NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 28 E 4.3195 8.3033 121.4702 56.2990 31.7067 177.8033 29 I 3.5142 7.7312 119.3414 63.9109 36.9927 176.3859 30 D 4.4130 8.0906 119.8155 57.9276 41.1969 178.8521 31 T 4.2672 7.7360 110.7001 63.9421 68.9773 176.6530 32 L 3.9719 8.2003 122.0740 57.7884 41.6453 179.6180 33 R 3.9277 8.3091 118.2748 59.3934 29.5143 178.9791 34 E 3.9536 8.3082 118.3514 59.3155 29.3831 179.0253 35 E 4.0480 8.0332 118.9943 59.0105 29.6704 178.7623 36 I 3.6900 7.9589 120.0892 64.5339 37.1936 177.8837 37 D 4.4277 8.2993 119.7494 57.5574 40.6134 179.3947 38 R 3.9119 7.8046 118.4287 59.2678 30.0558 178.9961 39 L 4.0077 7.8577 118.7607 57.9980 41.5321 179.4379 40 D 4.3164 8.6140 118.9727 57.1957 40.8065 178.5560 41 A 3.9971 8.0403 121.2995 55.2729 18.3941 179.5901 42 E 3.9134 8.3239 116.9577 59.5898 29.4790 179.6992 43 I 3.7222 8.0027 120.0406 64.2025 37.0999 178.2188 44 L 3.8985 8.2740 121.2828 58.0492 41.9311 178.5513 45 A 3.9947 7.8442 120.5463 55.5021 18.2247 179.6777 46 L 3.9557 8.0042 117.1671 57.8639 41.6826 180.0267 47 V 3.5809 8.1754 118.5844 65.7774 31.3642 178.0145 48 K 3.8698 8.2705 118.6011 59.7312 31.9289 179.2354 49 R 3.8929 7.9745 118.6997 59.3508 29.9045 178.3932 50 R 3.8674 8.4375 118.7684 59.3989 30.0628 178.3556 51 A 3.9781 8.0872 120.5431 55.1718 18.3511 179.5411 52 E 3.9150 8.0214 116.9828 59.5187 29.5231 179.6719 53 V 3.6038 7.9786 118.3873 66.0963 31.5531 178.3117 54 S 4.1169 8.3529 115.0625 61.6274 62.7100 176.8425 55 K 3.9838 8.2341 120.9410 59.1565 31.7178 179.2868 56 A 3.9828 8.0230 121.1676 55.3078 18.3729 179.6554 57 I 3.7614 7.9894 118.5342 64.6154 37.1169 179.0024 58 G 3.6253 8.3041 106.5070 47.3893 0.0000 175.9832 59 K 3.9271 8.2279 120.5706 59.4656 31.7751 179.1947 60 A 4.0085 8.0839 120.8479 55.2301 18.3017 179.6434 61 R 3.7375 8.0988 117.2054 59.6913 30.2342 178.5323 62 M 4.1622 8.3728 118.2012 57.7661 31.7556 178.2399 63 A 4.1847 8.0904 119.8945 53.8791 18.6496 178.5882 64 S 4.6606 7.3840 111.5767 57.1305 63.4179 174.1032 65 G 4.0914 7.7240 108.7269 45.9583 0.0000 174.2127 66 G 3.7586 7.6307 106.7669 45.3829 0.0000 174.2137 67 T 4.1592 8.1598 118.3157 62.4839 69.3435 175.0477 68 R 4.0137 8.3699 126.0803 56.5215 31.5459 176.9882 69 L 4.4267 8.0961 125.5751 53.8570 40.8458 177.7960 70 V 3.5251 7.4396 123.1359 66.3910 32.2891 177.6370 71 H 4.5086 7.9769 114.8154 57.4897 28.8416 175.4067 72 S 4.3364 7.3680 113.8384 59.2070 64.1599 175.9369 73 R 3.8451 8.2868 119.0211 59.1381 30.4648 178.3136 74 E 4.0146 8.2964 117.9965 59.5015 29.3270 179.1074 75 M 4.0734 7.7622 116.9796 58.6450 32.3130 178.5109 76 K 3.9873 8.1742 118.6537 59.0849 31.9477 179.6468 77 V 3.6142 7.7406 118.8166 66.0552 31.3053 177.9864 78 I 3.8149 7.6298 118.1355 64.4623 37.2395 177.5372 79 E 4.1000 8.4565 120.1863 59.5282 29.0515 179.0240 80 R 3.8606 7.9695 117.8979 59.5896 30.1819 178.4399 81 Y 3.9706 7.8910 115.6454 59.9240 37.9729 177.9077 82 S 4.4180 7.9186 115.2370 60.8718 62.8651 175.7375 83 E 4.0423 7.5641 121.9472 58.4394 29.3896 177.6336 84 L 4.3402 7.8058 117.1069 56.0544 42.5024 176.4303 85 G 3.8616 8.3227 105.8218 43.6630 0.0000 172.0849 86 P 4.2738 0.0000 0.0000 65.9360 31.1411 178.3981 87 D 4.5559 8.1552 117.0234 56.7326 40.8065 178.8637 88 G 3.6410 7.8610 106.5139 47.6132 0.0000 175.7150 89 K 4.0229 8.0372 121.7121 59.4246 32.2055 178.5156 90 D 4.3315 7.9927 119.0230 56.8879 40.5727 178.4592 91 L 3.7707 8.0351 120.8228 58.0906 42.1448 178.7226 92 A 3.5640 7.7331 120.5380 55.1822 18.1827 179.5299 