#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 1.42 -0.16 7.34 3.03 -1.23 -4.79 118.95 124.56 1lqq s ARG 2 Ca 0.00 -1.20 -0.01 0.00 2.03 0.00 0.00 55.73 56.55 1lqq s ARG 2 Cb 0.00 0.45 -0.01 0.00 -1.03 0.00 0.00 34.95 34.36 1lqq s ARG 2 CO 0.00 -0.57 -0.12 -0.51 -1.13 0.00 0.00 175.30 172.97 1lqq s ASP 3 N -3.00 3.98 0.13 -2.89 1.11 -1.26 0.23 116.67 114.97 1lqq s ASP 3 Ca 0.20 -0.39 -0.19 0.00 0.18 0.00 0.00 52.55 52.36 1lqq s ASP 3 Cb 0.01 -1.63 0.06 0.00 1.07 0.00 0.00 42.92 42.43 1lqq s ASP 3 CO 0.06 0.09 0.88 0.00 1.18 0.00 0.00 175.17 177.38 1lqq n ALA 4 N 4.01 -2.33 -2.63 5.23 0.00 -0.28 -4.95 120.51 119.56 1lqq n ALA 4 Ca -0.18 -0.82 -0.43 0.00 0.00 0.00 0.00 53.44 52.01 1lqq n ALA 4 Cb 0.52 0.42 -0.02 0.00 0.00 0.00 0.00 19.45 20.37 1lqq n ALA 4 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1lqq s TYR 5 N -2.71 3.36 0.08 0.00 1.51 -1.26 -0.91 117.35 117.42 1lqq s TYR 5 Ca 0.20 1.46 -0.27 0.00 -1.01 0.00 0.00 57.07 57.45 1lqq s TYR 5 Cb -0.02 -3.27 -0.06 0.00 -0.11 0.00 0.00 41.96 38.50 1lqq s TYR 5 CO 0.04 -0.55 0.83 -1.50 -1.11 0.00 0.00 175.55 173.26 1lqq s ILE 6 N 2.60 4.61 0.93 2.71 2.07 -0.07 -1.09 121.20 132.96 1lqq s ILE 6 Ca 0.48 1.78 -0.12 0.00 -1.41 0.00 0.00 60.65 61.37 1lqq s ILE 6 Cb -0.18 -4.18 0.15 0.00 0.13 0.00 0.00 42.46 38.38 1lqq s ILE 6 CO 0.14 0.37 1.13 0.00 -1.91 0.00 0.00 174.94 174.67 1lqq s ALA 7 N -0.17 1.64 0.08 1.50 0.00 -1.25 -3.91 121.76 119.65 1lqq s ALA 7 Ca 0.41 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 51.84 1lqq s ALA 7 Cb -0.22 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 19.87 1lqq s ALA 7 CO 0.25 -2.39 0.00 1.17 0.00 0.00 0.00 175.76 174.79 1lqq n LYS 8 N -3.84 0.00 0.05 0.00 4.81 0.30 -4.78 118.16 114.70 1lqq n LYS 8 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 1lqq n LYS 8 Cb 0.59 -0.26 0.00 0.00 0.02 0.00 0.00 35.03 35.38 1lqq n LYS 8 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1lqq n ASN 9 N -3.13 0.04 -3.20 3.14 2.85 -1.26 -5.01 115.26 108.68 1lqq n ASN 9 Ca 0.00 0.18 -0.23 0.00 -0.11 0.00 0.00 54.58 54.42 1lqq n ASN 9 Cb 0.00 0.11 -0.06 0.00 1.24 0.00 0.00 39.78 41.07 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 -2.98 0.50 -2.96 1.20 4.02 -1.26 -4.89 117.16 110.79 1lqq n TYR 10 Ca 0.00 -3.72 -0.16 0.00 -0.01 0.00 0.00 57.90 54.01 1lqq n TYR 10 Cb 0.06 -0.40 0.04 0.00 -0.02 0.00 0.00 