#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 0.07 -0.29 2.03 -7.23 -1.26 -3.55 120.40 110.18 1lqi s VAL 2 Ca 0.00 -0.71 -0.15 0.00 -1.81 0.00 0.00 61.98 59.31 1lqi s VAL 2 Cb 0.00 -1.29 0.10 0.00 0.56 0.00 0.00 36.38 35.75 1lqi s VAL 2 CO 0.00 -0.31 0.76 0.00 -0.31 0.00 0.00 175.10 175.24 1lqi s ARG 3 N -3.83 0.60 -0.36 4.82 1.70 0.23 -4.75 118.95 117.36 1lqi s ARG 3 Ca 0.05 1.12 -0.17 0.00 -0.47 0.00 0.00 55.73 56.27 1lqi s ARG 3 Cb 0.02 0.24 -0.00 0.00 -0.57 0.00 0.00 34.95 34.64 1lqi s ARG 3 CO -0.10 -0.14 0.43 -0.51 -1.08 0.00 0.00 175.30 173.91 1lqi s ASP 4 N 1.79 6.23 0.14 -2.89 1.11 -1.26 -1.49 116.67 120.30 1lqi s ASP 4 Ca -0.09 -0.22 -0.10 0.00 0.18 0.00 0.00 52.55 52.32 1lqi s ASP 4 Cb -0.06 -2.23 0.04 0.00 1.07 0.00 0.00 42.92 41.74 1lqi s ASP 4 CO -0.19 -0.43 0.49 0.00 1.18 0.00 0.00 175.17 176.22 1lqi n ALA 5 N 5.56 -1.23 -2.69 5.23 0.00 -1.07 -4.98 120.51 121.34 1lqi n ALA 5 Ca -0.07 -0.58 -0.42 0.00 0.00 0.00 0.00 53.44 52.37 1lqi n ALA 5 Cb 0.49 0.38 -0.03 0.00 0.00 0.00 0.00 19.45 20.29 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 -4.53 2.61 0.30 0.00 1.51 -1.26 -1.75 117.35 114.24 1lqi s TYR 6 Ca 0.11 -0.70 -0.25 0.00 -1.01 0.00 0.00 57.07 55.22 1lqi s TYR 6 Cb -0.02 -4.52 -0.16 0.00 -0.11 0.00 0.00 41.96 37.14 1lqi s TYR 6 CO 0.04 -1.83 0.33 1.51 -1.11 0.00 0.00 175.55 174.49 1lqi n ILE 7 N 6.30 1.37 -3.63 2.71 3.06 -1.19 -1.19 119.36 126.79 1lqi n ILE 7 Ca 0.17 -0.50 -0.22 0.00 -2.50 0.00 0.00 62.75 59.70 1lqi n ILE 7 Cb 0.49 -0.02 -0.02 0.00 0.54 0.00 0.00 39.64 40.63 1lqi n ILE 7 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1lqi s ALA 8 N -1.32 4.20 0.00 1.51 0.00 -0.79 -3.48 121.76 121.87 1lqi s ALA 8 Ca 0.62 -1.75 0.00 0.00 0.00 0.00 0.00 51.96 50.82 1lqi s ALA 8 Cb -0.79 -0.95 0.00 0.00 0.00 0.00 0.00 23.12 21.39 1lqi s ALA 8 CO 0.59 -0.34 0.00 1.17 0.00 0.00 0.00 175.76 177.18 1lqi n LYS 9 N -1.65 2.52 -0.18 0.00 4.81 0.53 -4.80 118.16 119.38 1lqi n LYS 9 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.47 1lqi n LYS 9 Cb 0.63 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.71 1lqi n LYS 9 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 1lqi n ASN 10 N 0.00 -0.28 -3.17 3.14 0.23 -1.26 -2.32 115.26 111.60 1lqi n ASN 10 Ca 0.00 0.84 -0.22 0.00 -0.53 0.00 0.00 54.58 54.68 1lqi n ASN 10 Cb 0.00 -0.21 -0.05 0.00 -2.08 0.00 0.00 39.78 37.45 1lqi n ASN 10 