#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 0.00 1.12 0.46 0.00 -1.26 -4.95 105.19 100.55 2k4p n GLY 23 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 2k4p n GLY 23 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2k4p n LEU 24 N -2.43 0.01 -3.30 0.99 -0.00 -1.26 -5.03 117.00 105.98 2k4p n LEU 24 Ca 0.00 -1.82 -0.10 0.00 -0.00 0.00 0.00 56.01 54.09 2k4p n LEU 24 Cb 0.19 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.55 2k4p n LEU 24 CO 0.00 0.92 -0.06 -0.83 -0.00 0.00 0.00 177.39 177.42 2k4p s GLY 25 N -1.32 -0.49 -0.44 1.47 0.00 -1.26 -5.09 107.32 100.19 2k4p s GLY 25 Ca 0.14 -0.49 0.02 0.00 0.00 0.00 0.00 44.72 44.39 2k4p s GLY 25 CO -0.07 3.08 0.21 1.85 0.00 0.00 0.00 173.10 178.17 2k4p s GLU 26 N 1.64 1.43 -0.10 2.90 2.12 -1.26 -4.85 118.70 120.58 2k4p s GLU 26 Ca 0.16 -2.06 0.04 0.00 0.36 0.00 0.00 54.97 53.47 2k4p s GLU 26 Cb -0.11 -2.66 0.12 0.00 0.26 0.00 0.00 34.13 31.74 2k4p s GLU 26 CO -0.06 -1.10 0.84 0.00 -0.54 0.00 0.00 175.26 174.39 2k4p n ALA 27 N 3.65 1.05 0.22 6.30 0.00 -1.26 -4.98 120.51 125.49 2k4p n ALA 27 Ca 0.06 -0.47 -0.09 0.00 0.00 0.00 0.00 53.44 52.93 2k4p n ALA 27 Cb 0.35 -0.50 -0.04 0.00 0.00 0.00 0.00 19.45 19.26 2k4p n ALA 27 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2k4p h GLY 28 N 0.29 -0.64 1.04 0.00 0.00 -1.92 -3.24 103.07 98.61 2k4p h GLY 28 Ca -0.28 0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.29 2k4p h GLY 28 CO -0.13 -0.23 -0.00 1.15 0.00 0.00 0.00 176.54 177.32 2k4p n MET 29 N -4.88 0.93 0.00 4.80 0.00 -1.26 -4.14 117.12 112.57 2k4p n MET 29 Ca -0.08 -0.03 0.00 0.00 0.00 0.00 0.00 57.70 57.60 2k4p n MET 29 Cb 0.24 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 31.96 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 -1.01 0.00 -0.19 3.17 7.64 -1.22 -3.16 113.62 118.84 2k4p n SER 30 Ca 0.22 0.73 0.29 0.00 1.01 0.00 0.00 58.87 61.12 2k4p n SER 30 Cb 0.14 -0.32 0.73 0.00 -1.01 0.00 0.00 64.21 63.74 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 2.86 -0.91 -0.43 0.00 -1.72 0.64 119.26 117.70 2k4p h ALA 31 Ca 0.00 -0.03 0.14 0.00 0.00 0.00 0.00 54.91 55.01 2k4p h ALA 31 Cb 0.00 0.07 -0.09 0.00 0.00 0.00 0.00 17.79 17.77 2k4p h ALA 31 CO 0.00 -1.16 0.52 2.35 0.00 0.00 0.00 179.25 180.96 2k4p h TRP 32 N 0.00 0.93 0.00 0.00 7.01 -1.70 0.19 115.95 122.37 2k4p h TRP 32 Ca 0.44 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.47 2k4p h TRP 32 Cb 1.81 -0.28 0.00 0.00 -2.10 0.00 0.00 29.16 28.59 2k4p h TRP 32 CO 0.00 0.29 0.00 -0.07 -2.79 0.00 0.00 178.44 175.87 2k4p h LEU 33 N 0.77 0.00 -0.40 0.65 4.07 -0.82 -3.08 115.31 116.50 2k4p h LEU 33 Ca 0.48 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.44 2k4p h LEU 33 Cb 0.59 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.33 2k4p