#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gz7 n GLY 0 N 0.00 -2.33 3.54 2.61 0.00 -1.26 -5.24 105.19 102.51 3gz7 n GLY 0 Ca 0.00 0.75 -0.10 0.00 0.00 0.00 0.00 46.02 46.67 3gz7 n GLY 0 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3gz7 s ILE 2 N 0.00 0.00 -0.12 -0.61 -5.25 -0.25 -4.77 121.20 110.20 3gz7 s ILE 2 Ca 0.00 0.00 -0.01 0.00 -0.99 0.00 0.00 60.65 59.65 3gz7 s ILE 2 Cb 0.00 -1.00 -0.02 0.00 2.95 0.00 0.00 42.46 44.39 3gz7 s ILE 2 CO 0.00 0.00 -0.09 -1.10 -1.79 0.00 0.00 174.94 171.96 3gz7 s GLN 3 N -1.97 3.33 0.20 0.37 -0.21 -0.04 -0.65 119.66 120.68 3gz7 s GLN 3 Ca 0.00 -0.62 -0.30 0.00 0.02 0.00 0.00 55.36 54.47 3gz7 s GLN 3 Cb -0.01 -2.69 -0.08 0.00 1.00 0.00 0.00 33.01 31.23 3gz7 s GLN 3 CO -0.02 0.31 1.11 -2.00 -2.12 0.00 0.00 175.29 172.57 3gz7 s GLU 4 N 0.12 4.59 -0.23 2.91 2.12 0.24 -0.05 118.70 128.40 3gz7 s GLU 4 Ca -0.04 1.75 0.01 0.00 0.36 0.00 0.00 54.97 57.05 3gz7 s GLU 4 Cb -0.14 -3.25 0.06 0.00 0.26 0.00 0.00 34.13 31.05 3gz7 s GLU 4 CO 0.04 0.09 -0.06 0.42 -0.54 0.00 0.00 175.26 175.21 3gz7 s ILE 5 N -0.41 1.51 -0.28 -3.70 -1.09 0.16 -1.22 121.20 116.18 3gz7 s ILE 5 Ca 0.49 -1.17 -0.04 0.00 -2.23 0.00 0.00 60.65 57.71 3gz7 s ILE 5 Cb -0.30 -1.76 0.03 0.00 -1.58 0.00 0.00 42.46 38.85 3gz7 s ILE 5 CO 0.36 -0.06 0.01 0.00 -1.23 0.00 0.00 174.94 174.01 3gz7 s ALA 6 N 1.41 2.86 -0.28 9.38 0.00 -0.45 -1.66 121.76 133.03 3gz7 s ALA 6 Ca -0.05 -1.55 -0.19 0.00 0.00 0.00 0.00 51.96 50.17 3gz7 s ALA 6 Cb -0.18 -1.92 -0.02 0.00 0.00 0.00 0.00 23.12 20.99 3gz7 s ALA 6 CO -0.06 -0.99 0.57 -1.12 0.00 0.00 0.00 175.76 174.16 3gz7 s SER 7 N 1.37 6.48 -0.01 0.00 0.01 0.51 -0.76 113.70 121.29 3gz7 s SER 7 Ca -0.00 0.51 0.08 0.00 1.31 0.00 0.00 55.95 57.85 3gz7 s SER 7 Cb -0.18 -2.31 -0.02 0.00 0.21 0.00 0.00 66.02 63.73 3gz7 s SER 7 CO -0.01 -0.37 -0.25 -0.63 0.41 0.00 0.00 173.24 172.39 3gz7 s ILE 8 N 2.44 1.98 -0.16 1.44 1.01 0.07 -1.23 121.20 126.74 3gz7 s ILE 8 Ca 0.23 -1.11 0.01 0.00 0.00 0.00 0.00 60.65 59.79 3gz7 s ILE 8 Cb -0.15 -1.65 0.01 0.00 0.01 0.00 0.00 42.46 40.67 3gz7 s ILE 8 CO 0.10 0.52 -0.20 -0.22 0.00 0.00 0.00 174.94 175.14 3gz7 s LEU 9 N -0.69 2.20 0.11 2.97 2.96 -1.26 -1.37 118.68 123.60 3gz7 s LEU 9 Ca 0.10 -0.59 0.00 0.00 -0.22 0.00 0.00 54.13 53.42 3gz7 s LEU 9 Cb -0.10 -1.49 -0.04 0.00 0.50 0.00 0.00 46.19 45.07 3gz7 s LEU 9 CO -0.00 0.05 0.26 -0.69 -1.32 0.00 0.00 176.35 174.65 3gz7 s VAL 10 N 0.98 5.33 0.69 1.68 1.01 -0.13 -0.45 120.40 129.52 3gz7 s VAL 10 Ca -0.03 -0.44 -0.13 0.00 0.00 0.00 0.00 61.98 61.39 3gz7 s VAL 10 Cb -0.15 -3.67 0.01 0.00 0.00 0.00 0.00 36.38 32.57 3gz7 s VAL 10 CO -0.05 0.03 1.09 -1.10 0.00 0.00 0.00 175.10 175.07 3gz7 s GLN 11 N -2.81 2.74 0.15 2.72 -0.21 -0.23 -4.63 119.66 117.38 3gz7 s GLN 11 Ca 0.36 1.21 -0.31 0.00 0.02 0.00 0.00 55.36 56.63 3gz7 s GLN 11 Cb -0.12 -1.95 -0.11 0.00 1.00 0.00 0.00 33.01 31.83 3gz7 s GLN 11 CO 0.28 -1.28 1.81 -2.14 -2.12 0.00 0.00 175.29 171.84 3gz7 s PRO 12 N -4.52 4.13 0.00 2.91 0.02 -1.26 -1.93 135.00 134.35 3gz7 s PRO 12 Ca 0.63 2.61 0.00 0.00 0.02 0.00 0.00 61.00 64.26 3gz7 s PRO 12 Cb -0.17 -3.46 