#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vna n GLU 2 N 0.00 0.95 -3.37 1.64 1.02 -1.26 -2.38 120.64 117.24 1vna n GLU 2 Ca 0.00 -1.57 0.00 0.00 -0.02 0.00 0.00 57.16 55.57 1vna n GLU 2 Cb 0.00 0.02 0.00 0.00 -0.02 0.00 0.00 31.44 31.44 1vna n GLU 2 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vna n GLY 3 N 1.72 -1.60 3.08 0.62 0.00 -1.11 -4.95 105.19 102.95 1vna n GLY 3 Ca 0.04 -1.06 -0.31 0.00 0.00 0.00 0.00 46.02 44.68 1vna n GLY 3 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vna s TYR 4 N -2.37 2.34 0.63 1.61 2.02 -1.26 -2.49 117.35 117.82 1vna s TYR 4 Ca 0.00 -1.26 -0.18 0.00 -0.37 0.00 0.00 57.07 55.26 1vna s TYR 4 Cb 0.00 -1.66 -0.02 0.00 -0.40 0.00 0.00 41.96 39.88 1vna s TYR 4 CO 0.00 -0.64 1.20 -0.51 -1.57 0.00 0.00 175.55 174.02 1vna s LEU 5 N 1.21 3.56 0.00 -1.29 1.43 -1.01 -3.62 118.68 118.97 1vna s LEU 5 Ca 0.00 2.34 0.00 0.00 -1.03 0.00 0.00 54.13 55.44 1vna s LEU 5 Cb -0.14 -4.59 -0.00 0.00 0.03 0.00 0.00 46.19 41.49 1vna s LEU 5 CO -0.08 -1.73 0.00 1.33 0.23 0.00 0.00 176.35 176.11 1vna n VAL 6 N -1.91 0.00 -2.51 -1.59 0.24 -1.26 -1.97 118.33 109.33 1vna n VAL 6 Ca 0.13 -0.39 -0.41 0.00 -2.04 0.00 0.00 64.34 61.64 1vna n VAL 6 Cb 0.50 0.09 -0.01 0.00 -1.47 0.00 0.00 33.84 32.94 1vna n VAL 6 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1vna s LYS 7 N -2.29 3.71 0.13 7.34 2.47 0.21 -4.53 119.74 126.78 1vna s LYS 7 Ca 0.01 -1.66 -0.09 0.00 -1.56 0.00 0.00 55.97 52.67 1vna s LYS 7 Cb 0.00 -5.46 0.15 0.00 -1.46 0.00 0.00 37.83 31.06 1vna s LYS 7 CO 0.00 -2.44 0.83 1.17 0.16 0.00 0.00 175.35 175.08 1vna n LYS 8 N 8.52 -0.11 0.00 4.03 4.81 -1.26 -1.56 118.16 132.59 1vna n LYS 8 Ca 0.44 0.83 0.00 0.00 -0.87 0.00 0.00 58.31 58.71 1vna n LYS 8 Cb 0.47 -1.23 0.00 0.00 0.02 0.00 0.00 35.03 34.29 1vna n LYS 8 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1vna n SER 9 N -4.80 0.00 0.00 3.14 2.88 -1.26 -4.85 113.62 108.72 1vna n SER 9 Ca 0.06 0.42 0.00 0.00 -1.33 0.00 0.00 58.87 58.02 1vna n SER 9 Cb 0.22 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.68 1vna n SER 9 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1vna n ASP 10 N -0.69 0.00 0.00 -3.46 5.75 -0.60 -5.14 116.55 112.41 1vna n ASP 10 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1vna n ASP 10 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1vna n ASP 10 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1vna n GLY 11 N 0.00 1.39 0.00 6.12 0.00 -1.23 -5.09 105.19 106.38 1vna n GLY 11 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1vna n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vna n LYS 13 N 0.00 -3.33 -3.55 0.00 2.85 -1.26 -0.62 118.16 112.25 1vna n LYS 13 Ca 0.00 -1.17 -0.38 0.00 -1.05 0.00 0.00 58.31 55.71 1vna n LYS 13 Cb 0.00 -1.29 -0.09 0.00 -0.65 0.00 0.00 35.03 33.00 1vna n LYS 13 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 177.40 176.88 1vna s TYR 14 N -2.13 3.30 0.46 5.58 6.14 -0.83 -4.14 117.35 125.72 1vna s TYR 14 Ca 0.50 0.31 0.08 0.00 0.64 