NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 78 P 4.2124 0.0000 0.0000 67.2034 32.9190 178.0121 79 S 3.7058 6.9873 114.4723 58.4342 59.5468 171.6837 80 D 4.6869 9.0058 125.4048 54.0034 41.6353 176.9238 81 F 5.1229 7.7901 117.0800 56.8204 39.6689 174.8500 82 E 4.9123 7.9908 116.8418 55.1201 32.4583 173.8841 83 H 4.9560 8.2147 114.3093 54.2710 31.5628 173.1986 84 T 4.1314 8.3480 118.1248 63.4320 69.0147 174.1702 85 I 4.7154 7.8781 117.4739 59.3155 40.8608 174.0565 86 H 4.8569 8.6810 117.6441 53.9730 31.2683 173.4092 87 V 4.7162 8.5371 123.5480 61.1102 34.7515 174.2342 88 G 4.4853 9.2496 112.9561 44.3663 0.0000 170.9285 89 F 5.0629 8.6154 120.5705 56.2468 42.7347 173.5717 90 D 4.4630 7.8932 125.8043 52.1567 41.5859 176.3781 91 A 4.0860 8.4627 130.1172 55.1746 18.8024 179.0278 92 V 3.6686 7.7856 114.7742 66.3123 31.6962 177.3309 93 T 3.9458 8.2281 108.2096 61.8752 69.4715 174.3025 94 G 3.7001 8.1821 110.1947 46.1861 0.0000 173.2804 95 E 4.8026 6.5418 116.0133 54.3448 34.5545 176.6579 96 F 4.9130 9.1084 121.5919 57.5973 40.3508 174.8078 97 T 4.4743 9.1746 112.0162 60.5402 71.4016 174.6244 98 G 3.9828 8.9757 112.8353 46.5437 0.0000 172.7471 99 M 4.2385 8.0756 119.2953 53.8085 33.0587 174.7577 100 P 4.1599 0.0000 0.0000 62.5842 33.2583 176.7754 101 E 3.9228 8.7702 122.1076 59.7876 29.4749 179.2029 102 Q 4.0769 8.0410 118.8633 58.9149 29.1202 177.9594 103 W 4.2083 8.2957 119.5722 59.5309 29.0936 178.1903 104 A 4.0451 8.3497 120.9390 55.3171 17.6375 179.9597 105 R 3.9353 7.9234 115.5018 59.1918 30.3715 179.0561 106 L 4.0278 8.1696 119.0845 57.7158 41.6635 179.2498 107 L 3.9620 8.1501 120.5803 57.9637 41.7180 178.5150 108 Q 4.0445 7.8342 119.1129 58.8582 28.9804 178.5110 109 T 4.6103 7.1588 107.0063 61.6943 70.0858 175.9896 110 S 4.2332 7.8096 118.3221 59.7865 63.4782 174.0377 111 N 4.3555 8.0544 117.6331 53.4493 35.8035 173.7260 112 I 4.1322 7.5610 120.6369 60.5687 37.4995 176.7868 113 T 4.1888 8.8150 116.9428 61.0446 70.6252 175.5932 114 K 3.9848 8.5472 120.9209 59.8395 32.0467 179.4972 115 S 4.1380 8.0992 114.6481 61.9624 62.8817 176.4896 116 E 3.8729 8.3106 120.9351 59.6737 28.9353 179.6425 117 Q 3.9925 8.1917 117.6795 58.7731 28.8573 178.2995 118 K 3.7347 8.0386 120.0125 58.8171 32.3241 178.4848 119 K 4.1507 8.4964 119.9444 58.3946 33.6341 176.8446 120 N 4.9253 7.9144 117.0218 50.0629 39.5494 172.2333 121 P 4.2312 0.0000 0.0000 65.4168 31.7702 177.6428 122 Q 4.0336 8.1140 117.4382 59.1651 28.8711 178.1154 123 A 3.9495 8.0438 121.6688 54.8336 18.4125 179.7633 124 V 3.4280 7.6820 116.3618 66.2558 31.7208 178.2062 125 L 3.8798 7.8960 118.6688 57.6032 41.4244 179.2141 126 D 4.3431 8.3177 119.2573 57.2626 40.7403 178.9454 127 V 3.5727 7.8813 118.8454 66.0189 31.4710 178.0898 128 L 3.4968 7.5862 118.6744 57.4905 41.2007 179.1411 129 E 3.6843 7.6944 119.2333 59.0301 29.6793 178.6948 130 F 4.1102 8.2280 120.8752 61.1941 39.3620 176.4925 131 Y 3.7577 8.1524 119.2352 60.5959 38.6342 177.3696 132 N 4.3919 8.3337 118.3549 57.0149 38.8803 176.9430 133 S 4.1609 7.9739 113.8866 61.1170 63.3556 176.1039 134 K 3.9363 7.3826 121.6198 58.7849 31.7334 179.3480 135 K 3.9879 7.9483 118.5415 58.7104 31.9384 177.9444 136 T 4.4355 7.5445 107.0731 60.9615 69.0299 174.1122 137 S 4.8002 7.3902 115.3298 57.1071 64.9190 173.9308 138 N 4.8276 8.4095 121.1156 52.9409 38.9838 175.6802 139 S 4.2134 7.9845 113.8312 58.3501 63.1406 173.5277 140 Q 4.1957 8.5854 126.8302 55.1448 29.7493 174.9155 141 K 4.3389 8.1375 124.7932 