NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 101 M 4.3284 8.2893 120.3491 55.4825 33.1160 174.8053 102 K 3.8925 7.7678 120.4382 57.6057 34.2231 173.0661 103 G 4.0911 8.2923 127.0700 45.9128 0.0000 171.3144 104 M 4.1521 7.0878 120.6599 57.2537 33.4808 176.6174 105 S 4.3890 7.2435 113.6010 59.1635 63.4894 175.2154 106 K 4.6059 7.3228 119.4964 56.9947 37.1788 177.2579 107 M 4.8492 8.0642 121.4179 53.9011 33.6256 175.5906 108 P 4.6107 0.0000 0.0000 61.3790 30.8981 175.3255 109 Q 4.3024 7.9027 126.2842 55.9802 30.3463 175.1254 110 F 4.7529 8.4408 125.5384 56.5645 41.3439 173.2019 111 N 4.4270 8.3516 126.0551 51.3890 38.4347 174.7727 112 L 4.1363 7.5540 121.7049 52.9431 43.9305 176.5845 113 R 4.3517 7.8304 117.5867 54.1899 31.2733 174.7498 114 W 5.1572 8.0776 121.1595 53.3741 32.7220 174.7784 115 P 4.4401 0.0000 0.0000 62.8193 32.6646 178.0350 116 R 4.0455 8.6838 118.0819 59.6060 29.3533 179.0950 117 E 3.9785 8.1624 118.9220 59.1205 29.5282 179.2016 118 V 3.5584 7.7360 117.9167 65.9735 31.6278 177.7631 119 L 4.3039 8.1455 120.1244 58.2938 41.9262 178.6145 120 D 4.4104 8.4949 118.9607 56.8369 40.6403 178.3091 121 L 4.0458 7.9158 120.7667 57.7169 42.1013 178.9386 122 V 3.7471 7.9823 118.5037 65.8946 31.5159 178.0145 123 R 3.9735 8.4227 118.2601 59.2678 29.9853 178.6060 124 K 3.9581 8.0955 119.0924 59.7895 32.2317 178.7363 125 V 3.7558 8.3117 119.4966 65.4338 31.3270 177.8936 126 A 3.8280 8.1065 120.2701 54.8776 18.0573 179.5952 127 E 3.8783 8.1120 117.2198 59.4499 29.5802 179.1112 128 E 3.9100 8.0751 118.5512 59.6860 29.4549 179.0405 129 N 4.5761 7.9589 113.5573 52.9644 40.0036 174.9780 130 G 3.8551 7.5935 108.2043 46.2807 0.0000 173.1119 131 M 4.8012 8.2169 115.8782 52.6652 36.3946 175.2758 132 S 4.3580 8.4758 120.5595 58.5335 64.9112 176.2585 133 V 3.9374 8.4473 118.7210 64.4444 31.4534 178.6421 134 N 4.3600 8.2067 115.9101 56.7275 38.5581 177.4450 135 S 4.3297 8.0661 115.2310 60.9346 63.0017 175.9937 136 Y 4.2934 7.8637 122.5547 61.0381 38.6355 177.8045 137 I 3.5341 7.6447 120.2781 63.9893 37.0222 177.7477 138 Y 3.9810 7.9594 120.4343 60.7222 38.4835 177.8163 139 Q 4.0144 8.2722 119.9515 58.3473 29.1851 177.6803 140 L 3.9589 7.5958 120.0973 57.3853 41.7176 179.4445 141 V 3.0783 7.7804 112.4460 63.8850 31.0971 178.1921 142 M 4.1013 7.0868 117.7589 57.6223 32.0382 178.1191 143 E 4.1002 8.1953 118.2960 58.7696 29.3514 178.9772 144 S 4.5566 7.7573 115.4774 60.1373 63.3279 173.9500 145 F 4.8268 7.8015 122.3257 57.9978 37.4697 175.3258 146 K 5.2151 8.0805 135.0000 57.7698 32.8218 175.7090 147 K 4.4878 7.4063 120.4428 53.3782 30.5559 175.6725 148 E 5.6007 8.2278 132.0634 55.9007 31.1087 175.9879 149 G 3.6968 7.8006 106.1380 45.8445 0.0000 171.6613 150 R 4.1772 6.9863 116.6722 57.3480 32.4377 177.9497 151 I 3.8697 8.2222 122.3995 64.1760 40.4324 176.9495 152 G 3.9904 8.0055 106.6168 45.2881 0.0000 173.2321 153 A 4.1428 8.8685 127.2440 52.3885 19.0746 177.0749 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 101 M 8.29 4.33 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.60 0.00 102 K 7.77 3.89 0.00 1.92 1.75 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.21 1.50 7.81 103 G 8.29 4.09 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 0.00 0.00 0.00 104 M 7.09 4.15 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 105 S 7.24 4.39 0.00 3.86 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 0.00 106 K 7.32 4.61 0.00 1.72 1.54 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.45 7.81 107 M 8.06 4.85 0.00 1.94 1.95 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 108 P 0.00 4.61 0.00 2.19 2.09 0.00 3.76 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.94 0.00 109 Q 7.90 4.30 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 110 F 8.44 4.75 0.00 2.84 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 0.00 111 N 8.35 4.43 0.00 2.64 2.65 0.00 0.00 6.11 7.71 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 0.00 112 L 7.55 4.14 0.00 0.60 0.66 0.81 