NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 94 Q 4.3477 8.3293 119.6867 56.1491 30.2204 175.2535 95 T 3.6697 7.9541 111.1824 63.8496 69.3207 172.9829 96 D 4.2960 8.7338 124.3265 54.7500 42.4062 178.3684 97 D 4.7859 8.0960 127.2796 53.2988 43.0045 176.0061 98 P 4.5517 0.0000 0.0000 61.8296 30.7172 177.9688 99 R 4.4697 7.5211 125.8445 56.0679 29.2043 176.9258 100 N 4.7439 7.6024 108.3196 54.3417 39.6510 175.5481 101 K 4.4204 7.5345 117.2151 54.4741 35.0173 175.7697 102 H 4.0802 8.0053 116.7607 56.0113 29.4825 176.3106 103 K 4.3306 7.9946 123.6891 55.5486 31.1549 176.7110 104 F 4.6641 7.1033 117.0418 58.2872 40.3775 177.2604 105 R 4.5548 9.2294 123.4303 54.5362 32.9666 173.9682 106 L 4.3806 8.7527 127.2424 57.3143 40.6653 176.7555 107 H 4.6164 8.2412 120.2113 53.5414 31.2936 174.7391 108 S 4.3426 7.2380 111.8985 58.1549 63.0013 174.4945 109 Y 4.2792 6.3612 119.9967 58.6826 38.6395 176.8262 110 S 4.8401 7.3665 121.1727 58.7163 65.2249 177.0537 111 S 4.7805 7.9374 113.7999 55.5941 66.7767 171.2587 112 P 4.4833 0.0000 0.0000 63.2303 32.1591 176.4717 113 T 4.3794 8.3327 119.8568 62.3809 70.9273 173.8171 114 F 4.4898 8.8254 120.9904 57.6414 40.2379 174.8681 115 C 4.8523 8.7315 121.2555 58.2709 32.8100 174.0886 116 D 4.6273 8.5517 123.6605 54.5581 39.9798 177.0416 117 H 4.4927 7.8882 119.5268 57.4417 30.1411 175.0822 118 C 4.6742 7.8690 110.2769 56.3769 31.1324 173.4063 119 G 4.5525 8.2448 108.1545 47.0706 0.0000 173.6205 120 S 4.8015 7.4444 112.2758 56.2757 68.1104 175.3649 121 L 3.8693 8.3057 123.6041 54.8401 41.9858 177.8549 122 L 4.2268 8.1326 124.0552 54.2825 40.7338 176.5149 123 Y 4.3109 8.1251 122.4778 57.5857 38.2676 177.8223 124 G 3.8439 8.8201 108.4030 48.0362 0.0000 174.6139 125 L 4.0393 8.1103 119.3177 57.4287 41.7730 177.9102 126 V 4.2729 7.5655 110.4155 59.3442 34.5982 173.1900 127 H 4.0519 8.9591 125.9486 56.8345 29.8125 175.8477 128 Q 3.4116 8.4316 128.3795 56.4542 26.5123 173.2852 129 G 4.2291 8.2758 109.2292 45.5847 0.0000 172.1500 130 M 4.6103 8.3331 120.4629 54.0054 33.0296 175.3718 131 K 5.1160 8.5650 126.2900 54.5241 34.1524 175.3876 132 C 4.6140 9.0307 128.9800 59.1019 32.5170 173.7937 133 S 5.0469 8.2147 125.5048 58.7426 61.2038 174.6973 134 C 4.7620 7.9899 115.3989 60.8821 34.3904 175.1295 135 C 4.6914 7.5407 108.9047 56.7056 30.6911 171.9928 136 E 3.6789 8.1752 121.7108 56.8098 26.0126 171.3313 137 M 4.7460 7.8773 118.7265 53.7182 35.7732 172.9714 138 N 5.9291 8.7854 124.0077 52.1976 40.7403 174.9799 139 V 4.3566 7.8707 115.1007 60.5938 36.9053 173.7425 140 H 4.9230 8.3694 118.9852 55.0661 30.0001 175.6884 141 R 4.1151 8.4034 118.2146 57.8240 30.1397 177.7830 142 R 4.5220 7.8496 111.8955 55.9965 30.2561 176.6347 143 C 4.2796 7.5385 116.8318 61.4105 28.6769 175.7442 144 V 3.4881 7.4413 120.0278 65.7544 30.9891 177.4505 145 R 4.0866 7.9015 116.2099 58.4247 30.0104 177.4515 146 S 4.4414 7.6541 113.4760 59.4511 63.8647 174.7546 147 V 4.0234 6.9011 120.7566 61.7581 32.0027 173.9065 148 P 4.5935 0.0000 0.0000 64.4471 31.7154 176.9182 149 S 3.6432 7.9664 108.5365 60.6881 61.6765 172.2715 150 L 4.5436 7.7527 130.5364 54.8492 41.1426 176.1404 151 C 4.5070 7.2568 119.2252 58.5272 33.9320 173.6227 152 G 4.0866 8.8346 112.8037 46.1758 0.0000 173.9250 153 V 4.4740 7.1124 116.8451 60.5709 32.2229 177.2798 154 D 4.1496 8.4281 119.0871 56.2216 40.2852 178.9662 155 H 4.4361 7.2973 120.2272 56.3582 32.1874 174.0870 156 T 4.5831 7.9804 108.6729 59.7510 70.7718 173.4390 157 E 3.9662 8.7784 124.8332 57.0670 30.5204 177.4668 158 R 4.5758 8.1585 117.7465 55.9846 29.6148 177.0227 159 R 4.2240 7.5915 120.4106 56.3675 30.5875 176.5669 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 94 Q 8.33 4.35 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.00 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 95 T 7.95 3.67 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 96 D 8.73 4.30 0.00 2.63 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 97 D 8.10 4.79 0.00 2.84 2.54 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 98 P 0.00 4.55 0.00 2.17 2.08 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 99 R 7.52 4.47 0.00 1.90 2.00 0.00 3.17 0.00 0.00 3.49 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 100 N 7.60 4.74 0.00 2.68 2.82 0.00 0.00 7.08 7.59 0.00 0.00 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 K 7.53 4.42 0.00 1.65 1.70 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.39 7.81 102 H 8.01 4.08 0.00 1.40 1.96 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 K 7.99 4.33 0.00 1.62 1.73 0.00 1.67 0.00 0.00 1.79 0.00 0.00 2.77 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.38 7.81 104 F 7.10 4.66 0.00 3.03 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 0.00 105 R 9.23 4.55 0.00 2.01 1.71 0.00 3.10 0.00 0.00 3.17 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 106 L 8.75 4.38 0.00 1.67 1.70 0.93 0.73 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 0.00 107 H 