#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lqq s ARG 2 N 0.00 1.43 -0.14 7.34 3.03 -1.25 -4.79 118.95 124.57 1lqq s ARG 2 Ca 0.00 -1.29 -0.00 0.00 2.03 0.00 0.00 55.73 56.46 1lqq s ARG 2 Cb 0.00 0.43 -0.01 0.00 -1.03 0.00 0.00 34.95 34.33 1lqq s ARG 2 CO 0.00 -0.57 -0.13 -0.51 -1.13 0.00 0.00 175.30 172.96 1lqq s ASP 3 N -3.03 3.98 0.08 -2.89 1.01 -1.26 0.49 116.67 115.05 1lqq s ASP 3 Ca 0.24 -0.36 -0.26 0.00 0.71 0.00 0.00 52.55 52.88 1lqq s ASP 3 Cb 0.01 -1.62 0.09 0.00 1.01 0.00 0.00 42.92 42.41 1lqq s ASP 3 CO 0.08 0.13 1.15 0.00 0.21 0.00 0.00 175.17 176.74 1lqq s ALA 4 N 0.55 -1.99 -0.03 5.23 0.00 -0.11 -4.94 121.76 120.47 1lqq s ALA 4 Ca -0.08 0.04 -0.23 0.00 0.00 0.00 0.00 51.96 51.69 1lqq s ALA 4 Cb -0.16 0.70 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 1lqq s ALA 4 CO 0.04 -1.09 0.69 0.71 0.00 0.00 0.00 175.76 176.11 1lqq s TYR 5 N -2.32 3.64 0.35 0.00 2.02 -1.26 -0.60 117.35 119.19 1lqq s TYR 5 Ca 0.21 1.29 -0.25 0.00 -0.37 0.00 0.00 57.07 57.96 1lqq s TYR 5 Cb -0.00 -2.76 -0.10 0.00 -0.40 0.00 0.00 41.96 38.69 1lqq s TYR 5 CO 0.01 0.19 0.95 -1.50 -1.57 0.00 0.00 175.55 173.63 1lqq s ILE 6 N 0.37 4.25 0.88 2.71 2.07 -0.49 -1.53 121.20 129.46 1lqq s ILE 6 Ca 0.36 1.72 -0.11 0.00 -1.41 0.00 0.00 60.65 61.21 1lqq s ILE 6 Cb -0.18 -3.89 0.12 0.00 0.13 0.00 0.00 42.46 38.63 1lqq s ILE 6 CO 0.19 0.01 1.12 0.00 -1.91 0.00 0.00 174.94 174.36 1lqq n ALA 7 N 0.22 -0.65 -0.36 1.50 0.00 -1.26 -3.25 120.51 116.70 1lqq n ALA 7 Ca 0.03 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.99 1lqq n ALA 7 Cb 0.51 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.77 1lqq n ALA 7 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1lqq n LYS 8 N -3.78 0.00 0.00 0.00 0.00 0.23 -4.58 118.16 110.03 1lqq n LYS 8 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.43 1lqq n LYS 8 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.55 1lqq n LYS 8 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1lqq n ASN 9 N -1.96 0.00 -3.35 3.14 2.85 -1.26 -4.99 115.26 109.70 1lqq n ASN 9 Ca 0.00 0.00 -0.31 0.00 -0.11 0.00 0.00 54.58 54.16 1lqq n ASN 9 Cb 0.00 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 40.98 1lqq n ASN 9 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 1lqq n TYR 10 N -1.96 3.49 -2.21 1.20 4.02 -1.26 -4.72 117.16 115.72 1lqq n TYR 10 Ca 0.00 -3.64 -0.08 0.00 -0.01 0.00 0.00 57.90 54.17 1lqq n TYR 10 Cb 0.00 -0.72 -0.00 0.00 -0.02 0.00 0.00 39.34 38.59 1lqq n TYR 10 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1lqq n ASN 11 N 0.34 -2.94 -4.68 7.72 4.05 -1.26 -2.37 115.26 116.11 1lqq n ASN 11 Ca 0.33 -0.02 -0.27 0.00 0.45 0.00 0.00 54.58 55.06 1lqq n ASN 11 Cb 0.37 -2.20 -0.09 0.00 1.23 0.00 0.00 39.78 39.09 1lqq n ASN 11 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1lqq n VAL 13 N -1.11 0.00 -2.77 0.00 0.24 -1.26 0.76 118.33 114.20 1lqq n VAL 13 Ca -0.05 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 62.04 1lqq n VAL 13 Cb 0.66 0.00 0.06 0.00 -1.47 0.00 0.00 33.84 33.09 1lqq n VAL 13 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 1lqq s TYR 14 N -0.27 2.12 -0.29 6.34 1.51 -1.20 -4.50 117.35 121.05 1lqq s TYR 14 Ca 0.00 -0.32 -0.03 0.00 -1.01 0.00 0.00 57.07 55.71 1lqq s TYR 14 Cb 0.00 -2.65 0.10 0.00 -0.11 0.00 0.00 41.96 39.30 1lqq s TYR 14 CO 0.00 -1.14 0.12 -2.00 -1.11 0.00 0.00 175.55 171.42 1lqq s GLU 15 N -4.80 0.31 0.05 -0.62 2.12 -1.26 -3.27 118.70 111.22 1lqq s GLU 15 Ca 0.61 -0.64 0.05 0.00 0.36 0.00 0.00 54.97 55.35 1lqq s GLU 15 Cb -0.08 -1.38 -0.02 0.00 0.26 0.00 0.00 34.13 32.91 1lqq s GLU 15 CO 0.40 -1.00 -0.16 0.00 -0.54 0.00 0.00 175.26 173.96 1lqq n PHE 17 N 1.78 0.34 -3.71 0.00 3.01 -1.26 -4.85 117.46 112.77 1lqq n PHE 17 Ca -0.18 -0.63 -0.27 0.00 1.01 0.00 0.00 57.45 57.38 1lqq n PHE 17 Cb 0.54 -0.10 -0.17 0.00 -0.01 0.00 0.00 39.48 39.75 1lqq n PHE 17 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1lqq s ARG 18 N -1.55 0.53 0.42 -1.08 3.00 -1.26 -5.00 118.95 114.01 1lqq s ARG 18 Ca 0.20 -0.32 0.21 0.00 0.00 0.00 0.00 55.73 55.83 1lqq s ARG 18 Cb 0.14 -1.98 1.18 0.00 0.00 0.00 0.00 34.95 34.30 1lqq s ARG 18 CO 0.08 -0.62 1.77 0.22 0.00 0.00 0.00 175.30 176.75 1lqq h ASP 19 N 8.28 0.37 0.26 0.23 3.58 -1.91 -0.95 116.42 126.29 1lqq h ASP 19 Ca -0.16 0.07 0.01 0.00 0.42 0.00 0.00 57.03 57.37 1lqq h ASP 19 Cb 1.13 0.01 -0.03 0.00 1.72 0.00 0.00 39.33 42.16 1lqq h ASP 19 CO 0.32 0.06 -0.39 0.77 -2.88 0.00 0.00 179.24 177.13 1lqq h SER 20 N 0.32 -1.09 -0.74 2.28 4.64 -1.94 0.21 113.55 117.22 1lqq h SER 20 Ca 0.59 0.11 0.15 0.00 -0.47 0.00 0.00 61.79 62.17 1lqq h SER 20 Cb 1.64 0.39 -0.14 0.00 -0.31 0.00 0.00 62.40 63.98 1lqq h SER 20 CO -0.26 -0.50 -0.16 0.22 -0.87 0.00 0.00 176.83 175.26 1lqq h TYR 21 N -0.71 -0.34 0.02 4.77 3.20 -1.58 0.24 116.97 122.58 1lqq h TYR 21 Ca -0.00 0.07 