#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 3.95 3.00 0.46 0.00 -1.26 -5.17 105.19 106.18 2k4p n GLY 23 Ca 0.00 -0.80 -0.10 0.00 0.00 0.00 0.00 46.02 45.12 2k4p n GLY 23 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2k4p s LEU 24 N 0.00 2.25 0.00 0.99 2.34 -1.26 -4.92 118.68 118.08 2k4p s LEU 24 Ca 0.00 -0.52 0.00 0.00 0.06 0.00 0.00 54.13 53.67 2k4p s LEU 24 Cb 0.00 0.03 0.00 0.00 -0.56 0.00 0.00 46.19 45.66 2k4p s LEU 24 CO 0.00 -0.28 0.00 0.61 -1.06 0.00 0.00 176.35 175.62 2k4p n GLY 25 N 1.53 3.75 0.27 -3.48 0.00 -1.26 -4.93 105.19 101.06 2k4p n GLY 25 Ca -0.23 -0.21 -0.12 0.00 0.00 0.00 0.00 46.02 45.46 2k4p n GLY 25 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2k4p h GLU 26 N 0.00 0.93 -0.79 1.61 4.81 -2.04 -3.03 114.58 116.06 2k4p h GLU 26 Ca 0.00 -0.43 -0.35 0.00 -0.13 0.00 0.00 59.36 58.45 2k4p h GLU 26 Cb 0.00 -0.01 -0.21 0.00 0.63 0.00 0.00 28.75 29.16 2k4p h GLU 26 CO 0.00 1.09 0.39 0.00 -0.73 0.00 0.00 179.01 179.76 2k4p n ALA 27 N -2.52 4.98 -1.84 2.92 0.00 -1.26 -4.99 120.51 117.81 2k4p n ALA 27 Ca -0.01 -2.75 -0.41 0.00 0.00 0.00 0.00 53.44 50.27 2k4p n ALA 27 Cb 0.48 -1.24 -0.03 0.00 0.00 0.00 0.00 19.45 18.65 2k4p n ALA 27 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2k4p s GLY 28 N -1.45 2.92 -1.17 0.00 0.00 -1.15 -2.67 107.32 103.81 2k4p s GLY 28 Ca 0.54 1.02 0.00 0.00 0.00 0.00 0.00 44.72 46.28 2k4p s GLY 28 CO 0.10 1.73 0.00 -0.13 0.00 0.00 0.00 173.10 174.80 2k4p n MET 29 N 1.46 -1.36 0.00 2.90 0.00 -1.26 -4.83 117.12 114.02 2k4p n MET 29 Ca 0.01 0.86 0.00 0.00 0.00 0.00 0.00 57.70 58.56 2k4p n MET 29 Cb 0.44 -5.09 0.00 0.00 0.00 0.00 0.00 33.22 28.57 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 -0.80 0.00 0.33 6.12 7.64 -1.09 -4.56 113.62 121.26 2k4p n SER 30 Ca -0.11 0.00 0.20 0.00 1.01 0.00 0.00 58.87 59.97 2k4p n SER 30 Cb 0.51 -0.24 1.06 0.00 -1.01 0.00 0.00 64.21 64.52 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 -1.26 1.16 -0.54 -0.43 0.00 -1.88 -1.55 119.26 114.77 2k4p h ALA 31 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2k4p h ALA 31 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2k4p h ALA 31 CO 0.00 -0.14 0.28 2.35 0.00 0.00 0.00 179.25 181.74 2k4p h TRP 32 N 0.00 0.75 0.00 0.00 7.01 -1.85 -1.72 115.95 120.15 2k4p h TRP 32 Ca 0.00 -0.03 0.00 0.00 2.11 0.00 0.00 58.89 60.98 2k4p h TRP 32 Cb 0.27 -0.24 0.00 0.00 -2.10 0.00 0.00 29.16 27.09 2k4p h TRP 32 CO 0.00 0.57 0.00 -0.07 -2.79 0.00 0.00 178.44 176.15 2k4p h LEU 33 N 0.72 0.00 -0.58 0.65 3.38 -1.52 -2.71 115.31 115.24 2k4p h LEU 33 Ca 0.19 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 2k4p h LEU 33 Cb 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2k4p h LEU 33 CO -0.03 0.00 -0.19 0.03 0.09 0.00 0.00 178.44 178.34 2k4p h ARG 34 N 0.00 