#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4p s GLY 23 N 0.00 0.33 -0.08 5.00 0.00 -1.26 -4.92 107.32 106.39 2k4p s GLY 23 Ca 0.00 3.48 -0.05 0.00 0.00 0.00 0.00 44.72 48.15 2k4p s GLY 23 CO 0.00 2.53 0.19 -2.27 0.00 0.00 0.00 173.10 173.55 2k4p s LEU 24 N 0.94 0.88 0.00 0.66 0.20 -1.26 -4.98 118.68 115.11 2k4p s LEU 24 Ca -0.05 0.39 0.00 0.00 0.69 0.00 0.00 54.13 55.15 2k4p s LEU 24 Cb -0.03 0.57 0.00 0.00 -0.43 0.00 0.00 46.19 46.30 2k4p s LEU 24 CO -0.12 -0.12 0.00 0.61 -0.29 0.00 0.00 176.35 176.43 2k4p n GLY 25 N 3.71 0.91 1.61 7.98 0.00 -1.26 -4.18 105.19 113.96 2k4p n GLY 25 Ca -0.20 -1.44 -0.11 0.00 0.00 0.00 0.00 46.02 44.26 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 3.03 2.23 -0.53 1.61 0.28 -1.26 -4.43 120.64 121.56 2k4p n GLU 26 Ca 0.00 -3.10 0.04 0.00 -0.16 0.00 0.00 57.16 53.95 2k4p n GLU 26 Cb 0.00 -1.99 0.23 0.00 1.43 0.00 0.00 31.44 31.11 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 -1.01 3.36 -1.87 -1.84 0.00 -1.26 -4.98 120.51 112.92 2k4p n ALA 27 Ca 0.43 -2.63 -0.41 0.00 0.00 0.00 0.00 53.44 50.83 2k4p n ALA 27 Cb 1.29 -0.69 -0.02 0.00 0.00 0.00 0.00 19.45 20.03 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 -2.24 2.48 -1.27 0.00 0.00 -1.26 -2.74 107.32 102.29 2k4p s GLY 28 Ca 0.42 1.30 -0.14 0.00 0.00 0.00 0.00 44.72 46.29 2k4p s GLY 28 CO 0.05 2.19 0.44 1.15 0.00 0.00 0.00 173.10 176.93 2k4p n MET 29 N 2.04 -2.05 0.00 2.90 0.00 -1.26 -4.85 117.12 113.90 2k4p n MET 29 Ca 0.05 0.19 0.00 0.00 0.00 0.00 0.00 57.70 57.95 2k4p n MET 29 Cb 0.41 -4.79 0.00 0.00 0.00 0.00 0.00 33.22 28.84 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 -2.19 0.00 -0.11 3.17 7.64 -1.11 -3.31 113.62 117.71 2k4p n SER 30 Ca 0.06 0.27 0.23 0.00 1.01 0.00 0.00 58.87 60.44 2k4p n SER 30 Cb 0.48 -0.14 0.67 0.00 -1.01 0.00 0.00 64.21 64.21 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 2.56 -0.70 -0.43 0.00 -1.89 -0.49 119.26 116.32 2k4p h ALA 31 Ca 0.00 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.98 2k4p h ALA 31 Cb 0.00 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.76 2k4p h ALA 31 CO 0.00 -0.77 0.36 2.35 0.00 0.00 0.00 179.25 181.19 2k4p h TRP 32 N 0.08 0.65 0.00 0.00 7.01 -1.95 0.62 115.95 122.37 2k4p h TRP 32 Ca 0.35 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.38 2k4p h TRP 32 Cb 1.28 -0.19 0.00 0.00 -2.10 0.00 0.00 29.16 28.15 2k4p h TRP 32 CO -0.00 0.26 -0.11 1.28 -2.79 0.00 0.00 178.44 177.08 2k4p n LEU 33 N -4.84 0.16 0.23 0.65 4.77 -0.23 -3.27 117.00 114.48 2k4p n LEU 33 Ca 0.10 0.40 0.13 0.00 -0.03 0.00 0.00 56.01 56.62 2k4p n LEU 33 Cb 0.24 -0.43 0.30 0.00 -2.33 0.00 0.00 43.42 41.20 2k4p n LEU 33 CO 0.26 0.01 0.86 0.03 -1.33 0.00 0.00 177.39 