#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 1.53 0.00 -1.58 -1.05 -1.26 -3.32 118.70 113.02 1vna s GLU 2 Ca 0.00 -0.99 0.00 0.00 -0.15 0.00 0.00 54.97 53.83 1vna s GLU 2 Cb 0.00 0.53 0.00 0.00 -0.44 0.00 0.00 34.13 34.22 1vna s GLU 2 CO 0.00 -0.66 0.00 0.41 0.95 0.00 0.00 175.26 175.96 1vna n GLY 3 N -0.38 -0.37 3.77 -3.83 0.00 -0.64 -5.00 105.19 98.74 1vna n GLY 3 Ca -0.06 -1.45 -0.38 0.00 0.00 0.00 0.00 46.02 44.13 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 -2.75 3.70 1.23 1.61 2.02 -1.26 -2.08 117.35 119.81 1vna s TYR 4 Ca 0.00 1.79 -0.18 0.00 -0.37 0.00 0.00 57.07 58.31 1vna s TYR 4 Cb 0.00 -2.97 0.25 0.00 -0.40 0.00 0.00 41.96 38.84 1vna s TYR 4 CO 0.00 0.13 0.61 1.28 -1.57 0.00 0.00 175.55 176.00 1vna n LEU 5 N 0.68 -1.56 -4.42 -1.29 4.77 -1.12 -4.12 117.00 109.94 1vna n LEU 5 Ca 0.01 -0.39 -0.30 0.00 -0.03 0.00 0.00 56.01 55.30 1vna n LEU 5 Cb 0.49 -1.03 -0.13 0.00 -2.33 0.00 0.00 43.42 40.42 1vna n LEU 5 CO 0.46 -3.60 -0.53 0.54 -1.33 0.00 0.00 177.39 172.92 1vna s VAL 6 N -2.23 2.50 0.03 4.08 0.11 -1.26 0.40 120.40 124.03 1vna s VAL 6 Ca 0.60 -1.43 -0.14 0.00 -2.93 0.00 0.00 61.98 58.08 1vna s VAL 6 Cb -0.16 -2.07 -0.06 0.00 -1.53 0.00 0.00 36.38 32.57 1vna s VAL 6 CO 0.59 0.25 0.42 -0.75 -3.33 0.00 0.00 175.10 172.27 1vna s LYS 7 N -1.66 3.89 0.21 1.54 2.20 -0.93 -4.71 119.74 120.30 1vna s LYS 7 Ca 0.14 0.38 0.19 0.00 -0.36 0.00 0.00 55.97 56.32 1vna s LYS 7 Cb -0.10 -3.15 0.88 0.00 -1.51 0.00 0.00 37.83 33.95 1vna s LYS 7 CO 0.05 0.65 1.59 1.63 -0.36 0.00 0.00 175.35 178.91 1vna n LYS 8 N 1.56 0.13 0.16 4.03 4.01 -1.26 -2.20 118.16 124.59 1vna n LYS 8 Ca -0.12 0.47 -0.16 0.00 -0.51 0.00 0.00 58.31 57.99 1vna n LYS 8 Cb 0.52 -1.81 -0.09 0.00 -0.51 0.00 0.00 35.03 33.15 1vna n LYS 8 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 1vna h SER 9 N 0.00 -1.38 0.00 4.39 0.87 -1.98 -3.42 113.55 112.03 1vna h SER 9 Ca 0.00 0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 1vna h SER 9 Cb 0.21 0.49 0.00 0.00 -0.44 0.00 0.00 62.40 62.66 1vna h SER 9 CO 0.00 -0.55 0.00 -0.90 -0.53 0.00 0.00 176.83 174.85 1vna n ASP 10 N -5.20 0.00 0.00 6.23 5.68 -1.21 -5.04 116.55 117.01 1vna n ASP 10 Ca -0.09 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.20 1vna n ASP 10 Cb 0.39 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.37 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 -0.05 0.00 6.12 0.00 -0.93 -4.78 105.19 105.90 1vna n GLY 11 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1vna n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vna s LYS 13 N -1.01 2.10 -0.20 0.00 0.00 -1.26 -2.18 119.74 117.19 1vna s LYS 13 Ca 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 55.97 56.00 1vna s LYS 13 Cb 0.00 -1.99 -0.03 0.00 0.00 0.00 0.00 37.83 35.81 1vna s LYS 13 CO 0.00 -1.48 0.02 -0.47 0.00 0.00 0.00 175.35 173.42 1vna s TYR 14 N -3.50 3.08 