0.00 0.00 1.13 -0.00 -1.31 0.50 114.38 114.70 2k4p h ARG 34 Ca 0.00 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.47 2k4p h ARG 34 Cb 0.47 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 30.44 2k4p h ARG 34 CO 0.00 0.19 -0.07 0.00 0.00 0.00 0.00 179.97 180.10 2k4p h ALA 35 N 1.81 1.21 0.00 0.04 0.00 -1.39 -3.19 119.26 117.75 2k4p h ALA 35 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2k4p h ALA 35 Cb 0.94 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2k4p h ALA 35 CO 0.03 0.08 -0.86 0.44 0.00 0.00 0.00 179.25 178.94 2k4p n ILE 36 N -3.48 0.00 -0.63 0.00 -5.35 -1.15 -5.05 119.36 103.70 2k4p n ILE 36 Ca -0.02 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.46 2k4p n ILE 36 Cb 0.20 0.07 0.00 0.00 -1.74 0.00 0.00 39.64 38.17 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 2.29 0.56 0.16 3.28 0.00 0.14 -5.02 105.19 106.59 2k4p n GLY 37 Ca 0.00 -0.15 0.06 0.00 0.00 0.00 0.00 46.02 45.93 2k4p n GLY 37 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k4p n LEU 38 N -0.28 1.70 0.26 0.99 4.77 0.92 -4.75 117.00 120.60 2k4p n LEU 38 Ca 0.00 -2.41 0.18 0.00 -0.03 0.00 0.00 56.01 53.75 2k4p n LEU 38 Cb 0.15 -0.28 0.91 0.00 -2.33 0.00 0.00 43.42 41.87 2k4p n LEU 38 CO 0.00 0.56 1.15 -0.08 -1.33 0.00 0.00 177.39 177.69 2k4p h GLU 39 N 0.00 0.00 -0.05 3.23 4.22 -1.89 -0.02 114.58 120.07 2k4p h GLU 39 Ca 0.00 0.00 0.02 0.00 0.08 0.00 0.00 59.36 59.46 2k4p h GLU 39 Cb 1.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.30 2k4p h GLU 39 CO 0.00 0.00 0.10 0.00 -2.18 0.00 0.00 179.01 176.93 2k4p h ARG 40 N 0.00 0.00 -0.16 1.92 3.08 -1.93 0.26 114.38 117.55 2k4p h ARG 40 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 2k4p h ARG 40 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.50 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 -3.47 0.19 -0.00 3.04 4.01 -0.02 -4.64 117.16 116.26 2k4p n TYR 41 Ca -0.02 -0.10 -0.02 0.00 -0.16 0.00 0.00 57.90 57.60 2k4p n TYR 41 Cb 0.18 -0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.20 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 4.20 -0.06 -0.10 -0.72 4.22 -0.53 0.18 114.58 121.78 2k4p h GLU 42 Ca 0.00 0.00 0.03 0.00 0.08 0.00 0.00 59.36 59.47 2k4p h GLU 42 Cb 0.92 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.18 2k4p h GLU 42 CO 0.00 -0.04 0.12 1.49 -2.18 0.00 0.00 179.01 178.40 2k4p h GLU 43 N -0.06 0.00 -0.28 1.92 4.81 -1.82 0.32 114.58 119.46 2k4p h GLU 43 Ca 0.00 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.14 2k4p h GLU 43 Cb 0.08 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 2k4p h GLU 43 CO -0.05 0.00 -0.24 0.78 -0.73 0.00 0.00 179.01 178.77 2k4p h GLY 44 N 0.00 0.59 0.73 1.92 0.00 -1.31 -0.92 103.07 104.08 2k4p h GLY 44 Ca 0.05 -0.48 -0.31 0.00 0.00 0.00 0.00 47.33 46.59 