NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.1042 8.0244 121.4522 61.0468 38.4952 174.5987 17 V 3.6301 8.4423 125.7139 63.1487 32.0430 172.1816 18 E 3.8400 8.9030 126.9542 57.4017 28.4349 174.2597 19 G 4.2261 7.8624 109.3504 44.5301 0.0000 173.3668 20 S 4.7231 8.1438 113.3123 56.2540 66.2961 173.2373 21 D 4.3990 8.5388 121.1157 54.0140 41.0748 177.1463 22 A 4.3680 8.4768 126.6938 51.9209 19.7301 175.8316 23 E 4.7352 8.3655 115.4302 54.1678 32.6032 175.8887 24 I 3.7737 8.3290 122.4485 63.5835 37.1553 174.8842 25 G 4.0440 9.4285 112.8030 45.9855 0.0000 174.8591 26 M 4.0296 7.7297 118.7417 58.2408 32.0074 176.5436 27 S 3.8288 7.1080 113.0764 55.5118 62.1325 171.9840 28 P 4.0853 0.0000 0.0000 63.1499 32.2327 178.0039 29 W 4.3830 5.3120 115.4519 56.9679 29.4005 175.0070 30 Q 4.3791 7.2571 121.0836 56.9305 29.5128 174.9305 31 V 4.5944 8.5466 126.6755 61.2972 34.6807 174.2017 32 M 4.6947 8.3362 126.7376 53.3871 33.7189 174.9765 33 L 4.2213 8.0720 127.4668 55.0668 43.1754 175.9506 34 F 4.9407 8.7773 123.9695 56.1637 43.0300 175.2439 35 R 3.9580 8.4812 118.1018 56.9323 31.0443 176.4301 36 K 3.7703 7.8778 115.5365 56.1831 29.7774 174.4737 36A S 5.1031 9.0171 108.2868 57.8704 65.8102 174.8187 37 P 4.5363 0.0000 0.0000 62.0697 32.4293 173.8903 38 Q 4.4109 8.4562 119.6764 56.2771 29.5070 175.7873 39 E 4.5614 8.7709 125.6797 55.1205 32.6558 173.7887 40 L 2.9846 8.5133 130.4356 55.5405 41.9692 175.8943 41 L 4.3080 8.1626 126.1798 56.6341 42.8655 175.4358 42 C 4.7492 7.4493 113.6589 55.9133 44.7535 172.0203 43 G 4.2766 8.2407 105.6432 45.7589 0.0000 170.7572 44 A 4.6481 8.1179 119.4869 52.1786 24.0675 175.3633 45 S 5.2407 8.5350 111.0240 57.0970 67.0092 173.7806 46 L 4.7706 9.1585 124.9128 54.7881 41.5107 176.5771 47 I 4.2952 7.8905 119.5572 60.9448 38.5776 174.9102 48 S 4.6020 7.4218 113.6511 58.4117 64.9318 173.8218 49 D 4.6999 8.8428 118.7783 54.8277 39.7565 176.5961 50 R 4.5533 7.9270 119.1074 54.8483 31.3351 175.0429 51 W 5.0776 7.9065 116.1030 55.4100 33.7821 174.2589 52 V 4.8476 8.8304 123.5536 60.9848 34.1827 174.0146 53 L 4.8686 9.1334 129.1469 53.6963 44.4452 175.0461 54 T 4.9790 8.2809 118.8684 60.5396 71.4246 172.4143 55 A 4.1531 8.4606 126.5606 51.2924 19.2538 178.1514 56 A 4.0046 8.9368 126.8818 55.7503 18.4751 178.6640 57 H 4.5744 8.1598 107.1084 56.9104 28.5725 176.4414 58 C 4.5203 8.0655 117.9602 58.1169 37.7233 174.8122 59 L 4.2045 7.8574 118.9990 56.0715 42.0584 175.9395 60 L 5.5658 7.9957 120.3264 53.5224 43.4563 174.8370 60A Y 4.9057 8.3653 127.4182 54.7967 39.7658 173.4281 60B P 4.2173 0.0000 0.0000 64.7933 31.7426 177.1104 60C P 3.6124 0.0000 0.0000 64.5523 31.1249 176.4814 60D W 4.7887 7.4225 125.0183 56.2013 31.2781 172.6885 60E D 4.1749 9.3159 121.0643 53.9020 38.5249 171.6901 60F K 4.1407 7.5573 121.1981 54.9596 34.1891 173.5609 60G N 5.1337 7.7584 128.0992 52.1534 37.8306 173.7505 60H F 4.6762 9.4990 119.9956 57.5175 40.5403 176.5222 60I T 4.7456 8.7777 111.4066 59.2950 71.9135 174.8730 61 E 3.9579 8.9595 121.1808 59.8393 29.5323 179.3024 62 N 4.2700 8.4101 114.8787 56.9288 38.8994 175.5420 63 D 4.6147 8.8137 117.4982 56.4283 41.0897 175.7863 64 L 5.2959 7.8258 116.8881 52.8735 45.7005 175.8120 65 L 4.9578 8.2358 118.5459 53.1599 46.2177 175.9296 66 V 4.7756 8.3650 119.5123 61.2533 34.4629 175.0917 67 R 4.5477 8.4461 125.1380 54.5080 32.0362 175.8506 68 I 3.8430 8.4986 125.2810 59.9184 39.3130 176.0412 69 G 3.7052 7.4695 108.3766 46.3914 0.0000 173.2581 70 K 4.4651 7.4561 119.9661 54.8315 34.0118 176.0716 71 H 4.7438 8.3469 124.4515 57.1872 29.7859 172.7294 72 S 4.0451 8.0261 117.7259 58.6887 63.2117 171.1600 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 16 I 8.02 4.10 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 1.31 1.08 0.92 0.00 0.00 17 V 8.44 3.63 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 0.77 0.00 0.00 0.94 0.00 0.00 18 E 8.90 3.84 0.00 2.11 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 2.23 2.23 0.00 19 G 7.86 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 S 8.14 4.72 0.00 3.93 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.54 4.40 0.00 2.68 2.67 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 22 A 8.48 4.37 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 23 E 8.37 4.74 0.00 2.00 1.81 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 2.28 2.30 0.00 24 I 8.33 3.77 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.40 0.88 0.00 0.00 25 G 9.43 4.04 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 0.00 0.00 0.00 26 M 7.73 4.03 0.00 1.93 2.26 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.52 0.00 27 S 7.11 3.83 0.00 3.90 3.44 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 28 P 0.00 4.09 0.00 1.91 1.86 0.00 2.20 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.67 0.00 29 W 5.31 4.38 0.00 3.65 3.71 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 30 Q 7.26 