#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 0.03 0.07 1.12 -7.23 -1.26 -3.20 120.40 109.93 1lqi s VAL 2 Ca 0.00 -1.16 -0.26 0.00 -1.81 0.00 0.00 61.98 58.75 1lqi s VAL 2 Cb 0.00 -1.88 0.08 0.00 0.56 0.00 0.00 36.38 35.14 1lqi s VAL 2 CO 0.00 -0.12 0.67 0.00 -0.31 0.00 0.00 175.10 175.35 1lqi s ARG 3 N -3.95 1.13 -0.20 4.82 1.04 0.11 -4.72 118.95 117.18 1lqi s ARG 3 Ca 0.16 -0.23 0.01 0.00 -1.04 0.00 0.00 55.73 54.62 1lqi s ARG 3 Cb -0.00 0.53 0.04 0.00 -2.04 0.00 0.00 34.95 33.48 1lqi s ARG 3 CO 0.02 -0.46 -0.10 -0.51 -0.04 0.00 0.00 175.30 174.21 1lqi s ASP 4 N -2.24 3.38 0.04 -2.89 1.01 -1.26 -1.01 116.67 113.69 1lqi s ASP 4 Ca -0.02 -0.88 -0.03 0.00 0.71 0.00 0.00 52.55 52.33 1lqi s ASP 4 Cb -0.01 -1.22 0.01 0.00 1.01 0.00 0.00 42.92 42.71 1lqi s ASP 4 CO -0.06 -0.15 0.17 0.00 0.21 0.00 0.00 175.17 175.34 1lqi n ALA 5 N 4.69 -0.43 -2.73 5.23 0.00 -1.06 -4.98 120.51 121.23 1lqi n ALA 5 Ca -0.15 -0.18 -0.42 0.00 0.00 0.00 0.00 53.44 52.69 1lqi n ALA 5 Cb 0.47 0.11 -0.03 0.00 0.00 0.00 0.00 19.45 19.99 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 -5.70 2.71 -0.16 0.00 1.51 -1.26 -1.98 117.35 112.46 1lqi s TYR 6 Ca 0.04 -0.84 -0.42 0.00 -1.01 0.00 0.00 57.07 54.84 1lqi s TYR 6 Cb -0.01 -4.48 -0.20 0.00 -0.11 0.00 0.00 41.96 37.17 1lqi s TYR 6 CO 0.01 -1.76 1.29 1.51 -1.11 0.00 0.00 175.55 175.49 1lqi n ILE 7 N 6.18 0.02 -2.09 2.71 3.06 -1.24 -0.98 119.36 127.01 1lqi n ILE 7 Ca 0.18 -0.00 -0.28 0.00 -2.50 0.00 0.00 62.75 60.15 1lqi n ILE 7 Cb 0.49 -0.29 0.12 0.00 0.54 0.00 0.00 39.64 40.50 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 1.16 2.81 0.00 1.51 0.00 -1.04 -2.88 121.76 123.32 1lqi s ALA 8 Ca 0.95 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 51.87 1lqi s ALA 8 Cb -1.31 -2.67 0.00 0.00 0.00 0.00 0.00 23.12 19.14 1lqi s ALA 8 CO 0.64 -1.77 0.00 1.17 0.00 0.00 0.00 175.76 175.80 1lqi n LYS 9 N -3.27 2.42 -0.30 0.00 3.00 0.66 -4.76 118.16 115.90 1lqi n LYS 9 Ca 0.11 0.00 0.28 0.00 -0.00 0.00 0.00 58.31 58.70 1lqi n LYS 9 Cb 0.60 0.00 0.50 0.00 0.00 0.00 0.00 35.03 36.13 1lqi n LYS 9 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1lqi n ASN 10 N -0.60 0.25 -3.13 3.14 3.02 -1.26 -2.16 115.26 114.52 1lqi n ASN 10 Ca 0.00 1.27 -0.18 0.00 -0.03 0.00 0.00 54.58 55.65 1lqi n ASN 10 Cb 0.00 -0.62 -0.02 0.00 -0.61 0.00 0.00 39.78 38.52 1lqi n ASN 10 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1lqi n TYR 11 N -4.67 0.43 -1.29 3.10 4.01 -1.26 -4.94 117.16 112.55 1lqi n TYR 11 Ca 0.31 -3.72 -0.10 0.00 -0.16 0.00 0.00 57.90 54.23 1lqi n TYR 11 Cb 1.12 -0.42 -0.04 0.00 -0.31 0.00 0.00 39.34 39.69 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 0.22 -4.26 -4.87 7.72 5.15 -0.92 -2.35 115.26 115.95 1lqi n ASN 12 Ca 0.24 0.25 -0.35 0.00 -0.60 0.00 0.00 54.58 54.11 1lqi n ASN 12 Cb 0.67 -2.64 -0.05 0.00 -0.53 0.00 0.00 39.78 37.22 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 -1.35 3.18 -1.30 0.00 -7.23 -1.26 0.24 120.40 112.68 1lqi s VAL 14 Ca 0.31 0.38 -0.18 0.00 -1.81 0.00 0.00 61.98 60.69 1lqi s VAL 14 Cb -0.14 -3.31 0.06 0.00 0.56 0.00 0.00 36.38 33.56 1lqi s VAL 14 CO 0.17 -0.50 1.76 -1.22 -0.31 0.00 0.00 175.10 175.01 1lqi n TYR 15 N -3.17 4.58 -1.60 2.82 4.02 -1.14 -4.77 117.16 117.90 1lqi n TYR 15 Ca 0.07 -2.81 -0.51 0.00 -0.01 0.00 0.00 57.90 54.65 1lqi n TYR 15 Cb 0.57 -2.64 -0.05 0.00 -0.02 0.00 0.00 39.34 37.20 1lqi n TYR 15 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 1lqi n GLU 16 N 8.32 1.29 -2.48 -0.72 0.28 -1.26 -3.07 120.64 122.99 1lqi n GLU 16 Ca 0.49 0.46 -0.05 0.00 -0.16 0.00 0.00 57.16 57.90 1lqi n GLU 16 Cb 0.46 -2.09 -0.01 0.00 1.43 0.00 0.00 31.44 31.22 1lqi n GLU 16 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1lqi n PHE 18 N -0.20 0.00 -3.54 0.00 7.35 -1.26 -4.91 117.46 114.89 1lqi n PHE 18 Ca -0.02 0.00 -0.17 0.00 -0.76 0.00 0.00 57.45 56.50 1lqi n PHE 18 Cb 0.12 0.00 -0.06 0.00 0.35 0.00 0.00 39.48 39.89 1lqi n PHE 18 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 1lqi s ARG 19 N -1.89 1.03 0.60 -4.13 0.52 -1.26 -5.00 118.95 108.82 1lqi s ARG 19 Ca 0.00 0.10 0.29 0.00 -0.52 0.00 0.00 55.73 55.60 1lqi s ARG 19 Cb 0.00 0.48 1.18 0.00 0.52 0.00 0.00 34.95 37.13 1lqi s ARG 19 CO 0.00 -0.34 1.54 -0.44 0.02 0.00 0.00 175.30 176.08 1lqi h ASP 20 N 2.99 0.00 -0.05 0.23 5.19 -1.93 0.12 116.42 122.98 1lqi h ASP 20 Ca -0.28 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.14 1lqi h ASP 20 Cb 1.17 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.66 1lqi h ASP 20 CO 0.39 0.00 -0.02 0.00 -3.12 0.00 0.00 179.24 176.49 1lqi h ALA 21 N 0.90 0.02 -0.42 3.45 0.00 -1.94 -2.59 119.26 118.68 1lqi h ALA 21 Ca 0.41 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1lqi h ALA 21 Cb 2.31 0.05 0.00 0.00 0.00 0.00 0.00 17.79 20.15 1lqi h ALA 21 CO -0.00 -0.50 0.00 0.98 0.00 0.00 0.00 179.25 179.72 1lqi n TYR 22 N -5.13 0.00 -0.32 0.00 9.36 0.43 -2.13 117.16 119.37 1lqi n TYR 22 Ca -0.06 0.00 -0.07 0.00 3.32 0.00 0.00 57.90 61.09 1lqi n TYR 22 Cb 0.06 -0.43 -0.03 0.00 -0.63 0.00 0.00 39.34 38.31 1lqi n TYR 22 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1lqi n ASN 24 N -5.38 -0.47 -0.27 0.00 5.15 -0.98 0.10 115.26 113.41 1lqi n ASN 24 Ca 0.04 1.67 -0.07 0.00 -0.60 0.00 0.00 54.58 55.63 1lqi n ASN 24 Cb 0.34 -0.45 0.05 0.00 -0.53 0.00 0.00 39.78 39.19 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 1.17 0.28 1.20 4.81 -0.25 -2.82 114.58 118.96 1lqi h GLU 25 Ca 0.41 -0.26 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1lqi h GLU 25 Cb 0.65 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.87 1lqi h GLU 25 CO -0.98 1.00 -0.13 1.25 -0.73 0.00 0.00 179.01 179.41 1lqi h LEU 26 