NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 101 M 4.3521 8.1627 120.6120 55.5117 33.6736 173.8621 102 L 4.6496 8.4013 129.3730 52.0867 42.2870 174.3358 103 I 4.4880 9.0587 122.2533 59.6719 40.9079 174.1823 104 K 5.2004 8.9892 121.1349 54.5079 36.0797 176.0393 105 V 4.8838 8.5901 123.5800 59.8288 34.5145 174.4607 106 K 4.8564 9.2089 124.8006 55.0674 33.8920 176.7005 107 T 4.2792 9.4368 123.0164 62.9210 69.9167 174.8194 108 L 4.4925 8.4018 121.4443 56.0829 41.5750 176.9178 109 T 4.5096 7.6953 103.6455 60.8352 69.8304 174.6511 110 G 3.9104 8.4396 111.2431 44.9211 0.0000 173.8266 111 K 4.0178 7.7167 122.4492 56.6160 33.1449 174.9109 112 E 5.3595 8.8416 128.8422 54.3507 31.6242 174.5824 113 I 4.5509 8.5679 120.8535 59.0594 40.2216 174.6071 114 E 4.8048 8.7508 125.7103 56.2005 30.4588 176.0665 115 I 4.7278 8.9466 123.9727 59.5299 42.0586 174.0769 116 D 4.9324 8.6551 124.9512 54.0318 41.3219 175.9106 117 I 4.7241 8.1774 123.2329 60.0241 41.9566 174.1916 118 E 4.7639 9.0565 123.0437 53.8517 32.5155 175.7402 119 P 4.1163 0.0000 0.0000 65.1730 31.9042 177.6339 120 T 4.1551 7.6423 111.1368 63.2094 68.4666 174.7928 121 D 4.4457 8.0935 121.4688 54.3142 41.4280 176.4705 122 K 4.7692 8.3428 121.9937 55.8837 34.3502 178.6511 123 V 3.6396 8.3291 119.9619 66.1154 30.9315 177.5748 124 E 3.9361 8.3004 118.7736 59.2405 29.2168 178.5059 125 R 3.9252 7.7699 117.8588 58.7350 30.4292 178.0225 126 I 3.6663 7.4608 119.5797 64.4518 37.0842 178.4787 127 K 4.2489 7.9845 120.5277 58.9245 31.5882 179.3234 128 E 4.0098 7.6840 118.6846 59.3897 29.4946 179.3885 129 R 4.2317 8.1586 119.6783 58.6940 30.0367 179.3350 130 V 3.6691 7.7727 117.8583 65.8620 31.2844 177.6293 131 E 3.8675 8.6047 119.5344 59.1900 28.9260 178.0651 132 E 3.9011 9.0507 120.4580 59.5561 29.3703 179.0115 133 K 4.1302 7.4969 114.8491 58.0503 32.6561 177.8596 134 E 4.4826 8.5327 117.9247 55.2899 30.5982 176.3359 135 G 3.7254 8.2687 106.3628 46.0154 0.0000 173.3083 136 I 4.1571 7.5371 120.9137 58.3993 37.3839 173.9364 137 P 4.4312 0.0000 0.0000 61.5948 31.5724 175.8338 138 P 4.3025 0.0000 0.0000 65.4816 31.4671 178.5259 139 Q 4.0564 8.1317 115.2021 58.1090 28.6939 176.7377 140 Q 4.5137 8.0103 114.7327 55.6673 28.9105 174.9652 141 Q 4.2745 7.7054 119.2853 55.3375 29.7867 174.7652 142 R 4.6651 8.4098 121.3037 54.4713 33.1688 174.3016 143 L 4.9592 8.3505 124.4651 53.5319 43.9711 175.9168 144 I 4.9803 8.5910 123.3822 59.6775 40.7653 173.9877 145 Y 4.9496 8.5885 126.9017 56.7506 42.2439 175.1050 146 S 3.5593 9.4022 121.3560 59.2406 60.7381 173.5216 147 G 3.9881 8.3414 109.0319 45.3013 0.0000 174.6854 148 K 4.2369 8.1430 120.4891 55.5390 33.0014 175.8061 149 Q 4.7367 8.3998 121.7027 54.8857 29.4347 174.8586 150 M 3.2752 7.9655 124.5766 55.5098 32.9398 176.2113 151 N 4.6246 9.6216 124.9830 52.2495 40.0810 176.1960 152 D 5.0804 8.4200 130.5008 52.7575 38.7160 176.3433 153 E 4.6202 7.8351 115.5781 56.9283 33.7529 174.4109 154 K 4.4844 8.1335 118.3050 55.7954 34.6439 174.9936 155 T 4.9685 9.0369 112.6818 60.2543 70.4674 174.8812 156 A 4.0713 8.4804 128.5971 55.5153 18.5501 180.2635 157 A 4.0884 7.8034 117.8452 55.1009 18.7363 179.5742 158 D 4.1981 8.4283 116.0090 57.4065 40.8253 176.9169 159 Y 4.5718 7.8043 113.4927 57.2517 38.0032 175.2743 160 K 3.9562 7.7155 118.0556 57.3798 30.1032 175.9301 161 I 3.6849 7.8240 119.8542 61.3442 37.5703 175.8827 162 L 4.8515 8.7340 126.5231 53.3291 44.4841 175.8645 163 G 3.5727 8.6923 103.1598 50.8214 0.0000 173.3366 164 G 4.0256 8.3995 106.1578 45.0526 0.0000 173.8513 165 S 4.3467 7.6266 116.0219 58.9062 63.9830 173.5197 166 V 4.8325 8.6219 123.1663 61.2215 33.2411 174.6105 167 L 5.1719 9.4605 128.3901 53.3565 45.2269 174.9777 168 H 5.3374 8.7660 118.1710 53.9152 31.9531 173.3740 169 L 4.6989 8.9915 124.0501 54.9483 42.3536 176.3138 170 