#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 2.28 0.00 1.64 2.02 -1.26 -2.82 118.70 120.56 1vna s GLU 2 Ca 0.00 -1.11 0.00 0.00 0.02 0.00 0.00 54.97 53.88 1vna s GLU 2 Cb 0.00 -2.51 0.00 0.00 0.10 0.00 0.00 34.13 31.72 1vna s GLU 2 CO 0.00 -0.89 0.00 0.41 0.02 0.00 0.00 175.26 174.80 1vna n GLY 3 N -2.40 1.28 3.75 -1.39 0.00 -1.13 -4.99 105.19 100.30 1vna n GLY 3 Ca 0.11 -0.40 -0.40 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.00 3.89 1.00 1.61 2.02 -1.26 -3.42 117.35 119.19 1vna s TYR 4 Ca 0.00 1.78 -0.15 0.00 -0.37 0.00 0.00 57.07 58.34 1vna s TYR 4 Cb 0.00 -2.96 0.19 0.00 -0.40 0.00 0.00 41.96 38.80 1vna s TYR 4 CO 0.00 0.36 1.16 -0.51 -1.57 0.00 0.00 175.55 174.99 1vna s LEU 5 N -0.62 1.76 0.00 -1.29 1.43 -1.20 -4.32 118.68 114.43 1vna s LEU 5 Ca 0.42 0.77 -0.01 0.00 -1.03 0.00 0.00 54.13 54.28 1vna s LEU 5 Cb -0.24 -2.87 0.00 0.00 0.03 0.00 0.00 46.19 43.11 1vna s LEU 5 CO 0.29 -3.05 0.04 0.52 0.23 0.00 0.00 176.35 174.38 1vna n VAL 6 N -4.06 0.00 -4.35 -1.59 0.31 -1.26 -2.44 118.33 104.93 1vna n VAL 6 Ca 0.10 -0.08 -0.31 0.00 -0.01 0.00 0.00 64.34 64.03 1vna n VAL 6 Cb 0.59 0.06 -0.16 0.00 -0.91 0.00 0.00 33.84 33.42 1vna n VAL 6 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1vna s LYS 7 N -2.03 2.66 0.63 5.55 1.02 -1.26 -4.76 119.74 121.55 1vna s LYS 7 Ca 0.01 -0.71 0.28 0.00 0.02 0.00 0.00 55.97 55.57 1vna s LYS 7 Cb -0.00 -2.26 1.45 0.00 -0.52 0.00 0.00 37.83 36.50 1vna s LYS 7 CO 0.01 -0.12 1.84 -0.22 -0.92 0.00 0.00 175.35 175.94 1vna h LYS 8 N 7.65 0.00 0.12 1.68 3.64 -2.01 0.38 116.57 128.02 1vna h LYS 8 Ca -0.36 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 1vna h LYS 8 Cb 1.16 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.96 1vna h LYS 8 CO 0.55 0.00 -0.28 1.03 -2.27 0.00 0.00 179.45 178.48 1vna h SER 9 N 0.00 -0.84 0.00 4.20 0.87 -2.01 -3.33 113.55 112.44 1vna h SER 9 Ca 0.10 0.08 -0.07 0.00 -1.23 0.00 0.00 61.79 60.67 1vna h SER 9 Cb 1.00 0.30 -0.14 0.00 -0.44 0.00 0.00 62.40 63.12 1vna h SER 9 CO -0.00 -0.32 -0.64 -0.90 -0.53 0.00 0.00 176.83 174.44 1vna n ASP 10 N -4.07 1.36 -3.04 6.23 5.68 -0.97 -4.70 116.55 117.05 1vna n ASP 10 Ca -0.05 -2.93 -0.05 0.00 -0.50 0.00 0.00 54.79 51.26 1vna n ASP 10 Cb 0.23 -0.40 -0.01 0.00 -1.14 0.00 0.00 41.12 39.80 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 -0.45 -0.04 0.10 6.12 0.00 0.13 -3.50 105.19 107.54 1vna n GLY 11 Ca 0.12 0.03 