NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 112 D 4.5928 8.2233 120.1883 53.8918 41.3696 175.5208 113 N 4.1492 8.5955 121.9036 54.1596 39.1303 173.9268 114 L 4.9567 7.4431 124.5160 54.1341 45.5399 174.9405 115 E 3.8575 7.7547 119.2385 59.8896 29.6706 178.5166 116 Q 4.0307 8.1147 117.5337 58.4338 28.8011 178.4330 117 K 3.8902 8.5817 121.0452 59.4648 32.3040 178.7976 118 I 3.6205 7.6143 120.0471 64.5676 37.0823 178.4460 119 L 4.0039 7.9326 119.6083 57.8197 41.4284 179.4420 120 Q 3.9724 8.4417 120.0130 59.0126 28.9768 178.4185 121 V 3.6003 8.2847 119.8462 65.9268 31.6091 178.0877 122 L 4.0373 8.0359 118.7780 57.8354 41.2278 179.6250 123 S 4.1537 7.9466 114.1168 61.7972 62.8653 176.2631 124 D 4.4886 7.9790 120.3374 57.2375 40.6254 178.0081 125 D 4.4551 7.8261 117.7729 56.5308 41.4257 177.6747 126 G 4.0290 8.5263 106.0702 45.0398 0.0000 172.3330 127 G 4.4835 7.9876 105.8139 43.6859 0.0000 170.2843 128 P 4.8605 0.0000 0.0000 62.8114 32.2819 175.9537 129 V 4.6268 9.2695 123.8410 60.6707 34.2601 174.9237 130 A 3.9974 8.7234 130.6340 51.7194 19.2269 177.8982 131 I 3.7968 8.5998 121.7834 64.3625 37.8889 178.4512 132 F 4.3508 8.1849 121.0692 61.2149 39.3066 177.0391 133 Q 3.8821 8.0820 117.3873 58.7857 28.3504 178.7265 134 L 3.9864 7.7307 119.7134 57.3124 41.6359 179.4023 135 V 3.4653 7.6257 118.3480 66.0500 31.2907 178.3216 136 K 3.7493 7.3328 116.6471 59.1769 31.8350 179.2361 137 K 4.0868 7.6902 118.0191 59.2060 32.2412 178.5967 138 C 4.2602 8.1797 115.0412 59.2347 28.7540 173.5648 139 Q 3.5294 8.2126 118.4663 56.8500 26.3463 173.4511 140 V 4.5041 7.4074 114.0303 59.3794 35.4643 173.3991 141 P 4.4052 0.0000 0.0000 62.2585 33.1662 177.2807 142 K 3.8224 8.7597 121.6220 59.8245 31.9838 178.8076 143 K 3.8728 8.0608 118.9126 60.0512 32.0273 178.5444 144 T 4.0643 7.9048 115.3089 66.6550 68.3406 176.4788 145 L 3.9050 7.8024 120.4015 57.8580 41.5993 179.2457 146 N 4.2862 8.6320 116.7426 56.3492 38.3598 177.1748 147 Q 4.0268 8.5233 119.8884 59.3465 28.7999 179.6136 148 V 3.6235 7.3901 118.7796 65.5066 31.4867 178.1189 149 L 3.4534 8.1582 119.0582 57.9128 41.3080 179.1288 150 Y 4.0955 8.0522 116.8633 60.8400 37.7962 178.7372 151 R 3.9013 7.8592 119.8803 59.4743 30.1715 178.4890 152 L 4.0474 8.3209 121.5862 58.4367 41.7473 180.3040 153 K 4.4406 8.3453 125.1855 59.2899 31.4558 180.8432 154 K 4.3705 8.0439 119.4956 58.5263 32.1883 177.7677 155 E 4.3825 7.7836 116.7169 55.5929 29.5704 175.8492 156 D 4.5508 7.6525 117.1627 55.5835 39.0415 174.7910 157 R 4.5151 8.3179 119.8171 57.0724 31.9208 176.3719 158 V 5.4016 7.8743 110.8330 59.0103 36.9816 173.7851 159 S 4.7392 9.1303 115.2757 57.0699 67.0807 173.1973 160 S 4.8093 8.4955 115.0644 54.5699 62.2594 171.6283 161 P 4.3262 0.0000 0.0000 64.9481 31.7459 176.7412 162 S 4.5810 7.4403 111.4271 55.5888 65.8883 171.2891 163 P 4.3396 0.0000 0.0000 64.3834 31.4110 177.2224 164 K 4.1039 8.8462 120.1678 56.6726 29.9065 174.8245 165 Y 5.1575 7.5626 116.6635 56.0365 41.2521 174.8141 166 W 5.5436 9.0221 120.7463 55.5061 34.1626 174.2657 167 S 5.0006 9.0491 115.9093 56.8836 66.3807 173.2125 168 I 4.0427 8.2818 121.4199 62.1570 38.6711 176.0027 169 G 4.0516 8.6213 115.6818 45.8479 0.0000 173.1671 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 112 D 8.22 4.59 0.00 2.68 2.63 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 0.00 0.00 0.00 0.00 113 N 8.60 4.15 0.00 2.81 2.85 0.00 0.00 7.02 6.97 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 0.00 114 L 7.44 4.96 0.00 1.66 1.56 0.87 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 115 E 7.75 3.86 0.00 2.04 1.90 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 2.34 2.37 0.00 116 Q 8.11 4.03 0.00 2.37 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.69 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 117 K 8.58 3.89 0.00 1.79 1.89 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.45 7.81 118 I 7.61 3.62 1.95 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.91 0.78 0.00 0.00 119 L 7.93 4.00 0.00 1.68 1.71 0.96 0.60 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 0.00 120 Q 8.44 3.97 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.55 0.00 121 V 8.28 3.60 2.23 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 0.97 0.00 0.00 0.98 0.00 0.00 122 L 8.04 4.04 0.00 1.76 1.74 0.97 0.80 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 0.00 123 S 7.95 4.15 0.00 4.01 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 0.00 124 D 7.98 