#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g6p s ARG 2 N 0.00 0.77 0.00 0.03 3.52 -0.86 0.12 118.95 122.52 1g6p s ARG 2 Ca 0.00 0.95 0.00 0.00 -0.13 0.00 0.00 55.73 56.55 1g6p s ARG 2 Cb 0.00 0.35 0.00 0.00 -1.56 0.00 0.00 34.95 33.74 1g6p s ARG 2 CO 0.00 -0.10 0.00 0.41 -0.81 0.00 0.00 175.30 174.80 1g6p n GLY 3 N 2.78 4.36 3.70 8.12 0.00 0.14 -2.48 105.19 121.81 1g6p n GLY 3 Ca -0.14 -0.56 -0.08 0.00 0.00 0.00 0.00 46.02 45.23 1g6p n GLY 3 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1g6p s LYS 4 N 3.04 1.61 -0.03 1.61 2.20 0.59 -2.04 119.74 126.71 1g6p s LYS 4 Ca 0.00 -0.91 0.07 0.00 -0.36 0.00 0.00 55.97 54.77 1g6p s LYS 4 Cb 0.00 0.58 -0.02 0.00 -1.51 0.00 0.00 37.83 36.88 1g6p s LYS 4 CO 0.00 -0.72 -0.25 0.08 -0.36 0.00 0.00 175.35 174.11 1g6p s VAL 5 N -3.89 1.96 0.00 4.02 1.01 0.92 -0.15 120.40 124.27 1g6p s VAL 5 Ca 0.10 -1.04 0.00 0.00 0.00 0.00 0.00 61.98 61.04 1g6p s VAL 5 Cb -0.04 -1.64 0.00 0.00 0.00 0.00 0.00 36.38 34.70 1g6p s VAL 5 CO 0.02 0.55 0.00 2.29 0.00 0.00 0.00 175.10 177.96 1g6p n LYS 6 N 2.67 2.39 -3.72 2.72 2.85 -1.05 -1.53 118.16 122.47 1g6p n LYS 6 Ca -0.16 0.00 -0.13 0.00 -1.05 0.00 0.00 58.31 56.96 1g6p n LYS 6 Cb 0.52 -0.90 -0.10 0.00 -0.65 0.00 0.00 35.03 33.90 1g6p n LYS 6 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 1g6p s TRP 7 N -1.80 -0.49 -0.11 5.58 0.52 -1.04 -4.74 118.94 116.86 1g6p s TRP 7 Ca 0.00 1.18 0.02 0.00 0.02 0.00 0.00 56.10 57.32 1g6p s TRP 7 Cb 0.00 0.17 0.01 0.00 -1.15 0.00 0.00 33.47 32.50 1g6p s TRP 7 CO 0.00 -0.24 -0.18 0.12 0.02 0.00 0.00 176.95 176.67 1g6p s PHE 8 N 0.30 2.22 0.22 -1.98 5.36 -1.26 -1.10 117.98 121.74 1g6p s PHE 8 Ca -0.01 -1.04 0.02 0.00 -0.96 0.00 0.00 56.93 54.94 1g6p s PHE 8 Cb -0.03 -1.55 -0.05 0.00 -0.34 0.00 0.00 43.02 41.05 1g6p s PHE 8 CO -0.00 -0.49 0.05 -0.51 -1.46 0.00 0.00 175.22 172.80 1g6p s ASP 9 N 0.82 1.33 0.41 6.13 1.11 0.40 -4.89 116.67 121.98 1g6p s ASP 9 Ca -0.09 -1.28 0.00 0.00 0.18 0.00 0.00 52.55 51.36 1g6p s ASP 9 Cb -0.16 0.12 0.00 0.00 1.07 0.00 0.00 42.92 43.95 1g6p s ASP 9 CO 0.00 -0.63 0.00 -0.24 1.18 0.00 0.00 175.17 175.48 1g6p n SER 10 N -0.38 -5.53 0.22 0.27 2.88 -1.26 -0.89 113.62 108.93 1g6p n SER 10 Ca -0.03 1.14 0.07 0.00 -1.33 0.00 0.00 58.87 58.72 1g6p n SER 10 Cb 0.65 -3.24 0.52 0.00 -0.75 0.00 0.00 64.21 61.39 1g6p n SER 10 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1g6p h LYS 11 N -0.41 0.00 