NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.9051 8.1676 115.7962 56.9648 40.1989 176.8180 2 V 3.5269 7.6928 121.9753 63.5708 30.8837 176.1129 3 N 4.2629 8.9471 118.5636 56.8380 39.1901 177.9274 4 Q 4.0638 8.0766 118.7118 58.8243 28.9479 177.9405 5 H 4.1363 8.1790 119.1192 59.2607 30.1245 176.9772 6 L 3.9611 8.3361 121.2358 58.2931 41.4631 178.8634 7 C 4.4930 8.4479 118.1556 59.7088 42.7950 175.8574 8 G 3.5235 8.2298 107.3566 47.8070 0.0000 175.6470 9 S 3.9790 7.9674 115.1957 61.3875 62.3369 175.9147 10 H 4.2641 7.8146 117.6011 58.4478 28.5343 177.6719 11 L 3.9807 8.2738 121.2519 57.7185 41.3815 179.9374 12 V 3.2355 7.8686 112.8569 64.2751 31.4571 178.4620 13 E 3.9729 7.8822 118.1706 59.1635 29.2794 179.1513 14 A 3.9805 7.9493 120.9005 55.2353 18.4548 179.7091 15 L 3.7642 8.0350 117.8573 57.7039 41.3153 178.9845 16 Y 4.2285 7.6723 119.4853 60.9256 38.5163 178.4536 17 L 3.8024 7.5750 117.8615 57.7292 41.8466 179.3748 18 V 3.6621 8.1314 117.5622 65.8380 31.3531 176.9250 19 C 4.4944 9.0369 116.0068 57.8361 34.8708 174.9664 20 G 3.6567 7.8622 110.2143 46.6532 0.0000 175.3223 21 E 4.2520 8.7297 119.9052 57.2898 30.3502 178.2330 22 R 3.8967 7.5863 118.5238 59.4408 30.4305 178.0810 23 G 3.9833 9.1405 105.6222 45.4353 0.0000 171.8299 24 F 5.1118 7.5728 110.8988 56.0289 40.0767 173.3653 25 F 4.8157 8.9168 120.5437 57.4051 40.0968 175.6635 26 Y 4.7864 8.0911 124.2150 55.9350 38.9560 174.8791 27 T 4.3264 7.7283 111.6235 60.9875 71.9177 173.6483 28 D 4.3092 8.4083 120.1206 56.5317 39.5206 178.1976 29 K 4.1088 7.9049 118.5980 59.1393 32.2924 178.7294 30 A 4.3779 8.0244 120.0543 53.4112 19.4133 177.3422 31 A 4.2955 7.2569 119.7539 49.0469 18.9878 173.5515 32 K 4.4062 7.6944 121.8289 55.9290 39.9541 178.3716 33 G 3.6054 8.0370 105.6154 47.7981 0.0000 175.4755 34 I 3.2167 7.4775 122.2344 64.0372 37.1976 178.6089 35 V 3.5199 7.5937 118.3519 65.8526 31.2028 177.3843 36 E 3.9276 8.0296 118.3158 59.2992 29.4390 178.3090 37 Q 4.1566 8.2116 119.4956 58.6091 29.0943 176.3081 38 C 4.9518 8.6133 115.8204 56.3010 41.0723 173.5248 39 C 4.5189 8.0580 117.3859 57.0736 40.8266 174.3443 40 T 4.2607 7.9401 109.0930 62.3712 69.8680 174.8907 41 S 4.8055 7.3045 116.7254 55.8555 65.7601 172.8942 42 I 4.0155 8.1343 122.5662 60.8827 38.3908 175.8794 43 C 4.9485 8.5089 125.2123 55.5021 41.8513 174.3799 44 S 4.5101 9.5158 119.4840 57.8059 65.1538 175.3579 45 L 3.9545 8.4175 120.5482 58.1782 40.9822 179.2883 46 Y 4.1461 8.1787 115.5077 60.7383 38.2699 177.9683 47 Q 4.1805 8.2599 119.1836 59.0629 28.9147 178.4161 48 L 4.2726 8.3067 120.2258 57.9064 41.4903 179.1355 49 E 4.0150 8.3655 118.8012 58.7672 29.2448 178.4684 50 N 4.3220 7.8212 115.5541 56.0367 38.4308 174.9281 51 Y 4.6457 7.7197 116.7207 58.2602 37.9555 174.5712 52 C 4.9870 7.6819 117.4161 55.7505 41.8610 173.5156 53 N 4.3885 8.9677 120.4129 53.9120 38.4629 174.8495 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 1 F 8.17 4.91 0.00 3.21 3.34 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 2 V 7.69 3.53 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 0.82 0.00 0.00 0.96 0.00 0.00 3 N 8.95 4.26 0.00 2.77 2.85 0.00 0.00 7.22 7.20 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 4 Q 8.08 4.06 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.69 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 5 H 8.18 4.14 0.00 3.25 3.55 0.00 5.61 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.34 3.96 0.00 1.85 1.77 0.96 0.80 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 7 C 8.45 4.49 0.00 3.07 3.25 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 0.00 0.00 0.00 8 G 8.23 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 7.97 3.98 0.00 3.81 3.95 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 10 H 7.81 4.26 0.00 3.36 3.26 