NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 Q 4.2228 8.3449 119.6781 55.6536 30.1178 174.2308 25 E 4.4039 8.5880 120.7509 54.1601 31.4336 172.2936 26 E 4.4890 8.3958 123.0121 54.2339 34.7134 175.1773 27 V 3.9893 7.8791 123.6203 63.9693 32.1347 173.6076 28 Y 4.5264 8.3509 120.5136 58.6200 41.5057 174.9550 29 C 4.2892 8.7525 115.1744 55.4194 42.9742 175.4618 30 F 4.0918 9.1583 115.7158 59.4757 36.9805 177.1721 31 C 3.7583 7.2170 118.7145 58.2083 40.0036 175.2090 32 R 3.7657 8.1527 116.7371 56.3350 28.1669 175.0948 33 N 4.8830 7.2224 114.9701 50.4721 39.8209 174.2073 34 V 3.8887 7.8745 117.7232 61.9748 32.1434 175.4270 35 S 3.3064 8.0700 118.5823 58.3073 61.4330 173.8040 36 Y 4.3234 7.1782 125.7367 59.1991 37.8693 177.1273 37 G 3.8080 7.3533 114.6210 45.5420 0.0000 171.8373 38 P 3.9931 0.0000 0.0000 62.2635 32.0244 174.4028 39 M 5.2563 7.3362 123.3328 54.3960 36.7661 173.8833 40 V 4.8838 9.5460 118.1148 61.4365 35.4222 172.4648 41 A 4.9819 8.1969 122.0176 48.7755 21.2735 176.6129 42 C 4.0822 9.0650 121.4607 56.7247 44.2620 172.9117 43 D 4.5982 7.5181 125.5791 54.5417 41.3469 175.3711 44 N 5.2052 7.8467 115.3806 50.5610 41.3619 172.9644 45 P 4.2081 0.0000 0.0000 64.7752 32.1640 176.0871 46 A 4.1123 7.6438 118.0017 49.4105 20.2815 175.1644 47 C 4.1360 8.8202 123.8519 55.5242 38.3239 172.2966 48 P 3.8316 0.0000 0.0000 64.9038 31.2208 175.8737 49 F 5.1235 8.2440 114.2252 56.1554 42.3858 173.9100 50 E 5.0427 8.6209 118.4019 55.7465 30.5768 175.4371 51 W 5.5205 7.9258 116.0164 56.2597 33.1016 174.2735 52 F 5.0482 10.5277 124.3732 56.2905 43.4848 173.7680 53 H 5.0991 8.9728 118.4296 55.0557 30.0831 176.2247 54 Y 4.4432 9.7342 120.5200 61.1692 37.9782 179.0396 55 G 3.7453 8.4112 105.5059 47.4595 0.0000 175.1114 56 C 4.2372 7.6336 117.3960 62.7034 32.2163 174.3969 57 V 5.0804 8.7276 115.9397 60.0682 31.8521 179.0100 58 G 3.8779 8.1053 119.7159 46.3903 0.0000 170.9936 59 L 4.0080 7.1531 125.3439 55.0922 42.1770 173.5948 60 K 4.2535 6.8364 116.8551 55.8344 34.9177 176.8791 61 Q 3.5690 10.0544 120.5614 55.4981 26.8548 169.5317 62 A 3.4083 7.1144 128.1231 50.3872 19.5250 176.0686 63 P 4.3399 0.0000 0.0000 62.4178 32.1407 177.4079 64 K 4.3151 8.5642 120.4752 55.1450 29.6793 177.7262 65 G 4.5537 7.3583 117.0052 44.9727 0.0000 170.1976 66 K 4.6395 7.8353 117.2811 54.9288 35.9165 176.0756 67 W 4.8159 8.7391 131.4990 55.9034 34.7802 173.2515 68 Y 4.3866 5.4419 119.8043 56.7215 39.1428 176.9446 69 C 3.4691 8.0063 119.5055 58.2603 37.5165 174.0129 70 S 4.8117 7.8295 114.3765 57.0243 67.0104 175.4578 71 K 3.7674 8.7860 121.0012 59.8264 32.0891 179.2543 72 D 4.2538 8.1741 118.0092 57.3725 41.0357 179.1709 73 C 3.5855 7.9277 116.9039 59.6124 42.8814 175.5712 74 K 2.4800 7.6089 120.8286 58.8607 31.7333 178.3860 75 E 4.1421 7.2541 120.2443 58.7367 29.1653 179.0140 76 I 3.6665 8.3835 119.9790 64.0023 37.1518 177.8480 77 A 4.6995 7.5205 122.7460 54.3376 18.3718 179.1388 78 N 4.4692 7.7967 114.5236 53.3069 38.5813 172.3637 79 Q 3.2209 7.6208 121.3980 56.0018 26.5654 173.3660 80 R 3.5242 8.4876 115.4482 56.9813 26.8761 175.6602 81 S 4.6857 7.6671 114.7735 55.8773 66.2205 176.0435 82 K 4.0165 8.6858 121.8689 59.4116 32.1794 177.2651 83 S 4.2630 7.3229 119.1854 58.8581 62.6429 173.9583 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 24 Q 8.34 4.22 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.68 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 25 E 8.59 4.40 0.00 1.95 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.36 0.00 26 E 8.40 4.49 0.00 1.63 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.15 0.00 27 V 7.88 3.99 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.82 0.00 0.00 28 Y 8.35 4.53 0.00 2.80 2.64 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 29 C 8.75 4.29 0.00 3.30 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 30 F 9.16 4.09 0.00 3.30 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 31 C 7.22 3.76 0.00 2.93 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 32 R 8.15 3.77 0.00 1.92 2.03 0.00 3.18 0.00 0.00 3.32 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.83 0.00 33 N 7.22 4.88 0.00 3.00 2.98 0.00 0.00 6.50 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.87 3.89 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 0.85 0.00 0.00 0.82 0.00 0.00 35 S 8.07 3.31 0.00 3.62 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 Y 7.18 4.32 0.00 3.02 2.91 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 