0.00 -1.46 1.79 -1.99 -3.41 116.57 111.09 1g6p h LYS 11 Ca -0.07 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 1g6p h LYS 11 Cb 0.79 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.44 1g6p h LYS 11 CO 0.03 0.24 0.00 1.63 -1.08 0.00 0.00 179.45 180.26 1g6p n LYS 12 N -3.89 0.00 -3.63 3.15 4.76 -1.26 -5.00 118.16 112.30 1g6p n LYS 12 Ca -0.02 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.10 1g6p n LYS 12 Cb 0.32 0.00 -0.08 0.00 -1.84 0.00 0.00 35.03 33.43 1g6p n LYS 12 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1g6p n GLY 13 N 5.00 4.33 3.70 0.72 0.00 -1.02 -4.91 105.19 113.01 1g6p n GLY 13 Ca 0.00 -2.64 -0.25 0.00 0.00 0.00 0.00 46.02 43.13 1g6p n GLY 13 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1g6p s TYR 14 N -1.77 2.89 -4.41 1.61 6.14 -0.06 0.95 117.35 122.69 1g6p s TYR 14 Ca 0.30 -0.13 0.00 0.00 0.64 0.00 0.00 57.07 57.87 1g6p s TYR 14 Cb -0.00 -1.36 0.00 0.00 0.42 0.00 0.00 41.96 41.02 1g6p s TYR 14 CO -0.10 0.54 0.00 0.41 0.64 0.00 0.00 175.55 177.04 1g6p n GLY 15 N -0.45 0.46 3.05 8.97 0.00 -1.01 0.15 105.19 116.36 1g6p n GLY 15 Ca -0.09 -1.39 -0.18 0.00 0.00 0.00 0.00 46.02 44.37 1g6p n GLY 15 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1g6p s PHE 16 N -4.00 0.85 0.13 1.61 0.40 -0.26 0.27 117.98 116.98 1g6p s PHE 16 Ca 0.00 -0.26 0.06 0.00 -0.60 0.00 0.00 56.93 56.13 1g6p s PHE 16 Cb 0.00 -0.52 -0.04 0.00 0.51 0.00 0.00 43.02 42.97 1g6p s PHE 16 CO 0.00 -0.01 -0.13 0.42 0.70 0.00 0.00 175.22 176.20 1g6p s ILE 17 N -0.58 1.31 -0.20 0.64 -1.09 -1.01 -2.48 121.20 117.79 1g6p s ILE 17 Ca 0.00 -1.80 0.01 0.00 -2.23 0.00 0.00 60.65 56.64 1g6p s ILE 17 Cb -0.06 -1.60 0.03 0.00 -1.58 0.00 0.00 42.46 39.26 1g6p s ILE 17 CO 0.00 -0.49 -0.15 -0.89 -1.23 0.00 0.00 174.94 172.19 1g6p s THR 18 N -2.40 1.89 0.48 2.92 2.01 0.78 0.35 115.64 121.67 1g6p s THR 18 Ca 0.11 -1.06 -0.23 0.00 0.31 0.00 0.00 61.69 60.82 1g6p s THR 18 Cb -0.03 -1.85 -0.07 0.00 0.01 0.00 0.00 72.50 70.56 1g6p s THR 18 CO 0.03 0.31 1.26 -1.59 -0.69 0.00 0.00 174.62 173.94 1g6p s LYS 19 N 1.31 3.59 0.00 4.92 -2.85 -0.76 0.22 119.74 126.17 1g6p s LYS 19 Ca 0.00 2.02 0.00 0.00 -1.00 0.00 0.00 55.97 56.99 1g6p s LYS 19 Cb -0.15 -2.43 0.00 0.00 -2.06 0.00 0.00 37.83 33.18 1g6p s LYS 19 CO -0.10 -0.76 0.00 -3.47 0.10 0.00 0.00 175.35 171.13 1g6p n ASP 20 N -0.54 0.00 -1.13 0.03 2.03 -1.04 -1.22 116.55 114.69 1g6p n ASP 20 Ca 0.08 