NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1122 K 4.2145 8.3149 121.7731 56.4019 32.1566 175.1680 1123 D 4.5349 7.8192 124.7088 51.8266 42.3663 174.1817 1124 P 4.4703 0.0000 0.0000 62.9736 33.3710 175.4934 1125 K 4.9285 8.7335 124.2270 55.7889 34.1082 175.8429 1126 F 5.4244 9.2372 121.6805 55.7351 44.0878 173.2286 1127 E 5.0745 9.7797 120.8295 54.3277 32.9567 174.6313 1128 A 4.8648 9.1346 129.1666 51.8004 18.3857 177.6772 1129 A 4.1409 9.2858 124.3696 54.5247 19.1038 177.0045 1130 Y 4.5571 7.4017 112.1774 55.4650 41.3961 175.1333 1131 D 4.3123 8.7575 123.3276 54.8157 42.8816 174.7379 1132 F 5.2161 9.3431 128.3451 55.6267 40.5151 170.9354 1133 P 4.4488 0.0000 0.0000 61.1106 31.8197 176.0587 1134 G 3.5430 8.5214 112.4691 46.3392 0.0000 172.9552 1135 S 4.3410 8.6841 122.5784 59.9264 63.5912 175.9143 1136 G 3.8600 8.0099 106.6479 44.7946 0.0000 174.3525 1137 S 3.4371 9.6312 113.1922 59.6087 63.8115 169.8785 1138 S 4.1531 8.6707 115.3578 59.6221 61.5593 172.2063 1139 S 4.6003 7.7289 112.8584 59.3328 63.4279 172.9151 1140 E 5.2422 8.1581 118.0553 55.6684 31.6166 175.8871 1141 L 4.8625 9.1809 124.5164 52.0474 42.5618 172.8087 1142 P 4.8514 0.0000 0.0000 63.1409 31.9558 175.5711 1143 L 5.1367 9.5604 123.2210 52.8903 46.6582 175.2131 1144 K 5.2419 8.2517 117.0492 53.1018 36.9754 175.9159 1145 K 4.1655 8.8697 123.2781 60.6423 31.7290 176.4862 1146 G 4.0260 9.1930 115.4473 45.0020 0.0000 171.7577 1147 D 4.7293 8.5031 120.1129 53.2171 43.0278 175.1604 1148 I 4.8725 7.9852 124.4161 59.6951 40.1148 175.2042 1149 V 4.2258 8.2395 118.3874 60.0310 36.9440 173.6169 1150 F 5.2573 9.2277 120.2536 56.7705 40.8075 175.6053 1151 I 4.6478 8.4510 123.9081 60.2878 37.3704 175.5806 1152 S 4.5167 9.3138 123.7528 60.5373 63.3207 173.6292 1153 R 4.7002 7.4387 114.0406 55.8960 32.3563 173.4932 1154 D 5.3535 8.6133 117.6032 51.9998 42.3892 174.3611 1155 E 4.7883 9.5030 121.7712 53.9480 31.6834 175.2412 1156 P 4.5055 0.0000 0.0000 64.1276 31.1483 177.3378 1157 S 4.2314 7.8066 115.2009 59.7161 63.3593 174.8004 1158 G 4.1498 8.5741 110.5582 44.6888 0.0000 172.6749 1159 W 5.2441 8.2480 118.7893 54.6777 32.9531 174.2212 1160 S 5.1933 9.5731 121.4029 56.7633 64.9177 173.4373 1161 L 3.7118 8.9830 127.2371 54.5603 42.2284 175.0087 1162 A 5.0276 9.1525 130.0147 50.3744 21.1117 175.4067 1163 K 5.0022 9.4358 124.3990 54.1082 34.9983 175.4015 1164 L 4.3060 8.7591 127.3774 55.2424 42.4907 178.3135 1165 L 3.3847 8.5765 122.9845 56.7434 42.1533 176.8503 1166 D 4.6327 8.1132 115.9001 54.2436 41.6638 175.6269 1167 G 3.9308 8.7220 106.4823 47.7897 0.0000 175.5341 1168 S 4.4290 8.3609 116.5171 60.0920 63.9609 175.2234 1169 K 4.6260 7.6639 120.0102 55.2056 35.3925 173.9671 1170 E 4.9416 8.8617 125.8158 55.2276 31.4970 175.1811 1171 G 4.2278 9.4212 109.8118 45.2290 0.0000 170.9800 1172 W 5.6088 9.3186 120.1729 55.2641 31.3169 176.4580 1173 V 4.2253 9.3461 122.9308 59.0056 34.7789 172.6428 1174 P 3.4078 0.0000 0.0000 62.7491 31.3644 176.9654 1175 T 3.7861 8.8046 115.0646 64.0294 68.4488 175.7105 1176 A 4.2491 7.4440 121.6726 53.4506 19.0170 177.6307 1177 Y 4.8312 8.1214 114.7048 60.4727 38.3519 175.0140 1178 M 5.0735 7.7457 120.2948 54.6797 32.4906 176.0904 1179 T 4.8388 9.1492 115.5186 58.9475 71.6356 171.9361 1180 P 3.5983 0.0000 0.0000 63.1003 31.7996 175.3245 1181 Y 4.2821 8.6653 127.4109 57.1438 39.5290 176.6576 1182 K 4.0090 7.7494 126.1515 55.3988 31.0791 174.4368 1183 D 4.6808 7.5903 125.9716 53.4291 41.6652 178.2303 1184 T 3.3488 8.6925 117.1899 63.7228 66.4568 171.4977 1185 R 4.4945 7.5397 121.2193 54.5261 31.5185 174.6928 1186 N 4.9293 8.3851 125.8879 51.7416 37.7902 174.4011 1187 T 3.7004 8.2125 109.9598 63.2904 68.4970 173.3009 1188 V 4.0083 8.1907 126.9855 59.5282 32.2881 174.4440 1189 P 4.6973 0.0000 0.0000 61.3915 33.1370 176.2639 1190 V 4.0060 7.8719 116.7155 62.0088 31.4676 175.0977 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 1122 K 8.31 4.21 0.00 1.75 1.84 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.56 7.81 1123 D 7.82 4.53 0.00 2.80 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 1124 P 0.00 4.47 0.00 2.52 2.08 0.00 3.89 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 1125 K 8.73 4.93 0.00 1.96 1.75 0.00 1.92 0.00 0.00 1.82 0.00 0.00 2.73 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.30 1.80 7.81 1126 F 9.24 5.42 0.00 2.94 2.93 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 1127 E 9.78 5.07 0.00 2.15 1.93 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 2.21 2.25 0.00 1128 A 9.13 4.86 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1129 A 9.29 4.14 0.87 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 0.00 0.00 1130 Y 7.40 4.56 0.00 1.49 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 0.00 0.00 0.00 0.00 1131 D 8.76 4.31 0.00 2.79 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1132 F 9.34 5.22 0.00 3.29 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 1133 P 0.00 4.45 0.00 1.99 1.92 0.00 3.68 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.20 0.00 1134 G 8.52 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 0.00 0.00 0.00 1135 S 8.68 4.34 0.00 3.92 3.94 