h LEU 33 CO -0.32 0.00 0.00 0.54 -1.08 0.00 0.00 178.44 177.58 2k4p n ARG 34 N -3.03 0.09 0.17 1.13 5.12 0.65 -1.01 116.66 119.78 2k4p n ARG 34 Ca 0.04 0.37 0.08 0.00 -1.93 0.00 0.00 57.85 56.40 2k4p n ARG 34 Cb 0.48 -1.69 0.08 0.00 -1.16 0.00 0.00 32.46 30.17 2k4p n ARG 34 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2k4p h ALA 35 N 2.33 0.81 -0.01 7.54 0.00 -1.44 -3.30 119.26 125.19 2k4p h ALA 35 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2k4p h ALA 35 Cb 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2k4p h ALA 35 CO 0.00 0.30 0.00 0.44 0.00 0.00 0.00 179.25 179.99 2k4p n ILE 36 N -3.10 0.34 -3.04 0.00 -5.35 -0.80 -5.02 119.36 102.39 2k4p n ILE 36 Ca 0.02 -0.67 -0.13 0.00 -0.27 0.00 0.00 62.75 61.70 2k4p n ILE 36 Cb 0.63 0.85 0.07 0.00 -1.74 0.00 0.00 39.64 39.44 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 -0.08 -0.35 0.80 3.28 0.00 -0.18 -4.95 105.19 103.71 2k4p n GLY 37 Ca 0.01 0.11 0.01 0.00 0.00 0.00 0.00 46.02 46.15 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 -3.26 0.25 0.27 0.99 4.32 -0.54 -4.86 117.00 114.17 2k4p n LEU 38 Ca -0.17 -1.31 0.19 0.00 -0.02 0.00 0.00 56.01 54.69 2k4p n LEU 38 Cb 0.62 0.00 0.97 0.00 -1.62 0.00 0.00 43.42 43.39 2k4p n LEU 38 CO 0.47 0.42 1.05 1.05 -1.22 0.00 0.00 177.39 179.16 2k4p h GLU 39 N 0.28 0.00 0.00 3.23 4.11 -1.87 -1.56 114.58 118.76 2k4p h GLU 39 Ca -0.08 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.34 2k4p h GLU 39 Cb 1.51 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.76 2k4p h GLU 39 CO 0.02 0.00 -0.01 0.07 0.07 0.00 0.00 179.01 179.16 2k4p h ARG 40 N 0.00 0.00 -0.28 1.06 0.11 -1.93 0.13 114.38 113.47 2k4p h ARG 40 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2k4p h ARG 40 Cb 0.05 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.13 2k4p h ARG 40 CO 0.00 0.01 0.00 0.66 0.10 0.00 0.00 179.97 180.74 2k4p n TYR 41 N -3.79 0.36 0.00 4.08 4.01 -0.59 -4.54 117.16 116.69 2k4p n TYR 41 Ca -0.03 -0.18 -0.01 0.00 -0.16 0.00 0.00 57.90 57.52 2k4p n TYR 41 Cb 0.09 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.12 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 3.28 -0.03 -0.35 -0.72 4.81 -0.86 -0.82 114.58 119.90 2k4p h GLU 42 Ca 0.00 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.33 2k4p h GLU 42 Cb 0.72 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 2k4p h GLU 42 CO 0.00 -0.02 0.36 1.49 -0.73 0.00 0.00 179.01 180.11 2k4p h GLU 43 N -0.03 0.00 -0.48 1.92 4.22 -1.80 0.10 114.58 118.52 2k4p h GLU 43 Ca 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.42 2k4p h GLU 43 Cb 0.03 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 2k4p h GLU 43 CO -0.01 0.00 0.20 0.78 -2.18 0.00 0.00 179.01 177.80 2k4p h GLY 44 N 0.00 0.73 0.00 1.92 0.00 -1.40 -1.69 