0.68 1.78 6.14 0.16 -3.92 117.35 121.77 1vna s TYR 14 Ca 0.61 -0.35 -0.10 0.00 0.64 0.00 0.00 57.07 57.87 1vna s TYR 14 Cb -0.11 -2.10 0.01 0.00 0.42 0.00 0.00 41.96 40.19 1vna s TYR 14 CO 0.49 -0.17 1.06 0.34 0.64 0.00 0.00 175.55 177.90 1vna s ASP 15 N 0.94 5.45 0.08 4.32 2.15 -1.26 -3.23 116.67 125.12 1vna s ASP 15 Ca 0.02 1.03 -0.05 0.00 0.43 0.00 0.00 52.55 53.98 1vna s ASP 15 Cb -0.14 -1.86 -0.02 0.00 -0.30 0.00 0.00 42.92 40.59 1vna s ASP 15 CO 0.02 -1.30 0.09 0.00 -0.17 0.00 0.00 175.17 173.81 1vna n PHE 17 N 0.00 0.00 -1.34 0.00 7.35 -1.26 -4.13 117.46 118.08 1vna n PHE 17 Ca -0.13 0.00 -0.59 0.00 -0.76 0.00 0.00 57.45 55.97 1vna n PHE 17 Cb 0.62 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 40.34 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 -1.28 1.29 -3.00 -5.13 -0.00 -1.26 -4.88 117.44 103.18 1vna n TRP 18 Ca 0.00 0.85 -0.33 0.00 -0.00 0.00 0.00 57.50 58.02 1vna n TRP 18 Cb 0.00 -2.11 -0.06 0.00 -0.00 0.00 0.00 31.31 29.14 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 4.50 4.06 0.00 5.87 1.43 -1.26 -4.64 118.68 128.64 1vna s LEU 19 Ca 1.06 1.46 0.00 0.00 -1.03 0.00 0.00 54.13 55.63 1vna s LEU 19 Cb -1.40 -4.20 0.00 0.00 0.03 0.00 0.00 46.19 40.63 1vna s LEU 19 CO 0.67 -0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.63 1vna n GLY 20 N -0.32 -1.98 3.76 -3.19 0.00 -1.08 -4.94 105.19 97.44 1vna n GLY 20 Ca 0.04 -2.07 -0.41 0.00 0.00 0.00 0.00 46.02 43.57 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 -0.14 4.14 -0.30 1.61 1.02 -1.26 -2.42 119.74 122.39 1vna s LYS 21 Ca 0.00 2.53 0.03 0.00 0.02 0.00 0.00 55.97 58.55 1vna s LYS 21 Cb 0.00 -3.01 0.08 0.00 -0.52 0.00 0.00 37.83 34.38 1vna s LYS 21 CO 0.00 -0.55 -0.02 1.21 -0.92 0.00 0.00 175.35 175.08 1vna s ASN 22 N 0.14 4.53 0.57 2.83 3.84 -1.26 -4.89 114.94 120.69 1vna s ASN 22 Ca 0.57 -1.76 0.34 0.00 0.21 0.00 0.00 52.86 52.23 1vna s ASN 22 Cb -0.46 -1.52 1.62 0.00 -0.55 0.00 0.00 41.25 40.34 1vna s ASN 22 CO 0.55 -0.30 2.09 -0.08 -2.79 0.00 0.00 177.10 176.57 1vna h GLU 23 N 7.73 0.00 0.00 0.43 4.81 -1.98 -1.24 114.58 124.32 1vna h GLU 23 Ca -0.11 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.05 1vna h GLU 23 Cb 1.03 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 1vna h GLU 23 CO 0.49 0.04 -0.40 1.25 -0.73 0.00 0.00 179.01 179.66 1vna h HIS 24 N 0.00 0.00 0.00 0.92 2.76 -1.99 -2.36 115.15 114.48 1vna h HIS 24 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1vna h HIS 24 Cb 0.37 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.33 1vna h HIS 24 CO 0.00 1.08 0.00 0.00 -1.30 0.00 0.00 177.93 177.71 1vna h ASN 26 N 0.00 0.00 -0.99 0.00 4.21 -1.30 -3.09 115.58 114.41 1vna h ASN 26 Ca 0.00 -0.37 0.17 0.00 1.21 0.00 0.00 56.30 57.31 1vna h ASN 26 Cb 0.30 0.00 -0.09 0.00 -1.12 0.00 0.00 38.32 37.40 1vna h ASN 26 CO 0.00 0.99 0.62 0.00 -1.29 0.00 0.00 177.43 177.75 1vna h