#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5e s THR 2 N 0.00 0.72 0.12 3.17 -1.32 -1.26 -5.18 115.64 111.88 2k5e s THR 2 Ca 0.00 -2.00 0.03 0.00 -1.21 0.00 0.00 61.69 58.51 2k5e s THR 2 Cb 0.00 -2.41 -0.04 0.00 -1.51 0.00 0.00 72.50 68.53 2k5e s THR 2 CO 0.00 0.00 -0.09 -1.10 -2.21 0.00 0.00 174.62 171.22 2k5e s GLN 3 N -3.75 0.92 0.00 7.08 -0.21 -1.26 -5.04 119.66 117.40 2k5e s GLN 3 Ca 0.25 -1.33 0.22 0.00 0.02 0.00 0.00 55.36 54.52 2k5e s GLN 3 Cb 0.04 -0.45 -0.12 0.00 1.00 0.00 0.00 33.01 33.48 2k5e s GLN 3 CO 0.14 0.04 0.98 1.63 -2.12 0.00 0.00 175.29 175.96 2k5e n LYS 4 N 0.05 0.14 -3.77 2.91 4.76 -1.26 -4.87 118.16 116.12 2k5e n LYS 4 Ca -0.12 -0.12 -0.25 0.00 -2.87 0.00 0.00 58.31 54.95 2k5e n LYS 4 Cb 0.60 -1.50 -0.17 0.00 -1.84 0.00 0.00 35.03 32.12 2k5e n LYS 4 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2k5e s PHE 5 N -2.94 0.93 0.35 2.13 0.08 -1.26 -4.95 117.98 112.32 2k5e s PHE 5 Ca 0.10 -0.54 0.07 0.00 0.12 0.00 0.00 56.93 56.68 2k5e s PHE 5 Cb 0.16 -0.95 -0.07 0.00 -0.57 0.00 0.00 43.02 41.59 2k5e s PHE 5 CO 0.82 -0.47 -0.03 -0.08 -0.10 0.00 0.00 175.22 175.35 2k5e s THR 6 N 1.89 1.90 0.23 0.64 -1.32 -1.26 -4.86 115.64 112.85 2k5e s THR 6 Ca 0.02 -2.09 0.23 0.00 -1.21 0.00 0.00 61.69 58.64 2k5e s THR 6 Cb -0.14 -2.74 0.21 0.00 -1.51 0.00 0.00 72.50 68.32 2k5e s THR 6 CO -0.07 -0.13 1.86 0.07 -2.21 0.00 0.00 174.62 174.15 2k5e h LYS 7 N 2.01 0.00 0.05 7.08 2.10 -1.97 -3.22 116.57 122.61 2k5e h LYS 7 Ca -0.42 0.00 -0.23 0.00 -2.00 0.00 0.00 60.65 57.99 2k5e h LYS 7 Cb 1.24 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.56 2k5e h LYS 7 CO 0.73 0.25 -1.10 0.22 -2.00 0.00 0.00 179.45 177.55 2k5e h ASP 8 N 0.00 0.16 -4.29 7.07 3.58 -1.96 -2.15 116.42 118.83 2k5e h ASP 8 Ca -0.00 -0.17 -0.51 0.00 0.42 0.00 0.00 57.03 56.76 2k5e h ASP 8 Cb 0.68 -0.05 0.12 0.00 1.72 0.00 0.00 39.33 41.80 2k5e h ASP 8 CO 0.03 1.14 0.33 0.00 -2.88 0.00 0.00 179.24 177.86 2k5e s MET 9 N -2.69 2.39 0.48 0.28 0.23 -1.22 -4.63 119.30 114.15 2k5e s MET 9 Ca -0.01 1.22 -0.11 0.00 -1.03 0.00 0.00 55.69 55.76 2k5e s MET 9 Cb 0.09 -1.91 -0.06 0.00 -1.53 0.00 0.00 34.83 31.42 2k5e s MET 9 CO 0.84 -1.54 0.86 0.95 -2.03 0.00 0.00 175.02 174.10 2k5e s THR 10 N -2.77 4.75 0.23 3.16 -4.23 -1.26 -0.79 115.64 114.73 2k5e s THR 10 Ca 0.62 0.69 -0.06 0.00 -1.18 0.00 0.00 61.69 61.76 2k5e s THR 10 Cb -0.18 -3.78 0.18 0.00 1.34 0.00 0.00 72.50 70.06 2k5e s THR 10 CO 0.53 -0.72 1.79 -0.26 -0.54 0.00 0.00 174.62 175.41 2k5e h PHE 11 N 0.72 0.70 -0.12 3.99 0.04 -1.22 -2.60 116.94 118.45 2k5e h PHE 11 Ca -0.47 0.03 0.04 0.00 2.80 0.00 0.00 57.97 60.37 2k5e h PHE 11 Cb 1.19 -0.20 -0.04 0.00 2.20 0.00 0.00 35.95 39.10 2k5e h PHE 