4.49 0.00 2.66 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.83 4.46 0.00 2.72 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 0.00 126 G 8.53 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 0.00 127 G 7.99 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.86 0.00 2.09 2.03 0.00 3.72 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.85 0.00 129 V 9.27 4.63 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 1.00 0.00 0.00 1.12 0.00 0.00 130 A 8.72 4.00 1.09 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 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.60 3.80 2.13 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.27 1.01 0.00 0.00 132 F 8.18 4.35 0.00 3.08 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 0.00 133 Q 8.08 3.88 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.59 0.00 0.00 0.00 0.00 0.00 2.44 2.59 0.00 134 L 7.73 3.99 0.00 1.80 1.63 0.87 0.84 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 0.00 135 V 7.63 3.47 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 1.10 0.00 0.00 1.05 0.00 0.00 136 K 7.33 3.75 0.00 1.49 1.66 0.00 1.60 0.00 0.00 1.50 0.00 0.00 2.56 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.99 0.52 7.81 137 K 7.69 4.09 0.00 1.72 1.81 0.00 1.50 0.00 0.00 1.93 0.00 0.00 3.26 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.48 7.81 138 C 8.18 4.26 0.00 2.92 2.92 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 0.00 139 Q 8.21 3.53 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.69 0.00 0.00 0.00 0.00 0.00 2.33 2.23 0.00 140 V 7.41 4.50 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 0.82 0.00 0.00 0.95 0.00 0.00 141 P 0.00 4.41 0.00 2.20 1.97 0.00 3.66 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 2.11 2.15 0.00 142 K 8.76 3.82 0.00 1.88 1.87 0.00 1.80 0.00 0.00 1.80 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.59 1.61 7.81 143 K 8.06 3.87 0.00 1.87 1.80 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.55 7.81 144 T 7.90 4.06 4.35 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 1.18 0.00 0.00 145 L 7.80 3.90 0.00 1.83 1.55 0.94 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 146 N 8.63 4.29 0.00 3.00 3.08 0.00 0.00 7.06 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 Q 8.52 4.03 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.83 0.00 0.00 0.00 0.00 0.00 2.40 2.60 0.00 148 V 7.39 3.62 1.96 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 1.04 0.00 0.00 0.97 0.00 0.00 149 L 8.16 3.45 0.00 0.78 0.13 -0.11 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 150 Y 8.05 4.10 0.00 3.19 3.12 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 0.00 151 R 7.86 3.90 0.00 1.94 2.08 0.00 3.11 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 152 L 8.32 4.05 0.00 1.81 1.69 0.83 0.85 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 0.00 153 K 8.35 4.44 0.00 1.74 1.82 0.00 1.79 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.18 7.81 154 K 8.04 4.37 0.00 1.98 2.03 0.00 1.79 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.54 7.81 155 E 7.78 4.38 0.00 2.16 1.97 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 2.32 2.51 0.00 156 D 7.65 4.55 0.00 2.88 2.80 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 0.00 157 R 8.32 4.52 0.00 1.75 1.96 0.00 3.08 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.79 0.00 158 V 7.87 5.40 2.35 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 0.97 0.00 0.00 1.09 0.00 0.00 159 S 9.13 4.74 0.00 3.82 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 0.00 160 S 8.50 4.81 0.00 2.72 3.09 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 0.00 0.00 0.00 0.00 161 P 0.00 4.33 0.00 2.12 2.10 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.91 0.00 162 S 7.44 4.58 0.00 3.96 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 P 0.00 4.34 0.00 2.09 2.07 0.00 3.77 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 164 K 8.85 4.10 0.00 1.87 1.86 0.00 1.60 0.00 0.00 1.83 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.47 7.81 165 Y 7.56 5.16 0.00 2.99 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 0.00 166 W 9.02 5.54 0.00 3.25 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 9.05 5.00 0.00 3.90 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 0.00 168 I 8.28 4.04 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.71 0.93 0.00 0.00 169 G 8.62 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 0.00 0.00 0.00