N 1.11 -0.31 -0.72 1.64 5.85 0.16 -0.20 115.31 122.84 1lqi h LEU 26 Ca 0.24 0.01 0.06 0.00 0.84 0.00 0.00 57.88 59.03 1lqi h LEU 26 Cb 0.33 0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.35 1lqi h LEU 26 CO -0.01 -0.20 -0.43 0.00 -0.34 0.00 0.00 178.44 177.47 1lqi h THR 28 N 0.00 0.88 -0.99 0.00 1.35 -1.56 -0.10 112.91 112.49 1lqi h THR 28 Ca 0.12 -0.13 0.03 0.00 -0.55 0.00 0.00 66.41 65.87 1lqi h THR 28 Cb 0.30 0.47 -0.05 0.00 -1.73 0.00 0.00 68.15 67.13 1lqi h THR 28 CO -0.68 0.07 0.65 0.11 -0.25 0.00 0.00 175.52 175.42 1lqi h LYS 29 N 0.38 1.25 0.00 4.72 1.79 0.27 0.00 116.57 124.98 1lqi h LYS 29 Ca 0.28 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.67 1lqi h LYS 29 Cb 0.58 -0.28 0.00 0.00 -1.58 0.00 0.00 32.23 30.95 1lqi h LYS 29 CO -0.07 0.83 0.00 0.09 -1.08 0.00 0.00 179.45 179.21 1lqi n ASN 30 N -4.42 0.59 0.00 0.86 3.02 -0.15 -4.85 115.26 110.32 1lqi n ASN 30 Ca 0.13 0.59 0.00 0.00 -0.03 0.00 0.00 54.58 55.27 1lqi n ASN 30 Cb 0.06 -0.74 0.00 0.00 -0.61 0.00 0.00 39.78 38.50 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 0.81 1.35 0.00 7.41 0.00 -0.01 -4.67 105.19 110.08 1lqi n GLY 31 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.97 0.00 -0.11 4.61 0.00 -0.61 -4.55 120.51 118.88 1lqi n ALA 32 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 1lqi n ALA 32 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 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 -2.13 1.88 -3.52 0.00 2.88 0.23 -4.40 113.62 108.57 1lqi n SER 33 Ca 0.00 0.42 -0.08 0.00 -1.33 0.00 0.00 58.87 57.88 1lqi n SER 33 Cb 0.00 -0.90 -0.02 0.00 -0.75 0.00 0.00 64.21 62.54 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 -6.82 -0.34 0.25 -3.46 0.01 -1.24 -4.69 113.70 97.40 1lqi s SER 34 Ca -0.30 0.04 0.01 0.00 1.31 0.00 0.00 55.95 57.01 1lqi s SER 34 Cb 0.08 0.35 -0.04 0.00 0.21 0.00 0.00 66.02 66.62 1lqi s SER 34 CO 0.50 -0.56 0.14 -0.83 0.41 0.00 0.00 173.24 172.91 1lqi s GLY 35 N -2.33 1.71 0.30 3.44 0.00 -1.26 -0.70 107.32 108.48 1lqi s GLY 35 Ca 0.05 -1.79 -0.06 0.00 0.00 0.00 0.00 44.72 42.92 1lqi s GLY 35 CO -0.08 -1.49 0.45 -2.52 0.00 0.00 0.00 173.10 169.47 1lqi s TYR 36 N -3.89 0.79 -0.18 1.90 -0.85 -0.52 -3.14 117.35 111.45 1lqi s TYR 36 Ca 0.38 -1.08 -0.06 0.00 -0.52 0.00 0.00 57.07 55.78 1lqi s TYR 36 Cb 0.06 -0.00 -0.04 0.00 0.38 0.00 0.00 41.96 42.37 1lqi s TYR 36 CO 0.15 -1.05 0.04 0.00 -1.52 0.00 0.00 175.55 173.17 1lqi s GLN 38 N 0.52 3.92 0.09 0.00 -0.44 -0.14 -4.88 119.66 118.73 1lqi s GLN 38 Ca 0.02 -2.07 -0.31 0.00 -2.50 0.00 0.00 55.36 50.50 1lqi s GLN 38 Cb -0.13 -5.26 -0.08 0.00 -1.64 0.00 0.00 33.01 25.90 1lqi s GLN 38 CO 0.01 -2.00 1.54 -1.58 0.50 0.00 0.00 175.29 173.76 1lqi s TRP 39 N 3.14 2.80 0.10 1.67 0.23 -1.26 -2.36 118.94 123.26 1lqi s TRP 39 Ca 0.46 0.60 0.00 0.00 -2.03 0.00 0.00 56.10 55.13 