NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.4405 0.0000 0.0000 61.9446 32.8308 175.8566 3 L 4.2633 8.2775 119.7802 53.2129 42.3418 176.0329 4 T 4.6103 9.5439 113.8654 59.7771 73.0001 173.8992 5 P 4.4280 0.0000 0.0000 66.0934 31.2786 178.6100 6 N 4.3647 8.1977 114.5941 56.5277 38.3545 176.8286 7 D 4.4116 8.3253 120.1899 57.5803 40.6641 179.1065 8 I 3.7569 7.3391 119.4808 64.5861 37.1827 177.6369 9 H 4.3257 7.9819 118.1918 59.2083 29.8302 176.5349 10 N 4.4727 8.3910 116.4236 53.2303 38.9126 175.5517 11 K 3.8134 7.2303 122.8815 56.4244 32.7409 175.8827 12 T 4.4399 7.8405 115.2222 59.6043 71.3929 173.2504 13 F 5.0151 8.0901 120.2980 55.5812 42.4605 175.4064 14 T 4.0494 8.5585 120.6227 63.7313 68.9107 174.4066 15 K 4.4498 8.4044 124.7197 56.0319 33.1915 176.3503 16 S 4.5942 8.0690 114.2142 56.3864 65.8898 173.3500 17 A 4.0162 8.4689 124.6864 53.8515 18.5235 177.6560 18 R 3.7418 8.6274 120.2580 57.0160 27.8712 176.9533 19 G 3.7747 7.3522 106.4340 44.5114 0.0000 173.6036 20 Y 4.4109 7.8152 116.8813 57.3517 38.5707 176.2721 21 D 4.3918 8.9426 122.5744 55.3144 42.3627 177.5511 22 E 4.0867 8.8698 126.2396 59.4940 29.5985 178.9966 23 D 4.4192 8.1541 118.5771 57.4112 40.9755 178.5225 24 E 3.9762 8.5608 119.0396 59.3460 29.3963 179.6428 25 V 3.6212 7.7721 118.1768 66.1019 31.6518 177.7466 26 N 4.4032 8.6793 116.6803 56.3653 38.5084 176.9978 27 E 3.9605 8.6262 121.0249 59.2660 29.7153 178.6618 28 F 4.2597 8.4097 120.6854 61.4087 39.4416 177.1644 29 L 3.9340 8.5104 118.7001 57.4892 41.4022 179.3935 30 A 4.0214 7.9881 121.1553 54.9492 18.3024 179.5123 31 Q 3.8134 7.8092 117.9107 59.2400 29.0813 178.5047 32 V 3.3617 7.6478 119.6877 65.8081 31.4113 177.7936 33 R 3.9392 8.2216 118.8501 59.3961 29.9197 178.4123 34 K 3.9154 7.9336 119.0307 59.7229 32.2830 178.5265 35 D 4.3897 8.1697 119.1867 57.5041 40.7046 178.2496 36 Y 4.2798 8.3689 120.3967 60.5671 38.8039 177.4306 37 E 3.7277 8.4740 120.5468 59.3014 29.7013 178.9406 38 I 3.6999 7.7923 120.0397 64.3105 37.1029 178.8508 39 V 3.6489 7.8796 120.0537 64.7088 31.1208 178.3675 40 L 3.8421 7.8542 119.6535 57.3850 41.3537 179.4724 41 R 3.7965 7.9715 118.4598 59.4078 30.0163 178.5699 42 K 3.8940 8.3146 118.6672 59.3603 31.9926 179.1998 43 K 3.9025 8.2539 119.9048 59.9314 32.1520 179.0395 44 T 3.8600 8.1069 116.1773 66.5404 68.2764 176.6990 45 E 3.9140 8.5285 120.9504 59.2134 29.4433 179.0143 46 L 3.9277 8.0660 120.4831 58.3275 42.1046 178.8885 47 E 3.9283 8.4073 118.3250 59.2468 29.1445 179.2397 48 A 3.9681 7.7241 119.7414 55.2671 18.8271 179.6138 49 K 4.3614 8.1768 118.4436 58.9584 32.0584 179.7911 50 V 3.6271 8.0965 118.9355 65.9976 31.2814 177.1676 51 N 4.6970 7.8330 112.5780 54.2656 38.6281 175.8533 52 E 4.5114 7.9893 120.0085 56.4021 30.3122 177.6566 53 L 4.0248 7.5822 118.9992 57.1494 41.7933 177.3243 54 D 4.7070 7.9030 115.9718 54.0323 41.7606 175.4435 55 E 4.0848 7.8975 123.6572 56.0658 31.1397 173.6340 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 P 0.00 4.44 0.00 2.13 2.13 0.00 3.67 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.15 0.00 3 L 8.28 4.26 0.00 1.77 1.69 0.87 0.56 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 4 T 9.54 4.61 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 1.27 0.00 0.00 5 P 0.00 4.43 0.00 2.16 2.16 0.00 3.53 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 6 N 8.20 4.36 0.00 2.78 2.89 0.00 0.00 7.11 8.08 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 7 D 8.33 4.41 0.00 2.98 2.74 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 0.00 0.00 0.00 0.00 8 I 7.34 3.76 2.09 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 1.41 0.70 0.96 0.00 0.00 9 H 7.98 4.33 0.00 3.14 3.52 0.00 5.94 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 N 8.39 4.47 0.00 2.68 2.81 0.00 0.00 7.00 7.15 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 11 K 7.23 3.81 0.00 1.68 1.55 0.00 1.34 0.00 0.00 1.62 0.00 0.00 3.15 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.24 