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 113 R 7.83 4.35 0.00 1.73 1.82 0.00 3.11 0.00 0.00 3.19 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.48 0.00 114 W 8.08 5.16 0.00 3.28 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 0.00 115 P 0.00 4.44 0.00 2.19 2.01 0.00 3.69 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 116 R 8.68 4.05 0.00 2.06 2.23 0.00 2.98 0.00 0.00 3.35 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.76 0.00 117 E 8.16 3.98 0.00 2.05 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 2.41 2.38 0.00 118 V 7.74 3.56 2.22 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 0.65 0.00 0.00 0.87 0.00 0.00 119 L 8.15 4.30 0.00 2.12 1.94 1.06 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 120 D 8.49 4.41 0.00 2.80 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.92 4.05 0.00 1.91 1.79 0.93 0.72 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 0.00 122 V 7.98 3.75 2.47 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 1.25 0.00 0.00 1.07 0.00 0.00 123 R 8.42 3.97 0.00 2.13 2.01 0.00 3.39 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.82 0.00 124 K 8.10 3.96 0.00 1.83 2.00 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.60 1.46 7.81 125 V 8.31 3.76 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 0.81 0.00 0.00 1.01 0.00 0.00 126 A 8.11 3.83 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 127 E 8.11 3.88 0.00 2.23 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 2.32 2.53 0.00 128 E 8.08 3.91 0.00 2.10 1.96 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 2.31 2.58 0.00 129 N 7.96 4.58 0.00 2.56 2.78 0.00 0.00 7.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 G 7.59 3.86 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 0.00 0.00 0.00 131 M 8.22 4.80 0.00 1.79 1.83 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.57 0.00 132 S 8.48 4.36 0.00 3.93 3.79 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 0.00 133 V 8.45 3.94 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 1.30 0.00 0.00 0.98 0.00 0.00 134 N 8.21 4.36 0.00 2.74 2.88 0.00 0.00 7.21 7.20 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 0.00 135 S 8.07 4.33 0.00 3.92 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 0.00 136 Y 7.86 4.29 0.00 3.18 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 0.00 137 I 7.64 3.53 1.93 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 1.68 0.17 1.00 0.00 0.00 138 Y 7.96 3.98 0.00 3.22 3.06 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 0.00 0.00 0.00 0.00 139 Q 8.27 4.01 0.00 2.50 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.61 0.00 0.00 0.00 0.00 0.00 2.45 2.66 0.00 140 L 7.60 3.96 0.00 1.55 1.52 0.48 0.94 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 0.00 141 V 7.78 3.08 1.30 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 0.77 0.00 0.00 0.71 0.00 0.00 142 M 7.09 4.10 0.00 1.84 1.94 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.32 0.00 143 E 8.20 4.10 0.00 1.89 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 2.33 2.51 0.00 144 S 7.76 4.56 0.00 3.57 3.81 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 0.00 0.00 0.00 145 F 7.80 4.83 0.00 2.89 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 0.00 146 K 8.08 5.22 0.00 2.10 1.89 0.00 1.66 0.00 0.00 1.79 0.00 0.00 2.84 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.31 1.37 7.81 147 K 7.41 4.49 0.00 1.74 1.76 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.42 7.81 148 E 8.23 5.60 0.00 2.01 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 2.04 2.05 0.00 149 G 7.80 3.70 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 0.00 0.00 0.00 150 R 6.99 4.18 0.00 1.79 1.66 0.00 3.27 0.00 0.00 3.11 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 151 I 8.22 3.87 1.91 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 1.37 0.64 1.01 0.00 0.00 152 G 8.01 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 153 A 8.87 4.14 1.20 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