0.00 0.00 57.07 58.61 1vna s TYR 14 Cb -0.07 -2.39 0.02 0.00 0.42 0.00 0.00 41.96 39.94 1vna s TYR 14 CO 0.40 -0.04 0.59 0.34 0.64 0.00 0.00 175.55 177.49 1vna s ASP 15 N 1.28 5.45 -0.29 4.32 2.15 -1.26 -3.25 116.67 125.08 1vna s ASP 15 Ca 0.11 -0.56 -0.16 0.00 0.43 0.00 0.00 52.55 52.36 1vna s ASP 15 Cb -0.15 -0.42 0.16 0.00 -0.30 0.00 0.00 42.92 42.22 1vna s ASP 15 CO 0.07 -0.88 1.05 0.00 -0.17 0.00 0.00 175.17 175.25 1vna n PHE 17 N 3.56 0.08 -2.42 0.00 7.35 -1.26 -4.32 117.46 120.46 1vna n PHE 17 Ca -0.18 0.02 -0.38 0.00 -0.76 0.00 0.00 57.45 56.16 1vna n PHE 17 Cb 0.57 -0.23 -0.03 0.00 0.35 0.00 0.00 39.48 40.15 1vna n PHE 17 CO 0.00 0.00 0.00 -0.46 -0.76 0.00 0.00 176.76 175.54 1vna s TRP 18 N -3.08 2.42 0.04 -5.13 -0.00 -1.26 -4.95 118.94 106.97 1vna s TRP 18 Ca 0.07 -0.68 -0.28 0.00 -0.00 0.00 0.00 56.10 55.21 1vna s TRP 18 Cb 0.16 -4.52 -0.05 0.00 -0.00 0.00 0.00 33.47 29.07 1vna s TRP 18 CO 0.80 -1.76 0.89 -0.51 -0.00 0.00 0.00 176.95 176.37 1vna s LEU 19 N 6.41 4.43 0.00 5.86 1.43 -1.26 -4.40 118.68 131.14 1vna s LEU 19 Ca 0.56 1.59 0.00 0.00 -1.03 0.00 0.00 54.13 55.25 1vna s LEU 19 Cb 0.00 -3.43 0.00 0.00 0.03 0.00 0.00 46.19 42.79 1vna s LEU 19 CO 0.01 -0.11 0.00 0.61 0.23 0.00 0.00 176.35 177.09 1vna n GLY 20 N 2.59 1.52 3.90 -3.19 0.00 -1.26 -5.00 105.19 103.74 1vna n GLY 20 Ca 0.02 -0.73 -0.28 0.00 0.00 0.00 0.00 46.02 45.03 1vna n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vna s LYS 21 N 0.00 3.57 -0.15 1.61 -0.14 -1.26 -4.42 119.74 118.96 1vna s LYS 21 Ca 0.00 0.20 -0.01 0.00 -1.36 0.00 0.00 55.97 54.81 1vna s LYS 21 Cb 0.00 -2.40 0.04 0.00 -1.68 0.00 0.00 37.83 33.79 1vna s LYS 21 CO 0.00 -0.15 -0.06 0.54 -0.76 0.00 0.00 175.35 174.92 1vna s ASN 22 N -3.95 2.59 -0.25 2.83 4.22 -1.26 -4.68 114.94 114.44 1vna s ASN 22 Ca 0.47 -0.54 -0.15 0.00 -2.14 0.00 0.00 52.86 50.50 1vna s ASN 22 Cb -0.10 -0.87 -0.10 0.00 1.28 0.00 0.00 41.25 41.46 1vna s ASN 22 CO 0.42 -0.17 -0.34 1.21 -2.04 0.00 0.00 177.10 176.19 1vna n GLU 23 N 4.91 0.57 0.07 3.55 2.13 -1.26 -3.91 120.64 126.70 1vna n GLU 23 Ca -0.12 0.26 -0.05 0.00 0.66 0.00 0.00 57.16 57.92 1vna n GLU 23 Cb 0.48 -1.48 -0.09 0.00 0.27 0.00 0.00 31.44 30.62 1vna n GLU 23 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1vna h HIS 24 N -1.00 0.00 0.00 4.31 3.86 -2.00 -3.13 115.15 117.20 1vna h HIS 24 Ca -0.49 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.72 1vna h HIS 24 Cb 1.42 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.89 1vna h HIS 24 CO -0.18 0.86 0.00 0.00 0.86 0.00 0.00 177.93 179.47 1vna n ASN 26 N -1.33 1.97 0.19 0.00 5.15 -1.19 -3.18 115.26 116.87 1vna n ASN 26 Ca 0.12 0.26 0.06 0.00 -0.60 0.00 0.00 54.58 54.41 1vna n ASN 26 Cb 0.25 -0.82 0.33 0.00 -0.53 0.00 0.00 39.78 39.01 1vna n ASN 26 CO 0.00 0.00 0.00 0.74 1.40 0.00 0.00 177.26 179.40 1vna h THR 27 N -0.55 0.89 0.08 -0.44 2.02 -1.60 -1.19 112.91 112.11 1vna h THR 27 Ca -0.49 -1.53 -0.26 0.00 0.77 0.00 0.00 66.41 64.90 1vna h THR 27 Cb 1.67 1.93 0.01 0.00 -1.74 0.00 0.00 68.15 70.02 1vna h THR 27 CO -0.16 0.37 -1.12 -0.08 0.37 0.00 0.00 175.52 174.89 1vna h GLU 28 N 0.00 0.41 -0.01 6.66 4.81 -1.64 -3.19 114.58 121.62 1vna h GLU 28 Ca -0.00 -0.54 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 1vna h GLU 28 Cb 0.90 0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.46 1vna h GLU 28 CO 0.05 1.21 -0.20 0.00 -0.73 0.00 0.00 179.01 179.34 1vna h LYS 30 N 1.05 0.28 -6.24 0.00 1.57 -1.21 -2.50 116.57 109.52 1vna h LYS 30 Ca 0.00 -0.47 -0.58 0.00 -1.87 0.00 0.00 60.65 57.73 1vna h LYS 30 Cb 0.46 0.18 0.19 0.00 0.08 0.00 0.00 32.23 33.14 1vna h LYS 30 CO 0.00 1.23 -0.99 0.00 -0.57 0.00 0.00 179.45 179.11 1vna n ALA 31 N -2.89 -2.88 0.76 3.86 0.00 -1.21 -4.76 120.51 113.38 1vna n ALA 31 Ca -0.23 -0.22 0.13 0.00 0.00 0.00 0.00 53.44 53.12 1vna n ALA 31 Cb 0.91 -1.53 0.50 0.00 0.00 0.00 0.00 19.45 19.33 1vna n ALA 31 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1vna n LYS 32 N 0.88 0.10 0.27 0.00 -0.00 -1.26 -3.04 118.16 115.11 1vna n LYS 32 Ca 0.07 0.14 0.18 0.00 -0.00 0.00 0.00 58.31 58.70 1vna n LYS 32 Cb 0.50 -1.63 0.93 0.00 -0.00 0.00 0.00 35.03 34.82 1vna n LYS 32 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.40 174.45 1vna h ASN 33 N 0.00 0.00 0.00 -5.58 7.08 -1.93 -3.30 115.58 111.84 1vna h ASN 33 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1vna h ASN 33 Cb 0.53 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.77 1vna h ASN 33 CO 0.00 0.00 -0.25 0.00 -2.08 0.00 0.00 177.43 175.10 1vna n GLN 34 N -2.78 0.13 0.00 4.14 3.00 -1.17 -5.07 117.38 115.64 1vna n GLN 34 Ca -0.02 0.05 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 1vna n GLN 34 Cb 0.10 -0.62 0.00 0.00 0.00 0.00 0.00 30.24 29.72 1vna n GLN 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1vna n GLY 35 N 2.66 2.95 0.00 1.08 0.00 -1.21 -4.80 105.19 105.87 1vna n GLY 35 Ca -0.04 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1vna n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vna n GLY 36 N 0.00 -2.70 0.10 -0.02 0.00 -1.21 -4.69 105.19 96.67 1vna n GLY 36 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.11 1vna n GLY 36 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1vna n SER 37 N -0.72 -0.16 -4.91 1.61 3.41 -0.94 -4.18 113.62 107.74 1vna n SER 37 Ca 0.00 0.41 -0.32 0.00 -0.26 0.00 0.00 58.87 58.70 1vna n SER 37 Cb 0.00 0.53 -0.04 0.00 -0.26 0.00 0.00 64.21 64.43 1vna n SER 37 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1vna s TYR 38 N -2.00 3.51 0.00 7.33 -0.85 -1.26 -4.53 117.35 119.55 1vna s TYR 38 Ca 0.00 0.40 0.00 0.00 -0.52 0.00 0.00 57.07 56.95 1vna s TYR 38 Cb 0.00 -1.87 0.00 0.00 0.38 0.00 0.00 41.96 40.47 1vna s TYR 38 CO 0.00 0.55 0.00 0.41 -1.52 0.00 0.00 175.55 174.99 1vna n GLY 39 N 0.37 -0.53 0.00 5.49 0.00 -1.26 -3.30 105.19 105.96 1vna n GLY 39 Ca -0.05 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1vna n GLY 39 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1vna n TYR 40 N 0.00 0.00 -3.67 1.61 0.18 -1.16 -4.88 117.16 109.24 1vna n TYR 40 Ca 0.00 0.00 -0.37 0.00 1.88 0.00 0.00 57.90 59.41 1vna n TYR 40 Cb 0.00 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 38.90 1vna n TYR 40 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1vna s TYR 42 N -0.70 3.71 0.00 0.00 5.04 -0.66 -4.44 117.35 120.29 1vna s TYR 42 Ca 0.18 -2.88 0.00 0.00 -2.44 0.00 0.00 57.07 51.93 1vna s TYR 42 Cb -0.14 -2.87 0.00 0.00 0.35 0.00 0.00 41.96 39.30 1vna s TYR 42 CO 0.07 -0.95 0.00 0.00 -1.34 0.00 0.00 175.55 173.34 1vna n ALA 43 N 4.30 0.00 -1.53 3.97 0.00 -1.26 -3.32 120.51 122.68 1vna n ALA 43 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.45 1vna n ALA 43 Cb 0.42 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.86 1vna n ALA 43 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1vna n PHE 44 N 0.00 0.00 -4.22 0.00 3.72 -1.26 -4.95 117.46 110.75 1vna n PHE 44 Ca 0.00 -0.06 -0.15 0.00 -0.05 0.00 0.00 57.45 57.19 1vna n PHE 44 Cb 0.00 0.24 -0.11 0.00 -0.94 0.00 0.00 39.48 38.67 1vna n PHE 44 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1vna s ALA 45 N 0.00 1.32 -0.93 4.37 0.00 -1.21 0.25 121.76 125.56 1vna s ALA 45 Ca 0.00 -1.33 -0.24 0.00 0.00 0.00 0.00 51.96 50.39 1vna s ALA 45 Cb 0.00 0.02 0.03 0.00 0.00 0.00 0.00 23.12 23.16 1vna s ALA 45 CO 0.00 -0.03 1.52 0.00 0.00 0.00 0.00 175.76 177.24 1vna s TRP 47 N 6.09 3.53 0.15 0.00 -0.11 -0.47 -2.40 118.94 125.74 1vna s TRP 47 Ca 0.49 1.52 -0.06 0.00 1.22 0.00 0.00 56.10 59.27 1vna s TRP 47 Cb -0.03 -2.75 -0.02 0.00 -1.50 0.00 0.00 33.47 29.17 1vna s TRP 47 CO -0.03 0.15 0.19 0.00 -4.62 0.00 0.00 176.95 172.65 1vna s GLU 49 N -3.99 0.07 0.00 0.00 -6.30 -1.21 -2.76 118.70 104.51 1vna s GLU 49 Ca 0.19 -0.02 0.00 0.00 -2.50 0.00 0.00 54.97 52.65 1vna s GLU 49 Cb 0.05 -1.67 0.00 0.00 0.00 0.00 0.00 34.13 32.50 1vna s GLU 49 CO 0.00 -0.65 0.00 0.41 0.02 0.00 0.00 175.26 175.04 1vna n GLY 50 N 5.29 0.00 3.25 -1.50 0.00 -1.00 -4.48 105.19 106.74 1vna n GLY 50 Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 1vna n GLY 50 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1vna s LEU 51 N 0.00 2.57 0.00 0.99 2.34 -1.24 -3.30 118.68 120.05 1vna s LEU 51 Ca 0.00 -0.48 -0.17 0.00 0.06 0.00 0.00 54.13 53.54 1vna s LEU 51 Cb 0.00 -1.62 0.26 0.00 -0.56 0.00 0.00 46.19 44.28 1vna s LEU 51 CO 0.00 0.02 0.60 -2.65 -1.06 0.00 0.00 176.35 173.25 1vna n PRO 52 N 4.53 -3.00 0.00 1.48 -0.01 -1.26 -4.71 135.00 132.02 1vna n PRO 52 Ca -0.19 -1.00 0.15 0.00 -0.01 0.00 0.00 63.50 62.45 1vna n PRO 52 Cb 0.51 -1.54 0.79 0.00 -0.01 0.00 0.00 33.50 33.25 1vna n PRO 52 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 175.50 175.88 1vna n GLU 53 N -3.44 0.52 0.09 -0.52 4.71 -1.26 -3.32 120.64 117.43 1vna n GLU 53 Ca 0.09 0.00 -0.06 0.00 -0.01 0.00 0.00 57.16 57.19 1vna n GLU 53 Cb 0.41 -1.50 0.06 0.00 -1.01 0.00 0.00 31.44 29.40 1vna n GLU 53 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 177.13 177.99 1vna h SER 54 N 0.00 0.18 -3.32 1.62 0.02 -1.99 -3.42 113.55 106.64 