#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n9r n LYS 20 N 0.00 0.00 0.00 1.96 5.02 -1.26 -2.54 118.16 121.34 1n9r n LYS 20 Ca 0.00 0.06 0.12 0.00 -2.02 0.00 0.00 58.31 56.47 1n9r n LYS 20 Cb 0.00 -1.50 0.61 0.00 -0.02 0.00 0.00 35.03 34.12 1n9r n LYS 20 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n9r n GLY 21 N -1.05 -1.20 0.00 0.72 0.00 -1.26 -3.64 105.19 98.75 1n9r n GLY 21 Ca 0.00 -0.11 0.06 0.00 0.00 0.00 0.00 46.02 45.97 1n9r n GLY 21 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n9r n LEU 22 N -1.35 0.28 -4.33 0.99 4.77 -1.05 -4.95 117.00 111.36 1n9r n LEU 22 Ca 0.10 -0.23 -0.40 0.00 -0.03 0.00 0.00 56.01 55.46 1n9r n LEU 22 Cb 0.23 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.34 1n9r n LEU 22 CO 0.21 0.07 -0.38 0.52 -1.33 0.00 0.00 177.39 176.48 1n9r n VAL 23 N -1.67 0.79 -1.05 4.08 0.31 -1.24 0.14 118.33 119.69 1n9r n VAL 23 Ca -0.00 -0.50 -0.07 0.00 -0.01 0.00 0.00 64.34 63.76 1n9r n VAL 23 Cb 0.28 -0.20 -0.03 0.00 -0.91 0.00 0.00 33.84 32.98 1n9r n VAL 23 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1n9r n ASN 24 N 1.92 -4.01 -4.98 4.52 3.02 0.11 -4.95 115.26 110.89 1n9r n ASN 24 Ca 0.10 0.18 -0.20 0.00 -0.03 0.00 0.00 54.58 54.62 1n9r n ASN 24 Cb 0.45 -3.05 -0.01 0.00 -0.61 0.00 0.00 39.78 36.56 1n9r n ASN 24 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1n9r s HIS 25 N -1.45 3.26 -0.40 3.10 3.76 0.37 -4.84 115.29 119.09 1n9r s HIS 25 Ca 0.00 -0.07 -0.24 0.00 -0.15 0.00 0.00 55.06 54.60 1n9r s HIS 25 Cb 0.00 -1.87 0.02 0.00 1.11 0.00 0.00 32.58 31.83 1n9r s HIS 25 CO 0.00 0.12 0.81 0.50 -0.85 0.00 0.00 174.74 175.32 1n9r s ARG 26 N -4.15 3.63 0.38 1.40 3.52 -1.26 -1.40 118.95 121.05 1n9r s ARG 26 Ca 0.41 0.18 0.05 0.00 -0.13 0.00 0.00 55.73 56.24 1n9r s ARG 26 Cb -0.09 -3.86 -0.06 0.00 -1.56 0.00 0.00 34.95 29.37 1n9r s ARG 26 CO 0.31 -0.98 0.04 0.14 -0.81 0.00 0.00 175.30 174.00 1n9r s VAL 27 N 3.26 1.48 -0.08 7.11 -7.23 -0.16 0.22 120.40 125.00 1n9r s VAL 27 Ca 0.32 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.50 1n9r s VAL 27 Cb -0.12 -2.81 0.02 0.00 0.56 0.00 0.00 36.38 34.02 1n9r s VAL 27 CO 0.20 0.00 -0.11 -0.83 -0.31 0.00 0.00 175.10 174.05 1n9r s GLY 28 N -3.61 0.81 -0.35 2.32 0.00 0.52 -1.75 107.32 105.26 1n9r s GLY 28 Ca 0.33 -0.47 -0.11 0.00 0.00 0.00 0.00 44.72 44.47 1n9r s GLY 28 CO 0.16 0.37 0.20 0.14 0.00 0.00 0.00 173.10 173.96 1n9r s VAL 29 N 1.04 4.67 -0.15 1.40 1.01 0.24 -1.07 120.40 127.54 1n9r s VAL 29 Ca -0.07 -0.66 -0.12 