THR 27 N -1.00 0.77 -0.16 2.81 1.03 -1.35 0.34 112.91 115.35 1vna h THR 27 Ca -0.11 -0.27 -0.09 0.00 -0.01 0.00 0.00 66.41 65.93 1vna h THR 27 Cb 0.77 -0.09 -0.01 0.00 -1.07 0.00 0.00 68.15 67.75 1vna h THR 27 CO -0.07 0.14 -0.28 1.05 -0.01 0.00 0.00 175.52 176.36 1vna h GLU 28 N 0.79 0.31 0.00 0.00 -0.00 -1.59 -2.06 114.58 112.03 1vna h GLU 28 Ca 0.54 -0.11 0.00 0.00 -0.00 0.00 0.00 59.36 59.79 1vna h GLU 28 Cb 0.80 -0.02 0.00 0.00 -0.00 0.00 0.00 28.75 29.53 1vna h GLU 28 CO -0.32 0.57 0.00 0.00 -0.00 0.00 0.00 179.01 179.26 1vna n LYS 30 N -2.62 2.36 -0.21 0.00 2.85 -0.26 -2.12 118.16 118.17 1vna n LYS 30 Ca 0.04 -1.99 -0.26 0.00 -1.05 0.00 0.00 58.31 55.04 1vna n LYS 30 Cb 0.42 -1.47 0.25 0.00 -0.65 0.00 0.00 35.03 33.59 1vna n LYS 30 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1vna n ALA 31 N 1.38 -4.54 0.18 0.58 0.00 -0.89 -4.40 120.51 112.82 1vna n ALA 31 Ca 0.15 -1.32 0.07 0.00 0.00 0.00 0.00 53.44 52.34 1vna n ALA 31 Cb 0.60 -0.12 0.12 0.00 0.00 0.00 0.00 19.45 20.05 1vna n ALA 31 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1vna h LYS 32 N 0.00 0.00 0.00 0.00 5.09 -1.93 -1.80 116.57 117.93 1vna h LYS 32 Ca -0.34 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.40 1vna h LYS 32 Cb 1.14 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.47 1vna h LYS 32 CO 0.20 0.28 0.00 0.27 -2.09 0.00 0.00 179.45 178.12 1vna n ASN 33 N -3.18 0.36 0.00 7.07 6.94 -1.26 -4.27 115.26 120.92 1vna n ASN 33 Ca 0.03 0.63 0.00 0.00 -0.02 0.00 0.00 54.58 55.22 1vna n ASN 33 Cb 0.63 -0.69 0.00 0.00 -2.36 0.00 0.00 39.78 37.36 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 -1.94 0.00 0.00 -3.83 6.02 -1.16 -5.01 117.38 111.46 1vna n GLN 34 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 1vna n GLN 34 Cb 0.10 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.36 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 2.63 0.92 0.00 1.08 0.00 -0.69 -4.46 105.19 104.68 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 0.00 5.34 0.00 -0.02 0.00 -0.90 -4.38 105.19 105.23 1vna n GLY 36 Ca 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.55 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 0.00 0.00 -4.77 1.61 3.41 -1.26 -3.92 113.62 108.69 1vna n SER 37 Ca 0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.23 1vna n SER 37 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 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 0.00 3.62 -3.27 7.33 2.02 -1.26 -4.85 117.35 120.94 1vna s TYR 38 Ca 0.00 1.76 0.00 0.00 -0.37 0.00 0.00 57.07 58.46 1vna s TYR 38 Cb 0.00 -3.06 0.00 0.00 -0.40 0.00 0.00 41.96 38.50 1vna s TYR 38 CO 0.00 -0.11 0.00 0.41 -1.57 0.00 0.00 175.55 174.28 1vna n GLY 39 N 0.80 -1.67 0.00 0.71 0.00 -1.26 -3.28 105.19 100.49 1vna n GLY 39 Ca 0.01 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.91 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 