#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4p n GLY 23 N 0.00 2.58 3.09 5.00 0.00 -1.26 -4.99 105.19 109.61 2k4p n GLY 23 Ca 0.00 0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 2k4p n GLY 23 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k4p s LEU 24 N 0.00 2.44 0.25 0.99 2.96 -1.26 -5.11 118.68 118.95 2k4p s LEU 24 Ca 0.00 -0.89 0.00 0.00 -0.22 0.00 0.00 54.13 53.02 2k4p s LEU 24 Cb 0.00 0.09 0.00 0.00 0.50 0.00 0.00 46.19 46.78 2k4p s LEU 24 CO 0.00 -0.49 0.00 0.61 -1.32 0.00 0.00 176.35 175.15 2k4p n GLY 25 N 0.42 -3.36 2.11 7.98 0.00 -1.26 -4.67 105.19 106.41 2k4p n GLY 25 Ca -0.16 -1.10 -0.23 0.00 0.00 0.00 0.00 46.02 44.53 2k4p n GLY 25 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2k4p n GLU 26 N -1.93 2.17 -1.23 1.61 0.28 -1.26 -4.94 120.64 115.34 2k4p n GLU 26 Ca 0.00 -2.70 0.00 0.00 -0.16 0.00 0.00 57.16 54.30 2k4p n GLU 26 Cb 0.20 -2.06 0.00 0.00 1.43 0.00 0.00 31.44 31.01 2k4p n GLU 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2k4p n ALA 27 N -0.90 0.00 -0.70 -1.84 0.00 -1.26 -4.89 120.51 110.92 2k4p n ALA 27 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.97 2k4p n ALA 27 Cb 1.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.84 2k4p n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k4p n GLY 28 N 0.00 0.61 0.00 0.00 0.00 -1.26 -4.61 105.19 99.92 2k4p n GLY 28 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2k4p n GLY 28 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2k4p n MET 29 N -2.70 0.00 0.00 1.61 0.00 -1.26 -3.29 117.12 111.48 2k4p n MET 29 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 2k4p n MET 29 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 2k4p n MET 29 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 2k4p n SER 30 N -0.21 0.00 -0.05 6.12 7.64 -1.26 -3.25 113.62 122.61 2k4p n SER 30 Ca 0.00 0.52 0.25 0.00 1.01 0.00 0.00 58.87 60.64 2k4p n SER 30 Cb 0.00 -0.25 0.72 0.00 -1.01 0.00 0.00 64.21 63.67 2k4p n SER 30 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k4p h ALA 31 N -2.00 2.52 -0.59 -0.43 0.00 -1.94 -0.21 119.26 116.61 2k4p h ALA 31 Ca 0.00 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.96 2k4p h ALA 31 Cb 0.00 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 2k4p h ALA 31 CO 0.00 -0.92 0.26 2.35 0.00 0.00 0.00 179.25 180.94 2k4p h TRP 32 N 0.00 0.47 0.00 0.00 7.01 -1.94 0.19 115.95 121.68 2k4p h TRP 32 Ca 0.32 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.35 2k4p h TRP 32 Cb 1.47 -0.12 0.00 0.00 -2.10 0.00 0.00 29.16 28.41 2k4p h TRP 32 CO 0.00 0.18 0.00 1.28 -2.79 0.00 0.00 178.44 177.11 2k4p n LEU 33 N -4.92 0.00 0.15 0.65 4.77 -0.10 -2.68 117.00 114.86 2k4p n LEU 33 Ca 0.07 0.38 0.02 0.00 -0.03 0.00 0.00 56.01 56.45 2k4p n LEU 33 Cb 0.21 -0.38 0.12 0.00 -2.33 0.00 0.00 43.42 41.05 2k4p n LEU 33 CO 0.25 -0.11 0.50 -0.09 -1.33 0.00 0.00 