177.22 2k4p h ARG 34 N 0.00 0.00 0.00 3.23 2.47 -0.49 0.42 114.38 120.01 2k4p h ARG 34 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2k4p h ARG 34 Cb 0.52 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.84 2k4p h ARG 34 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 179.97 180.53 2k4p h ALA 35 N 2.01 1.00 -0.00 0.04 0.00 -1.47 -3.16 119.26 117.68 2k4p h ALA 35 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2k4p h ALA 35 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2k4p h ALA 35 CO 0.00 0.00 -0.02 0.44 0.00 0.00 0.00 179.25 179.67 2k4p n ILE 36 N -2.80 0.00 -2.60 0.00 -5.35 -1.15 -5.03 119.36 102.43 2k4p n ILE 36 Ca 0.02 -0.49 -0.07 0.00 -0.27 0.00 0.00 62.75 61.95 2k4p n ILE 36 Cb 0.36 1.00 0.03 0.00 -1.74 0.00 0.00 39.64 39.30 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 0.74 0.16 1.17 3.28 0.00 -0.43 -4.97 105.19 105.13 2k4p n GLY 37 Ca 0.00 -0.26 0.03 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.22 0.67 0.11 0.99 0.00 0.01 -4.84 117.00 111.72 2k4p n LEU 38 Ca -0.10 -1.67 0.10 0.00 0.00 0.00 0.00 56.01 54.35 2k4p n LEU 38 Cb 0.56 0.00 0.46 0.00 0.00 0.00 0.00 43.42 44.44 2k4p n LEU 38 CO 0.24 0.42 0.81 1.21 0.00 0.00 0.00 177.39 180.06 2k4p n GLU 39 N 0.33 0.14 0.28 1.96 0.00 -1.18 -2.22 120.64 119.95 2k4p n GLU 39 Ca 0.04 0.47 0.14 0.00 0.00 0.00 0.00 57.16 57.80 2k4p n GLU 39 Cb 1.00 -1.82 0.83 0.00 0.00 0.00 0.00 31.44 31.45 2k4p n GLU 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2k4p h ARG 40 N 0.00 0.00 -0.01 5.31 3.08 -1.91 0.38 114.38 121.23 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 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2k4p h ARG 40 CO 0.00 0.05 -0.07 0.66 -1.07 0.00 0.00 179.97 179.55 2k4p n TYR 41 N -3.78 0.00 -0.01 3.04 4.01 -0.94 -4.42 117.16 115.05 2k4p n TYR 41 Ca -0.03 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.65 2k4p n TYR 41 Cb 0.15 -0.03 -0.04 0.00 -0.31 0.00 0.00 39.34 39.11 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 2.15 -0.22 -0.30 -0.72 4.81 -1.07 0.11 114.58 119.35 2k4p h GLU 42 Ca 0.00 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.33 2k4p h GLU 42 Cb 0.52 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 2k4p h GLU 42 CO 0.00 -0.14 0.32 1.49 -0.73 0.00 0.00 179.01 179.95 2k4p h GLU 43 N -0.23 0.00 -0.39 1.92 4.57 -1.78 0.31 114.58 118.99 2k4p h GLU 43 Ca 0.02 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.13 2k4p h GLU 43 Cb 0.27 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.84 2k4p h GLU 43 CO -0.19 0.00 -0.05 0.78 -1.18 0.00 0.00 179.01 178.37 2k4p h GLY 44 N 0.00 0.69 0.00 1.92 0.00 -1.05 -2.06 103.07 102.58 2k4p h GLY 44 Ca 0.14 -0.46 -0.06 0.00 0.00 0.00 