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 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 -4.44 0.00 -3.43 0.00 3.00 -1.26 -4.97 118.16 107.07 1vna n LYS 13 Ca -0.21 0.00 -0.37 0.00 -0.00 0.00 0.00 58.31 57.72 1vna n LYS 13 Cb 0.57 0.00 -0.07 0.00 0.00 0.00 0.00 35.03 35.52 1vna n LYS 13 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.40 176.93 1vna s TYR 14 N -1.73 3.43 0.42 5.64 5.04 -1.02 -4.68 117.35 124.43 1vna s TYR 14 Ca 0.00 0.65 0.08 0.00 -2.44 0.00 0.00 57.07 55.36 1vna s TYR 14 Cb 0.00 -2.47 0.01 0.00 0.35 0.00 0.00 41.96 39.85 1vna s TYR 14 CO 0.00 0.10 0.54 0.34 -1.34 0.00 0.00 175.55 175.20 1vna s ASP 15 N 0.79 5.59 -0.30 4.32 2.15 -1.26 -3.42 116.67 124.53 1vna s ASP 15 Ca 0.19 -0.46 -0.07 0.00 0.43 0.00 0.00 52.55 52.64 1vna s ASP 15 Cb -0.14 -0.66 0.16 0.00 -0.30 0.00 0.00 42.92 41.98 1vna s ASP 15 CO 0.07 -0.74 0.69 0.00 -0.17 0.00 0.00 175.17 175.02 1vna h PHE 17 N 7.95 0.29 -1.42 0.00 3.57 -1.94 -3.41 116.94 121.97 1vna h PHE 17 Ca -0.19 -0.21 -0.59 0.00 3.53 0.00 0.00 57.97 60.51 1vna h PHE 17 Cb 1.13 -0.01 -0.10 0.00 2.79 0.00 0.00 35.95 39.76 1vna h PHE 17 CO 0.14 1.31 1.38 -0.46 -2.23 0.00 0.00 178.31 178.45 1vna s TRP 18 N -2.61 2.50 0.31 0.41 -0.00 -1.26 -4.98 118.94 113.32 1vna s TRP 18 Ca -0.09 -0.70 -0.29 0.00 -0.00 0.00 0.00 56.10 55.02 1vna s TRP 18 Cb 0.07 -4.67 -0.10 0.00 -0.00 0.00 0.00 33.47 28.78 1vna s TRP 18 CO 0.83 -1.95 1.24 -0.51 -0.00 0.00 0.00 176.95 176.56 1vna s LEU 19 N 5.04 4.47 0.00 5.86 1.43 -1.26 -4.80 118.68 129.42 1vna s LEU 19 Ca 0.43 2.56 0.00 0.00 -1.03 0.00 0.00 54.13 56.09 1vna s LEU 19 Cb -0.02 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.56 1vna s LEU 19 CO -0.05 -0.41 0.00 0.61 0.23 0.00 0.00 176.35 176.73 1vna n GLY 20 N 0.94 0.74 3.58 -3.19 0.00 -1.26 -4.99 105.19 101.01 1vna n GLY 20 Ca -0.00 -2.09 -0.43 0.00 0.00 0.00 0.00 46.02 43.50 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 -0.93 3.61 0.16 1.61 1.02 -1.26 -4.34 119.74 119.61 1vna s LYS 21 Ca 0.00 0.34 0.01 0.00 0.02 0.00 0.00 55.97 56.34 1vna s LYS 21 Cb 0.00 -3.94 0.01 0.00 -0.52 0.00 0.00 37.83 33.38 1vna s LYS 21 CO 0.00 -1.39 0.08 0.09 -0.92 0.00 0.00 175.35 173.22 1vna n ASN 22 N 7.70 1.82 -1.00 2.83 3.02 -1.26 -5.03 115.26 123.34 1vna n ASN 22 Ca 0.09 -1.60 0.12 0.00 -0.03 0.00 0.00 54.58 53.16 1vna n ASN 22 Cb 0.49 0.03 0.12 0.00 -0.61 0.00 0.00 39.78 39.81 1vna n ASN 22 