NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2826 8.1227 123.5835 52.2308 19.7284 177.1406 3 R 3.7817 7.3862 125.8104 57.9951 30.1180 175.1163 4 K 3.7586 8.4123 120.3495 59.9515 32.8966 178.2301 5 A 4.0763 8.0549 120.0939 54.9453 18.2003 179.1221 6 L 4.0727 7.4933 118.7781 57.9999 42.0713 178.9664 7 I 3.8190 7.6545 111.9912 63.5008 37.5824 177.2030 8 E 4.1868 7.8532 120.0587 58.3373 29.2107 177.9871 9 K 4.0408 7.9699 118.8589 58.7546 32.0420 178.0577 10 A 4.0168 7.8275 119.3996 53.0133 18.6065 177.8084 11 K 4.3062 7.2911 115.0023 56.1541 32.8201 177.2308 12 R 4.0123 7.7282 119.3453 58.9521 30.9088 176.6932 13 T 3.3934 7.8038 110.9328 64.0470 64.8854 169.6718 14 P 4.3634 0.0000 0.0000 65.3732 33.4954 181.8113 15 K 4.1826 7.1379 127.9592 54.5100 31.2856 177.8450 16 F 4.5831 7.1683 128.7444 58.1854 39.1138 174.8282 17 K 4.2707 8.6420 118.9738 58.5795 32.9206 177.3238 18 V 3.9572 7.6792 119.2238 63.4528 31.6806 176.3860 19 R 4.7706 7.8972 115.0602 55.5419 33.1461 175.8180 20 A 4.1974 7.5647 120.9492 51.3452 17.9251 176.8816 21 Y 4.3535 7.9243 118.7992 57.8645 38.5555 176.2131 22 T 3.9181 8.5208 110.8275 61.5751 69.1673 173.8997 23 R 4.6182 8.2626 125.9283 53.9817 31.9346 174.1079 24 C 4.2878 8.4158 125.8140 60.1225 32.2515 174.6967 25 V 3.8673 8.1725 124.6443 65.2278 33.0767 177.8178 26 R 3.9113 8.5657 112.3397 59.3435 28.6407 177.1732 27 C 4.3748 9.5620 115.6150 58.2217 30.2729 174.6972 28 G 4.3542 7.2586 104.6517 47.2476 0.0000 172.9239 29 R 4.6328 7.8274 123.9465 54.3515 32.9670 176.6253 30 A 4.2666 8.5959 124.8816 53.5938 19.1977 177.4154 31 R 4.6207 7.4907 109.5812 54.6463 32.6160 174.6627 32 S 3.5050 8.2677 110.0304 59.6436 60.0194 172.4643 33 V 4.2449 7.6469 119.9181 61.2184 32.1263 174.6436 34 Y 4.3031 8.5310 126.2287 57.9556 38.4389 177.6313 35 R 4.0317 8.8567 123.6470 59.2510 30.3530 177.7462 36 F 4.2700 8.2420 118.9949 61.4320 38.3163 176.1949 37 F 3.7454 8.5814 118.9602 58.2555 39.5159 176.8899 38 G 4.2013 8.4657 108.1975 46.1611 0.0000 172.8674 39 L 5.0729 7.4293 117.7000 52.1665 44.8352 176.3982 40 C 5.6286 8.6534 115.9352 57.2512 30.4359 174.6364 41 R 4.2586 8.5178 115.9541 59.3009 28.8780 178.0466 42 I 3.8369 7.7928 121.4632 63.7173 37.4915 177.3221 43 C 4.6429 7.9927 116.4304 60.6836 29.1621 175.5986 44 L 3.6651 7.5514 122.4456 58.2693 41.5756 179.0583 45 R 3.7679 7.4602 118.5906 59.1798 29.8908 178.0020 46 E 3.9809 7.9408 118.4173 59.7723 29.5212 179.5945 47 L 3.9827 7.8652 118.1756 57.4569 41.6608 178.9667 48 A 3.8817 8.0095 121.0234 55.8655 18.0496 179.2578 49 H 4.0680 8.2095 113.2578 59.1545 28.9371 178.0743 50 K 4.1889 7.5949 118.9972 57.4982 31.7817 178.1296 51 G 3.8828 7.9624 106.5838 46.2677 0.0000 173.4987 52 Q 4.4824 7.9291 116.2041 55.3849 28.7513 176.5133 53 L 4.7748 7.4535 120.1773 51.4057 42.1054 172.7801 54 P 4.3845 0.0000 0.0000 64.1591 31.7554 177.3604 55 G 3.9685 8.9813 110.9496 45.6683 0.0000 174.0081 56 V 3.9438 7.6246 119.5213 61.7516 30.0123 175.0894 57 R 4.4519 7.8826 125.6024 53.5663 31.9057 175.7044 58 K 3.9636 8.4068 122.3888 55.9926 32.3850 176.4527 59 A 4.3609 8.4755 129.8886 52.4936 19.0488 176.7216 60 S 4.4935 8.0858 117.0592 57.1705 67.1493 174.6741 61 W 4.1183 8.1757 121.2013 57.4106 27.2067 174.1529 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 8.12 4.28 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 3 R 7.39 3.78 0.00 1.98 1.89 0.00 3.22 0.00 0.00 3.31 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.76 0.00 4 K 8.41 3.76 0.00 1.91 1.81 0.00 1.68 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.60 7.81 5 A 8.05 4.08 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 6 L 7.49 4.07 0.00 2.27 1.73 0.94 1.07 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 7 I 7.65 3.82 1.89 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 1.42 0.89 1.00 0.00 0.00 8 E 7.85 4.19 0.00 2.14 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 2.27 2.34 0.00 9 K 7.97 4.04 0.00 1.99 1.98 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.48 7.81 10 A 7.83 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 7.29 4.31 0.00 1.68 1.78 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.32 1.47 7.81 12 R 7.73 4.01 0.00 1.84 1.91 0.00 3.44 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 13 T 7.80 3.39 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 1.20 0.00 0.00 14 P 0.00 4.36 0.00 2.09 2.01 0.00 3.74 