NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3833 8.2644 123.5851 52.2588 20.2892 177.3996 3 R 4.2302 8.0313 119.5940 58.3353 32.9930 175.2739 4 K 3.8553 8.5135 120.2549 59.2112 33.4379 177.4716 5 A 4.5405 7.8738 118.1605 52.2846 18.0497 177.3918 6 L 4.7681 7.9489 118.8421 55.8256 44.0831 177.5455 7 I 4.2449 7.3414 109.8904 61.9288 37.9035 176.7591 8 E 4.0386 7.8043 122.1580 59.3276 29.8987 178.4716 9 K 3.9695 8.0015 116.5632 58.0013 32.3000 178.3973 10 A 3.7636 7.6607 121.1307 52.9584 19.1422 177.8222 11 K 4.4817 8.1405 114.4329 55.9315 33.1225 176.0731 12 R 4.1455 7.7253 117.5330 57.9428 32.0909 177.9577 13 T 3.5714 7.1341 108.4667 62.4057 67.9030 170.3667 14 P 4.7121 0.0000 0.0000 62.9154 30.5492 180.6595 15 K 3.8935 8.6685 117.0060 56.1595 30.4968 171.6371 16 F 3.8645 7.8815 129.5175 57.2340 38.5927 175.5874 17 K 4.3047 8.4894 120.4633 58.4897 33.3044 179.1122 18 V 3.8426 7.7989 111.9066 63.4196 31.9033 177.1608 19 R 4.1695 8.1291 116.3577 57.1682 30.2379 176.0229 20 A 4.2302 7.4875 122.3491 51.2277 19.0691 176.2536 21 Y 4.9682 7.4993 120.4171 54.8437 41.4706 175.8085 22 T 4.2699 8.3570 109.7238 63.6272 70.6093 173.2746 23 R 4.5195 7.8409 121.1367 57.0377 32.3610 174.8614 24 C 4.7053 8.3986 120.6598 55.9772 44.4791 173.0147 25 V 4.1318 8.1783 121.5099 63.9593 33.1708 176.5711 26 R 4.3108 7.9980 117.3705 57.5506 31.0682 174.9186 27 C 4.5960 7.8102 113.7832 55.2686 42.9587 174.3575 28 G 3.7978 8.1686 104.3031 45.5112 0.0000 172.1602 29 R 3.5112 6.9270 118.9066 55.2625 30.3075 175.6499 30 A 4.9579 8.5569 128.3621 51.6676 19.5370 175.8667 31 R 4.5984 7.7841 116.0501 56.8579 34.7769 175.5553 32 S 3.6270 8.2424 110.0587 59.4946 61.3692 170.3690 33 V 5.2208 7.3770 121.4585 61.0860 33.0182 174.7477 34 Y 4.3574 9.1049 126.6128 57.3886 37.5429 176.3498 35 R 4.1048 9.0068 122.7544 59.3562 28.6372 177.2447 36 F 3.6699 7.9347 117.5873 62.0281 39.7026 176.0491 37 F 4.5099 8.4577 121.4212 59.0484 39.3249 176.9408 38 G 4.0040 9.8479 108.0876 45.5115 0.0000 172.1824 39 L 4.9099 7.6920 118.8092 52.6673 45.7963 175.1650 40 C 5.6540 8.4244 113.3461 56.1915 31.5154 174.6301 41 R 3.6470 8.5863 117.4916 59.6914 28.4161 178.9461 42 I 3.6779 7.5881 119.7862 64.3324 37.3157 177.6608 43 C 4.5890 7.8818 118.1144 62.4415 28.2193 175.6326 44 L 3.6111 7.9329 121.8589 58.2508 41.1676 179.1444 45 R 3.7386 7.4259 117.2839 59.9002 30.2835 177.7912 46 E 4.0132 8.6488 118.7867 58.9974 29.3870 179.0491 47 L 3.8781 8.3796 118.4233 58.2755 41.8670 179.3384 48 A 3.8153 7.5808 119.5364 56.1022 17.9891 179.2887 49 H 4.0352 7.6439 113.2022 58.8799 29.1230 177.4099 50 K 4.3187 8.2334 117.9319 55.8890 31.8200 178.1323 51 G 3.9663 8.2790 107.3343 46.4819 0.0000 175.1316 52 Q 4.3982 7.9550 116.4741 55.9212 28.1504 175.8691 53 L 4.7280 7.8660 118.1659 52.1593 44.7894 174.9496 54 P 4.2803 0.0000 0.0000 63.7032 31.7812 178.3409 55 G 4.0810 8.9306 110.2872 45.9777 0.0000 174.1159 56 V 3.7728 7.4205 119.5920 62.8613 31.9747 174.9435 57 R 4.5330 7.9450 124.9346 54.8893 32.8140 174.1951 58 K 4.0135 8.4977 121.1630 56.5056 32.7370 178.4855 59 A 4.4555 8.4493 130.5885 51.6595 17.3175 178.0812 60 S 4.3526 7.9566 118.2906 58.3071 63.8889 175.3951 61 W 4.1948 8.4736 121.7987 57.3155 27.1993 174.1636 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 8.26 4.38 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 3 R 8.03 4.23 0.00 1.89 1.86 0.00 3.19 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 4 K 8.51 3.86 0.00 1.88 1.78 0.00 1.66 0.00 0.00 1.83 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.50 7.81 5 A 7.87 4.54 1.29 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 0.00 0.00 6 L 7.95 4.77 0.00 1.69 1.64 1.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 7 I 7.34 4.24 1.90 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 1.50 0.73 1.06 0.00 0.00 8 E 7.80 4.04 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 2.31 0.00 9 K 8.00 3.97 0.00 1.87 1.79 0.00 1.79 0.00 0.00 1.88 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.46 7.81 10 A 7.66 3.76 1.26 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 0.00 0.00 0.00 11 K 8.14 4.48 0.00 1.61 1.72 0.00 1.63 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.35 7.81 12 R 7.73 4.15 0.00 1.76 1.91 0.00 3.28 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 13 T 7.13 3.57 4.17 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 