103.07 102.63 2k4p h GLY 44 Ca 0.17 -0.34 -0.08 0.00 0.00 0.00 0.00 47.33 47.07 2k4p h GLY 44 CO -0.00 0.33 -2.08 1.04 0.00 0.00 0.00 176.54 175.83 2k4p n LEU 45 N -4.37 0.00 0.08 3.11 4.32 -0.02 -4.32 117.00 115.80 2k4p n LEU 45 Ca 0.04 0.00 -0.04 0.00 -0.02 0.00 0.00 56.01 55.99 2k4p n LEU 45 Cb 0.14 0.11 0.16 0.00 -1.62 0.00 0.00 43.42 42.22 2k4p n LEU 45 CO 0.37 0.11 0.56 0.58 -1.22 0.00 0.00 177.39 177.80 2k4p h VAL 46 N 0.00 1.34 -1.25 4.08 2.07 -0.73 -0.58 116.25 121.17 2k4p h VAL 46 Ca -0.13 -1.73 -0.56 0.00 0.82 0.00 0.00 66.70 65.10 2k4p h VAL 46 Cb 1.28 1.81 -0.20 0.00 -1.52 0.00 0.00 31.29 32.66 2k4p h VAL 46 CO 0.01 0.52 0.56 1.57 0.02 0.00 0.00 177.57 180.25 2k4p n HIS 47 N -3.96 1.96 0.00 1.57 -0.00 -0.65 -4.02 115.22 110.12 2k4p n HIS 47 Ca -0.02 -2.06 0.00 0.00 -0.00 0.00 0.00 57.72 55.64 2k4p n HIS 47 Cb 0.55 -1.32 0.00 0.00 -0.00 0.00 0.00 29.99 29.22 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 0.47 0.00 0.00 0.26 5.15 -1.20 -5.02 115.26 114.92 2k4p n ASN 48 Ca 0.49 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.47 2k4p n ASN 48 Cb 0.48 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.73 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 -1.35 0.00 1.76 8.20 0.00 -1.12 -5.06 105.19 107.63 2k4p n GLY 49 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 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 0.57 -1.25 1.61 7.02 -0.24 -4.79 117.44 120.36 2k4p n TRP 50 Ca 0.00 -1.24 -0.11 0.00 -1.02 0.00 0.00 57.50 55.12 2k4p n TRP 50 Cb 0.00 -0.20 0.22 0.00 -2.42 0.00 0.00 31.31 28.91 2k4p n TRP 50 CO 0.00 0.00 0.00 -0.40 -2.02 0.00 0.00 177.69 175.27 2k4p n ASP 51 N -0.15 3.57 0.00 -0.99 5.75 -1.26 -4.22 116.55 119.25 2k4p n ASP 51 Ca 0.12 -3.54 0.00 0.00 -0.01 0.00 0.00 54.79 51.35 2k4p n ASP 51 Cb 0.97 -0.73 0.00 0.00 -1.03 0.00 0.00 41.12 40.33 2k4p n ASP 51 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2k4p n ASP 52 N -0.89 0.33 0.00 -1.12 8.00 -1.26 -4.81 116.55 116.80 2k4p n ASP 52 Ca 0.45 -0.66 0.00 0.00 0.71 0.00 0.00 54.79 55.29 2k4p n ASP 52 Cb 1.35 0.60 0.00 0.00 -0.02 0.00 0.00 41.12 43.05 2k4p n ASP 52 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2k4p n LEU 53 N -0.60 0.00 -0.27 0.64 4.77 -1.26 -4.16 117.00 116.13 2k4p n LEU 53 Ca 0.00 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.04 2k4p n LEU 53 Cb 0.01 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.27 2k4p n LEU 53 CO 0.00 0.00 0.83 -0.33 -1.33 0.00 0.00 177.39 176.56 2k4p h GLU 54 N 0.00 0.10 -0.66 3.23 5.08 -1.96 0.33 114.58 120.71 2k4p h GLU 54 Ca 0.00 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 2k4p h GLU 54 Cb 0.00 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 2k4p h GLU 54 CO 0.00 0.07 0.14 0.74 -1.00 0.00 0.00 179.01 178.96 