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.34 1g6p n ASP 20 Cb 0.46 0.00 0.18 0.00 -0.72 0.00 0.00 41.12 41.04 1g6p n ASP 20 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1g6p n GLU 21 N 0.00 1.94 0.00 -0.67 1.02 -1.26 -4.91 120.64 116.76 1g6p n GLU 21 Ca 0.00 -3.32 0.00 0.00 -0.02 0.00 0.00 57.16 53.82 1g6p n GLU 21 Cb 0.00 -1.82 0.00 0.00 -0.02 0.00 0.00 31.44 29.60 1g6p n GLU 21 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1g6p n GLY 22 N -1.08 0.20 0.00 0.62 0.00 -0.36 -5.16 105.19 99.41 1g6p n GLY 22 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.33 1g6p n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g6p n GLY 23 N 4.90 5.45 3.55 -0.02 0.00 -1.26 -4.92 105.19 112.89 1g6p n GLY 23 Ca 0.00 -1.21 -0.24 0.00 0.00 0.00 0.00 46.02 44.57 1g6p n GLY 23 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1g6p s ASP 24 N 1.00 3.94 0.45 1.61 1.47 -1.26 -1.84 116.67 122.05 1g6p s ASP 24 Ca 0.00 -0.97 0.03 0.00 1.18 0.00 0.00 52.55 52.79 1g6p s ASP 24 Cb 0.00 -0.47 -0.02 0.00 -0.34 0.00 0.00 42.92 42.09 1g6p s ASP 24 CO 0.00 -0.07 0.09 0.54 0.68 0.00 0.00 175.17 176.41 1g6p s VAL 25 N -2.49 0.77 -0.07 2.11 0.11 1.09 -4.89 120.40 117.03 1g6p s VAL 25 Ca 0.32 -2.00 0.01 0.00 -2.93 0.00 0.00 61.98 57.38 1g6p s VAL 25 Cb -0.03 -2.24 0.02 0.00 -1.53 0.00 0.00 36.38 32.59 1g6p s VAL 25 CO 0.17 0.00 -0.09 0.12 -3.33 0.00 0.00 175.10 171.97 1g6p s PHE 26 N -3.08 1.21 0.03 1.54 5.36 -1.22 -2.39 117.98 119.44 1g6p s PHE 26 Ca 0.16 -0.45 0.09 0.00 -0.96 0.00 0.00 56.93 55.77 1g6p s PHE 26 Cb 0.02 -0.95 -0.03 0.00 -0.34 0.00 0.00 43.02 41.72 1g6p s PHE 26 CO 0.10 -0.28 -0.25 0.14 -1.46 0.00 0.00 175.22 173.47 1g6p s VAL 27 N 0.93 1.99 -0.17 3.12 -7.23 0.14 -3.19 120.40 115.98 1g6p s VAL 27 Ca -0.10 -1.29 0.21 0.00 -1.81 0.00 0.00 61.98 58.99 1g6p s VAL 27 Cb -0.15 -1.70 -0.10 0.00 0.56 0.00 0.00 36.38 34.99 1g6p s VAL 27 CO 0.01 0.36 0.86 1.57 -0.31 0.00 0.00 175.10 177.58 1g6p n HIS 28 N 1.91 0.79 0.00 2.82 -0.00 -1.26 -2.41 115.22 117.07 1g6p n HIS 28 Ca -0.17 0.24 0.00 0.00 0.46 0.00 0.00 57.72 58.25 1g6p n HIS 28 Cb 0.52 -0.92 0.00 0.00 -0.12 0.00 0.00 29.99 29.47 1g6p n HIS 28 CO 0.00 0.00 0.00 -2.67 0.46 0.00 0.00 176.34 174.13 1g6p n TRP 29 N -2.67 0.00 -0.89 1.57 -0.00 0.27 -4.59 117.44 111.13 1g6p n TRP 29 Ca -0.04 0.00 0.08 0.00 -0.00 0.00 0.00 57.50 57.53 1g6p n TRP 29 Cb 0.65 0.00 0.11 0.00 -0.00 0.00 0.00 31.31 32.07 1g6p n TRP 29 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 177.69 178.12 1g6p n SER 30 N 0.00 2.18 0.00 -0.67 7.64 -1.26 -3.05 113.62 118.46 1g6p n SER 30 Ca 0.00 -2.81 0.00 0.00 1.01 0.00 0.00 58.87 57.07 1g6p n SER 30 Cb 0.00 -0.