#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vna s GLU 2 N 0.00 3.87 0.00 1.64 0.41 -1.26 -1.21 118.70 122.15 1vna s GLU 2 Ca 0.00 -0.38 0.00 0.00 -0.41 0.00 0.00 54.97 54.18 1vna s GLU 2 Cb 0.00 -3.34 0.00 0.00 -1.78 0.00 0.00 34.13 29.01 1vna s GLU 2 CO 0.00 0.04 0.00 0.41 -0.49 0.00 0.00 175.26 175.22 1vna n GLY 3 N 4.26 -1.64 3.89 -1.39 0.00 -1.22 -5.01 105.19 104.09 1vna n GLY 3 Ca -0.16 -1.09 -0.30 0.00 0.00 0.00 0.00 46.02 44.46 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 -2.10 3.45 1.17 1.61 1.51 -1.26 -2.16 117.35 119.58 1vna s TYR 4 Ca 0.00 0.74 -0.14 0.00 -1.01 0.00 0.00 57.07 56.67 1vna s TYR 4 Cb 0.00 -2.17 0.28 0.00 -0.11 0.00 0.00 41.96 39.97 1vna s TYR 4 CO 0.00 0.24 1.03 -0.51 -1.11 0.00 0.00 175.55 175.19 1vna s LEU 5 N -3.14 0.70 -0.10 -1.29 1.43 -1.15 -3.28 118.68 111.85 1vna s LEU 5 Ca 0.45 1.37 -0.05 0.00 -1.03 0.00 0.00 54.13 54.87 1vna s LEU 5 Cb -0.11 -3.26 0.05 0.00 0.03 0.00 0.00 46.19 42.90 1vna s LEU 5 CO 0.26 -4.20 0.24 -0.69 0.23 0.00 0.00 176.35 172.19 1vna s VAL 6 N -2.53 -0.04 0.25 -1.59 1.01 -1.26 -1.49 120.40 114.75 1vna s VAL 6 Ca 0.68 0.15 -0.30 0.00 0.00 0.00 0.00 61.98 62.51 1vna s VAL 6 Cb -0.23 -0.37 -0.11 0.00 0.00 0.00 0.00 36.38 35.67 1vna s VAL 6 CO 0.63 0.06 1.52 -0.54 0.00 0.00 0.00 175.10 176.78 1vna s LYS 7 N 1.26 4.21 0.00 2.72 1.02 -0.78 -4.44 119.74 123.73 1vna s LYS 7 Ca -0.09 2.41 0.00 0.00 0.02 0.00 0.00 55.97 58.31 1vna s LYS 7 Cb -0.10 -3.09 0.00 0.00 -0.52 0.00 0.00 37.83 34.12 1vna s LYS 7 CO -0.08 -0.53 0.00 1.17 -0.92 0.00 0.00 175.35 174.99 1vna n LYS 8 N 2.57 0.00 0.00 1.68 0.00 -1.26 -3.49 118.16 117.66 1vna n LYS 8 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.40 1vna n LYS 8 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.42 1vna n LYS 8 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1vna n SER 9 N 0.00 0.00 0.00 3.14 2.88 -1.26 -3.79 113.62 114.59 1vna n SER 9 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1vna n SER 9 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 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 0.00 0.00 0.00 -3.46 5.68 -1.25 -5.05 116.55 112.46 1vna n ASP 10 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1vna n ASP 10 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1vna n ASP 10 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1vna n GLY 11 N -0.36 0.21 3.83 6.12 0.00 -1.23 -5.10 105.19 108.65 1vna n GLY 11 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.58 0.66 -2.62 0.00 2.85 -1.26 -1.87 118.16 115.34 1vna n LYS 13 Ca -0.07 0.25 -0.36 0.00 -1.05 0.00 0.00 58.31 57.08 1vna n LYS 13 Cb 0.60 -1.70 -0.05 0.00 -0.65 0.00 0.00 35.03 33.22 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 -1.57 3.37 0.31 5.58 5.04 -0.56 -4.64 117.35 124.89 1vna s TYR 14 Ca 0.66 1.67 0.06 0.00 -2.44 0.00 0.00 57.07 57.03 1vna