0.00 0.00 0.00 0.00 61.98 61.12 1n9r s VAL 29 Cb -0.15 -3.52 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 1n9r s VAL 29 CO -0.01 -0.13 0.25 -0.75 0.00 0.00 0.00 175.10 174.47 1n9r s LYS 30 N 1.59 4.12 0.52 2.72 2.47 0.17 -0.67 119.74 130.67 1n9r s LYS 30 Ca 0.03 0.04 -0.02 0.00 -1.56 0.00 0.00 55.97 54.46 1n9r s LYS 30 Cb -0.18 -3.38 0.01 0.00 -1.46 0.00 0.00 37.83 32.81 1n9r s LYS 30 CO 0.07 0.35 0.78 -0.51 0.16 0.00 0.00 175.35 176.20 1n9r s LEU 31 N 0.15 3.42 -0.00 5.43 1.43 -1.12 -0.20 118.68 127.79 1n9r s LEU 31 Ca 0.15 0.44 -0.24 0.00 -1.03 0.00 0.00 54.13 53.45 1n9r s LEU 31 Cb -0.13 -3.29 -0.16 0.00 0.03 0.00 0.00 46.19 42.64 1n9r s LEU 31 CO 0.04 -0.92 1.15 0.11 0.23 0.00 0.00 176.35 176.96 1n9r h LYS 32 N 0.10 -0.38 -7.04 1.70 1.57 -1.18 -3.40 116.57 107.94 1n9r h LYS 32 Ca -0.45 0.03 -0.50 0.00 -1.87 0.00 0.00 60.65 57.86 1n9r h LYS 32 Cb 1.26 0.09 0.04 0.00 0.08 0.00 0.00 32.23 33.69 1n9r h LYS 32 CO 0.58 -0.05 0.20 -0.59 -0.57 0.00 0.00 179.45 179.02 1n9r s PHE 33 N -4.41 3.57 0.00 -1.35 -0.12 -1.26 -4.91 117.98 109.49 1n9r s PHE 33 Ca -0.14 0.98 0.00 0.00 -0.05 0.00 0.00 56.93 57.72 1n9r s PHE 33 Cb 0.02 -2.44 0.00 0.00 -0.63 0.00 0.00 43.02 39.97 1n9r s PHE 33 CO 0.52 -0.37 0.00 0.09 -0.05 0.00 0.00 175.22 175.41 1n9r n ASN 34 N -2.26 0.00 -2.83 1.98 3.02 -1.26 -4.18 115.26 109.73 1n9r n ASN 34 Ca 0.02 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.46 1n9r n ASN 34 Cb 0.55 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.77 1n9r n ASN 34 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1n9r n SER 35 N 0.36 -0.46 -4.78 6.41 3.41 -1.26 -5.04 113.62 112.25 1n9r n SER 35 Ca 0.00 -3.00 -0.34 0.00 -0.26 0.00 0.00 58.87 55.27 1n9r n SER 35 Cb 0.00 0.43 -0.07 0.00 -0.26 0.00 0.00 64.21 64.31 1n9r n SER 35 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1n9r s THR 36 N -1.30 4.81 -0.05 6.66 2.01 -1.26 -0.93 115.64 125.58 1n9r s THR 36 Ca 0.28 -0.24 -0.05 0.00 0.31 0.00 0.00 61.69 61.99 1n9r s THR 36 Cb 0.37 -3.14 0.01 0.00 0.01 0.00 0.00 72.50 69.75 1n9r s THR 36 CO -0.05 0.46 0.14 -0.70 -0.69 0.00 0.00 174.62 173.78 1n9r s GLU 37 N -1.42 0.16 -0.18 4.92 2.12 -0.02 -2.78 118.70 121.50 1n9r s GLU 37 Ca 0.19 0.18 -0.07 0.00 0.36 0.00 0.00 54.97 55.63 1n9r s GLU 37 Cb -0.12 0.08 -0.04 0.00 0.26 0.00 0.00 34.13 34.31 1n9r s GLU 37 CO 0.10 -0.02 0.05 0.71 -0.54 0.00 0.00 175.26 175.56 1n9r s TYR 38 N 0.05 3.22 0.00 5.30 1.51 0.15 -0.73 117.35 126.85 1n9r s TYR 38 Ca -0.00 0.01 0.05 0.00 -1.01 0.00 0.00 57.07 56.12 1n9r s TYR 38 Cb -0.01 -2.08 -0.03 0.00 -0.11 0.00 0.00 41.96 39.73 1n9r s TYR 38 CO 0.00 0.10 -0.16 1.03 -1.11 0.00 0.00 175.55 175.41 1n9r s ARG 39 N 0.46 2.28 0.00 -0.62 0.52 -0.80 0.83 118.95 121.62 1n9r s ARG 39 Ca 0.03 -0.85 0.00 0.00 -0.52 0.00 0.00 55.73 54.39 1n9r s ARG 39 Cb -0.13 -2.28 0.00 0.00 0.52 0.00 0.00 34.95 33.06 1n9r s ARG 39 CO 0.01 0.58 0.00 0.41 0.02 0.00 0.00 175.30 176.32 1n9r n GLY 40 N 1.87 -0.88 3.66 -3.53 0.00 -0.72 -0.84 105.19 104.76 1n9r n GLY 40 Ca -0.16 -0.78 -0.36 0.00 0.00 0.00 0.00 46.02 44.71 1n9r n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n9r s THR 41 N -3.00 5.27 -0.59 2.61 2.01 0.18 -0.99 115.64 121.13 1n9r s THR 41 Ca 0.00 0.15 -0.27 0.00 0.31 0.00 0.00 61.69 61.87 1n9r s THR 41 Cb 0.00 -3.44 0.00 0.00 0.01 0.00 0.00 72.50 69.07 1n9r s THR 41 CO 0.00 0.37 1.58 -0.22 -0.69 0.00 0.00 174.62 175.65 1n9r s LEU 42 N 0.93 3.33 -0.09 4.42 2.96 -0.50 -0.53 118.68 129.20 1n9r s LEU 42 Ca 0.07 0.27 -0.26 0.00 -0.22 0.00 0.00 54.13 53.99 1n9r s LEU 42 Cb -0.13 -2.83 -0.22 0.00 0.50 0.00 0.00 46.19 43.51 1n9r s LEU 42 CO 0.03 -1.96 0.90 0.58 -1.32 0.00 0.00 176.35 174.59 1n9r h VAL 43 N 6.53 1.49 -3.58 1.68 2.07 -0.61 0.32 116.25 124.15 1n9r h VAL 43 Ca -0.27 -1.79 -0.18 0.00 0.82 0.00 0.00 66.70 65.29 1n9r h VAL 43 Cb 1.12 2.66 -0.04 0.00 -1.52 0.00 0.00 31.29 33.51 1n9r h VAL 43 CO 1.20 0.44 0.03 -1.54 0.02 0.00 0.00 177.57 177.72 1n9r n SER 44 N -4.73 -1.74 -1.37 0.57 3.41 -1.21 -4.56 113.62 103.99 1n9r n SER 44 Ca -0.09 -2.76 -0.00 0.00 -0.26 0.00 0.00 58.87 55.76 1n9r n SER 44 Cb 0.37 3.05 0.00 0.00 -0.26 0.00 0.00 64.21 67.37 1n9r n SER 44 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1n9r n THR 45 N -0.56 0.00 -3.57 6.66 -1.04 -1.26 -1.84 114.28 112.67 1n9r n THR 45 Ca -0.03 -0.09 -0.08 0.00 -2.04 0.00 0.00 64.05 61.81 1n9r n THR 45 Cb 0.59 0.12 -0.04 0.00 -1.82 0.00 0.00 70.33 69.18 1n9r n THR 45 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 1n9r s ASP 46 N -1.39 -0.29 0.14 8.00 -4.77 -1.23 -5.00 116.67 112.13 1n9r s ASP 46 Ca 0.04 0.20 0.02 0.00 -3.30 0.00 0.00 52.55 49.50 1n9r s ASP 46 Cb -0.00 0.26 0.36 0.00 -1.09 0.00 0.00 42.92 42.44 1n9r s ASP 46 CO 0.01 -0.35 0.66 0.59 0.70 0.00 0.00 175.17 176.79 1n9r n ASN 47 N 0.34 -0.02 0.00 2.11 3.02 -1.26 0.10 115.26 119.55 1n9r n ASN 47 Ca -0.07 0.72 0.00 0.00 -0.03 0.00 0.00 54.58 55.20 1n9r n ASN 47 Cb 0.59 -0.27 0.00 0.00 -0.61 0.00 0.00 39.78 39.49 1n9r n ASN 47 