NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 89 I 4.1793 8.0201 118.5505 59.5070 38.0065 175.6890 90 A 4.4421 8.0600 120.0776 51.0093 20.8386 174.1633 91 Q 4.6263 7.9125 112.0488 55.1882 32.7263 172.6429 92 A 4.3780 8.0065 117.1407 51.1967 18.9650 177.0801 93 D 4.3604 7.7618 120.3232 52.4716 42.9041 177.8770 94 R 3.7819 7.9120 118.7126 56.7527 29.8436 177.4141 95 L 4.1173 8.7133 116.1795 56.4202 43.1685 177.0696 96 T 4.6587 8.6340 105.7736 62.0720 71.5275 174.9688 97 Q 4.3040 8.0453 119.1003 57.0426 29.5074 176.1451 98 E 4.6272 7.9181 115.5590 56.3444 32.3190 176.3157 99 P 4.2964 0.0000 0.0000 65.2189 31.7969 177.5509 100 E 4.2401 8.1466 117.7411 58.2301 29.4577 177.7416 101 S 4.3758 8.1746 113.3481 61.8068 62.2438 176.1994 102 I 3.7918 8.4084 115.7579 64.5415 37.0435 177.0607 103 R 3.9502 8.1699 120.3810 58.9226 29.4956 178.1292 104 K 3.7910 8.0077 119.0257 60.0366 32.6627 178.4121 105 W 4.9980 7.8784 119.5076 60.1772 28.9742 178.3845 106 R 4.0478 8.3134 117.4197 59.8523 29.3664 178.7877 107 E 4.3909 8.4534 114.8225 57.0832 29.1238 177.5925 108 E 4.5978 8.6816 118.0618 56.0830 31.1800 177.0115 109 Q 4.2621 8.0920 116.8063 56.1898 29.0784 176.0796 110 R 4.5449 7.7631 112.2906 55.4355 30.8264 175.8298 111 K 4.3800 7.8582 118.2832 56.7790 34.0218 175.7628 112 R 4.5016 7.1764 121.6931 55.2590 28.3308 180.2289 113 L 3.2446 9.6786 117.9301 57.1711 43.3935 173.4504 114 Q 3.3642 7.2278 119.7941 57.8189 27.7806 178.0388 115 E 3.6272 7.7540 113.8668 57.8794 30.8389 177.5325 116 L 3.8633 7.3393 116.6796 58.4926 42.3948 178.9580 117 D 4.1217 8.2090 116.7830 57.5552 42.0281 178.9024 118 A 3.8736 9.4075 122.7897 55.6842 18.1565 179.0884 119 A 3.6873 8.7436 117.6350 56.0839 19.2694 179.7453 120 S 3.9137 8.2607 108.0276 61.1210 62.4744 176.4223 121 K 3.9219 7.5917 120.5780 60.2491 31.7106 179.5518 122 V 3.5097 7.8097 111.9014 64.6440 31.5736 178.7241 123 M 3.6267 7.7969 118.5805 58.3624 31.4436 177.6025 124 E 2.9579 8.0806 120.9593 58.4603 29.5285 178.2041 125 Q 3.9269 7.6431 122.0507 59.1943 29.4416 177.2562 126 E 4.1259 7.5869 120.9570 57.1953 29.6429 177.3135 127 W 4.4303 8.0691 117.4686 60.1591 28.2021 178.8354 128 R 4.1748 8.2158 119.1935 59.0272 29.7423 178.5849 129 E 4.0966 8.5608 117.6293 58.9873 29.2778 179.5955 130 K 3.9776 8.0329 119.2534 59.4723 32.3880 178.6972 131 A 4.7654 8.3757 122.6013 54.5043 18.1093 179.5896 132 K 4.0930 8.1645 116.9186 59.4180 32.8584 179.2042 133 K 3.9420 7.8314 119.7798 59.7695 32.0620 178.7311 134 D 5.1839 8.3830 120.4379 55.9038 39.4372 178.0360 135 L 3.9343 7.8304 121.7660 58.2823 42.0260 179.0315 136 E 4.1800 9.0130 118.2121 59.2548 29.1618 177.9680 137 E 3.9629 8.2369 119.8627 58.9348 29.4402 178.4879 138 W 4.4153 8.8045 126.5537 60.7360 30.9986 177.4279 139 N 4.0359 8.6876 115.7253 57.8770 37.9523 176.5340 140 Q 4.0078 8.2074 118.7301 58.7120 28.7634 178.7502 141 R 3.8938 8.0200 118.9745 60.0603 30.1808 178.3258 142 Q 3.8612 8.3877 117.5941 60.2266 28.7329 179.0919 143 S 3.8018 7.7890 113.5501 62.4815 62.6302 176.8245 144 E 3.9370 8.3202 119.6994 59.7105 29.4608 179.6614 145 Q 4.3625 7.8097 117.7760 59.2325 28.7225 179.3107 146 V 4.0043 8.1140 114.8869 63.7276 31.6359 178.3795 147 E 3.9538 8.0136 119.4004 59.0894 29.3059 178.8536 148 K 4.1157 8.8418 118.6125 59.8694 32.3908 177.9754 149 N 4.0981 9.0509 117.1153 56.9102 38.1382 176.8330 150 K 3.8645 8.0216 122.5286 59.8171 32.5918 178.7593 151 I 3.7758 7.0931 111.1770 63.4838 37.3899 176.3249 152 N 4.5547 7.2265 