NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 T 4.2121 8.1631 115.2220 61.9804 68.6223 173.2512 9 G 4.2420 7.6936 115.4184 42.3087 0.0000 170.3494 10 K 4.0294 8.7263 120.7877 57.8606 33.6820 176.1275 11 K 4.1413 7.7360 128.2096 56.8147 32.0089 177.2991 12 N 4.6791 8.6900 117.8368 53.1951 37.5380 174.7741 13 L 4.6555 7.9132 121.1781 55.2609 45.2535 176.2656 14 V 4.2579 7.8525 118.2037 59.8705 39.1290 178.2538 15 V 3.4605 8.7574 123.9695 62.2546 30.5099 176.6675 16 N 3.8372 7.9975 123.2583 53.5875 35.7189 172.6431 17 S 4.9164 8.2046 125.3320 57.6441 67.0251 173.0304 18 V 4.6944 8.1791 113.9694 60.1293 36.5016 174.7766 19 I 4.0335 8.4433 115.3781 61.8156 38.4075 175.6490 20 R 4.4630 8.3656 122.0985 54.8301 32.5605 174.8398 21 R 4.6028 8.6541 125.6090 55.7449 32.2761 176.9965 22 G 4.0254 8.2969 107.3058 45.6860 0.0000 172.8816 23 K 5.1572 8.6306 125.8791 55.6971 35.2414 174.9668 24 A 4.6348 8.6871 121.8117 51.1628 23.1629 177.1857 25 R 3.7785 8.6457 114.5485 56.2532 27.8499 176.3721 26 A 3.6401 7.7753 120.3199 53.2524 18.1462 173.4437 27 D 4.3884 9.0663 130.9179 54.0819 39.4383 173.4397 28 G 4.1571 8.2209 111.6835 43.9364 0.0000 171.9456 29 G 3.8482 7.8669 108.2643 46.0312 0.0000 175.5159 30 V 3.3720 8.3240 126.9492 64.1823 32.0839 173.1089 31 G 4.0662 10.2824 102.9948 44.4817 0.0000 172.2816 32 R 4.3862 8.9010 124.8803 56.3824 28.4479 177.9809 33 K 4.3526 9.4078 114.2439 55.8723 33.9990 176.0004 34 T 3.7928 6.5381 108.6811 62.7362 72.0732 171.2898 35 T 4.6107 8.1827 118.1230 61.8477 70.9478 174.1656 36 G 3.8793 8.6940 114.1675 46.0353 0.0000 171.2259 37 I 5.0157 8.2329 122.8015 59.9308 39.2890 175.7817 38 T 4.5732 8.9277 111.6642 62.0419 70.9420 174.2060 39 K 3.9519 8.4053 119.7528 55.7360 31.4360 175.7920 40 R 3.8271 5.8400 135.0000 56.7820 30.4447 174.1309 41 V 4.5377 9.0807 117.0719 60.6109 34.0080 176.8052 42 Q 5.3727 8.5804 131.1367 57.0355 31.8736 172.4076 43 R 4.8270 7.8609 122.5614 55.1517 35.0121 173.7873 44 A 4.7725 8.3852 119.9668 50.5639 22.6675 175.3143 45 N 4.8616 10.2326 118.6497 51.5980 41.3979 173.5397 46 L 4.6327 8.0849 126.3903 54.6715 44.4434 173.2054 47 H 4.5714 7.7594 126.1018 55.9444 34.2724 176.4458 48 K 4.9169 9.0154 122.8120 57.2217 37.3460 171.6203 49 K 4.7524 8.6336 116.3960 56.7094 35.1946 174.7350 50 A 4.4887 7.5121 120.6120 50.6560 22.4627 176.3582 51 I 4.4802 8.1134 122.2824 61.3477 37.9049 175.8012 52 R 4.7527 8.5423 125.5079 57.1641 34.2652 173.9514 53 E 5.4124 7.2708 120.8536 57.3071 32.0712 175.2389 54 N 5.0491 7.9013 117.9746 52.1366 42.7425 174.6116 55 G 4.1017 8.5129 111.0042 46.3557 0.0000 173.3163 56 Q 4.4527 7.1705 112.9276 55.2473 31.0412 173.2167 57 V 4.7471 8.2631 116.6273 63.5504 32.7978 175.9505 58 K 4.2812 7.9411 127.6873 55.3732 34.3663 175.2424 59 T 3.8922 8.3826 118.2357 60.2808 72.9885 173.7949 60 V 3.2210 7.2707 112.1788 60.8331 31.0745 173.1504 61 W 4.1610 8.5401 120.3488 56.8151 30.0250 175.8342 62 L 4.7620 8.1602 123.3191 53.7021 44.5552 175.5432 63 S 4.3608 9.2182 121.5804 58.4616 64.1055 174.9847 64 A 3.8122 8.6885 126.5225 55.5955 19.1597 180.5234 65 N 4.7382 7.9138 112.2250 52.4772 38.4326 175.7205 66 A 4.7424 9.7732 120.6010 52.6482 25.5209 179.3731 67 L 4.5963 8.3114 118.5070 56.8547 41.8177 179.1918 68 R 3.9078 7.9342 118.6020 59.9076 30.1580 178.3088 69 T 4.0293 7.8879 113.0860 65.7234 68.5075 175.4433 70 L 4.5171 8.0816 122.0271 56.9197 42.7331 177.8504 71 S 4.2097 7.9188 113.6863 60.2560 62.9416 175.7992 72 K 4.7786 8.0206 120.1083 54.5128 31.4028 180.0935 73 G 3.4504 