#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 0.04 -0.28 1.12 -7.23 -1.25 -2.56 120.40 110.24 1lqi s VAL 2 Ca 0.00 -0.33 -0.15 0.00 -1.81 0.00 0.00 61.98 59.69 1lqi s VAL 2 Cb 0.00 -0.65 0.10 0.00 0.56 0.00 0.00 36.38 36.38 1lqi s VAL 2 CO 0.00 -0.18 0.72 0.00 -0.31 0.00 0.00 175.10 175.33 1lqi s ARG 3 N -1.04 0.65 -0.35 4.82 1.70 0.51 -4.85 118.95 120.39 1lqi s ARG 3 Ca -0.11 1.19 -0.19 0.00 -0.47 0.00 0.00 55.73 56.15 1lqi s ARG 3 Cb -0.04 0.24 -0.00 0.00 -0.57 0.00 0.00 34.95 34.57 1lqi s ARG 3 CO 0.04 -0.15 0.56 -0.51 -1.08 0.00 0.00 175.30 174.17 1lqi s ASP 4 N 1.79 6.36 0.33 -2.89 1.01 -1.26 -1.86 116.67 120.16 1lqi s ASP 4 Ca -0.09 0.06 -0.12 0.00 0.71 0.00 0.00 52.55 53.10 1lqi s ASP 4 Cb -0.06 -2.29 0.05 0.00 1.01 0.00 0.00 42.92 41.63 1lqi s ASP 4 CO -0.19 -0.52 0.66 0.00 0.21 0.00 0.00 175.17 175.33 1lqi n ALA 5 N 5.85 -1.49 -2.55 5.23 0.00 -1.03 -4.97 120.51 121.55 1lqi n ALA 5 Ca -0.03 -1.07 -0.41 0.00 0.00 0.00 0.00 53.44 51.93 1lqi n ALA 5 Cb 0.49 0.85 -0.03 0.00 0.00 0.00 0.00 19.45 20.76 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 -3.23 2.31 0.13 0.00 1.51 -1.26 -1.88 117.35 114.92 1lqi s TYR 6 Ca 0.13 -0.16 -0.33 0.00 -1.01 0.00 0.00 57.07 55.70 1lqi s TYR 6 Cb -0.04 -4.64 -0.18 0.00 -0.11 0.00 0.00 41.96 37.00 1lqi s TYR 6 CO 0.10 -2.06 0.88 1.51 -1.11 0.00 0.00 175.55 174.87 1lqi n ILE 7 N 6.46 1.05 -2.57 2.71 3.06 -1.25 -1.43 119.36 127.38 1lqi n ILE 7 Ca 0.07 -0.26 -0.26 0.00 -2.50 0.00 0.00 62.75 59.80 1lqi n ILE 7 Cb 0.49 -0.23 0.02 0.00 0.54 0.00 0.00 39.64 40.46 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 -0.47 3.41 0.00 1.51 0.00 -1.07 -3.88 121.76 121.27 1lqi s ALA 8 Ca 0.75 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 52.00 1lqi s ALA 8 Cb -1.02 -2.51 0.00 0.00 0.00 0.00 0.00 23.12 19.58 1lqi s ALA 8 CO 0.56 -0.60 0.00 1.17 0.00 0.00 0.00 175.76 176.89 1lqi n LYS 9 N -2.40 3.74 0.13 0.00 0.00 0.07 -4.76 118.16 114.94 1lqi n LYS 9 Ca 0.03 0.00 -0.16 0.00 0.00 0.00 0.00 58.31 58.17 1lqi n LYS 9 Cb 0.57 0.00 -0.10 0.00 0.00 0.00 0.00 35.03 35.50 1lqi n LYS 9 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.40 176.49 1lqi h ASN 10 N 0.00 -1.54 -2.16 3.14 2.35 -1.91 -3.32 115.58 112.14 1lqi h ASN 10 Ca 0.00 0.16 -0.59 0.00 -0.55 0.00 0.00 56.30 55.32 1lqi h ASN 10 Cb 0.00 0.56 -0.41 0.00 0.05 0.00 0.00 38.32 38.52 1lqi h ASN 10 CO 0.00 -0.57 -0.69 -1.22 -1.65 0.00 0.00 177.43 173.30 1lqi n TYR 11 N -5.50 2.95 -1.24 1.19 4.01 -1.26 -4.85 117.16 112.46 1lqi n TYR 11 Ca -0.09 -4.04 -0.08 0.00 -0.16 0.00 0.00 57.90 53.53 1lqi n TYR 11 Cb 0.42 -0.52 -0.04 0.00 -0.31 0.00 0.00 39.34 38.89 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 0.87 -4.49 -1.64 7.72 5.15 -1.25 -2.32 115.26 119.31 1lqi n ASN 12 Ca 0.28 0.20 0.00 0.00 -0.60 0.00 0.00 54.58 54.47 1lqi n ASN 12 Cb 