#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 1.24 -3.61 1.64 -0.58 -1.26 -1.59 120.64 116.48 1vna n GLU 2 Ca 0.00 -0.28 -0.13 0.00 -0.42 0.00 0.00 57.16 56.33 1vna n GLU 2 Cb 0.00 0.01 -0.06 0.00 -0.57 0.00 0.00 31.44 30.82 1vna n GLU 2 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1vna s GLY 3 N -1.93 -0.36 -0.33 0.62 0.00 -0.38 -4.70 107.32 100.24 1vna s GLY 3 Ca 0.04 0.46 0.03 0.00 0.00 0.00 0.00 44.72 45.24 1vna s GLY 3 CO 0.02 0.17 0.03 -0.19 0.00 0.00 0.00 173.10 173.14 1vna s TYR 4 N -2.50 3.65 0.54 1.90 2.02 -1.26 -2.51 117.35 119.19 1vna s TYR 4 Ca -0.05 -2.81 -0.17 0.00 -0.37 0.00 0.00 57.07 53.67 1vna s TYR 4 Cb -0.01 -2.75 -0.14 0.00 -0.40 0.00 0.00 41.96 38.66 1vna s TYR 4 CO -0.02 -0.94 -0.21 1.28 -1.57 0.00 0.00 175.55 174.10 1vna n LEU 5 N 4.32 -3.79 -4.15 -1.29 4.77 -1.18 -4.05 117.00 111.64 1vna n LEU 5 Ca -0.00 0.56 -0.16 0.00 -0.03 0.00 0.00 56.01 56.38 1vna n LEU 5 Cb 0.42 -0.80 -0.06 0.00 -2.33 0.00 0.00 43.42 40.66 1vna n LEU 5 CO 0.23 -4.72 0.05 0.54 -1.33 0.00 0.00 177.39 172.16 1vna s VAL 6 N -1.90 0.00 0.00 4.08 0.11 -1.26 -2.90 120.40 118.53 1vna s VAL 6 Ca 0.52 -1.73 0.00 0.00 -2.93 0.00 0.00 61.98 57.84 1vna s VAL 6 Cb -0.43 -2.58 0.00 0.00 -1.53 0.00 0.00 36.38 31.84 1vna s VAL 6 CO 0.65 0.00 0.00 0.29 -3.33 0.00 0.00 175.10 172.71 1vna n LYS 7 N -0.56 3.07 0.00 1.54 4.76 -1.26 -4.74 118.16 120.97 1vna n LYS 7 Ca 0.03 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.47 1vna n LYS 7 Cb 0.62 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.81 1vna n LYS 7 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1vna n LYS 8 N -0.10 0.00 0.00 1.97 5.02 -1.26 -3.50 118.16 120.28 1vna n LYS 8 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1vna n LYS 8 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1vna n LYS 8 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1vna n SER 9 N 0.00 0.00 0.06 4.39 3.41 -1.26 -0.62 113.62 119.59 1vna n SER 9 Ca 0.00 0.00 0.16 0.00 -0.26 0.00 0.00 58.87 58.77 1vna n SER 9 Cb 0.00 0.00 0.34 0.00 -0.26 0.00 0.00 64.21 64.29 1vna n SER 9 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1vna h ASP 10 N 0.00 0.00 -2.76 4.04 3.04 -1.84 -3.44 116.42 115.46 1vna h ASP 10 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1vna h ASP 10 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 1vna h ASP 10 CO 0.00 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.81 1vna n GLY 11 N -1.58 -0.09 0.00 7.15 0.00 0.21 -1.59 105.19 109.29 1vna n GLY 11 Ca 0.11 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.15 0.00 -4.05 0.00 3.00 -1.26 -4.88 118.16 108.82 1vna n LYS 13 Ca 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 58.31 57.96 1vna n LYS 13 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 35.03 34.89 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 -1.54 2.94 0.41 