.52 7.81 19 R 8.78 5.26 0.00 1.88 1.99 0.00 3.50 0.00 0.00 3.38 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.29 0.00 20 R 9.29 4.70 0.00 1.49 1.55 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.12 0.00 21 I 8.25 4.77 1.80 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 1.16 0.84 0.85 0.00 0.00 22 R 8.61 4.45 0.00 1.68 1.72 0.00 3.41 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 1.45 1.42 0.00 23 K 8.52 3.61 0.00 1.87 1.35 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.75 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.28 0.98 7.81 24 G 8.65 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 0.00 0.00 0.00 0.00 25 R 7.81 4.67 0.00 1.80 1.73 0.00 3.12 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 26 I 7.99 4.62 1.92 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 1.26 1.12 0.46 0.00 0.00 27 E 9.09 5.02 0.00 1.72 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 2.23 2.18 0.00 28 Y 8.92 5.17 0.00 2.76 2.50 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 29 L 8.60 3.82 0.00 0.27 0.76 -0.13 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.36 4.06 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 -0.71 0.00 0.00 0.60 0.00 0.00 31 K 8.22 4.17 0.00 1.78 1.70 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.37 7.81 32 W 8.40 4.67 0.00 3.12 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 33 K 8.81 4.40 0.00 1.88 1.86 0.00 1.85 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.48 7.81 34 G 8.51 4.08 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 0.00 35 W 8.77 4.68 0.00 3.45 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 36 A 9.02 4.17 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 37 I 8.71 3.82 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 1.47 0.70 0.91 0.00 0.00 38 K 8.10 3.91 0.00 1.68 1.88 0.00 1.19 0.00 0.00 1.52 0.00 0.00 2.87 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.14 0.65 7.81 39 Y 7.88 4.56 0.00 3.29 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 40 S 8.44 5.03 0.00 3.69 3.60 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 41 T 8.30 4.71 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 42 W 8.77 4.92 0.00 3.22 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 43 E 9.47 5.03 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 44 P 0.00 4.61 0.00 2.63 2.21 0.00 3.81 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 2.29 2.01 0.00 45 E 8.66 4.28 0.00 2.18 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 2.47 2.59 0.00 46 E 8.19 4.17 0.00 2.15 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 0.00 2.32 2.31 0.00 47 N 8.32 4.56 0.00 3.00 3.04 0.00 0.00 6.99 7.00 0.00 0.00 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 I 7.50 4.11 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.50 0.78 0.00 0.00 49 L 8.33 4.11 0.00 1.66 1.74 0.96 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 50 D 7.82 4.76 0.00 2.66 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 S 8.54 4.33 0.00 4.08 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 R 8.48 3.89 0.00 1.99 2.01 0.00 3.12 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 53 L 7.73 3.92 0.00 1.69 1.51 0.81 0.36 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 54 I 7.54 3.59 1.77 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.06 0.92 0.00 0.00 55 A 8.17 3.96 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 56 A 7.84 3.95 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 57 F 7.80 4.30 0.00 2.91 3.20 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 58 E 8.37 3.88 0.00 1.94 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 2.40 2.61 0.00 59 Q 7.70 4.30 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.55 0.00 0.00 0.00 0.00 0.00 2.14 2.04 0.00