#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 0.02 0.00 1.96 5.02 -1.26 -0.89 118.16 123.00 1n9s n LYS 20 Ca 0.00 0.52 0.06 0.00 -2.02 0.00 0.00 58.31 56.87 1n9s n LYS 20 Cb 0.00 -1.86 0.30 0.00 -0.02 0.00 0.00 35.03 33.45 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 -1.13 -0.80 0.00 0.72 0.00 -1.26 -2.40 105.19 100.32 1n9s n GLY 21 Ca 0.00 -0.05 0.07 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.37 0.57 -4.46 0.99 4.77 -0.07 -4.96 117.00 112.47 1n9s n LEU 22 Ca 0.05 -0.42 -0.40 0.00 -0.03 0.00 0.00 56.01 55.21 1n9s n LEU 22 Cb 0.12 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.23 1n9s n LEU 22 CO 0.11 0.14 0.07 0.52 -1.33 0.00 0.00 177.39 176.90 1n9s n VAL 23 N -1.45 1.93 -1.42 4.08 0.31 -1.01 0.81 118.33 121.58 1n9s n VAL 23 Ca 0.02 -0.50 -0.14 0.00 -0.01 0.00 0.00 64.34 63.71 1n9s n VAL 23 Cb 0.25 -0.62 -0.06 0.00 -0.91 0.00 0.00 33.84 32.51 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 0.97 -3.57 -4.86 4.52 3.02 -0.21 -4.96 115.26 110.16 1n9s n ASN 24 Ca 0.11 0.33 -0.23 0.00 -0.03 0.00 0.00 54.58 54.76 1n9s n ASN 24 Cb 0.43 -3.32 -0.04 0.00 -0.61 0.00 0.00 39.78 36.24 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 -2.16 3.24 -0.48 3.10 3.76 0.24 -4.86 115.29 118.13 1n9s s HIS 25 Ca 0.00 -0.04 -0.23 0.00 -0.15 0.00 0.00 55.06 54.65 1n9s s HIS 25 Cb 0.00 -1.50 0.03 0.00 1.11 0.00 0.00 32.58 32.22 1n9s s HIS 25 CO 0.00 0.50 0.79 0.50 -0.85 0.00 0.00 174.74 175.68 1n9s s ARG 26 N -3.59 3.35 0.36 1.40 3.52 -1.26 -1.02 118.95 121.71 1n9s s ARG 26 Ca 0.33 -0.25 0.07 0.00 -0.13 0.00 0.00 55.73 55.75 1n9s s ARG 26 Cb -0.09 -3.98 -0.07 0.00 -1.56 0.00 0.00 34.95 29.25 1n9s s ARG 26 CO 0.26 -1.20 -0.02 0.14 -0.81 0.00 0.00 175.30 173.67 1n9s s VAL 27 N 3.31 1.88 -0.07 7.11 -7.23 -0.09 -0.18 120.40 125.14 1n9s s VAL 27 Ca 0.28 -2.07 0.02 0.00 -1.81 0.00 0.00 61.98 58.39 1n9s s VAL 27 Cb -0.13 -2.79 0.01 0.00 0.56 0.00 0.00 36.38 34.03 1n9s s VAL 27 CO 0.20 -0.10 -0.12 -0.83 -0.31 0.00 0.00 175.10 173.95 1n9s s GLY 28 N -3.61 0.80 -0.22 2.32 0.00 0.28 -0.95 107.32 105.94 1n9s s GLY 28 Ca 0.34 -0.43 -0.10 0.00 0.00 0.00 0.00 44.72 44.53 1n9s s GLY 28 CO 0.16 0.21 0.14 0.14 0.00 0.00 0.00 173.10 173.75 1n9s s VAL 29 N 0.80 5.31 -0.22 1.40 1.01 0.68 -2.34 120.40 127.03 1n9s s VAL 29 Ca -0.12 0.16 -0.08 0.00 0.00 0.00 0.00 61.98 61.93 1n9s s VAL 29 Cb -0.15 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 1n9s s VAL 29 CO 0.02 0.39 0.10 -0.75 