5.64 5.04 -1.14 -4.21 117.35 124.50 1vna s TYR 14 Ca 0.00 -0.85 -0.00 0.00 -2.44 0.00 0.00 57.07 53.77 1vna s TYR 14 Cb 0.00 -2.06 -0.02 0.00 0.35 0.00 0.00 41.96 40.23 1vna s TYR 14 CO 0.00 -0.47 0.63 0.34 -1.34 0.00 0.00 175.55 174.71 1vna s ASP 15 N 1.25 6.10 -0.28 4.32 2.15 -1.25 -4.19 116.67 124.76 1vna s ASP 15 Ca 0.03 0.45 0.01 0.00 0.43 0.00 0.00 52.55 53.47 1vna s ASP 15 Cb -0.14 -1.86 0.17 0.00 -0.30 0.00 0.00 42.92 40.79 1vna s ASP 15 CO -0.02 -0.50 0.52 0.00 -0.17 0.00 0.00 175.17 175.00 1vna n PHE 17 N 5.40 0.00 -1.54 0.00 7.35 -1.26 -4.10 117.46 123.30 1vna n PHE 17 Ca 0.00 0.00 -0.24 0.00 -0.76 0.00 0.00 57.45 56.45 1vna n PHE 17 Cb 0.51 -0.35 -0.09 0.00 0.35 0.00 0.00 39.48 39.90 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 -1.56 1.04 -1.10 -5.13 -0.00 -1.26 -4.91 117.44 104.53 1vna n TRP 18 Ca 0.00 0.06 -0.29 0.00 -0.00 0.00 0.00 57.50 57.27 1vna n TRP 18 Cb 0.00 -2.33 0.22 0.00 -0.00 0.00 0.00 31.31 29.20 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 11.60 1.01 0.00 5.87 1.43 -1.26 -4.96 118.68 132.37 1vna s LEU 19 Ca 1.04 0.86 0.00 0.00 -1.03 0.00 0.00 54.13 55.00 1vna s LEU 19 Cb -0.34 -2.77 0.00 0.00 0.03 0.00 0.00 46.19 43.11 1vna s LEU 19 CO 0.24 -3.76 0.00 0.61 0.23 0.00 0.00 176.35 173.67 1vna n GLY 20 N -0.94 0.75 3.54 -3.19 0.00 -1.26 -4.98 105.19 99.10 1vna n GLY 20 Ca 0.10 -2.06 -0.42 0.00 0.00 0.00 0.00 46.02 43.63 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 -1.16 3.31 -0.13 1.61 3.01 -1.26 -2.18 119.74 122.94 1vna s LYS 21 Ca 0.00 -0.20 -0.29 0.00 -1.01 0.00 0.00 55.97 54.47 1vna s LYS 21 Cb 0.00 -4.11 -0.02 0.00 -1.01 0.00 0.00 37.83 32.70 1vna s LYS 21 CO 0.00 -1.79 1.19 1.21 0.51 0.00 0.00 175.35 176.47 1vna s ASN 22 N 3.27 7.03 -0.08 2.83 2.47 -1.26 -4.93 114.94 124.27 1vna s ASN 22 Ca 0.34 1.67 -0.11 0.00 0.42 0.00 0.00 52.86 55.19 1vna s ASN 22 Cb -0.10 -2.55 -0.08 0.00 -1.45 0.00 0.00 41.25 37.07 1vna s ASN 22 CO 0.18 -0.66 0.39 -0.08 -3.72 0.00 0.00 177.10 173.22 1vna h GLU 23 N 7.73 -0.17 -0.70 0.43 4.81 -1.94 -3.19 114.58 121.56 1vna h GLU 23 Ca -0.28 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 58.99 1vna h GLU 23 Cb 1.12 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.50 1vna h GLU 23 CO 0.93 0.07 0.46 1.25 -0.73 0.00 0.00 179.01 180.99 1vna h HIS 24 N -1.01 0.81 0.00 0.92 2.76 -1.99 -1.42 115.15 115.21 1vna h HIS 24 Ca -0.02 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.14 1vna h HIS 24 Cb 0.31 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 28.99 1vna h HIS 24 CO 0.05 0.47 -0.17 0.00 -1.30 0.00 0.00 177.93 176.97 1vna n ASN 26 N -3.87 1.86 -0.22 0.00 0.23 -0.63 -3.09 115.26 109.55 1vna n ASN 26 Ca -0.02 0.44 0.18 0.00 -0.53 0.00 0.00 54.58 54.65 1vna n ASN 26 Cb 0.27 -0.94 0.51 0.00 -2.08 0.00 0.00 39.78 37.55 1vna n ASN 26 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1vna