115.4145 53.7630 39.1339 174.1989 153 N 4.4587 8.9996 115.0370 54.3902 35.5108 175.6251 154 R 4.6240 7.9193 115.1677 55.4999 33.4007 175.6205 155 I 4.2267 7.7875 111.9487 59.9401 37.6205 175.3992 156 A 3.9646 7.9382 127.2103 53.3362 18.0656 178.4542 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 89 I 8.02 4.18 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 1.35 1.21 0.91 0.00 0.00 90 A 8.06 4.44 1.27 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 0.00 0.00 0.00 91 Q 7.91 4.63 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.49 0.00 0.00 0.00 0.00 0.00 2.22 2.40 0.00 92 A 8.01 4.38 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 93 D 7.76 4.36 0.00 2.63 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.91 3.78 0.00 2.09 1.77 0.00 3.29 0.00 0.00 3.25 7.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 95 L 8.71 4.12 0.00 1.64 1.68 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.63 4.66 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 97 Q 8.05 4.30 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.90 0.00 0.00 0.00 0.00 0.00 2.66 2.33 0.00 98 E 7.92 4.63 0.00 2.14 1.92 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 2.24 2.19 0.00 99 P 0.00 4.30 0.00 2.06 2.12 0.00 3.65 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.08 0.00 100 E 8.15 4.24 0.00 2.03 1.98 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 2.36 2.32 0.00 101 S 8.17 4.38 0.00 4.19 4.06 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 0.00 102 I 8.41 3.79 1.91 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 1.75 0.74 0.95 0.00 0.00 103 R 8.17 3.95 0.00 1.97 2.09 0.00 3.49 0.00 0.00 3.19 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 104 K 8.01 3.79 0.00 1.58 1.59 0.00 1.57 0.00 0.00 1.60 0.00 0.00 3.02 0.00 0.00 2.43 0.00 0.00 0.00 0.00 1.37 1.55 7.81 105 W 7.88 5.00 0.00 3.36 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 0.00 106 R 8.31 4.05 0.00 1.95 1.98 0.00 3.33 0.00 0.00 3.23 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.88 0.00 107 E 8.45 4.39 0.00 2.07 1.98 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 2.38 2.48 0.00 108 E 8.68 4.60 0.00 2.04 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 0.00 1.92 2.36 0.00 109 Q 8.09 4.26 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 2.68 2.55 0.00 110 R 7.76 4.54 0.00 1.87 2.00 0.00 3.03 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 111 K 7.86 4.38 0.00 1.86 1.84 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.35 1.34 7.81 112 R 7.18 4.50 0.00 1.89 1.04 0.00 3.62 0.00 0.00 3.15 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 113 L 9.68 3.24 0.00 1.70 1.60 0.92 0.69 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 0.00 114 Q 7.23 3.36 0.00 2.32 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.67 6.20 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 115 E 7.75 3.63 0.00 2.11 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 2.35 2.44 0.00 116 L 7.34 3.86 0.00 1.79 1.62 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 117 D 8.21 4.12 0.00 2.74 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 A 9.41 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 119 A 8.74 3.69 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 0.00 120 S 8.26 3.91 0.00 3.82 3.87 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 0.00 121 K 7.59 3.92 0.00 2.00 1.79 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.61 7.81 122 V 7.81 3.51 