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1n9r n TYR 48 N -4.37 0.00 -2.47 3.10 4.02 -1.26 -4.74 117.16 111.43 1n9r n TYR 48 Ca 0.11 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.80 1n9r n TYR 48 Cb 0.36 -0.16 -0.01 0.00 -0.02 0.00 0.00 39.34 39.51 1n9r n TYR 48 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1n9r n PHE 49 N -1.11 -1.15 -3.40 -0.72 3.01 0.28 -4.42 117.46 109.95 1n9r n PHE 49 Ca 0.00 0.06 -0.38 0.00 1.01 0.00 0.00 57.45 58.13 1n9r n PHE 49 Cb 0.04 -3.89 -0.08 0.00 -0.01 0.00 0.00 39.48 35.54 1n9r n PHE 49 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 1n9r s ASN 50 N -2.12 6.37 0.08 4.37 0.01 -1.24 -2.49 114.94 119.93 1n9r s ASN 50 Ca 0.03 0.44 0.03 0.00 -0.71 0.00 0.00 52.86 52.65 1n9r s ASN 50 Cb -0.02 -2.22 -0.03 0.00 0.41 0.00 0.00 41.25 39.39 1n9r s ASN 50 CO 0.04 -0.11 -0.09 -1.48 -1.51 0.00 0.00 177.10 173.95 1n9r s LEU 51 N 1.53 2.38 -0.24 0.60 0.05 -0.64 -3.57 118.68 118.79 1n9r s LEU 51 Ca 0.18 -0.78 -0.06 0.00 0.05 0.00 0.00 54.13 53.52 1n9r s LEU 51 Cb -0.15 -0.25 -0.02 0.00 -2.05 0.00 0.00 46.19 43.72 1n9r s LEU 51 CO 0.08 -0.27 0.04 -1.58 -0.55 0.00 0.00 176.35 174.07 1n9r s GLN 52 N -2.64 3.60 -0.09 1.48 0.74 -0.77 -1.02 119.66 120.97 1n9r s GLN 52 Ca 0.03 -0.51 0.04 0.00 0.05 0.00 0.00 55.36 54.96 1n9r s GLN 52 Cb -0.03 -3.23 -0.01 0.00 1.10 0.00 0.00 33.01 30.83 1n9r s GLN 52 CO -0.01 -0.16 -0.20 -1.17 -0.55 0.00 0.00 175.29 173.20 1n9r s LEU 53 N 1.49 2.33 -0.09 3.68 2.96 -0.13 0.19 118.68 129.12 1n9r s LEU 53 Ca 0.06 -0.43 0.01 0.00 -0.22 0.00 0.00 54.13 53.54 1n9r s LEU 53 Cb -0.15 -1.47 -0.03 0.00 0.50 0.00 0.00 46.19 45.05 1n9r s LEU 53 CO 0.02 0.21 -0.10 0.21 -1.32 0.00 0.00 176.35 175.37 1n9r s ASN 54 N 0.03 4.34 -1.21 3.68 3.84 0.31 -1.37 114.94 124.56 1n9r s ASN 54 Ca -0.08 -0.15 -0.04 0.00 0.21 0.00 0.00 52.86 52.80 1n9r s ASN 54 Cb -0.15 -1.24 0.00 0.00 -0.55 0.00 0.00 41.25 39.32 1n9r s ASN 54 CO 0.05 0.29 1.03 -0.62 -2.79 0.00 0.00 177.10 175.07 1n9r n GLU 55 N 2.68 -6.91 -2.65 0.43 1.02 -1.12 -0.64 120.64 113.45 1n9r n GLU 55 Ca -0.18 0.80 -0.41 0.00 -0.02 0.00 0.00 57.16 57.36 1n9r n GLU 55 Cb 0.53 -5.71 -0.05 0.00 -0.02 0.00 0.00 31.44 26.19 1n9r n GLU 55 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1n9r s ALA 56 N -3.32 3.33 -0.08 0.62 0.00 -0.95 -4.37 121.76 116.99 1n9r s ALA 56 Ca 0.26 0.69 0.03 0.00 0.00 0.00 0.00 51.96 52.94 1n9r s ALA 56 Cb -0.12 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 19.73 1n9r s ALA 56 CO 0.69 -0.02 -0.15 -2.00 0.00 0.00 0.00 175.76 174.28 1n9r s GLU 57 N -0.62 2.08 -0.03 0.00 2.12 -0.02 0.16 118.70 122.39 1n9r s GLU 57 Ca 0.45 -0.54 -0.25 0.00 0.36 0.00 0.00 54.97 54.99 1n9r s GLU 57 Cb -0.27 -1.66 -0.04 0.00 0.26 0.00 0.00 34.13 32.43 1n9r s GLU 57 CO 0.33 0.07 0.76 -2.00 -0.54 0.00 0.00 175.26 173.88 1n9r s GLU 58 N 0.58 4.47 -0.13 4.30 2.12 -0.44 -1.90 118.70 127.70 1n9r s GLU 58 Ca -0.16 1.02 0.00 0.00 0.36 0.00 0.00 54.97 56.19 1n9r s GLU 58 Cb -0.16 -3.43 0.02 0.00 0.26 0.00 0.00 34.13 30.82 1n9r s GLU 58 CO 0.05 0.09 -0.13 -0.06 -0.54 0.00 0.00 175.26 174.68 1n9r s PHE 59 N 0.64 1.97 -0.20 5.30 0.40 0.09 -0.44 117.98 125.74 1n9r s PHE 59 Ca 0.40 -1.05 -0.04 0.00 -0.60 0.00 0.00 56.93 55.65 1n9r s PHE 59 Cb -0.19 -1.48 -0.01 0.00 0.51 0.00 0.00 43.02 41.85 1n9r s PHE 59 CO 0.21 -0.60 -0.05 0.08 0.70 0.00 0.00 175.22 175.56 1n9r s VAL 60 N 1.44 3.44 -1.63 -0.44 1.01 -0.25 -0.84 120.40 123.14 1n9r s VAL 60 Ca 0.03 -0.48 -0.17 0.00 0.00 0.00 0.00 61.98 61.35 1n9r s VAL 60 Cb -0.13 -2.55 0.15 0.00 0.00 0.00 0.00 36.38 33.85 1n9r s VAL 60 CO -0.08 0.44 0.77 0.00 0.00 0.00 0.00 175.10 176.23 1n9r n ALA 61 N 4.48 -1.22 -1.15 5.51 0.00 -0.10 0.08 120.51 128.10 1n9r n ALA 61 Ca -0.18 0.02 -0.05 0.00 0.00 0.00 0.00 53.44 53.23 1n9r n ALA 61 Cb 0.51 -3.50 -0.02 0.00 0.00 0.00 0.00 19.45 16.44 1n9r n ALA 61 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n9r n GLY 62 N -1.38 0.78 3.30 0.00 0.00 -1.26 -5.03 105.19 101.61 1n9r n GLY 62 Ca 0.07 -0.74 -0.31 0.00 0.00 0.00 0.00 46.02 45.03 1n9r n GLY 62 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n9r s VAL 63 N -2.17 2.14 0.02 1.61 1.01 0.11 -5.07 120.40 118.06 1n9r s VAL 63 Ca 0.00 -1.06 -0.30 0.00 0.00 0.00 0.00 61.98 60.62 1n9r s VAL 63 Cb 0.00 -1.76 -0.05 0.00 0.00 0.00 0.00 36.38 34.57 1n9r s VAL 63 CO 0.00 0.58 1.28 -0.55 0.00 0.00 0.00 175.10 176.41 1n9r s SER 64 N -0.40 6.97 -0.27 3.32 0.15 -1.26 -1.09 113.70 121.12 1n9r s SER 64 Ca 0.04 2.03 0.11 0.00 0.70 0.00 0.00 55.95 58.83 1n9r s SER 64 Cb -0.12 -2.57 0.54 0.00 -1.71 0.00 0.00 66.02 62.16 1n9r s SER 64 CO 0.01 -0.60 1.50 1.41 1.20 0.00 0.00 173.24 176.77 1n9r n HIS 65 N 4.69 1.25 0.00 3.44 8.25 0.41 -4.97 115.22 128.30 1n9r n HIS 65 Ca 0.11 -1.37 0.00 0.00 -0.26 0.00 0.00 57.72 56.20 1n9r n HIS 65 Cb 0.45 -0.48 0.00 0.00 1.12 0.00 0.00 29.99 31.08 1n9r n HIS 65 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1n9r n GLY 66 N -0.89 1.27 3.48 -1.41 0.00 -1.26 -4.79 105.19 101.59 1n9r n