h THR 27 N -1.00 0.71 0.01 5.53 1.03 -1.36 0.29 112.91 118.12 1vna h THR 27 Ca -0.34 -0.14 -0.20 0.00 -0.01 0.00 0.00 66.41 65.72 1vna h THR 27 Cb 1.24 0.27 -0.02 0.00 -1.07 0.00 0.00 68.15 68.57 1vna h THR 27 CO -0.21 0.07 -0.91 -0.08 -0.01 0.00 0.00 175.52 174.39 1vna h GLU 28 N 0.40 0.11 0.00 0.00 4.57 -1.61 -2.98 114.58 115.07 1vna h GLU 28 Ca 0.44 -0.14 0.00 0.00 -1.18 0.00 0.00 59.36 58.49 1vna h GLU 28 Cb 1.09 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.72 1vna h GLU 28 CO -0.16 0.94 0.00 0.00 -1.18 0.00 0.00 179.01 178.61 1vna h LYS 30 N 0.00 0.00 -5.95 0.00 3.64 -1.06 -0.87 116.57 112.32 1vna h LYS 30 Ca 0.00 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 59.13 1vna h LYS 30 Cb 0.47 0.00 0.14 0.00 -0.41 0.00 0.00 32.23 32.43 1vna h LYS 30 CO 0.00 0.23 -0.67 0.00 -2.27 0.00 0.00 179.45 176.74 1vna n ALA 31 N -2.32 -0.93 1.37 5.00 0.00 -1.04 -4.50 120.51 118.09 1vna n ALA 31 Ca -0.06 -0.95 0.14 0.00 0.00 0.00 0.00 53.44 52.58 1vna n ALA 31 Cb 0.75 -0.81 0.64 0.00 0.00 0.00 0.00 19.45 20.04 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 -0.65 0.54 -0.13 0.00 0.00 -1.26 -3.07 118.16 113.59 1vna n LYS 32 Ca 0.03 -0.13 0.07 0.00 -0.00 0.00 0.00 58.31 58.28 1vna n LYS 32 Cb 0.38 -1.50 0.23 0.00 -0.00 0.00 0.00 35.03 34.14 1vna n LYS 32 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 1vna n ASN 33 N -1.11 1.66 0.00 -5.58 0.23 -1.26 -4.55 115.26 104.65 1vna n ASN 33 Ca 0.14 -1.89 0.00 0.00 -0.53 0.00 0.00 54.58 52.29 1vna n ASN 33 Cb 0.27 -0.18 0.00 0.00 -2.08 0.00 0.00 39.78 37.79 1vna n ASN 33 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1vna n GLN 34 N 0.38 0.00 0.00 -3.83 3.00 -1.20 -5.03 117.38 110.70 1vna n GLN 34 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.12 1vna n GLN 34 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.52 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 2.03 0.59 0.00 1.08 0.00 -1.17 -4.59 105.19 103.12 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 5.40 0.69 -0.02 0.00 -0.34 -4.43 105.19 106.49 1vna n GLY 36 Ca 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.08 -4.89 1.61 3.41 -1.26 -4.29 113.62 108.13 1vna n SER 37 Ca 0.00 0.03 -0.31 0.00 -0.26 0.00 0.00 58.87 58.33 1vna n SER 37 Cb 0.00 0.25 -0.05 0.00 -0.26 0.00 0.00 64.21 64.15 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 3.45 -0.18 7.33 2.02 -1.26 -4.78 117.35 121.92 1vna s TYR 38 Ca 0.00 0.76 -0.31 0.00 -0.37 0.00 0.00 57.07 57.15 1vna s TYR 38 Cb 0.00 -2.18 0.14 0.00 -0.40 0.00 0.00 41.96 39.53 1vna s TYR 38 CO 0.00 0.26 1.13 0.20 -1.57 0.00 0.00 175.55 175.57 1vna s GLY 39 N -2.61 -0.20 0.00 0.71 0.00 -1.26 -3.43 107.32 100.53 1vna s GLY 39 Ca 0.45 2.06 0.00 0.00 0.00 0.00 0.00 44.72 47.24 1vna s GLY 39 CO 0.24 0.88 0.00 1.58 0.00 0.00 0.00 173.10 175.81 1vna n TYR 40 N 0.41 -0.48 -4.25 1.90 4.11 -1.18 -4.42 