177.39 176.62 2k4p h ARG 34 N 0.00 0.00 0.00 3.23 9.65 -0.60 0.16 114.38 126.82 2k4p h ARG 34 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2k4p h ARG 34 Cb 0.27 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.85 2k4p h ARG 34 CO 0.00 0.53 0.00 0.00 2.80 0.00 0.00 179.97 183.30 2k4p h ALA 35 N 1.47 1.00 0.00 2.80 0.00 -1.45 -3.02 119.26 120.07 2k4p h ALA 35 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2k4p h ALA 35 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2k4p h ALA 35 CO 0.07 0.00 -0.15 0.44 0.00 0.00 0.00 179.25 179.60 2k4p n ILE 36 N -2.66 0.00 -2.67 0.00 -5.35 -1.16 -5.04 119.36 102.49 2k4p n ILE 36 Ca 0.01 -0.39 -0.07 0.00 -0.27 0.00 0.00 62.75 62.03 2k4p n ILE 36 Cb 0.24 0.91 0.03 0.00 -1.74 0.00 0.00 39.64 39.08 2k4p n ILE 36 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2k4p n GLY 37 N 1.17 0.21 1.54 3.28 0.00 0.34 -4.97 105.19 106.75 2k4p n GLY 37 Ca 0.00 -0.28 0.03 0.00 0.00 0.00 0.00 46.02 45.77 2k4p n GLY 37 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2k4p n LEU 38 N -2.21 1.53 0.29 0.99 7.94 -0.01 -4.83 117.00 120.69 2k4p n LEU 38 Ca -0.08 -2.58 0.19 0.00 -1.11 0.00 0.00 56.01 52.44 2k4p n LEU 38 Cb 0.55 -0.04 0.94 0.00 0.53 0.00 0.00 43.42 45.40 2k4p n LEU 38 CO 0.24 0.79 1.07 -0.33 -1.11 0.00 0.00 177.39 178.06 2k4p h GLU 39 N 1.26 0.00 -0.04 1.96 3.07 -1.89 -2.18 114.58 116.75 2k4p h GLU 39 Ca -0.15 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.72 2k4p h GLU 39 Cb 1.64 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.55 2k4p h GLU 39 CO 0.12 0.00 0.07 0.00 -1.40 0.00 0.00 179.01 177.80 2k4p h ARG 40 N 0.00 0.00 -0.02 2.33 3.08 -1.92 0.26 114.38 118.10 2k4p h ARG 40 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2k4p h ARG 40 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.25 2k4p h ARG 40 CO 0.00 0.00 -0.19 0.66 -1.07 0.00 0.00 179.97 179.37 2k4p n TYR 41 N -3.52 0.00 0.00 3.04 4.01 -0.82 -4.55 117.16 115.33 2k4p n TYR 41 Ca -0.02 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.69 2k4p n TYR 41 Cb 0.16 -0.02 -0.02 0.00 -0.31 0.00 0.00 39.34 39.15 2k4p n TYR 41 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 2k4p h GLU 42 N 3.11 -0.11 -0.22 -0.72 4.81 -0.59 -0.17 114.58 120.69 2k4p h GLU 42 Ca 0.00 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.30 2k4p h GLU 42 Cb 0.77 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 2k4p h GLU 42 CO 0.00 -0.07 0.24 1.49 -0.73 0.00 0.00 179.01 179.94 2k4p h GLU 43 N -0.12 0.00 -0.37 1.92 4.57 -1.80 0.88 114.58 119.66 2k4p h GLU 43 Ca 0.00 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.12 2k4p h GLU 43 Cb 0.13 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 2k4p h GLU 43 CO -0.07 0.00 -0.03 0.78 -1.18 0.00 0.00 179.01 178.51 2k4p h GLY 44 N 0.00 0.65 0.28 1.92 0.00 -1.31 -1.45 103.07 103.15 2k4p h GLY 44 Ca 0.10 -0.41 -0.10 0.00 0.00 0.00 0.00 47.33 46.92 2k4p h GLY 44 CO -0.00 0.38 -1.86 1.04 0.00 0.00 0.00 176.54 176.10 2k4p n LEU 45 N -4.24 0.24 0.08 3.11 4.77 -0.20 -4.25 117.00 116.51 2k4p n LEU 45 Ca 0.02 0.10 -0.06 0.00 -0.03 0.00 0.00 56.01 56.03 2k4p n LEU 45 Cb 0.28 0.11 0.08 0.00 -2.33 0.00 0.00 43.42 41.56 2k4p n LEU 45 CO 0.40 0.10 0.41 0.58 -1.33 0.00 0.00 177.39 177.55 2k4p h VAL 46 N 0.00 1.41 0.00 4.08 2.07 -0.80 0.26 116.25 123.27 2k4p h VAL 46 Ca -0.14 -2.15 0.00 0.00 0.82 0.00 0.00 66.70 65.23 2k4p h VAL 46 Cb 1.35 2.12 0.00 0.00 -1.52 0.00 0.00 31.29 33.24 2k4p h VAL 46 CO 0.01 0.63 0.00 1.57 0.02 0.00 0.00 177.57 179.81 2k4p n HIS 47 N -3.82 0.00 -0.05 1.57 -0.00 -0.56 -3.02 115.22 109.35 2k4p n HIS 47 Ca -0.03 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.66 2k4p n HIS 47 Cb 0.67 -0.29 -0.10 0.00 -0.00 0.00 0.00 29.99 30.26 2k4p n HIS 47 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.34 174.63 2k4p n ASN 48 N -1.29 1.86 0.00 0.26 5.15 -1.07 -5.02 115.26 115.15 2k4p n ASN 48 Ca 0.11 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.09 2k4p n ASN 48 Cb 0.19 1.00 0.00 0.00 -0.53 0.00 0.00 39.78 40.44 2k4p n ASN 48 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2k4p n GLY 49 N 2.10 0.84 0.00 8.20 0.00 -0.74 -5.04 105.19 110.55 2k4p n GLY 49 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2k4p n GLY 49 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2k4p n TRP 50 N 0.00 0.00 0.28 1.61 7.02 0.85 -4.68 117.44 122.51 2k4p n TRP 50 Ca 0.00 -0.21 0.18 0.00 -1.02 0.00 0.00 57.50 56.45 2k4p n TRP 50 Cb 0.00 -0.02 0.95 0.00 -2.42 0.00 0.00 31.31 29.82 2k4p n TRP 50 CO 0.00 0.00 0.00 0.22 -2.02 0.00 0.00 177.69 175.89 2k4p h ASP 51 N 0.00 0.00 -2.65 -0.99 1.82 -1.78 -3.38 116.42 109.44 2k4p h ASP 51 Ca 0.00 0.00 -0.59 0.00 -0.39 0.00 0.00 57.03 56.05 2k4p h ASP 51 Cb 0.29 0.00 -0.11 0.00 0.68 0.00 0.00 39.33 40.19 2k4p h ASP 51 CO 0.00 0.00 0.78 -1.81 -1.61 0.00 0.00 179.24 176.60 2k4p s ASP 52 N -5.47 6.21 0.53 2.28 1.01 -1.26 -4.54 116.67 115.42 2k4p s ASP 52 Ca -0.05 -0.61 0.30 0.00 0.71 0.00 0.00 52.55 52.90 2k4p s ASP 52 Cb 0.14 -2.49 1.45 0.00 1.01 0.00 0.00 42.92 43.03 2k4p s ASP 52 CO 0.47 -1.57 1.89 -0.07 0.21 0.00 0.00 175.17 176.10 2k4p h LEU 53 N 12.00 0.03 -0.19 1.23 3.38 -1.72 0.26 115.31 130.30 2k4p h LEU 53 Ca -0.28 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 2k4p h LEU 53 Cb 1.06 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 2k4p h LEU 53 CO 1.21 0.01 0.05 -0.33 0.09 0.00 0.00 178.44 179.47 2k4p h GLU 54 N 0.03 0.31 0.01 1.13 3.07 -1.89 -2.30 114.58 114.93 2k4p h GLU 54 Ca 0.42 -0.07 -0.26 0.00 -0.50 0.00 0.00 59.36 58.96 2k4p h GLU 54 Cb 1.65 -0.04 0.02 0.00 -0.84 0.00 0.00 28.75 29.54 2k4p h GLU 54 CO -0.02 0.43 -1.01 0.35 -1.40 0.00 0.00 179.01 177.36 2k4p h PHE 55 N 0.13 1.00 -0.03 4.33 3.04 -1.33 -3.15 116.94 