NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.1333 7.9133 120.6524 62.8550 33.2140 174.1110 3 E 5.2678 8.5997 126.1675 54.4763 33.7224 172.8650 4 A 5.0214 9.0842 121.9805 51.2209 23.9616 174.6290 5 I 4.8025 8.6441 119.4247 58.8628 41.4998 174.8670 6 V 3.8555 8.7573 129.8671 63.3708 31.6917 175.7824 7 E 4.0532 9.1918 129.7969 57.2988 30.5802 176.1707 8 F 5.0732 7.8006 115.5227 55.3032 42.5319 175.1097 9 D 4.9526 8.9983 121.8430 55.1015 41.7425 175.2441 10 Y 4.8769 8.9239 121.7718 56.5891 42.7802 172.9889 11 Q 4.4408 7.7785 127.5319 53.8962 30.4546 174.9046 12 A 4.4268 8.2517 128.5369 52.9124 18.8867 177.2069 13 Q 4.4438 10.7000 115.2373 55.4378 31.1698 175.5451 14 H 4.9766 7.8409 114.2604 53.7105 32.6947 173.9598 15 D 4.4550 8.8681 121.8353 56.5175 40.8796 176.9401 16 D 4.8260 8.0575 117.9848 52.9407 39.8487 175.2163 17 E 5.2850 8.1681 119.1624 55.1723 31.9141 174.9466 18 L 4.6959 8.8195 124.9188 53.8737 43.6211 176.0446 19 T 4.6176 8.7316 123.9680 63.2439 68.9605 174.0647 20 I 4.6533 8.4100 120.6213 59.2687 40.8744 174.8616 21 S 5.2851 8.4364 117.9246 56.3731 67.3463 173.4039 22 V 3.6666 9.3356 123.3625 65.4507 30.9507 174.6528 23 G 4.1945 9.2354 117.4047 45.9649 0.0000 174.1091 24 E 4.1347 7.9594 118.1831 56.6284 30.7448 176.4100 25 I 4.7593 8.1930 122.9324 60.1113 39.0632 175.0042 26 I 4.6575 9.3755 128.5737 59.7965 39.5495 174.9877 27 T 4.9284 8.8197 116.4795 59.3248 72.4034 173.1311 28 N 4.3385 8.6280 114.7342 54.2690 36.1577 174.2368 29 I 4.6344 7.6260 118.3637 61.2693 38.1492 175.9489 30 R 4.3511 9.2292 128.6496 54.3615 31.8413 176.3189 31 K 3.6984 8.1186 127.0300 56.1569 33.3997 174.7606 32 E 5.4200 8.4938 122.3131 55.7601 29.8281 176.6822 33 D 4.5898 8.1458 123.4273 54.8298 41.5104 176.0731 34 G 4.0458 9.3865 107.7087 45.4745 0.0000 175.2337 35 G 3.7655 8.9897 107.9502 44.3317 0.0000 172.5759 36 W 4.9755 7.7119 118.4447 54.4501 32.2849 174.7667 37 W 5.0385 8.6776 123.5622 54.7955 32.6896 173.8703 38 E 5.7513 7.7377 122.0212 54.1174 32.0304 175.1646 39 G 4.4121 8.2675 111.4535 46.0889 0.0000 171.2227 40 Q 5.1824 9.3047 120.6954 54.3105 32.5445 174.5107 41 I 4.2743 8.2385 125.7035 60.2256 38.2840 175.7626 42 N 4.0905 9.3081 121.0893 54.7308 40.2181 177.4790 43 G 3.5084 8.2338 108.6299 47.2479 0.0000 175.2131 44 R 4.3543 8.9974 122.7915 55.8108 32.8128 174.3885 45 R 5.0345 9.4189 121.1880 53.6634 33.6091 174.4888 46 G 4.2140 7.9519 108.6675 46.1117 0.0000 170.8914 47 L 5.4699 8.4027 120.9876 54.0139 42.9107 176.6740 48 F 5.5678 9.3360 119.1032 53.9721 42.1087 172.6984 49 P 3.3204 0.0000 0.0000 61.6485 31.5456 176.8259 50 D 3.4025 7.6297 124.3770 55.7777 38.9831 178.0760 51 N 4.5017 7.6790 114.5412 54.1608 37.5028 175.1243 52 F 4.8687 8.3284 117.7187 57.9684 39.6765 175.2331 53 V 5.0202 7.7169 113.1080 59.6484 35.8846 174.8945 54 R 4.7471 8.7865 120.9456 54.3430 33.0340 175.0984 55 E 4.7412 8.8763 124.3746 56.0896 30.4248 176.3997 56 I 4.1742 8.4145 127.6205 61.0343 38.2515 175.2156 57 K 4.4379 8.4640 124.3292 55.5005 34.1078 176.3747 58 K 4.2009 8.5773 122.0687 57.0980 32.0801 175.4749 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 V 7.91 4.13 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 0.86 0.00 0.00 0.82 0.00 0.00 3 E 8.60 5.27 0.00 2.06 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.46 0.00 4 A 9.08 5.02 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 5 I 8.64 4.80 1.86 0.00 0.00 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 1.08 2.03 0.90 0.00 0.00 6 V 8.76 3.86 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 0.90 0.00 0.00 0.92 0.00 0.00 7 E 9.19 4.05 0.00 1.75 1.68 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 1.47 1.74 0.00 8 F 7.80 5.07 0.00 2.73 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 9 D 9.00 4.95 0.00 2.70 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.92 4.88 0.00 2.91 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 11 Q 7.78 4.44 0.00 1.93 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.71 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 12 A 8.25 4.43 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 13 Q 10.70 4.44 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.62 0.00 0.00 0.00 0.00 0.00 2.20 