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1vna n GLU 23 N -0.72 2.35 0.00 3.52 2.13 -1.26 -4.24 120.64 122.42 1vna n GLU 23 Ca -0.03 -2.00 0.00 0.00 0.66 0.00 0.00 57.16 55.80 1vna n GLU 23 Cb 0.19 -1.47 0.00 0.00 0.27 0.00 0.00 31.44 30.43 1vna n GLU 23 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 1vna n HIS 24 N 1.37 0.00 0.28 4.31 8.25 -1.26 -2.52 115.22 125.65 1vna n HIS 24 Ca 0.15 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.77 1vna n HIS 24 Cb 0.60 -0.14 0.77 0.00 1.12 0.00 0.00 29.99 32.34 1vna n HIS 24 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1vna h ASN 26 N 0.00 0.23 -0.47 0.00 4.21 -1.74 -1.16 115.58 116.66 1vna h ASN 26 Ca 0.05 -0.94 0.11 0.00 1.21 0.00 0.00 56.30 56.73 1vna h ASN 26 Cb 0.82 -0.07 -0.02 0.00 -1.12 0.00 0.00 38.32 37.92 1vna h ASN 26 CO -0.00 1.24 0.33 0.74 -1.29 0.00 0.00 177.43 178.45 1vna h THR 27 N -0.68 0.82 0.00 2.81 2.02 -0.93 0.01 112.91 116.96 1vna h THR 27 Ca -0.10 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.04 1vna h THR 27 Cb 1.35 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 68.45 1vna h THR 27 CO 0.06 0.02 0.00 -0.62 0.37 0.00 0.00 175.52 175.35 1vna n GLU 28 N -4.43 0.00 0.15 6.66 -0.58 -1.09 -2.92 120.64 118.42 1vna n GLU 28 Ca 0.08 0.04 0.18 0.00 -0.42 0.00 0.00 57.16 57.04 1vna n GLU 28 Cb 0.46 -0.43 0.68 0.00 -0.57 0.00 0.00 31.44 31.57 1vna n GLU 28 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1vna n LYS 30 N -3.32 0.67 -1.11 0.00 3.00 -0.03 -3.24 118.16 114.13 1vna n LYS 30 Ca 0.06 0.13 -0.36 0.00 -0.00 0.00 0.00 58.31 58.13 1vna n LYS 30 Cb 0.69 -1.55 0.05 0.00 0.00 0.00 0.00 35.03 34.21 1vna n LYS 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1vna n ALA 31 N -3.08 -3.49 0.86 3.14 0.00 -0.54 -4.73 120.51 112.67 1vna n ALA 31 Ca -0.40 -0.39 0.13 0.00 0.00 0.00 0.00 53.44 52.77 1vna n ALA 31 Cb 1.04 -1.47 0.34 0.00 0.00 0.00 0.00 19.45 19.36 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 0.91 0.10 -0.16 0.00 2.85 -1.26 -3.31 118.16 117.28 1vna n LYS 32 Ca 0.05 0.04 0.09 0.00 -1.05 0.00 0.00 58.31 57.44 1vna n LYS 32 Cb 0.52 -1.57 0.41 0.00 -0.65 0.00 0.00 35.03 33.73 1vna n LYS 32 CO 0.00 0.00 0.00 -2.95 -0.05 0.00 0.00 177.40 174.40 1vna h ASN 33 N 0.00 0.56 0.00 -5.58 7.08 -1.90 -3.26 115.58 112.49 1vna h ASN 33 Ca 0.00 0.01 -0.01 0.00 -3.08 0.00 0.00 56.30 53.22 1vna h ASN 33 Cb 0.58 -0.11 -0.00 0.00 -2.08 0.00 0.00 38.32 36.71 1vna h