NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 89 L 4.3953 8.1849 120.6409 54.7913 43.0269 175.9092 90 Q 4.2975 8.5558 120.6731 53.5762 31.0389 173.6294 91 Q 4.2479 8.7774 119.9264 55.2534 30.0839 175.6143 92 W 5.2341 8.6725 122.2535 54.7031 33.0637 174.6195 93 K 4.8594 9.3705 118.6901 54.6543 35.3069 176.0680 94 V 3.8006 8.3080 119.8360 64.7210 31.7580 176.4572 95 G 4.0277 9.2254 115.8973 45.1408 0.0000 173.5906 96 D 4.6537 8.0088 120.1220 54.4640 42.0346 175.9885 97 K 4.8828 8.7010 121.8106 56.6437 33.3778 175.9186 98 C 4.9014 9.0501 117.9978 57.6676 33.0640 172.4363 99 S 5.3267 9.0959 113.2986 57.3434 66.8823 173.3394 100 A 4.6873 8.8312 121.8592 50.7678 23.1320 175.4980 101 I 4.4962 8.2932 120.7127 60.6109 38.0505 175.8343 102 W 4.9050 9.5557 135.0000 56.4446 31.1669 177.3399 103 S 4.3478 9.8345 121.8484 60.3904 62.9982 175.1619 104 E 3.9705 8.0892 121.9756 58.3887 29.4214 176.4648 105 D 4.5691 7.3270 113.3044 51.6109 40.8984 175.6341 106 G 3.9046 8.4669 107.6718 46.7202 0.0000 173.1382 107 C 4.8075 8.1984 116.5783 57.5599 31.3782 173.0903 108 I 4.6042 7.8908 121.3967 61.1976 37.9219 175.1119 109 Y 4.8711 9.0242 123.2664 55.2019 42.5551 173.1950 110 P 5.0281 0.0000 0.0000 63.4180 32.9300 174.8649 111 A 5.0857 9.1928 122.4935 51.2674 23.3994 174.8990 112 T 4.9899 8.3277 115.2690 61.6425 72.1372 173.9338 113 I 4.1164 8.3814 126.6432 61.3369 37.5290 176.5244 114 A 4.3515 8.8079 130.0418 53.7562 20.1370 177.2856 115 S 4.5798 7.4038 106.8974 57.5791 66.0398 174.3782 116 I 4.6695 8.1389 121.5649 59.5475 40.6301 174.8041 117 D 4.5884 8.9174 126.5690 52.4481 41.8348 176.5756 118 F 4.2859 8.5761 125.6725 60.2119 39.4806 178.3865 119 K 4.0761 8.3184 119.0342 59.1184 31.9264 177.8855 120 R 4.2956 8.0942 114.8337 55.4665 30.7259 175.9327 121 E 3.8248 7.9746 117.0928 57.8838 27.6484 173.6218 122 T 5.2496 7.6748 107.1597 60.1256 72.9269 172.0611 123 C 4.9238 9.1719 115.9926 57.0002 34.0329 172.5785 124 V 4.6390 8.3381 118.9023 61.2172 33.3021 174.8257 125 V 4.6054 8.3257 120.7890 59.4529 35.0765 174.6742 126 V 4.3464 7.9992 123.1691 61.0616 33.8785 174.2328 127 Y 4.5716 8.1856 126.7744 57.5858 38.7587 175.3114 128 T 3.8995 8.7199 122.6918 65.4927 68.3114 174.8158 129 G 3.7915 9.0322 114.8147 45.6989 0.0000 172.4279 130 Y 4.5305 8.1713 116.0270 56.7924 39.1271 176.9974 131 G 4.1024 8.4692 107.1008 46.0684 0.0000 172.8911 132 N 5.3833 7.7382 116.1829 51.2087 43.2111 173.4678 133 R 4.8656 8.2983 115.9684 54.9111 33.2740 173.7366 134 E 4.7045 8.3462 118.2275 54.9329 33.5320 173.8750 135 E 4.5528 8.7548 127.2573 56.4140 30.7137 175.7694 136 Q 4.6713 9.0483 124.6433 53.7836 33.5569 174.6672 137 N 4.7638 8.6582 119.8887 53.0639 39.6349 176.1531 138 L 3.8888 8.7757 123.4210 57.9931 41.9245 179.9030 139 S 4.3212 8.0885 111.4198 60.6406 62.9984 174.4114 140 D 4.7061 7.7391 119.2433 54.3574 41.1623 176.6311 141 L 4.1783 7.5265 119.6630 54.5689 42.3232 176.3278 142 L 5.0193 8.5751 121.1090 52.3823 45.8678 175.7767 143 S 4.6521 8.9572 114.9431 58.6268 62.7101 173.6564 144 P 4.5594 0.0000 0.0000 64.3651 31.4643 177.5739 145 I 3.8375 7.6632 120.1541 64.2528 37.1713 176.4290 146 C 4.3280 7.9754 118.8564 59.7997 28.1782 173.5279 147 E 4.2431 8.5418 123.4478 56.5974 30.1606 175.3571 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 L 8.18 4.40 0.00 1.73 1.80 1.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 90 Q 8.56 4.30 0.00 1.64 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.91 0.00 0.00 0.00 0.00 0.00 2.28 2.59 0.00 91 Q 8.78 4.25 0.00 1.86 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.79 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 92 W 8.67 5.23 0.00 3.30 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 93 K 9.37 4.86 0.00 1.95 1.95 0.00 1.37 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.83 1.42 7.81 94 V 8.31 3.80 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 0.84 0.00 0.00 0.92 0.00 0.00 95 G 9.23 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 96 D 8.01 4.65 0.00 3.01 2.97 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 97 K 8.70 4.88 0.00 1.73 1.80 0.00 1.79 0.00 0.00 1.80 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.48 7.81 98 C 9.05 4.90 0.00 2.66 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 99 S 9.10 5.33 0.00 3.92 3.80 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 0.00 100 A 8.83 4.69 1.22 