#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4p h GLY 23 N 0.00 0.28 -2.03 0.23 0.00 -2.08 -3.50 103.07 95.99 2k4p h GLY 23 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 47.33 46.61 2k4p h GLY 23 CO 0.00 0.64 0.08 0.48 0.00 0.00 0.00 176.54 177.74 2k4p s LEU 24 N -7.52 0.02 0.00 3.11 -0.00 -1.26 -4.99 118.68 108.04 2k4p s LEU 24 Ca -0.20 -0.80 0.00 0.00 -0.00 0.00 0.00 54.13 53.13 2k4p s LEU 24 Cb 0.05 2.32 0.00 0.00 -0.00 0.00 0.00 46.19 48.56 2k4p s LEU 24 CO 0.77 -1.29 0.00 0.61 -0.00 0.00 0.00 176.35 176.44 2k4p n GLY 25 N -0.44 1.67 3.61 -3.48 0.00 -1.26 -4.86 105.19 100.43 2k4p n GLY 25 Ca -0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.72 2k4p n GLY 25 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2k4p n GLU 26 N 0.00 -1.97 -3.10 1.61 2.13 -1.26 -4.97 120.64 113.08 2k4p n GLU 26 Ca 0.00 0.55 -0.18 0.00 0.66 0.00 0.00 57.16 58.19 2k4p n GLU 26 Cb 0.00 -4.60 -0.04 0.00 0.27 0.00 0.00 31.44 27.06 2k4p n GLU 26 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2k4p n ALA 27 N -4.02 1.04 -1.00 4.31 0.00 -1.26 -5.02 120.51 114.55 2k4p n ALA 27 Ca -0.12 -2.47 0.00 0.00 0.00 0.00 0.00 53.44 50.85 2k4p n ALA 27 Cb 0.61 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 19.04 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 2.26 -1.58 0.18 0.00 0.00 -1.26 -4.08 105.19 100.71 2k4p n GLY 28 Ca 0.21 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.37 2k4p n GLY 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k4p h MET 29 N 0.00 0.00 0.00 1.61 -0.00 -1.94 -3.27 114.93 111.34 2k4p h MET 29 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2k4p h MET 29 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.60 2k4p h MET 29 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.91 177.34 2k4p n SER 30 N -2.64 0.00 0.30 -0.10 7.64 -1.26 -0.74 113.62 116.82 2k4p n SER 30 Ca 0.03 0.64 0.19 0.00 1.01 0.00 0.00 58.87 60.74 2k4p n SER 30 Cb 0.36 -0.14 1.01 0.00 -1.01 0.00 0.00 64.21 64.43 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 -1.89 1.35 -0.39 -0.43 0.00 -1.71 -1.57 119.26 114.62 2k4p h ALA 31 Ca 0.00 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2k4p h ALA 31 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2k4p h ALA 31 CO 0.00 -0.13 0.06 2.35 0.00 0.00 0.00 179.25 181.53 2k4p h TRP 32 N 0.00 0.70 0.00 0.00 7.01 -1.48 -2.37 115.95 119.82 2k4p h TRP 32 Ca 0.02 -0.10 0.00 0.00 2.11 0.00 0.00 58.89 60.92 2k4p h TRP 32 Cb 0.23 -0.19 0.00 0.00 -2.10 0.00 0.00 29.16 27.10 2k4p h TRP 32 CO 0.00 0.70 0.00 1.28 -2.79 0.00 0.00 178.44 177.63 2k4p n LEU 33 N -4.52 0.00 0.14 0.65 4.77 0.08 -2.88 117.00 115.24 2k4p n LEU 33 Ca -0.01 0.43 0.02 0.00 -0.03 0.00 0.00 56.01 56.42 2k4p n LEU 33 Cb 0.24 -0.43 0.05 0.00 -2.33 0.00 0.00 43.42 40.96 2k4p n LEU 33 CO 