ASN 33 CO 0.00 0.34 -0.87 0.00 -2.08 0.00 0.00 177.43 174.82 1vna n GLN 34 N -4.49 0.51 0.00 4.14 6.02 -1.24 -5.04 117.38 117.27 1vna n GLN 34 Ca 0.11 0.31 0.00 0.00 -0.01 0.00 0.00 57.00 57.41 1vna n GLN 34 Cb 0.31 -1.51 0.00 0.00 1.02 0.00 0.00 30.24 30.05 1vna n GLN 34 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1vna n GLY 35 N 1.50 1.99 0.00 1.08 0.00 -1.21 -4.89 105.19 103.67 1vna n GLY 35 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.46 -1.12 1.64 -0.02 0.00 -1.20 -4.91 105.19 99.12 1vna n GLY 36 Ca 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.41 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 -1.36 0.01 -3.81 1.61 3.41 -1.21 -4.85 113.62 107.42 1vna n SER 37 Ca 0.00 0.01 -0.13 0.00 -0.26 0.00 0.00 58.87 58.49 1vna n SER 37 Cb 0.00 0.01 -0.14 0.00 -0.26 0.00 0.00 64.21 63.82 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 -0.10 -0.01 7.33 2.02 -1.26 -4.84 117.35 118.48 1vna s TYR 38 Ca 0.00 0.30 0.02 0.00 -0.37 0.00 0.00 57.07 57.01 1vna s TYR 38 Cb 0.00 -0.02 0.00 0.00 -0.40 0.00 0.00 41.96 41.54 1vna s TYR 38 CO 0.00 -0.08 -0.06 0.20 -1.57 0.00 0.00 175.55 174.04 1vna s GLY 39 N 0.45 0.35 0.00 0.71 0.00 -1.26 -3.44 107.32 104.13 1vna s GLY 39 Ca -0.03 -0.23 0.00 0.00 0.00 0.00 0.00 44.72 44.46 1vna s GLY 39 CO -0.02 -0.08 0.00 1.58 0.00 0.00 0.00 173.10 174.58 1vna n TYR 40 N 3.17 -0.25 -4.30 1.90 4.11 -0.78 -4.47 117.16 116.54 1vna n TYR 40 Ca -0.16 0.00 -0.35 0.00 -0.00 0.00 0.00 57.90 57.39 1vna n TYR 40 Cb 0.56 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.80 1vna n TYR 40 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1vna s TYR 42 N -0.46 3.23 0.00 0.00 6.14 -0.56 -4.81 117.35 120.89 1vna s TYR 42 Ca 0.08 -3.10 0.00 0.00 0.64 0.00 0.00 57.07 54.70 1vna s TYR 42 Cb -0.12 -2.89 0.00 0.00 0.42 0.00 0.00 41.96 39.37 1vna s TYR 42 CO 0.02 -0.76 0.00 0.00 0.64 0.00 0.00 175.55 175.45 1vna n ALA 43 N 3.17 0.00 -1.58 3.97 0.00 -1.26 -3.33 120.51 121.48 1vna n ALA 43 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.49 1vna n ALA 43 Cb 0.33 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.77 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 -4.41 0.00 3.72 -1.26 -4.99 117.46 110.52 1vna n PHE 44 Ca 0.00 -0.06 -0.23 0.00 -0.05 0.00 0.00 57.45 57.10 1vna n PHE 44 Cb 0.00 0.25 -0.08 0.00 -0.94 0.00 0.00 39.48 38.71 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 2.46 -0.05 4.37 