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.95 0.00 15 K 7.14 4.18 0.00 1.37 0.74 0.00 1.12 0.00 0.00 1.36 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.21 1.11 7.81 16 F 7.17 4.58 0.00 3.09 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.64 4.27 0.00 1.98 2.11 0.00 1.52 0.00 0.00 1.78 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.47 7.81 18 V 7.68 3.96 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 0.86 0.00 0.00 0.97 0.00 0.00 19 R 7.90 4.77 0.00 1.84 1.98 0.00 3.28 0.00 0.00 3.29 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 20 A 7.56 4.20 1.25 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 21 Y 7.92 4.35 0.00 3.11 3.04 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 0.00 0.00 0.00 22 T 8.52 3.92 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 1.26 0.00 0.00 23 R 8.26 4.62 0.00 1.59 1.71 0.00 3.37 0.00 0.00 3.47 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.64 0.00 24 C 8.42 4.29 0.00 3.09 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 25 V 8.17 3.87 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 0.84 0.00 0.00 0.94 0.00 0.00 26 R 8.57 3.91 0.00 1.90 1.54 0.00 3.34 0.00 0.00 3.39 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.62 0.00 27 C 9.56 4.37 0.00 3.09 3.02 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 28 G 7.26 4.35 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 0.00 0.00 0.00 29 R 7.83 4.63 0.00 1.86 1.80 0.00 3.19 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.61 0.00 30 A 8.60 4.27 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 31 R 7.49 4.62 0.00 1.87 1.89 0.00 3.18 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 1.47 1.59 0.00 32 S 8.27 3.50 0.00 4.07 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 33 V 7.65 4.24 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 0.92 0.00 0.00 1.06 0.00 0.00 34 Y 8.53 4.30 0.00 3.48 3.08 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 35 R 8.86 4.03 0.00 1.93 2.07 0.00 3.26 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 36 F 8.24 4.27 0.00 3.00 3.17 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 0.00 0.00 0.00 37 F 8.58 3.75 0.00 3.23 3.08 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 38 G 8.47 4.20 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 0.00 39 L 7.43 5.07 0.00 1.78 1.57 0.99 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.65 5.63 0.00 3.16 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 41 R 8.52 4.26 0.00 2.20 2.50 0.00 3.00 0.00 0.00 3.36 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.77 0.00 42 I 7.79 3.84 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.95 0.00 0.00 43 C 7.99 4.64 0.00 3.14 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 44 L 7.55 3.67 0.00 1.80 1.83 0.06 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.46 3.77 0.00 1.96 1.91 0.00 3.28 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.59 0.00 46 E 7.94 3.98 0.00 2.17 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 2.34 2.58 0.00 47 L 7.87 3.98 0.00 1.77 1.69 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 48 A 8.01 3.88 1.23 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 49 H 8.21 4.07 0.00 3.11 3.37 0.00 5.67 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.59 4.19 0.00 1.87 1.89 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.62 1.61 7.81 51 G 7.96 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 0.00 0.00 0.00 52 Q 7.93 4.48 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.11 6.94 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 53 L 7.45 4.77 0.00 1.72 1.80 0.65 1.10 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 54 P 0.00 4.38 0.00 2.08 2.06 0.00 3.84 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 55 G 8.98 3.97 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 0.00 0.00 0.00 56 V 7.62 3.94 2.34 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 0.78 0.00 0.00 1.39 0.00 0.00 57 R 7.88 4.45 0.00 1.83 1.83 0.00 3.32 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 58 K 8.41 3.96 0.00 1.75 1.73 0.00 1.83 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.38 7.81 59 A 8.48 4.36 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 60 S 8.09 4.49 0.00 3.89 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 61 W 8.18 4.12 0.00 3.31 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