NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 90 Q 3.5961 8.3444 118.7741 56.0393 29.8076 172.1943 91 Q 3.0199 8.1451 121.8812 55.1182 26.6118 170.9566 92 W 4.6651 8.1696 125.5306 56.3026 30.7600 175.5595 93 K 4.8090 8.4891 120.3890 54.8373 35.4162 175.8136 94 V 3.5789 8.2586 119.2752 64.1313 32.0630 174.5586 95 G 3.6939 9.5500 115.8665 45.4792 0.0000 171.9095 96 D 4.7963 7.4170 119.9101 53.1136 46.3044 175.5496 97 K 4.4522 8.8880 122.8461 56.1665 32.2313 175.1991 98 C 5.1366 8.5370 121.9891 56.2050 33.5412 172.3889 99 S 4.8686 8.6727 113.2413 56.9602 66.2018 173.4832 100 A 4.8891 8.3173 125.0121 50.0083 22.2759 175.1269 101 I 4.5342 8.3264 121.5053 60.6287 38.4982 175.4297 102 W 5.6116 8.9711 135.0000 56.0619 32.2817 176.4724 103 S 4.8804 8.8631 121.1510 58.6611 62.6263 174.5868 104 E 4.1104 7.5502 121.5284 57.1061 30.6071 176.5836 105 D 4.6068 7.3851 113.8494 52.4335 43.5965 174.8064 106 G 3.9623 8.3620 106.4414 45.9586 0.0000 171.9735 107 C 4.8267 7.3101 115.8407 58.0575 33.9173 174.7432 108 I 4.3505 7.8688 121.3642 61.1016 37.8369 175.2608 109 Y 4.9924 8.3202 123.0598 55.3504 42.1845 172.9793 110 P 4.5403 0.0000 0.0000 63.6268 32.8785 174.9894 111 A 5.1663 8.7678 123.1940 50.6747 23.8351 175.3261 112 T 5.1086 8.0157 114.3827 61.4299 72.7913 173.6178 113 I 4.0380 8.5251 127.7644 62.0424 37.3653 176.4403 114 A 4.2345 8.7373 130.3289 54.0239 19.6933 177.3866 115 S 4.7095 7.6779 108.7759 57.4568 67.7637 173.5869 116 I 4.8059 8.0131 121.1220 59.9808 41.4814 175.1253 117 D 4.6129 8.6536 124.8646 51.9343 42.0117 176.3959 118 F 4.3026 8.3220 123.3039 59.8634 39.0416 177.3930 119 K 3.9540 7.9305 119.0079 59.6959 32.3263 177.6469 120 R 4.3979 7.8322 117.6318 54.6957 30.9482 176.9190 121 E 3.8260 7.6446 115.3291 57.6315 27.3971 172.5671 122 T 4.8604 7.6826 109.0057 60.9869 73.7417 173.6569 123 C 4.9339 8.2539 114.5269 57.8952 33.6457 172.7514 124 V 4.7215 8.6634 119.3346 61.1643 33.9339 174.4628 125 V 4.8052 8.5037 120.8621 59.5963 34.7615 174.6698 126 V 4.6976 8.2348 124.1566 61.4483 33.8301 174.4199 127 Y 4.4904 8.9694 126.1692 57.3279 38.4320 175.0535 128 T 3.8277 7.9535 121.9461 67.7204 68.2561 173.9288 129 G 3.9733 8.9276 115.6581 45.5557 0.0000 173.0352 130 Y 4.1454 8.1260 116.1107 57.3939 39.2218 176.8277 131 G 4.2027 8.5888 109.0274 45.4331 0.0000 173.9216 132 N 4.4207 7.7268 116.2034 53.8542 39.8127 174.5702 133 R 5.2226 8.4936 120.2914 54.5394 33.2432 174.7576 134 E 4.7981 8.8326 122.2830 54.2833 33.6954 174.6708 135 E 4.6794 8.7757 124.3308 56.1385 30.8423 175.1445 136 Q 4.6431 9.0003 126.9917 54.4527 33.8276 172.4844 137 N 4.9443 8.4173 118.9728 52.0421 40.2797 175.7640 138 L 3.7817 8.6916 125.6381 58.0350 41.9554 179.1886 139 S 4.3795 8.2855 110.8855 60.2026 62.4866 173.8376 140 D 4.8278 7.9792 118.5097 54.2888 40.9835 175.8928 141 L 4.0829 7.6364 120.9963 54.4207 42.0683 176.7944 142 L 4.6641 8.3552 124.0164 53.6792 43.6596 176.7241 143 S 5.0009 8.6601 117.6093 57.7469 63.9508 172.2720 144 P 4.5867 0.0000 0.0000 62.9375 32.4744 176.4571 145 I 4.1084 8.0647 119.2579 61.6058 37.6692 175.7538 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 Q 8.34 3.60 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.28 0.00 0.00 0.00 0.00 0.00 2.12 2.29 0.00 91 Q 8.15 3.02 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.90 0.00 0.00 0.00 0.00 0.00 2.26 2.47 0.00 92 W 8.17 4.67 0.00 3.40 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 8.49 4.81 0.00 1.90 1.86 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.51 7.81 94 V 8.26 3.58 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 0.90 0.00 0.00 0.96 0.00 0.00 95 G 9.55 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 0.00 0.00 0.00 96 D 7.42 4.80 0.00 2.95 2.72 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 97 K 8.89 4.45 0.00 1.68 1.82 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.75 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.39 7.81 98 C 8.54 5.14 0.00 2.85 2.79 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 99 S 8.67 4.87 0.00 3.91 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 0.00 100 A 8.32 4.89 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.33 4.53 1.93 