0.00 0.00 0.00 175.10 174.86 1n9s s LYS 30 N 0.73 3.91 0.55 2.72 2.47 0.17 -0.44 119.74 129.84 1n9s s LYS 30 Ca 0.07 -0.36 -0.11 0.00 -1.56 0.00 0.00 55.97 54.01 1n9s s LYS 30 Cb -0.12 -3.36 -0.05 0.00 -1.46 0.00 0.00 37.83 32.84 1n9s s LYS 30 CO 0.01 0.05 0.96 -0.51 0.16 0.00 0.00 175.35 176.02 1n9s s LEU 31 N 1.00 3.44 0.11 5.43 1.43 -1.19 0.25 118.68 129.15 1n9s s LEU 31 Ca 0.05 1.35 -0.13 0.00 -1.03 0.00 0.00 54.13 54.37 1n9s s LEU 31 Cb -0.14 -4.34 -0.11 0.00 0.03 0.00 0.00 46.19 41.63 1n9s s LEU 31 CO 0.03 -0.71 1.37 0.11 0.23 0.00 0.00 176.35 177.38 1n9s h LYS 32 N 0.20 0.80 0.05 1.70 1.57 -1.75 -3.41 116.57 115.73 1n9s h LYS 32 Ca -0.45 -0.53 -0.32 0.00 -1.87 0.00 0.00 60.65 57.48 1n9s h LYS 32 Cb 1.19 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 33.54 1n9s h LYS 32 CO 0.62 1.16 -1.78 0.27 -0.57 0.00 0.00 179.45 179.15 1n9s h PHE 33 N 0.55 0.20 -0.11 -1.35 -5.15 -1.94 -3.42 116.94 105.73 1n9s h PHE 33 Ca 0.00 -0.14 0.00 0.00 -0.20 0.00 0.00 57.97 57.63 1n9s h PHE 33 Cb 1.15 -0.01 0.00 0.00 0.22 0.00 0.00 35.95 37.31 1n9s h PHE 33 CO 0.08 1.29 0.00 0.09 -2.00 0.00 0.00 178.31 177.77 1n9s n ASN 34 N -3.23 2.08 -1.12 -0.68 3.02 -1.26 -4.95 115.26 109.11 1n9s n ASN 34 Ca -0.21 -1.61 -0.15 0.00 -0.03 0.00 0.00 54.58 52.58 1n9s n ASN 34 Cb 1.05 -0.07 -0.06 0.00 -0.61 0.00 0.00 39.78 40.09 1n9s n ASN 34 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1n9s n SER 35 N 0.35 -4.75 -4.32 6.41 2.88 -1.26 -4.81 113.62 108.11 1n9s n SER 35 Ca 0.06 0.36 -0.32 0.00 -1.33 0.00 0.00 58.87 57.63 1n9s n SER 35 Cb 0.27 -3.54 -0.15 0.00 -0.75 0.00 0.00 64.21 60.04 1n9s n SER 35 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1n9s s THR 36 N -2.54 2.57 0.06 2.46 2.01 -1.26 -3.13 115.64 115.81 1n9s s THR 36 Ca 0.00 -0.85 0.05 0.00 0.31 0.00 0.00 61.69 61.19 1n9s s THR 36 Cb 0.00 -2.02 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 1n9s s THR 36 CO 0.00 0.55 -0.05 -0.70 -0.69 0.00 0.00 174.62 173.73 1n9s s GLU 37 N 0.07 2.43 -0.27 4.92 2.12 -0.59 -3.19 118.70 124.19 1n9s s GLU 37 Ca -0.08 -0.85 -0.06 0.00 0.36 0.00 0.00 54.97 54.34 1n9s s GLU 37 Cb -0.15 -2.46 -0.00 0.00 0.26 0.00 0.00 34.13 31.77 1n9s s GLU 37 CO 0.05 0.55 0.04 0.71 -0.54 0.00 0.00 175.26 176.07 1n9s s TYR 38 N -1.18 3.09 -0.10 5.30 1.51 0.42 -0.79 117.35 125.60 1n9s s TYR 38 Ca 0.22 -0.92 -0.03 0.00 -1.01 0.00 0.00 57.07 55.33 1n9s s TYR 38 Cb -0.11 -2.20 -0.03 0.00 -0.11 0.00 0.00 41.96 39.50 1n9s s TYR 38 CO 