#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 0.88 0.00 1.64 -1.05 -1.26 -1.36 118.70 117.54 1vna s GLU 2 Ca 0.00 0.09 0.00 0.00 -0.15 0.00 0.00 54.97 54.91 1vna s GLU 2 Cb 0.00 0.41 0.00 0.00 -0.44 0.00 0.00 34.13 34.10 1vna s GLU 2 CO 0.00 -0.30 0.00 0.41 0.95 0.00 0.00 175.26 176.32 1vna n GLY 3 N 0.59 -0.56 3.70 -3.83 0.00 -1.01 -4.98 105.19 99.10 1vna n GLY 3 Ca -0.14 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 44.84 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 -3.30 2.08 0.00 1.61 2.02 -1.26 -1.69 117.35 116.82 1vna s TYR 4 Ca 0.00 0.90 0.00 0.00 -0.37 0.00 0.00 57.07 57.60 1vna s TYR 4 Cb 0.00 -3.32 0.00 0.00 -0.40 0.00 0.00 41.96 38.24 1vna s TYR 4 CO 0.00 -2.86 0.00 1.28 -1.57 0.00 0.00 175.55 172.40 1vna n LEU 5 N -4.13 0.00 -4.00 -1.29 4.77 -1.10 -4.54 117.00 106.71 1vna n LEU 5 Ca 0.06 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.93 1vna n LEU 5 Cb 0.58 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.63 1vna n LEU 5 CO 0.57 -0.21 0.22 0.54 -1.33 0.00 0.00 177.39 177.18 1vna s VAL 6 N 1.26 0.00 0.34 4.08 0.11 -1.26 -3.87 120.40 121.06 1vna s VAL 6 Ca 0.00 -1.40 0.03 0.00 -2.93 0.00 0.00 61.98 57.68 1vna s VAL 6 Cb 0.00 -2.45 -0.01 0.00 -1.53 0.00 0.00 36.38 32.39 1vna s VAL 6 CO 0.00 0.00 0.11 0.29 -3.33 0.00 0.00 175.10 172.17 1vna n LYS 7 N -0.47 0.67 0.00 1.54 5.02 0.23 -4.60 118.16 120.55 1vna n LYS 7 Ca -0.02 -2.84 0.00 0.00 -2.02 0.00 0.00 58.31 53.43 1vna n LYS 7 Cb 0.61 1.49 0.00 0.00 -0.02 0.00 0.00 35.03 37.12 1vna n LYS 7 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1vna n LYS 8 N -0.77 0.00 0.00 1.97 5.02 -1.26 -3.58 118.16 119.53 1vna n LYS 8 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 1vna n LYS 8 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.51 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 -0.23 4.39 3.41 -1.26 -0.85 113.62 119.08 1vna n SER 9 Ca 0.00 0.00 0.29 0.00 -0.26 0.00 0.00 58.87 58.90 1vna n SER 9 Cb 0.00 0.00 0.44 0.00 -0.26 0.00 0.00 64.21 64.39 1vna n SER 9 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1vna n ASP 10 N -1.85 0.00 -0.35 4.04 5.68 -1.26 -4.70 116.55 118.11 1vna n ASP 10 Ca 0.00 0.76 0.00 0.00 -0.50 0.00 0.00 54.79 55.05 1vna n ASP 10 Cb 0.00 -0.26 0.00 0.00 -1.14 0.00 0.00 41.12 39.72 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 -1.72 -0.58 3.54 6.12 0.00 -0.03 -3.60 105.19 108.92 1vna n GLY 11 Ca 0.24 -0.71 -0.08 0.00 0.00 0.00 0.00 46.02 45.47 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 4.16 -0.08 -4.70 0.00 5.02 -1.26 0.78 118.16 122.08 1vna n LYS 13 Ca -0.20 0.01 -0.33 0.00 -2.02 0.00 0.00 58.31 55.76 1vna n LYS 13 Cb 0.58 -1.56 -0.14 0.00 -0.02 0.00 0.00 35.03 33.89 1vna n LYS 13 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1vna s TYR 14 N -2.17 2.86 0.37 2.13 6.14 -1.25 -4.39 117.35 121.04 1vna s TYR 14 Ca 