8.4723 118.5792 45.6058 0.0000 170.9705 74 P 4.2883 0.0000 0.0000 62.2425 32.5825 175.9395 75 Y 4.5360 7.5461 117.1326 56.7368 39.0527 175.6568 76 K 4.2653 8.9522 125.6801 55.6304 31.0827 177.0115 77 G 4.2898 8.1563 105.0945 44.1672 0.0000 172.1540 78 I 4.7113 7.7261 122.7128 58.3515 40.4943 175.2907 79 E 4.2231 8.8338 127.0619 56.9372 29.4980 176.9567 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 8 T 8.16 4.21 4.19 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 1.09 0.00 0.00 9 G 7.69 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 0.00 0.00 0.00 0.00 10 K 8.73 4.03 0.00 1.78 1.75 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.50 7.81 11 K 7.74 4.14 0.00 1.79 1.77 0.00 1.87 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.50 7.81 12 N 8.69 4.68 0.00 2.92 2.91 0.00 0.00 6.68 6.74 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 13 L 7.91 4.66 0.00 1.57 1.59 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 14 V 7.85 4.26 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 0.57 0.00 0.00 0.79 0.00 0.00 15 V 8.76 3.46 2.05 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 1.01 0.00 0.00 0.91 0.00 0.00 16 N 8.00 3.84 0.00 2.78 3.12 0.00 0.00 6.53 7.57 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 17 S 8.20 4.92 0.00 3.91 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 18 V 8.18 4.69 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 0.85 0.00 0.00 0.93 0.00 0.00 19 I 8.44 4.03 1.95 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 1.23 0.52 1.00 0.00 0.00 20 R 8.37 4.46 0.00 1.85 1.80 0.00 3.16 0.00 0.00 3.33 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 21 R 8.65 4.60 0.00 1.73 1.85 0.00 3.28 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 22 G 8.30 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 0.00 0.00 0.00 23 K 8.63 5.16 0.00 1.96 1.83 0.00 1.53 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.43 7.81 24 A 8.69 4.63 1.20 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 0.00 0.00 0.00 25 R 8.65 3.78 0.00 1.98 2.08 0.00 3.26 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 26 A 7.78 3.64 1.26 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 0.00 0.00 0.00 27 D 9.07 4.39 0.00 2.83 2.76 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 28 G 8.22 4.16 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 0.00 0.00 0.00 29 G 7.87 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.32 3.37 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 0.77 0.00 0.00 0.93 0.00 0.00 31 G 10.28 4.07 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 0.00 32 R 8.90 4.39 0.00 1.93 1.33 0.00 3.34 0.00 0.00 3.32 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 33 K 9.41 4.35 0.00 1.75 1.88 0.00 1.90 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.34 7.81 34 T 6.54 3.79 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 35 T 8.18 4.61 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 36 G 8.69 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 37 I 8.23 5.02 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 1.40 0.66 0.91 0.00 0.00 38 T 8.93 4.57 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 39 K 8.41 3.95 0.00 1.73 1.40 0.00 2.06 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.35 1.51 7.81 40 R 5.84 3.83 0.00 2.04 1.98 0.00 3.20 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 41 V 9.08 4.54 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 0.74 0.00 0.00 0.98 0.00 0.00 42 Q 8.58 5.37 