39.34 39.02 1lqq n TYR 10 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1lqq n ASN 11 N 0.96 -4.81 -4.44 7.72 4.13 -1.26 -2.41 115.26 115.16 1lqq n ASN 11 Ca 0.24 -0.26 -0.27 0.00 1.68 0.00 0.00 54.58 55.97 1lqq n ASN 11 Cb 0.54 -3.56 -0.12 0.00 -1.54 0.00 0.00 39.78 35.10 1lqq n ASN 11 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1lqq s VAL 13 N -1.70 1.06 0.89 0.00 -7.23 -1.26 0.11 120.40 112.27 1lqq s VAL 13 Ca 0.21 -1.97 -0.14 0.00 -1.81 0.00 0.00 61.98 58.28 1lqq s VAL 13 Cb -0.08 -2.03 0.15 0.00 0.56 0.00 0.00 36.38 34.98 1lqq s VAL 13 CO 0.10 0.00 1.25 -0.31 -0.31 0.00 0.00 175.10 175.83 1lqq s TYR 14 N -2.90 2.13 -0.54 2.82 2.02 -1.25 -4.78 117.35 114.84 1lqq s TYR 14 Ca 0.03 0.45 0.04 0.00 -0.37 0.00 0.00 57.07 57.22 1lqq s TYR 14 Cb 0.00 -3.82 0.16 0.00 -0.40 0.00 0.00 41.96 37.90 1lqq s TYR 14 CO 0.02 -2.25 0.37 -2.00 -1.57 0.00 0.00 175.55 170.11 1lqq s GLU 15 N -5.72 1.70 0.15 -0.62 2.12 -1.26 -3.80 118.70 111.27 1lqq s GLU 15 Ca 0.69 -2.62 -0.02 0.00 0.36 0.00 0.00 54.97 53.38 1lqq s GLU 15 Cb -0.07 -2.58 -0.05 0.00 0.26 0.00 0.00 34.13 31.69 1lqq s GLU 15 CO 0.51 -1.27 0.35 0.00 -0.54 0.00 0.00 175.26 174.31 1lqq n PHE 17 N -0.21 0.00 -3.62 0.00 3.72 -1.26 -4.67 117.46 111.42 1lqq n PHE 17 Ca -0.04 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.07 1lqq n PHE 17 Cb 0.53 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.91 1lqq n PHE 17 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1lqq s ARG 18 N -0.21 0.34 0.09 -1.08 1.81 -1.26 -5.01 118.95 113.63 1lqq s ARG 18 Ca 0.00 -0.57 -0.02 0.00 -1.72 0.00 0.00 55.73 53.42 1lqq s ARG 18 Cb 0.00 -1.55 0.16 0.00 -0.45 0.00 0.00 34.95 33.11 1lqq s ARG 18 CO 0.00 -0.92 0.50 -3.47 -0.68 0.00 0.00 175.30 170.73 1lqq n ASP 19 N 5.14 -0.11 -0.27 0.23 2.03 -1.26 0.12 116.55 122.43 1lqq n ASP 19 Ca -0.06 0.55 -0.10 0.00 0.52 0.00 0.00 54.79 55.71 1lqq n ASP 19 Cb 0.44 -0.17 -0.07 0.00 -0.72 0.00 0.00 41.12 40.60 1lqq n ASP 19 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 1lqq h SER 20 N 0.00 -1.81 -1.04 1.67 0.87 -1.95 0.56 113.55 111.85 1lqq h SER 20 Ca 0.16 0.28 0.27 0.00 -1.23 0.00 0.00 61.79 61.27 1lqq h SER 20 Cb 0.26 0.80 -0.10 0.00 -0.44 0.00 0.00 62.40 62.92 1lqq h SER 20 CO -0.33 -0.32 0.66 0.22 -0.53 0.00 0.00 176.83 176.54 1lqq h TYR 21 N -0.18 0.72 0.05 2.24 3.20 0.46 0.18 116.97 123.64 1lqq h TYR 