37 G 7.35 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 0.00 0.00 0.00 38 P 0.00 3.99 0.00 1.86 2.14 0.00 3.72 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.02 0.00 39 M 7.34 5.26 0.00 1.93 1.78 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 40 V 9.55 4.88 2.51 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 1.17 0.00 0.00 1.18 0.00 0.00 41 A 8.20 4.98 0.21 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 0.00 0.00 0.00 42 C 9.07 4.08 0.00 3.30 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.52 4.60 0.00 2.41 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 0.00 0.00 0.00 0.00 44 N 7.85 5.21 0.00 3.18 2.69 0.00 0.00 7.10 7.63 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 45 P 0.00 4.21 0.00 2.07 2.14 0.00 3.71 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 46 A 7.64 4.11 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 47 C 8.82 4.14 0.00 3.33 3.47 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 0.00 0.00 0.00 0.00 48 P 0.00 3.83 0.00 2.27 2.03 0.00 3.73 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.19 0.00 49 F 8.24 5.12 0.00 2.87 2.91 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 50 E 8.62 5.04 0.00 1.97 1.55 0.00 0.00 0.00 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 2.34 0.00 51 W 7.93 5.52 0.00 2.93 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 0.00 0.00 0.00 0.00 52 F 10.53 5.05 0.00 3.17 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 H 8.97 5.10 0.00 3.27 3.04 0.00 5.64 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 9.73 4.44 0.00 2.93 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 55 G 8.41 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.63 4.24 0.00 3.00 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 57 V 8.73 5.08 2.55 0.00 0.00 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 0.00 0.00 0.95 0.00 0.00 58 G 8.11 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 59 L 7.15 4.01 0.00 0.84 0.71 -0.11 -1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 60 K 6.84 4.25 0.00 1.70 1.68 0.00 1.81 0.00 0.00 1.80 0.00 0.00 3.09 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.38 1.35 7.81 61 Q 10.05 3.57 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.04 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 62 A 7.11 3.41 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.34 0.00 2.15 2.12 0.00 3.92 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 64 K 8.56 4.32 0.00 1.76 1.81 0.00 1.91 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.40 7.81 65 G 7.36 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.84 4.64 0.00 1.53 1.67 0.00 1.34 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.28 1.30 7.81 67 W 8.74 4.82 0.00 3.43 2.91 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 68 Y 5.44 4.39 0.00 2.27 2.41 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 69 C 8.01 3.47 0.00 1.23 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 0.00 0.00 0.00 70 S 7.83 4.81 0.00 3.85 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 71 K 8.79 3.77 0.00 1.80 1.86 0.00 1.69 0.00 0.00 1.86 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.63 1.61 7.81 72 D 8.17 4.25 0.00 2.63 2.63 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 73 C 7.93 3.59 0.00 2.87 3.02 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 0.00 0.00 0.00 74 K 7.61 2.48 0.00 1.36 1.33 0.00 1.47 0.00 0.00 1.32 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.07 0.31 7.81 75 E 7.25 4.14 0.00 2.23 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 0.00 2.22 2.17 0.00 76 I 8.38 3.67 1.94 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.66 0.90 0.00 0.00 77 A 7.52 4.70 1.11 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 0.00 0.00 78 N 7.80 4.47 0.00 2.79 2.77 0.00 0.00 7.06 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 7.62 3.22 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.12 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 80 R 8.49 3.52 0.00 1.84 1.88 0.00 3.13 0.00 0.00 3.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 81 S 7.67 4.69 0.00 3.88 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 82 K 8.69 4.02 0.00 1.74 1.90 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.78 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.44 7.81 83 S 7.32 4.26 0.00 3.84 3.73 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