0.53 -0.56 0.07 0.00 0.64 0.00 0.00 57.07 57.75 1vna s TYR 14 Cb -0.24 -1.87 -0.00 0.00 0.42 0.00 0.00 41.96 40.27 1vna s TYR 14 CO 0.70 -0.17 0.49 0.34 0.64 0.00 0.00 175.55 177.55 1vna s ASP 15 N 0.35 5.74 -0.20 4.32 -1.08 -1.26 -3.14 116.67 121.39 1vna s ASP 15 Ca -0.09 -0.34 -0.07 0.00 -0.52 0.00 0.00 52.55 51.52 1vna s ASP 15 Cb -0.16 -0.94 0.09 0.00 -1.46 0.00 0.00 42.92 40.46 1vna s ASP 15 CO 0.05 -0.57 0.43 0.00 0.52 0.00 0.00 175.17 175.60 1vna n PHE 17 N 5.31 0.00 -1.64 0.00 7.35 -1.26 -4.56 117.46 122.66 1vna n PHE 17 Ca -0.10 0.00 -0.61 0.00 -0.76 0.00 0.00 57.45 55.99 1vna n PHE 17 Cb 0.50 0.00 -0.09 0.00 0.35 0.00 0.00 39.48 40.24 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 -0.03 1.80 -3.96 -5.13 -0.00 -1.26 -4.91 117.44 103.96 1vna n TRP 18 Ca 0.00 0.74 -0.36 0.00 -0.00 0.00 0.00 57.50 57.88 1vna n TRP 18 Cb 0.00 -2.37 -0.06 0.00 -0.00 0.00 0.00 31.31 28.88 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 4.05 4.25 0.00 5.87 1.02 -1.26 -4.89 118.68 127.73 1vna s LEU 19 Ca 1.04 0.39 0.00 0.00 0.02 0.00 0.00 54.13 55.58 1vna s LEU 19 Cb -1.25 -2.15 0.00 0.00 0.02 0.00 0.00 46.19 42.81 1vna s LEU 19 CO 0.70 0.37 0.00 0.61 0.02 0.00 0.00 176.35 178.05 1vna n GLY 20 N 1.76 -1.54 2.33 -3.19 0.00 -1.26 -4.99 105.19 98.31 1vna n GLY 20 Ca -0.18 -1.04 -0.29 0.00 0.00 0.00 0.00 46.02 44.51 1vna n GLY 20 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1vna n LYS 21 N -0.18 2.39 -2.69 1.61 2.85 -1.26 -3.84 118.16 117.03 1vna n LYS 21 Ca 0.00 -2.65 -0.06 0.00 -1.05 0.00 0.00 58.31 54.55 1vna n LYS 21 Cb 0.00 -2.06 0.08 0.00 -0.65 0.00 0.00 35.03 32.40 1vna n LYS 21 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1vna n ASN 22 N -0.16 -1.79 -4.84 -5.58 2.85 -1.26 -5.03 115.26 99.45 1vna n ASN 22 Ca 0.49 -2.42 -0.33 0.00 -0.11 0.00 0.00 54.58 52.21 1vna n ASN 22 Cb 0.54 1.25 -0.06 0.00 1.24 0.00 0.00 39.78 42.76 1vna n ASN 22 CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 1vna s GLU 23 N 0.25 4.05 0.23 1.20 2.56 -1.26 -4.97 118.70 120.75 1vna s GLU 23 Ca 0.25 0.71 -0.05 0.00 0.00 0.00 0.00 54.97 55.88 1vna s GLU 23 Cb 0.25 -2.52 0.22 0.00 2.00 0.00 0.00 34.13 34.07 1vna s GLU 23 CO -0.14 0.20 1.71 0.45 -0.56 0.00 0.00 175.26 176.92 1vna h HIS 24 N 2.49 0.99 0.00 5.30 3.86 -1.97 -0.31 115.15 125.51 1vna h HIS 24 Ca -0.48 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 58.58 1vna h HIS 24 Cb 1.18 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 29.38 1vna h HIS 24 CO 0.62 0.89 0.10 0.00 0.86 0.00 0.00 177.93 180.40 1vna h ASN 26 N 0.00 -0.20 -0.30 0.00 -0.00 -1.37 -2.57 115.58 111.14 1vna h ASN 26 Ca 0.00 -0.27 0.01 0.00 -0.00 0.00 0.00 56.30 56.04 1vna h ASN 26 Cb 0.20 0.05 -0.02 0.00 -0.00 0.00 0.00 38.32 38.55 1vna h ASN 26 CO 0.00 0.19 0.20 0.00 -0.00 0.00 0.00 177.43 177.82 1vna h THR 27 N -0.63 1.05 -0.73 -3.57 1.03 -1.20 0.01 