V 4.5847 8.2450 121.4284 62.0305 35.3678 173.4670 171 L 4.4845 8.0936 121.9294 53.8838 44.5781 173.7793 172 R 4.5512 8.3827 123.0371 54.4638 32.4911 174.8480 173 L 4.7091 8.3805 124.4357 53.5310 43.9789 176.2334 174 R 4.3195 8.3885 118.6021 57.7943 31.2939 177.9585 175 G 3.8474 7.9587 104.9464 45.6014 0.0000 173.4029 176 G 3.7044 8.2680 107.7853 45.5486 0.0000 172.6671 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 8.16 4.35 0.00 2.35 2.05 0.00 0.00 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.53 0.00 102 L 8.40 4.65 0.00 1.75 1.59 0.94 0.92 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 0.00 103 I 9.06 4.49 1.79 0.00 0.00 0.82 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 0.77 0.95 0.00 0.00 104 K 8.99 5.20 0.00 1.64 1.66 0.00 1.60 0.00 0.00 1.91 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.34 7.81 105 V 8.59 4.88 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.91 0.00 0.00 106 K 9.21 4.86 0.00 1.66 1.76 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.36 1.33 7.81 107 T 9.44 4.28 4.42 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 1.23 0.00 0.00 108 L 8.40 4.49 0.00 1.59 1.66 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 109 T 7.70 4.51 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 0.00 110 G 8.44 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 0.00 111 K 7.72 4.02 0.00 1.85 1.71 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.39 7.81 112 E 8.84 5.36 0.00 1.98 1.80 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 2.18 2.25 0.00 113 I 8.57 4.55 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 1.39 0.71 0.93 0.00 0.00 114 E 8.75 4.80 0.00 1.87 1.91 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 2.30 2.33 0.00 115 I 8.95 4.73 1.85 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 1.21 1.01 0.89 0.00 0.00 116 D 8.66 4.93 0.00 2.55 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.18 4.72 1.84 0.00 0.00 0.82 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 0.38 0.94 0.00 0.00 118 E 9.06 4.76 0.00 2.07 1.78 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 0.00 2.20 2.24 0.00 119 P 0.00 4.12 0.00 2.16 2.14 0.00 3.57 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 2.12 2.11 0.00 120 T 7.64 4.16 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 0.00 121 D 8.09 4.45 0.00 2.81 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.34 4.77 0.00 1.81 1.81 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.50 7.81 123 V 8.33 3.64 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 1.04 0.00 0.00 1.13 0.00 0.00 124 E 8.30 3.94 0.00 2.30 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 2.39 2.39 0.00 125 R 7.77 3.93 0.00 1.92 2.02 0.00 3.39 0.00 0.00 3.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 126 I 7.46 3.67 2.02 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.92 0.87 0.00 0.00 127 K 7.98 4.25 0.00 1.97 1.85 0.00 1.67 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.50 7.81 128 E 7.68 4.01 0.00 1.99 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 2.52 0.00 129 R 8.16 4.23 0.00 2.03 1.98 0.00 3.29 0.00 0.00 3.29 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.64 0.00 130 V 7.77 3.67 2.34 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 1.10 0.00 0.00 0.98 0.00 0.00 131 E 8.60 3.87 0.00 2.12 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 0.00 2.30 2.32 0.00 132 E 9.05 3.90 0.00 2.15 2.11 0.00 0.00 0.00 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 2.39 0.00 133 K 7.50 4.13 0.00 1.82 1.83 0.00 1.72 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.42 7.81 134 E 8.53 4.48 0.00 1.90 1.94 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 2.23 2.33 0.00 135 G 8.27 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 0.00 