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 1lqq h TYR 21 Cb 0.68 0.27 0.00 0.00 1.54 0.00 0.00 36.73 39.22 1lqq h TYR 21 CO -0.27 -0.31 -0.01 0.00 -1.64 0.00 0.00 178.16 175.93 1lqq h ASN 23 N -0.10 0.00 0.00 0.00 -1.24 0.26 -0.31 115.58 114.19 1lqq h ASN 23 Ca -0.00 0.00 -0.27 0.00 0.71 0.00 0.00 56.30 56.73 1lqq h ASN 23 Cb 0.09 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.10 1lqq h ASN 23 CO 0.00 0.00 -1.80 0.47 -1.29 0.00 0.00 177.43 174.81 1lqq n ASP 24 N -2.87 1.93 -0.17 1.15 9.92 -0.48 -4.15 116.55 121.88 1lqq n ASP 24 Ca 0.01 0.37 -0.03 0.00 -0.53 0.00 0.00 54.79 54.61 1lqq n ASP 24 Cb 0.65 -0.82 0.04 0.00 -0.64 0.00 0.00 41.12 40.35 1lqq n ASP 24 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 1lqq h LEU 25 N -1.00 -0.53 0.40 0.64 5.85 0.96 0.21 115.31 121.85 1lqq h LEU 25 Ca -0.41 0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.45 1lqq h LEU 25 Cb 1.32 0.34 0.00 0.00 0.37 0.00 0.00 40.66 42.70 1lqq h LEU 25 CO -0.25 -0.18 -0.19 0.00 -0.34 0.00 0.00 178.44 177.47 1lqq h THR 27 N -0.99 0.62 -1.01 0.00 1.35 -1.70 0.21 112.91 111.39 1lqq h THR 27 Ca -0.06 -0.10 0.24 0.00 -0.55 0.00 0.00 66.41 65.95 1lqq h THR 27 Cb 0.54 0.32 -0.12 0.00 -1.73 0.00 0.00 68.15 67.17 1lqq h THR 27 CO 0.09 0.05 0.61 0.50 -0.25 0.00 0.00 175.52 176.52 1lqq h LYS 28 N 0.28 0.56 0.00 4.72 3.11 -0.53 0.86 116.57 125.56 1lqq h LYS 28 Ca 0.34 -0.03 -0.03 0.00 -2.81 0.00 0.00 60.65 58.12 1lqq h LYS 28 Cb 0.51 -0.13 -0.00 0.00 -1.00 0.00 0.00 32.23 31.61 1lqq h LYS 28 CO -0.42 0.37 -0.13 -0.97 -2.81 0.00 0.00 179.45 175.49 1lqq h ASN 29 N 0.58 0.00 0.00 4.20 -0.00 -0.52 -3.46 115.58 116.38 1lqq h ASN 29 Ca 0.63 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.93 1lqq h ASN 29 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.54 1lqq h ASN 29 CO -0.44 0.13 0.00 0.61 -0.00 0.00 0.00 177.43 177.73 1lqq n GLY 30 N 0.64 1.99 3.84 1.57 0.00 0.30 -4.82 105.19 108.70 1lqq n GLY 30 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 1lqq n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lqq s ALA 31 N -2.00 3.07 0.05 4.61 0.00 0.03 -3.11 121.76 124.41 1lqq s ALA 31 Ca 0.00 0.21 -0.23 0.00 0.00 0.00 0.00 51.96 51.93 1lqq s ALA 31 Cb 0.00 -3.11 -0.16 0.00 0.00 0.00 0.00 23.12 19.85 1lqq s ALA 31 CO 0.00 -0.16 1.54 1.03 0.00 0.00 0.00 175.76 178.17 1lqq h SER 32 N 1.11 0.06 -5.21 0.00 0.87 0.34 -3.36 113.55 107.36 1lqq h SER 32 Ca -0.47 -0.22 -0.10 0.00 -1.23 0.00 