112.91 108.87 1vna h THR 27 Ca -0.02 -0.12 0.04 0.00 -0.01 0.00 0.00 66.41 66.29 1vna h THR 27 Cb 0.46 0.66 -0.04 0.00 -1.07 0.00 0.00 68.15 68.16 1vna h THR 27 CO 0.04 0.06 0.48 -0.33 -0.01 0.00 0.00 175.52 175.76 1vna h GLU 28 N 0.35 0.83 -0.58 0.00 5.08 -1.16 0.33 114.58 119.43 1vna h GLU 28 Ca 0.11 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1vna h GLU 28 Cb 0.03 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 1vna h GLU 28 CO -0.02 0.55 0.39 0.00 -1.00 0.00 0.00 179.01 178.92 1vna h LYS 30 N 0.70 0.00 -6.12 0.00 1.63 -0.91 -2.65 116.57 109.21 1vna h LYS 30 Ca 0.23 0.00 -0.52 0.00 -0.85 0.00 0.00 60.65 59.51 1vna h LYS 30 Cb 0.05 0.00 0.24 0.00 -0.60 0.00 0.00 32.23 31.93 1vna h LYS 30 CO -0.06 0.08 -1.96 0.00 -3.45 0.00 0.00 179.45 174.06 1vna n ALA 31 N -2.48 -5.24 1.76 5.00 0.00 0.02 -4.50 120.51 115.07 1vna n ALA 31 Ca -0.03 -0.94 0.02 0.00 0.00 0.00 0.00 53.44 52.49 1vna n ALA 31 Cb 0.16 -1.12 0.07 0.00 0.00 0.00 0.00 19.45 18.56 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 1.77 1.18 0.10 0.00 -0.00 -1.26 -2.75 118.16 117.20 1vna n LYS 32 Ca -0.01 -0.27 0.10 0.00 -0.00 0.00 0.00 58.31 58.12 1vna n LYS 32 Cb 0.62 -1.08 -0.01 0.00 -0.00 0.00 0.00 35.03 34.57 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 0.45 0.00 0.00 -5.58 7.08 -1.87 -3.42 115.58 112.24 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 0.10 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.34 1vna h ASN 33 CO 0.00 0.09 -0.55 0.00 -2.08 0.00 0.00 177.43 174.89 1vna n GLN 34 N -2.72 0.00 -0.95 4.14 6.02 -1.21 -4.77 117.38 117.90 1vna n GLN 34 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 1vna n GLN 34 Cb 0.59 -0.46 0.00 0.00 1.02 0.00 0.00 30.24 31.39 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 3.08 0.91 0.00 1.08 0.00 -1.11 -4.33 105.19 104.83 1vna n GLY 35 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.56 -1.03 2.03 -0.02 0.00 -1.01 -4.62 105.19 98.97 1vna n GLY 36 Ca 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.57 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 -0.60 -3.94 1.61 3.41 -1.08 -4.70 113.62 108.32 1vna n SER 37 Ca 0.00 0.24 -0.09 0.00 -0.26 0.00 0.00 58.87 58.76 1vna n SER 37 Cb 0.00 0.73 -0.10 0.00 -0.26 0.00 0.00 64.21 64.58 1vna n SER 37 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1vna s TYR 38 N -2.00 0.22 0.00 7.33 5.04 -1.25 -4.86 117.35 121.83 1vna s TYR 38 Ca 0.00 -0.52 0.00 0.00 -2.44 0.00 0.00 57.07 54.11 1vna s TYR 38 Cb 0.00 -0.16 0.00 0.00 0.35 0.00 0.00 41.96 42.15 1vna s TYR 38 CO 0.00 -0.35 0.00 0.41 -1.34 0.00 0.00 175.55 174.27 1vna n GLY 39 N 0.83 1.77 0.00 8.97 0.00 -1.25 -1.09 105.19 114.42 1vna n GLY 39 Ca -0.19 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.02 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 -3.89 1.61 4.11 -0.37 -4.70 117.16 113.92 1vna n TYR 40 Ca 