#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lqi s VAL 2 N 0.00 0.00 -0.29 2.03 -7.23 -1.26 -3.68 120.40 109.97 1lqi s VAL 2 Ca 0.00 -1.30 -0.14 0.00 -1.81 0.00 0.00 61.98 58.73 1lqi s VAL 2 Cb 0.00 -2.22 0.11 0.00 0.56 0.00 0.00 36.38 34.84 1lqi s VAL 2 CO 0.00 0.00 0.76 0.00 -0.31 0.00 0.00 175.10 175.55 1lqi s ARG 3 N -3.85 0.57 -0.28 4.82 1.70 0.14 -4.77 118.95 117.28 1lqi s ARG 3 Ca 0.20 1.15 -0.13 0.00 -0.47 0.00 0.00 55.73 56.48 1lqi s ARG 3 Cb -0.02 0.38 -0.04 0.00 -0.57 0.00 0.00 34.95 34.70 1lqi s ARG 3 CO 0.09 -0.15 0.29 -0.51 -1.08 0.00 0.00 175.30 173.95 1lqi s ASP 4 N 2.05 6.15 0.01 -2.89 1.01 -1.26 -1.06 116.67 120.68 1lqi s ASP 4 Ca -0.08 0.10 -0.01 0.00 0.71 0.00 0.00 52.55 53.27 1lqi s ASP 4 Cb -0.07 -2.17 0.00 0.00 1.01 0.00 0.00 42.92 41.69 1lqi s ASP 4 CO -0.19 -0.14 0.07 0.00 0.21 0.00 0.00 175.17 175.11 1lqi n ALA 5 N 5.22 -0.17 -2.80 5.23 0.00 -1.01 -4.95 120.51 122.03 1lqi n ALA 5 Ca -0.11 -0.07 -0.43 0.00 0.00 0.00 0.00 53.44 52.84 1lqi n ALA 5 Cb 0.51 0.04 -0.03 0.00 0.00 0.00 0.00 19.45 19.97 1lqi n ALA 5 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1lqi s TYR 6 N -6.08 2.68 0.15 0.00 1.51 -1.26 -2.00 117.35 112.34 1lqi s TYR 6 Ca 0.01 -0.64 -0.33 0.00 -1.01 0.00 0.00 57.07 55.10 1lqi s TYR 6 Cb -0.00 -4.38 -0.17 0.00 -0.11 0.00 0.00 41.96 37.30 1lqi s TYR 6 CO 0.00 -1.72 0.95 1.51 -1.11 0.00 0.00 175.55 175.19 1lqi n ILE 7 N 6.00 1.09 -4.71 2.71 3.06 -1.21 -0.94 119.36 125.36 1lqi n ILE 7 Ca 0.05 -0.27 -0.31 0.00 -2.50 0.00 0.00 62.75 59.72 1lqi n ILE 7 Cb 0.47 -0.43 -0.07 0.00 0.54 0.00 0.00 39.64 40.15 1lqi n ILE 7 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1lqi n ALA 8 N 0.98 0.46 -4.00 1.51 0.00 -1.06 -3.65 120.51 114.76 1lqi n ALA 8 Ca 0.17 -2.25 -0.02 0.00 0.00 0.00 0.00 53.44 51.33 1lqi n ALA 8 Cb 0.21 1.29 -0.00 0.00 0.00 0.00 0.00 19.45 20.95 1lqi n ALA 8 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1lqi n LYS 9 N -1.20 1.80 0.19 0.00 4.81 -0.19 -4.78 118.16 118.80 1lqi n LYS 9 Ca -0.18 -0.27 0.12 0.00 -0.87 0.00 0.00 58.31 57.11 1lqi n LYS 9 Cb 0.64 0.08 0.64 0.00 0.02 0.00 0.00 35.03 36.41 1lqi n LYS 9 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 1lqi h ASN 10 N 0.09 0.00 -0.76 3.14 4.21 -1.99 -0.34 115.58 119.93 1lqi h ASN 10 Ca -0.03 0.00 -0.52 0.00 1.21 0.00 0.00 56.30 56.96 1lqi h ASN 10 Cb 0.09 0.00 -0.33 0.00 -1.12 0.00 0.00 38.32 36.97 1lqi h ASN 10 CO 0.05 0.00 -0.15 -1.22 -1.29 0.00 0.00 177.43 174.82 1lqi