NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 101 S 4.4416 8.2929 117.0992 58.1233 65.1135 176.0311 102 R 4.0249 8.2273 122.4362 61.3593 29.0038 180.0395 103 R 4.2100 8.1936 122.8010 62.1360 29.9706 180.7840 104 M 4.3943 8.0560 123.5997 60.0646 31.3934 181.0588 105 K 4.2823 9.3544 125.1965 59.4415 31.8257 181.4445 106 A 4.1809 7.8251 121.4813 55.1699 18.3502 179.4590 107 N 4.2224 8.5602 115.2375 56.3890 38.6665 177.4566 108 A 4.0236 8.5097 124.9236 55.7843 18.4098 180.3377 109 R 3.8766 8.0620 119.1693 61.7314 29.4063 180.2907 110 E 4.0766 8.0956 120.3805 59.0895 29.6896 178.8778 111 R 3.7742 7.9798 118.6689 59.5282 30.1225 178.3219 112 N 4.3092 8.1238 116.3122 55.9499 38.4076 177.3982 113 R 3.8726 8.1331 120.4955 59.8745 30.1868 178.5943 114 M 4.0639 8.1945 118.4458 58.6201 31.8592 178.5628 115 H 4.3860 8.1066 116.4995 58.6753 28.8264 178.0069 116 G 3.6276 8.2591 107.6300 47.5978 0.0000 175.3620 117 L 3.9539 8.1092 123.2015 58.1823 42.1706 178.8931 118 N 4.2984 8.9215 116.3356 56.1536 38.3003 177.3841 119 A 3.9742 8.1424 122.1840 55.0599 18.3262 179.4715 120 A 3.9186 8.1823 119.4490 55.2011 18.4409 179.6162 121 L 3.9264 8.1893 119.1440 58.4261 42.1820 178.9747 122 D 4.4194 8.2412 118.9143 57.4662 40.5521 178.4863 123 N 4.3603 8.2399 116.0202 55.6353 38.5132 176.8050 124 L 4.1459 7.4857 122.0519 57.8867 42.0160 178.7015 125 R 3.9393 8.0359 117.9704 59.2933 29.7346 179.1910 126 K 2.8529 7.6490 117.3110 58.8773 32.0551 178.8850 127 V 4.0784 6.9375 109.4669 60.2380 31.7705 175.5968 128 V 3.9655 6.4651 117.9315 59.8079 32.7291 173.0480 129 P 4.3551 0.0000 0.0000 62.5737 31.8676 176.1372 130 C 4.1717 8.5146 112.9233 60.9864 25.5121 173.0946 131 Y 4.2520 7.3463 119.3984 57.5687 38.6928 175.1857 132 S 3.8274 7.5116 119.2519 57.8974 64.3117 176.6048 133 K 3.4874 8.3817 133.1993 58.3334 31.7826 175.7995 134 T 4.0626 7.4586 111.5865 64.2888 69.0057 180.1338 135 Q 4.7299 7.3871 117.7189 52.8926 28.5013 177.0657 136 K 4.2637 7.5341 120.1189 56.2253 34.0707 177.9510 137 L 4.1570 8.1964 120.4945 54.4874 42.4330 178.0697 138 S 4.3620 8.2503 115.9017 57.7700 64.9801 175.3680 139 K 3.8158 8.5987 123.4352 59.9501 31.8629 178.5947 140 I 3.6491 7.7287 117.9932 64.2747 37.8952 177.4457 141 E 4.0059 8.1509 119.5228 59.6623 29.2206 179.5139 142 T 3.9840 8.1303 109.8105 64.6090 68.6157 176.8640 143 L 4.0427 7.9690 122.0200 57.5340 41.6072 179.6829 144 R 3.9453 8.1618 118.1021 59.0539 30.0969 178.6927 145 L 3.9531 8.2815 120.2776 58.2951 42.1493 178.7201 146 A 4.1723 8.3914 121.0274 55.1072 18.2347 179.6022 147 K 3.9482 7.8756 117.6795 59.9232 32.3452 178.7834 148 N 4.4379 8.3488 116.8015 56.5218 38.3994 176.8188 149 Y 4.2440 8.7855 121.1664 60.9164 38.9621 178.0788 150 I 3.6053 8.0343 120.7681 64.1283 37.1664 178.2587 151 W 3.9934 8.5067 129.0383 60.3077 30.5338 177.9784 152 A 3.9922 8.4693 121.0605 54.8832 17.8889 179.6404 153 L 3.7056 7.7721 117.8288 57.9557 41.5296 179.9948 154 S 4.0379 7.5350 112.3645 60.9521 63.1213 175.6832 155 E 3.5594 7.4313 123.1988 58.7374 28.6401 178.6311 156 I 3.7314 7.4295 120.0362 63.6155 36.8354 177.1604 157 L 4.4886 7.0933 117.4307 54.7357 41.4335 176.6637 158 R 4.3138 7.3307 117.8510 58.5203 32.3628 176.4038 159 S 4.3083 8.0758 117.2784 58.2968 62.2485 175.9587 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 S 8.29 4.44 0.00 3.67 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 0.00 102 R 8.23 4.02 0.00 1.89 2.00 0.00 3.22 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.32 0.00 103 R 8.19 4.21 0.00 1.81 1.96 0.00 3.22 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.26 0.00 104 M 8.06 4.39 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.17 0.00 105 K 9.35 4.28 0.00 1.76 1.85 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.37 1.33 7.81 106 A 7.83 4.18 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 0.00 107 N 8.56 4.22 0.00 2.85 2.87 0.00 0.00 6.94 7.05 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 0.00 108 A 8.51 4.02 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 0.00 109 R 8.06 3.88 0.00 1.83 1.96 0.00 3.28 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.52 0.00 110 E 8.10 4.08 0.00 2.08 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 0.00 2.30 2.35 0.00 111 R 7.98 3.77 0.00 2.08 1.89 0.00 3.16 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 112 N 8.12 4.31 0.00 2.94 2.84 0.00 0.00 6.65 6.94 