3.68 -0.01 -3.92 1.61 4.11 -1.11 -4.79 117.16 116.72 1vna n TYR 40 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.90 57.60 1vna n TYR 40 Cb 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 39.34 39.18 1vna n TYR 40 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1vna n TYR 42 N 4.73 -2.87 -0.16 0.00 9.36 -0.86 -2.65 117.16 124.70 1vna n TYR 42 Ca -0.12 0.00 -0.00 0.00 3.32 0.00 0.00 57.90 61.10 1vna n TYR 42 Cb 0.45 0.00 0.02 0.00 -0.63 0.00 0.00 39.34 39.18 1vna n TYR 42 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1vna n ALA 43 N -3.00 -0.04 -2.70 2.98 0.00 -1.26 -3.39 120.51 113.10 1vna n ALA 43 Ca 0.00 0.43 -0.07 0.00 0.00 0.00 0.00 53.44 53.80 1vna n ALA 43 Cb 0.00 -0.20 0.09 0.00 0.00 0.00 0.00 19.45 19.34 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 -4.63 -2.17 -3.53 0.00 3.72 -1.26 -4.88 117.46 104.72 1vna n PHE 44 Ca 0.05 -1.73 -0.01 0.00 -0.05 0.00 0.00 57.45 55.71 1vna n PHE 44 Cb 0.17 1.52 -0.05 0.00 -0.94 0.00 0.00 39.48 40.19 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 0.19 -2.45 -0.08 4.37 0.00 -1.22 -2.04 121.76 120.52 1vna s ALA 45 Ca 0.20 2.15 -0.29 0.00 0.00 0.00 0.00 51.96 54.02 1vna s ALA 45 Cb 0.31 -1.87 -0.02 0.00 0.00 0.00 0.00 23.12 21.54 1vna s ALA 45 CO -0.08 -0.69 0.96 0.00 0.00 0.00 0.00 175.76 175.95 1vna s TRP 47 N 1.70 3.37 0.03 0.00 -0.11 -1.13 -2.81 118.94 119.99 1vna s TRP 47 Ca 0.47 0.23 -0.03 0.00 1.22 0.00 0.00 56.10 57.99 1vna s TRP 47 Cb -0.19 -1.75 -0.02 0.00 -1.50 0.00 0.00 33.47 30.02 1vna s TRP 47 CO 0.20 0.58 0.04 0.00 -4.62 0.00 0.00 176.95 173.15 1vna s GLU 49 N -2.27 0.98 0.00 0.00 -1.05 -1.21 -1.62 118.70 113.54 1vna s GLU 49 Ca -0.08 0.10 0.00 0.00 -0.15 0.00 0.00 54.97 54.84 1vna s GLU 49 Cb -0.03 0.46 0.00 0.00 -0.44 0.00 0.00 34.13 34.11 1vna s GLU 49 CO -0.03 -0.31 0.00 0.41 0.95 0.00 0.00 175.26 176.28 1vna n GLY 50 N 0.90 1.25 3.38 -3.83 0.00 -1.21 -4.27 105.19 101.40 1vna n GLY 50 Ca -0.19 -0.04 -0.24 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.04 2.46 0.76 0.99 2.34 -1.25 -4.16 118.68 119.78 1vna s LEU 51 Ca 0.00 -0.89 -0.14 0.00 0.06 0.00 0.00 54.13 53.16 1vna s LEU 51 Cb 0.00 -0.98 0.06 0.00 -0.56 0.00 0.00 46.19 44.70 1vna s LEU 51 CO 0.00 0.03 1.21 -2.16 -1.06 0.00 0.00 176.35 174.37 1vna s PRO 52 N -2.85 1.92 0.00 1.48 0.04 -1.26 -2.44 135.00 131.89 1vna s PRO 52 Ca 0.19 1.78 0.28 0.00 0.04 0.00 0.00 61.00 63.29 1vna s PRO 52 Cb -0.06 -1.81 1.61 0.00 0.04 0.00 0.00 34.50 34.29 1vna s PRO 52 CO 0.09 -2.01 2.04 -0.85 0.04 0.00 0.00 177.00 176.32 1vna n GLU 53 N -2.95 1.04 0.06 4.56 0.28 -1.26 -3.19 120.64 119.18 1vna n GLU 53 Ca 0.14 -0.06 0.13 0.00 -0.16 0.00 0.00 57.16 57.21 1vna n GLU 53 Cb 0.50 -1.43 0.44 0.00 1.43 0.00 0.00 31.44 32.37 1vna n GLU 53 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1vna n SER 54 N -0.87 0.54 -4.86 -1.84 3.41 -1.26 -4.78 