1lqi s TRP 39 Cb -0.00 -3.85 0.00 0.00 0.03 0.00 0.00 33.47 29.65 1lqi s TRP 39 CO 0.00 -3.22 0.00 0.00 0.96 0.00 0.00 176.95 174.69 1lqi n ALA 40 N 4.87 -2.32 0.00 0.98 0.00 0.83 -4.94 120.51 119.93 1lqi n ALA 40 Ca 0.14 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1lqi n ALA 40 Cb 0.41 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.74 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 1.32 -0.55 0.21 0.00 0.00 -1.16 -4.83 105.19 100.17 1lqi n GLY 41 Ca 0.00 -0.81 -0.01 0.00 0.00 0.00 0.00 46.02 45.20 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 0.26 -0.57 1.61 6.56 -1.98 -2.58 116.57 119.88 1lqi h LYS 42 Ca 0.00 -0.11 0.00 0.00 -1.06 0.00 0.00 60.65 59.48 1lqi h LYS 42 Cb 0.00 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 31.65 1lqi h LYS 42 CO 0.00 0.58 0.00 2.48 -2.06 0.00 0.00 179.45 180.45 1lqi n TYR 43 N -4.08 1.27 0.00 -1.35 0.18 -1.26 -5.02 117.16 106.90 1lqi n TYR 43 Ca -0.01 -0.63 0.00 0.00 1.88 0.00 0.00 57.90 59.14 1lqi n TYR 43 Cb 0.43 -0.22 0.00 0.00 -0.38 0.00 0.00 39.34 39.18 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 0.87 1.25 3.21 -7.48 0.00 -0.97 -3.96 105.19 98.10 1lqi n GLY 44 Ca 0.23 0.25 -0.42 0.00 0.00 0.00 0.00 46.02 46.09 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 6.05 0.02 1.61 0.02 -1.26 -0.12 114.94 117.26 1lqi s ASN 45 Ca 0.00 -2.83 0.00 0.00 -1.02 0.00 0.00 52.86 49.01 1lqi s ASN 45 Cb 0.00 -2.04 0.00 0.00 0.02 0.00 0.00 41.25 39.23 1lqi s ASN 45 CO 0.00 -0.46 0.00 0.00 0.02 0.00 0.00 177.10 176.66 1lqi n ALA 46 N 3.66 0.00 -3.69 0.60 0.00 -1.00 -3.06 120.51 117.02 1lqi n ALA 46 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.27 1lqi n ALA 46 Cb 0.42 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.72 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 1.85 3.08 -0.17 0.00 -0.11 0.80 -3.74 118.94 120.65 1lqi s TRP 48 Ca 0.04 0.47 -0.15 0.00 1.22 0.00 0.00 56.10 57.68 1lqi s TRP 48 Cb -0.17 -3.49 -0.04 0.00 -1.50 0.00 0.00 33.47 28.26 1lqi s TRP 48 CO -0.19 -0.81 0.36 0.00 -4.62 0.00 0.00 176.95 171.69 1lqi s TYR 50 N 0.86 3.46 -0.21 0.00 2.02 0.12 -2.57 117.35 121.03 1lqi s TYR 50 Ca 0.19 0.78 -0.17 0.00 -0.37 0.00 0.00 57.07 57.50 1lqi s TYR 50 Cb -0.14 -2.18 0.03 0.00 -0.40 0.00 0.00 41.96 39.26 1lqi s TYR 50 CO 0.06 0.34 0.30 0.00 -1.57 0.00 0.00 175.55 174.69 1lqi n ALA 51 N 0.06 -2.21 -2.73 3.71 0.00 -1.16 -2.51 120.51 115.68 1lqi n ALA 51 Ca -0.01 0.20 -0.17 0.00 0.00 0.00 0.00 53.44 53.45 1lqi n ALA 51 Cb 0.52 -1.35 -0.13 0.00 0.00 0.00 0.00 19.45 18.49 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 -1.69 2.16 0.32 0.00 2.96 -0.18 -0.60 118.68 121.66 1lqi s LEU 52 Ca 0.17 -0.41 -0.29 0.00 -0.22 0.00 0.00 54.13 53.38 1lqi s LEU 52 Cb -0.02 -0.41 -0.12 0.00 0.50 0.00 0.00 46.19 46.14 1lqi s LEU 52 CO 0.42 -0.03 1.41 -0.81 -1.32 