#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n9s n LYS 20 N 0.00 0.04 0.00 1.96 5.02 -1.26 -2.11 118.16 121.80 1n9s n LYS 20 Ca 0.00 0.39 0.08 0.00 -2.02 0.00 0.00 58.31 56.77 1n9s n LYS 20 Cb 0.00 -1.95 0.49 0.00 -0.02 0.00 0.00 35.03 33.55 1n9s n LYS 20 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n9s n GLY 21 N -1.25 -0.60 0.00 0.72 0.00 -1.26 -3.12 105.19 99.68 1n9s n GLY 21 Ca -0.00 -0.10 0.02 0.00 0.00 0.00 0.00 46.02 45.93 1n9s n GLY 21 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n9s n LEU 22 N -1.07 0.12 -4.34 0.99 4.77 -0.90 -5.01 117.00 111.56 1n9s n LEU 22 Ca 0.12 -0.35 -0.39 0.00 -0.03 0.00 0.00 56.01 55.36 1n9s n LEU 22 Cb 0.08 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.18 1n9s n LEU 22 CO 0.10 0.03 -0.33 0.52 -1.33 0.00 0.00 177.39 176.38 1n9s n VAL 23 N -1.26 0.94 -4.19 4.08 0.31 -1.18 -0.43 118.33 116.60 1n9s n VAL 23 Ca 0.00 -0.50 -0.36 0.00 -0.01 0.00 0.00 64.34 63.48 1n9s n VAL 23 Cb 0.07 -0.26 -0.06 0.00 -0.91 0.00 0.00 33.84 32.68 1n9s n VAL 23 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1n9s n ASN 24 N 1.75 -2.03 -4.34 4.52 3.02 -0.83 -4.91 115.26 112.46 1n9s n ASN 24 Ca 0.10 -0.95 -0.27 0.00 -0.03 0.00 0.00 54.58 53.42 1n9s n ASN 24 Cb 0.46 -1.75 -0.13 0.00 -0.61 0.00 0.00 39.78 37.74 1n9s n ASN 24 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1n9s s HIS 25 N -3.08 2.10 -0.27 3.10 3.76 0.43 -4.91 115.29 116.42 1n9s s HIS 25 Ca 0.70 -0.40 -0.29 0.00 -0.15 0.00 0.00 55.06 54.93 1n9s s HIS 25 Cb -0.40 -1.17 -0.01 0.00 1.11 0.00 0.00 32.58 32.10 1n9s s HIS 25 CO 0.86 0.24 1.44 0.50 -0.85 0.00 0.00 174.74 176.92 1n9s s ARG 26 N -1.78 3.86 0.32 1.40 3.52 -1.26 -1.38 118.95 123.62 1n9s s ARG 26 Ca 0.11 1.41 0.04 0.00 -0.13 0.00 0.00 55.73 57.16 1n9s s ARG 26 Cb -0.10 -3.95 -0.06 0.00 -1.56 0.00 0.00 34.95 29.28 1n9s s ARG 26 CO 0.04 -1.20 0.03 0.14 -0.81 0.00 0.00 175.30 173.50 1n9s s VAL 27 N 4.75 1.30 -0.08 7.11 -7.23 0.52 0.41 120.40 127.19 1n9s s VAL 27 Ca 0.63 -2.02 0.03 0.00 -1.81 0.00 0.00 61.98 58.81 1n9s s VAL 27 Cb -0.20 -2.74 0.01 0.00 0.56 0.00 0.00 36.38 34.01 1n9s s VAL 27 CO 0.26 -0.06 -0.18 -0.83 -0.31 0.00 0.00 175.10 173.98 1n9s s GLY 28 N -3.49 1.05 -0.29 2.32 0.00 -0.31 -0.90 107.32 105.71 1n9s s GLY 28 Ca 0.35 -0.69 -0.05 0.00 0.00 0.00 0.00 44.72 44.33 1n9s s GLY 28 CO 0.15 -0.12 0.03 0.14 0.00 0.00 0.00 173.10 173.30 1n9s s VAL 29 N 0.48 3.52 -0.31 1.40 1.01 0.10 -1.68 120.40 124.93 1n9s s VAL 29 Ca -0.16 -0.91 -0.23 0.00 0.00 0.00 0.00 61.98 60.68 1n9s s VAL 29 Cb -0.17 -2.85 -0.00 0.00 0.00 0.00 0.00 36.38 33.36 1n9s s VAL 29 CO 0.06 0.07 0.75 -0.75 0.00 0.00 0.00 175.10 175.23 1n9s s LYS 30 N 1.41 3.95 -0.02 2.72 2.47 -0.25 -0.42 119.74 129.60 1n9s s LYS 30 Ca 0.01 0.52 -0.29 0.00 -1.56 0.00 0.00 55.97 54.64 1n9s s LYS 30 Cb -0.18 -3.73 -0.03 0.00 -1.46 0.00 0.00 37.83 32.44 1n9s s LYS 30 CO 0.00 -0.66 0.96 -0.51 0.16 0.00 0.00 175.35 175.31 1n9s s LEU 31 N 2.88 4.35 0.20 5.43 1.43 -0.07 -0.79 118.68 132.11 1n9s s LEU 31 Ca 0.31 1.61 -0.13 0.00 -1.03 0.00 0.00 54.13 54.88 1n9s s LEU 31 Cb -0.14 -3.53 0.22 0.00 0.03 0.00 0.00 46.19 42.76 1n9s s LEU 31 CO 0.12 -0.28 1.65 0.07 0.23 0.00 0.00 176.35 178.15 1n9s h LYS 32 N 6.84 0.04 -0.33 1.70 2.10 -1.68 -3.27 116.57 121.96 1n9s h LYS 32 Ca -0.40 -0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.11 1n9s h LYS 32 Cb 1.21 -0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1n9s h LYS 32 CO 0.76 0.03 -0.34 0.27 -2.00 0.00 0.00 179.45 178.17 1n9s h PHE 33 N 0.04 0.98 -3.78 0.07 -5.15 -1.91 -3.45 116.94 103.74 1n9s h PHE 33 Ca 0.28 -0.30 -0.25 0.00 -0.20 0.00 0.00 57.97 57.50 1n9s h PHE 33 Cb 0.44 -0.21 -0.28 0.00 0.22 0.00 0.00 35.95 36.12 1n9s h PHE 33 CO -0.42 1.08 -0.73 -0.80 -2.00 0.00 0.00 178.31 175.45 1n9s s ASN 34 N -6.69 0.15 0.00 -0.68 0.01 -1.23 -5.00 114.94 101.49 1n9s s ASN 34 Ca -0.12 -0.03 0.00 0.00 -0.71 0.00 0.00 52.86 52.00 1n9s s ASN 34 Cb 0.10 -0.01 0.00 0.00 0.41 0.00 0.00 41.25 41.74 1n9s s ASN 34 CO 0.86 0.01 0.18 -1.54 -1.51 0.00 0.00 177.10 175.09 1n9s n SER 35 N 3.01 0.00 -4.46 -1.22 3.41 -1.26 -4.64 113.62 108.47 1n9s n SER 35 Ca -0.12 -0.58 -0.33 0.00 -0.26 0.00 0.00 58.87 57.58 1n9s n SER 35 Cb 0.59 -0.05 -0.13 0.00 -0.26 0.00 0.00 64.21 64.37 1n9s n SER 35 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1n9s s THR 36 N 1.24 3.49 -0.05 6.66 2.01 -1.26 -1.12 115.64 126.61 1n9s s THR 36 Ca 0.00 -0.52 -0.02 0.00 0.31 0.00 0.00 61.69 61.46 1n9s s THR 36 Cb 0.00 -2.48 0.04 0.00 0.01 0.00 0.00 72.50 70.06 1n9s s THR 36 CO 0.00 0.53 0.12 -0.70 -0.69 0.00 0.00 174.62 173.87 1n9s s GLU 37 N 0.13 0.05 -0.26 4.92 2.12 -0.50 -0.89 118.70 124.28 1n9s s GLU 37 Ca -0.04 0.33 -0.17 0.00 0.36 0.00 0.00 54.97 55.46 1n9s s GLU 37 Cb -0.14 -0.20 -0.03 0.00 0.26 0.00 0.00 34.13 34.01 1n9s s GLU 37 CO 0.04 -0.17 0.45 0.71 -0.54 0.00 0.00 175.26 175.74 1n9s s TYR 38 N 1.19 3.27 -0.09 5.30 1.51 0.44 -1.22 117.35 127.76 1n9s s TYR 38 Ca -0.09 0.55 -0.02 0.00 -1.01 0.00 0.00 57.07 56.50 1n9s s TYR 38 Cb -0.12 -2.64 -0.03 0.00 -0.11 0.00 0.00 41.96 39.06 1n9s s TYR 