0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 57.90 57.64 1vna n TYR 40 Cb 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 39.34 39.17 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 4.96 -2.12 -0.16 0.00 9.36 -0.74 -4.33 117.16 124.13 1vna n TYR 42 Ca -0.12 0.00 0.01 0.00 3.32 0.00 0.00 57.90 61.11 1vna n TYR 42 Cb 0.50 0.00 0.03 0.00 -0.63 0.00 0.00 39.34 39.24 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 -2.65 2.98 0.00 -1.26 -3.37 120.51 113.21 1vna n ALA 43 Ca 0.00 0.44 -0.04 0.00 0.00 0.00 0.00 53.44 53.84 1vna n ALA 43 Cb 0.00 -0.22 0.07 0.00 0.00 0.00 0.00 19.45 19.30 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 -4.65 -1.47 -3.53 0.00 3.72 -1.26 -4.92 117.46 105.36 1vna n PHE 44 Ca 0.05 -1.27 -0.07 0.00 -0.05 0.00 0.00 57.45 56.11 1vna n PHE 44 Cb 0.18 1.33 -0.08 0.00 -0.94 0.00 0.00 39.48 39.97 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 0.11 -1.29 0.93 4.37 0.00 -1.22 -3.63 121.76 121.04 1vna s ALA 45 Ca 0.11 1.42 -0.11 0.00 0.00 0.00 0.00 51.96 53.37 1vna s ALA 45 Cb 0.27 -1.53 0.09 0.00 0.00 0.00 0.00 23.12 21.95 1vna s ALA 45 CO -0.07 -0.96 0.77 0.00 0.00 0.00 0.00 175.76 175.50 1vna s TRP 47 N -2.51 -0.01 0.30 0.00 -0.11 -0.50 -2.69 118.94 113.42 1vna s TRP 47 Ca 0.62 0.27 0.09 0.00 1.22 0.00 0.00 56.10 58.30 1vna s TRP 47 Cb -0.22 -0.30 -0.05 0.00 -1.50 0.00 0.00 33.47 31.40 1vna s TRP 47 CO 0.63 -0.15 0.00 0.00 -4.62 0.00 0.00 176.95 172.81 1vna s GLU 49 N -3.69 0.03 0.00 0.00 2.02 -0.25 -2.42 118.70 114.40 1vna s GLU 49 Ca 0.33 0.10 0.00 0.00 0.02 0.00 0.00 54.97 55.42 1vna s GLU 49 Cb -0.04 -0.21 0.00 0.00 0.10 0.00 0.00 34.13 33.99 1vna s GLU 49 CO 0.20 -0.10 0.00 0.41 0.02 0.00 0.00 175.26 175.78 1vna n GLY 50 N 3.79 0.72 3.73 -1.39 0.00 -0.46 -2.63 105.19 108.95 1vna n GLY 50 Ca -0.22 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 44.97 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 4.48 0.00 0.99 0.05 -1.09 -4.45 118.68 118.66 1vna s LEU 51 Ca 0.00 1.69 -0.10 0.00 0.05 0.00 0.00 54.13 55.77 1vna s LEU 51 Cb 0.00 -3.48 0.15 0.00 -2.05 0.00 0.00 46.19 40.81 1vna s LEU 51 CO 0.00 -0.04 0.41 -0.81 -0.55 0.00 0.00 176.35 175.36 1vna n PRO 52 N 2.79 -2.76 0.02 1.48 -0.04 -1.26 -4.08 135.00 131.15 1vna n PRO 52 Ca 0.01 -0.68 -0.19 0.00 -0.04 0.00 0.00 63.50 62.60 1vna n PRO 52 Cb 0.49 -0.78 -0.14 0.00 -0.04 0.00 0.00 33.50 33.03 1vna n PRO 52 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1vna h GLU 53 N 0.00 0.23 -0.59 0.54 5.08 -1.96 -3.36 114.58 114.53 1vna h GLU 53 Ca -0.17 -0.40 0.06 0.00 -1.00 0.00 0.00 59.36 57.85 1vna h GLU 53 Cb 0.56 0.15 -0.09 0.00 0.50 0.00 0.00 28.75 29.88 1vna h GLU 53 CO 0.11 1.19 -0.49 0.66 -1.00 0.00 0.00 179.01 179.48 1vna h SER 54 N -0.50 -1.72 -1.56 1.42 4.64 -1.97 -3.39 113.55 110.47 1vna h SER 54 Ca -0.12 0.24 -0.72 0.00 -0.47 0.00 0.00 61.79 60.72 1vna h