2k4p h PHE 55 N 0.10 1.09 0.00 4.33 -1.00 -1.95 -1.95 116.94 117.57 2k4p h PHE 55 Ca 0.44 -0.13 0.00 0.00 2.81 0.00 0.00 57.97 61.09 2k4p h PHE 55 Cb 0.78 -0.31 0.00 0.00 3.61 0.00 0.00 35.95 40.03 2k4p h PHE 55 CO -0.42 0.90 0.00 1.25 -1.61 0.00 0.00 178.31 178.43 2k4p h LEU 56 N 0.99 0.00 -0.52 1.54 6.46 -0.71 -1.28 115.31 121.80 2k4p h LEU 56 Ca 0.21 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.97 2k4p h LEU 56 Cb 0.37 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.30 2k4p h LEU 56 CO 0.00 0.00 0.00 -1.54 -0.62 0.00 0.00 178.44 176.28 2k4p n SER 57 N -2.70 0.54 -0.33 1.25 3.41 -0.55 -2.05 113.62 113.18 2k4p n SER 57 Ca -0.01 0.63 0.07 0.00 -0.26 0.00 0.00 58.87 59.30 2k4p n SER 57 Cb 0.14 -0.74 -0.00 0.00 -0.26 0.00 0.00 64.21 63.35 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 -2.09 1.53 -4.58 4.04 -0.08 -0.49 -5.02 116.55 109.87 2k4p n ASP 58 Ca 0.03 -1.27 -0.42 0.00 -1.51 0.00 0.00 54.79 51.62 2k4p n ASP 58 Cb 0.23 0.46 0.01 0.00 2.34 0.00 0.00 41.12 44.16 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 -0.14 2.33 -2.41 5.18 3.06 -0.87 -5.00 119.36 121.51 2k4p n ILE 59 Ca 0.06 -0.50 -0.10 0.00 -2.50 0.00 0.00 62.75 59.71 2k4p n ILE 59 Cb 0.31 -1.03 0.05 0.00 0.54 0.00 0.00 39.64 39.51 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 -0.53 0.00 0.08 9.51 -2.24 -1.26 -5.00 114.28 114.84 2k4p n THR 60 Ca 0.10 -0.67 -0.12 0.00 -2.27 0.00 0.00 64.05 61.09 2k4p n THR 60 Cb 0.39 -1.17 -0.05 0.00 -2.10 0.00 0.00 70.33 67.40 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 0.30 0.08 -0.78 5.08 -1.96 -3.28 114.58 114.01 2k4p h GLU 61 Ca -0.14 -0.36 -0.26 0.00 -1.00 0.00 0.00 59.36 57.60 2k4p h GLU 61 Cb 0.52 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 2k4p h GLU 61 CO 0.15 1.08 -1.25 0.93 -1.00 0.00 0.00 179.01 178.91 2k4p h GLU 62 N 0.15 0.16 -0.55 2.33 4.39 -1.97 -3.28 114.58 115.82 2k4p h GLU 62 Ca -0.08 -0.28 0.15 0.00 0.34 0.00 0.00 59.36 59.50 2k4p h GLU 62 Cb 1.64 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 30.37 2k4p h GLU 62 CO 0.16 1.08 0.39 -0.44 -1.16 0.00 0.00 179.01 179.04 2k4p h ASP 63 N 0.04 0.04 -0.60 1.42 5.19 -1.95 0.29 116.42 120.86 2k4p h ASP 63 Ca -0.13 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.29 2k4p h ASP 63 Cb 1.92 -0.01 -0.03 0.00 0.18 0.00 0.00 39.33 41.39 2k4p h ASP 63 CO 0.16 0.02 0.39 -0.07 -3.12 0.00 0.00 179.24 176.62 2k4p h LEU 64 N 0.05 0.70 -0.92 1.55 3.38 -1.63 -1.84 115.31 116.59 2k4p h LEU 64 Ca 0.26 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.12 2k4p h LEU 64 Cb 0.98 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 2k4p h LEU 64 CO -0.01 0.52 -0.17 -0.33 0.09 0.00 0.00 178.44 178.53 2k4p h GLU 65 N 0.82 0.60 -0.12 1.13 5.08 -0.45 0.20 114.58 121.83 2k4p h GLU 65 Ca 