0.13 -0.54 0.01 1.03 -1.11 0.00 0.00 175.55 175.07 1n9s s ARG 39 N 1.50 3.10 0.00 -0.62 0.52 0.24 0.25 118.95 123.93 1n9s s ARG 39 Ca 0.04 -0.39 0.00 0.00 -0.52 0.00 0.00 55.73 54.86 1n9s s ARG 39 Cb -0.16 -2.85 0.00 0.00 0.52 0.00 0.00 34.95 32.46 1n9s s ARG 39 CO 0.01 0.67 0.00 0.41 0.02 0.00 0.00 175.30 176.40 1n9s n GLY 40 N 2.26 -1.88 3.72 -3.53 0.00 -0.13 0.37 105.19 106.01 1n9s n GLY 40 Ca -0.19 -1.15 -0.41 0.00 0.00 0.00 0.00 46.02 44.28 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 -2.37 4.88 -0.92 2.61 2.01 0.93 -0.91 115.64 121.86 1n9s s THR 41 Ca 0.00 1.73 -0.21 0.00 0.31 0.00 0.00 61.69 63.52 1n9s s THR 41 Cb 0.00 -4.17 0.10 0.00 0.01 0.00 0.00 72.50 68.44 1n9s s THR 41 CO 0.00 0.25 1.22 -0.22 -0.69 0.00 0.00 174.62 175.18 1n9s s LEU 42 N 0.61 4.43 0.02 4.42 2.96 -0.19 0.15 118.68 131.09 1n9s s LEU 42 Ca 0.43 -1.70 -0.17 0.00 -0.22 0.00 0.00 54.13 52.47 1n9s s LEU 42 Cb -0.20 -2.46 -0.09 0.00 0.50 0.00 0.00 46.19 43.94 1n9s s LEU 42 CO 0.23 -1.27 1.15 0.58 -1.32 0.00 0.00 176.35 175.72 1n9s h VAL 43 N 6.16 0.00 -4.61 1.68 2.07 -1.73 -0.54 116.25 119.28 1n9s h VAL 43 Ca 0.11 -0.05 -0.30 0.00 0.82 0.00 0.00 66.70 67.28 1n9s h VAL 43 Cb 1.03 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.66 1n9s h VAL 43 CO 1.22 0.00 -0.53 -0.94 0.02 0.00 0.00 177.57 177.34 1n9s s SER 44 N -3.12 0.64 -0.26 0.57 1.04 -1.17 -4.44 113.70 106.96 1n9s s SER 44 Ca -0.09 -1.48 -0.26 0.00 0.48 0.00 0.00 55.95 54.60 1n9s s SER 44 Cb 0.01 0.46 0.14 0.00 0.10 0.00 0.00 66.02 66.72 1n9s s SER 44 CO 0.27 -0.95 1.10 -0.89 0.98 0.00 0.00 173.24 173.75 1n9s s THR 45 N -3.88 0.00 0.43 2.02 2.01 -1.26 -1.88 115.64 113.07 1n9s s THR 45 Ca 0.38 0.00 0.06 0.00 0.31 0.00 0.00 61.69 62.44 1n9s s THR 45 Cb 0.05 -1.00 -0.06 0.00 0.01 0.00 0.00 72.50 71.49 1n9s s THR 45 CO 0.17 0.00 0.01 1.51 -0.69 0.00 0.00 174.62 175.62 1n9s s ASP 46 N -0.11 3.85 -0.22 3.53 -4.77 -1.18 -4.96 116.67 112.82 1n9s s ASP 46 Ca 0.03 -1.43 -0.03 0.00 -3.30 0.00 0.00 52.55 47.82 1n9s s ASP 46 Cb -0.04 -0.19 -0.07 0.00 -1.09 0.00 0.00 42.92 41.54 1n9s s ASP 46 CO -0.06 -0.54 1.60 0.59 0.70 0.00 0.00 175.17 177.45 1n9s n ASN 47 N -1.02 2.24 0.00 2.11 3.02 -1.26 -1.51 115.26 118.84 1n9s n ASN 47 Ca -0.08 -1.98 0.00 0.00 -0.03 0.00 0.00 54.58 52.50 1n9s n ASN 47 Cb 0.67 -0.63 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 1n9s n ASN 47 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n9s n TYR 48 N 3.51 0.00 -1.02 3.10 