0.00 47.33 46.94 2k4p h GLY 44 CO -0.00 0.43 -2.07 1.04 0.00 0.00 0.00 176.54 175.94 2k4p n LEU 45 N -4.22 0.00 0.11 3.11 4.32 -0.02 -4.25 117.00 116.04 2k4p n LEU 45 Ca 0.02 0.00 -0.03 0.00 -0.02 0.00 0.00 56.01 55.97 2k4p n LEU 45 Cb 0.30 0.09 0.15 0.00 -1.62 0.00 0.00 43.42 42.34 2k4p n LEU 45 CO 0.41 0.09 0.50 0.58 -1.22 0.00 0.00 177.39 177.74 2k4p h VAL 46 N 0.00 1.40 -0.36 4.08 2.07 -0.43 0.21 116.25 123.21 2k4p h VAL 46 Ca -0.10 -1.98 0.00 0.00 0.82 0.00 0.00 66.70 65.44 2k4p h VAL 46 Cb 1.22 2.02 0.00 0.00 -1.52 0.00 0.00 31.29 33.01 2k4p h VAL 46 CO 0.01 0.58 0.00 1.57 0.02 0.00 0.00 177.57 179.74 2k4p n HIS 47 N -3.86 0.51 -0.01 1.57 -0.00 -0.78 -3.75 115.22 108.90 2k4p n HIS 47 Ca -0.02 -0.25 -0.00 0.00 0.46 0.00 0.00 57.72 57.91 2k4p n HIS 47 Cb 0.60 -0.01 -0.02 0.00 -0.12 0.00 0.00 29.99 30.44 2k4p n HIS 47 CO 0.00 0.00 0.00 -1.71 0.46 0.00 0.00 176.34 175.09 2k4p n ASN 48 N 0.56 4.40 0.00 0.26 5.15 -1.04 -5.02 115.26 119.56 2k4p n ASN 48 Ca 0.12 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.10 2k4p n ASN 48 Cb 0.33 0.80 0.00 0.00 -0.53 0.00 0.00 39.78 40.37 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 2.64 1.43 0.00 8.20 0.00 -0.89 -5.03 105.19 111.54 2k4p n GLY 49 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 0.05 1.61 7.02 0.69 -4.68 117.44 122.12 2k4p n TRP 50 Ca 0.00 -0.23 0.21 0.00 -1.02 0.00 0.00 57.50 56.46 2k4p n TRP 50 Cb 0.00 -0.02 0.74 0.00 -2.42 0.00 0.00 31.31 29.60 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 -2.60 -0.99 3.04 -1.76 -3.37 116.42 110.74 2k4p h ASP 51 Ca 0.00 0.00 -0.56 0.00 -3.24 0.00 0.00 57.03 53.23 2k4p h ASP 51 Cb 0.24 0.00 -0.09 0.00 -1.04 0.00 0.00 39.33 38.44 2k4p h ASP 51 CO 0.00 0.00 0.94 -0.62 -2.04 0.00 0.00 179.24 177.52 2k4p s ASP 52 N -5.55 6.22 0.54 4.15 -1.08 -1.26 -4.13 116.67 115.56 2k4p s ASP 52 Ca -0.05 -0.42 0.31 0.00 -0.52 0.00 0.00 52.55 51.88 2k4p s ASP 52 Cb 0.17 -2.53 1.48 0.00 -1.46 0.00 0.00 42.92 40.58 2k4p s ASP 52 CO 0.61 -1.68 1.90 -0.07 0.52 0.00 0.00 175.17 176.44 2k4p h LEU 53 N 12.47 0.00 -0.09 -1.34 3.38 -1.97 0.58 115.31 128.35 2k4p h LEU 53 Ca -0.27 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 2k4p h LEU 53 Cb 1.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 2k4p h LEU 53 CO 1.24 0.00 0.02 -0.33 0.09 0.00 0.00 178.44 179.46 2k4p h GLU 54 N 0.00 0.14 -0.30 1.13 5.08 -1.92 -2.66 114.58 116.06 2k4p h GLU 54 Ca 0.41 -0.04 -0.18 0.00 -1.00 0.00 0.00 59.36 58.55 2k4p h GLU 54 Cb 1.65 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.88 2k4p h GLU 54 CO -0.00 0.34 -0.53 0.74 -1.00 0.00 0.00 179.01 178.56 2k4p h PHE 55 N -0.08 1.08 -0.02 4.33 -1.00 -1.39 -2.90 116.94 116.97 2k4p h PHE 55 Ca 0.03 -0.38 0.01 0.00 2.81 0.00 0.00 57.97 60.44 2k4p h PHE 55 Cb 0.26 -0.21 -0.00 0.00 3.61 0.00 0.00 35.95 39.61 2k4p h PHE 55 CO 0.01 1.21 0.09 1.25 -1.61 0.00 0.00 178.31 179.26 2k4p h LEU 56 N 0.67 0.00 -0.47 1.54 6.46 -0.94 0.97 115.31 123.54 2k4p h LEU 56 Ca 0.02 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.78 2k4p h LEU 56 Cb 1.13 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.06 2k4p h LEU 56 CO 0.12 0.00 0.00 -1.54 -0.62 0.00 0.00 178.44 176.40 2k4p n SER 57 N -3.21 0.37 -0.32 1.25 3.41 -1.01 -1.73 113.62 112.38 2k4p n SER 57 Ca -0.02 0.60 0.04 0.00 -0.26 0.00 0.00 58.87 59.23 2k4p n SER 57 Cb 0.17 -0.68 0.03 0.00 -0.26 0.00 0.00 64.21 63.47 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 1.62 -4.58 4.04 2.03 0.33 -5.04 116.55 113.03 2k4p n ASP 58 Ca 0.02 -1.31 -0.42 0.00 0.52 0.00 0.00 54.79 53.61 2k4p n ASP 58 Cb 0.17 0.09 0.01 0.00 -0.72 0.00 0.00 41.12 40.67 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 0.35 2.33 -2.58 5.18 3.06 -0.70 -5.00 119.36 121.99 2k4p n ILE 59 Ca 0.05 -0.50 -0.10 0.00 -2.50 0.00 0.00 62.75 59.70 2k4p n ILE 59 Cb 0.21 -1.04 0.05 0.00 0.54 0.00 0.00 39.64 39.41 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 -0.51 0.00 0.08 9.51 -2.24 -1.26 -5.00 114.28 114.85 2k4p n THR 60 Ca 0.10 -0.78 -0.15 0.00 -2.27 0.00 0.00 64.05 60.94 2k4p n THR 60 Cb 0.39 -1.05 -0.07 0.00 -2.10 0.00 0.00 70.33 67.50 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 0.43 0.00 -0.78 4.81 -1.96 -3.25 114.58 113.84 2k4p h GLU 61 Ca -0.15 -0.51 -0.13 0.00 -0.13 0.00 0.00 59.36 58.44 2k4p h GLU 61 Cb 0.58 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.09 2k4p h GLU 61 CO 0.17 1.17 -0.63 1.49 -0.73 0.00 0.00 179.01 180.48 2k4p h GLU 62 N 0.22 0.00 0.00 1.92 4.81 -1.97 -3.22 114.58 116.34 2k4p h GLU 62 Ca -0.10 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.10 2k4p h GLU 62 Cb 1.69 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 31.07 2k4p h GLU 62 CO 0.18 0.63 -0.12 -0.44 -0.73 0.00 0.00 179.01 178.53 2k4p h ASP 63 N 0.00 0.00 -0.38 1.04 3.32 -1.95 -2.07 116.42 116.39 2k4p h ASP 63 Ca -0.01 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.99 2k4p h ASP 63 Cb 1.47 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.99 2k4p h ASP 63 CO 0.08 0.12 0.07 -0.07 -1.72 0.00 0.00 179.24 177.73 2k4p h LEU 64 N 0.00 0.66 -1.07 1.55 3.38 -1.61 -2.38 115.31 115.84 2k4p h LEU 64 Ca -0.00 -0.12 -0.09 0.00 0.09 0.00 0.00 57.88 57.76 2k4p h LEU 64 Cb 0.22 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2k4p h LEU 64 CO 0.02 0.68 -0.28 -0.33 0.09 0.00 0.00 178.44 178.61 2k4p h GLU 65 N 0.68 0.31 -0.14 1.13 5.08 -1.30 0.17 114.58 120.51 2k4p h GLU 65 Ca 0.15 