s TYR 14 Cb -0.51 -3.06 -0.02 0.00 0.35 0.00 0.00 41.96 38.73 1vna s TYR 14 CO 0.56 -0.39 0.40 0.34 -1.34 0.00 0.00 175.55 175.12 1vna s ASP 15 N -1.63 5.90 0.08 4.32 2.15 -1.26 -3.30 116.67 122.93 1vna s ASP 15 Ca 0.56 -0.19 -0.11 0.00 0.43 0.00 0.00 52.55 53.24 1vna s ASP 15 Cb -0.20 -1.32 0.01 0.00 -0.30 0.00 0.00 42.92 41.11 1vna s ASP 15 CO 0.25 -0.33 0.26 0.00 -0.17 0.00 0.00 175.17 175.19 1vna n PHE 17 N 0.17 0.00 -1.70 0.00 7.35 -1.26 -4.47 117.46 117.55 1vna n PHE 17 Ca -0.17 0.00 -0.64 0.00 -0.76 0.00 0.00 57.45 55.89 1vna n PHE 17 Cb 0.61 0.00 -0.09 0.00 0.35 0.00 0.00 39.48 40.35 1vna n PHE 17 CO 0.00 0.00 0.00 1.87 -0.76 0.00 0.00 176.76 177.87 1vna n TRP 18 N 0.00 1.83 -2.88 -5.13 -0.00 -1.26 -4.85 117.44 105.16 1vna n TRP 18 Ca 0.00 0.89 -0.38 0.00 -0.00 0.00 0.00 57.50 58.01 1vna n TRP 18 Cb 0.00 -2.32 -0.06 0.00 -0.00 0.00 0.00 31.31 28.93 1vna n TRP 18 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 177.69 177.18 1vna s LEU 19 N 3.46 4.47 0.00 5.87 1.02 -1.26 -4.72 118.68 127.52 1vna s LEU 19 Ca 1.04 1.74 0.00 0.00 0.02 0.00 0.00 54.13 56.93 1vna s LEU 19 Cb -1.33 -3.69 0.00 0.00 0.02 0.00 0.00 46.19 41.19 1vna s LEU 19 CO 0.75 0.06 0.00 0.61 0.02 0.00 0.00 176.35 177.79 1vna n GLY 20 N 1.02 0.49 3.67 -3.19 0.00 -1.25 -4.99 105.19 100.93 1vna n GLY 20 Ca -0.01 -2.17 -0.42 0.00 0.00 0.00 0.00 46.02 43.42 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 -0.19 4.20 0.00 1.61 1.02 -1.26 -3.60 119.74 121.52 1vna s LYS 21 Ca 0.00 2.17 0.07 0.00 0.02 0.00 0.00 55.97 58.23 1vna s LYS 21 Cb 0.00 -3.88 -0.02 0.00 -0.52 0.00 0.00 37.83 33.41 1vna s LYS 21 CO 0.00 -0.80 -0.21 -0.80 -0.92 0.00 0.00 175.35 172.62 1vna s ASN 22 N 3.00 2.48 -0.06 2.83 0.01 -1.26 -5.02 114.94 116.93 1vna s ASN 22 Ca 0.72 -0.43 0.12 0.00 -0.71 0.00 0.00 52.86 52.56 1vna s ASN 22 Cb -0.34 -0.25 -0.23 0.00 0.41 0.00 0.00 41.25 40.84 1vna s ASN 22 CO 0.29 0.23 0.61 1.21 -1.51 0.00 0.00 177.10 177.93 1vna n GLU 23 N 2.33 0.64 0.14 -0.60 4.07 -1.26 -3.71 120.64 122.25 1vna n GLU 23 Ca -0.16 0.28 0.13 0.00 -0.06 0.00 0.00 57.16 57.35 1vna n GLU 23 Cb 0.53 -1.77 0.45 0.00 -0.06 0.00 0.00 31.44 30.58 1vna n GLU 23 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1vna h HIS 24 N 0.00 0.00 0.00 4.31 3.86 -1.99 -2.81 115.15 118.52 1vna h HIS 24 Ca -0.31 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 58.90 1vna h HIS 24 Cb 2.03 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 30.50 1vna h HIS 24 CO 0.00 0.00 -0.27 0.00 0.86 0.00 0.00 177.93 178.52 1vna h ASN 26 N -1.00 0.00 -0.20 0.00 -1.07 -1.66 0.58 115.58 112.24 1vna h ASN 26 Ca -0.00 0.00 -0.20 0.00 0.07 0.00 0.00 56.30 56.16 1vna h ASN 26 Cb 0.29 0.00 0.01 0.00 -2.07 0.00 0.00 38.32 36.54 1vna h ASN 26 CO -0.00 0.00 -0.68 0.00 0.07 0.00 0.00 177.43 176.82 1vna h THR 27 N 0.00 1.28 0.00 6.14 1.03 -1.61 -1.07 112.91 118.69 