#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gf6 n ASN 3 N 0.00 5.25 0.26 -1.84 4.13 -1.26 -4.63 115.26 117.17 2gf6 n ASN 3 Ca 0.00 -3.06 0.12 0.00 1.68 0.00 0.00 54.58 53.31 2gf6 n ASN 3 Cb 0.00 -0.72 0.69 0.00 -1.54 0.00 0.00 39.78 38.21 2gf6 n ASN 3 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 2gf6 h ILE 4 N 3.28 0.65 0.00 2.41 2.10 -2.02 -1.68 117.51 122.24 2gf6 h ILE 4 Ca 0.14 -0.55 0.00 0.00 1.08 0.00 0.00 64.86 65.52 2gf6 h ILE 4 Cb 2.16 1.35 0.00 0.00 -1.09 0.00 0.00 36.82 39.24 2gf6 h ILE 4 CO 0.62 0.13 0.00 -1.84 -1.08 0.00 0.00 178.15 175.98 2gf6 n GLU 5 N -3.73 0.09 -0.12 2.19 0.00 -1.26 -1.90 120.64 115.91 2gf6 n GLU 5 Ca -0.02 0.48 0.10 0.00 0.00 0.00 0.00 57.16 57.73 2gf6 n GLU 5 Cb 0.24 -1.74 0.16 0.00 0.00 0.00 0.00 31.44 30.10 2gf6 n GLU 5 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2gf6 n TYR 6 N -1.93 0.32 -4.45 -1.84 4.01 -0.63 -3.83 117.16 108.81 2gf6 n TYR 6 Ca 0.01 -0.19 -0.27 0.00 -0.16 0.00 0.00 57.90 57.28 2gf6 n TYR 6 Cb 0.10 -0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 38.96 2gf6 n TYR 6 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2gf6 s VAL 7 N -1.44 1.38 -0.03 -0.72 1.01 -0.80 -0.73 120.40 119.08 2gf6 s VAL 7 Ca 0.31 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.73 2gf6 s VAL 7 Cb 0.19 -1.27 0.01 0.00 0.00 0.00 0.00 36.38 35.31 2gf6 s VAL 7 CO 0.27 0.42 -0.07 0.12 0.00 0.00 0.00 175.10 175.84 2gf6 s PHE 8 N 0.97 0.78 -0.01 5.22 5.36 -0.56 -4.97 117.98 124.78 2gf6 s PHE 8 Ca -0.08 -0.20 0.04 0.00 -0.96 0.00 0.00 56.93 55.74 2gf6 s PHE 8 Cb -0.15 -0.60 -0.01 0.00 -0.34 0.00 0.00 43.02 41.92 2gf6 s PHE 8 CO -0.01 -0.11 -0.14 -2.00 -1.46 0.00 0.00 175.22 171.50 2gf6 s GLU 9 N 0.39 1.16 0.19 10.12 2.12 -1.26 0.38 118.70 131.80 2gf6 s GLU 9 Ca -0.05 -0.51 -0.24 0.00 0.36 0.00 0.00 54.97 54.53 2gf6 s GLU 9 Cb -0.10 -1.12 0.05 0.00 0.26 0.00 0.00 34.13 33.23 2gf6 s GLU 9 CO 0.00 0.30 0.86 0.34 -0.54 0.00 0.00 175.26 176.23 2gf6 s ASP 10 N -0.32 -0.23 0.06 -1.70 2.15 -0.67 -5.00 116.67 110.96 2gf6 s ASP 10 Ca 0.05 -0.44 -0.02 0.00 0.43 0.00 0.00 52.55 52.57 2gf6 s ASP 10 Cb -0.06 0.57 -0.04 0.00 -0.30 0.00 0.00 42.92 43.09 2gf6 s ASP 10 CO -0.00 -1.04 0.25 -0.69 -0.17 0.00 0.00 175.17 173.51 2gf6 s VAL 11 N -3.51 5.33 -0.07 1.11 1.01 -1.26 0.06 120.40 123.07 2gf6 s VAL 11 Ca 0.11 -0.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.60 2gf6 s VAL 11 Cb -0.03 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.72 2gf6 s VAL 11 CO 0.03 0.17 1.09 -0.69 0.00 0.00 0.00 175.10 175.69 2gf6 s VAL 12 N -1.49 4.56 0.53 2.92 1.01 0.06 -4.94 120.40 123.05 2gf6 s VAL 12 Ca 0.34 1.84 0.06 0.00 0.00 0.00 0.00 61.98 64.23 2gf6 s VAL 12 Cb -0.13 -4.19 0.03 0.00 0.00 0.00 0.00 36.38 32.10 2gf6 s VAL 12 CO 0.24 0.02 0.41 -0.13 0.00 0.00 0.00 175.10 175.64 2gf6 s ARG 13 N 1.97 2.27 0.28 2.72 1.81 -1.26 -0.10 118.95 126.64 2gf6 s ARG 13 Ca 0.52 -1.98 -0.04 0.00 -1.72 0.00 0.00 55.73 52.51 2gf6 s ARG 13 Cb -0.21 -2.12 0.36 0.00 -0.45 0.00 0.00 34.95 32.52 2gf6 s ARG 13 CO 0.21 -0.59 1.94 0.97 -0.68 0.00 0.00 175.30 177.15 2gf6 h ILE 14 N 0.77 1.23 -0.06 1.52 6.09 -1.96 -0.41 117.51 124.69 2gf6 h ILE 14 Ca -0.37 -0.46 0.00 0.00 -1.37 0.00 0.00 64.86 62.66 2gf6 h ILE 14 Cb 1.30 -0.03 0.00 0.00 0.47 0.00 0.00 36.82 38.56 2gf6 h ILE 14 CO 0.57 0.23 0.00 0.00 -3.07 0.00 0.00 178.15 175.88 2gf6 n TYR 15 N -4.39 0.08 1.08 2.19 0.18 -1.26 -1.98 117.16 113.06 2gf6 n TYR 15 Ca 0.10 -0.04 0.12 0.00 1.88 0.00 0.00 57.90 59.96 2gf6 n TYR 15 Cb 0.04 0.00 0.11 0.00 -0.38 0.00 0.00 39.34 39.11 2gf6 n TYR 15 CO 0.00 0.00 0.00 -0.25 -2.08 0.00 0.00 176.86 174.53 2gf6 n ASP 16 N -0.40 1.86 -4.70 9.48 8.00 -0.17 -4.91 116.55 125.71 2gf6 n ASP 16 Ca 0.13 -1.41 -0.27 0.00 0.71 0.00 0.00 54.79 53.96 2gf6 n ASP 16 Cb 0.14 0.34 -0.07 0.00 -0.02 0.00 0.00 41.12 41.52 2gf6 n ASP 16 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2gf6 s THR 17 N -2.43 3.94 0.02 -3.53 -4.23 -0.84 -1.01 115.64 107.56 2gf6 s THR 17 Ca 0.21 -1.31 0.00 0.00 -1.18 0.00 0.00 61.69 59.41 2gf6 s THR 17 Cb 0.19 -2.98 0.00 0.00 1.34 0.00 0.00 72.50 71.04 2gf6 s THR 17 CO 0.53 -0.10 0.00 -0.90 -0.54 0.00 0.00 174.62 173.61 2gf6 n ASP 18 N -0.15 1.87 0.00 3.99 5.68 -1.18 -4.88 116.55 121.88 2gf6 n ASP 18 Ca -0.09 -1.10 0.09 0.00 -0.50 0.00 0.00 54.79 53.19 2gf6 n ASP 18 Cb 0.55 0.01 0.42 0.00 -1.14 0.00 0.00 41.12 40.96 2gf6 n ASP 18 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2gf6 n ALA 19 