2k4p h GLY 44 CO -0.00 0.44 -1.87 1.04 0.00 0.00 0.00 176.54 176.14 2k4p n LEU 45 N -4.12 0.65 0.13 3.11 4.77 -0.18 -4.10 117.00 117.27 2k4p n LEU 45 Ca -0.00 0.31 -0.02 0.00 -0.03 0.00 0.00 56.01 56.27 2k4p n LEU 45 Cb 0.41 0.25 0.17 0.00 -2.33 0.00 0.00 43.42 41.92 2k4p n LEU 45 CO 0.42 0.41 0.50 0.58 -1.33 0.00 0.00 177.39 177.98 2k4p h VAL 46 N 0.00 1.43 0.00 4.08 2.07 -0.97 0.27 116.25 123.13 2k4p h VAL 46 Ca -0.35 -2.06 0.00 0.00 0.82 0.00 0.00 66.70 65.11 2k4p h VAL 46 Cb 2.06 2.10 0.00 0.00 -1.52 0.00 0.00 31.29 33.94 2k4p h VAL 46 CO 0.07 0.59 0.00 1.57 0.02 0.00 0.00 177.57 179.82 2k4p n HIS 47 N -3.83 0.00 -0.03 1.57 -0.00 -0.36 -3.20 115.22 109.38 2k4p n HIS 47 Ca -0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 57.72 57.69 2k4p n HIS 47 Cb 0.60 -0.17 -0.07 0.00 -0.00 0.00 0.00 29.99 30.36 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 -1.17 2.79 0.00 0.26 5.15 -1.00 -5.02 115.26 116.27 2k4p n ASN 48 Ca 0.17 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.15 2k4p n ASN 48 Cb 0.17 0.94 0.00 0.00 -0.53 0.00 0.00 39.78 40.36 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 2.29 1.09 0.17 8.20 0.00 -0.71 -5.04 105.19 111.20 2k4p n GLY 49 Ca -0.11 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.93 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 0.07 0.30 1.61 7.02 0.86 -4.63 117.44 122.68 2k4p n TRP 50 Ca 0.00 -0.23 0.19 0.00 -1.02 0.00 0.00 57.50 56.44 2k4p n TRP 50 Cb 0.00 -0.02 1.00 0.00 -2.42 0.00 0.00 31.31 29.87 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 0.68 0.00 -2.49 -0.99 1.82 -1.79 -3.37 116.42 110.28 2k4p h ASP 51 Ca 0.00 0.00 -0.60 0.00 -0.39 0.00 0.00 57.03 56.04 2k4p h ASP 51 Cb 0.35 0.00 -0.12 0.00 0.68 0.00 0.00 39.33 40.24 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 -5.27 6.19 0.53 2.28 1.01 -1.26 -4.34 116.67 115.80 2k4p s ASP 52 Ca -0.05 -0.83 0.31 0.00 0.71 0.00 0.00 52.55 52.69 2k4p s ASP 52 Cb 0.13 -2.48 1.46 0.00 1.01 0.00 0.00 42.92 43.04 2k4p s ASP 52 CO 0.43 -1.59 1.89 -0.07 0.21 0.00 0.00 175.17 176.05 2k4p h LEU 53 N 12.01 0.02 -0.52 1.23 3.38 -1.94 0.25 115.31 129.75 2k4p h LEU 53 Ca -0.26 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.64 2k4p h LEU 53 Cb 1.06 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 2k4p h LEU 53 CO 1.22 0.01 0.02 -0.08 0.09 0.00 0.00 178.44 179.70 2k4p h GLU 54 N 0.02 0.90 0.21 1.13 4.81 -1.92 -2.60 114.58 117.13 2k4p h GLU 54 Ca 0.42 -0.28 -0.32 0.00 -0.13 0.00 0.00 59.36 59.06 2k4p h GLU 54 Cb 1.65 -0.09 0.03 0.00 0.63 0.00 0.00 28.75 30.98 2k4p h GLU 54 CO -0.02 0.91 -1.40 0.74 -0.73 0.00 0.00 179.01 178.52 2k4p h PHE 55 N 0.77 0.90 -0.01 0.92 0.04 -1.05 -3.23 116.94 115.28 2k4p h PHE 55 Ca 0.15 -0.64 0.00 0.00 2.80 0.00 0.00 57.97 60.28 2k4p h PHE 55 Cb 0.49 -0.04 -0.00 0.00 2.20 0.00 0.00 35.95 38.60 2k4p h PHE 55 CO 0.04 1.50 0.05 1.25 -0.60 0.00 0.00 178.31 180.54 2k4p h LEU 56 N 0.16 0.00 -0.49 1.54 6.46 -0.64 0.41 115.31 122.75 2k4p h LEU 56 Ca -0.22 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.54 2k4p h LEU 56 Cb 2.09 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 42.02 2k4p h LEU 56 CO 0.26 0.00 0.00 -1.54 -0.62 0.00 0.00 178.44 176.54 2k4p n SER 57 N -3.26 0.37 -0.31 1.25 3.41 -0.98 -1.66 113.62 112.44 2k4p n SER 57 Ca -0.03 0.61 0.05 0.00 -0.26 0.00 0.00 58.87 59.24 2k4p n SER 57 Cb 0.12 -0.68 0.02 0.00 -0.26 0.00 0.00 64.21 63.41 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 -1.92 1.49 -4.62 4.04 2.03 0.13 -5.03 116.55 112.67 2k4p n ASP 58 Ca 0.02 -1.24 -0.44 0.00 0.52 0.00 0.00 54.79 53.65 2k4p n ASP 58 Cb 0.16 0.29 -0.01 0.00 -0.72 0.00 0.00 41.12 40.84 2k4p n ASP 58 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k4p n ILE 59 N 0.08 2.01 -2.46 5.18 3.06 -0.66 -4.99 119.36 121.58 2k4p n ILE 59 Ca 0.05 -0.50 -0.11 0.00 -2.50 0.00 0.00 62.75 59.69 2k4p n ILE 59 Cb 0.24 -1.15 0.06 0.00 0.54 0.00 0.00 39.64 39.32 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 0.22 0.00 0.09 9.51 -2.24 -1.26 -4.99 114.28 115.60 2k4p n THR 60 Ca 0.08 -0.76 -0.15 0.00 -2.27 0.00 0.00 64.05 60.95 2k4p n THR 60 Cb 0.33 -1.12 -0.08 0.00 -2.10 0.00 0.00 70.33 67.36 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 0.36 0.00 -0.78 5.08 -1.96 -3.21 114.58 114.06 2k4p h GLU 61 Ca -0.16 -0.47 0.00 0.00 -1.00 0.00 0.00 59.36 57.74 2k4p h GLU 61 Cb 0.58 0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.99 2k4p h GLU 61 CO 0.17 1.16 0.00 0.93 -1.00 0.00 0.00 179.01 180.27 2k4p h GLU 62 N 0.17 0.00 0.00 2.33 5.08 -1.97 -3.19 114.58 116.99 2k4p h GLU 62 Ca -0.11 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.16 2k4p h GLU 62 Cb 1.75 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.98 2k4p h GLU 62 CO 0.18 0.00 -0.43 -0.44 -1.00 0.00 0.00 179.01 177.32 2k4p h ASP 63 N 0.00 0.00 -0.29 1.42 3.32 -1.94 -3.00 116.42 115.93 2k4p h ASP 63 Ca 0.00 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 2k4p h ASP 63 Cb 0.98 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.52 2k4p h ASP 63 CO 0.00 0.43 -0.11 -0.07 -1.72 0.00 0.00 179.24 177.77 2k4p h LEU 64 N 0.00 0.70 -1.80 1.55 3.38 -1.60 -2.35 115.31 115.20 2k4p h LEU 64 Ca -0.00 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 2k4p h LEU 64 Cb 0.88 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 2k4p h LEU 64 CO 0.06 0.84 -0.10 1.05 0.09 0.00 0.00 178.44 180.38 2k4p h GLU 65 N 0.65 0.00 -0.05 1.13 4.11 -1.28 0.98 114.58 120.11 2k4p h GLU 65 Ca 0.11 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.46 2k4p h GLU 65 Cb 0.57 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 