4.38 0.00 2.19 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 31 V 8.55 4.59 2.24 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 0.96 0.00 0.00 1.03 0.00 0.00 32 M 8.34 4.69 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.48 0.00 33 L 8.07 4.22 0.00 1.67 1.38 0.78 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 34 F 8.78 4.94 0.00 2.96 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 35 R 8.48 3.96 0.00 1.86 2.02 0.00 3.49 0.00 0.00 3.30 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.74 0.00 36 K 7.88 3.77 0.00 1.93 1.88 0.00 1.93 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.33 1.41 7.81 36A S 9.02 5.10 0.00 3.89 3.82 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 37 P 0.00 4.54 0.00 2.37 2.23 0.00 3.51 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 38 Q 8.46 4.41 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.26 6.77 0.00 0.00 0.00 0.00 0.00 2.58 2.29 0.00 39 E 8.77 4.56 0.00 2.10 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 40 L 8.51 2.98 0.00 0.86 1.20 0.73 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.16 4.31 0.00 1.31 1.42 0.10 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 42 C 7.45 4.75 0.00 2.67 2.86 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 43 G 8.24 4.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.12 4.65 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 45 S 8.53 5.24 0.00 4.05 4.03 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 0.00 0.00 0.00 0.00 46 L 9.16 4.77 0.00 1.86 1.81 1.02 1.19 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 47 I 7.89 4.30 1.89 0.00 0.00 0.80 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 0.95 0.95 0.00 0.00 48 S 7.42 4.60 0.00 3.94 4.03 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 0.00 0.00 0.00 0.00 49 D 8.84 4.70 0.00 2.83 2.81 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 50 R 7.93 4.55 0.00 1.69 1.51 0.00 3.02 0.00 0.00 3.07 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.62 0.00 51 W 7.91 5.08 0.00 3.36 3.11 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 0.00 0.00 0.00 0.00 52 V 8.83 4.85 2.13 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 0.88 0.00 0.00 0.97 0.00 0.00 53 L 9.13 4.87 0.00 1.79 1.51 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.28 4.98 4.26 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 1.21 0.00 0.00 55 A 8.46 4.15 1.09 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 56 A 8.94 4.00 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 57 H 8.16 4.57 0.00 3.12 3.37 0.00 5.52 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 58 C 8.07 4.52 0.00 3.03 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 59 L 7.86 4.20 0.00 1.90 1.76 0.95 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.00 5.57 0.00 1.63 1.61 1.02 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 60A Y 8.37 4.91 0.00 3.03 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 60B P 0.00 4.22 0.00 2.10 2.09 0.00 4.08 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.04 0.00 60C P 0.00 3.61 0.00 0.97 1.86 0.00 3.22 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.97 0.00 60D W 7.42 4.79 0.00 3.10 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 60E D 9.32 4.17 0.00 2.83 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 60F K 7.56 4.14 0.00 1.87 1.84 0.00 1.98 0.00 0.00 1.85 0.00 0.00 2.58 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.64 1.61 7.81 60G N 7.76 5.13 0.00 2.69 2.58 0.00 0.00 7.27 7.02 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 60H F 9.50 4.68 0.00 2.79 3.03 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 0.00 0.00 0.00 0.00 60I T 8.78 4.75 4.27 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 1.23 0.00 0.00 61 E 8.96 3.96 0.00 2.10 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 0.00 2.42 2.42 0.00 62 N 8.41 4.27 0.00 2.67 2.90 0.00 0.00 6.99 8.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 D 8.81 4.61 0.00 3.21 3.23 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.83 5.30 0.00 1.49 1.64 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.24 4.96 0.00 1.39 1.48 0.87 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.36 4.78 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 0.88 0.00 0.00 0.93 0.00 0.00 67 R 8.45 4.55 0.00 1.76 1.78 0.00 2.21 0.00 0.00 3.01 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.49 0.00 68 I 8.50 3.84 1.86 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 1.29 0.95 0.91 0.00 0.00 69 G 7.47 3.71 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 0.00 0.00 0.00 70 K 7.46 4.47 0.00 1.75 1.74 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.37 7.81 71 H 8.35 4.74 0.00 2.98 3.09 0.00 6.07 0.00 0.00 0.00 0.00 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.03 4.05 0.00 3.98 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