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 1lqi n TYR 11 N -4.73 0.81 -1.25 -2.53 4.01 -1.26 -4.91 117.16 107.29 1lqi n TYR 11 Ca 0.06 -3.80 -0.09 0.00 -0.16 0.00 0.00 57.90 53.91 1lqi n TYR 11 Cb 0.21 -0.42 -0.04 0.00 -0.31 0.00 0.00 39.34 38.78 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 0.58 -4.30 -4.78 7.72 5.15 -0.98 -2.40 115.26 116.25 1lqi n ASN 12 Ca 0.25 0.22 -0.38 0.00 -0.60 0.00 0.00 54.58 54.06 1lqi n ASN 12 Cb 0.57 -2.57 -0.06 0.00 -0.53 0.00 0.00 39.78 37.19 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 -0.36 4.16 -1.05 0.00 -7.23 -1.26 0.20 120.40 114.85 1lqi s VAL 14 Ca 0.29 0.89 -0.22 0.00 -1.81 0.00 0.00 61.98 61.13 1lqi s VAL 14 Cb -0.18 -3.53 0.05 0.00 0.56 0.00 0.00 36.38 33.28 1lqi s VAL 14 CO 0.16 -0.73 1.49 -0.31 -0.31 0.00 0.00 175.10 175.40 1lqi s TYR 15 N -2.75 2.55 0.03 2.82 2.02 -1.23 -4.82 117.35 115.98 1lqi s TYR 15 Ca 0.60 -0.91 -0.30 0.00 -0.37 0.00 0.00 57.07 56.09 1lqi s TYR 15 Cb -0.13 -4.70 -0.05 0.00 -0.40 0.00 0.00 41.96 36.68 1lqi s TYR 15 CO 0.43 -1.92 1.23 -1.83 -1.57 0.00 0.00 175.55 171.89 1lqi s GLU 16 N 4.92 4.39 0.00 -0.62 -1.05 -1.22 -3.08 118.70 122.05 1lqi s GLU 16 Ca 0.47 1.79 0.00 0.00 -0.15 0.00 0.00 54.97 57.09 1lqi s GLU 16 Cb 0.00 -3.41 0.00 0.00 -0.44 0.00 0.00 34.13 30.29 1lqi s GLU 16 CO -0.08 -0.34 0.00 0.00 0.95 0.00 0.00 175.26 175.79 1lqi n PHE 18 N 0.00 0.00 -4.45 0.00 -0.00 -1.26 -4.96 117.46 106.79 1lqi n PHE 18 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 57.45 57.20 1lqi n PHE 18 Cb 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 39.48 39.35 1lqi n PHE 18 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 1lqi s ARG 19 N -1.36 1.24 0.50 -4.13 0.52 -1.26 -5.01 118.95 109.45 1lqi s ARG 19 Ca 0.00 -1.06 0.24 0.00 -0.52 0.00 0.00 55.73 54.40 1lqi s ARG 19 Cb 0.00 -1.44 1.33 0.00 0.52 0.00 0.00 34.95 35.36 1lqi s ARG 19 CO 0.00 0.35 1.95 -0.44 0.02 0.00 0.00 175.30 177.18 1lqi h ASP 20 N 4.45 0.10 -0.78 0.23 5.19 -1.95 -1.20 116.42 122.46 1lqi h ASP 20 Ca -0.44 0.01 0.18 0.00 -0.62 0.00 0.00 57.03 56.15 1lqi h ASP 20 Cb 1.17 -0.01 -0.12 0.00 0.18 0.00 0.00 39.33 40.55 1lqi h ASP 20 CO 0.42 0.05 0.18 0.00 -3.12 0.00 0.00 179.24 176.77 1lqi h ALA 21 N 1.67 1.03 -0.02 3.45 0.00 -1.95 -2.17 119.26 121.27 1lqi h ALA 21 Ca 0.32 0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.43 1lqi h ALA 21 Cb 1.13 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 