0.00 0.00 0.02 0.00 0.00 34.50 30.88 3gz7 s PRO 12 CO 0.48 -0.82 0.00 0.41 -0.33 0.00 0.00 177.00 176.73 3gz7 n GLY 13 N 4.18 1.90 1.06 0.52 0.00 -1.26 -4.90 105.19 106.68 3gz7 n GLY 13 Ca 0.17 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.28 3gz7 n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gz7 n ARG 14 N -2.00 2.40 -0.16 1.61 5.12 -0.81 -4.54 116.66 118.26 3gz7 n ARG 14 Ca 0.00 -2.03 -0.09 0.00 -1.93 0.00 0.00 57.85 53.81 3gz7 n ARG 14 Cb 0.00 -1.47 0.00 0.00 -1.16 0.00 0.00 32.46 29.83 3gz7 n ARG 14 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 3gz7 h GLU 15 N 3.23 0.74 -0.18 5.56 3.07 -1.91 -0.43 114.58 124.66 3gz7 h GLU 15 Ca 0.00 -0.16 -0.16 0.00 -0.50 0.00 0.00 59.36 58.54 3gz7 h GLU 15 Cb 0.80 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.60 3gz7 h GLU 15 CO 0.02 0.71 -0.54 0.00 -1.40 0.00 0.00 179.01 177.80 3gz7 h ALA 16 N 1.00 0.71 -0.44 3.43 0.00 -1.98 -1.50 119.26 120.48 3gz7 h ALA 16 Ca 0.15 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 3gz7 h ALA 16 Cb 0.28 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3gz7 h ALA 16 CO -0.00 0.69 0.24 -0.44 0.00 0.00 0.00 179.25 179.73 3gz7 h ASP 17 N 0.42 0.55 -0.04 0.00 3.32 -1.83 -1.17 116.42 117.66 3gz7 h ASP 17 Ca 0.01 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 56.96 3gz7 h ASP 17 Cb 1.08 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.49 3gz7 h ASP 17 CO 0.10 0.48 0.00 0.15 -1.72 0.00 0.00 179.24 178.26 3gz7 h PHE 18 N 0.57 0.08 -0.89 4.55 3.57 -0.93 -1.27 116.94 122.63 3gz7 h PHE 18 Ca 0.15 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.77 3gz7 h PHE 18 Cb 0.06 -0.02 -0.09 0.00 2.79 0.00 0.00 35.95 38.69 3gz7 h PHE 18 CO -0.02 0.34 0.51 0.93 -2.23 0.00 0.00 178.31 177.84 3gz7 h GLU 19 N -0.20 0.76 -0.33 1.11 5.08 -1.28 -0.20 114.58 119.52 3gz7 h GLU 19 Ca 0.01 -0.05 0.04 0.00 -1.00 0.00 0.00 59.36 58.36 3gz7 h GLU 19 Cb 0.30 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 3gz7 h GLU 19 CO 0.00 0.50 0.12 0.00 -1.00 0.00 0.00 179.01 178.63 3gz7 h ALA 20 N 1.53 0.38 0.00 3.43 0.00 -1.04 -2.31 119.26 121.24 3gz7 h ALA 20 Ca 0.46 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.32 3gz7 h ALA 20 Cb 0.54 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3gz7 h ALA 20 CO -0.30 -0.28 -0.42 0.78 0.00 0.00 0.00 179.25 179.03 3gz7 h GLY 21 N 0.26 0.00 0.66 0.00 0.00 -0.39 -0.46 103.07 103.14 3gz7 h GLY 21 Ca 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.46 3gz7 h GLY 21 CO -0.15 0.00 -0.02 -2.08 0.00 0.00 0.00 176.54 174.29 3gz7 h VAL 22 N 0.00 1.31 -0.63 4.60 2.07 -0.84 -0.56 116.25 122.21 3gz7 h VAL 22 Ca -0.00 -0.96 0.06 0.00 0.82 0.00 0.00 66.70 66.61 3gz7 h VAL 22 Cb 0.75 1.84 -0.05 0.00 -1.52 0.00 0.00 31.29 32.31 3gz7 h VAL 22 CO 0.05 0.26 0.34 0.00 0.02 0.00 0.00 177.57 178.24 3gz7 h ALA 23 N 0.64 0.83 -0.22 1.67 0.00 -1.27 -1.25 119.26 119.67 3gz7 h ALA 23 Ca 0.01 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3gz7 h ALA 23 Cb 0.43 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3gz7 h ALA 23 CO 0.01 0.00 -0.03 0.37 0.00 0.00 0.00 179.25 179.60 3gz7 h GLN 24 N 