120.93 2k4p h PHE 55 Ca 0.06 -0.55 0.01 0.00 3.98 0.00 0.00 57.97 61.47 2k4p h PHE 55 Cb 0.26 -0.11 -0.00 0.00 2.56 0.00 0.00 35.95 38.65 2k4p h PHE 55 CO 0.01 1.39 0.09 1.25 -2.02 0.00 0.00 178.31 179.03 2k4p h LEU 56 N 0.34 0.00 -0.75 0.59 6.46 -0.59 0.80 115.31 122.15 2k4p h LEU 56 Ca -0.13 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.63 2k4p h LEU 56 Cb 1.67 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.60 2k4p h LEU 56 CO 0.20 0.00 0.00 -1.20 -0.62 0.00 0.00 178.44 176.82 2k4p n SER 57 N -3.29 0.53 -0.35 1.25 7.64 -0.87 -1.58 113.62 116.95 2k4p n SER 57 Ca -0.02 0.66 0.06 0.00 1.01 0.00 0.00 58.87 60.57 2k4p n SER 57 Cb 0.17 -0.76 0.02 0.00 -1.01 0.00 0.00 64.21 62.63 2k4p n SER 57 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2k4p n ASP 58 N -2.12 1.61 -4.62 6.43 -0.08 0.27 -5.03 116.55 113.02 2k4p n ASP 58 Ca 0.01 -1.31 -0.44 0.00 -1.51 0.00 0.00 54.79 51.55 2k4p n ASP 58 Cb 0.17 0.24 -0.01 0.00 2.34 0.00 0.00 41.12 43.85 2k4p n ASP 58 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2k4p n ILE 59 N 0.20 1.97 -2.07 5.18 3.06 -0.61 -4.99 119.36 122.10 2k4p n ILE 59 Ca 0.06 -0.49 -0.08 0.00 -2.50 0.00 0.00 62.75 59.74 2k4p n ILE 59 Cb 0.26 -1.14 0.04 0.00 0.54 0.00 0.00 39.64 39.35 2k4p n ILE 59 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 2k4p n THR 60 N 0.28 0.00 0.09 9.51 -2.24 -1.26 -4.99 114.28 115.66 2k4p n THR 60 Ca 0.08 -0.44 -0.12 0.00 -2.27 0.00 0.00 64.05 61.30 2k4p n THR 60 Cb 0.33 -1.39 -0.11 0.00 -2.10 0.00 0.00 70.33 67.05 2k4p n THR 60 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2k4p h GLU 61 N 0.00 0.18 0.00 -0.78 5.08 -1.96 -3.28 114.58 113.82 2k4p h GLU 61 Ca -0.11 -0.29 -0.19 0.00 -1.00 0.00 0.00 59.36 57.76 2k4p h GLU 61 Cb 0.38 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 2k4p h GLU 61 CO 0.11 1.11 -0.96 0.93 -1.00 0.00 0.00 179.01 179.20 2k4p h GLU 62 N 0.06 0.00 0.00 2.33 5.08 -1.97 -3.25 114.58 116.83 2k4p h GLU 62 Ca -0.08 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2k4p h GLU 62 Cb 1.83 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.08 2k4p h GLU 62 CO 0.17 0.87 -0.05 -0.44 -1.00 0.00 0.00 179.01 178.55 2k4p h ASP 63 N 0.00 0.00 -0.37 1.42 3.32 -1.95 -1.81 116.42 117.03 2k4p h ASP 63 Ca -0.03 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.95 2k4p h ASP 63 Cb 1.71 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.24 2k4p h ASP 63 CO 0.11 0.05 0.00 -0.07 -1.72 0.00 0.00 179.24 177.62 2k4p h LEU 64 N 0.00 0.72 -0.89 1.55 3.38 -1.63 -2.66 115.31 115.78 2k4p h LEU 64 Ca -0.00 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 57.70 2k4p h LEU 64 Cb 0.10 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2k4p h LEU 64 CO 0.01 0.78 -0.26 -0.08 0.09 0.00 0.00 178.44 178.98 2k4p h GLU 65 N 0.70 0.52 -0.04 1.13 4.81 -1.25 0.26 114.58 120.72 2k4p h GLU 65 Ca 0.14 -0.20 