#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 -0.28 2.03 -7.23 -1.25 -2.67 120.40 111.03 1lqi s VAL 2 Ca 0.00 -0.28 -0.20 0.00 -1.81 0.00 0.00 61.98 59.69 1lqi s VAL 2 Cb 0.00 -0.62 0.08 0.00 0.56 0.00 0.00 36.38 36.40 1lqi s VAL 2 CO 0.00 -0.16 0.73 0.00 -0.31 0.00 0.00 175.10 175.37 1lqi s ARG 3 N -0.82 0.73 -0.34 4.82 1.70 0.79 -4.82 118.95 121.01 1lqi s ARG 3 Ca -0.09 1.09 -0.16 0.00 -0.47 0.00 0.00 55.73 56.10 1lqi s ARG 3 Cb -0.04 0.24 -0.01 0.00 -0.57 0.00 0.00 34.95 34.57 1lqi s ARG 3 CO 0.03 -0.12 0.38 -0.51 -1.08 0.00 0.00 175.30 174.01 1lqi s ASP 4 N 1.10 6.20 0.05 -2.89 1.11 -1.26 -1.47 116.67 119.52 1lqi s ASP 4 Ca -0.06 -0.16 -0.03 0.00 0.18 0.00 0.00 52.55 52.48 1lqi s ASP 4 Cb -0.05 -2.21 0.01 0.00 1.07 0.00 0.00 42.92 41.74 1lqi s ASP 4 CO -0.11 -0.35 0.14 0.00 1.18 0.00 0.00 175.17 176.03 1lqi n ALA 5 N 5.43 -0.34 -2.79 5.23 0.00 -1.07 -4.98 120.51 122.00 1lqi n ALA 5 Ca -0.08 -0.19 -0.43 0.00 0.00 0.00 0.00 53.44 52.74 1lqi n ALA 5 Cb 0.49 0.14 -0.04 0.00 0.00 0.00 0.00 19.45 20.04 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 -6.99 2.72 0.35 0.00 1.51 -1.26 -1.58 117.35 112.09 1lqi s TYR 6 Ca 0.03 -0.40 -0.24 0.00 -1.01 0.00 0.00 57.07 55.45 1lqi s TYR 6 Cb -0.01 -4.20 -0.15 0.00 -0.11 0.00 0.00 41.96 37.49 1lqi s TYR 6 CO 0.02 -1.55 0.41 1.51 -1.11 0.00 0.00 175.55 174.83 1lqi n ILE 7 N 5.99 1.45 -3.81 2.71 3.06 -1.16 -0.46 119.36 127.13 1lqi n ILE 7 Ca -0.02 -0.50 -0.23 0.00 -2.50 0.00 0.00 62.75 59.50 1lqi n ILE 7 Cb 0.46 -0.24 -0.05 0.00 0.54 0.00 0.00 39.64 40.36 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 -1.38 3.91 0.00 1.51 0.00 -1.00 -3.95 121.76 120.85 1lqi s ALA 8 Ca 0.62 -1.92 0.00 0.00 0.00 0.00 0.00 51.96 50.65 1lqi s ALA 8 Cb -0.71 -0.74 0.00 0.00 0.00 0.00 0.00 23.12 21.67 1lqi s ALA 8 CO 0.59 -0.22 0.00 1.17 0.00 0.00 0.00 175.76 177.30 1lqi n LYS 9 N -1.45 3.82 -0.35 0.00 0.00 0.70 -4.78 118.16 116.11 1lqi n LYS 9 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 58.31 58.44 1lqi n LYS 9 Cb 0.63 0.00 0.30 0.00 0.00 0.00 0.00 35.03 35.96 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 0.83 -2.00 3.14 2.35 -1.99 -3.28 115.58 114.63 1lqi h ASN 10 Ca 0.00 0.08 -0.53 0.00 -0.55 0.00 0.00 56.30 55.31 1lqi h ASN 10 Cb 0.00 -0.07 -0.39 0.00 0.05 0.00 0.00 38.32 37.91 1lqi h ASN 10 CO 0.00 0.34 -1.15 -1.22 -1.65 0.00 0.00 177.43 173.75 1lqi n TYR 11 N -4.72 -0.13 -1.56 1.19 4.01 -1.26 -4.93 117.16 109.76 1lqi n TYR 11 Ca 0.22 -3.67 -0.12 0.00 -0.16 0.00 0.00 57.90 54.17 1lqi n TYR 11 Cb 0.51 -0.38 -0.04 0.00 -0.31 0.00 0.00 39.34 39.12 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 0.94 -4.37 -4.87 7.72 5.15 -1.24 -2.40 115.26 116.20 1lqi n ASN 12 Ca 0.23 0.23 -0.36 0.00 -0.60 0.00 0.00 54.58 54.08 1lqi n ASN 12 Cb 0.58 -3.10 -0.06 0.00 -0.53 0.00 0.00 39.78 36.68 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 -1.22 2.12 -0.84 0.00 -7.23 -1.26 0.25 120.40 112.23 1lqi s VAL 14 Ca 0.26 -0.13 -0.18 0.00 -1.81 0.00 0.00 61.98 60.11 1lqi s VAL 14 Cb -0.14 -2.99 0.14 0.00 0.56 0.00 0.00 36.38 33.95 1lqi s VAL 14 CO 0.14 0.00 0.99 -0.31 -0.31 0.00 0.00 175.10 175.60 1lqi s TYR 15 N -3.44 3.19 0.12 2.82 1.51 -1.25 -4.77 117.35 115.52 1lqi s TYR 15 Ca 0.62 -1.38 -0.31 0.00 -1.01 0.00 0.00 57.07 54.99 1lqi s TYR 15 Cb -0.10 -4.16 -0.09 0.00 -0.11 0.00 0.00 41.96 37.50 1lqi s TYR 15 CO 0.47 -1.38 1.54 -1.21 -1.11 0.00 0.00 175.55 173.86 1lqi s GLU 16 N 2.32 4.24 0.03 -0.62 2.02 -1.26 -3.71 118.70 121.71 1lqi s GLU 16 Ca 0.26 2.27 0.00 0.00 0.02 0.00 0.00 54.97 57.52 1lqi s GLU 16 Cb -0.09 -3.31 -0.00 0.00 0.10 0.00 0.00 34.13 30.82 1lqi s GLU 16 CO -0.06 -0.60 0.01 0.00 0.02 0.00 0.00 175.26 174.63 1lqi n PHE 18 N -0.06 0.00 -3.92 0.00 7.35 -1.26 -4.97 117.46 114.60 1lqi n PHE 18 Ca -0.01 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.60 1lqi n PHE 18 Cb 0.04 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 39.79 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 -1.38 0.74 0.34 -4.13 3.00 -1.26 -5.03 118.95 111.22 1lqi s ARG 19 Ca 0.00 -0.95 0.04 0.00 0.00 0.00 0.00 55.73 54.81 1lqi s ARG 19 Cb 0.00 0.29 0.62 0.00 0.00 0.00 0.00 34.95 35.86 1lqi s ARG 19 CO 0.00 -0.21 1.91 -0.44 0.00 0.00 0.00 175.30 176.57 1lqi h ASP 20 N 3.05 0.56 -0.89 0.23 3.32 -1.95 -2.34 116.42 118.41 1lqi h ASP 20 Ca -0.34 -0.08 0.21 0.00 0.02 0.00 0.00 57.03 56.84 1lqi h ASP 20 Cb 1.18 -0.15 -0.12 0.00 0.22 0.00 0.00 39.33 40.47 1lqi h ASP 20 CO 0.57 0.55 0.40 0.00 -1.72 0.00 0.00 179.24 179.04 1lqi h ALA 21 N 1.53 1.40 -0.04 3.45 0.00 -1.96 -1.99 119.26 121.65 1lqi h ALA 21 Ca 0.14 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.21 1lqi h ALA 21 Cb 