0.63 0.32 -0.01 0.00 4.15 -0.99 -2.77 115.11 116.43 3gz7 h GLN 24 Ca 0.28 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.64 3gz7 h GLN 24 Cb 0.18 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.82 3gz7 h GLN 24 CO -0.18 0.37 0.00 0.00 -1.93 0.00 0.00 178.83 177.09 3gz7 n ALA 25 N -2.49 2.65 -0.35 3.38 0.00 -0.23 -4.35 120.51 119.12 3gz7 n ALA 25 Ca 0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 53.44 53.16 3gz7 n ALA 25 Cb 0.21 -1.40 0.09 0.00 0.00 0.00 0.00 19.45 18.36 3gz7 n ALA 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gz7 h ARG 26 N 0.57 1.28 -0.97 0.00 3.08 -1.15 -2.15 114.38 115.04 3gz7 h ARG 26 Ca 0.00 -0.12 0.08 0.00 0.07 0.00 0.00 59.98 60.01 3gz7 h ARG 26 Cb 0.12 -0.26 -0.07 0.00 0.08 0.00 0.00 29.97 29.84 3gz7 h ARG 26 CO 0.00 0.90 0.62 -1.35 -1.07 0.00 0.00 179.97 179.07 3gz7 h PRO 27 N 1.30 1.05 -0.86 0.04 0.11 -1.84 -2.91 132.00 128.89 3gz7 h PRO 27 Ca 0.33 -0.06 0.07 0.00 0.11 0.00 0.00 66.00 66.45 3gz7 h PRO 27 Cb -0.04 -0.24 -0.06 0.00 0.11 0.00 0.00 31.00 30.77 3gz7 h PRO 27 CO -0.06 0.69 0.52 -0.07 -0.21 0.00 0.00 178.00 178.87 3gz7 h LEU 28 N 1.08 0.81 -1.78 2.35 3.38 -1.69 -1.70 115.31 117.75 3gz7 h LEU 28 Ca 0.43 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.42 3gz7 h LEU 28 Cb 0.25 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3gz7 h LEU 28 CO -0.18 0.50 0.00 0.49 0.09 0.00 0.00 178.44 179.34 3gz7 n PHE 29 N -4.65 0.00 0.00 1.13 3.72 -1.10 -2.90 117.46 113.67 3gz7 n PHE 29 Ca 0.13 -0.19 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 3gz7 n PHE 29 Cb 0.20 -0.15 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 3gz7 n PHE 29 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 3gz7 n ARG 31 N 0.65 0.00 -2.55 -1.08 1.85 -0.64 -4.71 116.66 110.18 3gz7 n ARG 31 Ca 0.00 0.00 -0.39 0.00 -1.00 0.00 0.00 57.85 56.46 3gz7 n ARG 31 Cb 0.22 0.00 -0.05 0.00 -1.05 0.00 0.00 32.46 31.58 3gz7 n ARG 31 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3gz7 s ALA 32 N 0.00 3.32 0.21 2.89 0.00 -1.14 -4.97 121.76 122.07 3gz7 s ALA 32 Ca 0.00 0.79 -0.32 0.00 0.00 0.00 0.00 51.96 52.43 3gz7 s ALA 32 Cb 0.00 -3.29 -0.12 0.00 0.00 0.00 0.00 23.12 19.72 3gz7 s ALA 32 CO 0.00 -0.09 1.69 0.50 0.00 0.00 0.00 175.76 177.85 3gz7 s ARG 33 N -1.65 4.14 -0.05 0.00 3.52 -1.26 -2.22 118.95 121.43 3gz7 s ARG 33 Ca 0.47 2.57 0.00 0.00 -0.13 0.00 0.00 55.73 58.64 3gz7 s ARG 33 Cb -0.28 -3.08 0.00 0.00 -1.56 0.00 0.00 34.95 30.03 3gz7 s ARG 33 CO 0.36 -0.72 0.00 0.41 -0.81 0.00 0.00 175.30 174.54 3gz7 n GLY 34 N 3.74 0.42 3.68 8.12 0.00 -1.26 -4.76 105.19 115.13 3gz7 n GLY 34 Ca 0.15 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 3gz7 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gz7 n HIS 36 N 4.12 0.00 0.00 0.00 8.25 0.09 -4.91 115.22 122.78 3gz7 n HIS 36 Ca -0.12 -0.82 0.00 0.00 -0.26 0.00 0.00 57.72 56.52 3gz7 n HIS 36 Cb 0.52 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.51 3gz7 n HIS 36 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3gz7 n GLY 37 N -1.13 3.67 2.86 -1.41 0.00 -1.25 -4.83 105.19 103.10 3gz7 n GLY 37 Ca 0.11 -0.65 -0.18 0.00 