11 CO 0.62 0.27 -0.11 0.00 -0.60 0.00 0.00 178.31 178.49 2k5e h ALA 12 N 1.43 -0.02 -0.50 2.45 0.00 -1.51 -0.61 119.26 120.49 2k5e h ALA 12 Ca 0.36 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.37 2k5e h ALA 12 Cb 0.35 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 2k5e h ALA 12 CO -0.25 -0.56 0.21 1.96 0.00 0.00 0.00 179.25 180.61 2k5e h GLN 13 N -0.13 0.41 -0.22 0.00 4.20 -1.75 -1.13 115.11 116.48 2k5e h GLN 13 Ca 0.08 -0.02 0.01 0.00 0.06 0.00 0.00 58.65 58.78 2k5e h GLN 13 Cb 0.25 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 2k5e h GLN 13 CO -0.20 0.27 0.10 0.00 -0.67 0.00 0.00 178.83 178.34 2k5e h ALA 14 N 1.31 0.26 -0.43 3.87 0.00 -1.09 -0.21 119.26 122.97 2k5e h ALA 14 Ca 0.24 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.16 2k5e h ALA 14 Cb 0.21 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2k5e h ALA 14 CO -0.21 -0.31 0.28 -0.07 0.00 0.00 0.00 179.25 178.95 2k5e h LEU 15 N 0.23 0.47 -0.06 0.00 3.38 -0.60 -2.28 115.31 116.45 2k5e h LEU 15 Ca 0.09 -0.01 -0.25 0.00 0.09 0.00 0.00 57.88 57.80 2k5e h LEU 15 Cb 0.02 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 40.67 2k5e h LEU 15 CO -0.06 0.33 -1.04 1.56 0.09 0.00 0.00 178.44 179.32 2k5e h GLN 16 N 0.55 0.52 0.07 1.13 1.08 -0.81 -3.35 115.11 114.30 2k5e h GLN 16 Ca 0.16 -0.60 0.01 0.00 -1.45 0.00 0.00 58.65 56.77 2k5e h GLN 16 Cb -0.02 0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.58 2k5e h GLN 16 CO -0.04 1.22 -0.09 1.15 -0.95 0.00 0.00 178.83 180.12 2k5e h THR 17 N 0.28 0.78 -3.27 -0.54 2.02 -0.48 -3.44 112.91 108.27 2k5e h THR 17 Ca -0.11 0.00 -0.16 0.00 0.77 0.00 0.00 66.41 66.90 2k5e h THR 17 Cb 1.69 0.78 -0.25 0.00 -1.74 0.00 0.00 68.15 68.64 2k5e h THR 17 CO 0.19 0.00 -0.46 -1.00 0.37 0.00 0.00 175.52 174.62 2k5e s HIS 18 N -6.16 -0.18 -0.01 3.16 3.76 -1.02 -5.06 115.29 109.79 2k5e s HIS 18 Ca -0.14 0.41 0.22 0.00 -0.15 0.00 0.00 55.06 55.40 2k5e s HIS 18 Cb 0.07 0.06 0.65 0.00 1.11 0.00 0.00 32.58 34.46 2k5e s HIS 18 CO 0.66 -0.16 1.71 -1.00 -0.85 0.00 0.00 174.74 175.09 2k5e h PRO 19 N 5.38 0.00 0.00 8.40 0.13 -1.86 -3.03 132.00 141.02 2k5e h PRO 19 Ca -0.27 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.85 2k5e h PRO 19 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2k5e h PRO 19 CO 0.38 0.26 -0.04 0.78 -0.23 0.00 0.00 178.00 179.15 2k5e h GLY 20 N 2.67 0.00 0.54 1.56 0.00 -1.95 -2.64 103.07 103.25 2k5e h GLY 20 Ca -0.00 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.43 2k5e h GLY 20 CO 0.03 0.00 0.64 -2.08 0.00 0.00 0.00 176.54 175.13 2k5e h VAL 21 N 0.00 0.96 -0.14 4.60 2.07 -1.85 -1.92 116.25 119.98 2k5e h VAL 21 Ca -0.00 -0.36 0.02 0.00 0.82 0.00 0.00 66.70 67.18 2k5e h VAL 21 