#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kj5 n GLN 11 N 0.00 0.00 0.00 0.00 1.13 -1.26 -5.05 117.38 112.20 3kj5 n GLN 11 Ca 0.00 0.44 0.00 0.00 -1.94 0.00 0.00 57.00 55.50 3kj5 n GLN 11 Cb 0.00 -1.26 0.00 0.00 0.11 0.00 0.00 30.24 29.09 3kj5 n GLN 11 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3kj5 n ALA 12 N -1.83 0.00 0.00 -1.58 0.00 -1.26 -5.03 120.51 110.81 3kj5 n ALA 12 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3kj5 n ALA 12 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3kj5 n ALA 12 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3kj5 n ARG 13 N -2.01 0.00 -0.22 0.00 0.00 -1.26 -3.96 116.66 109.21 3kj5 n ARG 13 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.85 57.81 3kj5 n ARG 13 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 32.46 32.43 3kj5 n ARG 13 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 3kj5 n LYS 14 N 0.00 -0.20 -0.40 -0.14 4.76 -1.26 -2.28 118.16 118.64 3kj5 n LYS 14 Ca 0.00 0.83 0.33 0.00 -2.87 0.00 0.00 58.31 56.60 3kj5 n LYS 14 Cb 0.00 -1.23 0.60 0.00 -1.84 0.00 0.00 35.03 32.57 3kj5 n LYS 14 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 3kj5 h LEU 15 N 0.00 0.31 -0.52 -0.35 6.46 -2.01 0.70 115.31 119.90 3kj5 h LEU 15 Ca 0.13 0.13 -0.05 0.00 -0.12 0.00 0.00 57.88 57.97 3kj5 h LEU 15 Cb 0.26 0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.28 3kj5 h LEU 15 CO -0.53 -0.13 0.14 0.58 -0.62 0.00 0.00 178.44 177.89 3kj5 h VAL 16 N 0.17 1.24 -0.33 1.05 2.07 -1.79 -1.98 116.25 116.68 3kj5 h VAL 16 Ca 0.76 -0.82 -0.06 0.00 0.82 0.00 0.00 66.70 67.40 3kj5 h VAL 16 Cb 2.26 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.80 3kj5 h VAL 16 CO -0.41 0.30 -0.06 -0.33 0.02 0.00 0.00 177.57 177.09 3kj5 h GLU 17 N 0.71 0.54 0.34 1.57 4.39 0.34 0.34 114.58 122.81 3kj5 h GLU 17 Ca 0.16 -0.14 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 3kj5 h GLU 17 Cb 0.31 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 3kj5 h GLU 17 CO -0.00 0.61 -0.17 1.96 -1.16 0.00 0.00 179.01 180.25 3kj5 h GLN 18 N 0.51 -0.45 -0.41 2.33 1.08 -1.05 0.18 115.11 117.29 3kj5 h GLN 18 Ca 0.10 0.03 -0.09 0.00 -1.45 0.00 0.00 58.65 57.24 3kj5 h GLN 18 Cb 0.42 0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.94 3kj5 h GLN 18 CO 0.02 -0.13 -0.09 -0.07 -0.95 0.00 0.00 178.83 177.60 3kj5 h LEU 19 N -0.79 0.79 -0.38 1.46 3.38 -1.32 -0.59 115.31 117.86 3kj5 h LEU 19 Ca -0.05 -0.36 -0.05 0.00 0.09 0.00 0.00 57.88 57.51 3kj5 h LEU 19 Cb 0.52 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3kj5 h LEU 19 CO 0.08 0.97 0.03 0.50 0.09 0.00 0.00 178.44 180.10 3kj5 h LYS 20 N 0.61 0.66 -0.32 1.13 3.64 -0.38 -1.16 116.57 120.75 3kj5 h LYS 20 Ca 0.10 -0.20 -0.16 0.00 -1.27 0.00 0.00 60.65 59.13 3kj5 h LYS 20 Cb 0.62 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.37 