0.00 0.00 0.00 46.02 45.30 3gz7 n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gz7 s VAL 38 N -2.00 0.32 0.10 1.61 1.01 -1.26 -0.80 120.40 119.38 3gz7 s VAL 38 Ca 0.00 -0.02 0.06 0.00 0.00 0.00 0.00 61.98 62.02 3gz7 s VAL 38 Cb 0.00 -0.37 -0.03 0.00 0.00 0.00 0.00 36.38 35.98 3gz7 s VAL 38 CO 0.00 0.16 -0.16 0.00 0.00 0.00 0.00 175.10 175.11 3gz7 s ALA 39 N 0.82 1.46 -0.09 5.51 0.00 -0.23 -5.01 121.76 124.23 3gz7 s ALA 39 Ca -0.09 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 50.71 3gz7 s ALA 39 Cb -0.12 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.88 3gz7 s ALA 39 CO -0.01 0.19 -0.15 -1.17 0.00 0.00 0.00 175.76 174.62 3gz7 s LEU 40 N -2.07 1.74 0.04 0.00 2.96 -1.26 -1.71 118.68 118.38 3gz7 s LEU 40 Ca 0.04 -0.39 0.08 0.00 -0.22 0.00 0.00 54.13 53.65 3gz7 s LEU 40 Cb -0.08 -1.01 -0.03 0.00 0.50 0.00 0.00 46.19 45.57 3gz7 s LEU 40 CO 0.03 0.05 -0.23 -1.00 -1.32 0.00 0.00 176.35 173.88 3gz7 s HIS 41 N 0.72 2.05 -0.04 5.38 3.76 0.06 -4.99 115.29 122.22 3gz7 s HIS 41 Ca -0.13 -0.39 0.07 0.00 -0.15 0.00 0.00 55.06 54.46 3gz7 s HIS 41 Cb -0.16 -1.23 -0.02 0.00 1.11 0.00 0.00 32.58 32.29 3gz7 s HIS 41 CO 0.03 0.10 -0.24 0.50 -0.85 0.00 0.00 174.74 174.28 3gz7 s ARG 42 N -1.17 2.35 0.28 1.40 3.52 -1.26 0.13 118.95 124.20 3gz7 s ARG 42 Ca 0.09 -0.88 -0.29 0.00 -0.13 0.00 0.00 55.73 54.52 3gz7 s ARG 42 Cb -0.09 -2.14 -0.09 0.00 -1.56 0.00 0.00 34.95 31.06 3gz7 s ARG 42 CO 0.02 0.49 1.14 0.45 -0.81 0.00 0.00 175.30 176.59 3gz7 s SER 43 N -0.44 7.17 -0.07 -2.12 0.15 -0.08 -4.98 113.70 113.34 3gz7 s SER 43 Ca 0.05 2.33 -0.21 0.00 0.70 0.00 0.00 55.95 58.81 3gz7 s SER 43 Cb -0.12 -2.63 -0.30 0.00 -1.71 0.00 0.00 66.02 61.27 3gz7 s SER 43 CO 0.01 -0.23 0.82 0.40 1.20 0.00 0.00 173.24 175.44 3gz7 h ILE 44 N 3.17 1.45 -0.37 6.45 2.04 -1.97 -3.23 117.51 125.06 3gz7 h ILE 44 Ca -0.47 -2.50 -0.11 0.00 1.00 0.00 0.00 64.86 62.79 3gz7 h ILE 44 Cb 1.21 3.12 -0.02 0.00 -0.74 0.00 0.00 36.82 40.40 3gz7 h ILE 44 CO 0.68 0.70 -0.20 -0.33 0.00 0.00 0.00 178.15 179.00 3gz7 h GLU 45 N -0.42 0.71 -2.83 2.37 3.07 -1.99 -3.38 114.58 112.12 3gz7 h GLU 45 Ca -0.16 -0.27 -0.61 0.00 -0.50 0.00 0.00 59.36 57.82 3gz7 h GLU 45 Cb 1.61 -0.04 -0.40 0.00 -0.84 0.00 0.00 28.75 29.08 3gz7 h GLU 45 CO 0.12 0.86 -0.77 0.00 -1.40 0.00 0.00 179.01 177.82 3gz7 s ALA 46 N -4.63 2.23 -0.42 3.43 0.00 -1.26 -5.01 121.76 116.11 3gz7 s ALA 46 Ca -0.09 -2.77 0.18 0.00 0.00 0.00 0.00 51.96 49.28 3gz7 s ALA 46 Cb 0.13 -1.85 0.91 0.00 0.00 0.00 0.00 23.12 22.31 3gz7 s ALA 46 CO 0.82 -2.05 1.54 -2.30 0.00 0.00 0.00 175.76 173.77 3gz7 n PRO 47 N 3.08 0.12 0.00 0.00 -0.02 -1.22 -0.49 135.00 136.46 3gz7 n PRO 47 Ca 0.16 0.57 0.13 0.00 -2.02 0.00 0.00 63.50 62.34 3gz7 n PRO 47 Cb 0.38 -1.85 0.43 0.00 -0.02 0.00 0.00 33.50 32.45 3gz7 n PRO 47 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3gz7 n GLN 48 N -2.09 0.06 -3.48 -0.52 6.02 -1.26 -4.81 117.38 111.29 3gz7 n GLN 48 Ca -0.00 -0.02 -0.37 0.00 -0.01 0.00 0.00 57.00 56.59 3gz7 n GLN 48 Cb 0.06 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.76 3gz7 n GLN 48 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3gz7 