0.39 -0.07 0.48 0.03 -1.33 0.00 0.00 177.39 176.89 2k4p h ARG 34 N 0.00 0.00 0.00 3.23 -0.00 -1.25 0.22 114.38 116.59 2k4p h ARG 34 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 2k4p h ARG 34 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.33 2k4p h ARG 34 CO 0.00 0.52 0.00 0.00 0.00 0.00 0.00 179.97 180.49 2k4p n ALA 35 N -2.24 1.76 -0.20 0.04 0.00 -1.14 -2.86 120.51 115.87 2k4p n ALA 35 Ca 0.02 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2k4p n ALA 35 Cb 0.72 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.81 2k4p n ALA 35 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2k4p n ILE 36 N -2.01 0.00 -3.06 0.00 -5.35 -1.18 -5.03 119.36 102.73 2k4p n ILE 36 Ca 0.03 -0.36 -0.13 0.00 -0.27 0.00 0.00 62.75 62.02 2k4p n ILE 36 Cb 0.24 1.20 0.07 0.00 -1.74 0.00 0.00 39.64 39.40 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 0.20 -0.14 1.12 3.28 0.00 -0.35 -4.95 105.19 104.35 2k4p n GLY 37 Ca 0.00 -0.05 0.03 0.00 0.00 0.00 0.00 46.02 46.00 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 -3.32 0.87 0.24 0.99 7.94 0.64 -4.83 117.00 119.53 2k4p n LEU 38 Ca -0.20 -1.88 0.16 0.00 -1.11 0.00 0.00 56.01 52.99 2k4p n LEU 38 Cb 0.62 -0.05 0.67 0.00 0.53 0.00 0.00 43.42 45.19 2k4p n LEU 38 CO 0.45 0.50 0.97 1.05 -1.11 0.00 0.00 177.39 179.24 2k4p h GLU 39 N 0.69 0.00 0.00 1.96 9.09 -1.86 -2.71 114.58 121.74 2k4p h GLU 39 Ca -0.14 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.27 2k4p h GLU 39 Cb 1.67 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.77 2k4p h GLU 39 CO 0.06 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.12 2k4p h ARG 40 N 0.00 0.00 -0.06 1.06 3.08 -1.91 0.25 114.38 116.80 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 0.42 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.47 2k4p h ARG 40 CO 0.00 0.00 0.00 0.66 -1.07 0.00 0.00 179.97 179.56 2k4p n TYR 41 N -3.07 0.05 -0.01 3.04 4.01 -1.02 -4.54 117.16 115.62 2k4p n TYR 41 Ca -0.03 -0.03 -0.01 0.00 -0.16 0.00 0.00 57.90 57.67 2k4p n TYR 41 Cb 0.07 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.09 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 3.57 -0.04 -0.35 -0.72 4.81 -0.65 0.13 114.58 121.32 2k4p h GLU 42 Ca 0.00 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.34 2k4p h GLU 42 Cb 0.76 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 2k4p h GLU 42 CO 0.00 -0.03 0.41 1.49 -0.73 0.00 0.00 179.01 180.16 2k4p h GLU 43 N -0.05 0.00 -0.36 1.92 4.22 -1.80 0.29 114.58 118.81 2k4p h GLU 43 Ca 0.00 0.00 -0.07 0.00 0.08 0.00 0.00 59.36 59.38 2k4p h GLU 43 Cb 0.06 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 2k4p h GLU 43 CO -0.05 0.00 -0.05 0.78 -2.18 0.00 0.00 179.01 177.51 2k4p h GLY 44 N 0.00 0.64 0.00 1.92 0.00 -1.01 -2.19 103.07 102.43 2k4p h GLY 44 Ca 0.17 -0.42 -0.16 0.00 0.00 0.00 0.00 47.33 46.92 2k4p h GLY 44 CO -0.00 0.39 -2.14 1.04 0.00 0.00 0.00 176.54 175.83 2k4p n LEU 45 N -4.23 0.00 0.15 3.11 4.32 0.27 -4.29 117.00 116.33 2k4p n LEU 45 Ca 0.01 0.00 0.01 0.00 -0.02 0.00 0.00 56.01 56.01 2k4p n LEU 45 Cb 0.29 0.22 0.29 0.00 -1.62 0.00 0.00 43.42 42.60 2k4p n LEU 45 CO 0.40 0.22 0.66 0.58 -1.22 0.00 0.00 177.39 178.03 2k4p h VAL 46 N 0.00 1.31 -0.42 4.08 2.07 -0.51 0.85 116.25 123.63 2k4p h VAL 46 Ca -0.24 -1.50 0.00 0.00 0.82 0.00 0.00 66.70 65.78 2k4p h VAL 46 Cb 1.53 1.78 0.00 0.00 -1.52 0.00 0.00 31.29 33.08 2k4p h VAL 46 CO 0.01 0.43 0.00 1.57 0.02 0.00 0.00 177.57 179.61 2k4p n HIS 47 N -4.02 0.97 0.00 1.57 -0.00 -0.83 -4.00 115.22 108.91 2k4p n HIS 47 Ca -0.02 -0.38 0.00 0.00 0.46 0.00 0.00 57.72 57.78 2k4p n HIS 47 Cb 0.46 -0.18 0.00 0.00 -0.12 0.00 0.00 29.99 30.15 2k4p n HIS 47 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89 2k4p n ASN 48 N 0.64 3.92 0.00 0.26 4.13 -0.91 -5.04 115.26 118.26 2k4p n ASN 48 Ca 0.17 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.43 2k4p n ASN 48 Cb 0.62 0.25 0.00 0.00 -1.54 0.00 0.00 39.78 39.11 2k4p n ASN 48 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2k4p n GLY 49 N 2.87 0.28 0.00 7.41 0.00 -0.62 -5.04 105.19 110.09 2k4p n GLY 49 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.02 1.61 7.02 0.19 -4.79 117.44 121.50 2k4p n TRP 50 Ca 0.00 -0.24 0.22 0.00 -1.02 0.00 0.00 57.50 56.47 2k4p n TRP 50 Cb 0.00 -0.02 0.72 0.00 -2.42 0.00 0.00 31.31 29.59 2k4p n TRP 50 CO 0.00 0.00 0.00 0.38 -2.02 0.00 0.00 177.69 176.05 2k4p h ASP 51 N 0.00 0.00 -3.56 -0.99 3.04 -1.76 -3.36 116.42 109.79 2k4p h ASP 51 Ca 0.00 0.00 -0.68 0.00 -3.24 0.00 0.00 57.03 53.11 2k4p h ASP 51 Cb 0.76 0.00 -0.18 0.00 -1.04 0.00 0.00 39.33 38.87 2k4p h ASP 51 CO 0.00 0.00 -0.15 -0.62 -2.04 0.00 0.00 179.24 176.43 2k4p s ASP 52 N -5.24 6.22 0.59 4.15 -1.08 -1.26 -4.56 116.67 115.48 2k4p s ASP 52 Ca -0.04 -0.53 0.28 0.00 -0.52 0.00 0.00 52.55 51.74 2k4p s ASP 52 Cb 0.16 -2.24 1.56 0.00 -1.46 0.00 0.00 42.92 40.95 2k4p s ASP 52 CO 0.58 -0.58 2.01 0.25 0.52 0.00 0.00 175.17 177.94 2k4p h LEU 53 N 9.14 0.00 -2.25 -1.34 6.46 -1.93 0.23 115.31 125.62 2k4p h LEU 53 Ca -0.27 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.48 2k4p h LEU 53 Cb 1.11 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.04 2k4p h LEU 53 CO 0.80 0.00 -0.05 -0.33 -0.62 0.00 0.00 178.44 178.24 2k4p h GLU 54 N 0.00 0.00 0.00 1.25 5.08 -1.91 -1.67 114.58 117.32 2k4p h GLU 54 Ca 0.15 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.36 2k4p h GLU 54 Cb 0.81 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 2k4p h GLU 54 CO -0.00 0.05 -1.36 1.19 -1.00 0.00 0.00 179.01 177.89 2k4p n PHE 55 N -3.56 0.98 0.15 4.33 3.01 0.81 -3.96 117.46 119.22 2k4p n