0.21 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1lqi h ALA 21 CO -0.01 -0.29 -0.18 -0.92 0.00 0.00 0.00 179.25 177.85 1lqi h TYR 22 N 0.44 -0.53 -0.88 0.00 3.20 -1.81 -2.40 116.97 114.99 1lqi h TYR 22 Ca 0.54 0.02 0.10 0.00 3.14 0.00 0.00 58.73 62.53 1lqi h TYR 22 Cb 0.98 0.24 -0.12 0.00 1.54 0.00 0.00 36.73 39.36 1lqi h TYR 22 CO -0.13 -0.18 -0.52 0.00 -1.64 0.00 0.00 178.16 175.69 1lqi h ASN 24 N -0.07 -0.46 -0.40 0.00 -1.24 -1.20 0.63 115.58 112.84 1lqi h ASN 24 Ca 0.20 0.27 -0.11 0.00 0.71 0.00 0.00 56.30 57.37 1lqi h ASN 24 Cb 0.50 0.47 -0.01 0.00 0.73 0.00 0.00 38.32 40.01 1lqi h ASN 24 CO -0.88 -0.34 -0.18 -0.08 -1.29 0.00 0.00 177.43 174.66 1lqi h GLU 25 N 0.02 0.83 0.00 6.67 4.81 0.17 -2.67 114.58 124.41 1lqi h GLU 25 Ca 0.58 -0.36 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1lqi h GLU 25 Cb 1.18 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.54 1lqi h GLU 25 CO -0.90 0.99 0.00 -0.11 -0.73 0.00 0.00 179.01 178.26 1lqi n LEU 26 N -4.25 0.01 -0.40 1.64 7.94 0.20 -0.87 117.00 121.27 1lqi n LEU 26 Ca -0.01 0.83 -0.10 0.00 -1.11 0.00 0.00 56.01 55.62 1lqi n LEU 26 Cb 0.42 -0.50 -0.08 0.00 0.53 0.00 0.00 43.42 43.79 1lqi n LEU 26 CO 0.44 -0.50 0.47 0.00 -1.11 0.00 0.00 177.39 176.70 1lqi h THR 28 N 0.00 1.07 -0.38 0.00 1.35 -1.57 -0.72 112.91 112.66 1lqi h THR 28 Ca 0.17 -0.26 -0.02 0.00 -0.55 0.00 0.00 66.41 65.75 1lqi h THR 28 Cb 0.41 0.25 -0.02 0.00 -1.73 0.00 0.00 68.15 67.06 1lqi h THR 28 CO -0.90 0.14 0.13 0.11 -0.25 0.00 0.00 175.52 174.74 1lqi h LYS 29 N 0.75 0.54 0.00 4.72 1.57 0.27 -1.07 116.57 123.35 1lqi h LYS 29 Ca 0.27 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1lqi h LYS 29 Cb 0.13 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1lqi h LYS 29 CO -0.08 0.47 0.00 0.09 -0.57 0.00 0.00 179.45 179.36 1lqi n ASN 30 N -4.37 0.42 0.00 0.86 3.02 -0.28 -4.84 115.26 110.07 1lqi n ASN 30 Ca 0.02 0.55 0.00 0.00 -0.03 0.00 0.00 54.58 55.13 1lqi n ASN 30 Cb 0.16 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 38.67 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 1.06 1.53 0.00 7.41 0.00 -0.41 -4.64 105.19 110.15 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 -0.87 0.00 -0.11 4.61 0.00 -0.39 -4.19 120.51 119.56 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 -0.88 1.59 -3.70 0.00 2.88 -1.08 -4.40 