8.24 4.62 0.00 2.79 1.45 0.00 5.62 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 S 7.24 4.34 0.00 3.72 3.72 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 0.00 0.00 0.00 0.00 109 Y 6.36 4.28 0.00 3.02 2.88 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 0.00 0.00 0.00 110 S 7.37 4.84 0.00 3.83 3.88 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 0.00 0.00 0.00 111 S 7.94 4.78 0.00 3.85 3.67 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 0.00 112 P 0.00 4.48 0.00 1.90 2.01 0.00 3.70 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.95 0.00 113 T 8.33 4.38 4.29 0.00 0.00 0.00 0.00 0.00 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 0.00 114 F 8.83 4.49 0.00 2.88 3.01 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 0.00 115 C 8.73 4.85 0.00 2.84 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.55 4.63 0.00 2.84 2.80 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 0.00 0.00 0.00 117 H 7.89 4.49 0.00 3.07 3.37 0.00 5.89 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 C 7.87 4.67 0.00 3.10 3.04 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 0.00 0.00 0.00 0.00 119 G 8.24 4.55 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 0.00 0.00 0.00 120 S 7.44 4.80 0.00 3.78 3.69 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 0.00 121 L 8.31 3.87 0.00 0.96 0.99 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 122 L 8.13 4.23 0.00 1.48 1.56 0.94 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 8.13 4.31 0.00 3.08 2.90 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 0.00 124 G 8.82 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 0.00 0.00 0.00 125 L 8.11 4.04 0.00 1.73 1.83 0.98 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 126 V 7.57 4.27 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 0.67 0.00 0.00 1.07 0.00 0.00 127 H 8.96 4.05 0.00 3.06 3.28 0.00 5.86 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 8.43 3.41 0.00 2.14 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.52 0.00 0.00 0.00 0.00 0.00 1.74 1.97 0.00 129 G 8.28 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 0.00 130 M 8.33 4.61 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.43 0.00 131 K 8.56 5.12 0.00 2.21 1.90 0.00 1.95 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.35 7.81 132 C 9.03 4.61 0.00 2.89 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 0.00 133 S 8.21 5.05 0.00 3.96 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 0.00 134 C 7.99 4.76 0.00 2.82 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 0.00 135 C 7.54 4.69 0.00 3.02 2.96 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 0.00 136 E 8.18 3.68 0.00 2.19 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 2.25 2.24 0.00 137 M 7.88 4.75 0.00 2.25 1.91 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.65 0.00 138 N 8.79 5.93 0.00 2.73 2.75 0.00 0.00 7.41 7.71 0.00 0.00 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 V 7.87 4.36 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 -0.04 0.00 0.00 140 H 8.37 4.92 0.00 3.06 3.22 0.00 5.89 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 R 8.40 4.12 0.00 1.79 1.97 0.00 3.16 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 142 R 7.85 4.52 0.00 1.86 1.97 0.00 3.01 0.00 0.00 3.19 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 143 C 7.54 4.28 0.00 2.98 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 0.00 144 V 7.44 3.49 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 1.32 0.00 0.00 0.14 0.00 0.00 145 R 7.90 4.09 0.00 1.83 1.93 0.00 3.28 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 146 S 7.65 4.44 0.00 3.72 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 0.00 147 V 6.90 4.02 2.22 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 1.01 0.00 0.00 0.95 0.00 0.00 148 P 0.00 4.59 0.00 2.25 2.15 0.00 4.05 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 2.03 1.99 0.00 149 S 7.97 3.64 0.00 4.05 3.97 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 0.00 0.00 0.00 0.00 150 L 7.75 4.54 0.00 1.75 1.78 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 151 C 7.26 4.51 0.00 2.26 2.57 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 0.00 152 G 8.83 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 V 7.11 4.47 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 0.88 0.00 0.00 0.93 0.00 0.00 154 D 8.43 4.15 0.00 2.55 2.21 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 0.00 155 H 7.30 4.44 0.00 3.30 3.44 0.00 5.66 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 T 7.98 4.58 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 1.23 0.00 0.00 157 E 8.78 3.97 0.00 1.98 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 2.35 2.33 0.00 158 R 8.16 4.58 0.00 1.77 1.88 0.00 3.30 0.00 0.00 3.21 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 159 R 7.59 4.22 0.00 1.76 1.78 0.00 3.40 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00