#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 2.94 0.07 0.23 0.00 -1.26 -5.05 105.19 102.12 2k4p n GLY 23 Ca 0.00 -0.55 -0.14 0.00 0.00 0.00 0.00 46.02 45.33 2k4p n GLY 23 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2k4p h LEU 24 N 0.00 0.03 0.00 0.99 7.12 -2.07 -3.50 115.31 117.88 2k4p h LEU 24 Ca 0.00 -0.91 0.00 0.00 0.13 0.00 0.00 57.88 57.10 2k4p h LEU 24 Cb 0.00 -0.01 0.00 0.00 -0.53 0.00 0.00 40.66 40.12 2k4p h LEU 24 CO 0.00 0.93 0.00 0.61 -0.13 0.00 0.00 178.44 179.85 2k4p n GLY 25 N 1.36 -1.18 2.86 3.75 0.00 -1.26 -4.61 105.19 106.12 2k4p n GLY 25 Ca -0.10 -1.66 -0.30 0.00 0.00 0.00 0.00 46.02 43.96 2k4p n GLY 25 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k4p s GLU 26 N 0.00 1.35 -0.69 1.61 2.12 -1.26 -4.87 118.70 116.96 2k4p s GLU 26 Ca 0.00 -1.87 -0.00 0.00 0.36 0.00 0.00 54.97 53.46 2k4p s GLU 26 Cb 0.00 -2.73 0.00 0.00 0.26 0.00 0.00 34.13 31.66 2k4p s GLU 26 CO 0.00 -1.04 0.65 0.00 -0.54 0.00 0.00 175.26 174.33 2k4p n ALA 27 N 3.99 -2.44 -0.44 6.30 0.00 -1.26 -5.01 120.51 121.65 2k4p n ALA 27 Ca 0.04 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2k4p n ALA 27 Cb 0.38 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.41 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 -1.71 0.11 0.21 0.00 0.00 -1.26 -4.07 105.19 98.47 2k4p n GLY 28 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.92 -3.13 114.93 111.49 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 -2.73 0.00 0.05 -0.10 7.64 -1.26 -3.15 113.62 114.07 2k4p n SER 30 Ca 0.02 0.65 0.22 0.00 1.01 0.00 0.00 58.87 60.76 2k4p n SER 30 Cb 0.31 -0.26 0.71 0.00 -1.01 0.00 0.00 64.21 63.97 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 2.24 -0.80 -0.43 0.00 -1.71 0.19 119.26 116.75 2k4p h ALA 31 Ca 0.00 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.97 2k4p h ALA 31 Cb 0.00 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.76 2k4p h ALA 31 CO 0.00 -0.80 0.47 2.35 0.00 0.00 0.00 179.25 181.27 2k4p h TRP 32 N 0.00 0.85 0.00 0.00 7.01 -1.51 0.38 115.95 122.69 2k4p h TRP 32 Ca 0.24 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.27 2k4p h TRP 32 Cb 1.31 -0.27 0.00 0.00 -2.10 0.00 0.00 29.16 28.11 2k4p h TRP 32 CO 0.00 0.39 0.00 1.28 -2.79 0.00 0.00 178.44 177.32 2k4p n LEU 33 N -4.72 0.76 0.22 0.65 4.77 0.05 -3.11 117.00 115.62 2k4p n LEU 33 Ca 0.12 0.58 0.10 0.00 -0.03 0.00 0.00 56.01 56.78 2k4p n LEU 33 Cb 0.23 -0.35 0.38 0.00 -2.33 0.00 0.00 43.42 41.35 2k4p n LEU 33 CO 0.28 -0.20 0.77 0.03 -1.33 0.00 0.00 177.39 176.94 2k4p h ARG 34 N 0.00 0.00 0.00 3.23 -0.00 -0.84 0.23 114.38 117.00 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 0.70 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.67 2k4p h ARG 34 CO 0.00 