NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3395 8.2644 123.5843 52.6078 19.9712 177.4861 3 R 4.2689 7.7821 122.2624 57.5311 32.0205 174.2136 4 K 3.9128 8.4016 120.9499 59.5798 32.6889 177.7080 5 A 4.0343 8.0913 120.3475 55.4929 18.2848 179.4732 6 L 4.0731 7.7316 116.3376 57.7203 41.3540 179.5553 7 I 3.7843 7.8511 113.1258 63.8245 37.3848 177.9433 8 E 4.0041 8.0572 119.5243 58.3911 29.5588 178.3068 9 K 4.0457 8.0341 118.3756 58.6139 32.2222 178.3208 10 A 3.8961 7.5213 120.0478 54.6621 18.7643 179.1417 11 K 4.1123 7.1638 115.5055 58.6767 32.3231 177.3769 12 R 3.8296 7.4504 121.0584 57.4673 30.2608 177.8059 13 T 4.5729 8.1152 124.0221 62.2492 68.5080 173.5964 14 P 4.4883 0.0000 0.0000 63.2017 32.4547 176.0695 15 K 4.3782 6.9252 117.5961 54.7735 35.5943 175.0510 16 F 3.8359 6.8319 118.2788 55.1464 39.7374 177.2253 17 K 4.3043 8.6869 123.3341 58.4232 32.8248 178.3074 18 V 3.7482 7.9228 119.8343 66.2983 31.5634 176.6998 19 R 4.3574 7.9310 114.7959 56.7393 30.3917 177.3578 20 A 4.3203 7.6422 123.7364 50.9673 17.2494 176.1904 21 Y 4.4950 7.4747 120.4537 55.8012 40.4769 175.0418 22 T 4.4040 8.0266 110.2213 61.3646 71.1726 173.2117 23 R 4.4656 8.2222 116.7399 55.9168 32.6200 173.5352 24 C 4.0492 9.2416 126.1835 60.1614 32.1227 173.8888 25 V 3.7552 8.8130 127.4763 66.3664 31.4935 177.7726 26 R 4.0794 8.1929 117.0697 58.7739 30.1711 176.5176 27 C 4.8412 7.7345 110.5040 56.0703 32.4597 174.4770 28 G 3.8394 8.4422 110.6993 45.2381 0.0000 174.3447 29 R 4.4098 7.6436 118.9154 54.6016 31.3833 176.0260 30 A 4.4585 8.6431 128.3261 53.3079 19.3831 177.0122 31 R 4.5273 7.8162 114.2426 55.1837 32.5660 175.6397 32 S 3.6188 8.3499 111.6652 59.2873 62.0070 172.4597 33 V 4.5224 7.5848 111.8130 61.8997 32.9199 175.6161 34 Y 4.5952 8.9460 122.4610 56.3177 39.0616 177.1088 35 R 4.0111 8.8827 124.4238 59.3891 30.4061 178.0086 36 F 4.1945 8.3155 119.0016 61.2496 39.6849 176.2563 37 F 4.0733 8.5375 118.5026 58.3581 39.3221 176.9162 38 G 3.9326 8.7891 108.1147 45.7769 0.0000 172.5637 39 L 4.9778 7.8262 119.3138 52.7074 45.0928 174.6437 40 C 5.9245 8.3466 113.7623 55.9760 32.3498 174.4538 41 R 4.0156 8.5436 115.8592 60.2471 28.6063 178.2113 42 I 3.7410 7.8548 120.2085 63.7941 37.0977 177.5387 43 C 3.9333 8.0209 116.5418 63.2206 28.2406 175.6456 44 L 3.5643 7.9654 121.5301 58.6543 41.4915 179.0505 45 R 3.7465 7.8441 117.6580 59.3238 29.8284 178.4603 46 E 3.9495 8.2568 118.4679 59.6012 29.4849 179.4263 47 L 4.0037 8.4738 119.0066 57.5822 41.3974 179.4934 48 A 3.9272 7.7861 120.1720 55.4494 18.3639 179.1122 49 H 4.2838 7.9548 113.7963 58.8037 28.7564 177.9664 50 K 4.1663 7.5451 119.9507 59.3123 32.3200 178.2174 51 G 4.0939 8.5595 106.4123 45.7613 0.0000 175.2946 52 Q 3.9873 8.0754 115.4903 56.9510 28.5774 176.2915 53 L 4.6469 7.7839 120.2866 51.8833 41.7737 173.7183 54 P 4.4132 0.0000 0.0000 64.3300 31.6659 176.4406 55 G 3.9264 8.8141 109.0326 46.1881 0.0000 173.1476 56 V 4.1089 7.7491 119.1515 61.2300 31.0572 175.0751 57 R 4.6794 8.0577 126.6030 53.5275 32.9264 175.0773 58 K 3.9647 8.4587 123.1448 56.1059 32.7047 176.5929 59 A 4.3568 8.4026 129.2663 52.7581 19.1194 178.3144 60 S 4.6100 8.3089 116.5814 57.1282 65.2241 174.6917 61 W 4.4750 7.6258 120.4512 56.2779 28.0138 176.5297 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 2 A 8.26 4.34 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 3 R 7.78 4.27 0.00 1.95 1.90 0.00 3.21 0.00 0.00 3.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.77 0.00 4 K 8.40 3.91 0.00 1.91 1.78 0.00 1.69 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.73 7.81 5 A 8.09 4.03 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 6 L 7.73 4.07 0.00 1.97 1.81 0.98 0.61 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 7 I 7.85 3.78 1.88 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 1.86 0.83 1.04 0.00 0.00 8 E 8.06 4.00 0.00 2.03 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 0.00 2.36 2.35 0.00 9 K 8.03 4.05 0.00 1.90 2.06 0.00 1.83 0.00 0.00 1.77 0.00 0.00 3.16 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.49 7.81 10 A 7.52 3.90 1.07 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 0.00 0.00 11 K 7.16 4.11 0.00 1.66 1.85 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.64 7.81 12 R 7.45 3.83 0.00 2.01 1.92 0.00 3.11 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 13 T 8.12 4.57 