NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 102 R 4.3371 8.2549 120.8600 56.2464 30.8633 174.0590 103 K 4.4316 8.2735 114.3474 52.4355 36.1828 173.3162 104 P 4.3336 0.0000 0.0000 62.6444 32.6120 176.1222 105 R 3.9325 8.3031 119.7806 56.5945 30.5624 176.5705 106 T 3.7922 8.1120 119.5045 62.4093 68.7605 172.9024 107 P 4.3370 0.0000 0.0000 61.3075 30.7217 176.0053 108 F 4.4373 7.8273 122.5471 57.6220 39.7783 176.3711 109 T 4.3127 9.4701 120.8415 63.2786 70.4525 176.3692 110 T 4.1564 8.3732 112.5964 64.7420 68.7678 176.6830 111 A 4.0053 7.8928 123.4337 54.9506 18.5665 179.3740 112 Q 3.7939 7.9495 116.0695 59.1796 28.9107 178.9335 113 L 3.7584 8.3523 120.2101 57.5896 41.4755 179.6557 114 L 4.0100 7.9170 118.9293 57.5253 41.5145 179.2535 115 A 4.0421 8.1679 120.9871 55.0471 18.2121 179.7540 116 L 3.8479 7.9824 117.9531 57.6722 41.3976 179.2875 117 E 4.1209 7.9274 119.4514 59.4166 29.5973 179.1014 118 R 4.1231 8.3459 116.2614 58.7639 29.5318 178.6556 119 K 3.8190 8.5121 121.1499 59.4373 31.9670 178.5543 120 F 4.5661 8.5398 123.8958 61.4544 39.3057 177.6384 121 R 4.2059 8.5345 122.6452 62.0092 29.2514 181.8251 122 Q 4.3639 8.0830 120.5237 58.8299 28.2049 179.1742 123 K 4.4672 7.8153 119.1348 55.7347 35.6615 175.3866 124 Q 4.1180 8.6534 123.9780 56.2736 29.0338 175.1426 125 Y 4.8189 7.7391 115.1057 55.9900 41.4916 174.5784 126 L 4.7775 8.0773 122.5286 52.6921 44.4383 177.3031 127 S 4.4752 9.2956 118.2235 57.5289 65.3853 175.6044 128 I 3.6607 8.2329 121.6706 64.5939 36.6868 178.4337 129 A 4.0128 7.9443 120.8504 55.3443 18.3055 179.3721 130 E 3.8979 8.1642 117.0885 59.5391 29.4240 179.6089 131 R 4.1516 8.1483 118.5926 59.0241 30.0435 178.4648 132 A 4.1869 7.9845 122.2888 54.4809 18.3028 179.2702 133 E 3.9078 8.5393 118.2620 59.3738 29.2695 178.8582 134 F 4.5030 8.8502 121.4314 61.2808 39.4152 177.2961 135 S 3.9636 8.3515 114.1481 61.5765 62.7067 176.6881 136 S 4.0803 7.9403 118.8013 61.2129 62.3795 176.8136 137 S 4.1725 8.1901 115.9395 60.4487 62.7038 175.4302 138 L 4.3905 6.9569 118.7245 53.1567 42.6225 175.9631 139 S 3.7452 8.0771 114.0236 59.9895 60.5663 171.2360 140 L 4.9111 8.1864 118.1988 52.3403 45.5133 177.6576 141 T 4.2488 8.9825 111.4079 61.2876 70.4740 175.5574 142 E 3.9700 8.7271 122.0883 60.1195 29.4918 179.7207 143 T 3.9524 7.9799 114.9481 66.8732 68.5383 176.1271 144 Q 4.2053 8.1078 119.7915 59.2462 28.8075 179.6130 145 V 3.7018 7.9462 118.8495 65.8745 31.6223 177.5129 146 K 3.9275 8.6383 119.8550 60.1856 31.9647 178.6521 147 I 3.9199 8.3475 120.0032 63.9346 36.9396 178.3421 148 W 3.9259 8.6425 129.5186 60.4809 30.4686 178.1538 149 F 3.9502 9.2465 118.3146 60.3283 38.2533 177.3560 150 Q 3.9777 8.6904 119.6613 59.5213 28.8767 178.3131 151 N 4.2047 8.5834 117.6566 56.2299 38.4198 177.4894 152 R 3.1884 7.5131 120.4708 58.9177 29.8160 178.7721 153 R 3.9867 8.0128 118.0516 58.9015 29.8760 178.9059 154 A 3.9281 7.5449 120.7145 54.8327 18.4715 179.5727 155 K 3.7321 7.9300 118.0556 59.6361 32.0655 178.9395 156 A 4.0752 8.0491 122.5163 55.6203 18.2892 180.0977 157 K 4.1451 7.9461 121.8474 59.8124 31.8714 182.5310 158 R 4.2449 7.9332 118.3136 59.1666 30.0672 177.3410 159 L 4.3164 7.6745 121.8463 54.9522 41.8933 176.6187 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 102 R 8.25 4.34 0.00 1.79 1.87 0.00 3.21 0.00 0.00 3.22 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 103 K 8.27 4.43 0.00 1.82 1.64 0.00 1.82 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.35 1.49 7.81 104 P 0.00 4.33 0.00 2.13 2.04 0.00 3.76 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 105 R 8.30 3.93 0.00 1.75 1.86 0.00 3.19 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 106 T 8.11 3.79 3.59 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 0.60 0.00 0.00 107 P 0.00 4.34 0.00 2.11 2.03 0.00 3.62 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.91 0.00 108 F 7.83 4.44 0.00 3.12 2.95 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 0.00 109 T 9.47 4.31 4.50 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 1.28 0.00 0.00 110 T 8.37 4.16 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 1.23 0.00 0.00 111 A 7.89 4.01 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 0.00 112 Q 7.95 3.79 0.00 2.33 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.84 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 113 L 8.35 3.76 0.00 1.80 1.71 1.04 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 