113.62 108.03 1lqi n SER 33 Ca 0.00 0.22 -0.02 0.00 -1.33 0.00 0.00 58.87 57.74 1lqi n SER 33 Cb 0.00 -0.60 -0.01 0.00 -0.75 0.00 0.00 64.21 62.85 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 -0.15 0.37 -3.46 0.01 -1.25 -4.61 113.70 97.79 1lqi s SER 34 Ca -0.30 -0.30 -0.16 0.00 1.31 0.00 0.00 55.95 56.51 1lqi s SER 34 Cb 0.11 0.38 0.05 0.00 0.21 0.00 0.00 66.02 66.77 1lqi s SER 34 CO 0.38 -0.71 0.76 -0.83 0.41 0.00 0.00 173.24 173.25 1lqi s GLY 35 N -2.92 0.38 0.17 3.44 0.00 -1.26 -0.10 107.32 107.02 1lqi s GLY 35 Ca 0.12 -0.74 -0.10 0.00 0.00 0.00 0.00 44.72 44.00 1lqi s GLY 35 CO -0.00 -0.33 0.31 -2.52 0.00 0.00 0.00 173.10 170.56 1lqi s TYR 36 N -2.60 0.34 -0.18 1.90 -0.85 -0.89 -3.41 117.35 111.67 1lqi s TYR 36 Ca 0.16 -0.70 -0.11 0.00 -0.52 0.00 0.00 57.07 55.90 1lqi s TYR 36 Cb -0.05 -0.01 -0.05 0.00 0.38 0.00 0.00 41.96 42.23 1lqi s TYR 36 CO 0.11 -0.74 0.20 0.00 -1.52 0.00 0.00 175.55 173.60 1lqi s GLN 38 N 0.27 3.04 -0.24 0.00 -0.44 0.11 -4.87 119.66 117.52 1lqi s GLN 38 Ca 0.12 -0.21 -0.29 0.00 -2.50 0.00 0.00 55.36 52.48 1lqi s GLN 38 Cb -0.12 -4.60 0.01 0.00 -1.64 0.00 0.00 33.01 26.66 1lqi s GLN 38 CO 0.01 -2.49 1.09 -1.58 0.50 0.00 0.00 175.29 172.82 1lqi s TRP 39 N 7.06 3.20 -0.03 1.67 0.23 -1.26 -2.03 118.94 127.78 1lqi s TRP 39 Ca 0.51 1.32 -0.03 0.00 -2.03 0.00 0.00 56.10 55.86 1lqi s TRP 39 Cb -0.07 -3.43 0.01 0.00 0.03 0.00 0.00 33.47 30.01 1lqi s TRP 39 CO 0.09 -0.77 0.06 0.00 0.96 0.00 0.00 176.95 177.29 1lqi n ALA 40 N 6.54 -2.29 0.00 0.98 0.00 0.11 -4.95 120.51 120.91 1lqi n ALA 40 Ca 0.12 0.90 0.00 0.00 0.00 0.00 0.00 53.44 54.46 1lqi n ALA 40 Cb 0.46 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 17.75 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 1.86 -0.87 0.26 0.00 0.00 -1.09 -4.87 105.19 100.48 1lqi n GLY 41 Ca -0.10 -0.19 -0.07 0.00 0.00 0.00 0.00 46.02 45.66 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 0.86 -0.49 1.61 1.57 -1.96 -2.66 116.57 115.51 1lqi h LYS 42 Ca 0.00 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.61 1lqi h LYS 42 Cb 0.00 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 1lqi h LYS 42 CO 0.00 0.71 0.03 0.66 -0.57 0.00 0.00 179.45 180.28 1lqi n TYR 43 N -4.51 1.73 0.00 -1.35 4.02 -1.26 -5.02 117.16 110.77 1lqi n TYR 43 Ca 0.04 -0.87 0.00 0.00 -0.01 0.00 0.00 57.90 