Cb 0.12 -0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 29.70 2k5e h VAL 21 CO 0.01 0.19 0.00 0.00 0.02 0.00 0.00 177.57 177.79 2k5e h ALA 22 N 1.52 0.12 -0.84 1.67 0.00 -1.69 0.54 119.26 120.57 2k5e h ALA 22 Ca 0.48 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.44 2k5e h ALA 22 Cb 0.41 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 2k5e h ALA 22 CO -0.24 -0.45 0.56 0.78 0.00 0.00 0.00 179.25 179.90 2k5e h GLY 23 N 0.05 1.19 0.60 0.00 0.00 -1.52 -1.09 103.07 102.30 2k5e h GLY 23 Ca 0.06 -0.44 -0.00 0.00 0.00 0.00 0.00 47.33 46.95 2k5e h GLY 23 CO -0.11 0.43 -0.03 -2.08 0.00 0.00 0.00 176.54 174.74 2k5e h VAL 24 N 1.14 1.16 -0.49 4.60 2.07 -0.94 -1.88 116.25 121.91 2k5e h VAL 24 Ca 0.31 -0.87 0.05 0.00 0.82 0.00 0.00 66.70 67.01 2k5e h VAL 24 Cb -0.12 1.73 -0.05 0.00 -1.52 0.00 0.00 31.29 31.33 2k5e h VAL 24 CO -0.07 0.21 0.23 -0.07 0.02 0.00 0.00 177.57 177.90 2k5e h LEU 25 N -0.49 0.31 -1.39 2.57 3.38 -0.74 0.11 115.31 119.05 2k5e h LEU 25 Ca -0.01 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2k5e h LEU 25 Cb 0.43 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 2k5e h LEU 25 CO 0.02 0.22 0.22 0.03 0.09 0.00 0.00 178.44 179.02 2k5e h ARG 26 N 0.45 0.63 -0.16 1.13 3.08 -1.24 0.36 114.38 118.63 2k5e h ARG 26 Ca 0.22 -0.07 -0.12 0.00 0.07 0.00 0.00 59.98 60.08 2k5e h ARG 26 Cb 0.16 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 2k5e h ARG 26 CO -0.17 0.49 -0.43 1.03 -1.07 0.00 0.00 179.97 179.82 2k5e h SER 27 N 0.64 0.41 -0.80 7.04 0.87 -0.35 -3.10 113.55 118.26 2k5e h SER 27 Ca 0.16 -0.18 -0.44 0.00 -1.23 0.00 0.00 61.79 60.10 2k5e h SER 27 Cb 0.07 -0.12 -0.24 0.00 -0.44 0.00 0.00 62.40 61.67 2k5e h SER 27 CO -0.02 0.79 0.56 -1.22 -0.53 0.00 0.00 176.83 176.41 2k5e n TYR 28 N -4.01 2.48 -0.08 2.24 4.02 0.26 -4.89 117.16 117.18 2k5e n TYR 28 Ca -0.02 -1.77 0.00 0.00 -0.01 0.00 0.00 57.90 56.10 2k5e n TYR 28 Cb 0.51 -0.89 0.00 0.00 -0.02 0.00 0.00 39.34 38.94 2k5e n TYR 28 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2k5e n ASN 29 N -0.74 0.00 0.00 7.72 2.85 -0.98 -4.76 115.26 119.34 2k5e n ASN 29 Ca 0.48 0.00 0.09 0.00 -0.11 0.00 0.00 54.58 55.05 2k5e n ASN 29 Cb 1.29 -0.90 0.56 0.00 1.24 0.00 0.00 39.78 41.97 2k5e n ASN 29 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2k5e n LEU 30 N 0.00 0.00 0.06 1.20 4.77 0.12 -3.76 117.00 119.39 2k5e n LEU 30 Ca 0.00 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.03 2k5e n LEU 30 Cb 0.00 0.00 0.26 0.00 -2.33 0.00 0.00 43.42 41.35 2k5e n LEU 30 CO 0.00 0.00 0.66 0.61 -1.33 0.00 0.00 177.39 177.33 2k5e n GLY 31 N 0.70 -0.74 0.67 -0.72 0.00 -0.98 -1.64 105.19 102.48 2k5e n GLY 31 Ca 0.14 0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.29 