SER 54 Cb 1.52 0.73 0.03 0.00 -0.31 0.00 0.00 62.40 64.37 1vna h SER 54 CO 0.11 -0.28 0.66 1.07 -0.87 0.00 0.00 176.83 177.52 1vna n THR 55 N -4.96 0.15 -2.00 2.95 5.66 -1.26 -4.87 114.28 109.94 1vna n THR 55 Ca -0.01 -0.03 -0.36 0.00 -3.05 0.00 0.00 64.05 60.60 1vna n THR 55 Cb 0.26 -0.96 0.03 0.00 -1.55 0.00 0.00 70.33 68.11 1vna n THR 55 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1vna s PRO 56 N 2.02 2.99 -0.23 1.09 0.05 -1.26 -4.90 135.00 134.76 1vna s PRO 56 Ca 0.92 1.86 -0.04 0.00 0.05 0.00 0.00 61.00 63.79 1vna s PRO 56 Cb -1.05 -1.95 0.12 0.00 0.05 0.00 0.00 34.50 31.67 1vna s PRO 56 CO 0.58 -1.20 0.39 0.95 0.05 0.00 0.00 177.00 177.77 1vna s THR 57 N -1.57 -0.63 0.30 1.26 -4.23 -1.26 -4.80 115.64 104.71 1vna s THR 57 Ca 0.77 0.02 -0.20 0.00 -1.18 0.00 0.00 61.69 61.10 1vna s THR 57 Cb -0.31 -0.76 -0.14 0.00 1.34 0.00 0.00 72.50 72.63 1vna s THR 57 CO 0.34 -0.05 0.19 0.00 -0.54 0.00 0.00 174.62 174.56 1vna n TYR 58 N 5.37 -1.40 -1.77 3.99 9.36 -1.26 -4.41 117.16 127.04 1vna n TYR 58 Ca -0.05 0.63 -0.34 0.00 3.32 0.00 0.00 57.90 61.46 1vna n TYR 58 Cb 0.50 -1.58 0.05 0.00 -0.63 0.00 0.00 39.34 37.68 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 -0.86 2.75 -0.38 2.98 0.04 -1.26 -4.85 135.00 133.41 1vna s PRO 59 Ca 0.52 1.52 -0.15 0.00 0.04 0.00 0.00 61.00 62.93 1vna s PRO 59 Cb -0.62 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 31.99 1vna s PRO 59 CO 0.52 -1.31 0.35 -1.17 0.04 0.00 0.00 177.00 175.43 1vna s LEU 60 N -4.73 4.73 0.35 -3.56 2.96 -1.26 -4.93 118.68 112.24 1vna s LEU 60 Ca 0.70 -0.55 0.09 0.00 -0.22 0.00 0.00 54.13 54.15 1vna s LEU 60 Cb -0.23 -2.29 0.65 0.00 0.50 0.00 0.00 46.19 44.82 1vna s LEU 60 CO 0.40 -0.42 1.82 1.55 -1.32 0.00 0.00 176.35 178.37 1vna h PRO 61 N 8.59 0.21 0.09 0.98 0.13 -1.98 -3.01 132.00 137.00 1vna h PRO 61 Ca -0.28 -0.07 -0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1vna h PRO 61 Cb 1.13 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1vna h PRO 61 CO 0.72 0.47 -0.04 -0.97 -0.23 0.00 0.00 178.00 177.95 1vna h ASN 62 N 0.19 -0.10 -2.19 1.44 -1.24 -1.95 -3.44 115.58 108.29 1vna h ASN 62 Ca 0.03 -0.20 0.02 0.00 0.71 0.00 0.00 56.30 56.86 1vna h ASN 62 Cb 0.58 0.03 -0.22 0.00 0.73 0.00 0.00 38.32 39.43 1vna h ASN 62 CO 0.04 0.14 -0.21 -0.54 -1.29 0.00 0.00 177.43 175.58 1vna s LYS 63 N -5.23 0.50 0.00 6.67 1.02 -1.15 -5.11 119.74 116.44 1vna s LYS 63 Ca -0.15 1.31 0.00 0.00 0.02 0.00 0.00 55.97 57.16 1vna s LYS 63 Cb 0.04 0.69 0.00 0.00 -0.52 0.00 0.00 37.83 38.03 1vna s LYS 63 CO 0.64 -0.22 0.00 -1.13 -0.92 0.00 0.00 175.35 173.73 1vna n SER 64 N 5.41 -0.05 -0.36 2.83 3.41 -1.16 -3.26 113.62 120.44 1vna n SER 64 Ca -0.11 -0.92 0.14 0.00 -0.26 0.00 0.00 58.87 57.73 1vna n SER 64 Cb 0.49 0.00 0.63 0.00 -0.26 0.00 0.00 64.21 65.07 1vna n SER 64 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88