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 1g6p n SER 30 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1g6p n ALA 31 N -1.19 1.81 -2.83 -0.43 0.00 -1.26 -4.76 120.51 111.85 1g6p n ALA 31 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.26 1g6p n ALA 31 Cb 0.56 0.20 -0.02 0.00 0.00 0.00 0.00 19.45 20.19 1g6p n ALA 31 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1g6p n ILE 32 N -1.71 3.68 -3.81 0.00 5.41 -1.26 0.14 119.36 121.81 1g6p n ILE 32 Ca 0.00 -5.61 -0.29 0.00 1.00 0.00 0.00 62.75 57.85 1g6p n ILE 32 Cb 0.39 -1.42 -0.13 0.00 -0.71 0.00 0.00 39.64 37.77 1g6p n ILE 32 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 1g6p s GLU 33 N -3.67 1.71 0.38 0.38 2.12 -1.26 -2.43 118.70 115.92 1g6p s GLU 33 Ca 0.47 -2.45 0.08 0.00 0.36 0.00 0.00 54.97 53.43 1g6p s GLU 33 Cb 0.27 -2.82 -0.07 0.00 0.26 0.00 0.00 34.13 31.77 1g6p s GLU 33 CO -0.15 -1.17 -0.03 1.41 -0.54 0.00 0.00 175.26 174.78 1g6p s MET 34 N -0.18 1.89 -0.11 4.30 1.75 -1.26 -5.06 119.30 120.63 1g6p s MET 34 Ca 0.19 -2.03 0.15 0.00 -1.25 0.00 0.00 55.69 52.76 1g6p s MET 34 Cb -0.20 -1.64 0.23 0.00 2.84 0.00 0.00 34.83 36.06 1g6p s MET 34 CO -0.04 0.03 1.12 -0.85 -0.65 0.00 0.00 175.02 174.63 1g6p n GLU 35 N -0.88 1.31 0.02 4.11 0.00 -1.26 -4.63 120.64 119.31 1g6p n GLU 35 Ca -0.05 -2.32 -0.02 0.00 0.00 0.00 0.00 57.16 54.77 1g6p n GLU 35 Cb 0.65 -1.36 -0.01 0.00 0.00 0.00 0.00 31.44 30.73 1g6p n GLU 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1g6p n GLY 36 N -1.21 -0.13 2.76 -1.84 0.00 -1.26 -5.01 105.19 98.50 1g6p n GLY 36 Ca 0.13 -0.06 -0.03 0.00 0.00 0.00 0.00 46.02 46.06 1g6p n GLY 36 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1g6p s PHE 37 N -2.13 -1.22 -0.18 1.61 5.36 -1.26 -5.13 117.98 115.03 1g6p s PHE 37 Ca -0.05 -0.38 -0.01 0.00 -0.96 0.00 0.00 56.93 55.53 1g6p s PHE 37 Cb 0.01 0.24 -0.00 0.00 -0.34 0.00 0.00 43.02 42.92 1g6p s PHE 37 CO 0.07 -0.95 -0.12 0.21 -1.46 0.00 0.00 175.22 172.97 1g6p s LYS 38 N 0.97 3.25 0.15 10.12 2.36 -1.26 -4.66 119.74 130.67 1g6p s LYS 38 Ca 0.27 -0.71 -0.24 0.00 -2.55 0.00 0.00 55.97 52.73 1g6p s LYS 38 Cb 0.04 -2.74 0.07 0.00 -1.05 0.00 0.00 37.83 34.14 1g6p s