NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 87 K 4.1422 8.3144 121.7894 56.8655 33.8436 174.2481 88 L 4.1509 8.4583 124.1407 55.5413 40.0833 173.6307 89 C 4.6329 8.9601 118.2887 58.3202 41.6545 174.9859 90 S 4.6811 7.7686 113.1353 57.8657 63.2729 174.7482 91 L 4.1287 8.0338 124.4305 58.0232 42.4011 177.3276 92 D 4.3923 7.9473 114.2969 53.4840 42.2761 175.6298 93 N 4.8452 8.1335 112.5414 54.0933 37.4215 173.9058 94 G 3.9843 8.3773 102.0210 46.2576 0.0000 173.6807 95 D 4.3487 7.9540 115.0098 54.7904 40.4056 173.4765 96 C 4.6804 7.5951 114.5451 56.4329 36.5296 172.1041 97 D 4.7875 8.5824 117.3946 55.9389 43.3167 175.1980 98 Q 4.4259 7.0408 118.9396 54.3458 32.1579 176.9686 99 F 4.4481 7.8122 125.8329 59.2561 40.1506 174.2186 100 C 5.2379 8.8333 120.4413 55.5041 45.0063 172.4909 101 H 5.1365 9.6462 121.9019 54.1299 33.4602 172.0998 102 E 4.8303 8.6856 118.7630 54.4626 31.1229 177.1749 103 E 4.3071 8.8759 130.5443 55.6777 29.7571 177.7658 104 Q 3.2505 8.5090 122.4836 56.4667 27.8292 175.0890 105 N 3.5897 8.4354 115.8061 56.0691 38.8432 177.6965 106 S 5.0219 7.6857 113.9723 55.1898 65.9702 172.8840 107 V 4.4922 8.1400 119.3322 61.3193 32.6623 175.7549 108 V 4.3808 9.3619 124.4272 61.5236 33.8308 174.1685 109 C 5.1755 8.7410 125.3480 56.3759 42.2461 172.4007 110 S 4.6238 7.7890 112.8608 58.4619 65.8501 173.1436 111 C 4.6910 8.5959 116.1478 54.7631 41.0335 174.1358 112 A 4.6530 8.4641 123.1449 51.4089 18.7397 177.2844 113 R 3.9794 8.6099 117.6722 58.5968 30.3917 177.2177 114 G 3.9961 9.5915 110.6901 45.0081 0.0000 171.6355 115 Y 5.2242 7.8156 116.4150 56.0520 41.2829 175.0846 116 T 4.7173 9.4080 113.9351 59.4867 71.8937 173.1172 117 L 4.3592 8.5665 126.6452 54.8004 43.0811 176.3431 118 A 4.1709 8.6988 128.3896 52.1456 19.1713 178.0337 119 D 4.3256 8.7039 118.1953 57.5313 40.8921 177.8050 120 N 4.4694 8.1681 113.5892 52.9114 37.6041 175.4297 121 G 3.9186 7.9441 106.4331 46.2714 0.0000 174.0791 122 K 4.2920 7.9721 115.3155 55.9289 35.4063 176.5113 123 A 4.9052 7.9411 120.3021 52.4122 20.2282 177.1207 124 C 5.3444 10.3529 116.9850 55.1904 41.3642 173.7250 125 I 4.7951 8.7323 123.5386 58.8179 39.8352 172.9227 126 P 4.5879 0.0000 0.0000 62.4300 31.5337 176.4850 127 T 4.0012 8.4732 115.0958 63.3739 69.6949 174.3884 128 G 4.1299 7.6679 109.5564 42.6038 0.0000 170.7097 129 P 4.1919 0.0000 0.0000 64.1921 32.0131 176.1294 130 Y 4.7759 7.2527 115.9207 55.4032 37.6213 172.8470 131 P 4.4543 0.0000 0.0000 61.6697 32.9617 176.8746 132 C 4.1966 8.4705 115.7006 59.7287 30.0282 174.2873 133 G 4.0045 8.9956 109.5200 45.4117 0.0000 173.1915 134 K 4.6298 7.3656 118.3757 54.2110 33.9735 176.3304 135 Q 4.1002 8.6220 123.1449 56.0111 29.2771 175.8827 136 T 4.4289 8.4844 113.1511 60.5601 69.4917 174.7054 137 L 4.3244 8.5077 125.9506 55.5833 40.6865 176.1855 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 87 K 8.31 4.14 0.00 1.92 1.78 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.49 7.81 88 L 8.46 4.15 0.00 1.92 1.87 0.92 0.60 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 89 C 8.96 4.63 0.00 2.98 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 90 S 7.77 4.68 0.00 3.95 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 91 L 8.03 4.13 0.00 1.70 1.79 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 92 D 7.95 4.39 0.00 2.68 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 93 N 8.13 4.85 0.00 3.01 2.86 0.00 0.00 7.62 8.01 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 94 G 8.38 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.95 4.35 0.00 2.81 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 96 C 7.60 4.68 0.00 3.04 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 97 D 8.58 4.79 0.00 2.78 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 