1vna h SER 54 Ca 0.00 -0.13 -0.57 0.00 -0.84 0.00 0.00 61.79 60.25 1vna h SER 54 Cb 0.24 -0.06 -0.06 0.00 0.14 0.00 0.00 62.40 62.66 1vna h SER 54 CO 0.00 0.87 0.92 -0.89 -1.14 0.00 0.00 176.83 176.59 1vna s THR 55 N -3.41 4.28 0.27 -2.27 2.01 -1.21 -4.98 115.64 110.33 1vna s THR 55 Ca -0.03 1.43 -0.30 0.00 0.31 0.00 0.00 61.69 63.11 1vna s THR 55 Cb 0.11 -4.34 -0.10 0.00 0.01 0.00 0.00 72.50 68.18 1vna s THR 55 CO 0.80 -0.59 1.46 -2.16 -0.69 0.00 0.00 174.62 173.44 1vna s PRO 56 N 4.07 4.24 0.19 4.92 0.04 -1.26 -4.95 135.00 142.24 1vna s PRO 56 Ca 0.51 2.36 0.09 0.00 0.04 0.00 0.00 61.00 63.99 1vna s PRO 56 Cb -0.13 -3.08 -0.04 0.00 0.04 0.00 0.00 34.50 31.28 1vna s PRO 56 CO 0.22 -0.44 -0.18 0.95 0.04 0.00 0.00 177.00 177.60 1vna s THR 57 N -0.18 1.89 0.47 1.26 -4.23 -1.26 -4.92 115.64 108.67 1vna s THR 57 Ca 0.59 -2.05 -0.20 0.00 -1.18 0.00 0.00 61.69 58.85 1vna s THR 57 Cb -0.43 -1.95 -0.14 0.00 1.34 0.00 0.00 72.50 71.32 1vna s THR 57 CO 0.46 -0.39 0.17 0.00 -0.54 0.00 0.00 174.62 174.32 1vna n TYR 58 N 0.03 -1.86 -0.32 3.99 9.36 -1.24 -4.53 117.16 122.59 1vna n TYR 58 Ca -0.11 0.53 0.00 0.00 3.32 0.00 0.00 57.90 61.64 1vna n TYR 58 Cb 0.58 -1.81 0.00 0.00 -0.63 0.00 0.00 39.34 37.48 1vna n TYR 58 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1vna n PRO 59 N 1.01 -0.98 -4.04 2.98 -0.04 -1.26 -4.89 135.00 127.78 1vna n PRO 59 Ca 0.10 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.24 1vna n PRO 59 Cb 0.44 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.75 1vna n PRO 59 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1vna s LEU 60 N 0.00 3.49 0.00 1.53 2.96 -1.26 -4.97 118.68 120.43 1vna s LEU 60 Ca 0.00 -1.35 0.07 0.00 -0.22 0.00 0.00 54.13 52.62 1vna s LEU 60 Cb 0.00 -1.58 0.39 0.00 0.50 0.00 0.00 46.19 45.50 1vna s LEU 60 CO 0.00 -0.20 0.80 -0.81 -1.32 0.00 0.00 176.35 174.82 1vna n PRO 61 N 4.47 0.38 -0.09 0.98 -0.04 -1.26 -2.87 135.00 136.56 1vna n PRO 61 Ca -0.14 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.19 1vna n PRO 61 Cb 0.42 -1.27 -0.09 0.00 -0.04 0.00 0.00 33.50 32.53 1vna n PRO 61 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1vna n ASN 62 N -0.77 2.45 0.00 3.54 4.05 -1.26 -5.06 115.26 118.22 1vna n ASN 62 Ca 0.05 -0.10 0.00 0.00 0.45 0.00 0.00 54.58 54.98 1vna n ASN 62 Cb 0.02 -0.25 0.00 0.00 1.23 0.00 0.00 39.78 40.78 1vna n ASN 62 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 1vna n LYS 63 N -3.04 2.22 0.00 1.20 5.02 -1.14 -5.15 118.16 117.27 1vna n LYS 63 Ca -0.34 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 55.95 1vna n LYS 63 Cb 0.87 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.88 1vna n LYS 63 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1vna n SER 64 N 0.00 0.00 0.00 4.39 2.88 -1.26 -4.77 113.62 114.86 1vna n SER 64 Ca 0.00 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.68 1vna n SER 64 Cb 0.00 0.00 0.84 0.00 -0.75 0.00 0.00 64.21 64.30 1vna n SER 64 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81