2k5e n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k5e h ILE 33 N 2.22 0.89 -0.10 0.00 3.07 -1.63 -2.18 117.51 119.78 2k5e h ILE 33 Ca 0.00 -0.14 -0.01 0.00 1.55 0.00 0.00 64.86 66.26 2k5e h ILE 33 Cb 0.50 0.44 -0.00 0.00 -0.27 0.00 0.00 36.82 37.49 2k5e h ILE 33 CO 0.00 0.08 0.03 1.23 -1.05 0.00 0.00 178.15 178.44 2k5e h GLY 34 N 0.42 0.17 0.94 0.16 0.00 -1.86 0.36 103.07 103.26 2k5e h GLY 34 Ca 0.28 -0.10 0.02 0.00 0.00 0.00 0.00 47.33 47.53 2k5e h GLY 34 CO -0.08 0.10 0.51 0.00 0.00 0.00 0.00 176.54 177.07 2k5e n MET 36 N -4.57 0.43 -1.84 0.00 0.00 -0.91 -4.94 117.12 105.29 2k5e n MET 36 Ca 0.08 -0.12 -0.11 0.00 0.00 0.00 0.00 57.70 57.56 2k5e n MET 36 Cb 0.05 -1.50 -0.02 0.00 0.00 0.00 0.00 33.22 31.75 2k5e n MET 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2k5e n GLY 37 N 1.35 0.46 2.22 3.17 0.00 0.60 -4.91 105.19 108.08 2k5e n GLY 37 Ca 0.12 -0.47 -0.26 0.00 0.00 0.00 0.00 46.02 45.42 2k5e n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k5e n ALA 38 N -0.39 6.81 0.04 4.61 0.00 0.93 -4.37 120.51 128.14 2k5e n ALA 38 Ca -0.12 -2.78 -0.22 0.00 0.00 0.00 0.00 53.44 50.32 2k5e n ALA 38 Cb 0.50 -2.67 -0.14 0.00 0.00 0.00 0.00 19.45 17.14 2k5e n ALA 38 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2k5e h GLN 39 N 3.79 0.30 -0.00 0.00 1.08 -1.91 -3.35 115.11 115.02 2k5e h GLN 39 Ca 0.49 -0.52 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 2k5e h GLN 39 Cb 0.88 0.19 0.00 0.00 -0.05 0.00 0.00 27.48 28.51 2k5e h GLN 39 CO 0.94 1.25 -0.24 0.09 -0.95 0.00 0.00 178.83 179.92 2k5e n ASN 40 N -3.89 0.52 -4.77 1.46 3.02 -1.26 -1.41 115.26 108.93 2k5e n ASN 40 Ca -0.22 -0.38 -0.38 0.00 -0.03 0.00 0.00 54.58 53.56 2k5e n ASN 40 Cb 0.93 -0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 40.05 2k5e n ASN 40 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2k5e s GLU 41 N -2.71 4.51 0.51 3.52 2.12 -1.26 -4.76 118.70 120.63 2k5e s GLU 41 Ca 0.20 1.58 -0.19 0.00 0.36 0.00 0.00 54.97 56.92 2k5e s GLU 41 Cb 0.19 -2.93 -0.07 0.00 0.26 0.00 0.00 34.13 31.58 2k5e s GLU 41 CO 0.56 0.16 1.06 -1.12 -0.54 0.00 0.00 175.26 175.38 2k5e s SER 42 N -1.27 6.11 0.25 -1.70 0.01 -1.26 -1.68 113.70 114.16 2k5e s SER 42 Ca 0.49 1.98 -0.03 0.00 1.31 0.00 0.00 55.95 59.69 2k5e s SER 42 Cb -0.26 -2.56 0.48 0.00 0.21 0.00 0.00 66.02 63.89 2k5e s SER 42 CO 0.32 -0.94 1.74 -0.07 0.41 0.00 0.00 173.24 174.70 2k5e h LEU 43 N 1.32 0.37 -0.13 2.44 3.38 -0.87 -1.71 115.31 120.11 2k5e h LEU 43 Ca -0.49 0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.57 2k5e h LEU 43 Cb 1.23 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 2k5e h LEU 43 CO 0.58 0.15 0.06 -0.08 0.09 0.00 0.00 178.44 179.24 