38 CO -0.05 -0.23 0.00 1.03 -1.11 0.00 0.00 175.55 175.19 1n9s s ARG 39 N 2.10 3.00 0.00 -0.62 0.52 0.72 0.01 118.95 124.68 1n9s s ARG 39 Ca 0.19 -0.41 0.00 0.00 -0.52 0.00 0.00 55.73 54.99 1n9s s ARG 39 Cb -0.16 -2.80 0.00 0.00 0.52 0.00 0.00 34.95 32.51 1n9s s ARG 39 CO 0.09 0.69 0.00 0.41 0.02 0.00 0.00 175.30 176.51 1n9s n GLY 40 N 2.18 -1.30 3.80 -3.53 0.00 -0.08 0.43 105.19 106.69 1n9s n GLY 40 Ca -0.19 -0.92 -0.37 0.00 0.00 0.00 0.00 46.02 44.55 1n9s n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n9s s THR 41 N -2.79 5.31 -0.90 2.61 2.01 -0.75 0.20 115.64 121.32 1n9s s THR 41 Ca 0.00 0.49 -0.21 0.00 0.31 0.00 0.00 61.69 62.28 1n9s s THR 41 Cb 0.00 -3.57 0.10 0.00 0.01 0.00 0.00 72.50 69.04 1n9s s THR 41 CO 0.00 0.52 1.19 -0.22 -0.69 0.00 0.00 174.62 175.42 1n9s s LEU 42 N -0.42 4.45 0.07 4.42 2.96 -0.48 -0.28 118.68 129.41 1n9s s LEU 42 Ca 0.17 -1.65 -0.33 0.00 -0.22 0.00 0.00 54.13 52.10 1n9s s LEU 42 Cb -0.13 -2.45 -0.19 0.00 0.50 0.00 0.00 46.19 43.91 1n9s s LEU 42 CO 0.06 -1.28 1.62 0.58 -1.32 0.00 0.00 176.35 176.01 1n9s h VAL 43 N 6.12 0.31 -3.34 1.68 2.07 -1.55 -2.20 116.25 119.33 1n9s h VAL 43 Ca 0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1n9s h VAL 43 Cb 1.03 0.31 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 1n9s h VAL 43 CO 1.21 0.00 0.05 -0.94 0.02 0.00 0.00 177.57 177.91 1n9s s SER 44 N -4.36 -0.18 0.00 0.57 1.04 -1.18 -4.48 113.70 105.11 1n9s s SER 44 Ca -0.18 -0.75 0.00 0.00 0.48 0.00 0.00 55.95 55.50 1n9s s SER 44 Cb 0.03 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.80 1n9s s SER 44 CO 0.62 -1.22 0.00 0.41 0.98 0.00 0.00 173.24 174.02 1n9s n THR 45 N -0.41 0.00 -3.63 2.02 -1.04 -1.26 -0.95 114.28 109.00 1n9s n THR 45 Ca -0.03 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 61.94 1n9s n THR 45 Cb 0.61 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 69.07 1n9s n THR 45 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 1n9s s ASP 46 N 0.25 -0.11 0.06 8.00 -4.77 -1.23 -5.02 116.67 113.85 1n9s s ASP 46 Ca 0.00 0.12 0.01 0.00 -3.30 0.00 0.00 52.55 49.39 1n9s s ASP 46 Cb 0.00 0.09 0.18 0.00 -1.09 0.00 0.00 42.92 42.10 1n9s s ASP 46 CO 0.00 -0.10 0.30 0.59 0.70 0.00 0.00 175.17 176.66 1n9s n ASN 47 N 0.60 0.00 0.08 2.11 3.02 -1.26 0.20 115.26 120.02 1n9s n ASN 47 Ca -0.03 0.32 0.04 0.00 -0.03 0.00 0.00 54.58 54.89 1n9s n ASN 47 Cb 0.59 -0.13 0.23 0.00 -0.61 0.00 0.00 39.78 39.86 1n9s n ASN 47 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1n9s n TYR 48 N -3.84 0.28 -1.18 3.10 4.02 -1.26 -4.78 117.16 113.50 1n9s n TYR 48 Ca 0.05 0.15 -0.06 0.00 -0.01 0.00 0.00 57.90 58.03 1n9s n TYR 48 Cb 0.18 -0.62 -0.03 0.00 -0.02 0.00 0.00 39.34 38.85 1n9s n TYR 48 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1n9s n PHE 49 N -1.76 0.00 -3.17 -0.72 3.01 0.13 -4.62 117.46 110.33 1n9s n PHE 49 Ca -0.01 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.06 1n9s n PHE 49 Cb 0.16 -1.40 -0.06 0.00 -0.01 0.00 0.00 39.48 38.17 1n9s n PHE 49 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 1n9s s ASN 50 N -2.90 7.06 0.04 4.37 0.01 -1.25 -2.60 114.94 119.67 1n9s s ASN 50 Ca 0.00 1.26 -0.06 0.00 -0.71 0.00 0.00 52.86 53.36 1n9s s ASN 50 Cb 0.00 -2.39 -0.01 0.00 0.41 0.00 0.00 41.25 39.26 1n9s s ASN 50 CO 0.00 0.14 0.10 -1.48 -1.51 0.00 0.00 177.10 174.34 1n9s s LEU 51 N -0.45 1.80 -0.21 0.60 0.05 -0.55 -3.58 118.68 116.35 1n9s s LEU 51 Ca 0.32 -0.51 -0.06 0.00 0.05 0.00 0.00 54.13 53.92 1n9s s LEU 51 Cb -0.19 0.60 -0.03 0.00 -2.05 0.00 0.00 46.19 44.52 1n9s s LEU 51 CO 0.19 -0.50 0.04 -1.58 -0.55 0.00 0.00 176.35 173.95 1n9s s GLN 52 N -2.52 3.74 0.00 1.48 0.74 -0.13 -0.29 119.66 122.68 1n9s s GLN 52 Ca -0.06 -0.46 0.07 0.00 0.05 0.00 0.00 55.36 54.97 1n9s s GLN 52 Cb -0.02 -3.18 -0.03 0.00 1.10 0.00 0.00 33.01 30.89 1n9s s GLN 52 CO -0.04 0.05 -0.23 -1.17 -0.55 0.00 0.00 175.29 173.35 1n9s s LEU 53 N 0.95 2.31 -0.05 3.68 2.96 0.17 -1.36 118.68 127.34 1n9s s LEU 53 Ca 0.03 -0.45 0.01 0.00 -0.22 0.00 0.00 54.13 53.50 1n9s s LEU 53 Cb -0.14 -1.40 -0.03 0.00 0.50 0.00 0.00 46.19 45.12 1n9s s LEU 53 CO 0.02 0.30 -0.03 0.21 -1.32 0.00 0.00 176.35 175.53 1n9s s ASN 54 N -0.95 4.95 -1.05 3.68 3.84 0.62 -0.35 114.94 125.67 1n9s s ASN 54 Ca 0.12 0.02 -0.16 0.00 0.21 0.00 0.00 52.86 53.05 1n9s s ASN 54 Cb -0.10 -1.29 -0.01 0.00 -0.55 0.00 0.00 41.25 39.29 1n9s s ASN 54 CO 0.01 0.33 0.77 -0.62 -2.79 0.00 0.00 177.10 174.81 1n9s n GLU 55 N 1.88 -1.30 -2.43 0.43 1.02 -1.22 -1.81 120.64 117.21 1n9s n GLU 55 Ca -0.17 0.63 -0.41 0.00 -0.02 0.00 0.00 57.16 57.20 1n9s n GLU 55 Cb 0.53 -4.17 -0.04 0.00 -0.02 0.00 0.00 31.44 27.74 1n9s n GLU 55 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1n9s s ALA 56 N -3.35 3.42 -0.12 0.62 0.00 -0.60 -4.35 121.76 117.38 1n9s s ALA 56 Ca 0.37 0.92 0.00 0.00 0.00 0.00 0.00 51.96 53.25 1n9s s ALA 56 Cb -0.13 -3.37 0.02 0.00 0.00 0.00 0.00 23.12 19.65 1n9s s ALA 56 CO 0.85 -0.27 -0.11 -2.00 0.00 0.00 0.00 175.76 174.23 1n9s s GLU 57 N -0.89 1.83 -0.05 0.00 2.12 0.17 -1.27 118.70 120.61 1n9s s GLU 57 Ca 0.48 -0.39 -0.22 0.00 0.36 0.00 