LYS 38 CO -0.07 -0.06 0.76 0.95 1.55 0.00 0.00 175.35 178.48 1g6p s THR 39 N 1.04 0.00 -0.24 3.43 -4.23 -1.26 -4.86 115.64 109.52 1g6p s THR 39 Ca -0.01 -0.35 -0.01 0.00 -1.18 0.00 0.00 61.69 60.14 1g6p s THR 39 Cb -0.15 -1.41 0.07 0.00 1.34 0.00 0.00 72.50 72.36 1g6p s THR 39 CO -0.03 0.00 0.04 -0.76 -0.54 0.00 0.00 174.62 173.34 1g6p s LEU 40 N -2.76 1.80 0.00 4.79 2.01 -1.26 -4.67 118.68 118.59 1g6p s LEU 40 Ca 0.06 -1.18 0.29 0.00 0.01 0.00 0.00 54.13 53.31 1g6p s LEU 40 Cb -0.02 -0.79 1.27 0.00 0.01 0.00 0.00 46.19 46.65 1g6p s LEU 40 CO -0.05 -0.33 1.94 0.29 1.01 0.00 0.00 176.35 179.21 1g6p n LYS 41 N 4.91 0.05 -0.86 1.70 4.76 -1.26 -4.74 118.16 122.72 1g6p n LYS 41 Ca -0.07 -0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.37 1g6p n LYS 41 Cb 0.45 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.14 1g6p n LYS 41 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1g6p n GLU 42 N -1.47 -0.76 -2.72 1.97 4.71 -1.26 -4.78 120.64 116.32 1g6p n GLU 42 Ca 0.08 0.19 -0.05 0.00 -0.01 0.00 0.00 57.16 57.37 1g6p n GLU 42 Cb 0.33 -4.11 0.06 0.00 -1.01 0.00 0.00 31.44 26.71 1g6p n GLU 42 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1g6p n GLY 43 N -1.05 1.62 0.00 0.62 0.00 -0.59 -2.59 105.19 103.21 1g6p n GLY 43 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.07 1g6p n GLY 43 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1g6p n GLN 44 N -0.45 0.00 -5.13 1.61 6.02 -1.16 -4.88 117.38 113.39 1g6p n GLN 44 Ca 0.04 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.71 1g6p n GLN 44 Cb 0.82 0.00 -0.16 0.00 1.02 0.00 0.00 30.24 31.92 1g6p n GLN 44 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1g6p s VAL 45 N -1.45 2.31 0.50 5.09 1.01 -1.06 -0.06 120.40 126.73 1g6p s VAL 45 Ca 0.00 -0.95 0.05 0.00 0.00 0.00 0.00 61.98 61.07 1g6p s VAL 45 Cb 0.00 -1.88 -0.00 0.00 0.00 0.00 0.00 36.38 34.49 1g6p s VAL 45 CO 0.00 0.56 0.21 -0.69 0.00 0.00 0.00 175.10 175.18 1g6p s VAL 46 N 0.09 1.68 -0.49 2.92 1.01 -0.87 0.12 120.40 124.86 1g6p s VAL 46 Ca -0.10 -1.71 0.04 0.00 0.00 0.00 0.00 61.98 60.21 1g6p s VAL 46 Cb -0.16 -2.39 0.13 0.00 0.00 0.00 0.00 36.38 33.96 1g6p s VAL 46 CO 0.06 0.00 0.23 -0.70 0.00 0.00 0.00 175.10 174.69 1g6p s GLU 47 N -4.05 1.88 0.18 2.72 2.56 -1.05 0.24 118.70 121.18 1g6p s GLU 47 Ca 0.27 -2.49 -0.00 0.00 0.00 0.00 0.00 54.97 52.74 1g6p s GLU 47 Cb 0.01 -3.27 -0.04 0.00 2.00 0.00 0.00 34.13 32.82 1g6p s