2k5e h GLU 44 N 0.51 0.18 -0.02 1.13 4.81 -1.67 -1.08 114.58 118.44 2k5e h GLU 44 Ca 0.43 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.66 2k5e h GLU 44 Cb 0.63 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.94 2k5e h GLU 44 CO -0.38 0.24 -0.20 1.96 -0.73 0.00 0.00 179.01 179.90 2k5e h GLN 45 N 0.08 -0.30 -0.68 1.92 4.20 -1.60 -1.35 115.11 117.38 2k5e h GLN 45 Ca 0.04 0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.73 2k5e h GLN 45 Cb 0.12 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.94 2k5e h GLN 45 CO -0.01 -0.20 0.26 0.78 -0.67 0.00 0.00 178.83 179.00 2k5e h GLY 46 N -0.31 1.08 0.86 3.46 0.00 -1.34 -1.12 103.07 105.69 2k5e h GLY 46 Ca 0.06 -0.57 -0.02 0.00 0.00 0.00 0.00 47.33 46.80 2k5e h GLY 46 CO -0.20 0.54 -0.31 0.00 0.00 0.00 0.00 176.54 176.57 2k5e h ALA 47 N 1.30 -0.78 0.00 3.60 0.00 -0.75 -2.11 119.26 120.52 2k5e h ALA 47 Ca 0.23 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2k5e h ALA 47 Cb 0.20 0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2k5e h ALA 47 CO -0.02 -0.96 -0.15 -0.91 0.00 0.00 0.00 179.25 177.22 2k5e h ASN 48 N -0.78 0.00 -0.41 0.00 2.35 -1.11 -0.43 115.58 115.20 2k5e h ASN 48 Ca -0.06 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.67 2k5e h ASN 48 Cb 0.64 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.98 2k5e h ASN 48 CO 0.06 0.15 0.21 0.00 -1.65 0.00 0.00 177.43 176.19 2k5e h ALA 49 N 1.85 1.51 -0.47 -0.83 0.00 -0.86 -2.59 119.26 117.86 2k5e h ALA 49 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2k5e h ALA 49 Cb 0.27 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2k5e h ALA 49 CO 0.02 0.39 0.00 0.72 0.00 0.00 0.00 179.25 180.38 2k5e n HIS 50 N -4.38 0.62 -1.97 0.00 8.25 -0.61 -4.96 115.22 112.17 2k5e n HIS 50 Ca 0.03 -0.31 0.00 0.00 -0.26 0.00 0.00 57.72 57.18 2k5e n HIS 50 Cb 0.13 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.24 2k5e n HIS 50 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2k5e n GLY 51 N 1.49 0.55 3.41 -1.41 0.00 -0.78 -5.07 105.19 103.38 2k5e n GLY 51 Ca 0.20 -0.81 -0.20 0.00 0.00 0.00 0.00 46.02 45.21 2k5e n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k5e s LEU 52 N -0.17 2.35 -0.17 0.99 1.43 -0.27 -4.99 118.68 117.85 2k5e s LEU 52 Ca 0.00 -1.24 -0.08 0.00 -1.03 0.00 0.00 54.13 51.78 2k5e s LEU 52 Cb 0.00 -0.49 -0.04 0.00 0.03 0.00 0.00 46.19 45.69 2k5e s LEU 52 CO 0.00 -0.45 0.10 0.21 0.23 0.00 0.00 176.35 176.44 2k5e s ASN 53 N -3.42 6.01 0.43 2.29 2.47 -1.26 -2.85 114.94 118.61 2k5e s ASN 53 Ca 0.31 0.23 0.11 0.00 0.42 0.00 0.00 52.86 53.92 2k5e s ASN 53 Cb 0.05 -2.01 0.94 0.00 -1.45 0.00 0.00 41.25 38.79 2k5e s ASN 53 CO 0.12 0.24 2.02 1.62 -3.72 0.00 0.00 177.10 177.38 