113.62 103.96 1vna n SER 54 Ca 0.21 0.46 -0.37 0.00 -0.26 0.00 0.00 58.87 58.90 1vna n SER 54 Cb 0.11 -0.54 -0.06 0.00 -0.26 0.00 0.00 64.21 63.45 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 -3.07 5.34 0.16 6.66 2.01 -1.19 -5.05 115.64 120.50 1vna s THR 55 Ca 0.11 0.43 -0.31 0.00 0.31 0.00 0.00 61.69 62.22 1vna s THR 55 Cb 0.15 -3.51 -0.09 0.00 0.01 0.00 0.00 72.50 69.06 1vna s THR 55 CO 0.60 0.60 1.50 -2.16 -0.69 0.00 0.00 174.62 174.47 1vna s PRO 56 N -1.02 4.25 -0.15 4.92 0.04 -1.26 -5.00 135.00 136.77 1vna s PRO 56 Ca 0.18 2.27 -0.04 0.00 0.04 0.00 0.00 61.00 63.45 1vna s PRO 56 Cb -0.14 -3.18 0.07 0.00 0.04 0.00 0.00 34.50 31.29 1vna s PRO 56 CO 0.07 -0.54 0.14 0.95 0.04 0.00 0.00 177.00 177.66 1vna s THR 57 N 1.04 -0.20 0.04 1.26 -4.23 -1.26 -4.91 115.64 107.38 1vna s THR 57 Ca 0.67 0.01 -0.38 0.00 -1.18 0.00 0.00 61.69 60.81 1vna s THR 57 Cb -0.41 -0.51 -0.19 0.00 1.34 0.00 0.00 72.50 72.72 1vna s THR 57 CO 0.32 -0.13 1.06 0.00 -0.54 0.00 0.00 174.62 175.33 1vna n TYR 58 N 5.30 0.70 -1.16 3.99 9.36 -1.26 -4.25 117.16 129.84 1vna n TYR 58 Ca -0.06 0.97 -0.30 0.00 3.32 0.00 0.00 57.90 61.83 1vna n TYR 58 Cb 0.49 -2.12 0.13 0.00 -0.63 0.00 0.00 39.34 37.21 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 -0.04 1.42 -0.21 2.98 0.04 -1.26 -4.44 135.00 133.49 1vna s PRO 59 Ca 0.87 0.95 -0.04 0.00 0.04 0.00 0.00 61.00 62.82 1vna s PRO 59 Cb -1.17 -1.82 -0.01 0.00 0.04 0.00 0.00 34.50 31.54 1vna s PRO 59 CO 0.55 -2.17 -0.04 -1.17 0.04 0.00 0.00 177.00 174.21 1vna s LEU 60 N -6.20 2.95 0.00 -3.56 2.96 -1.26 -4.96 118.68 108.60 1vna s LEU 60 Ca 0.63 -0.35 0.17 0.00 -0.22 0.00 0.00 54.13 54.36 1vna s LEU 60 Cb -0.18 -1.74 0.93 0.00 0.50 0.00 0.00 46.19 45.70 1vna s LEU 60 CO 0.57 0.01 1.47 -0.81 -1.32 0.00 0.00 176.35 176.27 1vna n PRO 61 N 4.57 0.38 -0.03 0.98 -0.04 -1.26 -2.63 135.00 136.96 1vna n PRO 61 Ca -0.18 0.07 0.04 0.00 -0.04 0.00 0.00 63.50 63.39 1vna n PRO 61 Cb 0.51 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.32 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 -1.16 0.51 -3.25 3.54 4.05 -1.26 -4.86 115.26 112.84 1vna n ASN 62 Ca 0.10 0.00 -0.04 0.00 0.45 0.00 0.00 54.58 55.09 1vna n ASN 62 Cb 0.10 1.59 -0.03 0.00 1.23 0.00 0.00 39.78 42.67 1vna n ASN 62 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 177.26 172.62 1vna s LYS 63 N -3.07 0.68 0.20 1.20 -2.85 -1.08 -5.12 119.74 109.70 1vna s LYS 63 Ca -0.08 -0.24 -0.33 0.00 -1.00 0.00 0.00 55.97 54.32 1vna s LYS 63 Cb 0.10 -0.14 -0.14 0.00 -2.06 0.00 0.00 37.83 35.59 1vna s LYS 63 CO 0.79 -1.15 1.46 0.45 0.10 0.00 0.00 175.35 177.00 1vna n SER 64 N 4.65 2.77 0.00 0.03 2.88 -1.23 -4.57 113.62 118.15 1vna n SER 64 Ca 0.09 1.12 0.01 0.00 -1.33 0.00 0.00 58.87 58.75 1vna n SER 64 Cb 0.53 -1.41 0.06 0.00 -0.75 0.00 0.00 64.21 62.64 1vna n SER 64 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81