NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C E 4.3000 8.4401 121.4709 56.2855 30.5691 174.2861 1B A 4.4822 8.5105 115.6980 50.9397 20.7500 175.0357 1A D 4.9729 7.7595 115.7920 53.7760 42.7462 173.8076 1 C 4.3536 7.9745 111.8410 58.8673 30.1726 173.9340 2 G 3.9214 8.9129 109.8578 45.4388 0.0000 172.9126 3 L 4.6525 7.2248 119.7341 52.9011 43.2317 176.1810 4 R 4.5280 8.7020 123.4311 54.3585 31.4247 175.7637 5 P 4.2290 0.0000 0.0000 65.7007 31.3661 177.4437 6 L 4.2147 7.8760 113.9604 54.8831 42.0234 176.4468 7 F 4.6945 7.1485 114.1272 56.7583 42.3120 176.6282 8 E 4.0679 8.9734 121.2914 60.0392 30.1106 180.0944 9 K 4.0594 8.2241 116.3444 58.6876 32.0362 178.0147 10 K 4.4097 8.2348 117.2817 55.3586 32.0970 176.3651 11 Q 3.3291 7.8708 115.6313 56.6057 26.6746 173.4545 12 V 4.2854 7.3411 116.4569 60.9985 32.7233 174.5764 13 Q 4.7579 8.5697 125.8779 54.7358 29.8151 175.3468 14 D 4.8717 9.4158 121.4664 52.9284 40.2326 177.1207 14A Q 4.0978 8.8119 118.8569 58.7847 28.7318 178.2151 14B T 4.5417 8.2056 105.2102 61.2130 69.6494 175.6760 14C E 3.9829 8.1493 123.2119 59.7793 29.3533 179.2970 14D K 4.2303 8.1499 118.0487 59.7248 32.3254 178.6348 14E E 3.8742 7.7120 120.4171 58.9414 29.9055 178.5394 14F L 3.7257 7.5624 118.8603 57.6224 41.8491 179.2115 14G F 3.7777 7.5996 116.9893 60.7415 38.6828 177.3111 14H E 4.0438 8.4778 118.4312 59.6563 28.9977 179.7336 14I S 4.2309 7.4640 112.9345 61.2620 63.1470 176.0117 14J Y 4.5541 7.2743 119.7045 60.5699 37.8301 177.3107 14K I 4.4150 7.2442 111.4378 61.3201 38.4933 175.5532 14L E 4.2847 8.2357 125.9862 57.6110 29.6495 176.0652 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 1C E 8.44 4.30 0.00 1.93 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 2.20 2.38 0.00 1B A 8.51 4.48 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 1A D 7.76 4.97 0.00 2.74 2.59 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 0.00 0.00 0.00 0.00 1 C 7.97 4.35 0.00 3.13 2.93 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 2 G 8.91 3.92 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 0.00 0.00 0.00 3 L 7.22 4.65 0.00 1.82 1.64 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 4 R 8.70 4.53 0.00 2.27 2.09 0.00 3.15 0.00 0.00 3.09 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 5 P 0.00 4.23 0.00 2.07 2.14 0.00 3.74 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 6 L 7.88 4.21 0.00 1.54 1.27 0.93 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 7 F 7.15 4.69 0.00 3.18 3.04 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 0.00 0.00 0.00 0.00 8 E 8.97 4.07 0.00 2.24 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 0.00 2.48 2.50 0.00 9 K 8.22 4.06 0.00 1.93 1.89 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.62 1.58 7.81 10 K 8.23 4.41 0.00 1.82 1.71 0.00 1.72 0.00 0.00 1.58 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.49 7.81 11 Q 7.87 3.33 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.63 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 12 V 7.34 4.29 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 0.94 0.00 0.00 0.89 0.00 0.00 13 Q 8.57 4.76 0.00 2.48 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 14 D 9.42 4.87 0.00 2.67 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 0.00 0.00 0.00 14A Q 8.81 4.10 0.00 2.08 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.10 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 14B T 8.21 4.54 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 1.20 0.00 0.00 14C E 8.15 3.98 0.00 2.35 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 0.00 2.44 2.53 0.00 14D K 8.15 4.23 0.00 2.03 2.13 0.00 1.53 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.51 7.81 14E E 7.71 3.87 0.00 1.92 2.10 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 2.25 2.31 0.00 14F L 7.56 3.73 0.00 1.24 1.11 0.76 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 14G F 7.60 3.78 0.00 3.08 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14H E 8.48 4.04 0.00 2.19 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 2.36 2.47 0.00 14I S 7.46 4.23 0.00 3.99 3.98 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 0.00 0.00 0.00 14J Y 7.27 4.55 0.00 3.24 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14K I 7.24 4.42 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.62 1.03 0.00 0.00 14L E 8.24 4.28 0.00 2.14 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00