0.22 -0.20 0.03 0.00 -1.00 0.00 0.00 59.36 58.41 2k4p h GLU 65 Cb -0.07 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.13 2k4p h GLU 65 CO -0.05 0.74 0.11 0.93 -1.00 0.00 0.00 179.01 179.75 2k4p h GLU 66 N 0.54 0.00 -0.02 2.33 4.39 -1.31 0.24 114.58 120.75 2k4p h GLU 66 Ca 0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.79 2k4p h GLU 66 Cb 0.60 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 2k4p h GLU 66 CO 0.04 0.00 -0.12 0.00 -1.16 0.00 0.00 179.01 177.77 2k4p n ALA 67 N -2.41 2.78 0.00 3.43 0.00 -0.95 -4.91 120.51 118.45 2k4p n ALA 67 Ca -0.00 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.91 2k4p n ALA 67 Cb 0.22 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.66 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 1.29 0.66 3.57 0.00 0.00 0.84 -4.19 105.19 107.36 2k4p n GLY 68 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.00 3.96 -0.40 1.61 1.01 0.65 -4.76 120.40 120.46 2k4p s VAL 69 Ca 0.00 -1.19 0.05 0.00 0.00 0.00 0.00 61.98 60.84 2k4p s VAL 69 Cb 0.00 -5.04 0.45 0.00 0.00 0.00 0.00 36.38 31.79 2k4p s VAL 69 CO 0.00 -1.89 1.38 0.00 0.00 0.00 0.00 175.10 174.60 2k4p n GLN 70 N 8.68 3.38 -4.35 2.72 10.64 -1.26 -2.22 117.38 134.96 2k4p n GLN 70 Ca 0.40 -4.01 -0.26 0.00 -1.83 0.00 0.00 57.00 51.30 2k4p n GLN 70 Cb 0.49 -2.28 -0.12 0.00 -0.86 0.00 0.00 30.24 27.47 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 -3.14 3.00 -0.01 2.61 1.11 -1.26 -5.05 116.67 113.92 2k4p s ASP 71 Ca 0.54 -0.77 -0.25 0.00 0.18 0.00 0.00 52.55 52.25 2k4p s ASP 71 Cb 0.43 -0.19 -0.19 0.00 1.07 0.00 0.00 42.92 44.03 2k4p s ASP 71 CO -0.01 0.10 1.28 1.55 1.18 0.00 0.00 175.17 179.27 2k4p h PRO 72 N 3.73 0.05 0.00 8.23 0.13 -1.98 0.12 132.00 142.28 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 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 2k4p h PRO 72 CO 0.42 0.53 -0.13 0.00 -0.23 0.00 0.00 178.00 178.59 2k4p h ALA 73 N 0.53 1.06 0.10 -0.56 0.00 -1.98 -1.38 119.26 117.02 2k4p h ALA 73 Ca 0.00 -0.12 -0.32 0.00 0.00 0.00 0.00 54.91 54.48 2k4p h ALA 73 Cb 0.52 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2k4p h ALA 73 CO 0.01 0.17 -1.66 0.45 0.00 0.00 0.00 179.25 178.21 2k4p h HIS 74 N 0.00 0.40 -0.10 0.00 3.86 -1.97 -3.02 115.15 114.32 2k4p h HIS 74 Ca -0.00 -0.29 -0.19 0.00 -1.16 0.00 0.00 60.37 58.73 2k4p h HIS 74 Cb 0.58 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 29.03 2k4p h HIS 74 CO 0.00 1.42 -0.71 0.87 0.86 0.00 0.00 177.93 180.37 2k4p h LYS 75 N 0.06 0.47 0.00 2.45 1.57 -0.60 -2.94 116.57 117.58 2k4p h LYS 75 Ca -0.29 -0.37 0.00 0.00 -1.87 0.00 0.00 60.65 58.12 2k4p h LYS 75 Cb 2.02 0.07 0.00 0.00 0.08 0.00 0.00 32.23 34.41 2k4p h LYS 75 CO 0.14 1.00 0.00 -0.09 -0.57 0.00 0.00 179.45 179.93 2k4p h ARG 76 N 0.33 0.00 0.10 