0.43 -2.71 0.00 0.00 -0.53 0.00 0.00 39.78 36.97 1lqi n ASN 12 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1lqi n VAL 14 N 0.00 0.00 -3.46 0.00 0.24 -1.26 -0.75 118.33 113.10 1lqi n VAL 14 Ca 0.00 -0.97 -0.43 0.00 -2.04 0.00 0.00 64.34 60.90 1lqi n VAL 14 Cb 0.00 0.46 -0.07 0.00 -1.47 0.00 0.00 33.84 32.76 1lqi n VAL 14 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 1lqi s TYR 15 N -2.47 3.36 0.32 6.34 1.51 -1.25 -4.52 117.35 120.64 1lqi s TYR 15 Ca 0.14 -1.63 -0.29 0.00 -1.01 0.00 0.00 57.07 54.28 1lqi s TYR 15 Cb 0.01 -3.60 -0.10 0.00 -0.11 0.00 0.00 41.96 38.16 1lqi s TYR 15 CO 0.10 -1.00 1.33 -1.83 -1.11 0.00 0.00 175.55 173.05 1lqi s GLU 16 N 1.46 4.33 -0.29 -0.62 4.04 -1.26 -2.38 118.70 123.99 1lqi s GLU 16 Ca 0.05 2.25 -0.14 0.00 0.04 0.00 0.00 54.97 57.16 1lqi s GLU 16 Cb -0.28 -3.07 0.10 0.00 0.02 0.00 0.00 34.13 30.90 1lqi s GLU 16 CO 0.01 -0.24 0.69 0.00 -1.84 0.00 0.00 175.26 173.88 1lqi n PHE 18 N 4.62 0.00 -4.16 0.00 7.35 -1.26 -4.77 117.46 119.24 1lqi n PHE 18 Ca -0.18 0.00 -0.20 0.00 -0.76 0.00 0.00 57.45 56.31 1lqi n PHE 18 Cb 0.56 -0.07 -0.16 0.00 0.35 0.00 0.00 39.48 40.16 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 -2.25 0.85 0.62 -4.13 0.52 -1.26 -4.99 118.95 108.31 1lqi s ARG 19 Ca 0.33 -0.11 0.26 0.00 -0.52 0.00 0.00 55.73 55.69 1lqi s ARG 19 Cb 0.20 -0.86 1.34 0.00 0.52 0.00 0.00 34.95 36.15 1lqi s ARG 19 CO 0.42 -0.09 1.76 -0.44 0.02 0.00 0.00 175.30 176.98 1lqi h ASP 20 N 7.21 0.00 -0.53 0.23 5.19 -1.93 0.00 116.42 126.60 1lqi h ASP 20 Ca -0.37 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.04 1lqi h ASP 20 Cb 1.15 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.64 1lqi h ASP 20 CO 0.46 0.00 0.33 0.00 -3.12 0.00 0.00 179.24 176.91 1lqi h ALA 21 N 1.19 0.67 -0.13 3.45 0.00 -1.94 -2.71 119.26 119.78 1lqi h ALA 21 Ca 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1lqi h ALA 21 Cb 1.26 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1lqi h ALA 21 CO -0.00 0.14 0.00 0.98 0.00 0.00 0.00 179.25 180.37 1lqi n TYR 22 N -4.69 0.00 -0.34 0.00 9.36 -0.01 -1.67 117.16 119.82 1lqi n TYR 22 Ca 0.03 0.00 -0.07 0.00 3.32 0.00 0.00 57.90 61.18 1lqi n TYR 22 Cb 0.04 -0.48 -0.03 0.00 -0.63 0.00 0.00 39.34 38.25 1lqi n TYR 22 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1lqi h ASN 24 N -0.08 -0.54 -0.06 0.00 -1.24 -1.22 0.66 115.58 113.10 1lqi h ASN 24 Ca 0.23 0.26 -0.12 0.00 0.71 0.00 0.00 56.30 57.38 1lqi h ASN 24 Cb 0.53 0.47 -0.01 0.00 0.73 0.00 0.00 38.32 40.04 1lqi h ASN 24 CO -0.88 -0.29 -0.34 -0.33 -1.29 0.00 0.00 177.43 174.30 1lqi h GLU 25 N 0.04 0.55 0.00 6.67 4.39 0.70 -2.36 114.58 124.57 1lqi h GLU 25 Ca 0.51 -0.25 0.00 0.00 0.34 0.00 0.00 59.36 59.96 1lqi h GLU 25 Cb 0.96 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.60 1lqi h GLU 25 CO -0.86 0.82 0.00 -0.11 -1.16 0.00 0.00 179.01 177.69 1lqi n LEU 26 N -4.06 0.11 -0.31 1.33 7.94 0.21 -1.21 117.00 121.00 1lqi n LEU 26 Ca -0.01 0.71 0.07 0.00 -1.11 0.00 0.00 56.01 55.67 1lqi n LEU 26 Cb 0.47 -0.47 0.16 0.00 0.53 0.00 0.00 43.42 44.12 1lqi n LEU 26 CO 0.44 -0.47 0.74 0.00 -1.11 0.00 0.00 177.39 176.99 1lqi h THR 28 N 0.02 1.25 -0.36 0.00 1.35 -1.50 -0.64 112.91 113.03 1lqi h THR 28 Ca 0.46 -0.61 -0.03 0.00 -0.55 0.00 0.00 66.41 65.68 1lqi h THR 28 Cb 0.80 0.05 -0.02 0.00 -1.73 0.00 0.00 68.15 67.25 1lqi h THR 28 CO -0.87 0.28 0.08 0.11 -0.25 0.00 0.00 175.52 174.87 1lqi h LYS 29 N 1.23 0.53 0.00 4.72 1.57 0.18 -1.16 116.57 123.63 1lqi h LYS 29 Ca 0.31 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1lqi h LYS 29 Cb 0.01 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.23 1lqi h LYS 29 CO -0.05 0.50 0.00 0.09 -0.57 0.00 0.00 179.45 179.42 1lqi n ASN 30 N -4.33 0.15 0.00 0.86 3.02 -0.45 -4.82 115.26 109.68 1lqi n ASN 30 Ca 0.02 0.53 0.00 0.00 -0.03 0.00 0.00 54.58 55.10 1lqi n ASN 30 Cb 0.19 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 38.80 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 0.59 1.82 0.00 7.41 0.00 -0.44 -4.67 105.19 109.90 1lqi n GLY 31 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.84 0.00 -0.11 4.61 0.00 -0.31 -3.88 120.51 119.98 1lqi n ALA 32 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 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 -0.48 1.65 -0.53 0.00 2.88 -0.74 -4.53 113.62 111.87 1lqi n SER 33 Ca 0.00 0.20 0.00 0.00 -1.33 0.00 0.00 58.87 57.74 1lqi n SER 33 Cb 0.00 -0.58 0.00 0.00 -0.75 0.00 0.00 64.21 62.88 1lqi n SER 33 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1lqi n SER 34 N -3.82 0.00 0.00 -3.46 7.64 -1.22 -4.70 113.62 108.07 1lqi n SER 34 Ca -0.41 -0.53 0.00 0.00 1.01 0.00 0.00 58.87 58.94 1lqi n SER 34 Cb 0.81 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.01 1lqi n SER 34 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1lqi n GLY 35 N 0.00 0.33 3.65 0.23 0.00 -1.26 -0.59 105.19 107.55 1lqi n GLY 35 Ca 0.00 -0.83 -0.12 0.00 0.00 0.00 0.00 46.02 45.07 1lqi n GLY 35 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1lqi s TYR 36 N -2.00 0.57 -0.13 1.61 -0.85 -0.51 -3.26 117.35 112.77 1lqi s TYR 36 Ca 0.00 -1.01 -0.07 0.00 -0.52 0.00 0.00 57.07 55.47 1lqi s TYR 36 Cb 0.00 0.36 -0.04 0.00 0.38 0.00 0.00 41.96 42.66 1lqi s TYR 36 CO 0.00 -1.33 0.11 0.00 -1.52 0.00 0.00 175.55 172.81 1lqi s GLN 38 N -0.63 1.01 0.09 0.00 0.74 -0.43 -4.81 119.66 115.63 1lqi s GLN 38 Ca 0.12 -0.93 -0.24 0.00 0.05 0.00 0.00 55.36 54.36 1lqi s GLN 38 Cb -0.12 -2.28 -0.07 0.00 1.10 0.00 0.00 33.01 31.64 1lqi s GLN 38 CO 0.02 -0.78 0.71 -1.58 -0.55 0.00 0.00 175.29 173.12 1lqi s TRP 39 N 1.57 3.82 0.00 1.67 0.52 -1.26 -2.49 118.94 122.76 1lqi s TRP 39 Ca 0.02 1.47 