n TYR 11 N -2.34 2.60 -2.21 1.19 4.01 -1.26 -4.76 117.16 114.39 1lqi n TYR 11 Ca -0.02 -2.36 -0.00 0.00 -0.16 0.00 0.00 57.90 55.36 1lqi n TYR 11 Cb 0.09 -0.72 -0.00 0.00 -0.31 0.00 0.00 39.34 38.40 1lqi n TYR 11 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1lqi n ASN 12 N -0.86 -0.87 -4.89 7.72 5.15 -0.14 -0.57 115.26 120.81 1lqi n ASN 12 Ca 0.48 0.40 -0.32 0.00 -0.60 0.00 0.00 54.58 54.54 1lqi n ASN 12 Cb 0.89 -0.95 -0.05 0.00 -0.53 0.00 0.00 39.78 39.14 1lqi n ASN 12 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1lqi s VAL 14 N -1.66 2.87 -0.59 0.00 -7.23 -1.26 -1.02 120.40 111.51 1lqi s VAL 14 Ca 0.41 -0.08 -0.17 0.00 -1.81 0.00 0.00 61.98 60.34 1lqi s VAL 14 Cb -0.12 -3.21 0.12 0.00 0.56 0.00 0.00 36.38 33.73 1lqi s VAL 14 CO 0.23 -0.23 0.62 -0.31 -0.31 0.00 0.00 175.10 175.10 1lqi s TYR 15 N -3.19 3.16 0.53 2.82 2.02 -1.24 -4.89 117.35 116.57 1lqi s TYR 15 Ca 0.58 -1.18 -0.21 0.00 -0.37 0.00 0.00 57.07 55.89 1lqi s TYR 15 Cb -0.11 -3.91 -0.07 0.00 -0.40 0.00 0.00 41.96 37.47 1lqi s TYR 15 CO 0.46 -1.15 0.98 0.39 -1.57 0.00 0.00 175.55 174.66 1lqi n GLU 16 N 5.70 1.10 -3.82 -0.62 1.02 -1.26 -2.81 120.64 119.95 1lqi n GLU 16 Ca -0.10 0.41 -0.09 0.00 -0.02 0.00 0.00 57.16 57.36 1lqi n GLU 16 Cb 0.42 -2.13 -0.07 0.00 -0.02 0.00 0.00 31.44 29.64 1lqi n GLU 16 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1lqi n PHE 18 N -0.11 0.00 -3.77 0.00 3.72 -1.26 -4.92 117.46 111.12 1lqi n PHE 18 Ca -0.15 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.12 1lqi n PHE 18 Cb 0.63 -0.07 -0.09 0.00 -0.94 0.00 0.00 39.48 39.01 1lqi n PHE 18 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1lqi s ARG 19 N -2.18 0.66 0.62 -1.08 0.52 -1.26 -5.00 118.95 111.23 1lqi s ARG 19 Ca -0.01 -0.22 0.25 0.00 -0.52 0.00 0.00 55.73 55.23 1lqi s ARG 19 Cb 0.02 0.29 1.20 0.00 0.52 0.00 0.00 34.95 36.98 1lqi s ARG 19 CO 0.11 -0.18 1.65 -0.44 0.02 0.00 0.00 175.30 176.46 1lqi h ASP 20 N 3.87 0.00 -0.28 0.23 5.19 -1.94 0.83 116.42 124.33 1lqi h ASP 20 Ca -0.30 0.00 0.02 0.00 -0.62 0.00 0.00 57.03 56.13 1lqi h ASP 20 Cb 1.18 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.66 1lqi h ASP 20 CO 0.40 0.00 0.13 0.00 -3.12 0.00 0.00 179.24 176.65 1lqi h ALA 21 N 1.03 0.33 0.04 3.45 0.00 -1.94 -1.75 119.26 120.42 1lqi h ALA 21 Ca 0.22 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1lqi h ALA 21 Cb 1.62 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 1lqi h ALA 21 CO -0.00 -0.27 -0.17 -0.92 