117.16 113.26 1vna n TYR 40 Ca -0.05 0.00 -0.34 0.00 -0.00 0.00 0.00 57.90 57.51 1vna n TYR 40 Cb 0.59 0.00 -0.15 0.00 -0.00 0.00 0.00 39.34 39.78 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 4.40 0.00 0.00 0.00 9.36 -0.89 -4.09 117.16 125.94 1vna n TYR 42 Ca -0.19 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.03 1vna n TYR 42 Cb 0.51 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.22 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 0.00 -2.68 2.98 0.00 -1.26 -3.31 120.51 113.24 1vna n ALA 43 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 1vna n ALA 43 Cb 0.00 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.52 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 -2.96 -1.62 -2.84 0.00 3.72 -1.26 -4.92 117.46 107.57 1vna n PHE 44 Ca 0.00 -1.42 0.00 0.00 -0.05 0.00 0.00 57.45 55.98 1vna n PHE 44 Cb 0.00 1.42 0.00 0.00 -0.94 0.00 0.00 39.48 39.96 1vna n PHE 44 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1vna n ALA 45 N -0.59 0.00 -3.13 4.37 0.00 -1.21 -0.54 120.51 119.40 1vna n ALA 45 Ca -0.13 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 52.97 1vna n ALA 45 Cb 0.77 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 20.09 1vna n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vna s TRP 47 N 0.89 3.43 0.29 0.00 -0.11 -1.04 -3.10 118.94 119.31 1vna s TRP 47 Ca -0.00 -2.09 0.08 0.00 1.22 0.00 0.00 56.10 55.31 1vna s TRP 47 Cb -0.14 -2.72 -0.04 0.00 -1.50 0.00 0.00 33.47 29.07 1vna s TRP 47 CO 0.02 -0.88 0.12 0.00 -4.62 0.00 0.00 176.95 171.59 1vna s GLU 49 N -3.80 2.02 -0.01 0.00 2.02 -1.22 -1.24 118.70 116.46 1vna s GLU 49 Ca 0.35 -1.62 -0.00 0.00 0.02 0.00 0.00 54.97 53.71 1vna s GLU 49 Cb -0.06 -1.97 -0.00 0.00 0.10 0.00 0.00 34.13 32.21 1vna s GLU 49 CO 0.23 0.30 0.01 0.41 0.02 0.00 0.00 175.26 176.23 1vna n GLY 50 N -0.81 0.85 2.94 -1.39 0.00 -0.62 -4.22 105.19 101.94 1vna n GLY 50 Ca -0.05 -0.27 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.99 2.95 0.90 0.99 2.01 -1.05 -3.84 118.68 117.65 1vna s LEU 51 Ca 0.01 -1.40 -0.10 0.00 0.01 0.00 0.00 54.13 52.64 1vna s LEU 51 Cb -0.00 -1.25 0.14 0.00 0.01 0.00 0.00 46.19 45.09 1vna s LEU 51 CO 0.01 -0.27 1.12 -2.16 1.01 0.00 0.00 176.35 176.06 1vna s PRO 52 N 1.32 1.14 0.01 1.29 0.04 -1.26 -4.75 135.00 132.78 1vna s PRO 52 Ca -0.02 1.39 0.18 0.00 0.04 0.00 0.00 61.00 62.59 1vna s PRO 52 Cb -0.19 -1.75 0.77 0.00 0.04 0.00 0.00 34.50 33.37 1vna s PRO 52 CO -0.09 -2.50 1.58 0.39 0.04 0.00 0.00 177.00 176.43 1vna n GLU 53 N -4.13 0.01 -0.01 4.56 1.02 -1.26 -1.93 120.64 118.90 1vna n GLU 53 Ca 0.10 0.20 0.14 0.00 -0.02 0.00 0.00 57.16 57.58 1vna n GLU 53 Cb 0.53 -1.51 0.48 0.00 -0.02 0.00 0.00 31.44 30.92 1vna n GLU 53 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1vna n SER 54 N -1.52 1.64 -4.65 1.62 2.88 -1.26 -4.82 113.62 107.50 1vna n SER 54 Ca 0.04 -1.55 -0.37 0.00 -1.33 0.00 0.00 58.87 55.66 1vna n SER 54 Cb 0.21 -0.01 -0.09 0.00 -0.75 0.00 0.00 64.21 63.57 1vna n SER 54 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1vna s THR 55 N -1.98 5.30 -0.23 2.46 2.01 -0.81 -5.02 115.64 117.36 1vna s THR 55 Ca 0.37 0.35 -0.28 0.00 0.31 0.00 0.00 61.69 62.44 1vna s THR 55 Cb 0.21 -3.58 -0.05 0.00 0.01 0.00 0.00 72.50 69.09 1vna s THR 55 CO 0.33 0.30 2.19 -2.84 -0.69 0.00 0.00 174.62 173.90 1vna s PRO 56 N 1.28 3.12 -0.29 4.92 0.02 -1.26 -4.90 135.00 137.88 1vna s PRO 56 Ca 0.11 1.96 -0.14 0.00 0.02 0.00 0.00 61.00 62.95 1vna s PRO 56 Cb -0.14 -4.36 0.13 0.00 0.02 0.00 0.00 34.50 30.15 1vna s PRO 56 CO 0.06 -2.11 0.84 0.95 -0.33 0.00 0.00 177.00 176.41 1vna s THR 57 N 8.28 -0.38 -0.10 0.99 -4.23 -1.26 -4.99 115.64 113.95 1vna s THR 57 Ca 0.99 0.00 -0.09 0.00 -1.18 0.00 0.00 61.69 61.41 1vna s THR 57 Cb -0.32 -1.00 -0.04 0.00 1.34 0.00 0.00 72.50 72.48 1vna s THR 57 CO 0.35 0.00 0.33 -1.22 -0.54 0.00 0.00 174.62 173.54 1vna n TYR 58 N 4.61 0.31 -0.38 3.99 4.01 -1.26 -4.35 117.16 124.08 1vna n TYR 58 Ca -0.15 0.20 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 1vna n TYR 58 Cb 0.54 -0.43 0.00 0.00 -0.31 0.00 0.00 39.34 39.14 1vna n TYR 58 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1vna n PRO 59 N 0.95 -0.80 -3.85 -0.72 -0.04 -1.26 -4.39 135.00 124.88 1vna n PRO 59 Ca 0.07 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.41 1vna n PRO 59 Cb -0.01 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.31 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 1.79 0.00 1.53 0.20 -1.26 -4.97 118.68 115.97 1vna s LEU 60 Ca 0.00 0.09 0.02 0.00 0.69 0.00 0.00 54.13 54.94 1vna s LEU 60 Cb 0.00 0.15 0.11 0.00 -0.43 0.00 0.00 46.19 46.02 1vna s LEU 60 CO 0.00 -0.02 0.98 -0.81 -0.29 0.00 0.00 176.35 176.21 1vna n PRO 61 N 3.11 0.02 -2.74 0.98 -0.04 -1.26 -2.71 135.00 132.36 1vna n PRO 61 Ca -0.13 0.36 -0.03 0.00 -0.04 0.00 0.00 63.50 63.66 1vna n PRO 61 Cb 0.59 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.63 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 -1.39 0.21 -4.37 3.54 0.23 -1.26 -5.12 115.26 107.09 1vna n ASN 62 Ca 0.01 -2.26 -0.43 0.00 -0.53 0.00 0.00 54.58 51.37 1vna n ASN 62 Cb 0.02 0.05 -0.01 0.00 -2.08 0.00 0.00 39.78 37.76 1vna n ASN 62 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1vna n LYS 63 N -0.79 0.20 -0.64 -3.83 5.02 -1.10 -4.70 118.16 112.33 1vna n LYS 63 Ca -0.01 0.07 -0.02 0.00 -2.02 0.00 0.00 58.31 56.33 1vna n LYS 63 Cb 0.83 -1.16 -0.02 0.00 -0.02 0.00 0.00 35.03 34.66 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 1.94 -0.32 0.00 4.39 2.88 -0.62 -5.00 113.62 116.89 1vna n SER 64 Ca 0.13 -1.26 0.14 0.00 -1.33 0.00 0.00 58.87 56.54 1vna n SER 64 Cb 0.36 0.10 0.83 0.00 -0.75 0.00 0.00 64.21 64.75 1vna n SER 64 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81