N -2.93 1.89 1.99 2.12 0.00 -1.26 -0.82 120.51 121.51 2gf6 n ALA 19 Ca -0.01 -0.07 0.14 0.00 0.00 0.00 0.00 53.44 53.50 2gf6 n ALA 19 Cb 0.03 -1.30 0.81 0.00 0.00 0.00 0.00 19.45 18.99 2gf6 n ALA 19 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2gf6 n GLN 20 N -1.43 1.01 -1.20 0.00 6.02 -1.26 -4.91 117.38 115.61 2gf6 n GLN 20 Ca 0.06 -0.02 -0.07 0.00 -0.01 0.00 0.00 57.00 56.96 2gf6 n GLN 20 Cb 0.19 -1.43 -0.03 0.00 1.02 0.00 0.00 30.24 29.99 2gf6 n GLN 20 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2gf6 n GLY 21 N 0.93 0.89 3.34 1.08 0.00 0.00 -4.97 105.19 106.46 2gf6 n GLY 21 Ca 0.21 -0.48 -0.18 0.00 0.00 0.00 0.00 46.02 45.56 2gf6 n GLY 21 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2gf6 s ILE 22 N -2.15 1.28 0.48 -0.61 -4.36 -1.26 -4.39 121.20 110.19 2gf6 s ILE 22 Ca 0.00 -2.08 -0.24 0.00 -0.26 0.00 0.00 60.65 58.07 2gf6 s ILE 22 Cb 0.00 -2.25 -0.07 0.00 1.25 0.00 0.00 42.46 41.39 2gf6 s ILE 22 CO 0.00 -0.42 1.37 0.00 0.24 0.00 0.00 174.94 176.13 2gf6 s ALA 23 N -3.26 3.06 0.45 2.27 0.00 0.00 -3.09 121.76 121.18 2gf6 s ALA 23 Ca 0.26 1.36 0.08 0.00 0.00 0.00 0.00 51.96 53.66 2gf6 s ALA 23 Cb 0.04 -3.56 0.01 0.00 0.00 0.00 0.00 23.12 19.61 2gf6 s ALA 23 CO 0.08 -1.20 0.53 -3.38 0.00 0.00 0.00 175.76 171.79 2gf6 s HIS 24 N -1.27 2.51 0.29 0.00 -3.43 -0.18 -4.89 115.29 108.31 2gf6 s HIS 24 Ca 0.65 -0.50 0.03 0.00 -0.80 0.00 0.00 55.06 54.44 2gf6 s HIS 24 Cb -0.41 -2.26 0.70 0.00 -1.43 0.00 0.00 32.58 29.18 2gf6 s HIS 24 CO 0.51 -0.42 1.72 -0.92 -2.00 0.00 0.00 174.74 173.62 2gf6 h TYR 25 N 0.71 0.75 0.00 0.38 3.20 -1.95 -0.76 116.97 119.30 2gf6 h TYR 25 Ca -0.39 0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.47 2gf6 h TYR 25 Cb 1.28 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 39.35 2gf6 h TYR 25 CO 0.48 0.04 -0.22 0.00 -1.64 0.00 0.00 178.16 176.81 2gf6 h ALA 26 N 1.67 0.86 -0.14 1.82 0.00 -1.95 -3.09 119.26 118.43 2gf6 h ALA 26 Ca 0.55 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 55.15 2gf6 h ALA 26 Cb 0.97 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 2gf6 h ALA 26 CO -0.47 0.28 -0.34 0.00 0.00 0.00 0.00 179.25 178.72 2gf6 h ALA 27 N 1.78 1.16 -0.08 0.00 0.00 -1.39 -2.58 119.26 118.14 2gf6 h ALA 27 Ca -0.00 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.44 2gf6 h ALA 27 Cb 1.17 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 2gf6 h ALA 27 CO 0.03 0.55 -0.38 1.88 0.00 0.00 0.00 179.25 181.33 2gf6 h TYR 28 N 0.24 0.20 -0.22 0.00 0.05 -1.48 -2.25 116.97 113.51 2gf6 h TYR 28 Ca 0.03 -0.05 -0.10 0.00 0.05 0.00 0.00 58.73 58.66 2gf6 h TYR 28 Cb 0.73 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 38.41 2gf6 h TYR 28 CO 0.01 0.53 -0.28 -0.92 -1.05 0.00 0.00 178.16 176.46 2gf6 h TYR 29 N 0.15 0.48 -0.03 4.88 3.20 -1.58 0.81 116.97 124.89 2gf6 h TYR 29 Ca 0.02 -0.11 -0.00 0.00 3.14 0.00 0.00 58.73 61.78 2gf6 h TYR 29 Cb 0.74 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.90 2gf6 h TYR 29 CO 0.01 0.67 0.01 -0.09 -1.64 0.00 0.00 178.16 177.12 2gf6 h ARG 30 N 0.38 0.05 -0.08 1.82 2.43 -1.21 0.53 114.38 118.29 2gf6 h ARG 30 Ca 0.05 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.23 2gf6 h ARG 30 Cb 0.69 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.22 2gf6 h ARG 30 CO 0.05 0.27 -0.02 0.74 -1.51 0.00 0.00 179.97 179.50 2gf6 h PHE 31 N -0.18 -0.04 0.00 2.20 -1.00 -1.15 -0.22 116.94 116.54 2gf6 h PHE 31 Ca 0.01 0.01 -0.12 0.00 2.81 0.00 0.00 57.97 60.68 2gf6 h PHE 31 Cb 0.24 0.03 -0.02 0.00 3.61 0.00 0.00 35.95 39.81 2gf6 h PHE 31 CO 0.01 -0.03 -0.55 0.27 -1.61 0.00 0.00 178.31 176.40 2gf6 h PHE 32 N 0.00 0.00 -0.56 -0.55 -5.15 -0.86 -2.41 116.94 107.40 2gf6 h PHE 32 Ca 0.04 0.00 -0.11 0.00 -0.20 0.00 0.00 57.97 57.71 2gf6 h PHE 32 Cb 0.06 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.21 2gf6 h PHE 32 CO -0.14 0.55 -0.06 1.15 -2.00 0.00 0.00 178.31 177.82 2gf6 h THR 33 N 0.00 1.27 -0.41 0.88 2.02 0.23 -1.90 112.91 115.00 2gf6 h THR 33 Ca -0.01 -1.21 -0.05 0.00 0.77 0.00 0.00 66.41 65.91 2gf6 h THR 33 Cb 1.24 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 68.54 2gf6 h THR 33 CO 0.07 0.43 0.04 0.78 0.37 0.00 0.00 175.52 177.22 2gf6 h ASN 34 N 0.92 0.59 -0.20 4.18 2.35 -0.91 -1.51 115.58 121.00 2gf6 h ASN 34 Ca 0.15 -0.11 -0.10 0.00 -0.55 0.00 0.00 56.30 55.69 2gf6 h ASN 34 Cb 0.62 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.84 2gf6 h ASN 34 CO 0.04 0.63 -0.27 0.74 -1.65 0.00 0.00 177.43 176.92 2gf6 