0.00 0.00 136 I 7.54 4.16 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 1.41 0.64 0.91 0.00 0.00 137 P 0.00 4.43 0.00 2.17 2.02 0.00 3.89 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 2.12 2.10 0.00 138 P 0.00 4.30 0.00 2.17 2.12 0.00 3.59 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 139 Q 8.13 4.06 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.10 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 140 Q 8.01 4.51 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.77 0.00 0.00 0.00 0.00 0.00 2.46 2.29 0.00 141 Q 7.71 4.27 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 142 R 8.41 4.67 0.00 1.84 1.82 0.00 3.27 0.00 0.00 3.33 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 143 L 8.35 4.96 0.00 1.53 1.51 0.88 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 144 I 8.59 4.98 2.00 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 1.10 0.55 0.90 0.00 0.00 145 Y 8.59 4.95 0.00 2.92 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.40 3.56 0.00 3.80 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 0.00 147 G 8.34 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 0.00 148 K 8.14 4.24 0.00 1.87 1.85 0.00 1.75 0.00 0.00 1.95 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.42 7.81 149 Q 8.40 4.74 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.93 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 150 M 7.97 3.28 0.00 1.71 1.91 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.39 0.00 151 N 9.62 4.62 0.00 2.86 2.88 0.00 0.00 6.58 8.21 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 0.00 152 D 8.42 5.08 0.00 2.90 2.74 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 0.00 153 E 7.84 4.62 0.00 1.72 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 2.23 2.33 0.00 154 K 8.13 4.48 0.00 2.13 1.83 0.00 1.64 0.00 0.00 1.27 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.41 7.81 155 T 9.04 4.97 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 1.36 0.00 0.00 156 A 8.48 4.07 1.31 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 0.00 0.00 157 A 7.80 4.09 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 0.00 158 D 8.43 4.20 0.00 2.29 2.31 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 0.00 159 Y 7.80 4.57 0.00 3.02 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 K 7.72 3.96 0.00 2.05 2.02 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.47 7.81 161 I 7.82 3.68 1.85 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.40 0.69 0.00 0.00 162 L 8.73 4.85 0.00 1.63 1.55 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 163 G 8.69 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 G 8.40 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 0.00 165 S 7.63 4.35 0.00 3.79 3.66 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 0.00 166 V 8.62 4.83 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.00 0.00 0.00 167 L 9.46 5.17 0.00 1.48 1.52 0.82 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 168 H 8.77 5.34 0.00 3.11 3.18 0.00 5.81 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 L 8.99 4.70 0.00 1.67 1.60 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 170 V 8.24 4.58 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 0.71 0.00 0.00 0.93 0.00 0.00 171 L 8.09 4.48 0.00 1.58 1.46 0.92 0.80 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 0.00 172 R 8.38 4.55 0.00 1.75 1.75 0.00 3.27 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 173 L 8.38 4.71 0.00 1.64 1.56 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 174 R 8.39 4.32 0.00 1.79 1.97 0.00 3.21 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 175 G 7.96 3.85 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 0.00 0.00 0.00 176 G 8.27 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