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 1.25 0.00 0.00 14 P 0.00 4.49 0.00 2.12 2.12 0.00 3.80 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 15 K 6.93 4.38 0.00 1.73 1.77 0.00 1.73 0.00 0.00 1.34 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.26 1.37 7.81 16 F 6.83 3.84 0.00 3.11 2.94 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 17 K 8.69 4.30 0.00 1.90 1.97 0.00 1.60 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.48 7.81 18 V 7.92 3.75 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 0.83 0.00 0.00 0.97 0.00 0.00 19 R 7.93 4.36 0.00 2.01 2.11 0.00 3.44 0.00 0.00 3.36 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 20 A 7.64 4.32 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 21 Y 7.47 4.49 0.00 3.13 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 22 T 8.03 4.40 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 1.25 0.00 0.00 23 R 8.22 4.47 0.00 1.75 1.80 0.00 3.39 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.54 0.00 24 C 9.24 4.05 0.00 3.05 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 25 V 8.81 3.76 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 0.83 0.00 0.00 1.00 0.00 0.00 26 R 8.19 4.08 0.00 1.86 1.98 0.00 3.23 0.00 0.00 3.29 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 27 C 7.73 4.84 0.00 3.06 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 28 G 8.44 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.64 4.41 0.00 1.87 1.86 0.00 3.20 0.00 0.00 3.39 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.63 0.00 30 A 8.64 4.46 1.38 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 0.00 0.00 31 R 7.82 4.53 0.00 1.82 1.86 0.00 3.36 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 32 S 8.35 3.62 0.00 4.13 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 33 V 7.58 4.52 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 0.83 0.00 0.00 0.99 0.00 0.00 34 Y 8.95 4.60 0.00 3.27 3.18 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 35 R 8.88 4.01 0.00 1.90 2.07 0.00 3.24 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 36 F 8.32 4.19 0.00 2.97 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 37 F 8.54 4.07 0.00 3.17 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 38 G 8.79 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 0.00 0.00 0.00 39 L 7.83 4.98 0.00 1.72 1.61 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.35 5.92 0.00 3.18 3.16 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 41 R 8.54 4.02 0.00 2.22 2.41 0.00 2.83 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 42 I 7.85 3.74 1.89 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 1.67 0.90 0.97 0.00 0.00 43 C 8.02 3.93 0.00 2.97 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 44 L 7.97 3.56 0.00 1.45 1.74 0.20 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.84 3.75 0.00 2.03 2.01 0.00 3.17 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 46 E 8.26 3.95 0.00 2.21 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 2.33 2.54 0.00 47 L 8.47 4.00 0.00 1.56 1.70 0.93 0.94 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 48 A 7.79 3.93 1.15 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 0.00 0.00 0.00 0.00 0.00 0.00 49 H 7.95 4.28 0.00 3.38 3.33 0.00 5.66 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.55 4.17 0.00 1.90 1.87 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.69 7.81 51 G 8.56 4.09 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 0.00 52 Q 8.08 3.99 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 53 L 7.78 4.65 0.00 1.72 1.74 0.63 1.21 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 54 P 0.00 4.41 0.00 2.10 2.07 0.00 3.95 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 55 G 8.81 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 0.00 0.00 0.00 56 V 7.75 4.11 2.30 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 0.75 0.00 0.00 1.34 0.00 0.00 57 R 8.06 4.68 0.00 1.79 1.77 0.00 3.32 0.00 0.00 3.18 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 58 K 8.46 3.96 0.00 1.74 1.70 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.38 1.37 7.81 59 A 8.40 4.36 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 60 S 8.31 4.61 0.00 3.85 3.75 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 61 W 7.63 4.47 0.00 3.29 3.18 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