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 0.93 0.00 0.00 0.88 0.00 0.00 123 M 7.80 3.63 0.00 1.44 1.72 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.84 0.00 124 E 8.08 2.96 0.00 1.90 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 0.00 2.26 2.27 0.00 125 Q 7.64 3.93 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.69 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 126 E 7.59 4.13 0.00 2.00 1.69 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 2.21 2.33 0.00 127 W 8.07 4.43 0.00 3.53 3.53 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 0.00 128 R 8.22 4.17 0.00 2.06 2.14 0.00 3.26 0.00 0.00 3.52 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.43 0.00 129 E 8.56 4.10 0.00 2.19 2.42 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 2.63 2.38 0.00 130 K 8.03 3.98 0.00 2.03 1.94 0.00 1.80 0.00 0.00 1.89 0.00 0.00 3.18 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.57 1.55 7.81 131 A 8.38 4.77 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 0.00 132 K 8.16 4.09 0.00 2.05 2.10 0.00 1.36 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.66 1.50 7.81 133 K 7.83 3.94 0.00 2.00 1.89 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.64 7.81 134 D 8.38 5.18 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 0.00 135 L 7.83 3.93 0.00 2.06 1.88 0.80 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 136 E 9.01 4.18 0.00 2.06 2.03 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 2.38 2.60 0.00 137 E 8.24 3.96 0.00 2.30 1.98 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 2.36 2.42 0.00 138 W 8.80 4.42 0.00 3.32 3.28 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.69 4.04 0.00 3.01 3.02 0.00 0.00 7.36 6.17 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 0.00 140 Q 8.21 4.01 0.00 2.27 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.45 0.00 0.00 0.00 0.00 0.00 2.52 2.39 0.00 141 R 8.02 3.89 0.00 2.01 1.98 0.00 3.16 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 142 Q 8.39 3.86 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.34 0.00 0.00 0.00 0.00 0.00 2.07 1.83 0.00 143 S 7.79 3.80 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 0.00 144 E 8.32 3.94 0.00 2.02 1.98 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 2.32 2.34 0.00 145 Q 7.81 4.36 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.76 0.00 0.00 0.00 0.00 0.00 2.44 2.54 0.00 146 V 8.11 4.00 2.03 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 0.90 0.00 0.00 0.96 0.00 0.00 147 E 8.01 3.95 0.00 2.27 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 2.28 2.37 0.00 148 K 8.84 4.12 0.00 1.86 1.85 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.47 7.81 149 N 9.05 4.10 0.00 2.92 2.77 0.00 0.00 6.89 6.78 0.00 0.00 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 K 8.02 3.86 0.00 1.68 1.89 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.45 7.81 151 I 7.09 3.78 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.51 0.98 0.00 0.00 152 N 7.23 4.55 0.00 2.87 2.78 0.00 0.00 7.15 8.07 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 0.00 153 N 9.00 4.46 0.00 2.89 2.96 0.00 0.00 6.71 7.66 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 0.00 154 R 7.92 4.62 0.00 2.10 1.88 0.00 3.16 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.97 0.00 155 I 7.79 4.23 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 1.34 0.48 0.91 0.00 0.00 156 A 7.94 3.96 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