0.21 0.00 0.00 0.00 0.00 0.00 179.97 180.18 2k4p h ALA 35 N 1.79 1.00 0.00 0.04 0.00 -1.44 -2.93 119.26 117.72 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 0.86 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2k4p h ALA 35 CO 0.03 0.00 0.00 0.44 0.00 0.00 0.00 179.25 179.72 2k4p n ILE 36 N -2.94 0.00 -3.06 0.00 -5.35 -1.09 -5.03 119.36 101.89 2k4p n ILE 36 Ca 0.00 -0.41 -0.13 0.00 -0.27 0.00 0.00 62.75 61.94 2k4p n ILE 36 Cb 0.24 1.15 0.07 0.00 -1.74 0.00 0.00 39.64 39.35 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 0.14 -0.16 1.08 3.28 0.00 -0.21 -4.95 105.19 104.38 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 0.91 0.12 0.99 7.94 -0.10 -4.83 117.00 118.72 2k4p n LEU 38 Ca -0.21 -1.92 0.11 0.00 -1.11 0.00 0.00 56.01 52.88 2k4p n LEU 38 Cb 0.63 -0.06 0.48 0.00 0.53 0.00 0.00 43.42 45.00 2k4p n LEU 38 CO 0.45 0.51 0.82 -1.84 -1.11 0.00 0.00 177.39 176.23 2k4p n GLU 39 N 0.14 0.16 0.30 1.96 -0.00 -1.22 -2.35 120.64 119.62 2k4p n GLU 39 Ca 0.06 0.47 0.16 0.00 -0.00 0.00 0.00 57.16 57.85 2k4p n GLU 39 Cb 0.96 -1.85 0.95 0.00 -0.00 0.00 0.00 31.44 31.50 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 -0.23 3.44 3.08 -1.92 0.22 114.38 118.97 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 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 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 -3.73 0.30 0.00 3.04 4.01 -0.99 -4.51 117.16 115.27 2k4p n TYR 41 Ca -0.03 -0.15 -0.01 0.00 -0.16 0.00 0.00 57.90 57.56 2k4p n TYR 41 Cb 0.11 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.13 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 2.92 -0.03 -0.33 -0.72 4.22 -0.73 -0.08 114.58 119.84 2k4p h GLU 42 Ca 0.00 0.00 0.10 0.00 0.08 0.00 0.00 59.36 59.54 2k4p h GLU 42 Cb 0.64 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 2k4p h GLU 42 CO 0.00 -0.02 0.36 1.49 -2.18 0.00 0.00 179.01 178.66 2k4p h GLU 43 N -0.03 0.00 -0.36 1.92 4.81 -1.79 0.31 114.58 119.45 2k4p h GLU 43 Ca 0.00 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.15 2k4p h GLU 43 Cb 0.03 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 2k4p h GLU 43 CO -0.02 0.00 -0.11 0.78 -0.73 0.00 0.00 179.01 178.93 2k4p h GLY 44 N 0.00 0.66 0.08 1.92 0.00 -1.27 -1.98 103.07 102.49 2k4p h GLY 44 Ca 0.16 -0.47 -0.09 0.00 0.00 0.00 0.00 47.33 46.93 2k4p h GLY 44 CO -0.00 0.43 -2.01 1.04 0.00 0.00 0.00 176.54 176.00 2k4p n LEU 45 N -4.19 0.07 0.12 3.11 4.77 0.05 -4.25 117.00 116.69 2k4p n LEU 45 Ca 0.01 0.03 -0.03 0.00 -0.03 0.00 0.00 56.01 55.99 2k4p n LEU 45 Cb 0.33 0.11 0.14 0.00 -2.33 0.00 0.00 43.42 41.67 2k4p n LEU 45 CO 0.41 0.10 0.47 0.58 -1.33 0.00 0.00 177.39 177.63 2k4p h VAL 46 N 0.00 1.43 -0.26 4.08 2.07 -0.43 0.27 116.25 123.41 2k4p h