NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 106 S 4.4326 8.1927 116.7899 58.6674 65.8411 175.3989 107 E 3.7180 7.8410 120.7453 58.2894 29.8281 175.9688 108 E 3.8112 8.1746 119.3396 59.3686 30.0960 178.1220 109 S 3.9960 7.9723 112.4829 61.0262 62.3005 175.6410 110 L 4.0046 8.1010 123.6293 57.6822 41.8431 178.6238 111 K 3.9598 7.8544 119.2845 59.7739 31.9377 178.5730 112 H 4.2634 8.2215 116.2338 58.6979 28.5779 177.6063 113 A 4.0614 7.8647 122.4883 55.2152 18.2300 179.8351 114 T 3.8334 8.1432 114.5340 66.6790 68.6211 176.8616 115 R 3.9035 8.2198 120.7310 59.4236 29.9959 178.6464 116 I 3.7087 7.5034 119.6153 64.3877 37.1916 178.3489 117 I 3.7237 7.6923 120.5382 64.7552 36.9354 178.2483 118 D 4.4311 8.5157 119.8333 57.2989 40.5422 178.6466 119 E 3.9538 8.1568 119.7022 58.9719 29.6512 178.8105 120 V 3.6137 7.5694 118.5642 65.9593 31.4962 178.1995 121 V 3.6754 7.7504 117.7206 66.2969 31.3468 178.2267 122 S 4.1291 8.4115 115.1980 61.3606 62.5324 176.5716 123 K 3.9217 8.5928 122.8624 59.5107 31.8940 178.6814 124 F 4.2638 8.2649 120.9592 61.3433 39.3316 177.1795 125 L 3.6358 8.2729 118.8703 57.4471 41.3267 179.2781 126 D 4.2620 8.2914 119.2582 57.6105 40.8589 178.5092 127 D 4.3480 8.2396 119.5510 57.2914 40.8746 178.7421 128 L 3.9074 7.7400 121.1362 57.7370 41.9749 179.1725 129 G 3.5666 8.0341 105.8486 47.1075 0.0000 175.4337 130 N 4.1611 8.0138 119.2012 56.7200 39.0350 176.8070 131 A 4.0694 7.9385 122.1484 55.1159 18.3253 179.5426 132 K 3.8883 7.9673 118.0832 59.4094 32.2497 179.3403 133 S 4.0651 8.0702 114.8069 61.6789 62.9074 175.8622 134 H 4.0508 8.0232 119.8979 58.7491 28.4385 177.3840 135 L 3.8983 8.1209 120.3635 58.4076 41.4823 179.7899 136 M 4.1253 8.3182 118.5484 58.3251 31.6656 178.6093 137 S 4.0836 8.2799 112.5381 61.5523 62.8588 176.0206 138 L 3.9318 8.0819 121.7658 57.6566 41.2299 178.8147 139 Y 4.2198 8.3309 120.1395 60.8926 38.6259 178.4370 140 S 4.2254 8.6909 113.5170 61.0684 63.0285 175.7069 141 A 4.2016 7.7066 122.5529 54.0709 18.1820 177.7160 142 C 4.4204 8.0032 113.8807 62.1057 29.6553 176.6991 143 S 3.5862 6.5807 115.6371 61.2172 63.2535 175.6924 *151 V 4.0242 7.7275 117.8338 62.2083 32.8452 176.2049 152 D 4.3999 7.8019 118.2214 58.3992 41.2449 177.8573 153 Q 4.0732 7.9626 118.0269 58.4895 28.8496 178.6187 154 K 3.9179 8.0131 120.3879 59.5454 32.4315 178.3274 155 F 4.1405 8.3301 120.9105 61.3505 39.2609 176.6380 156 Q 3.8852 8.2046 119.0789 59.4041 28.6029 178.6029 157 S 4.0886 7.7280 114.5673 61.6726 63.0573 176.4453 158 I 3.7492 7.7127 122.3166 64.4097 36.8511 178.6001 159 V 3.3329 7.7685 119.2327 66.0325 31.0462 177.8726 160 I 3.7514 7.5496 118.5344 64.3900 37.0496 177.8748 161 G 3.7275 7.5970 103.7539 45.1108 0.0000 173.3587 162 C 4.4683 7.2691 118.6944 57.9812 29.7107 173.5933 163 A 4.0932 8.3034 125.3828 52.1612 18.9444 178.2612 164 L 3.9036 8.7465 122.6109 58.5857 41.7902 179.2468 165 E 3.9280 8.2717 118.3540 59.5274 29.4078 178.2712 166 D 4.4304 8.2254 118.5974 56.8257 40.8984 178.7558 167 Q 4.0115 7.8568 118.4835 58.7677 28.7936 178.5240 168 K 4.0529 8.2903 119.6908 59.1672 32.0158 179.5571 169 K 4.0054 7.8099 118.7765 59.5301 32.0143 179.4640 170 I 3.7781 7.7956 120.0160 64.2014 37.0517 178.2748 171 K 4.0513 8.4441 120.9002 59.7688 32.0229 178.7574 172 R 3.9631 8.5650 119.3006 59.3957 29.9619 178.4580 173 R 3.9240 8.3257 118.7400 59.3378 30.0237 178.5325 174 L 4.0397 8.0268 118.8425 57.6393 41.5984 179.2594 175 E 3.5921 8.1574 118.4906 59.6435 29.4451 179.3282 176 T 3.8180 7.9101 115.5677 66.9295 68.5047 176.6069 177 L 4.0830 8.3189 120.9334 57.8025 41.6926 179.6785 178 L 3.9283 7.9837 119.1067 57.6197 41.5853 179.7323 179 R 3.9412 7.9020 118.2956 58.9750 29.9941 178.6187 180 N 4.2795 8.5236 116.7838 56.5705 38.6720 177.3748 181 I 3.7284 8.0007 119.9740 63.9825 38.0367 177.3763 182 D 4.3577 8.0259 118.5967 57.0360 41.0900 177.7828 183 N 4.4843 8.0332 