NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 87 K 4.3278 8.1733 120.1344 55.7882 35.6385 177.9812 88 L 3.3662 7.6123 116.9569 55.1431 41.2616 176.8284 89 C 4.4389 9.1582 130.5486 63.7210 28.8370 175.5683 90 S 4.0179 8.5103 115.3363 60.4191 62.6710 173.9715 91 L 4.2132 8.3254 123.3460 53.9565 41.1461 175.6735 92 D 4.4175 9.3566 129.1851 55.4438 39.8082 173.0519 93 N 4.2910 8.2367 109.2166 53.4136 37.6138 174.0684 94 G 4.0315 9.0612 101.4025 45.8878 0.0000 174.5220 95 D 4.4844 8.2181 115.3828 54.5131 40.3238 173.2899 96 C 4.5888 8.0283 114.7356 56.5891 41.0110 173.8091 97 D 4.5223 8.6141 123.6100 57.0992 42.0947 177.2768 98 Q 4.4322 7.4721 111.8415 55.5870 30.7662 179.4106 99 F 4.6486 6.4190 127.1554 58.8080 40.2220 173.0629 100 C 5.2749 8.7651 122.1713 58.0517 34.1724 172.6244 101 H 5.1018 9.3010 122.3387 54.1099 32.7559 172.7269 102 E 4.8972 8.8827 120.9643 55.0366 30.2641 175.3726 103 E 4.3928 9.0221 125.8268 55.2091 31.0584 176.8416 104 Q 3.3127 9.0158 124.9551 57.5323 25.5670 173.2541 105 N 4.2646 8.2936 108.4943 54.3729 38.1823 173.1699 106 S 4.7262 7.5444 109.3803 55.7899 66.7494 173.6531 107 V 4.1699 8.2585 123.8053 63.0684 32.4565 175.6614 108 V 4.3479 8.9305 126.8981 61.6377 34.2575 173.6022 109 C 5.3326 8.8766 125.7115 56.5225 39.8888 172.9399 110 S 4.7939 8.7434 115.2154 57.5392 66.7697 172.1702 111 C 4.4983 8.4073 116.0242 57.3101 32.0403 174.0655 112 A 4.4418 8.5540 124.2596 51.5686 18.7390 177.2586 113 R 4.0179 8.4317 120.0520 58.1693 30.6118 176.8398 114 G 3.9541 9.4008 112.7377 45.0606 0.0000 171.9329 115 Y 5.1768 7.4764 115.9230 56.3071 41.6928 175.1347 116 T 4.6865 8.7970 117.9707 61.3264 72.1311 173.3521 117 L 4.4279 8.6912 128.4069 54.9494 42.7478 176.4523 118 A 4.2367 9.1333 128.8001 51.8867 19.3166 177.9809 119 D 4.2601 8.7509 118.6254 57.4958 40.8827 177.8131 120 N 4.5228 8.2187 113.6550 52.5240 37.5724 174.9209 121 G 4.0618 8.2087 106.9119 46.8181 0.0000 174.6324 122 K 4.5168 8.7478 117.3660 57.5943 36.2532 177.1988 123 A 4.8056 8.2917 120.6880 52.0118 20.0047 175.6691 124 C 5.1734 9.0649 117.5475 57.9982 30.7355 173.7066 125 I 4.6889 8.7029 125.2841 58.6596 39.0761 173.6447 126 P 4.4242 0.0000 0.0000 63.0847 31.7337 176.3490 127 T 4.3423 8.2291 111.3286 62.0090 69.7872 173.9489 128 G 4.1621 7.4251 109.9557 43.3881 0.0000 170.7868 129 P 4.0755 0.0000 0.0000 64.7699 31.9677 176.1988 130 Y 4.7258 7.2980 115.2654 55.6077 38.5765 173.4082 131 P 4.2434 0.0000 0.0000 62.2876 32.5914 176.6701 132 C 4.3756 8.3202 115.1800 59.6913 30.0465 174.2655 133 G 3.9779 8.9421 109.1451 45.5574 0.0000 173.1472 134 K 4.5929 7.3454 118.3601 54.1491 33.7989 176.4690 135 Q 4.2051 8.6185 123.2802 56.3487 29.3659 177.2043 136 T 4.3732 8.2163 112.7635 60.4682 67.5207 173.8708 137 L 4.4834 7.6554 127.9100 54.0750 41.1855 176.6582 138 E 4.2402 8.3081 121.1645 56.2283 29.6162 176.3423 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 87 K 8.17 4.33 0.00 1.80 2.02 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.43 1.42 7.81 88 L 7.61 3.37 0.00 2.12 0.69 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 89 C 9.16 4.44 0.00 3.15 3.02 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 90 S 8.51 4.02 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 91 L 8.33 4.21 0.00 1.59 1.78 0.92 1.13 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 92 D 9.36 4.42 0.00 2.88 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 93 N 8.24 4.29 0.00 2.99 2.80 0.00 0.00 7.57 7.91 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 94 G 9.06 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 95 D 8.22 4.48 0.00 2.84 2.78 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 0.00 0.00 0.00 96 C 8.03 4.59 0.00 3.06 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 97 D 8.61 4.52 0.00 2.75 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 