GLU 47 CO 0.16 -1.08 0.08 -0.59 -0.56 0.00 0.00 175.26 173.26 1g6p s PHE 48 N -0.09 1.10 0.12 5.30 -0.71 0.32 -2.03 117.98 121.99 1g6p s PHE 48 Ca 0.16 -1.26 0.10 0.00 -1.04 0.00 0.00 56.93 54.90 1g6p s PHE 48 Cb -0.25 -0.59 -0.04 0.00 -1.21 0.00 0.00 43.02 40.93 1g6p s PHE 48 CO -0.01 -0.50 -0.26 -1.83 -1.34 0.00 0.00 175.22 171.27 1g6p s GLU 49 N -4.07 1.39 -0.07 1.99 -1.05 -0.96 0.11 118.70 116.04 1g6p s GLU 49 Ca 0.31 -1.29 -0.03 0.00 -0.15 0.00 0.00 54.97 53.82 1g6p s GLU 49 Cb 0.07 -1.81 0.04 0.00 -0.44 0.00 0.00 34.13 31.99 1g6p s GLU 49 CO 0.07 0.43 0.14 0.96 0.95 0.00 0.00 175.26 177.81 1g6p s ILE 50 N -1.05 -0.14 0.26 1.83 -0.00 -1.26 -1.27 121.20 119.57 1g6p s ILE 50 Ca 0.12 0.27 0.03 0.00 -0.00 0.00 0.00 60.65 61.08 1g6p s ILE 50 Cb -0.10 -0.25 -0.05 0.00 -0.00 0.00 0.00 42.46 42.06 1g6p s ILE 50 CO 0.05 0.11 0.02 -1.10 -0.00 0.00 0.00 174.94 174.02 1g6p s GLN 51 N 1.68 1.43 -0.14 0.37 -0.21 -1.02 -4.88 119.66 116.89 1g6p s GLN 51 Ca -0.03 -1.75 -0.01 0.00 0.02 0.00 0.00 55.36 53.59 1g6p s GLN 51 Cb -0.12 -0.66 -0.02 0.00 1.00 0.00 0.00 33.01 33.21 1g6p s GLN 51 CO -0.05 -0.13 -0.10 -1.21 -2.12 0.00 0.00 175.29 171.67 1g6p s GLU 52 N -3.88 3.45 0.00 2.91 2.02 -1.26 -1.48 118.70 120.45 1g6p s GLU 52 Ca 0.32 -0.64 0.00 0.00 0.02 0.00 0.00 54.97 54.66 1g6p s GLU 52 Cb 0.07 -2.72 0.00 0.00 0.10 0.00 0.00 34.13 31.58 1g6p s GLU 52 CO 0.11 0.19 0.00 0.41 0.02 0.00 0.00 175.26 176.00 1g6p n GLY 53 N 3.60 3.40 0.29 -1.39 0.00 -1.25 -4.97 105.19 104.88 1g6p n GLY 53 Ca -0.18 -0.49 0.12 0.00 0.00 0.00 0.00 46.02 45.47 1g6p n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1g6p h LYS 54 N 0.00 0.00 0.00 1.61 1.79 -2.06 -3.42 116.57 114.49 1g6p h LYS 54 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1g6p h LYS 54 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1g6p h LYS 54 CO 0.00 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 180.00 1g6p n LYS 55 N -4.26 0.00 -1.24 3.15 5.02 -1.26 -5.16 118.16 114.41 1g6p n LYS 55 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1g6p n LYS 55 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.17 1g6p n LYS 55 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1g6p n GLY 56 N 5.00 4.23 3.62 0.72 0.00 -1.26 -5.00 105.19 112.50 1g6p n GLY 56 Ca 0.00 -2.14 -0.43 0.00 0.00 0.00 0.00 46.02 43.45 1g6p n GLY 56 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1g6p s PRO 57 N -1.02 