NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2530 8.2644 123.5843 52.1886 20.3331 177.7106 3 R 4.1259 7.7365 122.5221 56.1466 29.1948 174.2211 4 K 3.9754 7.5335 123.1714 59.2771 34.6932 176.8807 5 A 3.9344 7.6510 124.2906 54.7085 18.6587 177.9651 6 L 4.6687 7.8816 114.5962 54.8252 42.1030 178.0741 7 I 4.3004 7.5645 121.9983 59.9293 35.5221 175.1016 8 E 4.6414 7.4379 118.1962 56.4709 31.6272 180.3954 9 K 4.5963 7.6279 121.0625 59.3853 33.4659 176.5104 10 A 4.3310 7.7710 118.1654 52.3278 18.8573 177.5575 11 K 4.1243 8.6849 118.0918 56.5445 32.7351 179.4522 12 R 3.2872 8.2265 114.9389 60.5968 30.4928 178.7911 13 T 3.4459 10.1328 111.0314 66.8195 65.8434 172.6509 14 P 4.2433 0.0000 0.0000 66.7242 32.2656 177.4397 15 K 3.4718 8.6490 117.3732 56.9870 30.7584 173.6018 16 F 4.5999 9.0253 117.7109 57.6963 37.6514 176.7777 17 K 4.7019 8.7359 125.1772 60.3630 34.0373 179.7106 18 V 3.5201 7.3471 112.5607 63.3761 31.9604 177.5908 19 R 4.1851 8.4979 118.5894 58.1092 30.4942 177.3294 20 A 4.3018 7.8097 120.0051 52.4446 18.8814 176.0072 21 Y 4.9326 8.3586 117.8195 54.9106 41.2271 175.7619 22 T 3.9920 8.4353 117.2883 64.2661 69.2311 173.6491 23 R 4.3340 7.4658 121.7926 56.9930 32.9590 175.5908 24 C 4.6483 8.1423 121.6303 54.7652 42.1522 174.7785 25 V 3.4458 7.8808 125.1568 63.7463 33.2584 178.1141 26 R 4.0135 8.5225 119.8022 57.2347 27.7879 176.6046 27 C 4.5263 9.4463 105.0769 55.1545 42.6536 174.8058 28 G 3.5700 7.8094 111.8860 45.2300 0.0000 175.3070 29 R 3.5764 7.0450 117.4442 54.8531 28.2917 175.9400 30 A 4.5101 8.4610 124.2611 51.8872 20.2212 177.4574 31 R 3.7645 8.0328 118.0123 57.9874 29.1882 177.7016 32 S 4.1730 8.6781 120.5366 58.1064 62.9905 175.0176 33 V 3.9442 7.4823 119.3855 59.0578 33.2064 177.6089 34 Y 4.7009 6.0125 132.6602 56.6350 38.4144 178.0131 35 R 4.5103 9.0346 110.8835 57.9527 35.2880 176.5472 36 F 4.4597 8.6200 118.3011 61.3171 39.3381 175.7863 37 F 4.5182 8.4588 116.0892 57.3308 40.4609 174.4449 38 G 3.8287 8.8269 108.4494 45.1273 0.0000 171.8283 39 L 4.7802 7.8412 121.1558 54.2346 46.5731 175.8835 40 C 4.6036 8.5756 117.3975 56.1998 41.5180 175.3886 41 R 4.4712 8.3467 121.5537 58.8543 28.5141 178.6151 42 I 3.9724 7.9215 114.2475 63.1146 38.0543 176.6473 43 C 3.9341 7.9551 116.2525 57.2135 42.1156 175.3500 44 L 3.9960 8.6191 120.9841 57.4271 41.2102 178.5129 45 R 3.8935 6.6690 116.2604 59.8934 29.8519 178.6508 46 E 4.0230 8.6086 119.0947 59.3619 29.5351 179.1858 47 L 3.9813 8.2268 118.7108 57.8728 41.2148 179.0888 48 A 3.9546 8.3230 120.9252 55.5945 18.0411 179.1120 49 H 3.9359 8.3771 113.9586 59.4380 29.0052 177.2015 50 K 3.9195 7.9193 118.4616 59.0544 32.2197 177.3408 51 G 3.9112 8.4602 106.4953 45.7814 0.0000 175.1530 52 Q 4.4789 8.0076 118.3861 56.4945 28.1454 176.6690 53 L 4.3971 7.5048 117.4544 55.3041 41.5313 174.4724 54 P 3.8205 0.0000 0.0000 62.1803 30.2515 176.0714 55 G 3.9895 8.9164 114.4498 47.4835 0.0000 173.6526 56 V 3.4529 6.5741 118.5879 62.7435 31.5040 175.0610 57 R 4.6631 8.2677 126.4759 53.6604 32.8525 174.8820 58 K 3.8734 8.5957 123.8772 56.7327 32.6959 175.5522 59 A 4.6979 8.3649 126.3685 50.6095 20.4323 176.6007 60 S 4.6303 9.8574 118.8876 55.7853 65.9770 174.3526 61 W 3.7195 8.5238 117.1827 56.8803 27.2143 174.3987 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 4.25 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 3 R 7.74 4.13 0.00 1.85 1.90 0.00 3.33 0.00 0.00 3.19 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.75 0.00 4 K 7.53 3.98 0.00 1.84 1.70 0.00 1.82 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.51 7.81 5 A 7.65 3.93 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 6 L 7.88 4.67 0.00 1.65 1.66 0.88 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 7 I 7.56 4.30 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 1.51 0.78 0.94 0.00 0.00 8 E 7.44 4.64 0.00 2.16 2.18 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 2.46 2.34 0.00 9 K 7.63 4.60 0.00 1.49 1.70 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.28 1.03 7.81 10 A 7.77 4.33 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 11 K 8.68 4.12 0.00 1.80 1.83 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.42 7.81 12 R 8.23 3.29 0.00 1.91 1.99 0.00 3.35 0.00 0.00 3.38 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 13 T 10.13 3.45 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 1.19 0.00 0.00 14 P 0.00 4.24 0.00 2.27 2.19 0.00 3.49 0.00 0.