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.43 2k4p h GLU 65 Cb 0.31 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 2k4p h GLU 65 CO 0.00 0.57 0.14 0.93 -1.00 0.00 0.00 179.01 179.66 2k4p h GLU 66 N 0.28 0.00 -0.02 2.33 5.08 -1.38 0.26 114.58 121.12 2k4p h GLU 66 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2k4p h GLU 66 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 2k4p h GLU 66 CO 0.05 0.00 -0.14 0.00 -1.00 0.00 0.00 179.01 177.92 2k4p n ALA 67 N -2.36 2.80 0.00 3.43 0.00 -0.95 -4.92 120.51 118.50 2k4p n ALA 67 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.83 2k4p n ALA 67 Cb 0.26 -0.89 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 1.34 0.66 2.49 0.00 0.00 0.90 -4.41 105.19 106.17 2k4p n GLY 68 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.18 4.39 -0.77 1.61 0.31 0.55 -4.63 118.33 118.61 2k4p n VAL 69 Ca 0.00 -3.29 -0.19 0.00 -0.01 0.00 0.00 64.34 60.85 2k4p n VAL 69 Cb 0.00 -2.46 0.14 0.00 -0.91 0.00 0.00 33.84 30.61 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 3.64 1.99 -4.11 5.55 10.64 -1.26 -3.08 117.38 130.74 2k4p n GLN 70 Ca 0.65 -2.38 -0.29 0.00 -1.83 0.00 0.00 57.00 53.16 2k4p n GLN 70 Cb 0.28 -1.93 -0.07 0.00 -0.86 0.00 0.00 30.24 27.66 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 5.21 -0.01 2.61 1.11 -1.26 -5.03 116.67 118.48 2k4p s ASP 71 Ca 0.45 -0.17 -0.25 0.00 0.18 0.00 0.00 52.55 52.76 2k4p s ASP 71 Cb 0.38 -1.29 -0.20 0.00 1.07 0.00 0.00 42.92 42.89 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 3.05 0.05 0.00 8.23 0.13 -1.98 0.14 132.00 141.62 2k4p h PRO 72 Ca -0.47 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.60 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 0.62 0.53 -0.16 0.00 -0.23 0.00 0.00 178.00 178.76 2k4p h ALA 73 N 0.52 1.09 0.10 -0.56 0.00 -1.98 -1.11 119.26 117.33 2k4p h ALA 73 Ca 0.00 -0.14 -0.32 0.00 0.00 0.00 0.00 54.91 54.45 2k4p h ALA 73 Cb 0.52 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2k4p h ALA 73 CO 0.01 0.20 -1.66 0.45 0.00 0.00 0.00 179.25 178.24 2k4p h HIS 74 N 0.00 0.40 -0.08 0.00 3.86 -1.93 -3.02 115.15 114.38 2k4p h HIS 74 Ca -0.00 -0.29 -0.18 0.00 -1.16 0.00 0.00 60.37 58.73 2k4p h HIS 74 Cb 0.57 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 29.02 2k4p h HIS 74 CO 0.00 1.42 -0.72 0.87 0.86 0.00 0.00 177.93 180.35 2k4p h LYS 75 N 0.06 0.39 0.00 2.45 1.57 -0.53 -2.92 116.57 117.59 2k4p h LYS 75 Ca -0.29 -0.32 -0.00 0.00 -1.87 0.00 0.00 60.65 58.16 2k4p h LYS 75 Cb 2.02 0.07 -0.00 0.00 0.08 0.00 0.00 32.23 34.40 2k4p h LYS 75 CO 0.14 0.96 -0.02 0.07 -0.57 0.00 0.00 179.45 180.02 2k4p h ARG 76 N 0.27 0.00 0.09 3.15 0.11 -1.34 -3.25 114.38 113.40 2k4p h ARG 76 Ca -0.03 