3kj5 h LYS 20 CO 0.04 0.74 -0.41 0.00 -2.27 0.00 0.00 179.45 177.55 3kj5 h MET 21 N 0.49 0.84 -0.80 1.90 -0.00 -0.65 -3.30 114.93 113.40 3kj5 h MET 21 Ca 0.11 -0.48 -0.04 0.00 -0.00 0.00 0.00 59.70 59.29 3kj5 h MET 21 Cb 0.42 0.03 -0.04 0.00 -0.00 0.00 0.00 31.60 32.02 3kj5 h MET 21 CO 0.01 1.11 0.34 0.93 -0.00 0.00 0.00 176.91 179.31 3kj5 h GLU 22 N 0.62 1.18 -0.71 -0.10 5.08 -1.03 -3.29 114.58 116.33 3kj5 h GLU 22 Ca 0.04 -0.20 -0.04 0.00 -1.00 0.00 0.00 59.36 58.16 3kj5 h GLU 22 Cb 1.00 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 30.02 3kj5 h GLU 22 CO 0.10 0.94 0.29 0.00 -1.00 0.00 0.00 179.01 179.34 3kj5 h ALA 23 N 1.21 1.17 -0.68 3.43 0.00 -1.29 -3.38 119.26 119.72 3kj5 h ALA 23 Ca 0.27 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3kj5 h ALA 23 Cb 0.19 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3kj5 h ALA 23 CO -0.03 0.60 0.34 -0.97 0.00 0.00 0.00 179.25 179.19 3kj5 h ASN 24 N 1.02 0.87 -0.95 0.00 -0.00 -1.67 -3.41 115.58 111.43 3kj5 h ASN 24 Ca 0.24 -0.09 0.08 0.00 -0.00 0.00 0.00 56.30 56.53 3kj5 h ASN 24 Cb 0.19 -0.22 -0.07 0.00 -0.00 0.00 0.00 38.32 38.22 3kj5 h ASN 24 CO -0.02 0.73 0.61 0.16 -0.00 0.00 0.00 177.43 178.91 3kj5 h ILE 25 N 0.96 1.04 0.00 2.57 -2.65 -1.81 -3.48 117.51 114.14 3kj5 h ILE 25 Ca 0.24 -0.36 0.00 0.00 1.03 0.00 0.00 64.86 65.77 3kj5 h ILE 25 Cb 0.08 -0.11 0.00 0.00 -2.05 0.00 0.00 36.82 34.75 3kj5 h ILE 25 CO -0.03 0.19 0.00 -0.90 0.03 0.00 0.00 178.15 177.44 3kj5 n ASP 26 N -4.51 0.00 -3.71 2.16 5.68 -1.26 -5.14 116.55 109.76 3kj5 n ASP 26 Ca 0.15 0.00 -0.14 0.00 -0.50 0.00 0.00 54.79 54.30 3kj5 n ASP 26 Cb 0.23 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.12 3kj5 n ASP 26 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 3kj5 s ARG 27 N -1.68 0.69 -0.09 0.11 1.81 -1.26 -5.14 118.95 113.39 3kj5 s ARG 27 Ca 0.00 0.07 0.04 0.00 -1.72 0.00 0.00 55.73 54.12 3kj5 s ARG 27 Cb 0.00 0.32 -0.00 0.00 -0.45 0.00 0.00 34.95 34.81 3kj5 s ARG 27 CO 0.00 -0.18 -0.24 0.42 -0.68 0.00 0.00 175.30 174.62 3kj5 s ILE 28 N -0.94 2.03 0.25 1.52 1.09 -1.26 -5.08 121.20 118.82 3kj5 s ILE 28 Ca -0.10 -1.01 -0.31 0.00 -1.10 0.00 0.00 60.65 58.13 3kj5 s ILE 28 Cb -0.04 -1.74 -0.12 0.00 -1.06 0.00 0.00 42.46 39.50 3kj5 s ILE 28 CO 0.04 0.56 1.61 0.29 -0.10 0.00 0.00 174.94 177.34 3kj5 n LYS 29 N 3.38 2.61 -0.15 2.79 4.76 -1.26 -4.41 118.16 125.88 3kj5 n LYS 29 Ca -0.19 0.93 0.28 0.00 -2.87 0.00 0.00 58.31 56.47 3kj5 n LYS 29 Cb 0.53 -2.72 0.72 0.00 -1.84 0.00 0.00 35.03 31.72 3kj5 n LYS 29 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 3kj5 h VAL 30 N 3.47 0.47 -0.86 -0.18 2.07 -1.97 14.73 116.25 133.97 3kj5 h VAL 30 Ca -0.45 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.30 3kj5 h VAL 30 Cb 1.23 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 