0.00 54.97 55.21 1n9s s GLU 57 Cb -0.32 -1.74 -0.04 0.00 0.26 0.00 0.00 34.13 32.28 1n9s s GLU 57 CO 0.39 -0.21 0.64 -2.00 -0.54 0.00 0.00 175.26 173.55 1n9s s GLU 58 N 1.47 4.39 -0.19 4.30 2.12 -1.00 -0.20 118.70 129.60 1n9s s GLU 58 Ca 0.02 0.79 0.00 0.00 0.36 0.00 0.00 54.97 56.14 1n9s s GLU 58 Cb -0.13 -3.41 0.04 0.00 0.26 0.00 0.00 34.13 30.89 1n9s s GLU 58 CO -0.07 0.18 -0.09 -0.06 -0.54 0.00 0.00 175.26 174.69 1n9s s PHE 59 N 0.41 2.16 -0.37 5.30 0.40 -0.36 -0.18 117.98 125.35 1n9s s PHE 59 Ca 0.34 -1.41 -0.08 0.00 -0.60 0.00 0.00 56.93 55.18 1n9s s PHE 59 Cb -0.18 -1.53 0.05 0.00 0.51 0.00 0.00 43.02 41.88 1n9s s PHE 59 CO 0.17 -0.70 0.17 0.08 0.70 0.00 0.00 175.22 175.64 1n9s s VAL 60 N 1.48 4.04 -1.52 -0.44 1.01 0.50 -1.40 120.40 124.07 1n9s s VAL 60 Ca -0.00 -1.18 -0.05 0.00 0.00 0.00 0.00 61.98 60.75 1n9s s VAL 60 Cb -0.16 -3.34 0.02 0.00 0.00 0.00 0.00 36.38 32.89 1n9s s VAL 60 CO -0.08 -0.29 0.49 0.00 0.00 0.00 0.00 175.10 175.22 1n9s n ALA 61 N 4.87 -0.94 -2.62 5.51 0.00 -0.27 -1.65 120.51 125.41 1n9s n ALA 61 Ca -0.11 0.24 -0.12 0.00 0.00 0.00 0.00 53.44 53.44 1n9s n ALA 61 Cb 0.44 -3.42 0.02 0.00 0.00 0.00 0.00 19.45 16.49 1n9s n ALA 61 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n9s n GLY 62 N -1.38 0.01 3.03 0.00 0.00 -1.26 -5.01 105.19 100.58 1n9s n GLY 62 Ca -0.12 -0.30 -0.18 0.00 0.00 0.00 0.00 46.02 45.43 1n9s n GLY 62 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n9s s VAL 63 N -2.85 0.68 0.09 1.61 1.01 -0.66 -5.11 120.40 115.18 1n9s s VAL 63 Ca 0.15 -0.50 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 1n9s s VAL 63 Cb -0.06 -0.60 -0.06 0.00 0.00 0.00 0.00 36.38 35.66 1n9s s VAL 63 CO 0.18 0.10 0.93 -0.55 0.00 0.00 0.00 175.10 175.76 1n9s s SER 64 N -0.45 7.44 -0.46 3.32 0.15 -1.26 -0.37 113.70 122.07 1n9s s SER 64 Ca 0.02 1.73 0.03 0.00 0.70 0.00 0.00 55.95 58.42 1n9s s SER 64 Cb -0.04 -2.57 0.46 0.00 -1.71 0.00 0.00 66.02 62.16 1n9s s SER 64 CO -0.00 -0.07 1.60 1.41 1.20 0.00 0.00 173.24 177.38 1n9s n HIS 65 N 2.86 2.86 0.00 3.44 8.25 0.75 -4.94 115.22 128.44 1n9s n HIS 65 Ca 0.02 -2.54 0.00 0.00 -0.26 0.00 0.00 57.72 54.94 1n9s n HIS 65 Cb 0.49 -0.86 0.00 0.00 1.12 0.00 0.00 29.99 30.74 1n9s n HIS 65 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1n9s n GLY 66 N -0.84 0.50 3.43 -1.41 0.00 -1.26 -4.80 105.19 100.81 1n9s n GLY 66 Ca 0.52 -1.85 -0.35 0.00 0.00 0.00 0.00 46.02 44.34 1n9s n GLY 66 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n9s s THR 67 N -2.14 3.85 0.14 2.61 2.01 -1.26 -2.38 115.64 