0.00 61.79 59.77 1lqq h SER 32 Cb 1.18 -0.02 -0.14 0.00 -0.44 0.00 0.00 62.40 62.99 1lqq h SER 32 CO 0.61 0.26 -0.40 -0.44 -0.53 0.00 0.00 176.83 176.34 1lqq s SER 33 N -5.47 0.14 -0.01 6.23 0.01 -1.08 -4.90 113.70 108.63 1lqq s SER 33 Ca -0.14 -0.77 0.03 0.00 1.31 0.00 0.00 55.95 56.37 1lqq s SER 33 Cb 0.05 0.35 -0.00 0.00 0.21 0.00 0.00 66.02 66.62 1lqq s SER 33 CO 0.68 -0.76 -0.09 -0.83 0.41 0.00 0.00 173.24 172.65 1lqq s GLY 34 N -2.91 0.45 0.07 3.44 0.00 -1.26 -0.55 107.32 106.57 1lqq s GLY 34 Ca 0.10 -0.35 -0.06 0.00 0.00 0.00 0.00 44.72 44.41 1lqq s GLY 34 CO -0.07 -0.22 0.10 -0.47 0.00 0.00 0.00 173.10 172.44 1lqq s TYR 35 N -0.06 0.29 -0.18 1.90 6.14 -0.15 -2.52 117.35 122.77 1lqq s TYR 35 Ca 0.01 -0.76 -0.03 0.00 0.64 0.00 0.00 57.07 56.92 1lqq s TYR 35 Cb -0.05 -0.19 -0.02 0.00 0.42 0.00 0.00 41.96 42.12 1lqq s TYR 35 CO -0.00 -0.47 -0.04 0.00 0.64 0.00 0.00 175.55 175.67 1lqq s GLN 37 N 0.86 2.03 0.01 0.00 2.00 0.50 -4.79 119.66 120.26 1lqq s GLN 37 Ca -0.01 -1.75 0.02 0.00 -2.00 0.00 0.00 55.36 51.62 1lqq s GLN 37 Cb -0.15 -1.91 -0.01 0.00 0.80 0.00 0.00 33.01 31.75 1lqq s GLN 37 CO 0.01 0.17 -0.06 1.67 -0.50 0.00 0.00 175.29 176.58 1lqq s TRP 38 N -2.51 0.53 -0.52 1.67 -2.14 -1.26 -0.56 118.94 114.14 1lqq s TRP 38 Ca 0.34 -0.20 -0.15 0.00 2.66 0.00 0.00 56.10 58.75 1lqq s TRP 38 Cb -0.01 -0.33 0.02 0.00 -3.10 0.00 0.00 33.47 30.05 1lqq s TRP 38 CO 0.19 -0.03 0.63 0.00 -2.66 0.00 0.00 176.95 175.08 1lqq n ALA 39 N 2.54 -2.80 -0.01 2.67 0.00 -0.26 -4.92 120.51 117.72 1lqq n ALA 39 Ca -0.16 0.75 -0.02 0.00 0.00 0.00 0.00 53.44 54.02 1lqq n ALA 39 Cb 0.57 -2.96 -0.01 0.00 0.00 0.00 0.00 19.45 17.05 1lqq n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lqq n GLY 40 N -0.67 -0.23 0.00 0.00 0.00 -0.99 -4.98 105.19 98.33 1lqq n GLY 40 Ca 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1lqq n GLY 40 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1lqq n LYS 41 N -3.16 0.00 -0.17 1.61 3.00 -1.26 -4.93 118.16 113.26 1lqq n LYS 41 Ca -0.03 0.00 0.05 0.00 -0.00 0.00 0.00 58.31 58.33 1lqq n LYS 41 Cb 0.11 -0.27 0.14 0.00 0.00 0.00 0.00 35.03 35.01 1lqq n LYS 41 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1lqq n TYR 42 N -1.17 0.43 0.00 5.64 4.01 -1.26 -4.77 117.16 120.04 1lqq n TYR 42 Ca 0.00 -0.51 0.00 0.00 -0.16 0.00 0.00 57.90 57.23 1lqq n TYR 42 Cb 0.00 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 38.99 1lqq n TYR 