NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 86 E 4.1849 8.4449 120.1951 55.9546 30.9307 175.4701 87 F 4.3268 8.2832 121.3178 56.9702 39.9190 173.3862 88 Q 4.7988 9.9191 123.1712 53.4873 32.5546 175.1198 89 I 3.9612 8.0913 119.7362 63.3946 37.3847 176.5687 90 N 4.4004 9.3390 120.6140 53.4347 37.0235 173.9601 91 E 4.4697 7.7702 119.7222 55.5491 31.3588 175.0730 92 Q 4.9121 8.5546 123.9043 55.1094 30.5828 175.1192 93 V 4.3577 8.3638 115.0832 59.6293 37.1216 174.0015 94 L 4.9713 8.7320 121.7830 53.6392 43.1718 176.1062 95 A 5.2820 8.9538 125.3410 50.1123 22.4670 174.4613 96 C 4.4350 8.7643 121.0622 58.5836 32.6995 172.7954 97 W 4.8885 8.6884 135.0000 55.2552 32.7660 176.4133 98 S 3.6827 6.1217 115.1642 60.7056 61.9652 175.1389 99 D 4.4503 7.6282 117.6889 52.8103 39.5824 175.4440 100 C 3.6133 8.0381 118.9475 61.0817 30.3416 172.4612 101 R 4.6878 7.8768 114.7768 53.9731 34.0824 174.8517 102 F 5.1283 8.4978 119.1107 56.7177 40.7142 174.9606 103 Y 4.9855 8.8999 118.7933 55.5551 42.7776 172.8273 104 P 4.5010 0.0000 0.0000 62.4641 32.0444 175.8898 105 A 4.4300 8.6283 125.2039 49.7920 23.0012 174.7235 106 K 4.4420 8.6397 123.0892 55.3344 34.0401 176.1113 107 V 4.1670 9.0192 128.6611 63.4749 31.7322 176.1147 108 T 4.5633 8.9470 118.4667 62.2156 70.4865 174.6717 109 A 4.6871 7.8040 122.8322 50.6885 22.8650 174.9609 110 V 4.6601 8.5260 121.5476 61.4673 33.2104 174.6179 111 N 5.0311 8.6726 125.4566 51.3813 40.4876 176.7222 112 K 4.0159 8.7557 121.4712 59.2417 32.3734 177.7597 113 D 4.4746 7.9933 116.0996 53.5819 39.5911 176.8643 114 G 3.7359 8.3886 108.6823 45.8406 0.0000 173.1181 115 T 4.8499 7.6380 109.3513 59.9252 71.9437 172.8201 116 Y 5.4078 9.0633 119.3915 56.5956 41.9259 174.9607 117 T 4.8728 8.8427 119.5893 62.9140 70.3309 174.4778 118 V 4.8923 8.8987 118.8210 59.3399 36.5484 174.4527 119 K 4.8856 8.4149 123.2008 54.6322 35.1611 176.3975 120 F 4.6986 8.9233 126.6885 56.8361 39.8307 176.0555 121 Y 4.3080 8.2679 119.2519 61.3498 37.5700 177.4621 122 D 4.4732 8.0271 116.3671 53.6828 39.7819 177.0254 123 G 3.9143 8.2332 108.9828 45.0450 0.0000 173.8067 124 V 3.8474 8.0244 121.3681 62.8365 32.3814 174.9581 125 V 4.8289 8.4375 127.7409 61.6849 33.5077 174.4856 126 Q 4.7251 8.8494 126.3455 55.2142 32.9817 172.9712 127 T 5.1332 8.5280 121.7187 62.2850 70.4192 174.4340 128 V 4.6808 8.8642 118.3729 59.5057 36.6602 175.1714 129 K 4.3517 8.7094 122.7663 56.2528 32.7702 177.6399 130 H 4.3311 8.8084 122.6997 59.5210 29.7793 177.2168 131 I 3.9159 7.7054 110.1476 62.7799 37.6894 175.8472 132 H 5.0411 8.3404 117.6428 55.6735 29.0502 174.3178 133 V 4.9310 7.5289 112.4741 59.5750 34.6104 174.9808 134 K 4.8538 8.5325 120.6959 53.9553 36.2575 175.5911 135 A 4.3503 8.7878 123.5269 52.5512 19.0326 176.6545 136 F 4.9369 8.8679 126.8346 57.1945 40.9860 176.4331 137 S 4.0405 8.0929 121.4870 58.1131 63.1935 170.1086 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 86 E 8.44 4.18 0.00 1.94 2.05 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 2.15 2.21 0.00 87 F 8.28 4.33 0.00 2.63 2.80 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 88 Q 9.92 4.80 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.94 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 89 I 8.09 3.96 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.51 0.92 0.00 0.00 90 N 9.34 4.40 0.00 2.86 3.01 0.00 0.00 6.91 8.20 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 91 E 7.77 4.47 0.00 2.22 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 2.34 2.35 0.00 92 Q 8.55 4.91 0.00 2.16 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 93 V 8.36 4.36 1.64 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 -0.36 0.00 0.00 0.60 0.00 0.00 94 L 8.73 4.97 0.00 1.47 1.66 0.93 0.62 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 95 A 8.95 5.28 1.14 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 