NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 V 4.1796 8.0544 114.0592 61.4612 33.8847 176.2314 14 K 4.3833 7.4687 121.3048 54.4910 32.3386 173.7278 15 C 4.8179 8.0728 118.6723 58.0787 30.7394 172.4574 16 F 4.5456 8.3295 116.9964 57.6567 39.1076 176.6703 17 N 3.9383 6.7388 118.9409 52.5336 38.4943 174.2237 18 C 4.4905 7.7057 126.4904 61.4672 35.8037 173.0965 19 G 4.1119 7.9396 106.4725 45.0568 0.0000 172.0489 20 K 4.1266 7.8561 122.1507 56.0315 35.6281 175.1244 21 E 4.4026 8.4529 117.6440 57.5425 30.9790 173.4825 22 G 3.4952 8.8121 116.8804 45.8913 0.0000 173.9484 23 H 4.3348 8.2753 118.4042 57.1944 29.1628 175.5702 24 T 3.9426 8.9188 113.1765 64.0478 65.7887 171.2669 25 A 4.0040 8.3647 116.4115 53.2496 16.4649 178.6863 26 R 4.7248 7.9676 114.0304 57.4455 32.3603 176.2679 27 N 4.6788 7.6032 115.3441 52.4348 38.6821 175.2615 28 H 4.6954 7.8957 116.5150 53.8694 28.3386 175.3656 29 R 4.2804 8.0699 121.1203 55.8400 30.8566 177.9295 30 A 4.7615 7.8286 119.1048 50.7750 19.7452 174.0205 31 P 4.3301 0.0000 0.0000 64.6945 32.2675 178.0878 32 R 4.5762 7.6095 116.4060 54.6671 32.0489 175.6838 33 K 4.5669 8.3051 118.2199 56.3813 32.2498 175.5720 34 K 3.9744 8.1193 118.6010 57.0001 31.8359 178.9215 35 G 4.2627 7.2924 107.1104 44.6531 0.0000 171.8843 36 C 4.2549 8.4059 119.7730 59.5592 31.8993 173.4783 37 W 4.5606 8.7024 133.9324 56.7178 30.5761 175.9143 38 K 4.7849 7.9035 115.0903 58.0328 38.5675 176.6314 39 C 4.1808 8.2037 118.9999 60.1001 32.1247 172.8146 40 G 3.6813 9.7017 105.8775 44.3425 0.0000 172.1571 41 K 4.3750 7.1279 118.2003 55.6315 36.0352 175.0865 42 E 4.0133 8.5341 125.9829 57.1851 30.8153 174.3945 43 G 4.0870 8.5409 108.5429 45.6745 0.0000 174.8199 44 H 5.0902 7.1380 118.2144 53.7826 30.5786 172.0996 45 Q 5.0379 8.4480 114.5343 55.8054 31.0040 174.6047 46 M 4.1989 8.7004 114.2145 58.2414 31.5160 177.7451 47 K 4.1737 8.0626 118.4799 59.2924 32.7670 178.0921 48 D 4.4349 8.1803 117.4435 57.2295 41.0825 176.6760 49 C 4.1564 8.0091 118.8910 59.8231 31.9497 173.1876 50 T 3.9453 8.5969 124.5774 66.3101 69.0853 174.8391 51 E 3.7205 7.8940 118.4037 57.2439 27.7698 174.1537 52 R 4.0791 7.9054 119.7371 57.2990 31.4495 175.7087 53 Q 3.7808 8.0808 119.8544 56.4413 28.9352 173.2695 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 13 V 8.05 4.18 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 0.87 0.00 0.00 0.96 0.00 0.00 14 K 7.47 4.38 0.00 1.87 1.77 0.00 1.73 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.51 7.81 15 C 8.07 4.82 0.00 3.06 2.98 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 16 F 8.33 4.55 0.00 3.25 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 17 N 6.74 3.94 0.00 1.95 2.25 0.00 0.00 6.60 7.66 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 18 C 7.71 4.49 0.00 2.70 2.77 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 19 G 7.94 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 20 K 7.86 4.13 0.00 1.57 1.35 0.00 1.85 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.34 7.81 21 E 8.45 4.40 0.00 2.06 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 22 G 8.81 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.28 4.33 0.00 3.20 3.14 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 T 8.92 3.94 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 25 A 8.36 4.00 1.62 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 0.00 0.00 0.00 0.00 0.00 0.00 26 R 7.97 4.72 0.00 2.02 1.85 0.00 3.21 0.00 0.00 3.39 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 27 N 7.60 4.68 0.00 2.51 2.44 0.00 0.00 6.60 7.76 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 28 H 7.90 4.70 0.00 3.16 3.18 0.00 5.75 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 R 8.07 4.28 0.00 1.91 1.94 0.00 3.18 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 30 A 7.83 4.76 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 31 P 0.00 4.33 0.00 2.11 2.15 0.00 3.77 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 1.97 1.96 0.00 32 R 7.61 4.58 0.00 1.86 2.04 0.00 3.28 0.00 0.00 2.99 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 33 K 8.31 4.57 0.00 1.68 1.67 0.00 1.67 0.00 0.00 1.27 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.26 1.28 7.81 34 K 8.12 3.97 0.00 1.94 1.79 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.36 7.81 35 G 7.29 4.26 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 0.00 36 C 8.41 4.25 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 37 W 8.70 4.56 0.00 3.29 3.24 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 38 K 7.90 4.78 0.00 2.20 1.95 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.58 7.81 39 C 8.20 4.18 0.00 3.01 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 40 G 9.70 3.68 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 0.00 0.00 0.00 41 K 7.13 4.37 0.00 1.77 1.65 0.00 1.75 0.00 0.00 1.95 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.38 7.81 42 E 8.53 4.01 0.00 2.08 1.90 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 2.24 2.28 0.00 43 G 8.54 4.09 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 0.00 0.00 0.00 44 H 7.14 5.09 0.00 3.32 3.43 0.00 5.46 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.45 5.04 0.00 2.26 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.96 0.00 0.00 0.00 0.00 0.00 2.50 2.39 0.00 46 M 8.70 4.20 0.00 2.39 2.35 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.63 0.00 47 K 8.06 4.17 0.00 1.79 1.91 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.46 7.81 48 D 8.18 4.43 0.00 2.80 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 49 C 8.01 4.16 0.00 2.90 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 50 T 8.60 3.95 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 1.24 0.00 0.00 51 E 7.89 3.72 0.00 2.07 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 2.22 2.29 0.00 52 R 7.91 4.08 0.00 1.81 1.93 0.00 3.44 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 53 Q 8.08 3.78 0.00 2.22 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.44 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00