NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 56 N 4.9251 8.2676 118.0764 53.5598 39.3560 172.2197 57 T 5.0523 7.6164 111.4177 59.3254 73.6701 172.4436 58 I 4.8774 8.7615 122.4313 59.5911 41.7168 175.8142 59 R 4.7022 8.1310 127.4734 55.2274 32.0161 175.1967 60 V 4.7268 8.3955 125.2280 61.2207 34.8188 174.3808 61 F 4.6962 9.2171 127.2747 56.9557 40.2329 174.7969 62 L 5.1729 8.8882 120.9015 52.0128 46.2646 174.2834 63 P 4.2773 0.0000 0.0000 62.9122 32.2243 175.3163 64 N 4.1211 9.1454 116.3175 55.5900 37.3647 173.8253 65 K 3.8720 8.1358 109.9037 57.7972 30.0764 174.5878 66 Q 4.9573 7.5599 114.8654 54.5649 32.4440 175.8421 67 R 4.9840 8.1460 115.2186 55.8556 32.3544 173.7770 68 T 4.6786 8.7109 113.7974 60.7263 71.6023 172.2691 69 V 4.8155 8.2568 124.2290 61.0943 34.0925 174.9387 70 V 4.6694 8.5598 120.4157 59.3914 34.9763 175.1690 71 R 4.6978 8.4956 119.8197 55.6475 31.0385 175.6226 72 V 4.4230 8.4625 120.9974 61.2868 33.9482 174.9068 73 R 4.5489 8.4256 126.4163 53.8881 31.9205 175.1344 74 N 4.3979 8.7417 120.4466 55.3497 39.2010 173.3868 75 G 4.2073 9.1000 113.9376 46.4730 0.0000 174.3852 76 M 4.2856 8.1602 119.5199 55.1229 32.6727 176.4008 77 S 4.9837 9.3821 118.3812 57.2474 66.0349 175.1991 78 L 3.9925 8.8293 123.7482 58.7488 41.7921 178.5067 79 H 4.4407 8.5387 118.1102 59.3689 29.5797 176.9685 80 D 4.3241 8.2450 120.4546 57.5375 40.7761 178.3516 81 C 4.2926 8.0572 113.6905 60.6263 29.9607 174.9855 82 L 4.4454 7.8380 119.7460 55.4889 41.7883 178.2096 83 M 3.8774 7.7619 118.7687 58.5107 32.0846 178.2293 84 K 3.9561 7.9159 118.1493 59.4123 32.0313 179.3790 85 K 4.0352 7.9476 118.3157 59.2327 31.9787 179.3576 86 L 4.0435 8.0923 119.5725 57.4508 41.5545 179.3300 87 K 3.9157 8.1944 119.7269 59.6172 32.0313 179.0765 88 V 3.8227 7.8247 110.1577 63.2310 31.5541 176.9559 89 R 4.4799 7.2913 117.8318 55.1813 30.3406 175.9806 90 G 3.9177 7.9261 105.0261 46.4287 0.0000 173.9412 91 L 4.4937 8.2089 120.6043 53.0834 42.0626 176.4723 92 Q 4.3247 8.5591 124.1052 53.8295 29.8418 175.4068 93 P 3.8398 0.0000 0.0000 65.0365 31.3130 178.0763 94 E 4.0723 7.9286 115.7636 58.3723 29.7823 176.9943 95 C 4.7119 8.3815 117.0948 59.7093 28.7399 172.4925 96 C 5.5109 7.9520 116.5573 57.9526 31.4496 173.3490 97 A 4.7640 9.0250 124.0893 50.3897 21.3098 176.2741 98 V 4.7134 7.2992 119.1648 59.7593 34.5028 174.5441 99 F 5.3268 9.0394 121.4242 55.6433 43.3288 173.9821 100 R 4.6877 8.8520 119.2577 55.2680 31.3989 175.3691 101 L 4.3888 8.5325 122.9610 54.4915 42.6814 177.1849 102 L 4.3667 8.7628 125.4407 53.5759 40.9268 177.1821 103 H 4.3167 8.4957 121.5152 58.4207 29.2300 177.3091 104 E 4.0528 8.2737 118.2724 59.0085 30.0555 177.2951 105 H 4.6793 8.0277 116.8049 56.0707 28.4611 174.7407 106 K 3.8725 9.1122 112.9973 57.2529 30.9337 175.2242 107 G 3.9018 8.2895 103.2239 44.1779 0.0000 173.9955 108 K 3.8944 7.7454 120.7146 55.8087 33.4239 175.0375 109 K 4.8395 8.5415 125.8526 55.2110 33.5562 175.6094 110 A 4.8008 8.9160 127.3099 49.8619 21.2281 175.6687 111 R 3.8467 8.8287 123.8499 56.3395 30.8021 175.6193 112 L 4.7225 8.1925 125.6980 52.4617 44.8835 176.0242 113 D 4.3478 8.3380 121.2190 53.6771 42.0902 177.3290 114 W 4.2720 8.7906 125.9025 59.7222 29.2135 177.0586 115 N 4.7320 8.5351 113.3433 52.9630 37.2557 175.3072 116 T 3.9330 7.8047 116.8050 63.6174 69.0545 173.1974 117 D 4.6091 8.5478 124.5182 54.3180 41.8530 176.7561 118 A 4.1384 9.1069 129.1704 55.0629 18.3651 179.2366 119 A 3.9215 8.0933 118.9127 55.6654 18.1443 179.8207 120 S 4.1888 8.2276 112.5229 60.8598 63.0760 175.8314 121 L 4.5398 7.7975 120.2893 53.3321 41.8310 176.2310 122 I 3.9245 6.9728 120.8771 62.6744 37.4076 176.8818 123 G 4.0210 8.5885 112.5839 45.5391 0.0000 173.7542 124 E 4.3180 8.2661 120.0264 56.2969 31.1669 175.4978 125 E 5.0974 