116.7985 55.8857 38.3589 177.6023 184 S 4.2318 7.8554 116.2980 61.3011 63.1316 175.9502 185 D 4.4196 8.1700 120.8337 57.3750 40.9114 178.2505 186 K 3.9089 7.9301 118.2904 59.3051 32.1869 178.0954 187 A 4.4024 7.7146 119.2713 53.0273 18.4792 177.2786 188 I 4.1662 7.5789 118.4773 60.0800 36.7295 176.1143 189 K 4.2064 8.4317 123.9377 56.3386 32.2316 176.6969 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 106 S 8.19 4.43 0.00 3.89 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 0.00 107 E 7.84 3.72 0.00 2.10 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 2.36 2.41 0.00 108 E 8.17 3.81 0.00 2.03 1.85 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 2.15 2.30 0.00 109 S 7.97 4.00 0.00 3.88 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 0.00 110 L 8.10 4.00 0.00 1.88 1.81 0.92 0.65 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 0.00 111 K 7.85 3.96 0.00 1.94 1.96 0.00 1.59 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.57 7.81 112 H 8.22 4.26 0.00 3.44 3.31 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 A 7.86 4.06 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 0.00 114 T 8.14 3.83 4.42 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 1.27 0.00 0.00 115 R 8.22 3.90 0.00 1.96 2.10 0.00 3.08 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 116 I 7.50 3.71 2.00 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 1.52 0.78 0.91 0.00 0.00 117 I 7.69 3.72 2.03 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 1.52 1.19 0.92 0.00 0.00 118 D 8.52 4.43 0.00 2.80 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.16 3.95 0.00 2.08 2.06 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 2.32 2.32 0.00 120 V 7.57 3.61 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 0.94 0.00 0.00 0.98 0.00 0.00 121 V 7.75 3.68 2.28 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 1.14 0.00 0.00 1.00 0.00 0.00 122 S 8.41 4.13 0.00 4.04 3.91 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 0.00 0.00 0.00 123 K 8.59 3.92 0.00 1.90 2.15 0.00 1.54 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.56 7.81 124 F 8.26 4.26 0.00 3.17 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 0.00 125 L 8.27 3.64 0.00 1.81 1.62 0.93 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.29 4.26 0.00 2.91 2.68 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 0.00 127 D 8.24 4.35 0.00 2.74 2.70 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 0.00 128 L 7.74 3.91 0.00 1.05 1.45 0.69 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.03 3.57 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 0.00 0.00 0.00 130 N 8.01 4.16 0.00 3.05 2.81 0.00 0.00 6.96 7.93 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 0.00 131 A 7.94 4.07 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 0.00 132 K 7.97 3.89 0.00 1.90 1.91 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.39 7.81 133 S 8.07 4.07 0.00 4.04 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 0.00 134 H 8.02 4.05 0.00 3.38 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.12 3.90 0.00 1.78 1.69 0.88 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 136 M 8.32 4.13 0.00 2.05 2.29 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.65 0.00 137 S 8.28 4.08 0.00 3.80 4.18 0.00 0.00 0.00 0.00 0.00 0.00 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 8.08 3.93 0.00 1.60 0.80 0.49 0.36 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 0.00 139 Y 8.33 4.22 0.00 3.10 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 0.00 140 S 8.69 4.23 0.00 4.02 4.08 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 0.00 141 A 7.71 4.20 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 C 8.00 4.42 0.00 2.89 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 S 6.58 3.59 0.00 3.68 3.69 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 *151 V 7.73 