114 L 7.92 4.01 0.00 1.69 1.70 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.17 4.04 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 0.00 116 L 7.98 3.85 0.00 0.54 0.13 -0.59 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 117 E 7.93 4.12 0.00 2.29 1.98 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 2.37 2.46 0.00 118 R 8.35 4.12 0.00 2.09 2.20 0.00 2.84 0.00 0.00 3.11 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.65 0.00 119 K 8.51 3.82 0.00 1.58 2.20 0.00 1.33 0.00 0.00 1.17 0.00 0.00 2.13 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.72 1.73 7.81 120 F 8.54 4.57 0.00 2.90 3.30 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 0.00 121 R 8.53 4.21 0.00 1.92 1.83 0.00 3.32 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 122 Q 8.08 4.36 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.54 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 123 K 7.82 4.47 0.00 1.70 1.61 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.67 1.40 7.81 124 Q 8.65 4.12 0.00 1.70 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.50 0.00 0.00 0.00 0.00 0.00 1.16 1.81 0.00 125 Y 7.74 4.82 0.00 2.88 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 8.08 4.78 0.00 1.36 1.42 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 127 S 9.30 4.48 0.00 3.98 3.99 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 0.00 128 I 8.23 3.66 1.87 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 1.58 1.16 0.92 0.00 0.00 129 A 7.94 4.01 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 E 8.16 3.90 0.00 2.23 1.94 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 2.29 2.29 0.00 131 R 8.15 4.15 0.00 1.93 2.07 0.00 3.13 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 132 A 7.98 4.19 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.54 3.91 0.00 2.24 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 0.00 2.35 2.34 0.00 134 F 8.85 4.50 0.00 3.06 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 0.00 135 S 8.35 3.96 0.00 4.32 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 0.00 136 S 7.94 4.08 0.00 4.02 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 0.00 137 S 8.19 4.17 0.00 4.06 4.30 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 0.00 138 L 6.96 4.39 0.00 1.42 1.50 0.76 0.04 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 0.00 139 S 8.08 3.75 0.00 3.99 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 0.00 140 L 8.19 4.91 0.00 1.48 1.72 0.80 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 141 T 8.98 4.25 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 1.23 0.00 0.00 142 E 8.73 3.97 0.00 2.06 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 0.00 2.43 2.43 0.00 143 T 7.98 3.95 4.30 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 1.27 0.00 0.00 144 Q 8.11 4.21 0.00 2.44 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.82 0.00 0.00 0.00 0.00 0.00 2.59 2.51 0.00 145 V 7.95 3.70 2.29 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 1.21 0.00 0.00 0.90 0.00 0.00 146 K 8.64 3.93 0.00 1.88 2.15 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.60 7.81 147 I 8.35 3.92 2.12 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.48 1.00 0.00 0.00 148 W 8.64 3.93 0.00 3.39 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 F 9.25 3.95 0.00 3.49 3.26 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 0.00 150 Q 8.69 3.98 0.00 2.24 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 151 N 8.58 4.20 0.00 2.49 2.59 0.00 0.00 6.76 7.68 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 0.00 152 R 7.51 3.19 0.00 0.67 0.66 0.00 2.21 0.00 0.00 2.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.50 0.00 153 R 8.01 3.99 0.00 2.13 1.96 0.00 3.15 0.00 0.00 2.87 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 154 A 7.54 3.93 1.27 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 0.00 0.00 0.00 155 K 7.93 3.73 0.00 1.67 1.68 0.00 1.51 0.00 0.00 1.43 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.20 1.33 7.81 156 A 8.05 4.08 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 K 7.95 4.15 0.00 1.87 1.74 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.35 7.81 158 R 7.93 4.24 0.00 1.89 2.01 0.00 3.09 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 159 L 7.67 4.32 0.00 1.65 1.56 0.89 0.81 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