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.05 2k4p h ARG 76 Cb 1.30 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.38 2k4p h ARG 76 CO 0.12 0.02 -0.04 1.25 0.10 0.00 0.00 179.97 181.42 2k4p h LEU 77 N 0.00 -0.10 -0.37 0.08 7.12 -1.42 -3.16 115.31 117.47 2k4p h LEU 77 Ca -0.00 -0.50 0.08 0.00 0.13 0.00 0.00 57.88 57.59 2k4p h LEU 77 Cb 0.94 0.03 -0.08 0.00 -0.53 0.00 0.00 40.66 41.02 2k4p h LEU 77 CO 0.00 0.54 -0.17 -0.07 -0.13 0.00 0.00 178.44 178.61 2k4p h LEU 78 N -0.84 -0.59 -1.07 2.25 3.38 -1.61 0.19 115.31 117.02 2k4p h LEU 78 Ca -0.01 0.14 0.20 0.00 0.09 0.00 0.00 57.88 58.30 2k4p h LEU 78 Cb 0.59 0.32 -0.11 0.00 0.09 0.00 0.00 40.66 41.56 2k4p h LEU 78 CO 0.02 -0.21 0.61 -0.07 0.09 0.00 0.00 178.44 178.88 2k4p h LEU 79 N -0.11 0.72 -0.26 1.67 3.38 -1.67 0.17 115.31 119.21 2k4p h LEU 79 Ca 0.18 0.10 -0.21 0.00 0.09 0.00 0.00 57.88 58.04 2k4p h LEU 79 Cb 0.39 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2k4p h LEU 79 CO -0.44 0.23 -0.87 -0.78 0.09 0.00 0.00 178.44 176.67 2k4p h ASP 80 N 0.69 0.45 1.02 -0.43 3.58 -0.98 -3.10 116.42 117.65 2k4p h ASP 80 Ca 0.58 -0.34 -0.00 0.00 0.42 0.00 0.00 57.03 57.69 2k4p h ASP 80 Cb 1.01 -0.14 -0.00 0.00 1.72 0.00 0.00 39.33 41.93 2k4p h ASP 80 CO -0.37 1.13 -0.01 0.74 -2.88 0.00 0.00 179.24 177.84 2k4p h THR 81 N 0.21 0.03 0.64 2.25 2.02 0.20 -2.55 112.91 115.70 2k4p h THR 81 Ca -0.06 -0.54 -0.03 0.00 0.77 0.00 0.00 66.41 66.55 2k4p h THR 81 Cb 1.49 1.52 0.01 0.00 -1.74 0.00 0.00 68.15 69.43 2k4p h THR 81 CO 0.15 0.01 -0.31 -0.07 0.37 0.00 0.00 175.52 175.67 2k4p h LEU 82 N 0.00 -0.72 -1.80 2.58 3.38 -0.86 -2.97 115.31 114.92 2k4p h LEU 82 Ca -0.00 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2k4p h LEU 82 Cb 0.52 0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 2k4p h LEU 82 CO 0.00 -0.34 -0.15 1.56 0.09 0.00 0.00 178.44 179.61 2k4p h GLN 83 N -1.21 0.00 0.40 1.13 4.20 -1.64 -3.16 115.11 114.83 2k4p h GLN 83 Ca -0.09 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 2k4p h GLN 83 Cb 0.66 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.43 2k4p h GLN 83 CO 0.14 0.15 -0.25 1.25 -0.67 0.00 0.00 178.83 179.45 2k4p h LEU 84 N 0.00 -0.63 -5.75 1.46 5.85 -1.43 -3.19 115.31 111.62 2k4p h LEU 84 Ca -0.00 0.04 -0.77 0.00 0.84 0.00 0.00 57.88 57.98 2k4p h LEU 84 Cb 0.38 0.18 -0.24 0.00 0.37 0.00 0.00 40.66 41.35 2k4p h LEU 84 CO 0.02 -0.38 1.20 -0.24 -0.34 0.00 0.00 178.44 178.70 2k4p n SER 85 N -3.86 7.45 0.00 1.25 2.88 -1.13 -5.11 113.62 115.11 2k4p n SER 85 Ca -0.07 -3.61 0.00 0.00 -1.33 0.00 0.00 58.87 53.85 2k4p n SER 85 Cb 0.25 -1.18 0.00 0.00 -0.75 0.00 0.00 64.21 62.53 2k4p n SER 85 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98