h THR 35 N 0.61 1.33 -0.20 2.81 2.02 -1.20 -2.17 112.91 116.10 2gf6 h THR 35 Ca 0.13 -1.47 -0.17 0.00 0.77 0.00 0.00 66.41 65.67 2gf6 h THR 35 Cb 0.32 1.81 -0.00 0.00 -1.74 0.00 0.00 68.15 68.53 2gf6 h THR 35 CO 0.01 0.45 -0.57 0.40 0.37 0.00 0.00 175.52 176.17 2gf6 h ILE 36 N 0.21 1.31 -0.56 3.11 2.04 -1.28 -2.27 117.51 120.06 2gf6 h ILE 36 Ca 0.02 -1.81 -0.04 0.00 1.00 0.00 0.00 64.86 64.03 2gf6 h ILE 36 Cb 0.84 1.77 -0.02 0.00 -0.74 0.00 0.00 36.82 38.67 2gf6 h ILE 36 CO 0.06 0.57 0.20 -0.08 0.00 0.00 0.00 178.15 178.91 2gf6 h GLU 37 N 0.48 0.86 -0.08 2.37 4.81 -1.29 -1.97 114.58 119.77 2gf6 h GLU 37 Ca 0.00 -0.17 -0.01 0.00 -0.13 0.00 0.00 59.36 59.05 2gf6 h GLU 37 Cb 1.14 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 30.38 2gf6 h GLU 37 CO 0.11 0.76 0.01 -0.22 -0.73 0.00 0.00 179.01 178.94 2gf6 h LYS 38 N 0.78 0.13 -0.30 1.92 3.64 -1.28 -1.52 116.57 119.94 2gf6 h LYS 38 Ca 0.19 -0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.59 2gf6 h LYS 38 Cb 0.24 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 31.96 2gf6 h LYS 38 CO -0.01 0.36 -0.40 0.35 -2.27 0.00 0.00 179.45 177.48 2gf6 h PHE 39 N -0.11 -1.15 -0.81 1.91 3.57 -1.39 0.19 116.94 119.15 2gf6 h PHE 39 Ca 0.02 0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 2gf6 h PHE 39 Cb 0.29 0.55 -0.04 0.00 2.79 0.00 0.00 35.95 39.53 2gf6 h PHE 39 CO 0.02 -0.44 0.50 0.82 -2.23 0.00 0.00 178.31 176.98 2gf6 h ILE 40 N -0.37 1.22 0.12 1.41 1.08 -1.34 0.43 117.51 120.07 2gf6 h ILE 40 Ca 0.12 -0.46 0.00 0.00 -0.39 0.00 0.00 64.86 64.13 2gf6 h ILE 40 Cb 0.59 0.08 -0.01 0.00 -3.07 0.00 0.00 36.82 34.40 2gf6 h ILE 40 CO -0.50 0.23 -0.12 0.50 -0.69 0.00 0.00 178.15 177.57 2gf6 h LYS 41 N 1.10 -0.26 -0.00 2.37 3.64 -0.40 0.12 116.57 123.13 2gf6 h LYS 41 Ca 0.29 0.02 -0.25 0.00 -1.27 0.00 0.00 60.65 59.44 2gf6 h LYS 41 Cb -0.07 0.06 0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2gf6 h LYS 41 CO -0.06 -0.17 -0.99 0.93 -2.27 0.00 0.00 179.45 176.89 2gf6 h GLU 42 N -0.27 0.57 0.09 1.90 5.08 -0.22 -0.40 114.58 121.33 2gf6 h GLU 42 Ca 0.00 -0.60 -0.12 0.00 -1.00 0.00 0.00 59.36 57.64 2gf6 h GLU 42 Cb 0.26 0.17 0.01 0.00 0.50 0.00 0.00 28.75 29.69 2gf6 h GLU 42 CO -0.03 1.22 -0.54 -0.22 -1.00 0.00 0.00 179.01 178.44 2gf6 h LYS 43 N 0.32 0.20 0.02 2.33 1.63 -0.20 -3.40 116.57 117.46 2gf6 h LYS 43 Ca -0.10 -0.33 -0.38 0.00 -0.85 0.00 0.00 60.65 58.98 2gf6 h LYS 43 Cb 1.63 0.12 -0.06 0.00 -0.60 0.00 0.00 32.23 33.33 2gf6 h LYS 43 CO 0.18 1.16 -2.35 0.28 -3.45 0.00 0.00 179.45 175.27 2gf6 n VAL 44 N -4.29 1.52 -0.67 2.00 0.31 0.30 -4.70 118.33 112.79 2gf6 n VAL 44 Ca -0.13 -0.66 0.00 0.00 -0.01 0.00 0.00 64.34 63.55 2gf6 n VAL 44 Cb 0.71 -1.24 0.00 0.00 -0.91 0.00 0.00 33.84 32.40 2gf6 n VAL 44 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2gf6 n GLY 45 N 2.08 0.80 3.30 2.92 0.00 -0.16 -5.01 105.19 109.12 2gf6 n GLY 45 Ca -0.40 -0.55 -0.16 0.00 0.00 0.00 0.00 46.02 44.91 2gf6 n GLY 45 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2gf6 s ILE 46 N -2.00 1.30 0.59 -0.61 -4.36 -1.25 -5.00 121.20 109.88 2gf6 s ILE 46 Ca 0.00 -2.10 -0.14 0.00 -0.26 0.00 0.00 60.65 58.15 2gf6 s ILE 46 Cb 0.00 -2.04 -0.04 0.00 1.25 0.00 0.00 42.46 41.63 2gf6 s ILE 46 CO 0.00 -0.59 1.03 -2.84 0.24 0.00 0.00 174.94 172.78 2gf6 s PRO 47 N -3.75 3.51 -0.02 0.37 0.02 -1.26 -3.84 135.00 130.03 2gf6 s PRO 47 Ca 0.21 0.99 -0.04 0.00 0.02 0.00 0.00 61.00 62.18 2gf6 s PRO 47 Cb 0.03 -2.07 0.00 0.00 0.02 0.00 0.00 34.50 32.48 2gf6 s PRO 47 CO 0.05 -0.64 0.10 -0.47 -0.33 0.00 0.00 177.00 175.71 2gf6 s TYR 48 N -2.75 -0.03 -2.55 6.54 6.14 -1.26 -3.98 117.35 119.46 2gf6 s TYR 48 Ca 0.59 0.08 0.27 0.00 0.64 0.00 0.00 57.07 58.65 2gf6 s TYR 48 Cb -0.13 -0.01 0.79 0.00 0.42 0.00 0.00 41.96 43.03 2gf6 s TYR 48 CO 0.41 -0.14 1.59 -0.35 0.64 0.00 0.00 175.55 177.71 2gf6 n PRO 49 N 2.40 1.75 -3.46 4.97 -0.04 -1.26 -4.94 135.00 134.41 2gf6 n PRO 49 Ca -0.17 -1.17 -0.42 0.00 -0.04 0.00 0.00 63.50 61.71 2gf6 n PRO 49 Cb 0.58 -1.48 -0.10 0.00 -0.04 0.00 0.00 33.50 32.46 2gf6 n PRO 49 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2gf6 s ILE 50 N -2.05 5.24 -0.21 0.52 1.01 -1.26 0.07 121.20 124.51 2gf6 s ILE 50 Ca 0.34 -0.34 -0.20 0.00 0.00 0.00 0.00 60.65 60.44 2gf6 s ILE 50 Cb 0.21 -3.84 -0.18 0.00 0.01 0.00 0.00 42.46 38.66 2gf6 s ILE 50 CO 0.35 -0.17 0.14 0.52 0.00 0.00 0.00 174.94 175.78 2gf6 n VAL 51 N 5.18 1.53 -3.19 2.92 0.31 -0.48 -4.64 118.33 119.95 2gf6 n VAL 51 Ca -0.11 -0.04 -0.01 0.00 -0.01 0.00 0.00 64.34 64.16 2gf6 n VAL 51 Cb 0.48 -2.05 0.00 0.00 -0.91 0.00 0.00 33.84 31.37 2gf6 n VAL 51 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 2gf6 n ASN 52 N -4.43 -0.30 0.28 4.52 0.23 -0.46 -4.75 115.26 110.36 2gf6 n ASN 52 Ca -0.33 -1.23 0.15 0.00 -0.53 0.00 0.00 54.58 52.64 2gf6 n ASN 52 Cb 0.68 0.51 0.78 0.00 -2.08 0.00 0.00 39.78 39.67 2gf6 n ASN 52 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 2gf6 h GLU 53 N 0.00 0.00 -0.04 -3.83 4.11 -2.01 -2.99 114.58 109.83 2gf6 h GLU 53 Ca -0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.38 2gf6 h GLU 53 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2gf6 h GLU 53 CO 0.06 0.08 0.00 0.09 0.07 0.00 0.00 179.01 179.31 2gf6 n ASN 54 N -3.42 2.51 -3.55 3.06 4.13 -1.26 -4.50 115.26 112.23 2gf6 n ASN 54 Ca -0.01 -1.75 -0.11 0.00 1.68 0.00 0.00 54.58 54.39 2gf6 n ASN 54 Cb 0.24 -0.01 -0.10 0.00 -1.54 0.00 0.00 39.78 38.37 2gf6 n ASN 54 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2gf6 s LEU 55 N -1.48 -0.52 0.21 3.41 2.96 -1.13 -4.06 118.68 118.07 2gf6 s LEU 55 Ca 0.21 0.57 0.08 0.00 -0.22 0.00 0.00 54.13 54.77 2gf6 s LEU 55 Cb 0.15 1.05 -0.05 0.00 0.50 0.00 0.00 46.19 47.85 2gf6 s LEU 55 CO 0.22 -0.26 -0.14 0.26 -1.32 0.00 0.00 176.35 175.11 2gf6 s TRP 56 N 2.53 1.72 -0.19 5.38 0.52 -0.34 -1.35 118.94 127.21 2gf6 s TRP 56 Ca 0.04 -0.58 -0.05 0.00 0.02 0.00 0.00 56.10 55.54 2gf6 s TRP 56 Cb -0.13 -0.81 -0.02 0.00 -1.15 0.00 0.00 33.47 31.35 2gf6 s TRP 56 CO -0.13 0.35 -0.01 -0.06 0.02 0.00 0.00 176.95 177.12 2gf6 s PHE 57 N -2.98 3.03 0.20 -1.98 0.08 0.11 -0.94 117.98 115.50 2gf6 s PHE 57 Ca 0.23 -0.44 0.10 0.00 0.12 0.00 0.00 56.93 56.94 2gf6 s PHE 57 Cb -0.01 -2.05 -0.04 0.00 -0.57 0.00 0.00 43.02 40.35 2gf6 s PHE 57 CO 0.07 -0.20 -0.21 0.14 -0.10 0.00 0.00 175.22 174.92 2gf6 s VAL 58 N 0.84 2.15 -0.18 -0.44 -7.23 -0.72 -4.80 120.40 110.01 2gf6 s VAL 58 Ca 0.00 -2.05 -0.23 0.00 -1.81 0.00 0.00 61.98 57.88 2gf6 s VAL 58 Cb -0.14 -2.04 -0.02 0.00 0.56 0.00 0.00 36.38 34.73 2gf6 s VAL 58 CO 0.02 -0.25 0.75 -0.63 -0.31 0.00 0.00 175.10 174.68 2gf6 s ILE 59 N -1.99 4.93 -0.19 -0.62 1.01 -1.26 -0.96 121.20 122.12 2gf6 s ILE 59 Ca 0.20 1.45 0.22 0.00 0.00 0.00 0.00 60.65 62.52 2gf6 s ILE 59 Cb -0.06 -4.06 -0.24 0.00 0.01 0.00 0.00 42.46 38.11 2gf6 s ILE 59 CO 0.09 0.06 0.68 0.00 0.00 0.00 0.00 174.94 175.77 2gf6 n ALA 60 N 5.20 2.94 -3.57 9.38 0.00 0.28 -4.97 120.51 129.77 2gf6 n ALA 60 Ca 0.02 -0.45 -0.14 0.00 0.00 0.00 0.00 53.44 52.87 2gf6 n ALA 60 Cb 0.49 -0.85 -0.06 0.00 0.00 0.00 0.00 19.45 19.03 2gf6 n ALA 60 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2gf6 s GLU 61 N -3.42 0.78 0.01 0.00 2.12 -1.22 -4.99 118.70 111.97 2gf6 s GLU 61 Ca -0.04 0.36 -0.10 0.00 0.36 0.00 0.00 54.97 55.55 2gf6 s GLU 61 Cb 0.13 0.37 0.01 0.00 0.26 0.00 0.00 34.13 34.90 2gf6 s GLU 61 CO 0.87 -0.21 0.20 -1.54 -0.54 0.00 0.00 175.26 174.04 2gf6 s SER 62 N -0.76 -0.03 -0.13 -1.70 1.04 -1.26 -1.44 113.70 109.42 2gf6 s SER 62 Ca -0.04 -0.16 -0.15 0.00 0.48 0.00 0.00 55.95 56.08 2gf6 s SER 62 Cb -0.02 0.25 0.04 0.00 0.10 0.00 0.00 66.02 66.39 2gf6 s SER 62 CO 0.03 -0.43 0.40 -2.28 0.98 0.00 0.00 173.24 171.95 2gf6 s HIS 63 N -1.61 -0.42 -0.12 5.02 5.04 -0.87 -5.00 115.29 117.34 2gf6 s HIS 63 Ca -0.13 0.98 -0.17 0.00 -1.54 0.00 0.00 55.06 54.20 2gf6 s HIS 63 Cb -0.06 0.15 0.04 0.00 0.04 0.00 0.00 32.58 32.76 2gf6 s HIS 63 CO 0.01 -0.25 0.45 0.00 -2.34 0.00 0.00 174.74 172.61 2gf6 s ALA 64 N -0.03 -1.12 -0.18 1.58 0.00 -1.26 -1.54 121.76 119.21 2gf6 s ALA 64 Ca -0.02 1.06 0.01 0.00 0.00 0.00 0.00 51.96 53.01 2gf6 s ALA 64 Cb -0.03 -0.47 0.02 0.00 0.00 0.00 0.00 23.12 22.64 2gf6 s ALA 64 CO 0.01 -0.24 -0.18 0.42 0.00 0.00 0.00 175.76 175.77 2gf6 s ILE 65 N -0.29 1.94 -0.62 0.00 1.01 0.09 -4.99 121.20 118.33 2gf6 s ILE 65 Ca -0.04 -0.92 -0.12 0.00 0.00 0.00 0.00 60.65 59.56 2gf6 s ILE 65 Cb -0.03 -1.80 0.16 0.00 0.01 0.00 0.00 42.46 40.80 2gf6 s ILE 65 CO 0.03 0.47 0.54 -0.31 0.00 0.00 0.00 174.94 175.66 2gf6 s TYR 66 N 1.33 3.48 0.07 3.97 1.51 -1.26 -2.28 117.35 124.17 2gf6 s TYR 66 Ca 0.04 -1.82 -0.09 0.00 -1.01 0.00 0.00 57.07 54.19 2gf6 s TYR 66 Cb -0.14 -3.66 -0.27 0.00 -0.11 0.00 0.00 41.96 37.78 2gf6 s TYR 66 CO -0.12 -0.98 1.13 0.45 -1.11 0.00 0.00 175.55 174.92 2gf6 h HIS 67 N 8.21 0.71 -4.04 2.71 3.86 -0.93 -3.46 115.15 122.21 2gf6 h HIS 67 Ca -0.11 -0.48 -0.16 0.00 -1.16 0.00 0.00 60.37 58.45 2gf6 h HIS 67 Cb 1.06 -0.04 -0.20 0.00 1.06 0.00 0.00 27.41 29.29 2gf6 h HIS 67 CO 0.80 1.35 -0.70 1.03 0.86 0.00 0.00 177.93 181.28 2gf6 s ARG 68 N -2.81 0.39 0.41 2.45 0.52 -0.50 -5.04 118.95 114.36 2gf6 s ARG 68 Ca -0.06 -0.77 -0.18 0.00 -0.52 0.00 0.00 55.73 54.20 2gf6 s ARG 68 Cb 0.06 0.12 -0.10 0.00 0.52 0.00 0.00 34.95 35.56 2gf6 s ARG 68 CO 0.90 -0.06 0.88 -1.25 0.02 0.00 0.00 175.30 175.79 2gf6 s PRO 69 N -2.07 4.10 -0.06 3.54 0.04 -1.26 -4.75 135.00 134.54 2gf6 s PRO 69 Ca -0.10 0.93 0.04 0.00 0.04 0.00 0.00 61.00 61.90 2gf6 s PRO 69 Cb -0.06 -2.26 -0.02 0.00 0.04 0.00 0.00 34.50 32.20 2gf6 s PRO 69 CO -0.03 -0.01 -0.16 0.14 0.04 0.00 0.00 177.00 176.98 2gf6 s VAL 70 N -2.19 2.93 0.36 -0.36 -7.23 -1.26 -5.05 120.40 107.59 2gf6 s VAL 70 Ca 0.59 -0.76 0.08 0.00 -1.81 0.00 0.00 61.98 60.07 2gf6 s VAL 70 Cb -0.10 -2.14 -0.04 0.00 0.56 0.00 0.00 36.38 34.66 2gf6 s VAL 70 CO 0.18 0.58 0.22 -0.54 -0.31 0.00 0.00 175.10 175.22 2gf6 s LYS 71 N -0.54 2.48 0.19 4.82 1.02 -1.26 -0.82 119.74 125.62 2gf6 s LYS 71 Ca 0.07 -1.50 -0.33 0.00 0.02 0.00 0.00 55.97 54.23 2gf6 s LYS 71 Cb -0.11 -2.27 -0.15 0.00 -0.52 0.00 0.00 37.83 34.78 2gf6 s LYS 71 CO 0.01 0.05 1.33 -0.11 -0.92 0.00 0.00 175.35 175.71 2gf6 n LEU 72 N -1.27 2.33 0.00 3.17 7.94 -1.26 -1.92 117.00 125.99 2gf6 n LEU 72 Ca -0.02 1.13 0.00 0.00 -1.11 0.00 0.00 56.01 56.01 2gf6 n LEU 72 Cb 0.61 -1.32 0.00 0.00 0.53 0.00 0.00 43.42 43.24 2gf6 n LEU 72 CO 0.43 -0.84 0.00 0.61 -1.11 0.00 0.00 177.39 176.48 2gf6 n GLY 73 N 2.31 1.63 3.72 -3.96 0.00 0.86 -4.97 105.19 104.78 2gf6 n GLY 73 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2gf6 n GLY 73 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gf6 s ASP 74 N -3.22 6.76 -0.41 1.61 1.01 -0.81 -4.67 116.67 116.94 2gf6 s ASP 74 Ca 0.00 2.43 -0.29 0.00 0.71 0.00 0.00 52.55 55.40 2gf6 s ASP 74 Cb 0.00 -2.59 0.02 0.00 1.01 0.00 0.00 42.92 41.36 2gf6 s ASP 74 CO 0.00 -0.69 1.11 -0.75 0.21 0.00 0.00 175.17 175.05 2gf6 s LYS 75 N 0.91 3.88 -0.02 8.23 2.20 -1.26 -0.76 119.74 132.92 2gf6 s LYS 75 Ca 0.65 0.80 -0.05 0.00 -0.36 0.00 0.00 55.97 57.00 2gf6 s LYS 75 Cb -0.39 -3.83 -0.04 0.00 -1.51 0.00 0.00 37.83 32.06 2gf6 s LYS 75 CO 0.32 -1.17 0.22 -0.51 -0.36 0.00 0.00 175.35 173.85 2gf6 s LEU 76 N 4.10 4.38 -0.15 5.43 1.43 0.11 -4.48 118.68 129.49 2gf6 s LEU 76 Ca 0.47 0.47 -0.02 0.00 -1.03 0.00 0.00 54.13 54.02 2gf6 s LEU 76 Cb -0.09 -2.54 -0.02 0.00 0.03 0.00 0.00 46.19 43.56 2gf6 s LEU 76 CO 0.24 0.29 -0.09 -0.89 0.23 0.00 0.00 176.35 176.13 2gf6 s THR 77 N -1.26 3.38 -0.14 5.49 2.01 -0.02 -1.67 115.64 123.44 2gf6 s THR 77 Ca 0.25 -0.54 -0.03 0.00 0.31 0.00 0.00 61.69 61.69 2gf6 s THR 77 Cb -0.13 -2.46 -0.03 0.00 0.01 0.00 0.00 72.50 69.90 2gf6 s THR 77 CO 0.15 0.50 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.85 2gf6 s VAL 78 N 0.46 3.84 -0.15 3.82 1.01 0.16 -0.31 120.40 129.22 2gf6 s VAL 78 Ca -0.07 -0.38 -0.02 0.00 0.00 0.00 0.00 61.98 61.51 2gf6 s VAL 78 Cb -0.15 -2.66 -0.02 0.00 0.00 0.00 0.00 36.38 33.55 2gf6 s VAL 78 CO 0.04 0.51 -0.09 -0.76 0.00 0.00 0.00 175.10 174.81 2gf6 s LEU 79 N 0.18 2.95 -0.12 3.92 1.43 0.09 -1.50 118.68 125.63 2gf6 s LEU 79 Ca -0.02 -0.25 -0.02 0.00 -1.03 0.00 0.00 54.13 52.81 2gf6 s LEU 79 Cb -0.14 -1.69 -0.03 0.00 0.03 0.00 0.00 46.19 44.36 2gf6 s LEU 79 CO 0.03 0.15 -0.05 -0.22 0.23 0.00 0.00 176.35 176.49 2gf6 s LEU 80 N 0.46 3.20 -0.39 1.79 2.96 0.10 -1.37 118.68 125.43 2gf6 s LEU 80 Ca -0.07 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.77 2gf6 s LEU 80 Cb -0.15 -1.74 0.12 0.00 0.50 0.00 0.00 46.19 44.92 2gf6 s LEU 80 CO 0.04 0.25 0.16 0.21 -1.32 0.00 0.00 176.35 175.69 2gf6 s ASN 81 N -0.11 4.06 0.21 3.68 3.04 0.19 -4.85 114.94 121.16 2gf6 s ASN 81 Ca 0.02 -2.29 -0.30 0.00 0.04 0.00 0.00 52.86 50.32 2gf6 s ASN 81 Cb -0.13 -1.18 -0.08 0.00 -1.54 0.00 0.00 41.25 38.32 2gf6 s ASN 81 CO 0.03 -0.33 0.97 -2.16 -3.04 0.00 0.00 177.10 172.57 2gf6 s PRO 82 N 0.75 4.79 -0.14 0.43 0.05 -1.26 -1.43 135.00 138.19 2gf6 s PRO 82 Ca 0.14 1.52 0.01 0.00 0.05 0.00 0.00 61.00 62.72 2gf6 s PRO 82 Cb -0.22 -3.30 0.02 0.00 0.05 0.00 0.00 34.50 31.06 2gf6 s PRO 82 CO -0.09 0.39 -0.15 0.15 0.05 0.00 0.00 177.00 177.36 2gf6 s LYS 83 N -0.86 2.29 -0.66 4.56 -0.14 0.61 -4.96 119.74 120.58 2gf6 s LYS 83 Ca 0.43 -0.56 -0.26 0.00 -1.36 0.00 0.00 55.97 54.22 2gf6 s LYS 83 Cb -0.26 -2.06 0.04 0.00 -1.68 0.00 0.00 37.83 33.87 2gf6 s LYS 83 CO 0.32 -0.19 1.16 0.42 -0.76 0.00 0.00 175.35 176.30 2gf6 s ILE 84 