1vna h THR 27 Ca 0.05 -1.87 0.00 0.00 -0.01 0.00 0.00 66.41 64.58 1vna h THR 27 Cb 0.48 1.88 0.00 0.00 -1.07 0.00 0.00 68.15 69.44 1vna h THR 27 CO -0.00 0.60 0.00 -0.62 -0.01 0.00 0.00 175.52 175.49 1vna n GLU 28 N -3.99 0.13 -0.08 0.00 4.71 0.18 -2.40 120.64 119.19 1vna n GLU 28 Ca -0.07 0.43 -0.14 0.00 -0.01 0.00 0.00 57.16 57.37 1vna n GLU 28 Cb 0.70 -1.78 -0.14 0.00 -1.01 0.00 0.00 31.44 29.21 1vna n GLU 28 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1vna h LYS 30 N 0.01 0.00 -6.41 0.00 3.64 -0.84 -3.24 116.57 109.74 1vna h LYS 30 Ca -0.49 0.00 -0.58 0.00 -1.27 0.00 0.00 60.65 58.31 1vna h LYS 30 Cb 2.07 0.00 0.18 0.00 -0.41 0.00 0.00 32.23 34.07 1vna h LYS 30 CO 0.01 0.06 -0.62 0.00 -2.27 0.00 0.00 179.45 176.63 1vna n ALA 31 N -2.21 -1.84 0.80 5.00 0.00 -1.13 -4.69 120.51 116.43 1vna n ALA 31 Ca -0.02 -0.11 0.08 0.00 0.00 0.00 0.00 53.44 53.39 1vna n ALA 31 Cb 0.20 -1.71 0.42 0.00 0.00 0.00 0.00 19.45 18.35 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 0.23 0.24 -0.72 0.00 2.85 -1.26 -2.36 118.16 117.14 1vna n LYS 32 Ca 0.10 0.13 0.02 0.00 -1.05 0.00 0.00 58.31 57.50 1vna n LYS 32 Cb 0.48 -1.50 0.28 0.00 -0.65 0.00 0.00 35.03 33.65 1vna n LYS 32 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 1vna n ASN 33 N -1.28 4.44 0.11 -5.58 6.94 -1.26 -4.46 115.26 114.17 1vna n ASN 33 Ca 0.08 -2.78 0.00 0.00 -0.02 0.00 0.00 54.58 51.86 1vna n ASN 33 Cb 0.13 -0.66 0.00 0.00 -2.36 0.00 0.00 39.78 36.89 1vna n ASN 33 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1vna n GLN 34 N 0.30 0.00 0.00 -3.83 3.00 -0.99 -4.99 117.38 110.86 1vna n GLN 34 Ca 0.25 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.24 1vna n GLN 34 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 30.24 31.27 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 1.33 2.49 0.00 1.08 0.00 -1.18 -4.04 105.19 104.88 1vna n GLY 35 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.00 -3.00 2.01 -0.02 0.00 -0.71 -4.79 105.19 96.68 1vna n GLY 36 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.03 -0.24 -4.23 1.61 3.41 -1.26 -4.62 113.62 106.27 1vna n SER 37 Ca 0.00 0.14 -0.13 0.00 -0.26 0.00 0.00 58.87 58.62 1vna n SER 37 Cb 0.00 0.34 -0.10 0.00 -0.26 0.00 0.00 64.21 64.19 1vna n SER 37 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1vna s TYR 38 N -2.00 1.19 -0.09 7.33 2.02 -1.26 -4.78 117.35 119.76 1vna s TYR 38 Ca 0.00 -1.18 0.00 0.00 -0.37 0.00 0.00 57.07 55.52 1vna s TYR 38 Cb 0.00 -0.67 0.00 0.00 -0.40 0.00 0.00 41.96 40.89 1vna s TYR 38 CO 0.00 -0.40 0.00 0.41 -1.57 0.00 0.00 175.55 173.99 1vna n GLY 39 N -0.26 -0.99 0.00 0.71 0.00 -1.26 -1.67 105.19 101.72 1vna n GLY 39 Ca -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 0.15 0.00 -3.25 1.61 0.18 -1.12 -4.83 117.16 109.90 1vna n TYR 40 Ca 0.00 0.00 -0.39 0.00 1.88 0.00 0.00 57.90 59.39 1vna n TYR 40 