3.15 9.65 -1.39 -3.24 114.38 122.97 2k4p h ARG 76 Ca -0.03 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.85 2k4p h ARG 76 Cb 1.29 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.87 2k4p h ARG 76 CO 0.13 0.00 -0.05 1.25 2.80 0.00 0.00 179.97 184.10 2k4p h LEU 77 N 0.00 -0.11 -0.35 3.80 7.12 -1.41 -3.16 115.31 121.19 2k4p h LEU 77 Ca 0.00 -0.47 0.07 0.00 0.13 0.00 0.00 57.88 57.62 2k4p h LEU 77 Cb 0.90 0.03 -0.07 0.00 -0.53 0.00 0.00 40.66 40.99 2k4p h LEU 77 CO 0.00 0.50 -0.15 -0.07 -0.13 0.00 0.00 178.44 178.59 2k4p h LEU 78 N -0.82 -0.50 -1.40 2.25 3.38 -1.61 0.33 115.31 116.94 2k4p h LEU 78 Ca -0.01 0.13 0.22 0.00 0.09 0.00 0.00 57.88 58.30 2k4p h LEU 78 Cb 0.57 0.29 -0.08 0.00 0.09 0.00 0.00 40.66 41.53 2k4p h LEU 78 CO 0.02 -0.18 0.63 -0.07 0.09 0.00 0.00 178.44 178.93 2k4p h LEU 79 N -0.08 0.47 0.25 1.67 4.07 -1.66 0.11 115.31 120.14 2k4p h LEU 79 Ca 0.18 0.06 -0.33 0.00 0.08 0.00 0.00 57.88 57.87 2k4p h LEU 79 Cb 0.35 -0.02 0.04 0.00 1.08 0.00 0.00 40.66 42.10 2k4p h LEU 79 CO -0.41 0.16 -1.44 -0.78 -1.08 0.00 0.00 178.44 174.89 2k4p h ASP 80 N 0.45 0.83 0.11 -0.43 1.82 -0.93 -3.28 116.42 115.00 2k4p h ASP 80 Ca 0.52 -0.92 -0.02 0.00 -0.39 0.00 0.00 57.03 56.22 2k4p h ASP 80 Cb 1.24 -0.27 -0.00 0.00 0.68 0.00 0.00 39.33 40.97 2k4p h ASP 80 CO -0.24 1.70 -0.10 0.74 -1.61 0.00 0.00 179.24 179.73 2k4p h THR 81 N 0.11 1.00 0.23 2.25 2.02 0.13 -0.98 112.91 117.68 2k4p h THR 81 Ca -0.25 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.58 2k4p h THR 81 Cb 2.14 1.19 0.00 0.00 -1.74 0.00 0.00 68.15 69.74 2k4p h THR 81 CO 0.27 0.09 -0.11 -0.07 0.37 0.00 0.00 175.52 176.08 2k4p h LEU 82 N 0.00 -0.26 -1.28 2.58 3.38 -0.93 -2.54 115.31 116.25 2k4p h LEU 82 Ca -0.00 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 2k4p h LEU 82 Cb 0.18 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2k4p h LEU 82 CO 0.01 0.01 -0.27 0.06 0.09 0.00 0.00 178.44 178.34 2k4p h GLN 83 N -0.54 0.00 0.90 1.13 3.07 -1.58 -3.24 115.11 114.86 2k4p h GLN 83 Ca -0.03 0.00 -0.04 0.00 0.09 0.00 0.00 58.65 58.66 2k4p h GLN 83 Cb 0.40 0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.97 2k4p h GLN 83 CO 0.05 0.27 -0.43 1.25 0.09 0.00 0.00 178.83 180.07 2k4p h LEU 84 N 0.00 -1.02 -6.52 0.06 5.85 -1.01 -3.30 115.31 109.37 2k4p h LEU 84 Ca -0.00 0.03 -0.65 0.00 0.84 0.00 0.00 57.88 58.10 2k4p h LEU 84 Cb 0.68 0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 2k4p h LEU 84 CO 0.04 -0.68 2.55 -1.54 -0.34 0.00 0.00 178.44 178.47 2k4p n SER 85 N -5.58 3.37 -0.47 1.25 3.41 -0.97 -5.10 113.62 109.52 2k4p n SER 85 Ca -0.15 -2.77 0.14 0.00 -0.26 0.00 0.00 58.87 55.83 2k4p n SER 85 Cb 0.48 -1.45 0.53 0.00 -0.26 0.00 0.00 64.21 63.50 2k4p n SER 85 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05