0.00 0.00 0.00 179.25 177.90 1lqi h TYR 22 N 0.27 -0.48 -0.42 0.00 3.20 -1.24 -2.42 116.97 115.88 1lqi h TYR 22 Ca 0.12 0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.06 1lqi h TYR 22 Cb 0.05 0.21 -0.09 0.00 1.54 0.00 0.00 36.73 38.44 1lqi h TYR 22 CO -0.10 -0.19 -0.50 0.00 -1.64 0.00 0.00 178.16 175.73 1lqi n ASN 24 N -5.39 -0.54 -0.06 0.00 5.15 -0.66 0.93 115.26 114.68 1lqi n ASN 24 Ca -0.02 1.71 -0.05 0.00 -0.60 0.00 0.00 54.58 55.62 1lqi n ASN 24 Cb 0.35 -0.43 0.16 0.00 -0.53 0.00 0.00 39.78 39.32 1lqi n ASN 24 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 1lqi h GLU 25 N 0.00 0.68 0.00 1.20 4.81 -0.79 -2.70 114.58 117.78 1lqi h GLU 25 Ca 0.39 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1lqi h GLU 25 Cb 0.63 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.95 1lqi h GLU 25 CO -0.99 0.79 0.00 -0.11 -0.73 0.00 0.00 179.01 177.97 1lqi n LEU 26 N -4.16 0.62 -0.35 1.64 7.94 0.27 -1.87 117.00 121.08 1lqi n LEU 26 Ca 0.01 0.54 -0.01 0.00 -1.11 0.00 0.00 56.01 55.44 1lqi n LEU 26 Cb 0.36 -0.28 0.03 0.00 0.53 0.00 0.00 43.42 44.06 1lqi n LEU 26 CO 0.42 -0.28 0.52 0.00 -1.11 0.00 0.00 177.39 176.94 1lqi h THR 28 N 0.00 1.19 -0.57 0.00 1.35 -1.60 -0.98 112.91 112.31 1lqi h THR 28 Ca 0.30 -0.42 -0.03 0.00 -0.55 0.00 0.00 66.41 65.71 1lqi h THR 28 Cb 0.53 -0.15 -0.03 0.00 -1.73 0.00 0.00 68.15 66.77 1lqi h THR 28 CO -0.89 0.23 0.22 0.11 -0.25 0.00 0.00 175.52 174.94 1lqi h LYS 29 N 1.23 0.82 0.00 4.72 1.57 0.10 -0.81 116.57 124.21 1lqi h LYS 29 Ca 0.37 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 1lqi h LYS 29 Cb -0.06 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.11 1lqi h LYS 29 CO -0.10 0.68 0.00 -0.91 -0.57 0.00 0.00 179.45 178.54 1lqi h ASN 30 N 0.81 0.00 0.00 0.86 2.35 -0.53 -3.44 115.58 115.63 1lqi h ASN 30 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1lqi h ASN 30 Cb 0.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.53 1lqi h ASN 30 CO -0.02 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.37 1lqi n GLY 31 N -0.25 1.59 0.00 2.83 0.00 -0.31 -4.63 105.19 104.42 1lqi n GLY 31 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1lqi n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lqi n ALA 32 N -0.99 0.00 -0.07 4.61 0.00 -0.44 -3.99 120.51 119.63 1lqi n ALA 32 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 1lqi n ALA 32 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1lqi n ALA 32 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1lqi