Q 7.47 4.43 0.00 1.50 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.93 0.00 0.00 0.00 0.00 0.00 1.87 1.96 0.00 99 F 6.42 4.65 0.00 3.01 2.77 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 0.00 0.00 0.00 0.00 100 C 8.77 5.27 0.00 3.04 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 0.00 101 H 9.30 5.10 0.00 3.22 3.11 0.00 5.65 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 0.00 102 E 8.88 4.90 0.00 1.83 1.91 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 2.23 2.32 0.00 103 E 9.02 4.39 0.00 2.01 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 2.24 2.28 0.00 104 Q 9.02 3.31 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.84 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 105 N 8.29 4.26 0.00 2.80 2.85 0.00 0.00 7.04 7.63 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 0.00 106 S 7.54 4.73 0.00 4.06 3.68 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 0.00 107 V 8.26 4.17 2.09 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 0.74 0.00 0.00 0.94 0.00 0.00 108 V 8.93 4.35 2.12 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 0.94 0.00 0.00 1.07 0.00 0.00 109 C 8.88 5.33 0.00 2.96 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 0.00 110 S 8.74 4.79 0.00 4.00 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 0.00 111 C 8.41 4.50 0.00 2.81 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 0.00 112 A 8.55 4.44 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 R 8.43 4.02 0.00 1.87 1.93 0.00 3.24 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 1.65 1.68 0.00 114 G 9.40 3.95 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 0.00 0.00 0.00 115 Y 7.48 5.18 0.00 2.88 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 0.00 116 T 8.80 4.69 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 0.00 117 L 8.69 4.43 0.00 1.64 1.60 0.99 1.11 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 0.00 118 A 9.13 4.24 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.75 4.26 0.00 2.68 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.22 4.52 0.00 2.80 2.92 0.00 0.00 5.98 7.00 0.00 0.00 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 G 8.21 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 0.00 0.00 0.00 122 K 8.75 4.52 0.00 1.76 1.89 0.00 1.66 0.00 0.00 1.89 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.58 7.81 123 A 8.29 4.81 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 0.00 124 C 9.06 5.17 0.00 2.50 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 0.00 125 I 8.70 4.69 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.76 0.92 0.00 0.00 126 P 0.00 4.42 0.00 2.00 1.71 0.00 3.79 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.94 0.00 127 T 8.23 4.34 4.19 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 1.21 0.00 0.00 128 G 7.43 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 0.00 0.00 0.00 0.00 129 P 0.00 4.08 0.00 1.64 2.01 0.00 3.68 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.00 0.00 130 Y 7.30 4.73 0.00 2.97 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 0.00 131 P 0.00 4.24 0.00 1.85 1.74 0.00 3.66 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.85 0.00 132 C 8.32 4.38 0.00 3.19 3.05 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 0.00 133 G 8.94 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 0.00 134 K 7.35 4.59 0.00 1.89 1.77 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.60 7.81 135 Q 8.62 4.21 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.38 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 136 T 8.22 4.37 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 137 L 7.66 4.48 0.00 1.66 1.68 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.31 4.24 0.00 1.98 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 2.28 2.35 0.00