8.7794 121.4079 54.8092 32.2257 175.2047 126 L 5.3435 9.0474 124.0398 52.9963 45.8353 175.0778 127 Q 5.1404 9.2196 121.2250 54.5211 32.4813 173.8081 128 V 4.9456 9.0716 126.3195 61.3919 33.4716 174.4580 129 D 5.0204 9.2731 126.7113 52.2182 45.2437 175.1490 130 F 4.7844 8.5546 119.3802 57.1887 40.0423 175.7134 131 L 4.2898 8.8968 121.6908 55.2839 41.3844 177.0940 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 56 N 8.27 4.93 0.00 2.74 2.85 0.00 0.00 6.50 6.17 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 57 T 7.62 5.05 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 1.20 0.00 0.00 58 I 8.76 4.88 1.86 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 1.29 0.74 0.92 0.00 0.00 59 R 8.13 4.70 0.00 1.88 1.69 0.00 3.00 0.00 0.00 2.81 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 1.33 0.00 60 V 8.40 4.73 2.02 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 1.02 0.00 0.00 0.91 0.00 0.00 61 F 9.22 4.70 0.00 3.16 2.99 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 0.00 0.00 0.00 62 L 8.89 5.17 0.00 1.68 1.52 0.92 1.25 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 63 P 0.00 4.28 0.00 1.96 2.08 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.82 0.00 64 N 9.15 4.12 0.00 2.92 2.93 0.00 0.00 7.16 6.68 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 65 K 8.14 3.87 0.00 1.94 1.88 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.48 7.81 66 Q 7.56 4.96 0.00 2.19 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.62 0.00 0.00 0.00 0.00 0.00 2.31 2.54 0.00 67 R 8.15 4.98 0.00 1.38 1.84 0.00 3.00 0.00 0.00 3.04 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 68 T 8.71 4.68 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 1.17 0.00 0.00 69 V 8.26 4.82 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 0.85 0.00 0.00 0.85 0.00 0.00 70 V 8.56 4.67 2.15 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 0.72 0.00 0.00 0.93 0.00 0.00 71 R 8.50 4.70 0.00 1.81 1.91 0.00 2.97 0.00 0.00 3.15 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 72 V 8.46 4.42 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 0.82 0.00 0.00 0.93 0.00 0.00 73 R 8.43 4.55 0.00 1.94 1.81 0.00 3.25 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 74 N 8.74 4.40 0.00 2.68 2.76 0.00 0.00 7.32 7.98 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 75 G 9.10 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 0.00 0.00 0.00 0.00 76 M 8.16 4.29 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.48 0.00 77 S 9.38 4.98 0.00 4.06 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.83 3.99 0.00 1.86 1.97 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 79 H 8.54 4.44 0.00 3.56 3.40 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 D 8.24 4.32 0.00 2.89 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 81 C 8.06 4.29 0.00 3.32 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 82 L 7.84 4.45 0.00 2.04 1.84 1.18 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 83 M 7.76 3.88 0.00 2.04 1.90 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.52 0.00 84 K 7.92 3.96 0.00 1.82 1.82 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.50 7.81 85 K 7.95 4.04 0.00 1.86 1.85 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.46 7.81 86 L 8.09 4.04 0.00 1.74 1.90 0.68 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 87 K 8.19 3.92 0.00 1.86 1.92 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.47 7.81 88 V 7.82 3.82 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 0.78 0.00 0.00 1.02 0.00 0.00 89 R 7.29 4.48 0.00 1.71 1.94 0.00 3.44 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 90 G 7.93 3.92 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 0.00 0.00 0.00 91 L 8.21 4.49 0.00 1.61 