0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2k4p h GLU 65 Cb 0.43 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.78 2k4p h GLU 65 CO 0.02 0.74 0.08 0.93 -0.73 0.00 0.00 179.01 180.05 2k4p h GLU 66 N 0.46 0.00 -0.02 1.92 4.39 -1.36 0.25 114.58 120.22 2k4p h GLU 66 Ca 0.07 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.77 2k4p h GLU 66 Cb 0.69 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 2k4p h GLU 66 CO 0.05 0.00 -0.23 0.00 -1.16 0.00 0.00 179.01 177.67 2k4p n ALA 67 N -2.17 3.00 0.00 3.43 0.00 -0.95 -4.93 120.51 118.89 2k4p n ALA 67 Ca -0.02 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.76 2k4p n ALA 67 Cb 0.17 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2k4p n ALA 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k4p n GLY 68 N 1.38 0.71 2.64 0.00 0.00 0.88 -4.40 105.19 106.40 2k4p n GLY 68 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2k4p n GLY 68 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2k4p n VAL 69 N -1.22 4.94 -0.77 1.61 0.31 0.88 -4.69 118.33 119.39 2k4p n VAL 69 Ca 0.00 -4.44 -0.19 0.00 -0.01 0.00 0.00 64.34 59.69 2k4p n VAL 69 Cb 0.00 -2.17 0.14 0.00 -0.91 0.00 0.00 33.84 30.90 2k4p n VAL 69 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k4p n GLN 70 N 2.45 2.00 -4.12 5.55 10.64 -1.26 -3.05 117.38 129.58 2k4p n GLN 70 Ca 0.52 -2.38 -0.29 0.00 -1.83 0.00 0.00 57.00 53.03 2k4p n GLN 70 Cb 0.29 -1.93 -0.07 0.00 -0.86 0.00 0.00 30.24 27.67 2k4p n GLN 70 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2k4p s ASP 71 N -0.82 5.13 -0.02 2.61 1.11 -1.26 -5.03 116.67 118.39 2k4p s ASP 71 Ca 0.45 -0.19 -0.25 0.00 0.18 0.00 0.00 52.55 52.74 2k4p s ASP 71 Cb 0.38 -1.24 -0.20 0.00 1.07 0.00 0.00 42.92 42.93 2k4p s ASP 71 CO 0.08 0.14 1.27 1.55 1.18 0.00 0.00 175.17 179.39 2k4p h PRO 72 N 3.11 0.03 0.00 8.23 0.13 -1.98 0.11 132.00 141.63 2k4p h PRO 72 Ca -0.47 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 64.61 2k4p h PRO 72 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 2k4p h PRO 72 CO 0.61 0.51 -0.14 0.00 -0.23 0.00 0.00 178.00 178.75 2k4p h ALA 73 N 0.52 1.07 0.07 -0.56 0.00 -1.98 -1.55 119.26 116.82 2k4p h ALA 73 Ca 0.00 -0.13 -0.30 0.00 0.00 0.00 0.00 54.91 54.48 2k4p h ALA 73 Cb 0.51 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2k4p h ALA 73 CO 0.00 0.18 -1.60 0.45 0.00 0.00 0.00 179.25 178.28 2k4p h HIS 74 N 0.00 0.27 -0.07 0.00 3.86 -1.93 -3.02 115.15 114.27 2k4p h HIS 74 Ca -0.00 -0.20 -0.20 0.00 -1.16 0.00 0.00 60.37 58.81 2k4p h HIS 74 Cb 0.58 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 29.04 2k4p h HIS 74 CO 0.00 1.28 -0.79 0.87 0.86 0.00 0.00 177.93 180.15 2k4p h LYS 75 N 0.04 0.45 0.00 2.45 1.57 -0.59 -2.98 116.57 117.52 2k4p h LYS 75 Ca -0.26 -0.40 0.00 0.00 -1.87 0.00 0.00 60.65 58.12 2k4p h LYS 75 Cb 1.99 0.09 0.00 0.00 0.08 0.00 0.00 32.23 34.39 2k4p