93 I 3.6033 7.8128 118.1097 64.5151 37.2041 178.5421 94 L 3.9199 7.9920 119.7346 57.8171 41.4869 179.4324 95 L 3.9027 7.9102 118.9352 57.8580 41.3418 179.5643 96 L 3.9445 8.0116 117.6657 58.0550 41.4428 179.4759 97 R 4.0414 8.1818 118.0524 59.2835 29.7569 178.9254 98 L 4.1777 8.2727 119.7025 57.6432 42.0729 177.9874 99 G 3.8973 7.8935 104.1464 44.7680 0.0000 173.8029 100 R 4.0708 7.4575 124.7096 56.3962 30.9651 176.1887 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 28 E 8.30 4.32 0.00 2.06 2.01 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 2.27 2.40 0.00 29 I 7.73 3.51 1.87 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 1.64 0.67 0.91 0.00 0.00 30 D 8.09 4.41 0.00 2.76 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 31 T 7.74 4.27 4.24 0.00 0.00 0.00 0.00 0.00 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 32 L 8.20 3.97 0.00 2.01 1.76 0.92 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.31 3.93 0.00 1.96 1.98 0.00 3.13 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.91 0.00 34 E 8.31 3.95 0.00 2.20 2.00 0.00 0.00 0.00 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 2.55 0.00 35 E 8.03 4.05 0.00 2.11 2.19 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 2.30 2.39 0.00 36 I 7.96 3.69 2.05 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 1.68 0.72 0.95 0.00 0.00 37 D 8.30 4.43 0.00 2.85 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 38 R 7.80 3.91 0.00 1.96 1.97 0.00 3.29 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 1.65 1.83 0.00 39 L 7.86 4.01 0.00 1.87 1.73 0.95 1.13 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 40 D 8.61 4.32 0.00 2.86 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.04 4.00 1.40 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 0.00 0.00 0.00 42 E 8.32 3.91 0.00 2.13 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 2.48 2.50 0.00 43 I 8.00 3.72 1.94 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 1.43 0.87 0.92 0.00 0.00 44 L 8.27 3.90 0.00 1.81 1.66 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 45 A 7.84 3.99 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 46 L 8.00 3.96 0.00 1.87 1.75 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.18 3.58 2.14 0.00 0.00 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 0.98 0.00 0.00 48 K 8.27 3.87 0.00 1.99 1.86 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.62 7.81 49 R 7.97 3.89 0.00 1.90 2.07 0.00 3.11 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 50 R 8.44 3.87 0.00 2.11 2.04 0.00 3.19 0.00 0.00 3.18 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 51 A 8.09 3.98 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 52 E 8.02 3.91 0.00 1.95 2.01 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 2.51 2.46 0.00 53 V 7.98 3.60 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 1.04 0.00 0.00 1.01 0.00 0.00 54 S 8.35 4.12 0.00 4.06 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 55 K 8.23 3.98 0.00 1.81 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.46 1.73 7.81 56 A 8.02 3.98 1.40 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 0.00 0.00 0.00 57 I 7.99 3.76 2.03 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 1.46 0.93 0.91 0.00 0.00 58 G 8.30 3.63 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 0.00 0.00 0.00 59 K 8.23 3.93 0.00 2.00 1.87 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.51 7.81 60 A 8.08 4.01 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 61 R 8.10 3.74 0.00 