4.02 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 1.01 0.00 0.00 0.94 0.00 0.00 152 D 7.80 4.40 0.00 2.77 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 7.96 4.07 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.69 0.00 0.00 0.00 0.00 0.00 2.47 2.37 0.00 154 K 8.01 3.92 0.00 1.86 1.87 0.00 1.77 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.57 1.53 7.81 155 F 8.33 4.14 0.00 3.35 3.22 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 0.00 156 Q 8.20 3.89 0.00 2.30 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.56 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 157 S 7.73 4.09 0.00 4.07 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 I 7.71 3.75 1.72 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.14 0.79 0.00 0.00 159 V 7.77 3.33 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 0.90 0.00 0.00 0.12 0.00 0.00 160 I 7.55 3.75 2.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.88 0.88 0.00 0.00 161 G 7.60 3.73 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 0.00 0.00 0.00 162 C 7.27 4.47 0.00 3.04 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 0.00 163 A 8.30 4.09 1.25 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 0.00 0.00 0.00 164 L 8.75 3.90 0.00 1.75 1.69 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 165 E 8.27 3.93 0.00 2.11 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 2.38 2.48 0.00 166 D 8.23 4.43 0.00 2.95 2.68 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 0.00 167 Q 7.86 4.01 0.00 2.24 2.12 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 2.50 2.68 0.00 168 K 8.29 4.05 0.00 1.82 1.87 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.64 7.81 169 K 7.81 4.01 0.00 1.95 1.88 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.61 7.81 170 I 7.80 3.78 2.07 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.03 1.14 0.00 0.00 171 K 8.44 4.05 0.00 2.02 2.05 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.76 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.67 1.48 7.81 172 R 8.57 3.96 0.00 2.04 2.18 0.00 3.36 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 173 R 8.33 3.92 0.00 2.07 2.07 0.00 3.18 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 174 L 8.03 4.04 0.00 2.28 1.79 0.90 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 175 E 8.16 3.59 0.00 2.14 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 2.18 2.76 0.00 176 T 7.91 3.82 4.40 0.00 0.00 0.00 0.00 0.00 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 0.00 177 L 8.32 4.08 0.00 1.79 1.69 0.92 0.59 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 0.00 178 L 7.98 3.93 0.00 1.65 1.58 0.58 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 179 R 7.90 3.94 0.00 2.02 1.94 0.00 3.11 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 180 N 8.52 4.28 0.00 2.94 2.86 0.00 0.00 6.65 7.27 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 0.00 181 I 8.00 3.73 1.93 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.32 0.94 0.00 0.00 182 D 8.03 4.36 0.00 2.91 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 0.00 183 N 8.03 4.48 0.00 3.01 2.85 0.00 0.00 6.90 6.59 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 0.00 184 S 7.86 4.23 0.00 4.09 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 0.00 185 D 8.17 4.42 0.00 2.85 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 0.00 186 K 7.93 3.91 0.00 1.85 1.93 0.00 1.86 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.47 7.81 187 A 7.71 4.40 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 0.00 188 I 7.58 4.17 2.09 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.27 0.99 0.00 0.00 189 K 8.43 4.21 0.00 1.73 1.69 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.15 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.41 7.81 * Residues marked with a * may have inaccurate shift predictions.