0.00 -1.21 -1.20 121.76 126.13 1vna s ALA 45 Ca 0.00 -1.61 -0.11 0.00 0.00 0.00 0.00 51.96 50.23 1vna s ALA 45 Cb 0.00 1.13 -0.05 0.00 0.00 0.00 0.00 23.12 24.20 1vna s ALA 45 CO 0.00 -0.51 0.30 0.00 0.00 0.00 0.00 175.76 175.55 1vna s TRP 47 N -1.05 0.93 -0.01 0.00 -0.11 -0.45 -3.22 118.94 115.03 1vna s TRP 47 Ca 0.20 -0.32 0.02 0.00 1.22 0.00 0.00 56.10 57.22 1vna s TRP 47 Cb -0.15 -0.84 -0.00 0.00 -1.50 0.00 0.00 33.47 30.98 1vna s TRP 47 CO 0.09 -0.29 -0.06 0.00 -4.62 0.00 0.00 176.95 172.07 1vna s GLU 49 N -0.05 2.67 0.00 0.00 1.03 -1.22 -2.84 118.70 118.29 1vna s GLU 49 Ca 0.01 -0.65 0.00 0.00 0.03 0.00 0.00 54.97 54.37 1vna s GLU 49 Cb -0.04 -2.58 0.00 0.00 -0.80 0.00 0.00 34.13 30.71 1vna s GLU 49 CO -0.00 0.62 0.00 0.41 -1.33 0.00 0.00 175.26 174.96 1vna n GLY 50 N 1.63 0.48 3.48 -3.83 0.00 -1.13 -3.72 105.19 102.11 1vna n GLY 50 Ca -0.16 -0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 1vna n GLY 50 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vna s LEU 51 N -0.80 3.27 0.96 0.99 2.01 -1.13 -4.31 118.68 119.68 1vna s LEU 51 Ca 0.00 -0.15 -0.11 0.00 0.01 0.00 0.00 54.13 53.88 1vna s LEU 51 Cb 0.00 -1.80 0.15 0.00 0.01 0.00 0.00 46.19 44.55 1vna s LEU 51 CO 0.00 0.13 1.01 -2.65 1.01 0.00 0.00 176.35 175.84 1vna n PRO 52 N 3.81 -0.73 0.07 1.29 -0.02 -1.26 -4.75 135.00 133.42 1vna n PRO 52 Ca -0.17 -0.15 -0.09 0.00 -2.02 0.00 0.00 63.50 61.07 1vna n PRO 52 Cb 0.52 -2.27 -0.10 0.00 -0.02 0.00 0.00 33.50 31.63 1vna n PRO 52 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1vna h GLU 53 N -1.97 0.06 0.00 -0.52 4.11 -2.00 -3.12 114.58 111.15 1vna h GLU 53 Ca -0.46 -0.10 0.00 0.00 0.07 0.00 0.00 59.36 58.87 1vna h GLU 53 Cb 1.28 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.57 1vna h GLU 53 CO 0.41 1.02 0.00 -1.13 0.07 0.00 0.00 179.01 179.38 1vna n SER 54 N -3.42 0.00 -4.81 3.06 3.41 -1.26 -4.79 113.62 105.81 1vna n SER 54 Ca -0.02 -1.66 -0.38 0.00 -0.26 0.00 0.00 58.87 56.55 1vna n SER 54 Cb 0.93 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.82 1vna n SER 54 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1vna s THR 55 N -2.00 4.97 -0.14 6.66 2.01 -1.18 -5.00 115.64 120.96 1vna s THR 55 Ca 0.12 0.96 -0.29 0.00 0.31 0.00 0.00 61.69 62.79 1vna s THR 55 Cb 0.06 -3.78 -0.05 0.00 0.01 0.00 0.00 72.50 68.73 1vna s THR 55 CO 0.09 0.54 1.96 -2.16 -0.69 0.00 0.00 174.62 174.36 1vna s PRO 56 N -0.85 3.65 -0.21 4.92 