21 Ca 0.16 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.05 1lqq h TYR 21 Cb 0.53 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.59 1lqq h TYR 21 CO -0.83 0.05 -0.02 0.00 -1.64 0.00 0.00 178.16 175.71 1lqq h ASN 23 N -0.66 -1.55 0.64 0.00 -1.24 0.20 0.21 115.58 113.19 1lqq h ASN 23 Ca -0.01 0.26 -0.03 0.00 0.71 0.00 0.00 56.30 57.24 1lqq h ASN 23 Cb 0.57 0.71 -0.00 0.00 0.73 0.00 0.00 38.32 40.33 1lqq h ASN 23 CO 0.01 -0.32 -0.36 -0.78 -1.29 0.00 0.00 177.43 174.69 1lqq h ASP 24 N -0.18 -0.90 -0.72 1.15 3.58 -1.16 -1.25 116.42 116.94 1lqq h ASP 24 Ca 0.20 0.05 0.09 0.00 0.42 0.00 0.00 57.03 57.79 1lqq h ASP 24 Cb 0.55 0.26 -0.12 0.00 1.72 0.00 0.00 39.33 41.74 1lqq h ASP 24 CO -0.75 -0.58 -0.48 0.25 -2.88 0.00 0.00 179.24 174.80 1lqq h LEU 25 N -0.94 -1.68 0.46 2.28 5.85 0.66 0.18 115.31 122.12 1lqq h LEU 25 Ca -0.08 0.28 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 1lqq h LEU 25 Cb 0.75 0.77 0.00 0.00 0.37 0.00 0.00 40.66 42.55 1lqq h LEU 25 CO 0.10 -0.31 -0.22 0.00 -0.34 0.00 0.00 178.44 177.67 1lqq h THR 27 N -0.66 0.93 -1.01 0.00 1.35 -0.76 0.66 112.91 113.42 1lqq h THR 27 Ca -0.06 -0.30 0.23 0.00 -0.55 0.00 0.00 66.41 65.72 1lqq h THR 27 Cb 0.50 -0.03 -0.12 0.00 -1.73 0.00 0.00 68.15 66.77 1lqq h THR 27 CO 0.10 0.16 0.60 0.50 -0.25 0.00 0.00 175.52 176.64 1lqq h LYS 28 N 0.88 0.62 0.00 4.72 3.11 -0.23 0.57 116.57 126.24 1lqq h LYS 28 Ca 0.44 -0.04 0.00 0.00 -2.81 0.00 0.00 60.65 58.25 1lqq h LYS 28 Cb 0.49 -0.14 0.00 0.00 -1.00 0.00 0.00 32.23 31.58 1lqq h LYS 28 CO -0.21 0.41 -0.22 0.09 -2.81 0.00 0.00 179.45 176.71 1lqq n ASN 29 N -4.84 0.55 0.00 4.20 4.13 0.09 -4.88 115.26 114.50 1lqq n ASN 29 Ca 0.26 0.34 0.00 0.00 1.68 0.00 0.00 54.58 56.86 1lqq n ASN 29 Cb 0.70 -0.35 0.00 0.00 -1.54 0.00 0.00 39.78 38.58 1lqq n ASN 29 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1lqq n GLY 30 N 1.39 1.98 3.90 7.41 0.00 0.20 -4.82 105.19 115.25 1lqq n GLY 30 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 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 2.84 -0.07 4.61 0.00 -0.39 -3.17 121.76 123.58 1lqq s ALA 31 Ca 0.00 -0.60 -0.12 0.00 0.00 0.00 0.00 51.96 51.24 1lqq s ALA 31 Cb 0.00 -2.90 -0.30 0.00 0.00 0.00 0.00 23.12 19.92 1lqq s ALA 31 CO 0.00 -1.40 0.62 1.03 0.00 0.00 0.00 175.76 176.01 1lqq h SER 32 N -0.81 0.56 -5.03 0.00 0.87 -0.95 -3.39 113.55 104.80 