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 1.22 0.57 0.96 0.00 0.00 102 W 8.97 5.61 0.00 3.82 3.11 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 0.00 0.00 0.00 103 S 8.86 4.88 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 0.00 104 E 7.55 4.11 0.00 1.16 1.12 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 1.56 1.47 0.00 105 D 7.39 4.61 0.00 2.73 2.70 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 0.00 106 G 8.36 3.96 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 0.00 0.00 0.00 107 C 7.31 4.83 0.00 2.80 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 0.00 108 I 7.87 4.35 1.71 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.27 0.83 0.00 0.00 109 Y 8.32 4.99 0.00 2.60 2.53 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 0.00 110 P 0.00 4.54 0.00 2.06 1.98 0.00 3.73 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 2.17 2.15 0.00 111 A 8.77 5.17 0.93 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 0.00 0.00 112 T 8.02 5.11 4.21 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 1.22 0.00 0.00 113 I 8.53 4.04 1.85 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.39 0.84 0.00 0.00 114 A 8.74 4.23 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 0.00 115 S 7.68 4.71 0.00 3.70 3.65 0.00 0.00 0.00 0.00 0.00 0.00 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 8.01 4.81 1.46 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 1.23 0.46 0.47 0.00 0.00 117 D 8.65 4.61 0.00 2.57 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 0.00 118 F 8.32 4.30 0.00 3.13 3.08 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 0.00 0.00 0.00 119 K 7.93 3.95 0.00 1.89 1.95 0.00 1.60 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.50 7.81 120 R 7.83 4.40 0.00 1.82 1.98 0.00 3.52 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 121 E 7.64 3.83 0.00 2.03 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 2.37 2.29 0.00 122 T 7.68 4.86 4.21 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 1.27 0.00 0.00 123 C 8.25 4.93 0.00 3.03 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 V 8.66 4.72 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 1.05 0.00 0.00 0.90 0.00 0.00 125 V 8.50 4.81 1.95 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 0.56 0.00 0.00 0.98 0.00 0.00 126 V 8.23 4.70 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 0.98 0.00 0.00 1.00 0.00 0.00 127 Y 8.97 4.49 0.00 2.94 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 0.00 128 T 7.95 3.83 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 1.20 0.00 0.00 129 G 8.93 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 0.00 0.00 0.00 130 Y 8.13 4.15 0.00 2.91 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 8.59 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.73 4.42 0.00 2.34 2.64 0.00 0.00 6.62 7.69 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 0.00 133 R 8.49 5.22 0.00 1.65 1.81 0.00 3.15 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.76 0.00 134 E 8.83 4.80 0.00 1.96 1.84 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 2.17 2.29 0.00 135 E 8.78 4.68 0.00 1.98 1.85 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 2.45 2.28 0.00 136 Q 9.00 4.64 0.00 2.13 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.91 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 137 N 8.42 4.94 0.00 2.88 2.85 0.00 0.00 7.14 6.69 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 0.00 138 L 8.69 3.78 0.00 1.84 1.92 1.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 139 S 8.29 4.38 0.00 3.90 3.93 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 0.00 140 D 7.98 4.83 0.00 2.82 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 7.64 4.08 0.00 1.30 0.67 -0.40 0.48 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 8.36 4.66 0.00 1.70 1.59 0.89 0.78 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 0.00 143 S 8.66 5.00 0.00 3.82 3.89 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 0.00 144 P 0.00 4.59 0.00 2.11 2.37 0.00 3.81 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 2.04 2.12 0.00 145 I 8.06 4.11 1.88 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 1.28 0.69 0.92 0.00 0.00