3.75 0.10 1.61 0.02 -1.26 -3.87 135.00 134.33 1g6p s PRO 57 Ca 0.00 1.41 0.06 0.00 0.02 0.00 0.00 61.00 62.49 1g6p s PRO 57 Cb 0.00 -4.01 -0.03 0.00 0.02 0.00 0.00 34.50 30.48 1g6p s PRO 57 CO 0.00 -1.34 -0.16 -1.14 -0.33 0.00 0.00 177.00 174.03 1g6p s GLN 58 N 4.67 0.99 0.26 5.54 -0.44 -0.55 -3.42 119.66 126.71 1g6p s GLN 58 Ca 0.66 -1.14 -0.30 0.00 -2.50 0.00 0.00 55.36 52.09 1g6p s GLN 58 Cb -0.21 -1.01 -0.10 0.00 -1.64 0.00 0.00 33.01 30.06 1g6p s GLN 58 CO 0.28 0.21 1.31 0.00 0.50 0.00 0.00 175.29 177.60 1g6p s ALA 59 N -1.65 3.52 -0.08 1.58 0.00 -1.19 -2.43 121.76 121.51 1g6p s ALA 59 Ca 0.05 1.17 0.06 0.00 0.00 0.00 0.00 51.96 53.25 1g6p s ALA 59 Cb -0.08 -3.48 -0.09 0.00 0.00 0.00 0.00 23.12 19.47 1g6p s ALA 59 CO 0.03 -0.57 0.02 0.00 0.00 0.00 0.00 175.76 175.24 1g6p n ALA 60 N 1.89 1.81 -3.89 0.00 0.00 -0.39 -4.49 120.51 115.44 1g6p n ALA 60 Ca 0.04 -0.50 -0.28 0.00 0.00 0.00 0.00 53.44 52.70 1g6p n ALA 60 Cb 0.42 0.10 -0.17 0.00 0.00 0.00 0.00 19.45 19.81 1g6p n ALA 60 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1g6p s HIS 61 N -2.19 1.61 -0.10 0.00 3.76 -1.25 -4.23 115.29 112.88 1g6p s HIS 61 Ca -0.05 -0.98 -0.01 0.00 -0.15 0.00 0.00 55.06 53.88 1g6p s HIS 61 Cb 0.02 -1.28 0.03 0.00 1.11 0.00 0.00 32.58 32.47 1g6p s HIS 61 CO 0.31 -0.59 -0.04 0.08 -0.85 0.00 0.00 174.74 173.65 1g6p s VAL 62 N 1.66 0.77 0.35 -0.90 1.01 0.36 -2.27 120.40 121.39 1g6p s VAL 62 Ca 0.02 -0.15 0.02 0.00 0.00 0.00 0.00 61.98 61.87 1g6p s VAL 62 Cb -0.15 -0.86 -0.01 0.00 0.00 0.00 0.00 36.38 35.37 1g6p s VAL 62 CO -0.08 0.30 0.08 0.29 0.00 0.00 0.00 175.10 175.70 1g6p n LYS 63 N 5.02 0.75 -5.12 2.72 5.02 -0.86 -4.45 118.16 121.25 1g6p n LYS 63 Ca -0.10 -2.85 -0.30 0.00 -2.02 0.00 0.00 58.31 53.03 1g6p n LYS 63 Cb 0.50 1.31 -0.15 0.00 -0.02 0.00 0.00 35.03 36.66 1g6p n LYS 63 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1g6p s VAL 64 N -2.70 2.08 0.32 -0.18 0.11 -1.26 -2.51 120.40 116.25 1g6p s VAL 64 Ca 0.12 -1.23 0.03 0.00 -2.93 0.00 0.00 61.98 57.96 1g6p s VAL 64 Cb 0.01 -1.75 -0.02 0.00 -1.53 0.00 0.00 36.38 33.08 1g6p s VAL 64 CO 0.08 0.48 0.32 0.68 -3.33 0.00 0.00 175.10 173.34 1g6p s VAL 65 N -0.70 0.00 0.00 2.04 -7.23 0.32 -4.76 120.40 110.08 1g6p s VAL 65 Ca 0.11 -1.87 0.00 0.00 -1.81 0.00 0.00 61.98 58.41 1g6p s VAL 65 Cb -0.10 -2.54 0.00 0.00 0.56 0.00 0.00 36.38 34.30 1g6p s VAL 65 CO 0.00 0.00 0.06 -1.84 -0.31 0.00 0.00 175.10 173.01