NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 90 A 4.1530 8.2493 123.5786 52.6580 20.2885 175.7933 91 Q 3.0675 8.6253 113.8067 54.5898 27.3062 172.1751 92 R 4.5823 7.0916 111.9365 54.7900 33.3875 174.4620 93 P 4.1815 0.0000 0.0000 62.8925 31.8074 176.2595 94 A 4.0135 8.5045 125.1436 54.3723 18.6939 176.9606 95 K 4.1490 7.2749 116.0655 56.2100 39.4224 174.2594 96 Y 4.2045 6.2773 113.2319 57.4281 42.0915 172.0670 97 S 4.8397 8.0415 113.8398 57.5583 66.6293 171.8224 98 Y 5.1350 8.2119 118.9223 56.6951 40.8116 173.6220 99 V 4.6149 8.2493 112.9381 60.0719 34.5507 173.0506 100 D 4.3250 7.9669 125.7272 54.5103 47.3800 176.4617 101 E 4.0598 8.9600 121.2306 58.8452 30.2724 176.4810 102 N 5.1639 7.8224 113.3923 50.8805 42.4176 175.2794 103 G 3.7453 8.5775 107.3857 47.5119 0.0000 174.0129 104 E 4.3559 7.8358 119.3388 55.3688 30.5740 176.2172 105 T 4.4125 8.3026 111.9633 61.5341 69.0968 175.0216 106 K 4.0692 9.0123 127.4498 57.3309 32.4921 176.7854 107 T 3.6371 7.9688 112.5564 61.5709 68.1234 171.5976 108 W 3.9055 8.3885 127.1137 60.0478 29.6363 177.4241 109 T 4.0123 7.6796 111.7885 62.1307 67.3958 171.5167 110 G 4.1216 9.3649 111.2141 45.4421 0.0000 174.5103 111 Q 4.4902 7.5782 121.5861 54.0259 29.2922 176.0576 112 G 4.0148 7.9100 103.9023 44.3921 0.0000 177.7536 113 R 3.4118 8.5470 119.9291 56.5298 30.7965 175.3089 114 T 4.6573 7.9059 104.9302 59.4884 71.8600 171.7865 115 P 4.4505 0.0000 0.0000 63.1665 33.3538 175.6580 116 A 4.0841 7.4182 126.0491 50.4951 24.0483 180.2958 117 V 3.3056 7.7700 117.5988 67.9955 30.9434 177.4032 118 I 3.6753 7.3080 119.1441 64.1035 36.6588 178.0415 119 K 3.8602 7.8773 119.3976 59.5761 31.8581 179.4286 120 K 3.9244 7.9216 117.7996 59.1855 31.9272 179.0703 121 A 4.0118 7.9897 121.0869 55.6653 18.3341 179.6840 122 M 4.0238 8.4547 117.5549 58.3257 31.7557 178.4215 123 D 4.3459 8.1024 117.5937 57.4641 41.5151 177.5907 124 E 4.2466 8.1136 115.4276 55.5560 30.7494 176.5612 125 Q 3.3717 8.3488 117.7860 57.5089 26.3342 174.3947 126 G 3.8963 8.4606 108.9919 46.5426 0.0000 171.9954 127 K 4.3439 7.6215 112.8284 57.0002 33.6328 178.6445 128 S 4.1974 7.1386 113.0713 57.1787 62.1532 176.6113 129 L 3.5625 7.6159 118.7092 57.7564 42.0562 178.6013 130 D 4.6143 7.7139 117.5215 56.6815 41.4382 178.3754 131 D 4.7964 7.7496 116.6220 55.9432 40.3364 176.9376 132 F 4.8165 8.0283 118.0065 60.1829 39.4496 176.2439 133 L 4.5763 7.7350 120.2885 54.8971 41.6483 176.8621 134 I 3.0318 7.3893 123.8205 62.6197 36.2677 173.2714 135 K 4.6028 8.4556 123.7398 55.7561 33.9538 176.2351 136 Q 4.1759 8.6217 121.0459 56.2730 28.7445 175.8694 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 90 A 8.25 4.15 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 8.63 3.07 0.00 2.30 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.64 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 92 R 7.09 4.58 0.00 1.84 1.93 0.00 3.00 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 93 P 0.00 4.18 0.00 1.99 1.95 0.00 3.69 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 1.85 1.86 0.00 94 A 8.50 4.01 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 95 K 7.27 4.15 0.00 1.57 1.56 0.00 1.88 0.00 0.00 1.95 0.00 0.00 3.22 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.86 1.23 7.81 96 Y 6.28 4.20 0.00 1.43 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 97 S 8.04 4.84 0.00 3.92 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 98 Y 8.21 5.14 0.00 3.16 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 V 8.25 4.61 2.30 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 1.00 0.00 0.00 1.02 0.00 0.00 100 D 7.97 4.32 0.00 2.44 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 0.00 0.00 0.00 0.00 101 E 8.96 4.06 0.00 1.96 2.01 0.00 0.00 0.00 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 2.36 0.00 102 N 7.82 5.16 0.00 2.77 2.68 0.00 0.00 6.99 7.85 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 0.00 103 G 8.58 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.84 4.36 0.00 2.01 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 2.32 2.32 0.00 105 T 8.30 4.41 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 1.30 0.00 0.00 106 K 9.01 4.07 0.00 2.09 2.08 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.50 7.81 107 T 7.97 3.64 4.27 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 1.30 0.00 0.00 108 W 8.39 3.91 0.00 3.15 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 0.00 109 T 7.68 4.01 4.28 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 1.22 0.00 0.00 110 G 9.36 4.12 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 0.00 0.00 0.00 111 Q 7.58 4.49 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.86 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 112 G 7.91 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.55 3.41 0.00 1.96 1.96 0.00 3.02 0.00 0.00 3.28 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.52 0.00 114 T 7.91 4.66 4.14 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 0.00 0.00 0.94 0.00 0.00 115 P 0.00 4.45 0.00 2.13 2.03 0.00 3.76 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.92 0.00 116 A 7.42 4.08 0.89 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 0.00 0.00 117 V 7.77 3.31 0.67 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 0.88 0.00 0.00 0.25 0.00 0.00 118 I 7.31 3.68 1.66 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.17 0.85 0.00 0.00 119 K 7.88 3.86 0.00 1.81 1.81 0.00 1.59 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.50 7.81 120 K 7.92 3.92 0.00 1.84 1.83 0.00 1.67 0.00 0.00 2.13 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.41 7.81 121 A 7.99 4.01 1.53 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 0.00 0.00 122 M 8.45 4.02 0.00 2.02 2.31 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.83 0.00 123 D 8.10 4.35 0.00 2.77 2.84 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 0.00 124 E 8.11 4.25 0.00 2.05 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 2.33 2.38 0.00 125 Q 8.35 3.37 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.65 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 126 G 8.46 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.62 4.34 0.00 1.83 1.87 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.35 7.81 128 S 7.14 4.20 0.00 3.64 3.17 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 0.00 0.00 0.00 0.00 129 L 7.62 3.56 0.00 1.56 1.62 0.89 1.14 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 0.00 130 D 7.71 4.61 0.00 2.77 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 0.00 131 D 7.75 4.80 0.00 2.53 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 0.00 132 F 8.03 4.82 0.00 2.94 3.03 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 0.00 133 L 7.73 4.58 0.00 1.82 1.87 0.82 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 134 I 7.39 3.03 1.90 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 1.45 0.76 0.94 0.00 0.00 135 K 8.46 4.60 0.00 1.72 1.73 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.50 7.81 136 Q 8.62 4.18 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00