2k5e h VAL 54 N 4.56 1.11 -0.31 -5.21 3.04 -1.88 -3.13 116.25 114.42 2k5e h VAL 54 Ca -0.43 -0.39 -0.01 0.00 -1.01 0.00 0.00 66.70 64.85 2k5e h VAL 54 Cb 1.17 0.95 -0.01 0.00 -2.01 0.00 0.00 31.29 31.39 2k5e h VAL 54 CO 0.69 0.13 0.14 -0.33 -1.01 0.00 0.00 177.57 177.20 2k5e h GLU 55 N 0.26 0.45 -0.84 4.17 5.08 -1.98 0.24 114.58 121.96 2k5e h GLU 55 Ca 0.06 -0.07 0.07 0.00 -1.00 0.00 0.00 59.36 58.42 2k5e h GLU 55 Cb 0.14 -0.08 -0.06 0.00 0.50 0.00 0.00 28.75 29.25 2k5e h GLU 55 CO 0.00 0.44 0.51 0.22 -1.00 0.00 0.00 179.01 179.18 2k5e h ASP 56 N 0.36 0.79 -0.03 1.42 3.58 -1.99 0.00 116.42 120.55 2k5e h ASP 56 Ca 0.10 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.57 2k5e h ASP 56 Cb 0.14 -0.14 -0.00 0.00 1.72 0.00 0.00 39.33 41.05 2k5e h ASP 56 CO -0.01 0.49 0.01 0.40 -2.88 0.00 0.00 179.24 177.25 2k5e h ILE 57 N 0.92 1.21 -0.91 2.25 2.04 -1.47 -3.04 117.51 118.51 2k5e h ILE 57 Ca 0.37 -0.62 0.09 0.00 1.00 0.00 0.00 64.86 65.70 2k5e h ILE 57 Cb 0.21 1.57 -0.06 0.00 -0.74 0.00 0.00 36.82 37.79 2k5e h ILE 57 CO -0.19 0.17 0.59 -0.07 0.00 0.00 0.00 178.15 178.65 2k5e h LEU 58 N -0.20 0.85 -0.44 1.44 3.38 -0.19 0.22 115.31 120.37 2k5e h LEU 58 Ca 0.01 0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.07 2k5e h LEU 58 Cb 0.26 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 2k5e h LEU 58 CO 0.00 0.51 0.07 -0.09 0.09 0.00 0.00 178.44 179.02 2k5e h ARG 59 N 0.95 0.19 -0.18 1.13 2.43 -0.90 0.18 114.38 118.17 2k5e h ARG 59 Ca 0.41 -0.01 -0.19 0.00 -0.81 0.00 0.00 59.98 59.38 2k5e h ARG 59 Cb 0.34 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 2k5e h ARG 59 CO -0.17 0.12 -0.65 0.22 -1.51 0.00 0.00 179.97 177.98 2k5e h ASP 60 N 0.19 0.78 0.17 -3.80 3.58 -1.21 -1.88 116.42 114.25 2k5e h ASP 60 Ca 0.22 -0.46 -0.01 0.00 0.42 0.00 0.00 57.03 57.19 2k5e h ASP 60 Cb 0.29 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.11 2k5e h ASP 60 CO -0.30 1.23 -0.08 -0.07 -2.88 0.00 0.00 179.24 177.14 2k5e h LEU 61 N 0.50 -0.19 -1.49 2.28 3.38 -0.54 -2.66 115.31 116.59 2k5e h LEU 61 Ca -0.02 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 2k5e h LEU 61 Cb 1.24 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 2k5e h LEU 61 CO 0.13 -0.03 -0.23 0.78 0.09 0.00 0.00 178.44 179.18 2k5e h ASN 62 N -0.34 0.00 0.02 -0.43 2.35 -0.74 -1.71 115.58 114.74 2k5e h ASN 62 Ca -0.02 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2k5e h ASN 62 Cb 0.26 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.63 2k5e h ASN 62 CO 0.04 0.23 -0.01 0.00 -1.65 0.00 0.00 177.43 176.04 2k5e h ALA 63 N 1.77 1.60 0.00 -0.83 0.00 -0.99 -0.22 119.26 120.58 2k5e h ALA 63 Ca -0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2k5e h ALA 