Cb 0.00 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 38.89 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 1.94 3.71 0.00 0.00 5.04 -0.70 -3.83 117.35 123.51 1vna s TYR 42 Ca 0.22 -2.73 0.00 0.00 -2.44 0.00 0.00 57.07 52.12 1vna s TYR 42 Cb -0.15 -3.36 0.00 0.00 0.35 0.00 0.00 41.96 38.80 1vna s TYR 42 CO 0.09 -0.83 0.00 0.00 -1.34 0.00 0.00 175.55 173.47 1vna n ALA 43 N 3.03 0.00 -1.67 3.97 0.00 -1.26 -3.18 120.51 121.40 1vna n ALA 43 Ca 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.58 1vna n ALA 43 Cb 0.39 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.82 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 -3.64 0.00 3.72 -1.26 -4.89 117.46 111.39 1vna n PHE 44 Ca 0.00 -0.13 -0.15 0.00 -0.05 0.00 0.00 57.45 57.12 1vna n PHE 44 Cb 0.00 0.29 -0.14 0.00 -0.94 0.00 0.00 39.48 38.69 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 -0.40 0.98 4.37 0.00 -1.19 -1.78 121.76 123.74 1vna s ALA 45 Ca 0.00 0.74 -0.14 0.00 0.00 0.00 0.00 51.96 52.56 1vna s ALA 45 Cb 0.00 -0.99 0.04 0.00 0.00 0.00 0.00 23.12 22.17 1vna s ALA 45 CO 0.00 -0.68 0.30 0.00 0.00 0.00 0.00 175.76 175.38 1vna s TRP 47 N -2.36 0.67 0.12 0.00 -0.11 0.52 -2.92 118.94 114.85 1vna s TRP 47 Ca 0.56 -1.00 -0.16 0.00 1.22 0.00 0.00 56.10 56.73 1vna s TRP 47 Cb -0.19 -0.44 0.03 0.00 -1.50 0.00 0.00 33.47 31.37 1vna s TRP 47 CO 0.68 -0.28 0.40 0.00 -4.62 0.00 0.00 176.95 173.12 1vna n GLU 49 N -0.15 2.65 0.00 0.00 0.00 -0.67 -3.44 120.64 119.02 1vna n GLU 49 Ca -0.16 -4.64 0.00 0.00 0.00 0.00 0.00 57.16 52.36 1vna n GLU 49 Cb 0.63 -2.29 0.00 0.00 0.00 0.00 0.00 31.44 29.78 1vna n GLU 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1vna n GLY 50 N 1.09 2.62 3.27 8.31 0.00 -0.35 -4.01 105.19 116.12 1vna n GLY 50 Ca 0.28 0.01 0.03 0.00 0.00 0.00 0.00 46.02 46.34 1vna n GLY 50 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1vna s LEU 51 N 0.00 -0.89 1.13 0.99 2.96 -1.25 -1.74 118.68 119.88 1vna s LEU 51 Ca 0.00 0.78 -0.13 0.00 -0.22 0.00 0.00 54.13 54.56 1vna s LEU 51 Cb 0.00 1.83 0.25 0.00 0.50 0.00 0.00 46.19 48.77 1vna s LEU 51 CO 0.00 -0.17 0.93 -2.65 -1.32 0.00 0.00 176.35 173.14 1vna n PRO 52 N 5.34 -2.09 -0.04 0.98 -0.02 -1.26 -4.08 135.00 133.85 1vna n PRO 52 Ca -0.06 -0.57 -0.16 0.00 -2.02 0.00 0.00 63.50 60.69 1vna n PRO 52 Cb 0.52 -2.15 -0.05 0.00 -0.02 0.00 0.00 33.50 31.80 1vna n PRO 52 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1vna h GLU 53 N -2.51 0.81 -1.17 -0.52 4.39 -2.00 -3.13 114.58 110.45 1vna h GLU 53 Ca -0.58 -0.60 0.39 0.00 0.34 0.00 0.00 59.36 58.91 1vna h GLU 53 Cb 1.33 0.11 -0.14 0.00 -0.10 0.00 0.00 28.75 29.95 1vna h GLU 53 CO 0.47 1.22 0.73 1.03 -1.16 0.00 0.00 179.01 181.29 1vna h SER 54 N 0.58 0.34 -3.34 1.42 0.87 -2.02 -3.24 113.55 108.16 1vna h SER 54 Ca -0.03 0.16 -0.69 0.00 -1.23 0.00 0.00 61.79 60.00 1vna h SER 54 Cb 1.31 0.13 -0.19 0.00 -0.44 0.00 0.00 62.40 63.22 1vna h SER 54 CO 0.15 -0.18 -0.05 -0.89 -0.53 0.00 0.00 176.83 175.33 1vna s THR 55 N -5.43 4.96 0.37 2.23 2.01 -1.18 -5.03 115.64 113.57 1vna s THR 55 Ca -0.08 -0.51 -0.26 0.00 0.31 0.00 0.00 61.69 61.15 1vna s THR 55 Cb 0.30 -4.22 -0.12 0.00 0.01 0.00 0.00 72.50 68.47 1vna s THR 55 CO 0.81 -0.69 1.07 -2.65 -0.69 0.00 0.00 174.62 172.47 1vna n PRO 56 N 5.93 1.52 -4.47 4.92 -0.02 -1.22 -4.74 135.00 136.92 1vna n PRO 56 Ca -0.07 0.54 -0.24 0.00 -2.02 0.00 0.00 63.50 61.71 1vna n PRO 56 Cb 0.46 -2.05 -0.10 0.00 -0.02 0.00 0.00 33.50 31.78 1vna n PRO 56 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1vna s THR 57 N -1.18 2.39 0.32 3.45 2.01 -1.26 -4.78 115.64 116.59 1vna s THR 57 Ca 0.60 -2.37 -0.27 0.00 0.31 0.00 0.00 61.69 59.95 1vna s THR 57 Cb -0.60 -2.31 -0.09 0.00 0.01 0.00 0.00 72.50 69.51 1vna s THR 57 CO 0.59 -0.40 1.03 -0.47 -0.69 0.00 0.00 174.62 174.68 1vna s TYR 58 N -2.56 3.57 0.88 4.92 5.04 -1.21 -3.33 117.35 124.66 1vna s TYR 58 Ca 0.30 1.73 -0.11 0.00 -2.44 0.00 0.00 57.07 56.54 1vna s TYR 58 Cb -0.04 -3.13 0.12 0.00 0.35 0.00 0.00 41.96 39.26 1vna s TYR 58 CO 0.14 -0.29 1.09 -1.25 -1.34 0.00 0.00 175.55 173.91 1vna s PRO 59 N -1.82 1.37 -0.25 4.97 0.04 -1.26 -4.40 135.00 133.64 1vna s PRO 59 Ca 0.49 0.84 -0.14 0.00 0.04 0.00 0.00 61.00 62.23 1vna s PRO 59 Cb -0.26 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 1vna s PRO 59 CO 0.33 -2.17 0.32 -0.51 0.04 0.00 0.00 177.00 175.01 1vna s LEU 60 N -6.18 4.07 0.00 -3.56 1.02 -1.21 -4.92 118.68 107.89 1vna s LEU 60 Ca 0.63 0.26 0.06 0.00 0.02 0.00 0.00 54.13 55.10 1vna s LEU 60 Cb -0.18 -2.35 0.27 0.00 0.02 0.00 0.00 46.19 43.96 1vna s LEU 60 CO 0.57 -0.11 1.17 -0.81 0.02 0.00 0.00 176.35 177.19 1vna n PRO 61 N 4.99 0.01 -0.00 1.29 -0.04 -1.26 -1.66 135.00 138.33 1vna n PRO 61 Ca -0.10 0.37 0.03 0.00 -0.04 0.00 0.00 63.50 63.76 1vna n PRO 61 Cb 0.51 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.42 1vna n PRO 61 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1vna n ASN 62 N -1.47 2.42 -3.92 3.54 6.94 -1.26 -4.91 115.26 116.60 1vna n ASN 62 Ca 0.02 -0.21 -0.30 0.00 -0.02 0.00 0.00 54.58 54.07 1vna n ASN 62 Cb 0.07 1.21 -0.16 0.00 -2.36 0.00 0.00 39.78 38.55 1vna n ASN 62 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1vna s LYS 63 N -2.21 1.58 -1.21 -3.83 2.47 -0.66 -5.04 119.74 110.83 1vna s LYS 63 Ca -0.01 -0.86 -0.11 0.00 -1.56 0.00 0.00 55.97 53.43 1vna s LYS 63 Cb 0.05 -2.45 0.19 0.00 -1.46 0.00 0.00 37.83 34.16 1vna s LYS 63 CO 0.28 -0.56 1.56 0.43 0.16 0.00 0.00 175.35 177.23 1vna n SER 64 N 4.73 5.32 -0.15 1.43 7.64 -1.26 -3.71 113.62 127.63 1vna n SER 64 Ca -0.12 -3.07 0.15 0.00 1.01 0.00 0.00 58.87 56.84 1vna n SER 64 Cb 0.45 -1.49 0.82 0.00 -1.01 0.00 0.00 64.21 62.98 1vna n SER 64 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03