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 1136 G 8.01 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 1137 S 9.63 3.44 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 1138 S 8.67 4.15 0.00 4.05 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 1139 S 7.73 4.60 0.00 3.99 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 1140 E 8.16 5.24 0.00 2.18 2.39 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 2.79 2.38 0.00 1141 L 9.18 4.86 0.00 1.72 1.64 1.00 1.10 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 1142 P 0.00 4.85 0.00 2.18 2.10 0.00 3.91 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.08 0.00 1143 L 9.56 5.14 0.00 1.83 1.68 0.93 0.51 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 1144 K 8.25 5.24 0.00 1.65 1.68 0.00 1.97 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.29 7.81 1145 K 8.87 4.17 0.00 1.66 1.73 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.39 7.81 1146 G 9.19 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1147 D 8.50 4.73 0.00 2.81 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1148 I 7.99 4.87 1.37 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.23 0.20 0.00 0.00 1149 V 8.24 4.23 2.15 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 0.74 0.00 0.00 0.92 0.00 0.00 1150 F 9.23 5.26 0.00 3.02 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 1151 I 8.45 4.65 1.80 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 -0.36 0.70 0.00 0.00 1152 S 9.31 4.52 0.00 3.77 3.73 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 1153 R 7.44 4.70 0.00 1.92 1.98 0.00 3.03 0.00 0.00 3.50 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.59 0.00 1154 D 8.61 5.35 0.00 2.79 2.61 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 0.00 0.00 0.00 1155 E 9.50 4.79 0.00 1.94 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 2.34 2.48 0.00 1156 P 0.00 4.51 0.00 2.18 2.17 0.00 3.77 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 1157 S 7.81 4.23 0.00 3.87 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 1158 G 8.57 4.15 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 0.00 0.00 0.00 1159 W 8.25 5.24 0.00 3.06 3.36 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 1160 S 9.57 5.19 0.00 3.61 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1161 L 8.98 3.71 0.00 0.27 1.06 -0.19 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 1162 A 9.15 5.03 1.19 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 1163 K 9.44 5.00 0.00 1.75 1.80 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.77 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.50 1.42 7.81 1164 L 8.76 4.31 0.00 1.69 1.62 0.95 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 1165 L 8.58 3.38 0.00 1.47 1.53 -0.20 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 1166 D 8.11 4.63 0.00 2.68 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1167 G 8.72 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 0.00 0.00 0.00 1168 S 8.36 4.43 0.00 3.90 3.94 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 1169 K 7.66 4.63 0.00 1.78 1.62 0.00 1.75 0.00 0.00 1.89 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.40 7.81 1170 E 8.86 4.94 0.00 1.86 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 2.11 2.14 0.00 1171 G 9.42 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1172 W 9.32 5.61 0.00 3.33 3.37 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 1173 V 9.35 4.23 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.09 0.00 0.00 1174 P 0.00 3.41 0.00 0.49 0.74 0.00 2.35 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.45 0.00 1175 T 8.80 3.79 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 1.16 0.00 0.00 1176 A 7.44 4.25 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 1177 Y 8.12 4.83 0.00 2.98 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 1178 M 7.75 5.07 0.00 1.83 1.80 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.53 0.00 1179 T 9.15 4.84 4.32 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 0.00 0.00 0.00 1.35 0.00 0.00 1180 P 0.00 3.60 0.00 1.82 1.76 0.00 3.75 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 1181 Y 8.67 4.28 0.00 2.68 2.81 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 1182 K 7.75 4.01 0.00 1.81 1.59 0.00 0.80 0.00 0.00 1.53 0.00 0.00 2.90 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.97 1.15 7.81 1183 D 7.59 4.68 0.00 2.97 2.93 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 1184 T 8.69 3.35 4.22 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 0.00 0.00 0.00 1.20 0.00 0.00 1185 R 7.54 4.49 0.00 1.66 1.68 0.00 3.11 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.46 0.00 1186 N 8.39 4.93 0.00 2.75 2.76 0.00 0.00 6.25 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1187 T 8.21 3.70 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 1.18 0.00 0.00 1188 V 8.19 4.01 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 0.72 0.00 0.00 0.92 0.00 0.00 1189 P 0.00 4.70 0.00 2.18 2.10 0.00 3.69 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.92 0.00 1190 V 7.87 4.01 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 0.82 0.00 0.00 0.92 0.00 0.00