63 Cb 0.55 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 2k5e h ALA 63 CO 0.03 0.01 -0.13 -0.07 0.00 0.00 0.00 179.25 179.09 2k5e h LEU 64 N 0.00 0.00 0.04 0.00 3.38 -1.06 0.11 115.31 117.79 2k5e h LEU 64 Ca -0.00 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.66 2k5e h LEU 64 Cb 0.02 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 2k5e h LEU 64 CO 0.00 0.13 -1.78 0.00 0.09 0.00 0.00 178.44 176.88 2k5e h ALA 65 N 1.87 0.66 0.14 1.53 0.00 -1.18 -3.39 119.26 118.89 2k5e h ALA 65 Ca -0.00 -1.43 -0.01 0.00 0.00 0.00 0.00 54.91 53.47 2k5e h ALA 65 Cb 0.50 0.54 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2k5e h ALA 65 CO 0.02 1.49 -0.07 -0.07 0.00 0.00 0.00 179.25 180.62 2k5e h LEU 66 N 0.02 -0.16 0.00 0.00 3.38 -1.07 -3.46 115.31 114.02 2k5e h LEU 66 Ca -0.32 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.29 2k5e h LEU 66 Cb 2.02 0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.81 2k5e h LEU 66 CO 0.08 0.33 0.00 -0.62 0.09 0.00 0.00 178.44 178.32 2k5e n GLU 67 N -4.95 0.00 -0.06 1.13 1.02 0.36 -4.75 120.64 113.39 2k5e n GLU 67 Ca -0.08 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 56.91 2k5e n GLU 67 Cb 0.26 -3.89 -0.06 0.00 -0.02 0.00 0.00 31.44 27.73 2k5e n GLU 67 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2k5e h HIS 68 N 0.00 0.76 -2.48 -0.32 3.86 -1.90 -3.39 115.15 111.67 2k5e h HIS 68 Ca 0.00 -0.26 -0.58 0.00 -1.16 0.00 0.00 60.37 58.36 2k5e h HIS 68 Cb 0.00 -0.14 -0.11 0.00 1.06 0.00 0.00 27.41 28.22 2k5e h HIS 68 CO 0.00 1.01 0.83 -1.01 0.86 0.00 0.00 177.93 179.62 2k5e s HIS 69 N -4.10 2.46 -0.28 2.45 3.76 -1.26 -4.91 115.29 113.40 2k5e s HIS 69 Ca -0.13 -0.28 -0.01 0.00 -0.15 0.00 0.00 55.06 54.49 2k5e s HIS 69 Cb 0.07 -4.48 0.18 0.00 1.11 0.00 0.00 32.58 29.46 2k5e s HIS 69 CO 0.82 -1.89 2.06 1.58 -0.85 0.00 0.00 174.74 176.47 2k5e n HIS 70 N 8.63 1.33 -1.58 1.40 -0.00 -1.26 -4.74 115.22 119.00 2k5e n HIS 70 Ca 0.00 -1.84 -0.18 0.00 0.46 0.00 0.00 57.72 56.16 2k5e n HIS 70 Cb 0.47 -0.92 -0.07 0.00 -0.12 0.00 0.00 29.99 29.35 2k5e n HIS 70 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2k5e n HIS 71 N 0.54 -0.05 0.23 1.57 8.25 -1.26 -4.87 115.22 119.63 2k5e n HIS 71 Ca 0.27 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.83 2k5e n HIS 71 Cb 0.57 -3.15 0.55 0.00 1.12 0.00 0.00 29.99 29.09 2k5e n HIS 71 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 2k5e h HIS 72 N 0.00 0.00 0.00 4.41 2.07 -1.97 -3.57 115.15 116.09 2k5e h HIS 72 Ca -0.38 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.14 2k5e h HIS 72 Cb 1.20 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.18 2k5e h HIS 72 CO 0.51 0.20 0.00 1.58 -3.07 0.00 0.00 177.93 177.16