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 0.00 113 R 8.13 3.87 0.00 1.85 2.08 0.00 3.09 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 114 M 8.19 4.06 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.97 0.00 115 H 8.11 4.39 0.00 3.39 3.33 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 G 8.26 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.11 3.95 0.00 1.88 1.87 0.93 0.94 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 N 8.92 4.30 0.00 2.97 2.88 0.00 0.00 7.01 7.72 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 0.00 119 A 8.14 3.97 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.18 3.92 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.19 3.93 0.00 1.87 1.91 0.93 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.24 4.42 0.00 2.92 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 0.00 123 N 8.24 4.36 0.00 2.86 2.86 0.00 0.00 7.00 8.09 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 0.00 124 L 7.49 4.15 0.00 1.73 1.88 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.04 3.94 0.00 2.15 2.18 0.00 3.28 0.00 0.00 3.26 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.90 0.00 126 K 7.65 2.85 0.00 1.67 1.52 0.00 1.57 0.00 0.00 1.55 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.70 1.07 7.81 127 V 6.94 4.08 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 0.70 0.00 0.00 0.98 0.00 0.00 128 V 6.47 3.97 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 0.71 0.00 0.00 0.88 0.00 0.00 129 P 0.00 4.36 0.00 2.10 1.87 0.00 3.41 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.37 0.00 130 C 8.51 4.17 0.00 3.11 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 0.00 131 Y 7.35 4.25 0.00 2.98 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 0.00 132 S 7.51 3.83 0.00 3.68 3.49 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 0.00 133 K 8.38 3.49 0.00 1.81 1.73 0.00 1.86 0.00 0.00 1.74 0.00 0.00 2.77 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.02 7.81 134 T 7.46 4.06 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 1.21 0.00 0.00 135 Q 7.39 4.73 0.00 2.05 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.90 0.00 0.00 0.00 0.00 0.00 2.19 2.12 0.00 136 K 7.53 4.26 0.00 1.88 1.92 0.00 1.59 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.46 7.81 137 L 8.20 4.16 0.00 1.68 1.66 0.94 0.89 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 0.00 138 S 8.25 4.36 0.00 4.10 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 0.00 139 K 8.60 3.82 0.00 1.85 1.87 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.53 7.81 140 I 7.73 3.65 1.87 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 1.64 1.06 0.91 0.00 0.00 141 E 8.15 4.01 0.00 2.24 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 2.33 2.32 0.00 142 T 8.13 3.98 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 1.29 0.00 0.00 143 L 7.97 4.04 0.00 1.89 1.77 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 144 R 8.16 3.95 0.00 2.01 1.98 0.00 3.13 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 145 L 8.28 3.95 0.00 1.91 1.84 0.95 0.84 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 0.00 146 A 8.39 4.17 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 K 7.88 3.95 0.00 1.87 2.06 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.53 7.81 148 N 8.35 4.44 0.00 3.01 2.95 0.00 0.00 6.75 7.10 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 0.00 149 Y 8.79 4.24 0.00 3.09 3.19 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 0.00 150 I 8.03 3.61 2.09 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.63 0.92 0.00 0.00 151 W 8.51 3.99 0.00 3.45 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 A 8.47 3.99 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 0.00 153 L 7.77 3.71 0.00 1.61 1.52 0.55 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 154 S 7.54 4.04 0.00 3.86 3.84 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 0.00 0.00 0.00 155 E 7.43 3.56 0.00 1.16 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 156 I 7.43 3.73 1.97 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 1.45 1.04 0.84 0.00 0.00 157 L 7.09 4.49 0.00 1.66 1.60 0.84 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 158 R 7.33 4.31 0.00 1.78 1.81 0.00 3.09 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.58 0.00 159 S 8.08 4.31 0.00 3.63 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00