42 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1lqq n GLY 43 N 0.38 0.26 3.43 2.72 0.00 -1.26 -4.66 105.19 106.06 1lqq n GLY 43 Ca 0.11 -1.72 -0.27 0.00 0.00 0.00 0.00 46.02 44.14 1lqq n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lqq s ASN 44 N -4.00 3.44 0.00 1.61 4.22 -1.26 -1.11 114.94 117.84 1lqq s ASN 44 Ca 0.00 -0.88 0.00 0.00 -2.14 0.00 0.00 52.86 49.84 1lqq s ASN 44 Cb 0.00 -0.26 0.00 0.00 1.28 0.00 0.00 41.25 42.27 1lqq s ASN 44 CO 0.00 0.11 0.00 0.00 -2.04 0.00 0.00 177.10 175.17 1lqq n ALA 45 N 0.18 0.00 -1.82 3.54 0.00 0.27 -4.45 120.51 118.24 1lqq n ALA 45 Ca -0.12 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.91 1lqq n ALA 45 Cb 0.56 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.99 1lqq n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lqq s TRP 47 N -0.86 3.32 -0.08 0.00 -0.00 0.22 -1.40 118.94 120.14 1lqq s TRP 47 Ca 0.50 -1.39 -0.06 0.00 -0.00 0.00 0.00 56.10 55.15 1lqq s TRP 47 Cb -0.38 -2.96 -0.04 0.00 -0.00 0.00 0.00 33.47 30.09 1lqq s TRP 47 CO 0.48 -0.83 0.18 0.00 -0.00 0.00 0.00 176.95 176.78 1lqq s TYR 49 N -1.12 3.27 -0.56 0.00 2.02 0.29 -0.94 117.35 120.31 1lqq s TYR 49 Ca 0.19 0.21 -0.02 0.00 -0.37 0.00 0.00 57.07 57.08 1lqq s TYR 49 Cb -0.13 -1.89 0.00 0.00 -0.40 0.00 0.00 41.96 39.54 1lqq s TYR 49 CO 0.09 0.43 0.42 0.00 -1.57 0.00 0.00 175.55 174.92 1lqq n ALA 50 N 2.49 -2.25 -0.68 3.71 0.00 0.18 -0.96 120.51 123.00 1lqq n ALA 50 Ca -0.18 -0.16 -0.31 0.00 0.00 0.00 0.00 53.44 52.78 1lqq n ALA 50 Cb 0.54 -0.56 0.17 0.00 0.00 0.00 0.00 19.45 19.60 1lqq n ALA 50 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1lqq s LEU 51 N -3.91 2.75 -0.04 0.00 2.01 0.16 -1.27 118.68 118.38 1lqq s LEU 51 Ca 0.02 2.17 0.00 0.00 0.01 0.00 0.00 54.13 56.33 1lqq s LEU 51 Cb -0.00 -4.52 0.05 0.00 0.01 0.00 0.00 46.19 41.72 1lqq s LEU 51 CO 0.63 -3.18 1.21 -0.81 1.01 0.00 0.00 176.35 175.21 1lqq n PRO 52 N -4.28 1.10 0.00 1.29 -0.04 -1.18 -3.76 135.00 128.12 1lqq n PRO 52 Ca 0.12 -0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 1lqq n PRO 52 Cb 0.52 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.89 1lqq n PRO 52 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1lqq n ASP 53 N 0.53 0.00 -0.80 3.54 8.00 -1.26 -4.60 116.55 121.95 1lqq n ASP 53 Ca 0.04 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.55 1lqq n ASP 53 Cb 0.57 -0.05 0.06 0.00 -0.02 0.00 0.00 41.12 41.68 1lqq n ASP 53 