3kj5 h VAL 30 CO 0.85 0.00 0.61 0.77 0.02 0.00 0.00 177.57 179.81 3kj5 h SER 31 N 0.00 0.11 0.00 0.57 4.64 -1.98 0.88 113.55 117.76 3kj5 h SER 31 Ca 0.40 0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.58 3kj5 h SER 31 Cb 1.72 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 63.78 3kj5 h SER 31 CO -0.00 0.04 -0.85 0.50 -0.87 0.00 0.00 176.83 175.64 3kj5 h LYS 32 N 0.10 0.00 -0.81 4.77 3.64 3.31 -2.34 116.57 125.25 3kj5 h LYS 32 Ca 0.42 0.00 0.16 0.00 -1.27 0.00 0.00 60.65 59.96 3kj5 h LYS 32 Cb 1.51 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 33.23 3kj5 h LYS 32 CO -0.05 0.97 0.35 0.00 -2.27 0.00 0.00 179.45 178.45 3kj5 h ALA 33 N -0.36 1.19 -0.73 5.00 0.00 0.20 -2.38 119.26 122.18 3kj5 h ALA 33 Ca -0.23 0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 3kj5 h ALA 33 Cb 1.18 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 3kj5 h ALA 33 CO -0.14 -0.20 0.22 0.00 0.00 0.00 0.00 179.25 179.13 3kj5 h ALA 34 N 1.58 0.96 -0.87 0.00 0.00 0.59 -3.12 119.26 118.40 3kj5 h ALA 34 Ca 0.46 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 3kj5 h ALA 34 Cb 0.72 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 3kj5 h ALA 34 CO -0.42 0.65 0.44 0.00 0.00 0.00 0.00 179.25 179.92 3kj5 h ALA 35 N 1.11 1.14 -0.29 0.00 0.00 -0.87 0.23 119.26 120.58 3kj5 h ALA 35 Ca 0.24 -0.15 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 3kj5 h ALA 35 Cb 0.32 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3kj5 h ALA 35 CO -0.01 0.66 -0.40 -0.44 0.00 0.00 0.00 179.25 179.07 3kj5 h ASP 36 N 1.23 0.75 -0.55 0.00 3.32 -1.56 -2.35 116.42 117.26 3kj5 h ASP 36 Ca 0.30 -0.34 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 3kj5 h ASP 36 Cb 0.08 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 3kj5 h ASP 36 CO -0.04 1.06 0.14 -0.07 -1.72 0.00 0.00 179.24 178.61 3kj5 h LEU 37 N 0.58 0.83 -1.06 1.55 3.38 -1.38 -0.64 115.31 118.56 3kj5 h LEU 37 Ca 0.05 -0.23 -0.08 0.00 0.09 0.00 0.00 57.88 57.71 3kj5 h LEU 37 Cb 0.94 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 3kj5 h LEU 37 CO 0.09 0.84 -0.39 -0.03 0.09 0.00 0.00 178.44 179.03 3kj5 h MET 38 N 0.77 0.00 -0.44 1.13 4.05 -0.38 -3.08 114.93 116.98 3kj5 h MET 38 Ca 0.17 0.00 -0.32 0.00 -0.28 0.00 0.00 59.70 59.27 3kj5 h MET 38 Cb 0.33 0.00 -0.25 0.00 -0.80 0.00 0.00 31.60 30.88 3kj5 h MET 38 CO 0.00 0.39 -0.64 0.00 0.23 0.00 0.00 176.91 176.89 3kj5 n ALA 39 N -2.35 4.48 -0.12 0.39 0.00 -0.90 -3.08 120.51 118.94 3kj5 n ALA 39 Ca -0.01 -3.57 -0.24 0.00 0.00 0.00 0.00 53.44 49.62 3kj5 n ALA 39 Cb 0.48 -0.37 -0.10 0.00 0.00 0.00 0.00 19.45 19.46 3kj5 n ALA 39 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 3kj5 n TYR 40 N -0.89 0.56 -1.63 0.00 4.19 -0.25 -3.61 117.16 115.52 3kj5 n TYR 40 Ca 0.34 0.24 -0.50 0.00 3.31 0.00 0.00 57.90 61.30 3kj5 