NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3582 8.2649 123.5881 52.0317 19.7599 175.8616 3 R 4.4799 7.3550 121.6149 52.9400 33.0174 176.0281 4 K 3.8548 9.2512 124.7944 59.8323 33.2919 178.0757 5 A 3.9128 8.2399 119.5414 55.5331 18.1066 178.1590 6 L 4.5030 8.3044 112.9213 55.1195 42.0223 177.9269 7 I 4.4647 8.1704 120.3748 60.4587 36.5944 175.7173 8 E 4.4777 7.6348 116.4230 55.8646 30.7364 178.2973 9 K 3.5297 7.8402 121.3192 59.5211 32.3322 177.4799 10 A 4.1121 7.7884 120.1205 53.6678 18.4527 178.5495 11 K 4.1479 7.9332 114.4633 56.4659 32.6318 178.8831 12 R 3.6447 7.1326 118.0449 56.8091 29.8849 179.5547 13 T 3.5966 7.4036 117.5197 64.9912 65.2257 171.3794 14 P 4.3901 0.0000 0.0000 62.6282 32.7008 179.3363 15 K 3.7594 8.7184 122.2386 57.1152 32.5401 175.9325 16 F 4.7925 8.9239 117.4701 55.9990 43.0928 174.9733 17 K 4.2836 8.8850 123.3872 58.3401 32.2481 177.8974 18 V 3.9642 7.6998 112.5121 63.1439 31.9714 176.7736 19 R 4.3848 7.8676 117.2468 56.1455 30.0470 176.3753 20 A 4.3086 7.7971 121.7532 51.9834 19.2573 177.4501 21 Y 4.5586 8.4225 119.6249 57.8248 39.0697 177.2940 22 T 2.9261 7.5665 112.6602 58.3245 72.4991 169.5997 23 R 3.9750 7.9289 128.6414 54.2716 30.4623 175.9398 24 C 4.5471 8.2923 121.3458 59.5014 32.2079 173.7037 25 V 4.0880 8.4804 126.4549 61.4933 31.6453 176.1588 26 R 4.7467 7.7538 120.4365 58.0621 36.3480 174.7115 27 C 4.6914 7.9597 108.8462 56.6047 30.9843 174.8867 28 G 3.9474 7.9863 107.2194 45.1913 0.0000 173.6789 29 R 4.1237 7.7451 121.1053 56.0382 28.3701 176.1131 30 A 4.2719 8.3196 125.0723 54.6084 18.9361 179.1993 31 R 4.0687 7.2528 112.6155 59.7170 30.8714 177.3360 32 S 4.7763 7.6005 112.3610 56.8055 62.4002 175.2212 33 V 4.4878 7.8242 113.1802 62.4165 32.5784 177.4376 34 Y 4.2726 9.6131 124.3216 57.9611 39.2085 177.1597 35 R 3.9180 8.9287 122.2221 59.5050 30.5572 178.8588 36 F 3.9845 8.3309 118.2212 60.3082 39.4686 175.5656 37 F 4.9474 8.3975 116.5105 56.6972 41.3117 176.9777 38 G 4.1594 8.5673 107.7533 45.3128 0.0000 173.0268 39 L 4.8885 7.4971 118.6772 53.1637 43.6501 175.8909 40 C 4.9852 8.2602 115.8286 57.0276 30.7986 174.5338 41 R 3.7955 8.5049 117.7402 60.2014 28.4625 178.7083 42 I 3.7973 7.7087 119.8064 64.0905 37.3420 177.5587 43 C 4.1363 8.0003 116.7243 62.9998 28.1016 175.8094 44 L 3.5846 7.9554 121.8067 58.3145 41.2974 179.2107 45 R 3.7220 7.1682 116.1834 59.1396 30.1493 178.0004 46 E 4.1098 8.4348 118.7997 59.6042 29.5566 179.4316 47 L 3.9496 8.3131 119.0432 57.6782 41.4140 179.4447 48 A 3.9237 7.6889 119.8737 55.3960 18.2709 179.1007 49 H 4.4278 7.5971 114.0520 58.7086 28.8245 177.7375 50 K 4.2142 7.8035 119.5059 58.2019 32.4716 177.9007 51 G 4.1127 8.1781 105.8498 45.5540 0.0000 174.5192 52 Q 4.1597 7.9058 116.6077 56.2417 29.0212 176.2883 53 L 4.4911 7.2599 119.9673 51.3538 41.3275 172.4602 54 P 4.2730 0.0000 0.0000 63.8321 30.9363 176.5544 55 G 3.9699 8.8449 112.0116 46.6857 0.0000 173.9020 56 V 4.1924 7.5107 120.0787 60.6543 30.6303 174.8244 57 R 4.2948 7.7603 124.4617 54.6408 31.7558 175.0908 58 K 4.2869 8.2962 118.4377 55.2134 32.8448 177.2426 59 A 4.4080 8.5227 126.4406 51.5112 19.3509 176.5134 60 S 5.1245 8.4908 115.6698 58.1655 64.7851 177.1561 61 W 4.2756 8.3039 123.2678 57.3868 27.1949 174.0580 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 2 A 8.26 4.36 1.31 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 0.00 0.00 0.00 3 R 7.35 4.48 0.00 1.97 1.84 0.00 3.19 0.00 0.00 3.36 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 4 K 9.25 3.85 0.00 1.82 1.90 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.50 7.81 5 A 8.24 3.91 1.31 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 0.00 0.00 0.00 6 L 8.30 4.50 0.00 1.77 1.79 0.95 0.88 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 7 I 8.17 4.46 1.96 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.96 0.90 0.00 0.00 8 E 7.63 4.48 0.00 2.14 2.33 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 2.33 2.31 0.00 9 K 7.84 3.53 0.00 0.99 1.59 0.00 1.61 0.00 0.00 1.52 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.73 0.76 7.81 10 A 7.79 4.11 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 11 K 7.93 4.15 0.00 1.95 1.85 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.44 7.81 12 R 7.13 3.64 0.00 1.86 1.77 0.00 3.32 0.00 0.00 3.20 7.