1.13 0.00 0.00 14 P 0.00 4.71 0.00 2.13 1.37 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 1.93 1.90 0.00 15 K 8.67 3.89 0.00 1.61 1.92 0.00 1.58 0.00 0.00 1.29 0.00 0.00 2.66 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.27 0.58 7.81 16 F 7.88 3.86 0.00 3.26 2.95 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 17 K 8.49 4.30 0.00 1.96 2.10 0.00 1.52 0.00 0.00 1.84 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.50 7.81 18 V 7.80 3.84 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 0.75 0.00 0.00 0.93 0.00 0.00 19 R 8.13 4.17 0.00 2.12 2.13 0.00 3.55 0.00 0.00 3.40 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.79 0.00 20 A 7.49 4.23 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 21 Y 7.50 4.97 0.00 3.06 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 22 T 8.36 4.27 4.34 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 1.28 0.00 0.00 23 R 7.84 4.52 0.00 1.91 1.91 0.00 3.55 0.00 0.00 3.41 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.52 0.00 24 C 8.40 4.71 0.00 3.24 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 25 V 8.18 4.13 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 0.89 0.00 0.00 0.96 0.00 0.00 26 R 8.00 4.31 0.00 1.82 1.93 0.00 3.26 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 27 C 7.81 4.60 0.00 3.07 2.89 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 28 G 8.17 3.80 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 0.00 0.00 0.00 29 R 6.93 3.51 0.00 1.95 1.82 0.00 3.22 0.00 0.00 3.36 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 30 A 8.56 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 31 R 7.78 4.60 0.00 1.77 1.81 0.00 3.33 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 32 S 8.24 3.63 0.00 4.27 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 33 V 7.38 5.22 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 1.24 0.00 0.00 1.06 0.00 0.00 34 Y 9.10 4.36 0.00 3.24 3.12 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 35 R 9.01 4.10 0.00 1.95 2.16 0.00 3.10 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 36 F 7.93 3.67 0.00 2.99 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 37 F 8.46 4.51 0.00 3.26 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 38 G 9.85 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.69 4.91 0.00 1.66 1.55 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.42 5.65 0.00 3.13 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 41 R 8.59 3.65 0.00 2.02 2.30 0.00 2.97 0.00 0.00 3.38 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 42 I 7.59 3.68 1.86 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 1.64 0.78 0.90 0.00 0.00 43 C 7.88 4.59 0.00 2.93 2.95 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 44 L 7.93 3.61 0.00 1.43 1.70 0.27 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.43 3.74 0.00 2.00 2.10 0.00 3.32 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 46 E 8.65 4.01 0.00 2.14 1.91 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 2.32 2.35 0.00 47 L 8.38 3.88 0.00 1.54 1.68 0.88 0.88 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 7.58 3.82 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 49 H 7.64 4.04 0.00 3.17 3.38 0.00 5.66 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.23 4.32 0.00 2.01 1.82 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.59 7.81 51 G 8.28 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 52 Q 7.95 4.40 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.62 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 53 L 7.87 4.73 0.00 1.53 1.57 0.43 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.28 0.00 2.28 2.03 0.00 3.84 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.14 0.00 55 G 8.93 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 56 V 7.42 3.77 2.21 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 0.67 0.00 0.00 1.13 0.00 0.00 57 R 7.94 4.53 0.00 1.78 1.75 0.00 3.30 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 58 K 8.50 4.01 0.00 1.80 1.79 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.40 7.81 59 A 8.45 4.46 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.96 4.35 0.00 3.95 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 61 W 8.47 4.19 0.00 3.30 3.12 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