118.47 1n9s s THR 67 Ca 0.00 -0.35 0.02 0.00 0.31 0.00 0.00 61.69 61.67 1n9s s THR 67 Cb 0.00 -2.73 -0.04 0.00 0.01 0.00 0.00 72.50 69.74 1n9s s THR 67 CO 0.00 0.44 0.26 -0.76 -0.69 0.00 0.00 174.62 173.86 1n9s s LEU 68 N 0.98 4.28 0.00 4.42 1.43 -0.39 -5.01 118.68 124.38 1n9s s LEU 68 Ca 0.01 0.15 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 1n9s s LEU 68 Cb -0.14 -2.86 0.00 0.00 0.03 0.00 0.00 46.19 43.22 1n9s s LEU 68 CO 0.01 0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.27 1n9s n GLY 69 N -0.41 -1.16 3.72 -3.19 0.00 -1.26 -2.46 105.19 100.43 1n9s n GLY 69 Ca -0.07 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.28 1n9s n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1n9s s GLU 70 N 0.00 4.62 0.12 1.61 0.41 -1.26 -1.56 118.70 122.64 1n9s s GLU 70 Ca 0.00 1.39 0.07 0.00 -0.41 0.00 0.00 54.97 56.02 1n9s s GLU 70 Cb 0.00 -3.41 -0.04 0.00 -1.78 0.00 0.00 34.13 28.90 1n9s s GLU 70 CO 0.00 0.11 -0.16 0.96 -0.49 0.00 0.00 175.26 175.68 1n9s s ILE 71 N 0.42 1.49 -0.32 -1.63 -4.36 0.52 -4.95 121.20 112.38 1n9s s ILE 71 Ca 0.48 -1.69 0.02 0.00 -0.26 0.00 0.00 60.65 59.20 1n9s s ILE 71 Cb -0.22 -1.56 0.08 0.00 1.25 0.00 0.00 42.46 42.01 1n9s s ILE 71 CO 0.28 -0.31 0.01 -0.36 0.24 0.00 0.00 174.94 174.81 1n9s s PHE 72 N -1.86 3.54 0.14 1.37 0.40 -1.26 0.44 117.98 120.76 1n9s s PHE 72 Ca 0.09 -2.61 -0.05 0.00 -0.60 0.00 0.00 56.93 53.76 1n9s s PHE 72 Cb -0.07 -2.57 -0.06 0.00 0.51 0.00 0.00 43.02 40.84 1n9s s PHE 72 CO 0.04 -0.92 0.38 0.42 0.70 0.00 0.00 175.22 175.84 1n9s s ILE 73 N 1.03 5.17 -0.37 0.64 1.01 0.60 -4.92 121.20 124.35 1n9s s ILE 73 Ca 0.03 0.02 -0.12 0.00 0.00 0.00 0.00 60.65 60.58 1n9s s ILE 73 Cb -0.20 -3.63 0.01 0.00 0.01 0.00 0.00 42.46 38.66 1n9s s ILE 73 CO -0.06 0.03 0.23 -0.13 0.00 0.00 0.00 174.94 175.01 1n9s s ARG 74 N -2.68 3.03 0.00 2.79 1.81 -1.26 -1.48 118.95 121.17 1n9s s ARG 74 Ca 0.41 -0.95 -0.00 0.00 -1.72 0.00 0.00 55.73 53.47 1n9s s ARG 74 Cb -0.12 -3.79 -0.00 0.00 -0.45 0.00 0.00 34.95 30.59 1n9s s ARG 74 CO 0.25 -0.64 0.04 -1.13 -0.68 0.00 0.00 175.30 173.14 1n9s n SER 75 N 5.06 -0.00 -0.39 0.23 3.41 -1.07 -0.29 113.62 120.57 1n9s n SER 75 Ca -0.12 0.04 0.31 0.00 -0.26 0.00 0.00 58.87 58.85 1n9s n SER 75 Cb 0.47 -0.02 0.51 0.00 -0.26 0.00 0.00 64.21 64.91 1n9s n SER 75 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1n9s n ASN 76 N -2.14 0.10 -0.12 4.04 5.03 -1.26 0.35 115.26 121.25 1n9s n ASN 76 Ca 0.00 0.87 0.14 0.00 0.87 0.00 0.00 54.58 56.47 1n9s n ASN 76 Cb 0.00 -0.43 0.66 0.00 -1.02 0.00 0.00 