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 13 T 7.40 3.60 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 1.17 0.00 0.00 14 P 0.00 4.39 0.00 2.53 2.37 0.00 3.75 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 2.10 1.95 0.00 15 K 8.72 3.76 0.00 1.77 1.46 0.00 1.83 0.00 0.00 1.88 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.56 1.18 7.81 16 F 8.92 4.79 0.00 2.96 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.89 4.28 0.00 1.89 1.96 0.00 1.59 0.00 0.00 1.73 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.52 7.81 18 V 7.70 3.96 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 0.76 0.00 0.00 0.97 0.00 0.00 19 R 7.87 4.38 0.00 1.98 2.10 0.00 3.59 0.00 0.00 3.36 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 20 A 7.80 4.31 1.31 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 0.00 0.00 0.00 21 Y 8.42 4.56 0.00 3.04 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 22 T 7.57 2.93 4.32 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 1.26 0.00 0.00 23 R 7.93 3.97 0.00 1.96 2.01 0.00 3.48 0.00 0.00 3.43 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.42 0.00 24 C 8.29 4.55 0.00 3.19 2.96 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 0.00 0.00 0.00 0.00 25 V 8.48 4.09 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 0.79 0.00 0.00 0.95 0.00 0.00 26 R 7.75 4.75 0.00 1.76 1.93 0.00 3.17 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 27 C 7.96 4.69 0.00 3.07 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 28 G 7.99 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 0.00 0.00 0.00 29 R 7.75 4.12 0.00 1.93 1.92 0.00 3.27 0.00 0.00 3.37 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00 30 A 8.32 4.27 1.40 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 0.00 0.00 31 R 7.25 4.07 0.00 1.78 2.02 0.00 3.33 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 32 S 7.60 4.78 0.00 3.99 4.02 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 33 V 7.82 4.49 2.20 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 0.89 0.00 0.00 1.05 0.00 0.00 34 Y 9.61 4.27 0.00 3.20 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 35 R 8.93 3.92 0.00 1.94 2.01 0.00 3.17 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.64 0.00 36 F 8.33 3.98 0.00 2.85 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.40 4.95 0.00 3.35 2.99 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.57 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 39 L 7.50 4.89 0.00 1.81 1.57 0.82 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.26 4.99 0.00 3.18 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 41 R 8.50 3.80 0.00 2.18 2.48 0.00 2.80 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.75 0.00 42 I 7.71 3.80 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.52 0.91 0.00 0.00 43 C 8.00 4.14 0.00 2.94 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 44 L 7.96 3.58 0.00 1.43 1.64 0.45 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.17 3.72 0.00 1.87 2.08 0.00 3.31 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 46 E 8.43 4.11 0.00 2.09 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 0.00 2.32 2.48 0.00 47 L 8.31 3.95 0.00 1.55 1.63 0.86 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.69 3.92 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 49 H 7.60 4.43 0.00 3.30 3.32 0.00 5.66 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 50 K 7.80 4.21 0.00 1.84 1.86 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.68 7.81 51 G 8.18 4.11 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 0.00 52 Q 7.91 4.16 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 7.01 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 53 L 7.26 4.49 0.00 1.75 1.59 0.23 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.27 0.00 2.23 2.18 0.00 4.03 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 55 G 8.84 3.97 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 0.00 0.00 0.00 56 V 7.51 4.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.16 0.00 0.00 57 R 7.76 4.29 0.00 1.83 1.86 0.00 3.29 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 58 K 8.30 4.29 0.00 1.82 1.77 0.00 1.85 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.40 7.81 59 A 8.52 4.41 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.49 5.12 0.00 3.93 3.86 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 61 W 8.30 4.28 0.00 3.36 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