1.97 1.92 0.00 3.24 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 1.71 1.66 0.00 62 M 8.37 4.16 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.55 0.00 63 A 8.09 4.18 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 64 S 7.38 4.66 0.00 3.94 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 65 G 7.72 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 66 G 7.63 3.76 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 0.00 0.00 0.00 67 T 8.16 4.16 4.24 0.00 0.00 0.00 0.00 0.00 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 68 R 8.37 4.01 0.00 1.76 1.80 0.00 3.21 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 69 L 8.10 4.43 0.00 1.74 1.60 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 70 V 7.44 3.53 1.82 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 0.87 0.00 0.00 0.87 0.00 0.00 71 H 7.98 4.51 0.00 3.21 3.33 0.00 5.74 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 7.37 4.34 0.00 4.00 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 73 R 8.29 3.85 0.00 1.94 2.15 0.00 3.24 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.81 0.00 74 E 8.30 4.01 0.00 2.29 1.99 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 2.33 2.54 0.00 75 M 7.76 4.07 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.65 0.00 76 K 8.17 3.99 0.00 1.93 1.85 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.63 1.61 7.81 77 V 7.74 3.61 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 0.98 0.00 0.00 78 I 7.63 3.81 2.03 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 1.43 0.75 0.95 0.00 0.00 79 E 8.46 4.10 0.00 2.08 2.16 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 2.31 2.40 0.00 80 R 7.97 3.86 0.00 1.93 1.70 0.00 3.04 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.78 0.00 81 Y 7.89 3.97 0.00 3.07 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.92 4.42 0.00 4.06 4.34 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 83 E 7.56 4.04 0.00 1.95 2.01 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 2.32 2.34 0.00 84 L 7.81 4.34 0.00 1.80 1.73 1.10 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.32 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 0.00 0.00 0.00 86 P 0.00 4.27 0.00 2.17 2.13 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 87 D 8.16 4.56 0.00 2.69 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 7.86 3.64 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 0.00 0.00 0.00 89 K 8.04 4.02 0.00 1.86 1.98 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.55 7.81 90 D 7.99 4.33 0.00 2.81 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 91 L 8.04 3.77 0.00 1.75 1.80 0.78 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 92 A 7.73 3.56 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 I 7.81 3.60 1.99 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 1.51 0.78 0.89 0.00 0.00 94 L 7.99 3.92 0.00 1.93 1.64 0.89 0.74 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 95 L 7.91 3.90 0.00 1.66 1.65 0.46 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 96 L 8.01 3.94 0.00 1.71 1.73 0.92 0.96 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 97 R 8.18 4.04 0.00 1.96 1.96 0.00 3.11 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 98 L 8.27 4.18 0.00 1.88 1.74 0.90 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 99 G 7.89 3.90 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 0.00 0.00 0.00 100 R 7.46 4.07 0.00 1.94 1.86 0.00 3.19 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00