N 1.36 3.99 0.16 2.17 1.09 -1.26 -1.33 121.20 127.38 2gf6 s ILE 84 Ca 0.02 0.42 0.03 0.00 -1.10 0.00 0.00 60.65 60.02 2gf6 s ILE 84 Cb -0.13 -4.78 -0.15 0.00 -1.06 0.00 0.00 42.46 36.34 2gf6 s ILE 84 CO -0.08 -1.55 1.37 -0.07 -0.10 0.00 0.00 174.94 174.51 2gf6 h LEU 85 N 12.17 0.22 0.00 2.97 3.38 -1.65 -3.48 115.31 128.92 2gf6 h LEU 85 Ca -0.27 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 2gf6 h LEU 85 Cb 1.06 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.74 2gf6 h LEU 85 CO 1.21 1.00 0.12 -1.54 0.09 0.00 0.00 178.44 179.32 2gf6 n SER 86 N -3.63 -0.92 0.00 -0.43 3.41 -0.98 -4.91 113.62 106.16 2gf6 n SER 86 Ca -0.03 -1.63 0.05 0.00 -0.26 0.00 0.00 58.87 57.00 2gf6 n SER 86 Cb 0.82 1.53 0.31 0.00 -0.26 0.00 0.00 64.21 66.61 2gf6 n SER 86 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2gf6 n ASN 87 N -1.20 0.00 0.00 4.04 0.23 -1.26 -2.96 115.26 114.11 2gf6 n ASN 87 Ca -0.03 -0.88 0.00 0.00 -0.53 0.00 0.00 54.58 53.14 2gf6 n ASN 87 Cb 0.24 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.94 2gf6 n ASN 87 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 2gf6 n LYS 88 N -0.77 3.10 -4.30 -3.83 5.02 -1.26 -4.36 118.16 111.75 2gf6 n LYS 88 Ca 0.08 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.18 2gf6 n LYS 88 Cb 0.04 -0.69 -0.15 0.00 -0.02 0.00 0.00 35.03 34.20 2gf6 n LYS 88 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2gf6 s THR 89 N -1.28 0.63 -0.05 -0.18 2.01 -1.16 -1.22 115.64 114.39 2gf6 s THR 89 Ca 0.00 -0.32 0.02 0.00 0.31 0.00 0.00 61.69 61.70 2gf6 s THR 89 Cb 0.00 -0.55 0.02 0.00 0.01 0.00 0.00 72.50 71.98 2gf6 s THR 89 CO 0.00 0.19 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.41 2gf6 s ILE 90 N -0.03 0.80 -0.33 1.82 1.01 -0.36 -1.54 121.20 122.57 2gf6 s ILE 90 Ca 0.01 -0.28 -0.16 0.00 0.00 0.00 0.00 60.65 60.22 2gf6 s ILE 90 Cb -0.05 -0.77 -0.02 0.00 0.01 0.00 0.00 42.46 41.63 2gf6 s ILE 90 CO -0.00 0.28 0.42 -0.75 0.00 0.00 0.00 174.94 174.89 2gf6 s LYS 91 N 0.82 3.70 -0.54 2.79 2.20 -0.44 -0.56 119.74 127.72 2gf6 s LYS 91 Ca -0.12 -0.20 -0.17 0.00 -0.36 0.00 0.00 55.97 55.12 2gf6 s LYS 91 Cb -0.15 -3.77 0.10 0.00 -1.51 0.00 0.00 37.83 32.50 2gf6 s LYS 91 CO 0.02 -0.50 0.56 -0.06 -0.36 0.00 0.00 175.35 175.00 2gf6 s PHE 92 N 2.17 3.14 0.38 4.03 0.08 -0.26 -0.28 117.98 127.25 2gf6 s PHE 92 Ca 0.15 -1.01 -0.23 0.00 0.12 0.00 0.00 56.93 55.96 2gf6 s PHE 92 Cb -0.16 -3.70 -0.10 0.00 -0.57 0.00 0.00 43.02 38.49 2gf6 s PHE 92 CO 0.12 -1.06 0.94 -1.21 -0.10 0.00 0.00 175.22 173.91 2gf6 s GLU 93 N 2.09 4.38 0.04 0.44 2.02 -0.51 -1.71 118.70 125.45 2gf6 s GLU 93 Ca 0.08 1.20 -0.05 0.00 0.02 0.00 0.00 54.97 56.22 2gf6 s GLU 93 Cb -0.25 -2.47 -0.02 0.00 0.10 0.00 0.00 34.13 31.49 2gf6 s GLU 93 CO 0.06 0.12 0.08 -0.59 0.02 0.00 0.00 175.26 174.94 2gf6 s PHE 94 N -1.92 0.26 0.02 1.61 -0.12 -0.70 -0.64 117.98 116.49 2gf6 s PHE 94 Ca 0.56 -0.61 0.04 0.00 -0.05 0.00 0.00 56.93 56.87 2gf6 s PHE 94 Cb -0.13 -0.18 -0.02 0.00 -0.63 0.00 0.00 43.02 42.06 2gf6 s PHE 94 CO 0.18 -0.38 -0.13 0.15 -0.05 0.00 0.00 175.22 174.99 2gf6 s LYS 95 N -2.90 0.96 -0.08 1.99 1.02 -0.47 -1.97 119.74 118.29 2gf6 s LYS 95 Ca -0.02 -0.62 0.04 0.00 0.02 0.00 0.00 55.97 55.38 2gf6 s LYS 95 Cb 0.01 -0.94 -0.01 0.00 -0.52 0.00 0.00 37.83 36.36 2gf6 s LYS 95 CO -0.06 0.24 -0.21 0.08 -0.92 0.00 0.00 175.35 174.49 2gf6 s VAL 96 N -0.61 2.42 0.05 3.17 1.01 0.18 -0.73 120.40 125.88 2gf6 s VAL 96 Ca 0.03 -0.92 0.05 0.00 0.00 0.00 0.00 61.98 61.14 2gf6 s VAL 96 Cb -0.07 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.36 2gf6 s VAL 96 CO 0.00 0.56 -0.14 -0.76 0.00 0.00 0.00 175.10 174.77 2gf6 s LEU 97 N 0.02 2.22 -0.20 3.92 1.02 0.57 -0.78 118.68 125.45 2gf6 s LEU 97 Ca -0.07 -0.53 0.01 0.00 0.02 0.00 0.00 54.13 53.55 2gf6 s LEU 97 Cb -0.15 -0.53 0.02 0.00 0.02 0.00 0.00 46.19 45.56 2gf6 s LEU 97 CO 0.05 -0.03 -0.16 -0.75 0.02 0.00 0.00 176.35 175.48 2gf6 s LYS 98 N -1.43 2.91 -1.38 1.70 2.20 0.03 -0.84 119.74 122.93 2gf6 s LYS 98 Ca -0.01 -0.90 -0.10 0.00 -0.36 0.00 0.00 55.97 54.61 2gf6 s LYS 98 Cb -0.09 -2.70 0.07 0.00 -1.51 0.00 0.00 37.83 33.60 2gf6 s LYS 98 CO 0.02 -0.28 0.59 -0.25 -0.36 0.00 0.00 175.35 175.06 2gf6 n ASP 99 N 4.62 -4.23 0.00 1.43 8.00 -1.26 -1.45 116.55 123.66 2gf6 n ASP 99 Ca -0.19 -0.45 0.00 0.00 0.71 0.00 0.00 54.79 54.86 2gf6 n ASP 99 Cb 0.49 -3.46 0.00 0.00 -0.02 0.00 0.00 41.12 38.12 2gf6 n ASP 99 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gf6 n GLY 100 