n SER 33 N -0.17 1.30 -3.64 0.00 2.88 -1.07 -4.55 113.62 108.37 1lqi n SER 33 Ca 0.00 0.22 -0.09 0.00 -1.33 0.00 0.00 58.87 57.67 1lqi n SER 33 Cb 0.00 -0.52 -0.07 0.00 -0.75 0.00 0.00 64.21 62.87 1lqi n SER 33 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1lqi s SER 34 N -6.37 -0.69 0.45 -3.46 1.04 -1.26 -4.68 113.70 98.73 1lqi s SER 34 Ca -0.22 1.23 0.05 0.00 0.48 0.00 0.00 55.95 57.49 1lqi s SER 34 Cb 0.07 1.26 -0.04 0.00 0.10 0.00 0.00 66.02 67.42 1lqi s SER 34 CO 0.29 -0.20 0.10 -0.83 0.98 0.00 0.00 173.24 173.57 1lqi s GLY 35 N 0.79 2.59 -0.22 7.32 0.00 -1.26 -1.12 107.32 115.42 1lqi s GLY 35 Ca -0.03 -1.62 -0.26 0.00 0.00 0.00 0.00 44.72 42.81 1lqi s GLY 35 CO -0.08 -2.06 0.72 -2.52 0.00 0.00 0.00 173.10 169.16 1lqi s TYR 36 N -2.73 -0.75 0.71 1.90 -0.85 -0.50 -3.36 117.35 111.76 1lqi s TYR 36 Ca 0.29 1.72 -0.13 0.00 -0.52 0.00 0.00 57.07 58.43 1lqi s TYR 36 Cb 0.05 0.31 0.02 0.00 0.38 0.00 0.00 41.96 42.72 1lqi s TYR 36 CO 0.16 -0.43 1.09 0.00 -1.52 0.00 0.00 175.55 174.85 1lqi s GLN 38 N -4.53 0.17 0.41 0.00 -0.44 -0.44 -4.79 119.66 110.03 1lqi s GLN 38 Ca 0.63 0.07 -0.15 0.00 -2.50 0.00 0.00 55.36 53.42 1lqi s GLN 38 Cb -0.18 -1.32 -0.08 0.00 -1.64 0.00 0.00 33.01 29.78 1lqi s GLN 38 CO 0.49 -0.70 0.84 -1.58 0.50 0.00 0.00 175.29 174.83 1lqi s TRP 39 N 2.27 3.41 0.35 1.67 0.52 -1.24 -2.19 118.94 123.73 1lqi s TRP 39 Ca 0.06 1.29 0.00 0.00 0.02 0.00 0.00 56.10 57.47 1lqi s TRP 39 Cb -0.16 -2.62 0.00 0.00 -1.15 0.00 0.00 33.47 29.55 1lqi s TRP 39 CO -0.14 -0.11 0.00 0.00 0.02 0.00 0.00 176.95 176.72 1lqi n ALA 40 N -0.98 -1.93 0.00 0.98 0.00 0.43 -4.86 120.51 114.16 1lqi n ALA 40 Ca 0.04 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1lqi n ALA 40 Cb 0.54 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.56 1lqi n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lqi n GLY 41 N 0.73 1.50 0.53 0.00 0.00 -1.25 -4.51 105.19 102.18 1lqi n GLY 41 Ca 0.00 -1.69 0.38 0.00 0.00 0.00 0.00 46.02 44.71 1lqi n GLY 41 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1lqi h LYS 42 N 0.00 0.09 0.00 1.61 1.57 -1.99 0.88 116.57 118.73 1lqi h LYS 42 Ca 0.00 -0.01 -0.30 0.00 -1.87 0.00 0.00 60.65 58.47 1lqi h LYS 42 Cb 0.00 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.24 1lqi h LYS 42 CO 0.00 0.06 -1.84 2.48 -0.57 0.00 0.00 179.45 179.58 1lqi n TYR 43 N -4.35 0.78 0.00 -1.35 0.18 -1.26 -5.03 117.16 106.13 1lqi n TYR 43 Ca 0.33 0.28 0.00 0.00 1.88 0.00 0.00 