GLY 66 Ca 0.32 -2.15 -0.34 0.00 0.00 0.00 0.00 46.02 43.85 1n9r n GLY 66 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n9r s THR 67 N -1.48 3.73 0.47 2.61 2.01 -1.26 -1.33 115.64 120.39 1n9r s THR 67 Ca 0.00 -0.42 0.07 0.00 0.31 0.00 0.00 61.69 61.65 1n9r s THR 67 Cb 0.00 -2.62 0.03 0.00 0.01 0.00 0.00 72.50 69.93 1n9r s THR 67 CO 0.00 0.51 0.65 -0.76 -0.69 0.00 0.00 174.62 174.32 1n9r s LEU 68 N 0.28 3.49 0.00 4.42 1.43 0.43 -4.95 118.68 123.77 1n9r s LEU 68 Ca -0.04 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 52.59 1n9r s LEU 68 Cb -0.14 -2.45 0.00 0.00 0.03 0.00 0.00 46.19 43.63 1n9r s LEU 68 CO 0.03 -0.95 0.00 0.61 0.23 0.00 0.00 176.35 176.28 1n9r n GLY 69 N -2.00 0.96 3.74 -3.19 0.00 -1.26 -3.27 105.19 100.17 1n9r n GLY 69 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 1n9r n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1n9r s GLU 70 N 1.09 4.55 0.06 1.61 0.41 -1.26 -2.23 118.70 122.93 1n9r s GLU 70 Ca 0.00 1.17 0.05 0.00 -0.41 0.00 0.00 54.97 55.77 1n9r s GLU 70 Cb 0.00 -3.36 -0.03 0.00 -1.78 0.00 0.00 34.13 28.96 1n9r s GLU 70 CO 0.00 0.29 -0.13 0.96 -0.49 0.00 0.00 175.26 175.89 1n9r s ILE 71 N -0.14 1.02 -0.24 -1.63 -4.36 -0.47 -5.00 121.20 110.39 1n9r s ILE 71 Ca 0.40 -1.23 -0.04 0.00 -0.26 0.00 0.00 60.65 59.52 1n9r s ILE 71 Cb -0.21 -0.99 -0.00 0.00 1.25 0.00 0.00 42.46 42.50 1n9r s ILE 71 CO 0.25 -0.22 -0.02 -0.36 0.24 0.00 0.00 174.94 174.83 1n9r s PHE 72 N -1.24 3.01 0.00 1.37 0.40 -1.26 -0.95 117.98 119.31 1n9r s PHE 72 Ca -0.03 -0.96 -0.01 0.00 -0.60 0.00 0.00 56.93 55.33 1n9r s PHE 72 Cb -0.10 -2.13 -0.04 0.00 0.51 0.00 0.00 43.02 41.26 1n9r s PHE 72 CO 0.02 -0.55 0.13 0.42 0.70 0.00 0.00 175.22 175.93 1n9r s ILE 73 N 1.48 5.03 -0.16 0.64 1.01 -0.19 -4.97 121.20 124.04 1n9r s ILE 73 Ca 0.05 -0.33 -0.15 0.00 0.00 0.00 0.00 60.65 60.23 1n9r s ILE 73 Cb -0.15 -3.33 -0.05 0.00 0.01 0.00 0.00 42.46 38.94 1n9r s ILE 73 CO -0.02 0.32 0.32 -0.13 0.00 0.00 0.00 174.94 175.43 1n9r s ARG 74 N -1.88 4.27 0.16 2.79 1.81 -1.26 -1.63 118.95 123.21 1n9r s ARG 74 Ca 0.25 0.15 -0.14 0.00 -1.72 0.00 0.00 55.73 54.27 1n9r s ARG 74 Cb -0.12 -3.44 0.15 0.00 -0.45 0.00 0.00 34.95 31.09 1n9r s ARG 74 CO 0.17 0.20 1.13 0.00 -0.68 0.00 0.00 175.30 176.12 1n9r h ASN 76 N 0.00 -0.63 0.00 0.00 -0.26 -1.88 0.62 115.58 113.43 1n9r h ASN 76 Ca 0.24 0.19 0.00 0.00 -0.56 0.00 0.00 56.30 56.17 1n9r h ASN 76 Cb 0.42 0.41 0.00 0.00 -1.06 0.00 0.00 38.32 38.09 1n9r h ASN 76 CO -0.72 -0.22 0.00 0.59 -1.06 