55.8753 33.1555 175.4222 142 Y 4.6231 8.1128 121.7987 55.6804 41.9561 174.6972 143 M 3.8765 8.7698 121.4079 55.8543 32.4947 175.4749 144 S 4.6815 8.1747 120.6240 56.3994 65.2321 173.2741 145 F 4.8308 8.5033 121.3365 55.4042 41.6710 174.8173 146 T 4.3239 8.3608 112.5406 61.6554 69.7807 174.4403 147 D 4.5824 8.4542 120.1192 54.5384 41.2743 176.4960 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 78 P 0.00 4.21 0.00 2.05 2.14 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 79 S 6.99 3.71 0.00 4.03 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 80 D 9.01 4.69 0.00 2.09 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 F 7.79 5.12 0.00 3.06 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 82 E 7.99 4.91 0.00 2.06 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 0.00 2.46 2.31 0.00 83 H 8.21 4.96 0.00 3.23 3.24 0.00 5.52 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 8.35 4.13 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 1.17 0.00 0.00 85 I 7.88 4.72 1.75 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.54 0.73 0.00 0.00 86 H 8.68 4.86 0.00 3.11 3.28 0.00 5.83 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 V 8.54 4.72 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 1.13 0.00 0.00 1.02 0.00 0.00 88 G 9.25 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 F 8.62 5.06 0.00 2.75 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 90 D 7.89 4.46 0.00 2.46 2.26 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 0.00 91 A 8.46 4.09 1.32 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 0.00 0.00 0.00 92 V 7.79 3.67 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 0.81 0.00 0.00 0.88 0.00 0.00 93 T 8.23 3.95 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 94 G 8.18 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 95 E 6.54 4.80 0.00 1.75 1.79 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 2.29 2.30 0.00 96 F 9.11 4.91 0.00 3.08 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 97 T 9.17 4.47 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 1.18 0.00 0.00 98 G 8.98 3.98 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 0.00 0.00 0.00 99 M 8.08 4.24 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.71 0.00 100 P 0.00 4.16 0.00 1.37 1.44 0.00 3.41 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 1.62 0.00 101 E 8.77 3.92 0.00 2.07 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 0.00 2.39 2.46 0.00 102 Q 8.04 4.08 0.00 2.27 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.56 2.69 0.00 103 W 8.30 4.21 0.00 3.45 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 0.00 104 A 8.35 4.05 1.42 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 0.00 0.00 0.00 105 R 7.92 3.94 0.00 1.99 2.02 0.00 3.34 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 106 L 8.17 4.03 0.00 1.73 1.41 0.57 0.37 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 0.00 107 L 8.15 3.96 0.00 1.75 1.80 0.86 0.92 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 0.00 108 Q 7.83 4.04 0.00 2.32 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.18 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 109 T 7.16 4.61 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 1.21 0.00 0.00 110 S 7.81 4.23 0.00 4.00 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 0.00 111 N 8.05 4.36 0.00 2.91 3.03 0.00 0.00 6.97 7.45 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 0.00 112 I 7.56 4.13 