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 15 K 8.65 3.47 0.00 1.84 1.83 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.11 1.25 7.81 16 F 9.03 4.60 0.00 3.25 3.27 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 17 K 8.74 4.70 0.00 2.01 2.07 0.00 1.57 0.00 0.00 1.85 0.00 0.00 3.08 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.58 1.62 7.81 18 V 7.35 3.52 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 1.09 0.00 0.00 19 R 8.50 4.19 0.00 1.98 2.02 0.00 3.22 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 20 A 7.81 4.30 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.36 4.93 0.00 3.08 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.44 3.99 4.20 0.00 0.00 0.00 0.00 0.00 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 23 R 7.47 4.33 0.00 1.51 1.70 0.00 3.49 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.89 0.00 24 C 8.14 4.65 0.00 3.08 3.34 0.00 0.00 0.00 0.00 0.00 0.00 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 7.88 3.45 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 0.77 0.00 0.00 0.94 0.00 0.00 26 R 8.52 4.01 0.00 1.92 1.60 0.00 3.11 0.00 0.00 3.25 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 27 C 9.45 4.53 0.00 3.14 3.19 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 0.00 28 G 7.81 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 29 R 7.04 3.58 0.00 1.87 2.05 0.00 3.21 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 30 A 8.46 4.51 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.03 3.76 0.00 1.75 1.68 0.00 3.29 0.00 0.00 3.27 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 32 S 8.68 4.17 0.00 3.85 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 33 V 7.48 3.94 2.03 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 0.76 0.00 0.00 1.01 0.00 0.00 34 Y 6.01 4.70 0.00 3.23 2.99 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 35 R 9.03 4.51 0.00 1.96 2.01 0.00 3.22 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 36 F 8.62 4.46 0.00 2.94 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 37 F 8.46 4.52 0.00 2.71 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 38 G 8.83 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.84 4.78 0.00 1.95 1.72 1.17 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.58 4.60 0.00 3.02 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 41 R 8.35 4.47 0.00 2.26 2.30 0.00 3.06 0.00 0.00 3.35 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.56 0.00 42 I 7.92 3.97 2.10 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 1.72 1.08 0.95 0.00 0.00 43 C 7.96 3.93 0.00 3.23 3.53 0.00 0.00 0.00 0.00 0.00 0.00 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 8.62 4.00 0.00 1.91 1.85 0.29 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 45 R 6.67 3.89 0.00 2.08 2.24 0.00 2.86 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.76 0.00 46 E 8.61 4.02 0.00 2.21 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 2.36 2.45 0.00 47 L 8.23 3.98 0.00 1.79 1.72 0.92 0.77 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 48 A 8.32 3.95 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.38 3.94 0.00 3.35 3.41 0.00 5.69 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.92 3.92 0.00 1.98 2.07 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.23 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.60 7.81 51 G 8.46 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 0.00 0.00 0.00 52 Q 8.01 4.48 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.25 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 53 L 7.50 4.40 0.00 1.51 1.30 0.91 0.89 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 54 P 0.00 3.82 0.00 2.06 2.16 0.00 4.03 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.93 0.00 55 G 8.92 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 0.00 0.00 0.00 56 V 6.57 3.45 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 0.89 0.00 0.00 0.99 0.00 0.00 57 R 8.27 4.66 0.00 1.85 1.77 0.00 3.33 0.00 0.00 3.18 7.36 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 8.60 3.87 0.00 1.73 1.70 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.37 7.81 59 A 8.36 4.70 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 60 S 9.86 4.63 0.00 3.88 3.81 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 61 W 8.52 3.72 0.00 3.36 3.32 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