57.90 60.40 1lqi n TYR 43 Cb 1.42 -1.14 0.00 0.00 -0.38 0.00 0.00 39.34 39.24 1lqi n TYR 43 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1lqi n GLY 44 N 1.59 1.51 2.93 -7.48 0.00 0.31 -4.40 105.19 99.63 1lqi n GLY 44 Ca -0.20 -0.45 -0.37 0.00 0.00 0.00 0.00 46.02 45.00 1lqi n GLY 44 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1lqi n ASN 45 N 4.16 4.96 -0.37 1.61 5.03 -1.25 0.16 115.26 129.56 1lqi n ASN 45 Ca 0.00 -3.30 0.00 0.00 0.87 0.00 0.00 54.58 52.15 1lqi n ASN 45 Cb 0.00 -1.06 0.00 0.00 -1.02 0.00 0.00 39.78 37.70 1lqi n ASN 45 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1lqi n ALA 46 N 1.65 0.00 -3.70 5.41 0.00 -0.93 -4.07 120.51 118.86 1lqi n ALA 46 Ca 0.25 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.46 1lqi n ALA 46 Cb 0.37 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.65 1lqi n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lqi s TRP 48 N 1.33 3.18 -0.06 0.00 -0.11 -0.32 -3.33 118.94 119.63 1lqi s TRP 48 Ca -0.04 -0.03 -0.08 0.00 1.22 0.00 0.00 56.10 57.17 1lqi s TRP 48 Cb -0.14 -2.85 -0.04 0.00 -1.50 0.00 0.00 33.47 28.94 1lqi s TRP 48 CO -0.03 -0.55 0.22 0.00 -4.62 0.00 0.00 176.95 171.97 1lqi s TYR 50 N -1.13 3.48 -1.43 0.00 2.02 -0.28 -2.41 117.35 117.61 1lqi s TYR 50 Ca 0.21 0.22 -0.07 0.00 -0.37 0.00 0.00 57.07 57.05 1lqi s TYR 50 Cb -0.13 -1.76 0.07 0.00 -0.40 0.00 0.00 41.96 39.74 1lqi s TYR 50 CO 0.10 0.35 0.18 0.00 -1.57 0.00 0.00 175.55 174.60 1lqi n ALA 51 N -1.13 -1.58 -1.78 3.71 0.00 -1.25 -2.60 120.51 115.88 1lqi n ALA 51 Ca -0.06 -0.30 -0.41 0.00 0.00 0.00 0.00 53.44 52.68 1lqi n ALA 51 Cb 0.55 -1.18 -0.03 0.00 0.00 0.00 0.00 19.45 18.79 1lqi n ALA 51 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1lqi s LEU 52 N -6.61 4.47 0.56 0.00 2.96 -0.23 -3.80 118.68 116.03 1lqi s LEU 52 Ca 0.25 2.53 -0.21 0.00 -0.22 0.00 0.00 54.13 56.48 1lqi s LEU 52 Cb -0.14 -3.64 -0.05 0.00 0.50 0.00 0.00 46.19 42.85 1lqi s LEU 52 CO 0.86 -0.39 1.19 -0.81 -1.32 0.00 0.00 176.35 175.89 1lqi n PRO 53 N 1.01 1.37 0.00 0.98 -0.04 -1.26 0.26 135.00 137.33 1lqi n PRO 53 Ca -0.00 0.51 0.07 0.00 -0.04 0.00 0.00 63.50 64.03 1lqi n PRO 53 Cb 0.43 -2.39 0.40 0.00 -0.04 0.00 0.00 33.50 31.90 1lqi n PRO 53 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1lqi n ASP 54 N -0.82 0.00 -0.92 3.54 8.00 -1.24 -2.21 116.55 122.90 1lqi n ASP 54 Ca 0.12 -0.37 0.08 0.00 0.71 0.00 0.00 54.79 55.32 1lqi n ASP 54 Cb 0.45 -0.03 0.22 0.00 -0.02 0.00 0.00 41.12 41.74 