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 0.00 0.00 0.00 101 I 8.29 4.50 1.93 0.00 0.00 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 1.26 0.62 0.97 0.00 0.00 102 W 9.56 4.91 0.00 2.99 2.94 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 0.00 103 S 9.83 4.35 0.00 4.10 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 0.00 104 E 8.09 3.97 0.00 1.63 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 1.68 1.81 0.00 105 D 7.33 4.57 0.00 2.66 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.47 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 0.00 107 C 8.20 4.81 0.00 3.10 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 I 7.89 4.60 1.76 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 1.34 0.45 0.94 0.00 0.00 109 Y 9.02 4.87 0.00 2.68 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 5.03 0.00 2.25 2.47 0.00 4.03 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.24 0.00 111 A 9.19 5.09 0.97 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 0.00 0.00 112 T 8.33 4.99 4.16 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 0.00 0.00 0.00 1.22 0.00 0.00 113 I 8.38 4.12 1.97 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 0.85 0.58 0.81 0.00 0.00 114 A 8.81 4.35 1.14 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 0.00 0.00 0.00 115 S 7.40 4.58 0.00 3.78 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 0.00 116 I 8.14 4.67 1.24 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 1.00 0.51 -0.29 0.00 0.00 117 D 8.92 4.59 0.00 2.56 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.58 4.29 0.00 3.26 3.06 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 0.00 119 K 8.32 4.08 0.00 1.79 1.91 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.51 7.81 120 R 8.09 4.30 0.00 1.82 1.96 0.00 3.31 0.00 0.00 3.22 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.84 0.00 121 E 7.97 3.82 0.00 2.20 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 0.00 2.29 2.42 0.00 122 T 7.67 5.25 4.25 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 1.20 0.00 0.00 123 C 9.17 4.92 0.00 2.89 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 0.00 124 V 8.34 4.64 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 0.87 0.00 0.00 0.84 0.00 0.00 125 V 8.33 4.61 1.62 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 0.35 0.00 0.00 0.23 0.00 0.00 126 V 8.00 4.35 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 0.93 0.00 0.00 0.79 0.00 0.00 127 Y 8.19 4.57 0.00 2.53 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.72 3.90 4.40 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 1.25 0.00 0.00 129 G 9.03 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 0.00 0.00 0.00 130 Y 8.17 4.53 0.00 3.24 3.19 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 0.00 131 G 8.47 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 132 N 7.74 5.38 0.00 2.95 2.86 0.00 0.00 6.52 7.54 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 0.00 133 R 8.30 4.87 0.00 1.69 1.73 0.00 3.03 0.00 0.00 3.07 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.52 0.00 134 E 8.35 4.70 0.00 2.12 1.66 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 2.23 2.28 0.00 135 E 8.75 4.55 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 2.25 2.46 0.00 136 Q 9.05 4.67 0.00 1.76 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.77 0.00 0.00 0.00 0.00 0.00 2.15 2.29 0.00 137 N 8.66 4.76 0.00 2.90 2.74 0.00 0.00 7.04 6.74 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 0.00 138 L 8.78 3.89 0.00 1.76 1.87 0.97 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 139 S 8.09 4.32 0.00 4.02 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 0.00 140 D 7.74 4.71 0.00 2.83 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 0.00 141 L 7.53 4.18 0.00 1.08 0.74 -0.35 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 142 L 8.58 5.02 0.00 1.68 1.59 0.95 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 143 S 8.96 4.65 0.00 3.98 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 0.00 144 P 0.00 4.56 0.00 2.29 2.37 0.00 3.57 0.00 0.00 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 145 I 7.66 3.84 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 1.33 0.58 0.93 0.00 0.00 146 C 7.98 4.33 0.00 3.02 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 0.00 147 E 8.54 4.24 0.00 1.91 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 2.25 2.31 0.00