VAL 46 Ca -0.12 -2.12 0.00 0.00 0.82 0.00 0.00 66.70 65.28 2k4p h VAL 46 Cb 1.29 2.12 0.00 0.00 -1.52 0.00 0.00 31.29 33.18 2k4p h VAL 46 CO 0.01 0.61 0.00 1.57 0.02 0.00 0.00 177.57 179.78 2k4p n HIS 47 N -3.81 0.35 -0.00 1.57 -0.00 -0.75 -3.68 115.22 108.89 2k4p n HIS 47 Ca -0.02 -0.17 0.00 0.00 -0.00 0.00 0.00 57.72 57.53 2k4p n HIS 47 Cb 0.63 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 30.60 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 0.33 4.60 0.00 0.26 5.15 -1.05 -5.03 115.26 119.53 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 0.27 0.81 0.00 0.00 -0.53 0.00 0.00 39.78 40.32 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 2.65 0.96 0.63 8.20 0.00 -0.82 -5.05 105.19 111.77 2k4p n GLY 49 Ca -0.01 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.06 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 1.06 1.61 7.02 0.90 -4.72 117.44 123.31 2k4p n TRP 50 Ca 0.00 -0.97 0.05 0.00 -1.02 0.00 0.00 57.50 55.57 2k4p n TRP 50 Cb 0.00 -0.18 0.15 0.00 -2.42 0.00 0.00 31.31 28.86 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 -0.72 1.59 -4.06 -0.99 5.68 -1.26 -4.63 116.55 112.16 2k4p n ASP 51 Ca 0.13 -1.98 -0.32 0.00 -0.50 0.00 0.00 54.79 52.11 2k4p n ASP 51 Cb 0.77 -0.19 -0.14 0.00 -1.14 0.00 0.00 41.12 40.41 2k4p n ASP 51 CO 0.00 0.00 0.00 1.51 -1.33 0.00 0.00 177.20 177.38 2k4p s ASP 52 N -1.03 4.76 1.14 -1.12 -4.77 -1.26 -4.89 116.67 109.50 2k4p s ASP 52 Ca 0.21 -1.86 -0.18 0.00 -3.30 0.00 0.00 52.55 47.42 2k4p s ASP 52 Cb 0.11 -1.64 0.16 0.00 -1.09 0.00 0.00 42.92 40.46 2k4p s ASP 52 CO 0.14 -0.34 0.23 0.18 0.70 0.00 0.00 175.17 176.08 2k4p n LEU 53 N 4.38 -1.97 0.00 2.11 4.77 -1.26 -2.97 117.00 122.05 2k4p n LEU 53 Ca -0.03 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 2k4p n LEU 53 Cb 0.42 -0.95 0.00 0.00 -2.33 0.00 0.00 43.42 40.56 2k4p n LEU 53 CO 0.24 -3.26 0.00 -0.62 -1.33 0.00 0.00 177.39 172.42 2k4p n GLU 54 N -2.64 -0.93 0.00 3.23 4.71 -1.26 -4.68 120.64 119.07 2k4p n GLU 54 Ca 0.03 0.23 0.00 0.00 -0.01 0.00 0.00 57.16 57.41 2k4p n GLU 54 Cb 0.56 -4.18 0.00 0.00 -1.01 0.00 0.00 31.44 26.81 2k4p n GLU 54 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 2k4p n PHE 55 N -2.23 0.00 0.25 -0.32 7.35 -1.16 -4.65 117.46 116.70 2k4p n PHE 55 Ca 0.00 0.00 0.14 0.00 -0.76 0.00 0.00 57.45 56.83 2k4p n PHE 55 Cb 0.23 0.00 0.51 0.00 0.35 0.00 0.00 39.48 40.58 2k4p n PHE 55 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2k4p h LEU 56 N 0.00 0.00 -0.00 -2.13 4.07 -1.84 -2.77 115.31 112.64 2k4p h LEU 56 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2k4p h LEU 56 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 2k4p h LEU 56 CO 0.00 0.06 0.00 -1.20 -1.08 0.00 0.00 178.44 176.22 2k4p n