9.36 -1.26 -4.98 117.16 125.88 1n9s n TYR 48 Ca 0.19 0.00 -0.01 0.00 3.32 0.00 0.00 57.90 61.41 1n9s n TYR 48 Cb 0.22 0.03 -0.00 0.00 -0.63 0.00 0.00 39.34 38.96 1n9s n TYR 48 CO 0.00 0.00 0.00 1.19 0.22 0.00 0.00 176.86 178.27 1n9s n PHE 49 N 0.00 0.00 -2.95 2.98 3.01 -0.57 -4.57 117.46 115.36 1n9s n PHE 49 Ca 0.00 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.07 1n9s n PHE 49 Cb 0.30 -0.79 -0.06 0.00 -0.01 0.00 0.00 39.48 38.92 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 -2.09 7.36 0.01 4.37 0.01 -1.25 -3.76 114.94 119.59 1n9s s ASN 50 Ca 0.00 1.66 -0.01 0.00 -0.71 0.00 0.00 52.86 53.80 1n9s s ASN 50 Cb 0.00 -2.51 -0.01 0.00 0.41 0.00 0.00 41.25 39.14 1n9s s ASN 50 CO 0.00 0.15 0.00 -1.48 -1.51 0.00 0.00 177.10 174.26 1n9s s LEU 51 N -1.38 2.09 -0.15 0.60 0.05 -0.83 -3.10 118.68 115.96 1n9s s LEU 51 Ca 0.39 -0.39 -0.10 0.00 0.05 0.00 0.00 54.13 54.08 1n9s s LEU 51 Cb -0.22 0.20 -0.05 0.00 -2.05 0.00 0.00 46.19 44.07 1n9s s LEU 51 CO 0.26 -0.28 0.18 -1.58 -0.55 0.00 0.00 176.35 174.37 1n9s s GLN 52 N -1.29 3.87 -0.07 1.48 0.74 -0.79 0.13 119.66 123.72 1n9s s GLN 52 Ca -0.14 -0.09 0.03 0.00 0.05 0.00 0.00 55.36 55.21 1n9s s GLN 52 Cb -0.09 -3.31 0.01 0.00 1.10 0.00 0.00 33.01 30.72 1n9s s GLN 52 CO -0.00 0.52 -0.16 -1.17 -0.55 0.00 0.00 175.29 173.92 1n9s s LEU 53 N -0.30 1.80 0.11 3.68 2.96 0.39 -2.00 118.68 125.33 1n9s s LEU 53 Ca 0.13 -0.38 0.04 0.00 -0.22 0.00 0.00 54.13 53.70 1n9s s LEU 53 Cb -0.12 -1.02 -0.04 0.00 0.50 0.00 0.00 46.19 45.51 1n9s s LEU 53 CO 0.02 0.08 0.08 0.21 -1.32 0.00 0.00 176.35 175.43 1n9s s ASN 54 N 0.52 5.42 -1.34 3.68 3.84 0.40 -1.41 114.94 126.05 1n9s s ASN 54 Ca -0.15 -0.08 -0.01 0.00 0.21 0.00 0.00 52.86 52.83 1n9s s ASN 54 Cb -0.16 -1.41 0.00 0.00 -0.55 0.00 0.00 41.25 39.13 1n9s s ASN 54 CO 0.05 0.14 0.64 -0.62 -2.79 0.00 0.00 177.10 174.53 1n9s n GLU 55 N 0.22 -4.54 -2.25 0.43 1.02 -1.14 -0.05 120.64 114.33 1n9s n GLU 55 Ca -0.09 0.57 -0.41 0.00 -0.02 0.00 0.00 57.16 57.21 1n9s n GLU 55 Cb 0.53 -5.04 -0.03 0.00 -0.02 0.00 0.00 31.44 26.88 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 -3.72 3.49 0.00 0.62 0.00 -1.07 -4.34 121.76 116.74 1n9s s ALA 56 Ca 0.03 1.10 0.04 0.00 0.00 0.00 0.00 51.96 53.12 1n9s s ALA 56 Cb -0.02 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.65 1n9s s ALA 56 CO 0.83 -0.48 -0.12 -2.00 0.00 0.00 0.00 175.76 173.99 1n9s s GLU 57 N -0.79 0.91 -0.17 0.00 2.12 0.16 -1.08 118.70 119.84 1n9s s GLU 57 