N -1.31 0.78 3.44 0.44 0.00 -1.26 -5.03 105.19 102.25 2gf6 n GLY 100 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2gf6 n GLY 100 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gf6 s GLU 101 N -0.39 3.61 0.17 1.61 2.02 -0.53 -5.06 118.70 120.14 2gf6 s GLU 101 Ca 0.00 -0.51 -0.31 0.00 0.02 0.00 0.00 54.97 54.17 2gf6 s GLU 101 Cb 0.00 -3.15 -0.09 0.00 0.10 0.00 0.00 34.13 30.98 2gf6 s GLU 101 CO 0.00 -0.07 1.43 -1.17 0.02 0.00 0.00 175.26 175.47 2gf6 s LEU 102 N 1.24 4.38 -0.10 1.80 2.96 -1.26 -0.79 118.68 126.91 2gf6 s LEU 102 Ca 0.04 2.49 0.06 0.00 -0.22 0.00 0.00 54.13 56.50 2gf6 s LEU 102 Cb -0.15 -3.60 -0.11 0.00 0.50 0.00 0.00 46.19 42.84 2gf6 s LEU 102 CO 0.02 -0.68 -0.01 0.35 -1.32 0.00 0.00 176.35 174.71 2gf6 n THR 103 N 3.35 0.67 -3.71 3.68 -2.24 0.04 -4.72 114.28 111.35 2gf6 n THR 103 Ca 0.10 -0.37 -0.14 0.00 -2.27 0.00 0.00 64.05 61.37 2gf6 n THR 103 Cb 0.41 -0.80 -0.09 0.00 -2.10 0.00 0.00 70.33 67.75 2gf6 n THR 103 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2gf6 s THR 104 N -2.24 0.02 -0.01 4.28 2.01 -1.08 -0.18 115.64 118.45 2gf6 s THR 104 Ca -0.08 -0.20 -0.16 0.00 0.31 0.00 0.00 61.69 61.56 2gf6 s THR 104 Cb 0.03 -0.67 0.03 0.00 0.01 0.00 0.00 72.50 71.90 2gf6 s THR 104 CO 0.36 -0.11 0.34 -1.83 -0.69 0.00 0.00 174.62 172.69 2gf6 s GLU 105 N -0.62 0.72 0.00 4.92 -1.05 -0.96 -0.65 118.70 121.05 2gf6 s GLU 105 Ca -0.07 -0.19 0.00 0.00 -0.15 0.00 0.00 54.97 54.56 2gf6 s GLU 105 Cb -0.04 0.32 0.00 0.00 -0.44 0.00 0.00 34.13 33.97 2gf6 s GLU 105 CO 0.03 -0.20 0.00 0.41 0.95 0.00 0.00 175.26 176.45 2gf6 n GLY 106 N 1.17 0.91 3.50 -3.83 0.00 -0.83 -0.73 105.19 105.37 2gf6 n GLY 106 Ca -0.21 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.05 2gf6 n GLY 106 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2gf6 s TYR 107 N -2.31 -0.19 -0.04 1.61 -0.85 -0.59 -1.72 117.35 113.26 2gf6 s TYR 107 Ca 0.00 -0.14 0.03 0.00 -0.52 0.00 0.00 57.07 56.44 2gf6 s TYR 107 Cb 0.00 0.41 0.01 0.00 0.38 0.00 0.00 41.96 42.76 2gf6 s TYR 107 CO 0.00 -0.90 -0.10 0.14 -1.52 0.00 0.00 175.55 173.17 2gf6 s VAL 108 N -3.85 0.91 -0.24 -3.49 -7.23 -0.69 -2.05 120.40 103.76 2gf6 s VAL 108 Ca 0.07 -0.41 -0.16 0.00 -1.81 0.00 0.00 61.98 59.68 2gf6 s VAL 108 Cb -0.01 -0.82 -0.04 0.00 0.56 0.00 0.00 36.38 36.08 2gf6 s VAL 108 CO -0.05 0.29 0.41 -0.63 -0.31 0.00 0.00 175.10 174.81 2gf6 s ILE 109 N 0.32 5.16 -0.00 -0.62 1.01 -0.52 -1.10 121.20 125.45 2gf6 s ILE 109 Ca -0.06 0.68 0.04 0.00 0.00 0.00 0.00 60.65 61.31 2gf6 s ILE 109 Cb -0.11 -3.74 -0.03 0.00 0.01 0.00 0.00 42.46 38.60 2gf6 s ILE 109 CO 0.01 0.18 -0.11 -1.10 0.00 0.00 0.00 174.94 173.92 2gf6 s GLN 110 N 1.85 2.44 -0.04 2.79 -0.21 0.28 -0.56 119.66 126.22 2gf6 s GLN 110 Ca 0.18 -0.77 0.06 0.00 0.02 0.00 0.00 55.36 54.84 2gf6 s GLN 110 Cb -0.15 -2.41 -0.02 0.00 1.00 0.00 0.00 33.01 31.43 2gf6 s GLN 110 CO 0.09 0.60 -0.20 0.42 -2.12 0.00 0.00 175.29 174.08 2gf6 s ILE 111 N -0.92 2.59 -0.07 1.08 -1.09 -0.13 -1.22 121.20 121.43 2gf6 s ILE 111 Ca 0.15 -0.90 -0.28 0.00 -2.23 0.00 0.00 60.65 57.39 2gf6 s ILE 111 Cb -0.11 -1.97 -0.02 0.00 -1.58 0.00 0.00 42.46 38.78 2gf6 s ILE 111 CO 0.05 0.58 0.90 0.00 -1.23 0.00 0.00 174.94 175.25 2gf6 s ALA 112 N -0.65 3.32 0.05 9.38 0.00 -0.36 -1.75 121.76 131.76 2gf6 s ALA 112 Ca 0.10 0.33 0.02 0.00 0.00 0.00 0.00 51.96 52.41 2gf6 s ALA 112 Cb -0.10 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.72 2gf6 s ALA 112 CO -0.00 -0.37 -0.08 0.96 0.00 0.00 0.00 175.76 176.27 2gf6 s ILE 113 N 1.41 0.61 -0.49 0.00 -4.36 -0.12 -0.32 121.20 117.93 2gf6 s ILE 113 Ca 0.46 -1.20 -0.23 0.00 -0.26 0.00 0.00 60.65 59.41 2gf6 s ILE 113 Cb -0.19 -0.78 0.03 0.00 1.25 0.00 0.00 42.46 42.78 2gf6 s ILE 113 CO 0.21 -0.42 0.82 0.21 0.24 0.00 0.00 174.94 175.99 2gf6 s ASN 114 N -1.77 6.37 0.36 4.36 3.84 -0.66 -1.20 114.94 126.25 2gf6 s ASN 114 Ca -0.07 -0.28 0.27 0.00 0.21 0.00 0.00 52.86 52.99 2gf6 s ASN 114 Cb -0.08 -2.39 1.22 0.00 -0.55 0.00 0.00 41.25 39.44 2gf6 s ASN 114 CO 0.00 -1.02 1.81 1.55 -2.79 0.00 0.00 177.10 176.65 2gf6 h PRO 115 N 9.09 0.00 -0.50 0.43 0.13 -1.79 0.82 132.00 140.18 2gf6 h PRO 115 Ca -0.25 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.75 2gf6 h PRO 115 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 2gf6 h PRO 115 CO 1.00 0.00 -0.18 0.87 -0.23 0.00 0.00 178.00 179.46 2gf6 h LYS 116 N 0.00 1.00 0.00 0.86 1.57 -1.92 -3.07 116.57 115.00 2gf6 h LYS 116 Ca 0.00 -0.41 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 