n TYR 40 Cb 0.86 -1.02 -0.05 0.00 0.49 0.00 0.00 39.34 39.62 3kj5 n TYR 40 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 3kj5 n GLU 42 N 6.99 1.90 0.15 0.00 1.02 -1.18 -4.00 120.64 125.53 3kj5 n GLU 42 Ca 0.27 -0.04 0.03 0.00 -0.02 0.00 0.00 57.16 57.40 3kj5 n GLU 42 Cb 0.27 -0.28 0.15 0.00 -0.02 0.00 0.00 31.44 31.56 3kj5 n GLU 42 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kj5 h ALA 43 N 0.00 0.79 -0.55 0.62 0.00 -1.74 -3.14 119.26 115.24 3kj5 h ALA 43 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3kj5 h ALA 43 Cb 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3kj5 h ALA 43 CO 0.00 0.64 0.00 0.72 0.00 0.00 0.00 179.25 180.61 3kj5 n HIS 44 N -3.39 1.37 0.93 0.00 8.25 -0.87 -4.51 115.22 117.00 3kj5 n HIS 44 Ca 0.01 -0.65 0.13 0.00 -0.26 0.00 0.00 57.72 56.94 3kj5 n HIS 44 Cb 0.66 -0.26 0.37 0.00 1.12 0.00 0.00 29.99 31.87 3kj5 n HIS 44 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3kj5 n ALA 45 N 0.76 3.03 0.11 -1.41 0.00 -1.19 -3.47 120.51 118.34 3kj5 n ALA 45 Ca 0.24 -0.24 0.07 0.00 0.00 0.00 0.00 53.44 53.51 3kj5 n ALA 45 Cb 0.88 -1.25 0.25 0.00 0.00 0.00 0.00 19.45 19.33 3kj5 n ALA 45 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3kj5 n LYS 46 N -1.61 2.72 0.00 0.00 3.00 -1.26 -3.45 118.16 117.56 3kj5 n LYS 46 Ca 0.06 -2.01 0.00 0.00 -0.00 0.00 0.00 58.31 56.36 3kj5 n LYS 46 Cb 0.35 -1.61 0.00 0.00 0.00 0.00 0.00 35.03 33.77 3kj5 n LYS 46 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 3kj5 n GLU 47 N 0.86 0.79 -3.08 1.64 1.02 -1.23 -4.95 120.64 115.69 3kj5 n GLU 47 Ca 0.18 -0.83 -0.43 0.00 -0.02 0.00 0.00 57.16 56.06 3kj5 n GLU 47 Cb 0.60 -0.88 -0.06 0.00 -0.02 0.00 0.00 31.44 31.07 3kj5 n GLU 47 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3kj5 s ASP 48 N -0.39 6.35 0.20 1.62 -1.08 -1.22 -4.87 116.67 117.28 3kj5 s ASP 48 Ca 0.00 -0.25 -0.08 0.00 -0.52 0.00 0.00 52.55 51.70 3kj5 s ASP 48 Cb 0.00 -2.33 0.12 0.00 -1.46 0.00 0.00 42.92 39.25 3kj5 s ASP 48 CO 0.00 -0.80 1.72 -0.65 0.52 0.00 0.00 175.17 175.97 3kj5 h PRO 49 N 8.87 1.16 -0.19 4.34 0.11 -1.93 -0.47 132.00 143.89 3kj5 h PRO 49 Ca -0.25 -0.27 -0.07 0.00 0.11 0.00 0.00 66.00 65.52 3kj5 h PRO 49 Cb 1.09 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.05 3kj5 h PRO 49 CO 0.90 1.01 -0.15 -0.07 -0.21 0.00 0.00 178.00 179.48 3kj5 h LEU 50 N 1.10 0.45 -0.55 2.35 3.38 -1.97 -3.32 115.31 116.75 3kj5 h LEU 50 Ca 0.23 -0.46 -0.09 0.00 0.09 0.00 0.00 57.88 57.65 3kj5 h LEU 50 Cb 0.36 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3kj5 h LEU 50 CO -0.00 0.81 -0.02 0.25 0.09 0.00 0.00 178.44 179.58 3kj5 h LEU 51 N 0.10 0.97 -8.61 1.67 6.46 -1.91 -3.43 115.31 110.55 3kj5 h LEU 51 Ca 0.03 -0.31 -0.69 0.00 -0.12 0.00 0.00 57.88 56.79 3kj5 h LEU 51 Cb 0.67 -0.26 -0.29 0.00 -0.73 0.00 0.00 40.66 40.05 3kj5 