s ARG 49 N -2.96 4.13 0.11 -1.09 0.52 0.35 -0.95 118.95 119.06 3gz7 s ARG 49 Ca 0.14 0.28 0.08 0.00 -0.52 0.00 0.00 55.73 55.70 3gz7 s ARG 49 Cb 0.18 -3.35 -0.03 0.00 0.52 0.00 0.00 34.95 32.27 3gz7 s ARG 49 CO 0.61 0.39 -0.19 0.71 0.02 0.00 0.00 175.30 176.84 3gz7 s TYR 50 N -0.05 1.66 -0.17 -0.53 1.51 -0.47 -0.90 117.35 118.39 3gz7 s TYR 50 Ca 0.21 -0.44 -0.00 0.00 -1.01 0.00 0.00 57.07 55.83 3gz7 s TYR 50 Cb -0.15 -0.90 0.00 0.00 -0.11 0.00 0.00 41.96 40.81 3gz7 s TYR 50 CO 0.09 0.19 -0.14 0.99 -1.11 0.00 0.00 175.55 175.56 3gz7 s THR 51 N -1.37 2.67 -0.19 -0.71 2.01 0.12 -0.75 115.64 117.42 3gz7 s THR 51 Ca 0.06 -0.75 -0.12 0.00 0.31 0.00 0.00 61.69 61.19 3gz7 s THR 51 Cb -0.09 -2.15 -0.05 0.00 0.01 0.00 0.00 72.50 70.23 3gz7 s THR 51 CO 0.04 0.50 0.23 -0.22 -0.69 0.00 0.00 174.62 174.48 3gz7 s LEU 52 N 1.03 4.21 -0.24 4.42 2.96 0.06 -0.76 118.68 130.36 3gz7 s LEU 52 Ca -0.01 0.36 0.01 0.00 -0.22 0.00 0.00 54.13 54.27 3gz7 s LEU 52 Cb -0.15 -2.26 0.04 0.00 0.50 0.00 0.00 46.19 44.33 3gz7 s LEU 52 CO -0.03 0.10 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.29 3gz7 s VAL 53 N 0.59 2.37 -0.08 1.68 1.01 -0.69 -1.34 120.40 123.95 3gz7 s VAL 53 Ca 0.13 -1.25 0.05 0.00 0.00 0.00 0.00 61.98 60.90 3gz7 s VAL 53 Cb -0.13 -2.23 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 3gz7 s VAL 53 CO 0.02 0.20 -0.24 -0.69 0.00 0.00 0.00 175.10 174.39 3gz7 s VAL 54 N 1.22 2.10 -0.18 2.92 1.01 -0.35 -1.06 120.40 126.06 3gz7 s VAL 54 Ca -0.02 -1.03 -0.14 0.00 0.00 0.00 0.00 61.98 60.78 3gz7 s VAL 54 Cb -0.17 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 3gz7 s VAL 54 CO -0.07 0.57 0.32 -1.81 0.00 0.00 0.00 175.10 174.11 3gz7 s ASP 55 N 0.04 6.41 0.04 3.32 1.01 0.02 -0.59 116.67 126.92 3gz7 s ASP 55 Ca -0.10 0.48 0.04 0.00 0.71 0.00 0.00 52.55 53.68 3gz7 s ASP 55 Cb -0.15 -2.20 -0.02 0.00 1.01 0.00 0.00 42.92 41.56 3gz7 s ASP 55 CO 0.06 0.03 -0.11 0.26 0.21 0.00 0.00 175.17 175.61 3gz7 s TRP 56 N 0.84 0.99 0.12 4.23 0.52 0.17 -0.73 118.94 125.08 3gz7 s TRP 56 Ca 0.17 -0.39 -0.15 0.00 0.02 0.00 0.00 56.10 55.75 3gz7 s TRP 56 Cb -0.14 -0.58 -0.04 0.00 -1.15 0.00 0.00 33.47 31.56 3gz7 s TRP 56 CO 0.06 0.00 1.54 0.93 0.02 0.00 0.00 176.95 179.50 3gz7 h GLU 57 N 4.78 0.68 -4.42 4.98 5.08 -1.14 -0.64 114.58 123.91 3gz7 h GLU 57 Ca -0.37 -0.24 -0.17 0.00 -1.00 0.00 0.00 59.36 57.58 3gz7 h GLU 57 Cb 1.19 -0.05 -0.15 0.00 0.50 0.00 0.00 28.75 30.24 3gz7 h GLU 57 CO 0.43 0.81 -0.68 0.95 -1.00 0.00 0.00 179.01 179.52 3gz7 s THR 58 N -4.90 0.39 0.19 1.13 -4.23 -1.26 -4.21 115.64 102.75 3gz7 s THR 58 Ca -0.13 -1.87 -0.13 0.00 -1.18 0.00 0.00 61.69 58.39 3gz7 s THR 58 Cb 0.10 -1.64 0.10 0.00 1.34 0.00 0.00 72.50 72.39 3gz7 s THR 58 CO 0.79 -0.89 1.84 0.58 -0.54 0.00 0.00 174.62 176.40 3gz7 h VAL 59 N 3.05 1.11 -0.79 2.29 2.07 -1.96 -2.70 116.25 119.32 3gz7 h VAL 59 Ca -0.35 -0.26 0.08 0.00 0.82 0.00 0.00 66.70 66.99 3gz7 h VAL 59 Cb 1.16 0.28 -0.05 0.00 -1.52 0.00 0.00 31.29 31.16 3gz7 h VAL 59 CO 0.65 0.14 0.52 0.44 0.02 0.00 0.00 177.57 179.33 3gz7 h ASP 60 N 0.76 0.70 -0.84 0.57 3.32 -2.00 -0.22 116.42 