2gf6 h LYS 116 Cb 0.29 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.55 2gf6 h LYS 116 CO 0.00 1.09 -1.14 0.44 -0.57 0.00 0.00 179.45 179.26 2gf6 n ILE 117 N -4.14 0.05 -3.56 1.86 -5.35 -1.19 -5.01 119.36 102.01 2gf6 n ILE 117 Ca 0.00 -0.16 -0.23 0.00 -0.27 0.00 0.00 62.75 62.10 2gf6 n ILE 117 Cb 0.44 0.54 0.05 0.00 -1.74 0.00 0.00 39.64 38.93 2gf6 n ILE 117 CO 0.00 0.00 0.00 1.87 -1.76 0.00 0.00 176.55 176.66 2gf6 n TRP 118 N -1.76 -2.07 -4.20 4.28 -0.00 0.27 -5.04 117.44 108.91 2gf6 n TRP 118 Ca 0.02 0.72 -0.12 0.00 -0.00 0.00 0.00 57.50 58.12 2gf6 n TRP 118 Cb 0.40 -4.04 -0.10 0.00 -0.00 0.00 0.00 31.31 27.57 2gf6 n TRP 118 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 2gf6 s LYS 119 N -5.52 0.95 0.61 5.87 -0.14 -1.14 -5.00 119.74 115.37 2gf6 s LYS 119 Ca 0.28 -1.41 -0.19 0.00 -1.36 0.00 0.00 55.97 53.29 2gf6 s LYS 119 Cb -0.07 -0.27 -0.03 0.00 -1.68 0.00 0.00 37.83 35.78 2gf6 s LYS 119 CO 0.81 -0.04 1.26 -1.54 -0.76 0.00 0.00 175.35 175.07 2gf6 s SER 120 N -3.10 4.94 -0.03 2.83 1.04 -1.26 -1.65 113.70 116.47 2gf6 s SER 120 Ca 0.16 2.54 -0.09 0.00 0.48 0.00 0.00 55.95 59.04 2gf6 s SER 120 Cb 0.05 -2.61 0.01 0.00 0.10 0.00 0.00 66.02 63.57 2gf6 s SER 120 CO -0.01 -1.77 0.20 0.28 0.98 0.00 0.00 173.24 172.91 2gf6 s THR 121 N -1.47 0.05 0.00 2.02 -1.32 0.56 -4.68 115.64 110.80 2gf6 s THR 121 Ca 0.79 -0.39 0.00 0.00 -1.21 0.00 0.00 61.69 60.88 2gf6 s THR 121 Cb -0.35 -0.42 0.00 0.00 -1.51 0.00 0.00 72.50 70.22 2gf6 s THR 121 CO 0.38 -0.21 0.00 -0.62 -2.21 0.00 0.00 174.62 171.95 2gf6 n GLU 122 N 1.99 3.42 -3.98 7.08 1.02 -1.26 -4.51 120.64 124.40 2gf6 n GLU 122 Ca -0.19 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.69 2gf6 n GLU 122 Cb 0.57 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.95 2gf6 n GLU 122 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 2gf6 s PRO 124 N 0.00 3.30 0.39 3.49 0.02 -1.26 -5.01 135.00 135.93 2gf6 s PRO 124 Ca 0.00 -0.64 0.07 0.00 0.02 0.00 0.00 61.00 60.45 2gf6 s PRO 124 Cb 0.00 -2.90 0.78 0.00 0.02 0.00 0.00 34.50 32.40 2gf6 s PRO 124 CO 0.00 0.52 1.98 -0.22 -0.33 0.00 0.00 177.00 178.95 2gf6 h LYS 125 N 2.33 0.47 -0.98 5.54 3.64 -2.05 -2.46 116.57 123.07 2gf6 h LYS 125 Ca -0.48 -0.06 0.03 0.00 -1.27 0.00 0.00 60.65 58.87 2gf6 h LYS 125 Cb 1.19 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 32.87 2gf6 h LYS 125 CO 0.68 0.41 0.64 1.05 -2.27 0.00 0.00 179.45 179.96 2gf6 h GLU 126 N 0.47 1.21 -0.87 1.90 4.11 -2.04 0.27 114.58 119.63 2gf6 h GLU 126 Ca 0.11 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 59.47 2gf6 h GLU 126 Cb 0.14 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.12 2gf6 h GLU 126 CO -0.01 0.80 0.00 -0.89 0.07 0.00 0.00 179.01 178.98 2gf6 n ILE 127 N -4.45 0.20 0.00 -1.06 5.41 -0.93 -1.68 119.36 116.86 2gf6 n ILE 127 Ca 0.13 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.88 2gf6 n ILE 127 Cb 0.08 -0.49 0.00 0.00 -0.71 0.00 0.00 39.64 38.52 2gf6 n ILE 127 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 2gf6 n ASP 129 N 0.31 0.00 -0.16 4.38 8.00 0.96 -0.97 116.55 129.07 2gf6 n ASP 129 Ca 0.00 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.48 2gf6 n ASP 129 Cb 0.22 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.39 2gf6 n ASP 129 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2gf6 h LYS 130 N 0.00 0.30 0.00 -1.24 1.79 -1.57 -2.74 116.57 113.11 2gf6 h LYS 130 Ca 0.00 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.44 2gf6 h LYS 130 Cb 0.00 -0.07 -0.00 0.00 -1.58 0.00 0.00 32.23 30.58 2gf6 h LYS 130 CO 0.00 0.20 -0.05 -0.07 -1.08 0.00 0.00 179.45 178.45 2gf6 h LEU 131 N 0.31 0.00 -0.17 2.94 3.38 -1.32 -2.80 115.31 117.64 2gf6 h LEU 131 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2gf6 h LEU 131 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2gf6 h LEU 131 CO -0.28 0.05 -0.07 -1.54 0.09 0.00 0.00 178.44 176.68 2gf6 n SER 132 N -3.43 0.34 -4.59 -0.43 3.41 -1.03 -4.79 113.62 103.09 2gf6 n SER 132 Ca -0.02 -0.52 -0.40 0.00 -0.26 0.00 0.00 58.87 57.67 2gf6 n SER 132 Cb 0.17 -0.12 -0.08 0.00 -0.26 0.00 0.00 64.21 63.93 2gf6 n SER 132 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2gf6 s ILE 133 N -2.45 5.09 -2.00 -1.33 1.01 -1.06 -5.12 121.20 115.33 2gf6 s ILE 133 Ca 0.30 0.59 0.15 0.00 0.00 0.00 0.00 60.65 61.69 2gf6 s ILE 133 Cb 0.20 -3.83 0.44 0.00 0.01 0.00 0.00 42.46 39.28 2gf6 s ILE 133 CO 0.46 0.01 1.33 1.17 0.00 0.00 0.00 174.94 177.91