Ca 0.52 -0.48 -0.06 0.00 0.36 0.00 0.00 54.97 55.31 1n9s s GLU 57 Cb -0.36 -0.88 -0.04 0.00 0.26 0.00 0.00 34.13 33.11 1n9s s GLU 57 CO 0.42 0.24 0.03 -2.00 -0.54 0.00 0.00 175.26 173.41 1n9s s GLU 58 N -0.45 3.86 -0.13 4.30 2.12 -0.94 -0.59 118.70 126.85 1n9s s GLU 58 Ca 0.03 -0.40 0.02 0.00 0.36 0.00 0.00 54.97 54.98 1n9s s GLU 58 Cb -0.05 -3.11 0.02 0.00 0.26 0.00 0.00 34.13 31.24 1n9s s GLU 58 CO -0.00 0.28 -0.17 -0.06 -0.54 0.00 0.00 175.26 174.77 1n9s s PHE 59 N 0.32 2.30 -0.26 5.30 0.40 0.03 -1.33 117.98 124.74 1n9s s PHE 59 Ca 0.01 -1.18 -0.02 0.00 -0.60 0.00 0.00 56.93 55.14 1n9s s PHE 59 Cb -0.13 -1.62 0.03 0.00 0.51 0.00 0.00 43.02 41.81 1n9s s PHE 59 CO 0.01 -0.59 -0.05 0.08 0.70 0.00 0.00 175.22 175.37 1n9s s VAL 60 N 1.07 2.90 -1.36 -0.44 1.01 0.22 -1.54 120.40 122.26 1n9s s VAL 60 Ca -0.03 -1.09 -0.00 0.00 0.00 0.00 0.00 61.98 60.85 1n9s s VAL 60 Cb -0.14 -2.51 0.00 0.00 0.00 0.00 0.00 36.38 33.72 1n9s s VAL 60 CO -0.05 0.14 0.03 0.00 0.00 0.00 0.00 175.10 175.22 1n9s n ALA 61 N 4.66 -0.73 -0.30 5.51 0.00 -1.18 -0.91 120.51 127.55 1n9s n ALA 61 Ca -0.16 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1n9s n ALA 61 Cb 0.46 -1.87 0.00 0.00 0.00 0.00 0.00 19.45 18.04 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 -0.92 0.76 3.53 0.00 0.00 -1.26 -5.07 105.19 102.23 1n9s n GLY 62 Ca -0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.26 3.20 -0.12 1.61 1.01 -0.09 -5.05 120.40 118.70 1n9s s VAL 63 Ca 0.00 -1.08 -0.27 0.00 0.00 0.00 0.00 61.98 60.63 1n9s s VAL 63 Cb 0.00 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 1n9s s VAL 63 CO 0.00 0.30 0.87 -0.55 0.00 0.00 0.00 175.10 175.72 1n9s s SER 64 N -1.62 7.08 -0.24 3.32 0.15 -1.26 0.72 113.70 121.84 1n9s s SER 64 Ca 0.17 1.32 0.13 0.00 0.70 0.00 0.00 55.95 58.27 1n9s s SER 64 Cb -0.11 -2.48 0.51 0.00 -1.71 0.00 0.00 66.02 62.23 1n9s s SER 64 CO 0.08 -0.34 1.45 1.41 1.20 0.00 0.00 173.24 177.03 1n9s n HIS 65 N 4.76 1.03 0.00 3.44 8.25 -0.44 -4.95 115.22 127.31 1n9s n HIS 65 Ca 0.05 -1.24 0.00 0.00 -0.26 0.00 0.00 57.72 56.27 1n9s n HIS 65 Cb 0.49 -0.41 0.00 0.00 1.12 0.00 0.00 29.99 31.20 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 -0.85 2.51 3.25 -1.41 0.00 -1.26 -4.89 105.19 102.55 1n9s n GLY 66 Ca 0.28 -2.09 -0.34 0.00 0.00 0.00 0.00 46.02 43.86 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 -2.22 2.96 0.37 2.61 2.01 -1.26 -2.23 115.64 117.88 1n9s s THR 67 Ca 0.00 -0.63 -0.06 0.00 0.31 