118.70 3gz7 h ASP 60 Ca 0.23 0.01 0.18 0.00 0.02 0.00 0.00 57.03 57.47 3gz7 h ASP 60 Cb -0.04 -0.14 -0.11 0.00 0.22 0.00 0.00 39.33 39.26 3gz7 h ASP 60 CO -0.07 0.43 0.35 0.78 -1.72 0.00 0.00 179.24 179.01 3gz7 h ASN 61 N 0.79 0.31 0.00 6.45 -0.26 -1.79 0.18 115.58 121.26 3gz7 h ASN 61 Ca 0.35 0.13 0.00 0.00 -0.56 0.00 0.00 56.30 56.23 3gz7 h ASN 61 Cb 0.35 0.11 0.00 0.00 -1.06 0.00 0.00 38.32 37.72 3gz7 h ASN 61 CO -0.13 0.05 0.00 1.57 -1.06 0.00 0.00 177.43 177.86 3gz7 n HIS 62 N -5.02 0.00 0.00 1.19 -0.00 -0.10 -0.69 115.22 110.60 3gz7 n HIS 62 Ca 0.19 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.37 3gz7 n HIS 62 Cb 0.55 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.42 3gz7 n HIS 62 CO 0.00 0.00 0.00 0.28 0.46 0.00 0.00 176.34 177.08 3gz7 n VAL 64 N -0.76 0.00 0.13 3.57 0.31 0.48 -1.38 118.33 120.69 3gz7 n VAL 64 Ca 0.11 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.30 3gz7 n VAL 64 Cb 0.05 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 32.90 3gz7 n VAL 64 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 3gz7 h ASP 65 N 0.00 -0.26 -0.04 4.52 3.32 -1.13 -1.47 116.42 121.35 3gz7 h ASP 65 Ca 0.00 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 3gz7 h ASP 65 Cb 0.00 0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.62 3gz7 h ASP 65 CO 0.00 -0.04 -0.06 0.15 -1.72 0.00 0.00 179.24 177.57 3gz7 h PHE 66 N -0.47 0.15 -0.80 4.55 3.57 -0.82 -3.22 116.94 119.90 3gz7 h PHE 66 Ca -0.03 -0.05 0.08 0.00 3.53 0.00 0.00 57.97 61.51 3gz7 h PHE 66 Cb 0.35 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.01 3gz7 h PHE 66 CO -0.02 0.61 0.52 0.00 -2.23 0.00 0.00 178.31 177.20 3gz7 h ARG 67 N -0.36 0.76 -0.26 1.11 2.47 -1.24 -2.50 114.38 114.36 3gz7 h ARG 67 Ca 0.01 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.68 3gz7 h ARG 67 Cb 0.60 -0.17 0.00 0.00 -1.65 0.00 0.00 29.97 28.74 3gz7 h ARG 67 CO 0.01 0.50 0.00 1.04 0.56 0.00 0.00 179.97 182.09 3gz7 n GLN 68 N -4.50 1.62 -3.95 0.04 6.02 -0.56 -4.82 117.38 111.24 3gz7 n GLN 68 Ca 0.13 -0.97 -0.21 0.00 -0.01 0.00 0.00 57.00 55.94 3gz7 n GLN 68 Cb 0.28 -1.22 -0.04 0.00 1.02 0.00 0.00 30.24 30.28 3gz7 n GLN 68 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 3gz7 s SER 69 N -1.05 5.55 0.44 1.08 1.04 -0.94 -5.00 113.70 114.82 3gz7 s SER 69 Ca 0.19 -0.30 0.10 0.00 0.48 0.00 0.00 55.95 56.42 3gz7 s SER 69 Cb 0.10 -1.29 0.97 0.00 0.10 0.00 0.00 66.02 65.91 3gz7 s SER 69 CO 0.13 -0.18 2.06 0.00 0.98 0.00 0.00 173.24 176.24 3gz7 h ALA 70 N 1.34 1.76 0.00 5.32 0.00 -1.92 -2.66 119.26 123.11 3gz7 h ALA 70 Ca -0.47 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.30 3gz7 h ALA 70 Cb 1.24 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3gz7 h ALA 70 CO 0.59 0.20 -0.41 -0.44 0.00 0.00 0.00 179.25 179.20 3gz7 h ASP 71 N 0.32 0.00 -0.70 0.00 3.32 -1.94 -1.24 116.42 116.18 3gz7 h ASP 71 Ca 0.08 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.22 3gz7 h ASP 71 Cb 0.04 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.54 3gz7 h ASP 71 CO -0.01 0.41 0.46 0.15 -1.72 0.00 0.00 179.24 178.53 3gz7 h PHE 72 N 0.00 0.65 0.02 4.55 