1lqi n ASP 54 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1lqi n ASN 55 N -1.03 2.65 -4.37 -2.24 6.94 -1.26 -4.86 115.26 111.10 1lqi n ASN 55 Ca 0.10 -2.00 -0.32 0.00 -0.02 0.00 0.00 54.58 52.34 1lqi n ASN 55 Cb 0.05 -0.33 -0.15 0.00 -2.36 0.00 0.00 39.78 36.99 1lqi n ASN 55 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1lqi s VAL 56 N -1.34 2.60 0.43 3.53 1.01 -0.94 -5.11 120.40 120.58 1lqi s VAL 56 Ca 0.33 -0.88 -0.23 0.00 0.00 0.00 0.00 61.98 61.21 1lqi s VAL 56 Cb 0.17 -2.00 -0.09 0.00 0.00 0.00 0.00 36.38 34.47 1lqi s VAL 56 CO 0.23 0.57 1.05 -2.16 0.00 0.00 0.00 175.10 174.79 1lqi s PRO 57 N -0.37 4.03 0.19 2.72 0.04 -1.26 -4.97 135.00 135.38 1lqi s PRO 57 Ca 0.03 1.49 0.00 0.00 0.04 0.00 0.00 61.00 62.56 1lqi s PRO 57 Cb -0.12 -2.40 0.00 0.00 0.04 0.00 0.00 34.50 32.02 1lqi s PRO 57 CO 0.02 -0.25 0.02 0.44 0.04 0.00 0.00 177.00 177.27 1lqi n ILE 58 N -0.36 0.00 -2.59 0.56 -5.35 -1.26 -2.57 119.36 107.79 1lqi n ILE 58 Ca 0.06 -0.85 -0.42 0.00 -0.27 0.00 0.00 62.75 61.27 1lqi n ILE 58 Cb 0.50 0.09 -0.03 0.00 -1.74 0.00 0.00 39.64 38.46 1lqi n ILE 58 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1lqi s ARG 59 N -2.69 4.47 0.38 6.28 1.81 -0.12 -4.29 118.95 124.79 1lqi s ARG 59 Ca 0.02 1.55 0.08 0.00 -1.72 0.00 0.00 55.73 55.65 1lqi s ARG 59 Cb -0.00 -3.46 -0.04 0.00 -0.45 0.00 0.00 34.95 31.00 1lqi s ARG 59 CO 0.01 -0.21 0.23 0.14 -0.68 0.00 0.00 175.30 174.79 1lqi s VAL 60 N 1.36 2.81 -0.22 3.52 -7.23 -1.26 -4.90 120.40 114.49 1lqi s VAL 60 Ca 0.54 -1.57 -0.29 0.00 -1.81 0.00 0.00 61.98 58.85 1lqi s VAL 60 Cb -0.23 -3.01 -0.02 0.00 0.56 0.00 0.00 36.38 33.67 1lqi s VAL 60 CO 0.26 -0.09 1.50 -2.16 -0.31 0.00 0.00 175.10 174.29 1lqi s PRO 61 N -3.95 3.91 0.00 4.82 0.04 -1.26 -4.68 135.00 133.88 1lqi s PRO 61 Ca 0.41 1.60 0.00 0.00 0.04 0.00 0.00 61.00 63.05 1lqi s PRO 61 Cb -0.01 -3.96 0.00 0.00 0.04 0.00 0.00 34.50 30.57 1lqi s PRO 61 CO 0.24 -1.14 0.00 0.41 0.04 0.00 0.00 177.00 176.55 1lqi n GLY 62 N 4.40 -0.02 0.00 0.56 0.00 -1.26 -5.14 105.19 103.74 1lqi n GLY 62 Ca 0.17 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1lqi n GLY 62 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1lqi n LYS 63 N 0.00 1.34 -4.32 1.61 5.02 -1.26 -5.18 118.16 115.37 1lqi n LYS 63 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.12 1lqi n LYS 63 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 34.91 1lqi n LYS 63 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88