PHE 55 Ca -0.02 0.32 0.15 0.00 1.01 0.00 0.00 57.45 58.91 2k4p n PHE 55 Cb 0.17 -1.07 0.72 0.00 -0.01 0.00 0.00 39.48 39.29 2k4p n PHE 55 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 2k4p h LEU 56 N 0.00 0.00 -0.00 4.37 -0.00 -1.21 0.25 115.31 118.71 2k4p h LEU 56 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.74 2k4p h LEU 56 Cb 1.50 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.16 2k4p h LEU 56 CO 0.04 0.00 0.00 -1.54 -0.00 0.00 0.00 178.44 176.94 2k4p n SER 57 N -4.25 0.00 -0.59 -0.43 3.41 -1.23 -2.00 113.62 108.52 2k4p n SER 57 Ca 0.03 0.50 0.06 0.00 -0.26 0.00 0.00 58.87 59.20 2k4p n SER 57 Cb 0.35 -0.50 0.19 0.00 -0.26 0.00 0.00 64.21 63.99 2k4p n SER 57 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2k4p n ASP 58 N -1.50 2.54 -4.84 4.04 2.03 0.86 -5.02 116.55 114.66 2k4p n ASP 58 Ca 0.03 -3.41 -0.38 0.00 0.52 0.00 0.00 54.79 51.55 2k4p n ASP 58 Cb 0.16 -0.52 -0.06 0.00 -0.72 0.00 0.00 41.12 39.98 2k4p n ASP 58 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2k4p s ILE 59 N -3.03 5.12 0.21 5.18 2.07 -0.85 -5.10 121.20 124.81 2k4p s ILE 59 Ca 0.38 0.72 0.00 0.00 -1.41 0.00 0.00 60.65 60.34 2k4p s ILE 59 Cb 0.34 -3.65 0.04 0.00 0.13 0.00 0.00 42.46 39.32 2k4p s ILE 59 CO 0.01 0.58 0.29 0.35 -1.91 0.00 0.00 174.94 174.27 2k4p n THR 60 N 1.88 0.00 0.09 4.00 -2.24 -1.26 -5.00 114.28 111.74 2k4p n THR 60 Ca -0.15 -0.48 -0.12 0.00 -2.27 0.00 0.00 64.05 61.03 2k4p n THR 60 Cb 0.53 -1.19 -0.08 0.00 -2.10 0.00 0.00 70.33 67.48 2k4p n THR 60 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2k4p h GLU 61 N 0.00 0.23 0.00 -0.78 4.81 -1.99 -3.27 114.58 113.58 2k4p h GLU 61 Ca -0.10 -0.32 -0.19 0.00 -0.13 0.00 0.00 59.36 58.63 2k4p h GLU 61 Cb 0.37 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.83 2k4p h GLU 61 CO 0.11 1.09 -1.02 0.93 -0.73 0.00 0.00 179.01 179.39 2k4p h GLU 62 N 0.10 0.00 0.00 1.92 4.39 -1.96 -3.28 114.58 115.74 2k4p h GLU 62 Ca -0.08 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.61 2k4p h GLU 62 Cb 1.74 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 30.39 2k4p h GLU 62 CO 0.17 0.67 -0.04 -0.44 -1.16 0.00 0.00 179.01 178.21 2k4p h ASP 63 N 0.00 0.00 -0.44 1.42 3.32 -1.95 -1.75 116.42 117.03 2k4p h ASP 63 Ca -0.07 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.93 2k4p h ASP 63 Cb 1.67 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.19 2k4p h ASP 63 CO 0.09 0.04 0.10 -0.07 -1.72 0.00 0.00 179.24 177.68 2k4p h LEU 64 N 0.00 0.73 -1.04 1.55 3.38 -1.63 -2.45 115.31 115.86 2k4p h LEU 64 Ca -0.00 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.75 2k4p h LEU 64 Cb 0.07 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2k4p h LEU 64 CO 0.01 0.73 -0.24 -0.08 0.09 0.00 0.00 178.44 178.95 2k4p h GLU 65 N 0.75 0.40 -0.22 1.13 4.22 -1.14 0.21 114.58 119.93 2k4p h GLU 65 Ca 0.16 -0.14 0.06 0.00 0.08 0.00 0.00 59.36 59.53 2k4p h GLU 65 Cb 0.31 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 2k4p h GLU 65 CO 0.00 0.62 0.18 0.93 -2.18 0.00 0.00 179.01 178.55 2k4p h GLU 66 N 0.36 0.00 -0.02 1.92 5.08 -1.38 0.26 114.58 120.80 2k4p h GLU 66 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2k4p h GLU 66 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2k4p h GLU 66 CO 0.04 0.00 -0.13 0.00 -1.00 0.00 0.00 179.01 177.92 2k4p n ALA 67 N -2.51 2.82 0.00 3.43 0.00 -0.97 -4.91 120.51 118.36 2k4p n ALA 67 Ca 0.02 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.93 2k4p n ALA 67 Cb 0.32 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.76 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 1.30 0.81 2.50 0.00 0.00 0.90 -4.19 105.19 106.51 2k4p n GLY 68 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.92 4.14 -0.77 1.61 0.31 0.71 -4.63 118.33 118.78 2k4p n VAL 69 Ca 0.00 -3.02 -0.19 0.00 -0.01 0.00 0.00 64.34 61.11 2k4p n VAL 69 Cb 0.00 -2.54 0.14 0.00 -0.91 0.00 0.00 33.84 30.53 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 4.23 2.00 -4.17 5.55 -0.00 -1.26 -2.80 117.38 120.92 2k4p n GLN 70 Ca 0.66 -2.38 -0.29 0.00 -0.00 0.00 0.00 57.00 54.98 2k4p n GLN 70 Cb 0.29 -1.93 -0.08 0.00 -0.00 0.00 0.00 30.24 28.51 2k4p n GLN 70 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2k4p s ASP 71 N -0.82 4.78 -0.01 2.61 1.11 -1.26 -5.03 116.67 118.04 2k4p s ASP 71 Ca 0.45 -0.29 -0.25 0.00 0.18 0.00 0.00 52.55 52.64 2k4p s ASP 71 Cb 0.38 -1.05 -0.19 0.00 1.07 0.00 0.00 42.92 43.13 2k4p s ASP 71 CO 0.08 0.15 1.28 1.55 1.18 0.00 0.00 175.17 179.41 2k4p h PRO 72 N 3.28 0.05 0.00 8.23 0.13 -1.98 0.17 132.00 141.88 2k4p h PRO 72 Ca -0.48 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.59 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 0.57 0.53 -0.14 0.00 -0.23 0.00 0.00 178.00 178.72 2k4p h ALA 73 N 0.53 1.08 0.08 -0.56 0.00 -1.98 -0.72 119.26 117.69 2k4p h ALA 73 Ca 0.00 -0.13 -0.31 0.00 0.00 0.00 0.00 54.91 54.47 2k4p h ALA 73 Cb 0.52 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2k4p h ALA 73 CO 0.01 0.18 -1.68 0.45 0.00 0.00 0.00 179.25 178.21 2k4p h HIS 74 N 0.00 0.31 -0.01 0.00 3.86 -1.93 -3.09 115.15 114.30 2k4p h HIS 74 Ca -0.00 -0.23 -0.20 0.00 -1.16 0.00 0.00 60.37 58.78 2k4p h HIS 74 Cb 0.56 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 29.01 2k4p h HIS 74 CO 0.00 1.36 -0.85 0.87 0.86 0.00 0.00 177.93 180.17 2k4p h LYS 75 N 0.05 0.26 0.00 2.45 1.57 -0.47 -2.89 116.57 117.54 2k4p h LYS 75 Ca -0.29 -0.26 -0.07 0.00 -1.87 0.00 0.00 60.65 58.15 2k4p h LYS 75 Cb 2.01 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 34.38 2k4p h LYS 75 CO 0.12 0.97 -0.35 -0.09 -0.57 0.00 0.00 179.45 179.52 2k4p