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1lqq n ASN 54 N 0.03 1.98 -4.08 -2.24 0.23 -1.26 -4.54 115.26 105.38 1lqq n ASN 54 Ca 0.00 -2.17 -0.36 0.00 -0.53 0.00 0.00 54.58 51.52 1lqq n ASN 54 Cb 0.00 -0.53 -0.11 0.00 -2.08 0.00 0.00 39.78 37.06 1lqq n ASN 54 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1lqq s VAL 55 N -1.18 3.46 -0.72 3.53 1.01 -1.26 -5.03 120.40 120.21 1lqq s VAL 55 Ca 0.09 -2.78 -0.26 0.00 0.00 0.00 0.00 61.98 59.03 1lqq s VAL 55 Cb 0.07 -3.30 -0.07 0.00 0.00 0.00 0.00 36.38 33.08 1lqq s VAL 55 CO 0.03 -0.82 2.13 -2.16 0.00 0.00 0.00 175.10 174.27 1lqq s PRO 56 N 0.20 2.26 0.00 2.72 0.04 -1.26 -4.95 135.00 134.00 1lqq s PRO 56 Ca 0.15 0.47 0.00 0.00 0.04 0.00 0.00 61.00 61.66 1lqq s PRO 56 Cb -0.21 -4.73 0.00 0.00 0.04 0.00 0.00 34.50 29.60 1lqq s PRO 56 CO -0.03 -3.44 0.00 0.44 0.04 0.00 0.00 177.00 174.00 1lqq n ILE 57 N 7.94 0.00 -4.81 0.56 -0.00 -1.26 -4.10 119.36 117.68 1lqq n ILE 57 Ca 0.36 0.00 -0.33 0.00 -0.00 0.00 0.00 62.75 62.78 1lqq n ILE 57 Cb 0.49 -1.27 -0.14 0.00 -0.00 0.00 0.00 39.64 38.72 1lqq n ILE 57 CO 0.00 0.00 0.00 -0.13 -0.00 0.00 0.00 176.55 176.42 1lqq s ARG 58 N -2.05 3.03 -0.35 6.28 3.00 -0.58 -4.50 118.95 123.77 1lqq s ARG 58 Ca 0.00 -0.68 0.15 0.00 0.00 0.00 0.00 55.73 55.20 1lqq s ARG 58 Cb 0.00 -2.54 0.44 0.00 0.00 0.00 0.00 34.95 32.85 1lqq s ARG 58 CO 0.00 0.39 1.09 1.33 0.00 0.00 0.00 175.30 178.11 1lqq n VAL 59 N 3.00 0.66 -0.07 3.52 0.24 -1.26 -4.65 118.33 119.78 1lqq n VAL 59 Ca -0.18 -2.52 -0.22 0.00 -2.04 0.00 0.00 64.34 59.38 1lqq n VAL 59 Cb 0.52 0.79 -0.12 0.00 -1.47 0.00 0.00 33.84 33.56 1lqq n VAL 59 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1lqq n PRO 60 N -0.25 0.63 0.00 7.34 -0.04 -1.26 -4.99 135.00 136.43 1lqq n PRO 60 Ca 0.05 0.47 0.00 0.00 -0.04 0.00 0.00 63.50 63.98 1lqq n PRO 60 Cb 0.83 -1.73 0.00 0.00 -0.04 0.00 0.00 33.50 32.56 1lqq n PRO 60 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1lqq n GLY 61 N 1.62 2.92 3.22 0.55 0.00 -1.26 -4.97 105.19 107.26 1lqq n GLY 61 Ca -0.32 -0.81 -0.34 0.00 0.00 0.00 0.00 46.02 44.55 1lqq n GLY 61 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1lqq s LYS 62 N 0.00 3.17 0.75 1.61 2.20 -1.26 -4.47 119.74 121.74 1lqq s LYS 62 Ca 0.00 -0.75 -0.12 0.00 -0.36 0.00 0.00 55.97 54.74 1lqq s LYS 62 Cb 0.00 -2.71 0.05 0.00 -1.51 0.00 0.00 37.83 33.66 1lqq s LYS 62 CO 0.00 -0.13 1.12 0.00 -0.36 0.00 0.00 175.35 175.98