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.27 3.98 0.00 1.78 1.65 0.95 0.82 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 12 V 7.87 3.24 1.92 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 -0.02 0.00 0.00 0.76 0.00 0.00 13 E 7.88 3.97 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.53 0.00 14 A 7.95 3.98 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.04 3.76 0.00 0.74 0.40 0.71 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.67 4.23 0.00 3.21 3.17 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 17 L 7.57 3.80 0.00 1.78 1.68 0.95 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 18 V 8.13 3.66 2.11 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 0.78 0.00 0.00 0.88 0.00 0.00 19 C 9.04 4.49 0.00 3.23 3.40 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 20 G 7.86 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.73 4.25 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 22 R 7.59 3.90 0.00 2.22 2.10 0.00 3.23 0.00 0.00 3.35 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.61 0.00 23 G 9.14 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 0.00 0.00 0.00 24 F 7.57 5.11 0.00 3.28 3.09 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 25 F 8.92 4.82 0.00 3.04 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.09 4.79 0.00 3.30 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 27 T 7.73 4.33 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 1.10 0.00 0.00 28 D 8.41 4.31 0.00 2.81 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 29 K 7.90 4.11 0.00 1.77 1.93 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.50 7.81 30 A 8.02 4.38 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 31 A 7.26 4.30 -0.10 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 32 K 7.69 4.41 0.00 1.72 1.75 0.00 1.75 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.36 7.81 33 G 8.04 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.48 3.22 1.69 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.37 0.55 0.00 0.00 35 V 7.59 3.52 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 36 E 8.03 3.93 0.00 2.03 2.11 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 2.34 2.34 0.00 37 Q 8.21 4.16 0.00 2.40 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.45 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 38 C 8.61 4.95 0.00 3.08 3.09 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 39 C 8.06 4.52 0.00 3.15 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 40 T 7.94 4.26 4.25 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 0.00 0.00 1.22 0.00 0.00 41 S 7.30 4.81 0.00 3.77 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 42 I 8.13 4.02 1.88 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 1.42 0.63 0.93 0.00 0.00 43 C 8.51 4.95 0.00 3.03 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 44 S 9.52 4.51 0.00 4.22 4.13 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 45 L 8.42 3.95 0.00 1.46 1.60 0.83 0.78 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 46 Y 8.18 4.15 0.00 2.87 3.07 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 47 Q 8.26 4.18 0.00 2.38 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.76 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 48 L 8.31 4.27 0.00 1.84 1.76 0.92 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.37 4.02 0.00 2.17 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 2.29 2.34 0.00 50 N 7.82 4.32 0.00 2.43 2.43 0.00 0.00 6.98 6.77 0.00 0.00 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 Y 7.72 4.65 0.00 3.13 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 52 C 7.68 4.99 0.00 2.94 3.07 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 53 N 8.97 4.39 0.00 2.67 2.89 0.00 0.00 6.99 7.10 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