0.00 0.00 0.02 0.00 0.00 56.10 57.62 1lqi s TRP 39 Cb -0.18 -2.71 0.00 0.00 -1.15 0.00 0.00 33.47 29.43 1lqi s TRP 39 CO -0.14 0.44 0.00 0.00 0.02 0.00 0.00 176.95 177.27 1lqi n ALA 40 N 2.09 0.00 0.05 0.98 0.00 -0.70 -4.91 120.51 118.02 1lqi n ALA 40 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1lqi n ALA 40 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 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 -0.06 0.41 0.00 0.00 -1.26 -3.96 105.19 100.32 1lqi n GLY 41 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.00 -0.32 1.61 1.57 -1.98 0.32 116.57 117.77 1lqi h LYS 42 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1lqi h LYS 42 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1lqi h LYS 42 CO 0.00 -0.00 0.00 2.48 -0.57 0.00 0.00 179.45 181.36 1lqi n TYR 43 N -5.31 0.42 -3.59 -1.35 4.11 -1.26 -5.06 117.16 105.12 1lqi n TYR 43 Ca 0.04 -0.27 0.00 0.00 -0.00 0.00 0.00 57.90 57.67 1lqi n TYR 43 Cb 0.30 -0.01 0.00 0.00 -0.00 0.00 0.00 39.34 39.63 1lqi n TYR 43 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1lqi n GLY 44 N 1.11 1.82 3.57 -7.48 0.00 0.10 -3.08 105.19 101.23 1lqi n GLY 44 Ca 0.15 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 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 6.73 0.00 1.61 -0.87 -1.26 -1.73 114.94 115.42 1lqi s ASN 45 Ca 0.00 -2.12 0.00 0.00 -1.57 0.00 0.00 52.86 49.17 1lqi s ASN 45 Cb 0.00 -2.57 0.00 0.00 -0.02 0.00 0.00 41.25 38.66 1lqi s ASN 45 CO 0.00 -1.28 0.00 0.00 -2.57 0.00 0.00 177.10 173.25 1lqi n ALA 46 N 8.50 0.00 -3.58 0.60 0.00 -1.04 -3.69 120.51 121.30 1lqi n ALA 46 Ca 0.43 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.75 1lqi n ALA 46 Cb 0.48 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.85 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 0.77 3.16 -0.19 0.00 -0.11 0.12 -3.94 118.94 118.76 1lqi s TRP 48 Ca -0.04 0.28 -0.20 0.00 1.22 0.00 0.00 56.10 57.37 1lqi s TRP 48 Cb -0.05 -3.05 -0.03 0.00 -1.50 0.00 0.00 33.47 28.84 1lqi s TRP 48 CO -0.06 -0.59 0.58 0.00 -4.62 0.00 0.00 176.95 172.26 1lqi s TYR 50 N 1.68 3.49 -1.23 0.00 2.02 0.25 -2.46 117.35 121.10 1lqi s TYR 50 Ca 0.27 0.79 -0.30 0.00 -0.37 0.00 0.00 57.07 57.46 1lqi s TYR 50 Cb -0.16 -2.24 0.03 0.00 -0.40 0.00 0.00 41.96 39.20 1lqi s TYR 50 CO 0.10 0.01 0.65 0.00 -1.57 0.00 0.00 175.55 174.75 1lqi n ALA 51 N -1.28 -2.55 -2.32 3.71 0.00 -1.26 -2.69 120.51 114.11 1lqi n ALA 51 Ca -0.00 -0.51 -0.39 0.00 0.00 0.00 0.00 53.44 52.54 1lqi n ALA 51 Cb 0.54 -2.74 -0.06 0.00 0.00 0.00 0.00 19.45 17.19 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 -7.29 4.50 0.63 0.00 2.96 -0.78 -1.78 118.68 116.91 1lqi s LEU 52 Ca 0.45 1.27 -0.18 0.00 -0.22 0.00 0.00 54.13 55.45 1lqi s LEU 52 Cb -0.23 -2.95 -0.02 0.00 0.50 0.00 0.00 46.19 43.49 1lqi s LEU 52 CO 0.96 0.21 1.28 -2.16 -1.32 