39.78 38.99 1n9s n ASN 76 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1n9s n ASN 77 N -3.82 0.44 -4.80 6.41 3.02 0.60 -4.87 115.26 112.24 1n9s n ASN 77 Ca 0.29 -0.64 -0.38 0.00 -0.03 0.00 0.00 54.58 53.82 1n9s n ASN 77 Cb 1.21 -0.08 -0.06 0.00 -0.61 0.00 0.00 39.78 40.24 1n9s n ASN 77 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1n9s s VAL 78 N -2.40 4.96 -0.19 2.41 1.01 1.07 -2.03 120.40 125.23 1n9s s VAL 78 Ca 0.32 1.01 -0.17 0.00 0.00 0.00 0.00 61.98 63.13 1n9s s VAL 78 Cb 0.20 -3.80 -0.07 0.00 0.00 0.00 0.00 36.38 32.71 1n9s s VAL 78 CO 0.45 0.52 -0.34 -0.11 0.00 0.00 0.00 175.10 175.62 1n9s n LEU 79 N 2.18 1.94 -3.73 3.92 7.94 0.03 -4.69 117.00 124.59 1n9s n LEU 79 Ca -0.11 0.34 -0.10 0.00 -1.11 0.00 0.00 56.01 55.04 1n9s n LEU 79 Cb 0.52 -0.76 -0.04 0.00 0.53 0.00 0.00 43.42 43.67 1n9s n LEU 79 CO 0.40 -0.19 0.20 -0.72 -1.11 0.00 0.00 177.39 175.97 1n9s s TYR 80 N -2.84 -0.08 -0.07 1.96 -0.85 -1.20 -5.01 117.35 109.27 1n9s s TYR 80 Ca -0.29 -0.26 0.03 0.00 -0.52 0.00 0.00 57.07 56.02 1n9s s TYR 80 Cb 0.05 0.29 0.01 0.00 0.38 0.00 0.00 41.96 42.70 1n9s s TYR 80 CO 0.43 -0.83 -0.15 0.42 -1.52 0.00 0.00 175.55 173.90 1n9s s ILE 81 N -3.86 1.33 0.18 -3.49 1.01 -1.26 -1.09 121.20 114.01 1n9s s ILE 81 Ca 0.08 -0.59 0.08 0.00 0.00 0.00 0.00 60.65 60.22 1n9s s ILE 81 Cb 0.00 -1.19 -0.04 0.00 0.01 0.00 0.00 42.46 41.24 1n9s s ILE 81 CO -0.05 0.40 -0.16 0.00 0.00 0.00 0.00 174.94 175.13 1n9s s ARG 82 N 0.58 1.26 -0.09 2.79 1.70 -0.68 -4.95 118.95 119.56 1n9s s ARG 82 Ca -0.15 -1.48 -0.25 0.00 -0.47 0.00 0.00 55.73 53.38 1n9s s ARG 82 Cb -0.16 -1.15 -0.03 0.00 -0.57 0.00 0.00 34.95 33.04 1n9s s ARG 82 CO 0.05 0.21 0.77 -2.00 -1.08 0.00 0.00 175.30 173.25 1n9s s GLU 83 N -3.23 4.40 -0.22 3.89 2.12 -1.26 -1.16 118.70 123.24 1n9s s GLU 83 Ca 0.18 0.97 -0.21 0.00 0.36 0.00 0.00 54.97 56.27 1n9s s GLU 83 Cb -0.03 -3.49 -0.02 0.00 0.26 0.00 0.00 34.13 30.85 1n9s s GLU 83 CO 0.06 -0.08 0.67 -0.51 -0.54 0.00 0.00 175.26 174.86 1n9s s LEU 84 N 1.27 4.11 0.00 2.70 1.43 0.17 -4.90 118.68 123.46 1n9s s LEU 84 Ca 0.39 0.85 0.00 0.00 -1.03 0.00 0.00 54.13 54.34 1n9s s LEU 84 Cb -0.18 -2.94 0.00 0.00 0.03 0.00 0.00 46.19 43.10 1n9s s LEU 84 CO 0.17 -0.34 0.00 -2.65 0.23 0.00 0.00 176.35 173.76 1n9s n PRO 85 N 5.37 0.00 0.00 1.29 -0.02 -1.26 -4.57 135.00 135.80 1n9s n PRO 85 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1n9s n PRO 85 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.97 1n9s n PRO 85 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57