1lqi h ALA 21 CO -0.04 -0.38 -0.12 -0.92 0.00 0.00 0.00 179.25 177.80 1lqi h TYR 22 N 0.25 -0.36 -0.99 0.00 3.20 -1.61 -2.62 116.97 114.83 1lqi h TYR 22 Ca 0.45 0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.43 1lqi h TYR 22 Cb 0.82 0.16 -0.12 0.00 1.54 0.00 0.00 36.73 39.13 1lqi h TYR 22 CO -0.28 -0.12 -0.57 0.00 -1.64 0.00 0.00 178.16 175.56 1lqi n ASN 24 N -5.26 -0.47 -0.14 0.00 5.15 -1.01 0.99 115.26 114.52 1lqi n ASN 24 Ca 0.03 1.69 -0.07 0.00 -0.60 0.00 0.00 54.58 55.63 1lqi n ASN 24 Cb 0.27 -0.46 0.09 0.00 -0.53 0.00 0.00 39.78 39.15 1lqi n ASN 24 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 1lqi h GLU 25 N 0.00 0.89 0.00 1.20 4.39 -0.46 -2.71 114.58 117.90 1lqi h GLU 25 Ca 0.42 -0.29 0.00 0.00 0.34 0.00 0.00 59.36 59.83 1lqi h GLU 25 Cb 0.66 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 1lqi h GLU 25 CO -0.99 0.92 0.00 -0.11 -1.16 0.00 0.00 179.01 177.67 1lqi n LEU 26 N -4.17 0.23 -0.40 1.33 7.94 0.28 -1.08 117.00 121.12 1lqi n LEU 26 Ca 0.02 0.70 -0.08 0.00 -1.11 0.00 0.00 56.01 55.54 1lqi n LEU 26 Cb 0.35 -0.41 -0.06 0.00 0.53 0.00 0.00 43.42 43.83 1lqi n LEU 26 CO 0.43 -0.41 0.49 0.00 -1.11 0.00 0.00 177.39 176.80 1lqi h THR 28 N 0.00 1.08 -0.46 0.00 1.35 -1.59 -0.83 112.91 112.46 1lqi h THR 28 Ca 0.20 -0.26 -0.02 0.00 -0.55 0.00 0.00 66.41 65.78 1lqi h THR 28 Cb 0.44 0.25 -0.02 0.00 -1.73 0.00 0.00 68.15 67.09 1lqi h THR 28 CO -0.92 0.14 0.22 0.11 -0.25 0.00 0.00 175.52 174.82 1lqi h LYS 29 N 0.76 0.64 0.00 4.72 1.57 0.24 -0.77 116.57 123.73 1lqi h LYS 29 Ca 0.26 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1lqi h LYS 29 Cb 0.10 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1lqi h LYS 29 CO -0.07 0.50 0.00 0.09 -0.57 0.00 0.00 179.45 179.40 1lqi n ASN 30 N -4.39 0.16 0.00 0.86 3.02 -0.39 -4.83 115.26 109.69 1lqi n ASN 30 Ca 0.04 0.52 0.00 0.00 -0.03 0.00 0.00 54.58 55.11 1lqi n ASN 30 Cb 0.12 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 38.73 1lqi n ASN 30 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lqi n GLY 31 N 1.03 1.36 0.00 7.41 0.00 -0.29 -4.64 105.19 110.06 1lqi n GLY 31 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.25 0.00 -0.11 4.61 0.00 -0.43 -4.24 120.51 119.09 1lqi n ALA 32 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 1lqi n ALA 32 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 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 -1.96 1.92 -3.55 0.00 2.88 -1.07 -4.38 113.62 107.46 1lqi n SER 33 Ca 0.00 0.38 -0.08 0.00 -1.33 0.00 0.00 58.87 57.84 1lqi n SER 33 Cb 0.00 -0.83 -0.03 0.00 -0.75 0.00 0.00 64.21 62.60 1lqi n SER 33 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1lqi s SER 34 N -6.79 -0.32 0.32 -3.46 0.01 -1.25 -4.60 113.70 97.61 1lqi s SER 34 Ca -0.32 0.17 0.03 0.00 1.31 0.00 0.00 55.95 57.13 1lqi s SER 34 Cb 0.09 0.30 -0.02 0.00 0.21 0.00 0.00 66.02 66.60 1lqi s SER 34 CO 0.46 -0.42 0.34 -0.83 0.41 0.00 0.00 173.24 173.20 1lqi s GLY 35 N -1.82 1.92 0.15 3.44 0.00 -1.26 -0.63 107.32 109.12 1lqi s GLY 35 Ca 0.03 -1.82 -0.16 0.00 0.00 0.00 0.00 44.72 42.77 1lqi s GLY 35 CO -0.04 -1.28 0.43 -2.52 0.00 0.00 0.00 173.10 169.69 1lqi s TYR 36 N -3.37 -0.14 0.05 1.90 -0.85 -0.94 -3.15 117.35 110.86 1lqi s TYR 36 Ca 0.37 -0.18 -0.18 0.00 -0.52 0.00 0.00 57.07 56.55 1lqi s TYR 36 Cb 0.02 0.28 -0.06 0.00 0.38 0.00 0.00 41.96 42.57 1lqi s TYR 36 CO 0.23 -0.76 0.53 0.00 -1.52 0.00 0.00 175.55 174.03 1lqi s GLN 38 N -1.01 0.58 0.27 0.00 2.00 -0.49 -4.85 119.66 116.16 1lqi s GLN 38 Ca 0.28 -0.89 -0.03 0.00 -2.00 0.00 0.00 55.36 52.72 1lqi s GLN 38 Cb -0.19 -1.79 -0.05 0.00 0.80 0.00 0.00 33.01 31.79 1lqi s GLN 38 CO 0.17 -0.97 0.50 1.67 -0.50 0.00 0.00 175.29 176.17 1lqi s TRP 39 N 1.76 3.48 0.00 1.67 -2.14 -1.26 -2.48 118.94 119.98 1lqi s TRP 39 Ca 0.09 0.50 0.00 0.00 2.66 0.00 0.00 56.10 59.35 1lqi s TRP 39 Cb -0.17 -1.99 0.00 0.00 -3.10 0.00 0.00 33.47 28.21 1lqi s TRP 39 CO -0.27 0.22 0.00 0.00 -2.66 0.00 0.00 176.95 174.24 1lqi n ALA 40 N -1.01 0.00 0.00 2.67 0.00 -0.68 -4.90 120.51 116.60 1lqi n ALA 40 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1lqi n ALA 40 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 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 0.00 0.00 0.09 0.00 0.00 -1.26 -4.36 105.19 99.66 1lqi n GLY 41 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.01 -0.29 1.61 1.79 -1.97 -2.36 116.57 115.34 1lqi h LYS 42 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1lqi h LYS 42 Cb 0.29 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.94 1lqi h LYS 42 CO 0.00 -0.00 0.00 2.48 -1.08 0.00 0.00 179.45 180.85 1lqi n TYR 43 N -3.48 0.84 -4.96 -1.35 0.18 -1.26 -5.07 117.16 102.06 1lqi n TYR 43 Ca 0.00 -0.77 0.00 0.00 1.88 0.00 0.00 57.90 59.01 1lqi n TYR 43 Cb 0.06 -0.24 0.00 0.00 -0.38 0.00 