h LEU 51 CO 0.04 1.05 -0.84 -0.89 -0.62 0.00 0.00 178.44 177.17 3kj5 s THR 52 N -4.99 2.41 0.25 1.05 2.01 -0.19 -5.07 115.64 111.11 3kj5 s THR 52 Ca -0.12 -0.94 -0.31 0.00 0.31 0.00 0.00 61.69 60.63 3kj5 s THR 52 Cb 0.13 -1.91 -0.12 0.00 0.01 0.00 0.00 72.50 70.61 3kj5 s THR 52 CO 0.84 0.57 1.65 -2.84 -0.69 0.00 0.00 174.62 174.16 3kj5 s PRO 53 N -0.29 4.12 0.63 4.92 0.02 -1.26 -4.33 135.00 138.82 3kj5 s PRO 53 Ca 0.01 2.59 -0.15 0.00 0.02 0.00 0.00 61.00 63.47 3kj5 s PRO 53 Cb -0.13 -3.05 -0.02 0.00 0.02 0.00 0.00 34.50 31.33 3kj5 s PRO 53 CO 0.03 -0.69 1.07 0.08 -0.33 0.00 0.00 177.00 177.16 3kj5 s VAL 54 N 0.53 3.68 0.32 3.83 1.01 -1.25 -4.97 120.40 123.56 3kj5 s VAL 54 Ca 0.68 0.74 -0.29 0.00 0.00 0.00 0.00 61.98 63.11 3kj5 s VAL 54 Cb -0.49 -3.29 -0.12 0.00 0.00 0.00 0.00 36.38 32.48 3kj5 s VAL 54 CO 0.41 -0.52 1.53 -2.65 0.00 0.00 0.00 175.10 173.86 3kj5 n PRO 55 N -2.36 2.61 -0.13 2.72 -0.02 -1.26 -4.81 135.00 131.76 3kj5 n PRO 55 Ca 0.09 0.92 -0.04 0.00 -2.02 0.00 0.00 63.50 62.45 3kj5 n PRO 55 Cb 0.53 -2.67 0.03 0.00 -0.02 0.00 0.00 33.50 31.37 3kj5 n PRO 55 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3kj5 h ALA 56 N 4.03 0.38 -3.02 3.55 0.00 -1.95 -3.36 119.26 118.90 3kj5 h ALA 56 Ca -0.48 0.13 -0.67 0.00 0.00 0.00 0.00 54.91 53.89 3kj5 h ALA 56 Cb 1.24 0.23 -0.11 0.00 0.00 0.00 0.00 17.79 19.14 3kj5 h ALA 56 CO 0.73 -0.40 -0.56 -1.54 0.00 0.00 0.00 179.25 177.48 3kj5 s SER 57 N -5.25 5.77 0.01 0.00 1.04 -1.26 -3.05 113.70 110.97 3kj5 s SER 57 Ca -0.13 0.27 -0.25 0.00 0.48 0.00 0.00 55.95 56.32 3kj5 s SER 57 Cb 0.15 -1.74 -0.19 0.00 0.10 0.00 0.00 66.02 64.34 3kj5 s SER 57 CO 0.71 0.37 1.42 -0.08 0.98 0.00 0.00 173.24 176.64 3kj5 h GLU 58 N 4.87 0.00 -1.71 4.02 4.81 -1.96 -3.50 114.58 121.11 3kj5 h GLU 58 Ca -0.52 -0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 58.66 3kj5 h GLU 58 Cb 1.20 -0.00 -0.26 0.00 0.63 0.00 0.00 28.75 30.33 3kj5 h GLU 58 CO 0.57 0.33 -0.37 -0.80 -0.73 0.00 0.00 179.01 178.02 3kj5 s ASN 59 N -5.53 -0.47 -0.25 1.04 0.02 -1.17 -4.51 114.94 104.08 3kj5 s ASN 59 Ca -0.15 0.66 0.14 0.00 -1.02 0.00 0.00 52.86 52.49 3kj5 s ASN 59 Cb 0.03 1.59 0.82 0.00 0.02 0.00 0.00 41.25 43.71 3kj5 s ASN 59 CO 0.67 -0.27 1.77 -2.65 0.02 0.00 0.00 177.10 176.64 3kj5 n PRO 60 N 5.40 4.83 -0.00 -0.60 -0.02 -1.26 -3.08 135.00 140.25 3kj5 n PRO 60 Ca -0.04 -3.17 0.01 0.00 -2.02 0.00 0.00 63.50 58.27 3kj5 n PRO 60 Cb 0.50 -2.27 0.01 0.00 -0.02 0.00 0.00 33.50 31.71 3kj5 n PRO 60 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3kj5 n PHE 61 N 0.55 0.01 1.24 6.00 3.72 -1.26 -5.24 117.46 122.48 3kj5 n PHE 61 Ca 0.29 -0.12 0.13 0.00 -0.05 0.00 0.00 57.45 57.70 3kj5 n PHE 61 Cb 1.23 -0.01 0.30 0.00 -0.94 0.00 0.00 39.48 40.06 3kj5 n PHE 61 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25