0.00 0.00 96 C 8.76 4.44 0.00 2.47 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.69 4.89 0.00 3.17 3.34 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 98 S 6.12 3.68 0.00 2.72 3.31 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 99 D 7.63 4.45 0.00 2.85 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 0.00 100 C 8.04 3.61 0.00 3.03 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 0.00 101 R 7.88 4.69 0.00 1.89 1.34 0.00 3.42 0.00 0.00 3.16 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 102 F 8.50 5.13 0.00 2.80 2.86 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 0.00 103 Y 8.90 4.99 0.00 2.96 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 P 0.00 4.50 0.00 0.96 0.62 0.00 3.57 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.34 0.00 105 A 8.63 4.43 0.47 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 0.00 106 K 8.64 4.44 0.00 1.75 1.59 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.34 7.81 107 V 9.02 4.17 2.14 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 0.89 0.00 0.00 0.57 0.00 0.00 108 T 8.95 4.56 4.24 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 1.24 0.00 0.00 109 A 7.80 4.69 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 0.00 110 V 8.53 4.66 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 0.95 0.00 0.00 1.18 0.00 0.00 111 N 8.67 5.03 0.00 2.86 2.67 0.00 0.00 6.58 6.31 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 0.00 112 K 8.76 4.02 0.00 1.73 1.86 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.42 7.81 113 D 7.99 4.47 0.00 2.76 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 0.00 114 G 8.39 3.74 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 0.00 0.00 0.00 115 T 7.64 4.85 4.31 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 1.21 0.00 0.00 116 Y 9.06 5.41 0.00 2.88 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 0.00 117 T 8.84 4.87 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 1.22 0.00 0.00 118 V 8.90 4.89 1.76 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 0.69 0.00 0.00 0.66 0.00 0.00 119 K 8.41 4.89 0.00 1.72 1.52 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.29 1.37 7.81 120 F 8.92 4.70 0.00 3.10 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.27 4.31 0.00 2.91 2.86 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 0.00 122 D 8.03 4.47 0.00 2.69 2.65 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 0.00 0.00 0.00 0.00 123 G 8.23 3.91 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 0.00 0.00 0.00 124 V 8.02 3.85 2.24 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 1.19 0.00 0.00 1.00 0.00 0.00 125 V 8.44 4.83 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 1.00 0.00 0.00 126 Q 8.85 4.73 0.00 2.34 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 127 T 8.53 5.13 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 1.23 0.00 0.00 128 V 8.86 4.68 2.20 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 0.85 0.00 0.00 1.13 0.00 0.00 129 K 8.71 4.35 0.00 1.71 1.65 0.00 1.60 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.45 7.81 130 H 8.81 4.33 0.00 3.06 3.28 0.00 5.78 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 7.71 3.92 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.42 0.92 0.00 0.00 132 H 8.34 5.04 0.00 3.35 3.41 0.00 5.62 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 V 7.53 4.93 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 0.82 0.00 0.00 1.11 0.00 0.00 134 K 8.53 4.85 0.00 1.46 1.55 0.00 0.85 0.00 0.00 0.61 0.00 0.00 2.38 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.17 1.21 7.81 135 A 8.79 4.35 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 F 8.87 4.94 0.00 2.74 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 0.00 137 S 8.09 4.04 0.00 3.61 3.54 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