0.00 0.00 61.69 61.30 1n9s s THR 67 Cb 0.00 -2.32 -0.05 0.00 0.01 0.00 0.00 72.50 70.14 1n9s s THR 67 CO 0.00 0.46 0.67 -0.76 -0.69 0.00 0.00 174.62 174.31 1n9s s LEU 68 N 1.40 3.89 0.00 4.42 1.43 -0.24 -5.01 118.68 124.56 1n9s s LEU 68 Ca 0.05 0.88 0.00 0.00 -1.03 0.00 0.00 54.13 54.03 1n9s s LEU 68 Cb -0.14 -3.75 0.00 0.00 0.03 0.00 0.00 46.19 42.33 1n9s s LEU 68 CO -0.06 -0.35 0.00 0.61 0.23 0.00 0.00 176.35 176.78 1n9s n GLY 69 N -1.39 0.10 3.72 -3.19 0.00 -1.26 -3.24 105.19 99.92 1n9s n GLY 69 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 4.21 0.04 1.61 0.41 -1.26 -2.58 118.70 121.13 1n9s s GLU 70 Ca 0.00 -0.04 0.05 0.00 -0.41 0.00 0.00 54.97 54.58 1n9s s GLU 70 Cb 0.00 -3.44 -0.02 0.00 -1.78 0.00 0.00 34.13 28.89 1n9s s GLU 70 CO 0.00 0.22 -0.15 0.96 -0.49 0.00 0.00 175.26 175.80 1n9s s ILE 71 N 0.55 1.17 -0.23 -1.63 -4.36 -0.50 -4.98 121.20 111.22 1n9s s ILE 71 Ca 0.13 -0.99 -0.01 0.00 -0.26 0.00 0.00 60.65 59.52 1n9s s ILE 71 Cb -0.12 -1.05 0.02 0.00 1.25 0.00 0.00 42.46 42.56 1n9s s ILE 71 CO 0.02 0.05 -0.09 -0.36 0.24 0.00 0.00 174.94 174.80 1n9s s PHE 72 N -0.81 3.00 -0.09 1.37 0.40 -1.26 -0.46 117.98 120.13 1n9s s PHE 72 Ca 0.02 -1.53 -0.03 0.00 -0.60 0.00 0.00 56.93 54.79 1n9s s PHE 72 Cb -0.08 -2.03 -0.04 0.00 0.51 0.00 0.00 43.02 41.39 1n9s s PHE 72 CO 0.01 -0.73 0.06 0.42 0.70 0.00 0.00 175.22 175.68 1n9s s ILE 73 N 1.33 4.76 -0.19 0.64 1.01 0.12 -4.95 121.20 123.92 1n9s s ILE 73 Ca 0.01 -0.10 -0.14 0.00 0.00 0.00 0.00 60.65 60.42 1n9s s ILE 73 Cb -0.16 -3.04 -0.04 0.00 0.01 0.00 0.00 42.46 39.23 1n9s s ILE 73 CO -0.06 0.59 0.33 -0.13 0.00 0.00 0.00 174.94 175.67 1n9s s ARG 74 N -1.01 4.20 0.23 2.79 1.81 -1.26 -1.97 118.95 123.75 1n9s s ARG 74 Ca 0.15 0.11 -0.10 0.00 -1.72 0.00 0.00 55.73 54.16 1n9s s ARG 74 Cb -0.12 -3.49 0.33 0.00 -0.45 0.00 0.00 34.95 31.23 1n9s s ARG 74 CO 0.04 0.09 1.38 0.45 -0.68 0.00 0.00 175.30 176.58 1n9s n SER 75 N 4.06 -0.42 -0.30 0.23 2.88 -1.25 -0.72 113.62 118.11 1n9s n SER 75 Ca -0.10 1.53 0.25 0.00 -1.33 0.00 0.00 58.87 59.21 1n9s n SER 75 Cb 0.51 -0.42 0.57 0.00 -0.75 0.00 0.00 64.21 64.12 1n9s n SER 75 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 1n9s h ASN 76 N 0.00 0.33 0.72 -3.46 -0.26 -1.89 -0.71 115.58 110.31 1n9s h ASN 76 Ca 0.38 0.06 0.00 0.00 -0.56 0.00 0.00 56.30 56.18 1n9s h ASN 76 Cb 0.60 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.86 1n9s h ASN 76 CO -0.90 0.08 0.00 0.59 -1.06 0.00 0.00 177.43 