0.04 -1.26 -4.94 135.00 136.35 1vna s PRO 56 Ca 0.25 2.10 -0.27 0.00 0.04 0.00 0.00 61.00 63.12 1vna s PRO 56 Cb -0.17 -4.21 0.10 0.00 0.04 0.00 0.00 34.50 30.27 1vna s PRO 56 CO 0.14 -1.50 0.90 0.99 0.04 0.00 0.00 177.00 177.58 1vna s THR 57 N 6.15 0.00 0.40 1.26 2.01 -1.26 -5.00 115.64 119.21 1vna s THR 57 Ca 0.88 0.00 -0.22 0.00 0.31 0.00 0.00 61.69 62.65 1vna s THR 57 Cb -0.33 -1.00 -0.14 0.00 0.01 0.00 0.00 72.50 71.04 1vna s THR 57 CO 0.35 0.00 0.42 0.00 -0.69 0.00 0.00 174.62 174.70 1vna n TYR 58 N 1.70 -0.94 -1.10 4.92 9.36 -1.26 -4.33 117.16 125.51 1vna n TYR 58 Ca -0.13 0.63 -0.30 0.00 3.32 0.00 0.00 57.90 61.42 1vna n TYR 58 Cb 0.56 -1.93 0.14 0.00 -0.63 0.00 0.00 39.34 37.48 1vna n TYR 58 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 1vna s PRO 59 N -1.38 1.30 -0.19 2.98 0.04 -1.26 -4.91 135.00 131.58 1vna s PRO 59 Ca 0.62 1.01 -0.01 0.00 0.04 0.00 0.00 61.00 62.66 1vna s PRO 59 Cb -0.63 -1.80 0.05 0.00 0.04 0.00 0.00 34.50 32.16 1vna s PRO 59 CO 0.59 -2.26 -0.03 -1.17 0.04 0.00 0.00 177.00 174.17 1vna s LEU 60 N -6.28 1.83 0.43 -3.56 2.96 -1.26 -5.10 118.68 107.70 1vna s LEU 60 Ca 0.64 -0.87 -0.25 0.00 -0.22 0.00 0.00 54.13 53.43 1vna s LEU 60 Cb -0.19 -0.93 -0.08 0.00 0.50 0.00 0.00 46.19 45.49 1vna s LEU 60 CO 0.57 -0.23 1.34 -2.16 -1.32 0.00 0.00 176.35 174.55 1vna s PRO 61 N 1.61 3.82 -0.53 0.98 0.04 -1.26 -3.63 135.00 136.02 1vna s PRO 61 Ca -0.02 2.22 -0.02 0.00 0.04 0.00 0.00 61.00 63.23 1vna s PRO 61 Cb -0.17 -2.68 -0.02 0.00 0.04 0.00 0.00 34.50 31.67 1vna s PRO 61 CO -0.07 -0.64 0.46 0.09 0.04 0.00 0.00 177.00 176.88 1vna n ASN 62 N -0.07 -3.39 -2.99 6.66 3.02 -1.26 -5.06 115.26 112.17 1vna n ASN 62 Ca 0.05 -0.33 -0.12 0.00 -0.03 0.00 0.00 54.58 54.15 1vna n ASN 62 Cb 0.43 -2.76 -0.02 0.00 -0.61 0.00 0.00 39.78 36.82 1vna n ASN 62 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1vna n LYS 63 N -2.40 1.54 -2.71 3.52 -0.00 -1.24 -5.06 118.16 111.81 1vna n LYS 63 Ca -0.07 -1.38 -0.06 0.00 -0.00 0.00 0.00 58.31 56.80 1vna n LYS 63 Cb 0.57 0.37 0.05 0.00 -0.00 0.00 0.00 35.03 36.01 1vna n LYS 63 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1vna n SER 64 N -1.11 1.06 -0.89 -5.58 3.41 -1.26 -5.04 113.62 104.21 1vna n SER 64 Ca -0.08 -2.48 0.12 0.00 -0.26 0.00 0.00 58.87 56.18 1vna n SER 64 Cb 0.24 -0.33 0.17 0.00 -0.26 0.00 0.00 64.21 64.03 1vna n SER 64 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88