1lqq h SER 32 Ca -0.45 -0.93 -0.06 0.00 -1.23 0.00 0.00 61.79 59.12 1lqq h SER 32 Cb 1.30 -0.18 -0.15 0.00 -0.44 0.00 0.00 62.40 62.92 1lqq h SER 32 CO 0.64 1.77 0.02 -0.55 -0.53 0.00 0.00 176.83 178.18 1lqq s SER 33 N -7.23 -0.41 0.00 6.23 0.15 -1.06 -4.92 113.70 106.47 1lqq s SER 33 Ca -0.17 0.07 0.00 0.00 0.70 0.00 0.00 55.95 56.55 1lqq s SER 33 Cb 0.05 0.49 -0.00 0.00 -1.71 0.00 0.00 66.02 64.85 1lqq s SER 33 CO 0.83 -0.76 -0.01 -0.83 1.20 0.00 0.00 173.24 173.67 1lqq s GLY 34 N -2.16 0.08 0.01 9.45 0.00 -1.26 -0.60 107.32 112.84 1lqq s GLY 34 Ca -0.04 -0.15 -0.09 0.00 0.00 0.00 0.00 44.72 44.45 1lqq s GLY 34 CO -0.04 -0.16 0.17 -2.52 0.00 0.00 0.00 173.10 170.55 1lqq s TYR 35 N -0.33 0.02 0.38 1.90 1.13 0.24 -1.76 117.35 118.93 1lqq s TYR 35 Ca -0.03 -0.13 -0.24 0.00 -1.41 0.00 0.00 57.07 55.25 1lqq s TYR 35 Cb -0.02 -0.03 -0.09 0.00 -1.10 0.00 0.00 41.96 40.71 1lqq s TYR 35 CO -0.00 -0.34 1.01 0.00 -2.51 0.00 0.00 175.55 173.71 1lqq s GLN 37 N -2.41 1.47 -0.30 0.00 -1.52 0.14 -4.75 119.66 112.30 1lqq s GLN 37 Ca 0.56 -1.74 -0.04 0.00 -1.95 0.00 0.00 55.36 52.18 1lqq s GLN 37 Cb -0.20 -0.98 0.17 0.00 -0.22 0.00 0.00 33.01 31.78 1lqq s GLN 37 CO 0.25 0.00 0.61 1.67 -0.25 0.00 0.00 175.29 177.58 1lqq s TRP 38 N -3.14 -1.50 0.00 0.91 -2.14 -1.26 -0.99 118.94 110.82 1lqq s TRP 38 Ca 0.29 1.94 0.00 0.00 2.66 0.00 0.00 56.10 60.99 1lqq s TRP 38 Cb 0.04 0.65 0.00 0.00 -3.10 0.00 0.00 33.47 31.06 1lqq s TRP 38 CO 0.10 -0.80 0.00 0.00 -2.66 0.00 0.00 176.95 173.60 1lqq n ALA 39 N 5.44 0.00 0.12 2.67 0.00 -0.60 -4.98 120.51 123.16 1lqq n ALA 39 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1lqq n ALA 39 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 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 4.26 -1.67 0.33 0.00 0.00 -1.26 -4.72 105.19 102.13 1lqq n GLY 40 Ca 0.00 0.36 0.27 0.00 0.00 0.00 0.00 46.02 46.65 1lqq n GLY 40 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1lqq h LYS 41 N 0.00 0.11 -0.03 1.61 1.63 -2.00 0.14 116.57 118.02 1lqq h LYS 41 Ca 0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1lqq h LYS 41 Cb 0.00 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.61 1lqq h LYS 41 CO 0.00 0.07 0.00 0.66 -3.45 0.00 0.00 179.45 176.73 1lqq n TYR 42 N -5.22 0.09 -4.81 1.91 4.01 -1.26 -4.39 117.16 107.49 1lqq n TYR 42 Ca 0.34 -0.96 0.00 0.00 -0.16 0.00 0.00 57.90 