57.06 1lqi n TYR 43 Cb 0.13 -0.47 0.00 0.00 -0.02 0.00 0.00 39.34 38.98 1lqi n TYR 43 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1lqi n GLY 44 N 0.09 1.00 3.08 2.72 0.00 -1.00 -3.85 105.19 107.21 1lqi n GLY 44 Ca 0.28 0.36 -0.35 0.00 0.00 0.00 0.00 46.02 46.30 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 5.49 0.00 1.61 -0.87 -1.23 0.09 114.94 116.03 1lqi s ASN 45 Ca 0.00 -3.31 0.00 0.00 -1.57 0.00 0.00 52.86 47.98 1lqi s ASN 45 Cb 0.00 -1.85 0.00 0.00 -0.02 0.00 0.00 41.25 39.38 1lqi s ASN 45 CO 0.00 -0.26 0.00 0.00 -2.57 0.00 0.00 177.10 174.27 1lqi n ALA 46 N 2.86 0.00 -3.61 0.60 0.00 -0.86 -3.78 120.51 115.72 1lqi n ALA 46 Ca 0.14 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.48 1lqi n ALA 46 Cb 0.37 0.00 -0.11 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 2.54 2.91 -0.08 0.00 -0.11 0.58 -3.00 118.94 121.78 1lqi s TRP 48 Ca 0.01 -0.19 -0.20 0.00 1.22 0.00 0.00 56.10 56.94 1lqi s TRP 48 Cb -0.13 -3.83 -0.04 0.00 -1.50 0.00 0.00 33.47 27.97 1lqi s TRP 48 CO -0.12 -1.19 0.56 0.00 -4.62 0.00 0.00 176.95 171.57 1lqi s TYR 50 N 0.46 3.50 -1.36 0.00 2.02 0.85 -2.59 117.35 120.23 1lqi s TYR 50 Ca 0.30 1.10 -0.09 0.00 -0.37 0.00 0.00 57.07 58.01 1lqi s TYR 50 Cb -0.16 -2.43 0.00 0.00 -0.40 0.00 0.00 41.96 38.98 1lqi s TYR 50 CO 0.14 0.27 0.44 0.00 -1.57 0.00 0.00 175.55 174.84 1lqi n ALA 51 N 0.19 -2.20 -2.24 3.71 0.00 -1.25 -2.63 120.51 116.09 1lqi n ALA 51 Ca -0.01 -0.34 -0.40 0.00 0.00 0.00 0.00 53.44 52.70 1lqi n ALA 51 Cb 0.52 -2.01 -0.05 0.00 0.00 0.00 0.00 19.45 17.91 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 -7.02 4.50 0.40 0.00 2.96 -0.54 -3.16 118.68 115.82 1lqi s LEU 52 Ca 0.16 1.54 -0.27 0.00 -0.22 0.00 0.00 54.13 55.34 1lqi s LEU 52 Cb -0.07 -3.28 -0.10 0.00 0.50 0.00 0.00 46.19 43.24 1lqi s LEU 52 CO 0.92 0.08 1.45 -2.16 -1.32 0.00 0.00 176.35 175.32 1lqi s PRO 53 N -0.44 3.95 0.00 0.98 0.04 -1.25 -0.15 135.00 138.12 1lqi s PRO 53 Ca 0.38 2.49 0.02 0.00 0.04 0.00 0.00 61.00 63.92 1lqi s PRO 53 Cb -0.22 -2.84 0.07 0.00 0.04 0.00 0.00 34.50 31.55 1lqi s PRO 53 CO 0.25 -0.63 1.00 -0.25 0.04 0.00 0.00 177.00 177.40 1lqi n ASP 54 N 0.20 0.00 0.00 6.66 9.92 -1.09 -1.45 116.55 130.79 1lqi n ASP 54 Ca 0.03 0.44 0.12 0.00 -0.53 0.00 0.00 54.79 54.84 1lqi n ASP 54 Cb 0.40 -0.45 0.67 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 -1.45 0.00 -4.26 -2.24 0.23 -1.26 -4.66 115.26 101.63 1lqi n ASN 55 Ca 0.00 -0.62 -0.32 0.00 -0.53 0.00 0.00 54.58 53.12 1lqi n ASN 55 Cb 0.02 -0.05 -0.17 0.00 -2.08 0.00 0.00 39.78 37.51 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 -2.09 2.16 0.65 3.53 1.01 -0.53 -5.12 120.40 120.01 1lqi s VAL 56 Ca 0.33 -1.00 -0.14 0.00 0.00 0.00 0.00 61.98 61.16 1lqi s VAL 56 Cb 0.16 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.72 1lqi s VAL 56 CO 0.28 0.56 1.08 -2.16 0.00 0.00 0.00 175.10 174.86 1lqi s PRO 57 N 0.13 2.96 -0.12 2.72 0.04 -1.26 -4.93 135.00 134.53 1lqi s PRO 57 Ca -0.12 1.24 0.02 0.00 0.04 0.00 0.00 61.00 62.18 1lqi s PRO 57 Cb -0.16 -1.98 0.01 0.00 0.04 0.00 0.00 34.50 32.41 1lqi s PRO 57 CO 0.07 -1.10 -0.17 0.96 0.04 0.00 0.00 177.00 176.79 1lqi s ILE 58 N -2.53 1.68 -0.42 0.56 -5.25 -1.26 -2.36 121.20 111.62 1lqi s ILE 58 Ca 0.64 -0.75 -0.46 0.00 -0.99 0.00 0.00 60.65 59.10 1lqi s ILE 58 Cb -0.18 -1.52 -0.20 0.00 2.95 0.00 0.00 42.46 43.52 1lqi s ILE 58 CO 0.43 0.48 1.53 -1.14 -1.79 0.00 0.00 174.94 174.44 1lqi n ARG 59 N 4.21 0.04 -3.20 0.37 3.00 0.39 -4.73 116.66 116.74 1lqi n ARG 59 Ca -0.19 0.01 -0.18 0.00 -0.00 0.00 0.00 57.85 57.49 1lqi n ARG 59 Cb 0.51 -1.52 0.00 0.00 0.00 0.00 0.00 32.46 31.46 1lqi n ARG 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 1lqi s VAL 60 N 2.58 3.50 -0.99 5.15 -7.23 -1.26 -4.72 120.40 117.42 1lqi s VAL 60 Ca 1.03 -0.98 -0.24 0.00 -1.81 0.00 0.00 61.98 59.98 1lqi s VAL 60 Cb -1.45 -3.20 -0.06 0.00 0.56 0.00 0.00 36.38 32.23 1lqi s VAL 60 CO 0.78 -0.08 1.94 -2.16 -0.31 0.00 0.00 175.10 175.27 1lqi s PRO 61 N -4.29 2.53 0.00 4.82 0.04 -1.26 -4.57 135.00 132.27 1lqi s PRO 61 Ca 0.50 -0.57 0.00 0.00 0.04 0.00 0.00 61.00 60.98 1lqi s PRO 61 Cb -0.10 -5.12 0.00 0.00 0.04 0.00 0.00 34.50 29.32 1lqi s PRO 61 CO 0.32 -3.57 0.00 0.41 0.04 0.00 0.00 177.00 174.20 1lqi n GLY 62 N 6.52 1.39 1.06 0.56 0.00 -1.26 -5.18 105.19 108.28 1lqi n GLY 62 Ca 0.42 0.35 -0.08 0.00 0.00 0.00 0.00 46.02 46.71 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 0.66 -3.55 1.61 5.02 -1.26 -5.18 118.16 115.45 1lqi n LYS 63 Ca 0.00 -1.09 -0.10 0.00 -2.02 0.00 0.00 58.31 55.10 1lqi n LYS 63 Cb 0.00 0.66 -0.02 0.00 -0.02 0.00 0.00 35.03 35.65 1lqi n LYS 63 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88