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.44 0.92 0.00 0.00 113 T 8.82 4.19 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 1.22 0.00 0.00 114 K 8.55 3.98 0.00 1.82 1.96 0.00 1.77 0.00 0.00 1.91 0.00 0.00 2.99 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.58 1.52 7.81 115 S 8.10 4.14 0.00 3.87 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 0.00 116 E 8.31 3.87 0.00 2.16 2.00 0.00 0.00 0.00 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 2.36 0.00 117 Q 8.19 3.99 0.00 2.28 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 7.01 0.00 0.00 0.00 0.00 0.00 2.53 2.67 0.00 118 K 8.04 3.73 0.00 1.93 1.99 0.00 1.90 0.00 0.00 1.87 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.65 7.81 119 K 8.50 4.15 0.00 1.85 1.91 0.00 1.80 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.44 7.81 120 N 7.91 4.93 0.00 2.69 2.57 0.00 0.00 7.24 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 0.00 121 P 0.00 4.23 0.00 2.05 1.35 0.00 3.53 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.32 0.00 122 Q 8.11 4.03 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.44 2.56 0.00 123 A 8.04 3.95 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.68 3.43 2.32 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 0.83 0.00 0.00 1.01 0.00 0.00 125 L 7.90 3.88 0.00 1.81 1.80 1.18 1.06 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 0.00 126 D 8.32 4.34 0.00 2.79 2.69 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 0.00 127 V 7.88 3.57 2.26 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 0.95 0.00 0.00 0.89 0.00 0.00 128 L 7.59 3.50 0.00 0.99 0.13 0.65 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 129 E 7.69 3.68 0.00 2.15 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 2.41 2.57 0.00 130 F 8.23 4.11 0.00 3.16 3.20 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 0.00 131 Y 8.15 3.76 0.00 3.16 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 0.00 132 N 8.33 4.39 0.00 3.02 3.18 0.00 0.00 7.05 8.02 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 0.00 133 S 7.97 4.16 0.00 4.01 3.98 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 0.00 134 K 7.38 3.94 0.00 1.46 1.55 0.00 1.32 0.00 0.00 0.93 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.59 0.64 7.81 135 K 7.95 3.99 0.00 1.69 1.81 0.00 1.62 0.00 0.00 1.57 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.81 1.42 7.81 136 T 7.54 4.44 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 1.28 0.00 0.00 137 S 7.39 4.80 0.00 4.02 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 0.00 138 N 8.41 4.83 0.00 2.73 2.86 0.00 0.00 7.04 7.57 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 0.00 139 S 7.98 4.21 0.00 4.02 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 Q 8.59 4.20 0.00 2.13 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.25 2.04 0.00 141 K 8.14 4.34 0.00 1.69 1.55 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.43 7.81 142 Y 8.11 4.62 0.00 2.94 2.85 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 0.00 143 M 8.77 3.88 0.00 1.91 1.94 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 2.23 1.50 0.00 144 S 8.17 4.68 0.00 3.97 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 0.00 145 F 8.50 4.83 0.00 2.99 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 0.00 146 T 8.36 4.32 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 1.25 0.00 0.00 147 D 8.45 4.58 0.00 2.68 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