57.12 1lqq n TYR 42 Cb 1.11 -0.16 0.00 0.00 -0.31 0.00 0.00 39.34 39.98 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 -1.30 1.50 3.92 2.72 0.00 0.47 -4.71 105.19 107.79 1lqq n GLY 43 Ca 0.16 -0.60 -0.28 0.00 0.00 0.00 0.00 46.02 45.29 1lqq n GLY 43 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1lqq s ASN 44 N -4.00 6.41 0.00 1.61 2.47 -1.26 -1.56 114.94 118.60 1lqq s ASN 44 Ca 0.00 0.47 0.00 0.00 0.42 0.00 0.00 52.86 53.75 1lqq s ASN 44 Cb 0.00 -2.04 0.00 0.00 -1.45 0.00 0.00 41.25 37.76 1lqq s ASN 44 CO 0.00 -0.05 0.00 0.00 -3.72 0.00 0.00 177.10 173.33 1lqq n ALA 45 N -0.57 0.00 -2.82 1.71 0.00 -0.16 -4.70 120.51 113.97 1lqq n ALA 45 Ca -0.04 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.07 1lqq n ALA 45 Cb 0.53 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.92 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 -1.22 2.60 0.06 0.00 -0.11 0.39 -0.90 118.94 119.76 1lqq s TRP 47 Ca 0.24 -1.12 0.08 0.00 1.22 0.00 0.00 56.10 56.52 1lqq s TRP 47 Cb -0.12 -1.74 -0.03 0.00 -1.50 0.00 0.00 33.47 30.07 1lqq s TRP 47 CO 0.15 -0.47 -0.22 0.00 -4.62 0.00 0.00 176.95 171.79 1lqq s TYR 49 N -0.93 1.70 -1.15 0.00 -0.85 0.23 -1.12 117.35 115.22 1lqq s TYR 49 Ca 0.14 -0.43 -0.13 0.00 -0.52 0.00 0.00 57.07 56.13 1lqq s TYR 49 Cb -0.10 -0.93 -0.02 0.00 0.38 0.00 0.00 41.96 41.28 1lqq s TYR 49 CO 0.05 0.18 0.80 0.00 -1.52 0.00 0.00 175.55 175.06 1lqq n ALA 50 N 1.09 -2.43 -1.12 9.51 0.00 0.14 -2.42 120.51 125.28 1lqq n ALA 50 Ca -0.20 -0.13 -0.31 0.00 0.00 0.00 0.00 53.44 52.81 1lqq n ALA 50 Cb 0.54 -4.11 0.12 0.00 0.00 0.00 0.00 19.45 16.00 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 -6.25 2.78 -0.01 0.00 2.01 0.17 -1.63 118.68 115.74 1lqq s LEU 51 Ca 0.38 1.82 0.00 0.00 0.01 0.00 0.00 54.13 56.34 1lqq s LEU 51 Cb -0.11 -4.38 0.01 0.00 0.01 0.00 0.00 46.19 41.73 1lqq s LEU 51 CO 0.82 -2.43 1.13 -0.81 1.01 0.00 0.00 176.35 176.07 1lqq n PRO 52 N -3.78 1.02 0.00 1.29 -0.04 -1.19 -3.57 135.00 128.74 1lqq n PRO 52 Ca 0.09 -0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 1lqq n PRO 52 Cb 0.53 -1.02 0.00 0.00 -0.04 0.00 0.00 33.50 32.97 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 0.58 0.00 -1.94 3.54 8.00 -1.26 -4.69 116.55 120.78 1lqq n ASP 53 Ca 0.01 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.49 1lqq n ASP 53 Cb 0.52 -1.17 0.32 0.00 -0.02 0.00 0.00 