0.00 0.00 177.43 176.02 1n9r n ASN 77 N -5.44 0.00 -4.71 5.81 3.02 -1.05 -4.72 115.26 108.17 1n9r n ASN 77 Ca 0.07 -0.77 -0.38 0.00 -0.03 0.00 0.00 54.58 53.47 1n9r n ASN 77 Cb 0.33 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.44 1n9r n ASN 77 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1n9r s VAL 78 N -2.00 5.15 -0.18 2.41 1.01 0.21 -0.66 120.40 126.35 1n9r s VAL 78 Ca 0.28 1.04 -0.14 0.00 0.00 0.00 0.00 61.98 63.15 1n9r s VAL 78 Cb 0.13 -3.86 -0.09 0.00 0.00 0.00 0.00 36.38 32.55 1n9r s VAL 78 CO 0.21 0.28 -0.07 -0.11 0.00 0.00 0.00 175.10 175.42 1n9r n LEU 79 N 3.90 1.84 -3.75 3.92 7.94 0.72 -4.74 117.00 126.83 1n9r n LEU 79 Ca -0.06 0.52 -0.07 0.00 -1.11 0.00 0.00 56.01 55.30 1n9r n LEU 79 Cb 0.51 -0.89 -0.02 0.00 0.53 0.00 0.00 43.42 43.55 1n9r n LEU 79 CO 0.44 -0.13 0.55 -0.72 -1.11 0.00 0.00 177.39 176.41 1n9r s TYR 80 N -2.35 -0.22 -0.02 1.96 -0.85 -1.07 -5.01 117.35 109.79 1n9r s TYR 80 Ca -0.22 -0.14 0.04 0.00 -0.52 0.00 0.00 57.07 56.22 1n9r s TYR 80 Cb 0.04 0.66 -0.00 0.00 0.38 0.00 0.00 41.96 43.04 1n9r s TYR 80 CO 0.38 -1.03 -0.13 0.42 -1.52 0.00 0.00 175.55 173.68 1n9r s ILE 81 N -3.66 1.03 0.28 -3.49 1.01 -1.26 -0.66 121.20 114.45 1n9r s ILE 81 Ca 0.10 -0.53 0.04 0.00 0.00 0.00 0.00 60.65 60.26 1n9r s ILE 81 Cb -0.04 -0.89 -0.06 0.00 0.01 0.00 0.00 42.46 41.49 1n9r s ILE 81 CO 0.02 0.30 0.03 0.00 0.00 0.00 0.00 174.94 175.30 1n9r s ARG 82 N -0.06 1.49 -0.20 2.79 1.70 -0.24 -4.96 118.95 119.47 1n9r s ARG 82 Ca 0.00 -1.79 -0.11 0.00 -0.47 0.00 0.00 55.73 53.36 1n9r s ARG 82 Cb -0.08 -0.70 -0.05 0.00 -0.57 0.00 0.00 34.95 33.55 1n9r s ARG 82 CO 0.00 -0.15 0.19 -2.00 -1.08 0.00 0.00 175.30 172.26 1n9r s GLU 83 N -3.89 4.17 0.09 3.89 2.12 -1.26 -0.36 118.70 123.47 1n9r s GLU 83 Ca 0.33 -0.15 -0.27 0.00 0.36 0.00 0.00 54.97 55.25 1n9r s GLU 83 Cb 0.07 -3.46 -0.06 0.00 0.26 0.00 0.00 34.13 30.94 1n9r s GLU 83 CO 0.12 0.20 0.84 -0.51 -0.54 0.00 0.00 175.26 175.37 1n9r s LEU 84 N 0.62 4.50 -0.32 2.70 1.43 0.13 -4.88 118.68 122.86 1n9r s LEU 84 Ca 0.10 1.61 -0.36 0.00 -1.03 0.00 0.00 54.13 54.45 1n9r s LEU 84 Cb -0.12 -3.37 -0.12 0.00 0.03 0.00 0.00 46.19 42.61 1n9r s LEU 84 CO 0.01 0.03 2.12 -0.81 0.23 0.00 0.00 176.35 177.93 1n9r n PRO 85 N 2.56 1.15 0.00 1.29 -0.04 -1.26 -4.79 135.00 133.91 1n9r n PRO 85 Ca -0.01 0.34 0.00 0.00 -0.04 0.00 0.00 63.50 63.78 1n9r n PRO 85 Cb 0.49 -2.42 0.00 0.00 -0.04 0.00 0.00 33.50 31.53 1n9r n PRO 85 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73