3.57 -1.62 0.18 116.94 124.29 3gz7 h PHE 72 Ca -0.00 0.02 -0.26 0.00 3.53 0.00 0.00 57.97 61.25 3gz7 h PHE 72 Cb 0.75 -0.21 0.02 0.00 2.79 0.00 0.00 35.95 39.30 3gz7 h PHE 72 CO 0.00 0.32 -1.04 1.96 -2.23 0.00 0.00 178.31 177.32 3gz7 h GLN 73 N 0.62 0.67 -0.55 1.11 1.08 -1.36 -2.03 115.11 114.66 3gz7 h GLN 73 Ca 0.32 -0.75 -0.00 0.00 -1.45 0.00 0.00 58.65 56.77 3gz7 h GLN 73 Cb 0.44 0.22 -0.03 0.00 -0.05 0.00 0.00 27.48 28.06 3gz7 h GLN 73 CO -0.11 1.32 0.32 1.49 -0.95 0.00 0.00 178.83 180.90 3gz7 h GLU 74 N 0.34 0.75 -0.17 1.46 4.57 -0.94 -1.06 114.58 119.52 3gz7 h GLU 74 Ca -0.13 -0.07 0.05 0.00 -1.18 0.00 0.00 59.36 58.02 3gz7 h GLU 74 Cb 1.70 -0.15 -0.06 0.00 -0.16 0.00 0.00 28.75 30.07 3gz7 h GLU 74 CO 0.20 0.55 -0.28 2.35 -1.18 0.00 0.00 179.01 180.65 3gz7 h TRP 75 N 0.73 -0.77 -1.00 0.92 2.91 -0.58 -1.86 115.95 116.30 3gz7 h TRP 75 Ca 0.19 0.04 0.02 0.00 1.13 0.00 0.00 58.89 60.28 3gz7 h TRP 75 Cb 0.00 0.36 -0.05 0.00 -0.51 0.00 0.00 29.16 28.96 3gz7 h TRP 75 CO -0.02 -0.36 0.66 0.00 -1.03 0.00 0.00 178.44 177.69 3gz7 h ARG 76 N -0.33 1.28 -0.68 2.65 2.47 -1.13 -1.40 114.38 117.24 3gz7 h ARG 76 Ca 0.11 -0.08 0.01 0.00 -1.26 0.00 0.00 59.98 58.76 3gz7 h ARG 76 Cb 0.50 -0.29 -0.03 0.00 -1.65 0.00 0.00 29.97 28.50 3gz7 h ARG 76 CO -0.36 0.85 0.45 0.87 0.56 0.00 0.00 179.97 182.34 3gz7 h LYS 77 N 1.32 0.89 -0.17 0.04 1.57 -0.86 0.22 116.57 119.58 3gz7 h LYS 77 Ca 0.38 -0.05 -0.21 0.00 -1.87 0.00 0.00 60.65 58.90 3gz7 h LYS 77 Cb -0.08 -0.20 0.01 0.00 0.08 0.00 0.00 32.23 32.03 3gz7 h LYS 77 CO -0.10 0.59 -0.74 -0.07 -0.57 0.00 0.00 179.45 178.56 3gz7 h LEU 78 N 0.92 0.89 0.00 2.94 3.38 -0.45 -3.42 115.31 119.57 3gz7 h LEU 78 Ca 0.25 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.65 3gz7 h LEU 78 Cb -0.11 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.38 3gz7 h LEU 78 CO -0.05 1.36 -0.71 1.33 0.09 0.00 0.00 178.44 180.46 3gz7 n VAL 79 N -3.93 0.00 -0.24 1.22 0.24 -0.72 -4.70 118.33 110.20 3gz7 n VAL 79 Ca -0.07 -0.04 0.21 0.00 -2.04 0.00 0.00 64.34 62.41 3gz7 n VAL 79 Cb 0.72 0.45 0.55 0.00 -1.47 0.00 0.00 33.84 34.09 3gz7 n VAL 79 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3gz7 h GLY 80 N 0.00 0.73 1.60 7.63 0.00 -0.74 -1.42 103.07 110.87 3gz7 h GLY 80 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.18 3gz7 h GLY 80 CO 0.00 -0.02 -0.04 -1.84 0.00 0.00 0.00 176.54 174.64 3gz7 n GLU 81 N -4.47 0.29 0.18 4.80 0.28 -1.26 -2.71 120.64 117.75 3gz7 n GLU 81 Ca 0.20 -0.03 0.08 0.00 -0.16 0.00 0.00 57.16 57.24 3gz7 n GLU 81 Cb 0.77 -1.50 0.11 0.00 1.43 0.00 0.00 31.44 32.25 3gz7 n GLU 81 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3gz7 s PHE 83 N -3.10 3.05 -0.09 0.00 0.08 -1.10 -1.07 117.98 115.75 3gz7 s PHE 83 Ca 0.06 1.54 0.15 0.00 0.12 0.00 0.00 56.93 58.79 3gz7 s PHE 83 Cb 0.06 -3.43 -0.20 0.00 -0.57 0.00 0.00 43.02 38.87 3gz7 s PHE 83 CO 0.70 -1.41 0.63 0.00 -0.10 0.00 0.00 175.22 175.05 3gz7 n ALA 84 N 0.15 1.68 -3.50 5.36 0.00 0.41 -4.64 120.51 119.97 3gz7 n ALA 84 Ca 0.04 -0.76 -0.08 0.00 0.00 0.00 0.00 53.44 52.64 3gz7 n ALA 84 Cb 0.46 -0.79 -0.04 0.00 0.00 0.00 0.00 19.45 