0.00 0.00 176.35 176.02 1lqi n PRO 53 N 1.98 2.31 0.00 0.98 -0.04 -1.26 0.07 135.00 139.03 1lqi n PRO 53 Ca -0.18 0.81 0.01 0.00 -0.04 0.00 0.00 63.50 64.10 1lqi n PRO 53 Cb 0.55 -2.48 0.06 0.00 -0.04 0.00 0.00 33.50 31.59 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 1.29 0.00 0.00 3.54 8.00 -1.19 -1.76 116.55 126.43 1lqi n ASP 54 Ca 0.06 0.31 0.07 0.00 0.71 0.00 0.00 54.79 55.94 1lqi n ASP 54 Cb 0.36 -0.33 0.33 0.00 -0.02 0.00 0.00 41.12 41.45 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 -1.33 0.00 -4.41 -2.24 6.94 -1.26 -4.50 115.26 108.45 1lqi n ASN 55 Ca 0.01 0.24 -0.35 0.00 -0.02 0.00 0.00 54.58 54.46 1lqi n ASN 55 Cb 0.02 -0.36 -0.13 0.00 -2.36 0.00 0.00 39.78 36.95 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 -2.73 3.76 0.88 3.53 1.01 -0.72 -5.10 120.40 121.03 1lqi s VAL 56 Ca 0.11 -0.38 -0.12 0.00 0.00 0.00 0.00 61.98 61.59 1lqi s VAL 56 Cb 0.09 -2.69 0.12 0.00 0.00 0.00 0.00 36.38 33.90 1lqi s VAL 56 CO 0.23 0.43 1.09 -2.16 0.00 0.00 0.00 175.10 174.69 1lqi s PRO 57 N 1.05 1.40 0.40 2.72 0.04 -1.26 -4.97 135.00 134.38 1lqi s PRO 57 Ca 0.02 0.77 0.03 0.00 0.04 0.00 0.00 61.00 61.85 1lqi s PRO 57 Cb -0.14 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.56 1lqi s PRO 57 CO 0.01 -2.13 0.10 0.44 0.04 0.00 0.00 177.00 175.46 1lqi n ILE 58 N -3.80 0.00 -2.73 0.56 -5.35 -1.26 -2.50 119.36 104.27 1lqi n ILE 58 Ca 0.07 -2.17 -0.41 0.00 -0.27 0.00 0.00 62.75 59.96 1lqi n ILE 58 Cb 0.56 0.69 -0.04 0.00 -1.74 0.00 0.00 39.64 39.10 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 -3.49 4.67 0.27 6.28 3.52 -0.15 -4.24 118.95 125.81 1lqi s ARG 59 Ca 0.14 1.44 0.09 0.00 -0.13 0.00 0.00 55.73 57.27 1lqi s ARG 59 Cb 0.01 -3.39 -0.04 0.00 -1.56 0.00 0.00 34.95 29.96 1lqi s ARG 59 CO 0.10 0.17 0.03 0.14 -0.81 0.00 0.00 175.30 174.93 1lqi s VAL 60 N 0.16 3.47 -1.05 7.11 -7.23 -1.26 -4.86 120.40 116.74 1lqi s VAL 60 Ca 0.47 -1.85 -0.23 0.00 -1.81 0.00 0.00 61.98 58.56 1lqi s VAL 60 Cb -0.23 -2.90 -0.06 0.00 0.56 0.00 0.00 36.38 33.75 1lqi s VAL 60 CO 0.29 -0.35 1.92 -2.16 -0.31 0.00 0.00 175.10 174.49 1lqi s PRO 61 N -3.71 2.60 0.00 4.82 0.04 -1.26 -4.31 135.00 133.19 1lqi s PRO 61 Ca 0.32 -0.79 0.00 0.00 0.04 0.00 0.00 61.00 60.57 1lqi s PRO 61 Cb -0.06 -5.17 0.00 0.00 0.04 0.00 0.00 34.50 29.31 1lqi s PRO 61 CO 0.21 -3.60 0.00 0.41 0.04 0.00 0.00 177.00 174.06 1lqi n GLY 62 N 6.31 -1.44 3.82 0.56 0.00 -1.26 -5.18 105.19 108.00 1lqi n GLY 62 Ca 0.42 0.57 -0.05 0.00 0.00 0.00 0.00 46.02 46.96 1lqi n GLY 62 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1lqi s LYS 63 N 0.00 1.61 0.05 1.61 2.47 -1.26 -5.18 119.74 119.04 1lqi s LYS 63 Ca 0.00 -0.97 -0.13 0.00 -1.56 0.00 0.00 55.97 53.31 1lqi s LYS 63 Cb 0.00 0.50 0.02 0.00 -1.46 0.00 0.00 37.83 36.89 1lqi s LYS 63 CO 0.00 -0.75 0.29 0.00 0.16 0.00 0.00 175.35 175.05