2k4p h GLU 65 CO 0.04 0.10 -0.37 0.93 0.07 0.00 0.00 179.01 179.77 2k4p h GLU 66 N 0.00 0.10 -0.10 1.06 4.39 -1.46 -2.29 114.58 116.29 2k4p h GLU 66 Ca -0.00 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.66 2k4p h GLU 66 Cb 0.41 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 2k4p h GLU 66 CO 0.01 0.46 0.00 0.00 -1.16 0.00 0.00 179.01 178.33 2k4p n ALA 67 N -2.47 2.53 0.00 3.43 0.00 -0.89 -4.90 120.51 118.20 2k4p n ALA 67 Ca -0.02 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.87 2k4p n ALA 67 Cb 0.43 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.82 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 1.22 1.39 3.58 0.00 0.00 -0.86 -4.41 105.19 106.11 2k4p n GLY 68 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 2k4p n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k4p s VAL 69 N -2.18 3.79 -0.42 1.61 1.01 0.29 -4.70 120.40 119.81 2k4p s VAL 69 Ca 0.00 -1.34 0.04 0.00 0.00 0.00 0.00 61.98 60.68 2k4p s VAL 69 Cb 0.00 -4.84 0.46 0.00 0.00 0.00 0.00 36.38 32.00 2k4p s VAL 69 CO 0.00 -1.43 1.52 0.00 0.00 0.00 0.00 175.10 175.18 2k4p n GLN 70 N 8.34 3.06 -4.35 2.72 6.02 -1.26 -2.17 117.38 129.74 2k4p n GLN 70 Ca 0.46 -3.74 -0.29 0.00 -0.01 0.00 0.00 57.00 53.43 2k4p n GLN 70 Cb 0.46 -2.22 -0.12 0.00 1.02 0.00 0.00 30.24 29.38 2k4p n GLN 70 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2k4p s ASP 71 N -2.85 3.65 -0.01 1.08 1.11 -1.26 -5.05 116.67 113.33 2k4p s ASP 71 Ca 0.55 -0.68 -0.25 0.00 0.18 0.00 0.00 52.55 52.35 2k4p s ASP 71 Cb 0.44 -0.40 -0.20 0.00 1.07 0.00 0.00 42.92 43.84 2k4p s ASP 71 CO 0.02 0.16 1.28 1.55 1.18 0.00 0.00 175.17 179.36 2k4p h PRO 72 N 3.62 0.05 0.00 8.23 0.13 -1.98 0.91 132.00 142.95 2k4p h PRO 72 Ca -0.49 -0.02 -0.02 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 32.31 2k4p h PRO 72 CO 0.45 0.52 -0.09 0.00 -0.23 0.00 0.00 178.00 178.64 2k4p h ALA 73 N 0.52 1.03 0.06 -0.56 0.00 -1.98 -1.42 119.26 116.91 2k4p h ALA 73 Ca 0.00 -0.08 -0.30 0.00 0.00 0.00 0.00 54.91 54.53 2k4p h ALA 73 Cb 0.51 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2k4p h ALA 73 CO 0.00 0.12 -1.62 0.45 0.00 0.00 0.00 179.25 178.20 2k4p h HIS 74 N 0.00 0.23 0.00 0.00 3.86 -1.96 -3.07 115.15 114.21 2k4p h HIS 74 Ca -0.00 -0.17 -0.22 0.00 -1.16 0.00 0.00 60.37 58.83 2k4p h HIS 74 Cb 0.58 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 29.03 2k4p h HIS 74 CO 0.00 1.26 -0.92 0.87 0.86 0.00 0.00 177.93 179.99 2k4p h LYS 75 N 0.03 0.34 0.00 2.45 1.57 -0.63 -2.93 116.57 117.40 2k4p h LYS 75 Ca -0.27 -0.37 -0.07 0.00 -1.87 0.00 0.00 60.65 58.08 2k4p h LYS 75 Cb 1.99 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 34.40 2k4p h LYS 75 CO 0.11 1.06 -0.32 0.07 -0.57 0.00 0.00 179.45 179.80 2k4p h ARG 76 N 0.19 0.00 0.09 3.15 -0.00 -1.40 -3.18 114.38 113.23 2k4p h ARG 76 Ca -0.07 0.00 -0.00 0.00 -0.00 0.00 0.00 59.98 59.91 2k4p h ARG 76 Cb 1.56 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.53 2k4p h ARG 76 CO 0.15 0.32 -0.04 1.25 -0.00 0.00 0.00 179.97 181.65 2k4p h LEU 77 N 0.00 -0.10 -0.25 0.08 5.85 -1.51 -3.05 115.31 116.32 2k4p h LEU 77 Ca -0.00 -0.48 0.06 0.00 0.84 0.00 0.00 57.88 58.30 2k4p h LEU 77 Cb 1.10 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 42.08 2k4p h LEU 77 CO 0.04 0.50 -0.21 0.25 -0.34 0.00 0.00 178.44 178.68 2k4p h LEU 78 N -0.79 -0.69 -0.87 2.25 6.46 -1.60 0.13 115.31 120.20 2k4p h LEU 78 Ca -0.01 0.13 0.17 0.00 -0.12 0.00 0.00 57.88 58.05 2k4p h LEU 78 Cb 0.58 0.33 -0.10 0.00 -0.73 0.00 0.00 40.66 40.74 2k4p h LEU 78 CO 0.02 -0.25 0.44 -0.07 -0.62 0.00 0.00 178.44 177.95 2k4p h LEU 79 N -0.21 0.49 -0.44 2.25 3.38 -1.66 0.17 115.31 119.28 2k4p h LEU 79 Ca 0.14 0.11 -0.15 0.00 0.09 0.00 0.00 57.88 58.07 2k4p h LEU 79 Cb 0.43 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2k4p h LEU 79 CO -0.37 0.16 -0.34 -0.78 0.09 0.00 0.00 178.44 177.19 2k4p h ASP 80 N 0.56 0.98 0.34 -0.43 1.82 -1.08 -2.97 116.42 115.64 2k4p h ASP 80 Ca 0.50 -0.43 -0.06 0.00 -0.39 0.00 0.00 57.03 56.65 2k4p h ASP 80 Cb 0.79 -0.27 -0.01 0.00 0.68 0.00 0.00 39.33 40.52 2k4p h ASP 80 CO -0.41 1.22 -0.30 0.74 -1.61 0.00 0.00 179.24 178.87 2k4p h THR 81 N 0.77 1.16 0.21 2.25 2.02 0.12 -2.45 112.91 117.00 2k4p h THR 81 Ca 0.07 -1.06 0.01 0.00 0.77 0.00 0.00 66.41 66.20 2k4p h THR 81 Cb 0.93 1.58 -0.03 0.00 -1.74 0.00 0.00 68.15 68.89 2k4p h THR 81 CO 0.09 0.30 -0.30 -0.07 0.37 0.00 0.00 175.52 175.91 2k4p h LEU 82 N 0.00 -0.83 -1.15 2.58 3.38 -0.60 0.23 115.31 118.92 2k4p h LEU 82 Ca -0.00 0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 2k4p h LEU 82 Cb 0.56 0.30 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 2k4p h LEU 82 CO 0.04 -0.41 -0.29 1.56 0.09 0.00 0.00 178.44 179.43 2k4p h GLN 83 N -0.58 0.00 0.00 1.13 1.08 -1.61 -3.33 115.11 111.81 2k4p h GLN 83 Ca 0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 2k4p h GLN 83 Cb 0.56 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.99 2k4p h GLN 83 CO -0.12 0.29 0.00 1.28 -0.95 0.00 0.00 178.83 179.33 2k4p n LEU 84 N -3.54 0.42 -2.59 1.46 4.77 -0.79 -4.89 117.00 111.84 2k4p n LEU 84 Ca -0.00 0.59 -0.14 0.00 -0.03 0.00 0.00 56.01 56.42 2k4p n LEU 84 Cb 0.44 -0.38 -0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2k4p n LEU 84 CO 0.35 -0.38 -0.14 -1.54 -1.33 0.00 0.00 177.39 174.35 2k4p n SER 85 N -1.64 -4.01 0.00 -1.43 3.41 0.75 -5.08 113.62 105.61 2k4p n SER 85 Ca 0.00 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 2k4p n SER 85 Cb 0.00 -3.38 0.00 0.00 -0.26 0.00 0.00 64.21 60.57 2k4p n SER 85 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05