41.12 40.77 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 0.00 5.01 -4.10 -2.24 0.23 -1.26 -4.78 115.26 108.11 1lqq n ASN 54 Ca 0.00 -3.08 -0.35 0.00 -0.53 0.00 0.00 54.58 50.61 1lqq n ASN 54 Cb 0.00 -0.72 -0.12 0.00 -2.08 0.00 0.00 39.78 36.86 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 -2.82 3.17 -0.49 3.53 1.01 -1.26 -5.04 120.40 118.50 1lqq s VAL 55 Ca 0.53 -2.15 -0.27 0.00 0.00 0.00 0.00 61.98 60.09 1lqq s VAL 55 Cb 0.42 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 1lqq s VAL 55 CO 0.14 -0.69 2.12 -2.16 0.00 0.00 0.00 175.10 174.51 1lqq s PRO 56 N 1.04 2.54 0.13 2.72 0.04 -1.26 -4.96 135.00 135.24 1lqq s PRO 56 Ca 0.09 1.20 -0.02 0.00 0.04 0.00 0.00 61.00 62.31 1lqq s PRO 56 Cb -0.22 -4.45 0.03 0.00 0.04 0.00 0.00 34.50 29.90 1lqq s PRO 56 CO -0.05 -2.80 0.17 0.44 0.04 0.00 0.00 177.00 174.81 1lqq n ILE 57 N 7.63 0.00 -3.94 0.56 -0.00 -1.26 -3.91 119.36 118.43 1lqq n ILE 57 Ca 0.29 -0.13 -0.17 0.00 -0.00 0.00 0.00 62.75 62.74 1lqq n ILE 57 Cb 0.52 -1.90 -0.16 0.00 -0.00 0.00 0.00 39.64 38.09 1lqq n ILE 57 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1lqq s ARG 58 N -3.35 0.32 -0.41 6.28 1.04 -0.25 -4.57 118.95 118.02 1lqq s ARG 58 Ca 0.10 0.06 0.09 0.00 -1.04 0.00 0.00 55.73 54.94 1lqq s ARG 58 Cb -0.00 -0.48 0.34 0.00 -2.04 0.00 0.00 34.95 32.76 1lqq s ARG 58 CO 0.07 -0.12 0.90 1.33 -0.04 0.00 0.00 175.30 177.43 1lqq n VAL 59 N 4.07 -0.10 -0.10 4.99 0.24 -1.26 -4.33 118.33 121.85 1lqq n VAL 59 Ca -0.26 -3.27 -0.13 0.00 -2.04 0.00 0.00 64.34 58.64 1lqq n VAL 59 Cb 0.51 0.49 -0.04 0.00 -1.47 0.00 0.00 33.84 33.33 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 0.31 0.53 0.00 7.34 -0.04 -1.26 -5.04 135.00 136.85 1lqq n PRO 60 Ca 0.17 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.89 1lqq n PRO 60 Cb 0.68 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.66 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 1.44 2.86 2.80 0.55 0.00 -1.26 -5.08 105.19 106.51 1lqq n GLY 61 Ca -0.21 -0.36 -0.21 0.00 0.00 0.00 0.00 46.02 45.24 1lqq n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lqq s LYS 62 N 0.00 0.53 0.76 1.61 -0.14 -1.26 -4.46 119.74 116.78 1lqq s LYS 62 Ca 0.00 0.07 -0.11 0.00 -1.36 0.00 0.00 55.97 54.57 1lqq s LYS 62 Cb 0.00 -0.78 0.05 0.00 -1.68 0.00 0.00 37.83 35.42 1lqq s LYS 62 CO 0.00 -0.21 1.10 0.00 -0.76 0.00 0.00 175.35 175.48