h LYS 75 CO 0.12 1.04 0.00 0.07 -0.57 0.00 0.00 179.45 180.11 2k4p h ARG 76 N 0.30 0.00 0.07 3.15 0.11 -1.42 -3.25 114.38 113.33 2k4p h ARG 76 Ca -0.05 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.03 2k4p h ARG 76 Cb 1.39 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.47 2k4p h ARG 76 CO 0.14 0.00 -0.03 1.25 0.10 0.00 0.00 179.97 181.43 2k4p h LEU 77 N 0.00 -0.08 -0.30 0.08 7.12 -1.44 -3.11 115.31 117.58 2k4p h LEU 77 Ca 0.00 -0.54 0.06 0.00 0.13 0.00 0.00 57.88 57.53 2k4p h LEU 77 Cb 0.90 0.02 -0.06 0.00 -0.53 0.00 0.00 40.66 40.98 2k4p h LEU 77 CO 0.00 0.58 -0.12 -0.07 -0.13 0.00 0.00 178.44 178.69 2k4p h LEU 78 N -0.82 -0.42 -1.12 2.25 3.38 -1.62 0.19 115.31 117.16 2k4p h LEU 78 Ca -0.01 0.11 0.19 0.00 0.09 0.00 0.00 57.88 58.25 2k4p h LEU 78 Cb 0.62 0.24 -0.10 0.00 0.09 0.00 0.00 40.66 41.51 2k4p h LEU 78 CO 0.02 -0.16 0.61 -0.07 0.09 0.00 0.00 178.44 178.93 2k4p h LEU 79 N -0.07 0.72 -0.22 1.67 3.38 -1.67 0.97 115.31 120.08 2k4p h LEU 79 Ca 0.15 0.08 -0.21 0.00 0.09 0.00 0.00 57.88 57.99 2k4p h LEU 79 Cb 0.30 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 2k4p h LEU 79 CO -0.35 0.28 -0.90 -0.78 0.09 0.00 0.00 178.44 176.77 2k4p h ASP 80 N 0.71 0.45 0.90 -0.43 1.82 -1.07 -3.11 116.42 115.68 2k4p h ASP 80 Ca 0.55 -0.36 -0.00 0.00 -0.39 0.00 0.00 57.03 56.83 2k4p h ASP 80 Cb 0.92 -0.14 -0.00 0.00 0.68 0.00 0.00 39.33 40.79 2k4p h ASP 80 CO -0.32 1.15 -0.02 0.74 -1.61 0.00 0.00 179.24 179.18 2k4p h THR 81 N 0.20 0.06 0.56 2.25 2.02 0.16 -2.82 112.91 115.35 2k4p h THR 81 Ca -0.07 -0.51 -0.03 0.00 0.77 0.00 0.00 66.41 66.57 2k4p h THR 81 Cb 1.53 1.48 0.01 0.00 -1.74 0.00 0.00 68.15 69.43 2k4p h THR 81 CO 0.15 0.02 -0.27 -0.07 0.37 0.00 0.00 175.52 175.72 2k4p h LEU 82 N 0.00 -0.64 -2.35 2.58 3.38 -0.98 -2.30 115.31 115.01 2k4p h LEU 82 Ca -0.00 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2k4p h LEU 82 Cb 0.48 0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 2k4p h LEU 82 CO 0.00 -0.24 -0.03 1.56 0.09 0.00 0.00 178.44 179.83 2k4p h GLN 83 N -1.18 0.00 0.00 1.13 4.20 -1.63 -3.19 115.11 114.43 2k4p h GLN 83 Ca -0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.63 2k4p h GLN 83 Cb 0.59 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.37 2k4p h GLN 83 CO 0.13 0.03 0.00 1.28 -0.67 0.00 0.00 178.83 179.59 2k4p n LEU 84 N -3.81 0.22 -3.10 1.46 4.77 -1.07 -4.90 117.00 110.58 2k4p n LEU 84 Ca -0.03 0.69 -0.21 0.00 -0.03 0.00 0.00 56.01 56.43 2k4p n LEU 84 Cb 0.12 -0.42 0.01 0.00 -2.33 0.00 0.00 43.42 40.80 2k4p n LEU 84 CO 0.28 -0.42 -0.05 -1.20 -1.33 0.00 0.00 177.39 174.68 2k4p n SER 85 N -1.75 -4.57 0.00 -1.43 7.64 -0.87 -5.11 113.62 107.53 2k4p n SER 85 Ca 0.00 -0.27 0.00 0.00 1.01 0.00 0.00 58.87 59.61 2k4p n SER 85 Cb 0.00 -3.76 0.00 0.00 -1.01 0.00 0.00 64.21 59.44 2k4p n SER 85 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32