0.00 0.00 176.35 175.31 1lqi s PRO 53 N -0.79 2.69 0.00 0.98 0.04 -1.25 -0.36 135.00 136.30 1lqi s PRO 53 Ca 0.30 2.02 0.10 0.00 0.04 0.00 0.00 61.00 63.46 1lqi s PRO 53 Cb -0.19 -1.89 0.55 0.00 0.04 0.00 0.00 34.50 33.01 1lqi s PRO 53 CO 0.19 -1.48 1.11 -0.25 0.04 0.00 0.00 177.00 176.61 1lqi n ASP 54 N -1.78 0.00 -0.49 6.66 9.92 -1.06 -2.09 116.55 127.71 1lqi n ASP 54 Ca 0.15 -0.12 0.07 0.00 -0.53 0.00 0.00 54.79 54.37 1lqi n ASP 54 Cb 0.48 -0.12 0.27 0.00 -0.64 0.00 0.00 41.12 41.11 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 -1.12 1.45 -4.10 -2.24 6.94 -1.26 -4.78 115.26 110.14 1lqi n ASN 55 Ca 0.06 -1.82 -0.29 0.00 -0.02 0.00 0.00 54.58 52.50 1lqi n ASN 55 Cb 0.05 -0.14 -0.17 0.00 -2.36 0.00 0.00 39.78 37.17 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 -1.72 1.66 0.70 3.53 1.01 -0.89 -5.12 120.40 119.57 1lqi s VAL 56 Ca 0.25 -0.75 -0.11 0.00 0.00 0.00 0.00 61.98 61.38 1lqi s VAL 56 Cb 0.13 -1.49 0.01 0.00 0.00 0.00 0.00 36.38 35.03 1lqi s VAL 56 CO 0.19 0.47 1.06 -2.16 0.00 0.00 0.00 175.10 174.67 1lqi s PRO 57 N 0.83 2.86 0.06 2.72 0.04 -1.26 -4.92 135.00 135.33 1lqi s PRO 57 Ca -0.09 0.92 0.00 0.00 0.04 0.00 0.00 61.00 61.87 1lqi s PRO 57 Cb -0.16 -1.98 -0.00 0.00 0.04 0.00 0.00 34.50 32.40 1lqi s PRO 57 CO 0.00 -1.14 0.01 0.44 0.04 0.00 0.00 177.00 176.35 1lqi n ILE 58 N -3.16 0.00 -2.55 0.56 -5.35 -1.26 -2.58 119.36 105.01 1lqi n ILE 58 Ca 0.07 -0.29 -0.43 0.00 -0.27 0.00 0.00 62.75 61.84 1lqi n ILE 58 Cb 0.54 0.08 -0.02 0.00 -1.74 0.00 0.00 39.64 38.49 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 -2.21 4.33 0.32 6.28 6.06 -0.52 -4.35 118.95 128.86 1lqi s ARG 59 Ca 0.01 1.54 0.06 0.00 -2.50 0.00 0.00 55.73 54.83 1lqi s ARG 59 Cb 0.00 -3.61 -0.02 0.00 0.06 0.00 0.00 34.95 31.39 1lqi s ARG 59 CO 0.01 -0.49 0.45 0.14 -2.50 0.00 0.00 175.30 172.91 1lqi s VAL 60 N 2.58 4.43 -1.04 7.11 -7.23 -1.26 -4.92 120.40 120.07 1lqi s VAL 60 Ca 0.51 -0.95 -0.23 0.00 -1.81 0.00 0.00 61.98 59.50 1lqi s VAL 60 Cb -0.21 -3.55 -0.06 0.00 0.56 0.00 0.00 36.38 33.12 1lqi s VAL 60 CO 0.17 -0.23 1.92 -2.16 -0.31 0.00 0.00 175.10 174.49 1lqi s PRO 61 N -4.15 2.60 0.00 4.82 0.04 -1.26 -4.55 135.00 132.50 1lqi s PRO 61 Ca 0.42 -0.75 0.00 0.00 0.04 0.00 0.00 61.00 60.71 1lqi s PRO 61 Cb -0.09 -5.16 0.00 0.00 0.04 0.00 0.00 34.50 29.28 1lqi s PRO 61 CO 0.31 -3.57 0.00 0.41 0.04 0.00 0.00 177.00 174.19 1lqi n GLY 62 N 6.36 0.91 2.48 0.56 0.00 -1.26 -5.18 105.19 109.06 1lqi n GLY 62 Ca 0.42 0.41 -0.16 0.00 0.00 0.00 0.00 46.02 46.69 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 0.40 -3.72 1.61 5.02 -1.26 -5.18 118.16 115.03 1lqi n LYS 63 Ca 0.00 -2.57 -0.11 0.00 -2.02 0.00 0.00 58.31 53.60 1lqi n LYS 63 Cb 0.00 1.93 -0.07 0.00 -0.02 0.00 0.00 35.03 36.87 1lqi n LYS 63 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88