176.14 1n9s n ASN 77 N -4.50 0.00 -4.83 5.81 3.02 0.10 -4.84 115.26 110.02 1n9s n ASN 77 Ca 0.24 0.17 -0.38 0.00 -0.03 0.00 0.00 54.58 54.58 1n9s n ASN 77 Cb 0.91 -0.39 -0.06 0.00 -0.61 0.00 0.00 39.78 39.63 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 -2.77 4.96 -0.19 2.41 1.01 -0.27 -2.38 120.40 123.17 1n9s s VAL 78 Ca 0.20 0.93 -0.15 0.00 0.00 0.00 0.00 61.98 62.96 1n9s s VAL 78 Cb 0.18 -3.76 -0.10 0.00 0.00 0.00 0.00 36.38 32.70 1n9s s VAL 78 CO 0.46 0.56 -0.12 -0.11 0.00 0.00 0.00 175.10 175.90 1n9s n LEU 79 N 1.87 1.87 -3.50 3.92 7.94 0.71 -4.70 117.00 125.11 1n9s n LEU 79 Ca -0.13 0.46 -0.09 0.00 -1.11 0.00 0.00 56.01 55.15 1n9s n LEU 79 Cb 0.52 -0.87 -0.02 0.00 0.53 0.00 0.00 43.42 43.58 1n9s n LEU 79 CO 0.39 -0.01 0.64 -0.72 -1.11 0.00 0.00 177.39 176.57 1n9s s TYR 80 N -2.44 -0.37 -0.06 1.96 -0.85 -1.07 -4.98 117.35 109.53 1n9s s TYR 80 Ca -0.26 0.22 0.05 0.00 -0.52 0.00 0.00 57.07 56.56 1n9s s TYR 80 Cb 0.06 0.55 -0.00 0.00 0.38 0.00 0.00 41.96 42.94 1n9s s TYR 80 CO 0.42 -0.61 -0.22 0.42 -1.52 0.00 0.00 175.55 174.04 1n9s s ILE 81 N -3.24 1.82 0.06 -3.49 1.01 -1.26 0.43 121.20 116.53 1n9s s ILE 81 Ca 0.05 -0.92 0.02 0.00 0.00 0.00 0.00 60.65 59.80 1n9s s ILE 81 Cb -0.01 -1.56 -0.03 0.00 0.01 0.00 0.00 42.46 40.87 1n9s s ILE 81 CO -0.09 0.51 -0.08 0.00 0.00 0.00 0.00 174.94 175.28 1n9s s ARG 82 N 0.05 0.64 0.48 2.79 1.70 -0.99 -5.00 118.95 118.62 1n9s s ARG 82 Ca -0.08 -0.93 -0.09 0.00 -0.47 0.00 0.00 55.73 54.16 1n9s s ARG 82 Cb -0.14 -0.31 -0.05 0.00 -0.57 0.00 0.00 34.95 33.87 1n9s s ARG 82 CO 0.04 0.04 0.85 -1.83 -1.08 0.00 0.00 175.30 173.32 1n9s s GLU 83 N -2.21 3.68 -0.16 3.89 -1.05 -1.26 -0.56 118.70 121.03 1n9s s GLU 83 Ca -0.03 0.48 -0.01 0.00 -0.15 0.00 0.00 54.97 55.26 1n9s s GLU 83 Cb -0.06 -2.30 -0.00 0.00 -0.44 0.00 0.00 34.13 31.33 1n9s s GLU 83 CO -0.01 -0.22 -0.13 -0.51 0.95 0.00 0.00 175.26 175.34 1n9s s LEU 84 N -4.44 2.59 0.00 1.83 1.43 0.75 -4.81 118.68 116.03 1n9s s LEU 84 Ca 0.51 -0.43 0.00 0.00 -1.03 0.00 0.00 54.13 53.18 1n9s s LEU 84 Cb -0.10 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.52 1n9s s LEU 84 CO 0.40 0.08 0.00 -2.65 0.23 0.00 0.00 176.35 174.42 1n9s n PRO 85 N 4.07 0.00 0.00 1.29 -0.02 -1.26 -4.90 135.00 134.19 1n9s n PRO 85 Ca -0.19 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.42 1n9s n PRO 85 Cb 0.52 -0.63 0.78 0.00 -0.02 0.00 0.00 33.50 34.14 1n9s n PRO 85 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75