19.08 3gz7 n ALA 84 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 3gz7 s GLU 85 N -2.72 1.67 0.18 0.00 -1.05 -1.26 -5.02 118.70 110.50 3gz7 s GLU 85 Ca -0.05 -1.14 -0.31 0.00 -0.15 0.00 0.00 54.97 53.31 3gz7 s GLU 85 Cb 0.08 0.54 -0.10 0.00 -0.44 0.00 0.00 34.13 34.21 3gz7 s GLU 85 CO 0.82 -0.73 1.55 -2.14 0.95 0.00 0.00 175.26 175.72 3gz7 s PRO 86 N -3.93 4.22 0.41 -4.83 0.02 -1.26 -4.67 135.00 124.96 3gz7 s PRO 86 Ca 0.17 2.36 -0.25 0.00 0.02 0.00 0.00 61.00 63.30 3gz7 s PRO 86 Cb -0.03 -3.15 -0.11 0.00 0.02 0.00 0.00 34.50 31.23 3gz7 s PRO 86 CO 0.08 -0.59 1.03 -2.30 -0.33 0.00 0.00 177.00 174.89 3gz7 n PRO 87 N 3.77 1.39 -3.32 5.54 -0.02 -1.26 -4.97 135.00 136.13 3gz7 n PRO 87 Ca 0.13 0.50 -0.39 0.00 -2.02 0.00 0.00 63.50 61.72 3gz7 n PRO 87 Cb 0.39 -2.05 -0.08 0.00 -0.02 0.00 0.00 33.50 31.73 3gz7 n PRO 87 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3gz7 s GLN 88 N -1.99 4.04 -0.08 -0.52 -0.21 -0.37 -4.91 119.66 115.63 3gz7 s GLN 88 Ca 0.63 0.16 0.04 0.00 0.02 0.00 0.00 55.36 56.21 3gz7 s GLN 88 Cb -0.56 -3.65 -0.01 0.00 1.00 0.00 0.00 33.01 29.79 3gz7 s GLN 88 CO 0.57 -0.30 -0.22 0.08 -2.12 0.00 0.00 175.29 173.30 3gz7 s VAL 89 N 2.15 2.31 0.31 1.09 1.01 -1.26 -0.36 120.40 125.65 3gz7 s VAL 89 Ca 0.18 -0.96 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 3gz7 s VAL 89 Cb -0.16 -1.88 -0.01 0.00 0.00 0.00 0.00 36.38 34.33 3gz7 s VAL 89 CO 0.10 0.56 0.40 -1.38 0.00 0.00 0.00 175.10 174.78 3gz7 s HIS 90 N -0.01 1.13 0.04 5.22 -3.43 -0.66 -5.02 115.29 112.56 3gz7 s HIS 90 Ca -0.07 -1.32 0.06 0.00 -0.80 0.00 0.00 55.06 52.93 3gz7 s HIS 90 Cb -0.15 -0.23 -0.02 0.00 -1.43 0.00 0.00 32.58 30.75 3gz7 s HIS 90 CO 0.05 -1.01 -0.17 -1.01 -2.00 0.00 0.00 174.74 170.60 3gz7 s HIS 91 N -3.36 1.49 0.13 0.38 3.76 -1.26 -0.66 115.29 115.77 3gz7 s HIS 91 Ca 0.33 -0.36 0.04 0.00 -0.15 0.00 0.00 55.06 54.92 3gz7 s HIS 91 Cb 0.01 -0.89 -0.04 0.00 1.11 0.00 0.00 32.58 32.77 3gz7 s HIS 91 CO 0.20 0.06 -0.10 -1.21 -0.85 0.00 0.00 174.74 172.83 3gz7 s GLU 92 N -1.11 0.99 0.01 1.40 2.02 0.92 -4.96 118.70 117.98 3gz7 s GLU 92 Ca 0.04 -1.35 0.07 0.00 0.02 0.00 0.00 54.97 53.75 3gz7 s GLU 92 Cb -0.08 -0.59 -0.02 0.00 0.10 0.00 0.00 34.13 33.54 3gz7 s GLU 92 CO 0.01 0.08 -0.22 -0.65 0.02 0.00 0.00 175.26 174.50 3gz7 s GLN 93 N -3.44 1.67 -0.08 1.61 -0.21 -1.26 -0.86 119.66 117.09 3gz7 s GLN 93 Ca 0.13 -0.89 -0.30 0.00 0.02 0.00 0.00 55.36 54.33 3gz7 s GLN 93 Cb 0.01 -1.70 -0.04 0.00 1.00 0.00 0.00 33.01 32.28 3gz7 s GLN 93 CO 0.00 0.45 1.36 0.21 -2.12 0.00 0.00 175.29 175.20 3gz7 s LYS 94 N -0.84 4.26 -0.25 2.91 2.20 -1.26 -4.93 119.74 121.84 3gz7 s LYS 94 Ca 0.09 1.85 -0.14 0.00 -0.36 0.00 0.00 55.97 57.41 3gz7 s LYS 94 Cb -0.09 -3.71 -0.15 0.00 -1.51 0.00 0.00 37.83 32.37 3gz7 s LYS 94 CO 0.00 -0.65 -0.16 0.28 -0.36 0.00 0.00 175.35 174.47 3gz7 n VAL 95 N 5.04 1.54 -0.50 4.02 0.31 -1.26 -5.19 118.33 122.29 3gz7 n VAL 95 Ca 0.14 -0.34 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 3gz7 n VAL 95 Cb 0.44 -1.86 0.00 0.00 -0.91 0.00 0.00 33.84 31.52 3gz7 n VAL 95 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69