2.39 0.00 14 H 7.84 4.98 0.00 3.14 3.09 0.00 5.63 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 D 8.87 4.45 0.00 2.67 2.74 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 16 D 8.06 4.83 0.00 2.84 2.85 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 17 E 8.17 5.28 0.00 2.06 2.27 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 2.20 2.36 0.00 18 L 8.82 4.70 0.00 1.72 1.84 0.94 1.00 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 19 T 8.73 4.62 4.27 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 1.28 0.00 0.00 20 I 8.41 4.65 1.87 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.97 0.87 0.00 0.00 21 S 8.44 5.29 0.00 3.92 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 22 V 9.34 3.67 2.07 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 0.64 0.00 0.00 1.06 0.00 0.00 23 G 9.24 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 0.00 0.00 0.00 0.00 24 E 7.96 4.13 0.00 1.90 1.86 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 2.32 2.29 0.00 25 I 8.19 4.76 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 1.33 0.79 0.95 0.00 0.00 26 I 9.38 4.66 1.73 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.57 0.72 0.00 0.00 27 T 8.82 4.93 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 28 N 8.63 4.34 0.00 2.98 2.93 0.00 0.00 6.84 7.32 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 29 I 7.63 4.63 2.01 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.75 0.82 0.00 0.00 30 R 9.23 4.35 0.00 1.80 1.77 0.00 3.08 0.00 0.00 3.16 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.51 0.00 31 K 8.12 3.70 0.00 1.40 1.39 0.00 1.66 0.00 0.00 1.54 0.00 0.00 2.73 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.41 0.80 7.81 32 E 8.49 5.42 0.00 2.22 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 0.00 2.33 2.16 0.00 33 D 8.15 4.59 0.00 2.74 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.39 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.99 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 36 W 7.71 4.98 0.00 3.09 3.05 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 0.00 0.00 0.00 0.00 37 W 8.68 5.04 0.00 1.93 2.68 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 38 E 7.74 5.75 0.00 2.11 1.84 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 2.31 2.25 0.00 39 G 8.27 4.41 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 0.00 40 Q 9.30 5.18 0.00 2.10 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.70 0.00 0.00 0.00 0.00 0.00 2.25 2.51 0.00 41 I 8.24 4.27 1.85 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.69 0.96 0.00 0.00 42 N 9.31 4.09 0.00 2.79 2.79 0.00 0.00 7.14 7.65 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 43 G 8.23 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 0.00 0.00 0.00 44 R 9.00 4.35 0.00 1.94 1.85 0.00 3.16 0.00 0.00 3.32 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.66 0.00 45 R 9.42 5.03 0.00 2.02 1.81 0.00 3.50 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 46 G 7.95 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 0.00 0.00 0.00 0.00 47 L 8.40 5.47 0.00 1.70 1.83 0.86 1.35 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 48 F 9.34 5.57 0.00 3.09 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 49 P 0.00 3.32 0.00 0.89 0.49 0.00 3.36 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.44 0.00 50 D 7.63 3.40 0.00 1.58 1.54 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.68 4.50 0.00 2.76 2.86 0.00 0.00 5.97 7.43 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 52 F 8.33 4.87 0.00 3.19 3.45 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 53 V 7.72 5.02 2.25 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 0.73 0.00 0.00 1.18 0.00 0.00 54 R 8.79 4.75 0.00 1.69 1.82 0.00 3.29 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.65 0.00 55 E 8.88 4.74 0.00 2.29 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 2.36 2.58 0.00 56 I 8.41 4.17 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 1.30 0.94 0.92 0.00 0.00 57 K 8.46 4.44 0.00 1.71 1.69 0.00 1.94 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.44 7.81 58 K 8.58 4.20 0.00 1.95 1.77 0.00 1.85 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.36 7.81