h ARG 76 N 0.15 0.00 0.05 3.15 2.43 -1.27 -3.23 114.38 115.66 2k4p h ARG 76 Ca -0.05 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2k4p h ARG 76 Cb 1.47 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.02 2k4p h ARG 76 CO 0.13 0.35 -0.03 1.25 -1.51 0.00 0.00 179.97 180.17 2k4p h LEU 77 N 0.00 -0.06 -0.49 3.80 5.85 -1.49 -3.09 115.31 119.83 2k4p h LEU 77 Ca -0.00 -0.58 0.10 0.00 0.84 0.00 0.00 57.88 58.23 2k4p h LEU 77 Cb 1.13 0.02 -0.10 0.00 0.37 0.00 0.00 40.66 42.08 2k4p h LEU 77 CO 0.05 0.60 -0.15 0.25 -0.34 0.00 0.00 178.44 178.85 2k4p h LEU 78 N -0.78 -0.54 -0.81 2.25 6.46 -1.59 0.36 115.31 120.66 2k4p h LEU 78 Ca -0.01 0.16 0.11 0.00 -0.12 0.00 0.00 57.88 58.02 2k4p h LEU 78 Cb 0.64 0.34 -0.08 0.00 -0.73 0.00 0.00 40.66 40.83 2k4p h LEU 78 CO 0.01 -0.19 0.44 -0.07 -0.62 0.00 0.00 178.44 178.01 2k4p h LEU 79 N -0.04 0.59 -0.52 2.25 3.38 -1.65 -0.32 115.31 118.99 2k4p h LEU 79 Ca 0.24 0.06 -0.16 0.00 0.09 0.00 0.00 57.88 58.11 2k4p h LEU 79 Cb 0.40 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2k4p h LEU 79 CO -0.52 0.31 -0.50 -0.78 0.09 0.00 0.00 178.44 177.04 2k4p h ASP 80 N 0.70 0.68 0.51 -0.43 3.58 -0.94 -2.91 116.42 117.61 2k4p h ASP 80 Ca 0.41 -0.34 -0.03 0.00 0.42 0.00 0.00 57.03 57.48 2k4p h ASP 80 Cb 0.45 -0.19 -0.00 0.00 1.72 0.00 0.00 39.33 41.30 2k4p h ASP 80 CO -0.29 1.06 -0.15 0.74 -2.88 0.00 0.00 179.24 177.73 2k4p h THR 81 N 0.49 0.56 0.78 2.25 2.02 0.93 -2.22 112.91 117.72 2k4p h THR 81 Ca 0.02 -0.69 -0.04 0.00 0.77 0.00 0.00 66.41 66.48 2k4p h THR 81 Cb 1.04 1.45 0.01 0.00 -1.74 0.00 0.00 68.15 68.91 2k4p h THR 81 CO 0.10 0.14 -0.37 -0.07 0.37 0.00 0.00 175.52 175.69 2k4p h LEU 82 N 0.00 -0.89 -1.80 2.58 3.38 -0.90 -2.48 115.31 115.20 2k4p h LEU 82 Ca -0.00 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 2k4p h LEU 82 Cb 0.44 0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 2k4p h LEU 82 CO 0.02 -0.56 -0.15 1.56 0.09 0.00 0.00 178.44 179.40 2k4p h GLN 83 N -1.20 0.00 0.76 1.13 4.20 -1.61 0.73 115.11 119.12 2k4p h GLN 83 Ca -0.11 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.57 2k4p h GLN 83 Cb 0.80 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.59 2k4p h GLN 83 CO 0.18 0.15 -0.37 1.25 -0.67 0.00 0.00 178.83 179.37 2k4p h LEU 84 N 0.00 -0.87 -3.79 1.46 7.12 -1.27 -3.22 115.31 114.75 2k4p h LEU 84 Ca -0.00 0.03 -0.47 0.00 0.13 0.00 0.00 57.88 57.57 2k4p h LEU 84 Cb 0.38 0.22 -0.26 0.00 -0.53 0.00 0.00 40.66 40.47 2k4p h LEU 84 CO 0.02 -0.61 0.35 -0.24 -0.13 0.00 0.00 178.44 177.82 2k4p n SER 85 N -4.78 4.53 0.00 1.25 2.88 -0.95 -5.10 113.62 111.45 2k4p n SER 85 Ca -0.13 -3.73 0.00 0.00 -1.33 0.00 0.00 58.87 53.69 2k4p n SER 85 Cb 0.40 -0.77 0.00 0.00 -0.75 0.00 0.00 64.21 63.10 2k4p n SER 85 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98