0.00 39.34 38.78 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 -0.21 3.00 3.52 -7.48 0.00 -0.89 -3.82 105.19 99.30 1lqi n GLY 44 Ca 0.19 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1lqi n GLY 44 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1lqi s ASN 45 N -4.00 6.27 0.00 1.61 -0.87 -1.26 -1.68 114.94 115.00 1lqi s ASN 45 Ca 0.00 -0.92 0.00 0.00 -1.57 0.00 0.00 52.86 50.37 1lqi s ASN 45 Cb 0.00 -2.51 0.00 0.00 -0.02 0.00 0.00 41.25 38.72 1lqi s ASN 45 CO 0.00 -1.60 0.00 0.00 -2.57 0.00 0.00 177.10 172.93 1lqi n ALA 46 N 8.59 0.00 -3.67 0.60 0.00 -1.03 -3.37 120.51 121.63 1lqi n ALA 46 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.43 1lqi n ALA 46 Cb 0.48 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.83 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 2.13 2.90 -0.11 0.00 -0.11 0.66 -3.19 118.94 121.21 1lqi s TRP 48 Ca -0.05 -0.21 -0.20 0.00 1.22 0.00 0.00 56.10 56.86 1lqi s TRP 48 Cb -0.11 -3.86 -0.04 0.00 -1.50 0.00 0.00 33.47 27.97 1lqi s TRP 48 CO -0.13 -1.22 0.56 0.00 -4.62 0.00 0.00 176.95 171.54 1lqi s TYR 50 N 0.82 3.47 -1.38 0.00 2.02 0.19 -2.61 117.35 119.87 1lqi s TYR 50 Ca 0.30 0.82 -0.13 0.00 -0.37 0.00 0.00 57.07 57.69 1lqi s TYR 50 Cb -0.16 -2.25 0.01 0.00 -0.40 0.00 0.00 41.96 39.16 1lqi s TYR 50 CO 0.13 0.05 0.37 0.00 -1.57 0.00 0.00 175.55 174.53 1lqi n ALA 51 N -1.08 -2.25 -2.27 3.71 0.00 -1.25 -2.59 120.51 114.76 1lqi n ALA 51 Ca 0.00 -0.43 -0.39 0.00 0.00 0.00 0.00 53.44 52.62 1lqi n ALA 51 Cb 0.54 -1.84 -0.06 0.00 0.00 0.00 0.00 19.45 18.10 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 -7.24 4.50 0.40 0.00 2.96 -0.56 -2.84 118.68 115.90 1lqi s LEU 52 Ca 0.20 1.41 -0.27 0.00 -0.22 0.00 0.00 54.13 55.25 1lqi s LEU 52 Cb -0.10 -3.12 -0.10 0.00 0.50 0.00 0.00 46.19 43.37 1lqi s LEU 52 CO 0.96 0.14 1.46 -2.16 -1.32 0.00 0.00 176.35 175.43 1lqi s PRO 53 N -0.61 4.00 0.00 0.98 0.04 -1.26 0.76 135.00 138.91 1lqi s PRO 53 Ca 0.34 2.51 0.00 0.00 0.04 0.00 0.00 61.00 63.89 1lqi s PRO 53 Cb -0.21 -2.88 0.01 0.00 0.04 0.00 0.00 34.50 31.46 1lqi s PRO 53 CO 0.22 -0.60 0.98 -0.25 0.04 0.00 0.00 177.00 177.38 1lqi n ASP 54 N 0.28 0.00 0.00 6.66 9.92 -1.23 -1.39 116.55 130.79 1lqi n ASP 54 Ca 0.02 0.47 0.10 0.00 -0.53 0.00 0.00 54.79 54.85 1lqi n ASP 54 Cb 0.40 -0.47 0.59 0.00 -0.64 0.00 0.00 41.12 41.00 1lqi n ASP 54 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 