1.63 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 8.56 4.32 0.00 2.13 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 93 P 0.00 3.84 0.00 0.90 0.49 0.00 3.19 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.48 0.00 94 E 7.93 4.07 0.00 2.07 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 0.00 2.27 2.25 0.00 95 C 8.38 4.71 0.00 3.24 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.95 5.51 0.00 3.09 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 97 A 9.02 4.76 1.04 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 0.00 0.00 98 V 7.30 4.71 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 -0.66 0.00 0.00 0.62 0.00 0.00 99 F 9.04 5.33 0.00 2.89 2.87 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.85 4.69 0.00 1.87 2.03 0.00 2.74 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 101 L 8.53 4.39 0.00 1.50 1.59 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 102 L 8.76 4.37 0.00 1.70 1.68 0.88 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 103 H 8.50 4.32 0.00 3.16 3.35 0.00 5.70 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.27 4.05 0.00 1.87 1.87 0.00 0.00 0.00 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 2.27 0.00 105 H 8.03 4.68 0.00 3.18 3.27 0.00 5.77 0.00 0.00 0.00 0.00 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 K 9.11 3.87 0.00 1.80 1.81 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.32 1.46 7.81 107 G 8.29 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 0.00 108 K 7.75 3.89 0.00 1.90 1.82 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.46 7.81 109 K 8.54 4.84 0.00 1.38 1.27 0.00 1.26 0.00 0.00 1.40 0.00 0.00 2.42 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 1.21 7.81 110 A 8.92 4.80 1.23 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 0.00 111 R 8.83 3.85 0.00 1.61 1.67 0.00 2.80 0.00 0.00 3.03 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.73 0.00 112 L 8.19 4.72 0.00 1.14 1.31 0.80 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 113 D 8.34 4.35 0.00 2.62 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 W 8.79 4.27 0.00 3.45 3.23 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 0.00 115 N 8.54 4.73 0.00 2.87 2.97 0.00 0.00 6.05 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 0.00 116 T 7.80 3.93 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 1.18 0.00 0.00 117 D 8.55 4.61 0.00 2.62 2.59 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 0.00 0.00 0.00 0.00 118 A 9.11 4.14 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.09 3.92 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.23 4.19 0.00 4.09 3.94 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 0.00 121 L 7.80 4.54 0.00 1.76 1.65 0.88 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 122 I 6.97 3.92 1.87 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 1.23 0.62 0.91 0.00 0.00 123 G 8.59 4.02 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 0.00 124 E 8.27 4.32 0.00 2.01 1.88 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 2.39 2.43 0.00 125 E 8.78 5.10 0.00 2.15 2.17 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 2.50 2.47 0.00 126 L 9.05 5.34 0.00 1.55 1.59 0.87 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 9.22 5.14 0.00 2.15 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.78 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 128 V 9.07 4.95 2.14 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 0.99 0.00 0.00 1.08 0.00 0.00 129 D 9.27 5.02 0.00 2.82 2.59 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 0.00 0.00 0.00 0.00 130 F 8.55 4.78 0.00 3.11 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.90 4.29 0.00 1.85 1.68 1.02 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00