7.04 4.43 0.00 1.36 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.82 0.00 0.00 0.00 0.00 0.00 1.85 1.97 0.00 99 F 7.81 4.45 0.00 2.97 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 0.00 100 C 8.83 5.24 0.00 3.01 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 0.00 101 H 9.65 5.14 0.00 3.23 3.16 0.00 5.81 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 E 8.69 4.83 0.00 1.81 1.87 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 2.20 2.27 0.00 103 E 8.88 4.31 0.00 1.93 2.02 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 2.29 2.28 0.00 104 Q 8.51 3.25 0.00 2.21 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.67 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 105 N 8.44 3.59 0.00 2.83 2.82 0.00 0.00 5.66 7.64 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 0.00 106 S 7.69 5.02 0.00 3.84 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 0.00 107 V 8.14 4.49 2.09 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 0.73 0.00 0.00 0.95 0.00 0.00 108 V 9.36 4.38 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 1.01 0.00 0.00 0.95 0.00 0.00 109 C 8.74 5.18 0.00 3.05 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 S 7.79 4.62 0.00 3.97 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 0.00 111 C 8.60 4.69 0.00 2.82 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 0.00 112 A 8.46 4.65 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 0.00 113 R 8.61 3.98 0.00 1.89 2.03 0.00 3.28 0.00 0.00 3.31 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 114 G 9.59 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 0.00 115 Y 7.82 5.22 0.00 2.95 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 0.00 116 T 9.41 4.72 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 1.22 0.00 0.00 117 L 8.57 4.36 0.00 1.68 1.64 1.01 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 118 A 8.70 4.17 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.70 4.33 0.00 2.68 2.75 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 0.00 120 N 8.17 4.47 0.00 2.81 2.93 0.00 0.00 6.02 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 0.00 121 G 7.94 3.92 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 0.00 122 K 7.97 4.29 0.00 1.82 1.76 0.00 1.74 0.00 0.00 1.97 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.53 7.81 123 A 7.94 4.91 1.24 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 0.00 0.00 124 C 10.35 5.34 0.00 2.70 3.01 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 0.00 125 I 8.73 4.80 1.99 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 1.31 1.27 0.90 0.00 0.00 126 P 0.00 4.59 0.00 1.76 1.50 0.00 3.74 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.87 0.00 127 T 8.47 4.00 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 1.19 0.00 0.00 128 G 7.67 4.13 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 0.00 0.00 0.00 129 P 0.00 4.19 0.00 1.66 1.97 0.00 3.64 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.89 0.00 130 Y 7.25 4.78 0.00 2.99 2.92 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 0.00 131 P 0.00 4.45 0.00 1.90 1.79 0.00 3.73 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 2.06 1.80 0.00 132 C 8.47 4.20 0.00 3.19 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 0.00 133 G 9.00 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 0.00 134 K 7.37 4.63 0.00 1.98 1.79 0.00 1.69 0.00 0.00 1.92 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.47 7.81 135 Q 8.62 4.10 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 136 T 8.48 4.43 4.49 0.00 0.00 0.00 0.00 0.00 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 0.00 137 L 8.51 4.32 0.00 1.75 1.68 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00