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.75 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 43 R 7.86 4.83 0.00 1.74 1.78 0.00 3.16 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 44 A 8.39 4.77 1.14 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 0.00 0.00 45 N 10.23 4.86 0.00 2.63 2.70 0.00 0.00 6.85 6.62 0.00 0.00 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 8.08 4.63 0.00 1.49 1.29 0.85 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 47 H 7.76 4.57 0.00 3.32 2.73 0.00 5.58 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 K 9.02 4.92 0.00 1.95 1.80 0.00 1.74 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.24 1.35 7.81 49 K 8.63 4.75 0.00 1.25 0.74 0.00 0.93 0.00 0.00 0.61 0.00 0.00 2.32 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.30 0.71 7.81 50 A 7.51 4.49 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 51 I 8.11 4.48 1.81 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 1.26 0.86 0.96 0.00 0.00 52 R 8.54 4.75 0.00 1.66 1.95 0.00 3.56 0.00 0.00 3.36 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 53 E 7.27 5.41 0.00 2.43 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 0.00 2.04 1.98 0.00 54 N 7.90 5.05 0.00 2.64 2.70 0.00 0.00 7.04 7.98 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 55 G 8.51 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 0.00 0.00 0.00 56 Q 7.17 4.45 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.88 0.00 0.00 0.00 0.00 0.00 2.13 2.24 0.00 57 V 8.26 4.75 2.07 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 1.05 0.00 0.00 0.98 0.00 0.00 58 K 7.94 4.28 0.00 2.00 1.40 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.38 7.81 59 T 8.38 3.89 4.15 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 1.17 0.00 0.00 60 V 7.27 3.22 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 0.82 0.00 0.00 0.95 0.00 0.00 61 W 8.54 4.16 0.00 3.33 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 62 L 8.16 4.76 0.00 1.75 1.49 0.96 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 63 S 9.22 4.36 0.00 3.95 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 64 A 8.69 3.81 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 65 N 7.91 4.74 0.00 2.71 2.87 0.00 0.00 6.61 7.35 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 66 A 9.77 4.74 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 67 L 8.31 4.60 0.00 1.74 1.69 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.93 3.91 0.00 2.00 1.96 0.00 3.25 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 69 T 7.89 4.03 4.31 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 1.41 0.00 0.00 70 L 8.08 4.52 0.00 1.86 2.02 1.04 1.04 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 71 S 7.92 4.21 0.00 4.06 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 0.00 72 K 8.02 4.78 0.00 1.77 0.97 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.66 1.61 7.81 73 G 8.47 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.29 0.00 2.12 1.93 0.00 3.49 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.86 0.00 75 Y 7.55 4.54 0.00 2.93 2.88 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 0.00 0.00 0.00 76 K 8.95 4.27 0.00 1.99 2.06 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.51 7.81 77 G 8.16 4.29 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 0.00 78 I 7.73 4.71 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 1.19 1.70 1.01 0.00 0.00 79 E 8.83 4.22 0.00 1.91 1.84 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 2.39 2.36 0.00