0.28 7.81 12 T 7.84 4.44 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 1.15 0.00 0.00 13 F 8.09 5.02 0.00 3.05 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 T 8.56 4.05 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 1.23 0.00 0.00 15 K 8.40 4.45 0.00 1.76 1.75 0.00 2.00 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.39 7.81 16 S 8.07 4.59 0.00 3.91 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.47 4.02 1.24 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 18 R 8.63 3.74 0.00 1.90 1.96 0.00 3.19 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 19 G 7.35 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.82 4.41 0.00 2.91 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 8.94 4.39 0.00 2.74 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.87 4.09 0.00 2.10 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 2.47 2.44 0.00 23 D 8.15 4.42 0.00 2.88 2.74 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 0.00 0.00 0.00 0.00 24 E 8.56 3.98 0.00 2.15 1.95 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 2.32 2.50 0.00 25 V 7.77 3.62 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 1.13 0.00 0.00 0.93 0.00 0.00 26 N 8.68 4.40 0.00 2.97 2.91 0.00 0.00 6.71 7.59 0.00 0.00 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 E 8.63 3.96 0.00 2.14 2.15 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 2.37 2.36 0.00 28 F 8.41 4.26 0.00 3.19 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 29 L 8.51 3.93 0.00 1.97 1.75 1.21 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.99 4.02 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 31 Q 7.81 3.81 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 32 V 7.65 3.36 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 0.85 0.00 0.00 0.08 0.00 0.00 33 R 8.22 3.94 0.00 2.01 2.08 0.00 3.32 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.93 0.00 34 K 7.93 3.92 0.00 1.89 1.90 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.47 7.81 35 D 8.17 4.39 0.00 2.73 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 8.37 4.28 0.00 2.97 3.14 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 37 E 8.47 3.73 0.00 2.11 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 2.24 2.26 0.00 38 I 7.79 3.70 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.62 0.90 0.00 0.00 39 V 7.88 3.65 2.21 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 0.91 0.00 0.00 0.95 0.00 0.00 40 L 7.85 3.84 0.00 1.73 1.57 0.18 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 41 R 7.97 3.80 0.00 1.92 2.03 0.00 3.07 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 42 K 8.31 3.89 0.00 1.87 1.84 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.44 7.81 43 K 8.25 3.90 0.00 1.81 2.00 0.00 1.63 0.00 0.00 1.63 0.00 0.00 3.21 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.63 7.81 44 T 8.11 3.86 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 1.19 0.00 0.00 45 E 8.53 3.91 0.00 1.97 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 2.31 2.53 0.00 46 L 8.07 3.93 0.00 1.94 1.66 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.41 3.93 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 2.33 2.47 0.00 48 A 7.72 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.18 4.36 0.00 1.86 1.86 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.44 7.81 50 V 8.10 3.63 2.15 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 1.03 0.00 0.00 0.93 0.00 0.00 51 N 7.83 4.70 0.00 2.85 2.84 0.00 0.00 6.97 8.91 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 52 E 7.99 4.51 0.00 2.17 1.95 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 2.23 2.44 0.00 53 L 7.58 4.02 0.00 1.68 1.74 0.96 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 54 D 7.90 4.71 0.00 2.60 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 55 E 7.90 4.08 0.00 2.17 1.99 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 2.18 2.28 0.00