1lqi n ASN 55 N -1.47 0.00 -4.23 -2.24 0.23 -1.26 -4.66 115.26 101.62 1lqi n ASN 55 Ca 0.00 -1.01 -0.32 0.00 -0.53 0.00 0.00 54.58 52.71 1lqi n ASN 55 Cb 0.00 0.00 -0.16 0.00 -2.08 0.00 0.00 39.78 37.54 1lqi n ASN 55 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1lqi s VAL 56 N -2.00 2.23 0.57 3.53 1.01 -0.48 -5.11 120.40 120.14 1lqi s VAL 56 Ca 0.30 -0.95 -0.17 0.00 0.00 0.00 0.00 61.98 61.16 1lqi s VAL 56 Cb 0.14 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.60 1lqi s VAL 56 CO 0.23 0.55 1.06 -2.16 0.00 0.00 0.00 175.10 174.78 1lqi s PRO 57 N 0.48 3.40 0.39 2.72 0.04 -1.26 -4.94 135.00 135.83 1lqi s PRO 57 Ca -0.14 1.27 0.02 0.00 0.04 0.00 0.00 61.00 62.18 1lqi s PRO 57 Cb -0.17 -2.04 0.02 0.00 0.04 0.00 0.00 34.50 32.35 1lqi s PRO 57 CO 0.05 -0.75 0.15 0.44 0.04 0.00 0.00 177.00 176.93 1lqi n ILE 58 N -1.78 0.00 -2.61 0.56 -5.35 -1.26 -1.88 119.36 107.03 1lqi n ILE 58 Ca 0.09 -1.68 -0.43 0.00 -0.27 0.00 0.00 62.75 60.46 1lqi n ILE 58 Cb 0.53 0.10 -0.02 0.00 -1.74 0.00 0.00 39.64 38.50 1lqi n ILE 58 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1lqi s ARG 59 N -3.50 3.79 0.49 6.28 6.06 -0.33 -4.38 118.95 127.35 1lqi s ARG 59 Ca 0.12 0.67 -0.01 0.00 -2.50 0.00 0.00 55.73 54.00 1lqi s ARG 59 Cb -0.01 -3.87 -0.00 0.00 0.06 0.00 0.00 34.95 31.13 1lqi s ARG 59 CO 0.07 -1.28 0.74 0.14 -2.50 0.00 0.00 175.30 172.47 1lqi s VAL 60 N 4.28 3.91 -0.90 7.11 -7.23 -1.26 -4.92 120.40 121.38 1lqi s VAL 60 Ca 0.47 -0.35 -0.24 0.00 -1.81 0.00 0.00 61.98 60.05 1lqi s VAL 60 Cb -0.08 -3.47 -0.01 0.00 0.56 0.00 0.00 36.38 33.38 1lqi s VAL 60 CO 0.28 -0.38 1.73 -2.16 -0.31 0.00 0.00 175.10 174.27 1lqi s PRO 61 N -4.68 2.94 0.00 4.82 0.04 -1.26 -4.46 135.00 132.40 1lqi s PRO 61 Ca 0.50 -0.48 0.00 0.00 0.04 0.00 0.00 61.00 61.06 1lqi s PRO 61 Cb -0.10 -5.04 0.00 0.00 0.04 0.00 0.00 34.50 29.40 1lqi s PRO 61 CO 0.40 -2.85 0.00 0.41 0.04 0.00 0.00 177.00 175.00 1lqi n GLY 62 N 6.67 -1.41 0.00 0.56 0.00 -1.26 -5.18 105.19 104.56 1lqi n GLY 62 Ca 0.34 0.68 0.00 0.00 0.00 0.00 0.00 46.02 47.04 1lqi n GLY 62 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1lqi n LYS 63 N 0.00 0.00 -3.47 1.61 4.81 -1.26 -5.19 118.16 114.66 1lqi n LYS 63 Ca 0.00 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.29 1lqi n LYS 63 Cb 0.00 0.00 -0.04 0.00 0.02 0.00 0.00 35.03 35.01 1lqi n LYS 63 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57