SER 57 N -3.15 0.00 -0.00 -0.43 7.64 -1.26 -1.82 113.62 114.59 2k4p n SER 57 Ca 0.01 0.50 0.08 0.00 1.01 0.00 0.00 58.87 60.47 2k4p n SER 57 Cb 0.39 -0.50 -0.10 0.00 -1.01 0.00 0.00 64.21 62.98 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 -1.50 1.04 -4.57 6.43 2.03 -1.05 -5.01 116.55 113.92 2k4p n ASP 58 Ca 0.03 -0.46 -0.41 0.00 0.52 0.00 0.00 54.79 54.47 2k4p n ASP 58 Cb 0.15 1.34 0.02 0.00 -0.72 0.00 0.00 41.12 41.90 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 -1.68 2.43 -2.63 5.18 3.06 -0.76 -5.00 119.36 119.96 2k4p n ILE 59 Ca 0.00 -0.50 -0.11 0.00 -2.50 0.00 0.00 62.75 59.64 2k4p n ILE 59 Cb 0.32 -1.00 0.05 0.00 0.54 0.00 0.00 39.64 39.55 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 -0.76 0.00 0.08 9.51 -2.24 -1.26 -5.00 114.28 114.60 2k4p n THR 60 Ca 0.10 -0.85 -0.14 0.00 -2.27 0.00 0.00 64.05 60.89 2k4p n THR 60 Cb 0.40 -1.01 -0.07 0.00 -2.10 0.00 0.00 70.33 67.56 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 0.38 0.00 -0.78 5.08 -1.97 -3.26 114.58 114.03 2k4p h GLU 61 Ca -0.15 -0.46 -0.18 0.00 -1.00 0.00 0.00 59.36 57.56 2k4p h GLU 61 Cb 0.62 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.98 2k4p h GLU 61 CO 0.18 1.14 -0.85 1.49 -1.00 0.00 0.00 179.01 179.97 2k4p h GLU 62 N 0.19 0.00 0.00 2.33 4.81 -1.96 -3.22 114.58 116.73 2k4p h GLU 62 Ca -0.10 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.13 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 0.85 -0.01 -0.44 -0.73 0.00 0.00 179.01 178.86 2k4p h ASP 63 N 0.00 0.00 -0.44 1.04 3.32 -1.95 -1.63 116.42 116.76 2k4p h ASP 63 Ca -0.01 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.97 2k4p h ASP 63 Cb 1.63 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.15 2k4p h ASP 63 CO 0.11 0.01 0.03 -0.07 -1.72 0.00 0.00 179.24 177.60 2k4p h LEU 64 N 0.00 0.79 -0.86 1.55 3.38 -1.62 -2.70 115.31 115.85 2k4p h LEU 64 Ca -0.00 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 57.69 2k4p h LEU 64 Cb 0.02 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2k4p h LEU 64 CO 0.00 0.84 -0.20 -0.33 0.09 0.00 0.00 178.44 178.84 2k4p h GLU 65 N 0.77 0.62 -0.02 1.13 5.08 -0.66 0.26 114.58 121.76 2k4p h GLU 65 Ca 0.15 -0.23 0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2k4p h GLU 65 Cb 0.43 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 2k4p h GLU 65 CO 0.02 0.79 0.06 0.93 -1.00 0.00 0.00 179.01 179.80 2k4p h GLU 66 N 0.55 0.00 -0.02 2.33 3.07 -1.35 0.24 114.58 119.40 2k4p h GLU 66 Ca 0.08 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.94 2k4p h GLU 66 Cb 0.66 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.57 2k4p h GLU 66 CO 0.05 0.00 -0.17 0.00 -1.40 0.00 0.00 179.01 177.49 2k4p n ALA 67 N -2.14 2.85 0.00 3.43 0.00 -0.93 -4.93 120.51 118.80 2k4p n ALA 67 Ca -0.02 -0.67 0.00 0.00 0.00 0.00 0.00 53.44 52.75 2k4p n ALA 67 Cb 0.13 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 18.77 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 1.37 0.68 3.46 0.00 0.00 0.86 -4.19 105.19 107.38 2k4p n GLY 68 Ca 0.12 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 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 4.80 -0.37 1.61 1.01 0.86 -4.80 120.40 121.51 2k4p s VAL 69 Ca 0.00 -1.97 0.05 0.00 0.00 0.00 0.00 61.98 60.06 2k4p s VAL 69 Cb 0.00 -4.85 0.45 0.00 0.00 0.00 0.00 36.38 31.98 2k4p s VAL 69 CO 0.00 -1.58 1.31 0.00 0.00 0.00 0.00 175.10 174.83 2k4p n GLN 70 N 6.33 3.46 -4.39 2.72 6.02 -1.26 -2.00 117.38 128.27 2k4p n GLN 70 Ca 0.30 -4.08 -0.27 0.00 -0.01 0.00 0.00 57.00 52.94 2k4p n GLN 70 Cb 0.47 -2.28 -0.12 0.00 1.02 0.00 0.00 30.24 29.32 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 -3.31 3.23 -0.02 1.08 1.11 -1.26 -5.05 116.67 112.44 2k4p s ASP 71 Ca 0.53 -0.79 -0.26 0.00 0.18 0.00 0.00 52.55 52.21 2k4p s ASP 71 Cb 0.42 -0.22 -0.20 0.00 1.07 0.00 0.00 42.92 43.99 2k4p s ASP 71 CO -0.00 0.13 1.27 1.55 1.18 0.00 0.00 175.17 179.30 2k4p h PRO 72 N 3.63 -0.00 0.00 8.23 0.13 -1.98 0.12 132.00 142.13 2k4p h PRO 72 Ca -0.48 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.63 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 0.43 0.48 -0.08 0.00 -0.23 0.00 0.00 178.00 178.60 2k4p h ALA 73 N 0.51 1.02 0.04 -0.56 0.00 -1.98 -1.92 119.26 116.37 2k4p h ALA 73 Ca -0.00 -0.08 -0.29 0.00 0.00 0.00 0.00 54.91 54.54 2k4p h ALA 73 Cb 0.49 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2k4p h ALA 73 CO 0.00 0.11 -1.62 0.45 0.00 0.00 0.00 179.25 178.19 2k4p h HIS 74 N 0.00 0.17 -0.05 0.00 3.86 -1.97 -3.06 115.15 114.10 2k4p h HIS 74 Ca -0.00 -0.12 -0.21 0.00 -1.16 0.00 0.00 60.37 58.87 2k4p h HIS 74 Cb 0.61 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.07 2k4p h HIS 74 CO 0.00 1.20 -0.85 0.87 0.86 0.00 0.00 177.93 180.01 2k4p h LYS 75 N 0.03 0.48 0.00 2.45 1.57 -0.59 -2.99 116.57 117.51 2k4p h LYS 75 Ca -0.26 -0.45 0.00 0.00 -1.87 0.00 0.00 60.65 58.07 2k4p h LYS 75 Cb 1.99 0.11 0.00 0.00 0.08 0.00 0.00 32.23 34.41 2k4p h LYS 75 CO 0.11 1.09 0.00 -0.09 -0.57 0.00 0.00 179.45 179.99 2k4p h ARG 76 N 0.30 0.00 0.10 3.15 2.43 -1.49 -3.18 114.38 115.68 2k4p h ARG 76 Ca -0.06 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.10 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 0.15 0.00 -0.05 1.25 -1.51 0.00 0.00 179.97 179.82 2k4p h LEU 77 N 0.00 -0.11 -0.17 3.80 7.12 -1.47 -3.03 115.31 121.45 2k4p h LEU 77 Ca 0.00 -0.48 0.04 0.00 0.13 0.00 0.00 57.88 57.57 2k4p h LEU 77 Cb 0.91 0.03 -0.04 0.00 -0.53 0.00 0.00 40.66 41.03 2k4p h LEU 77 CO 0.00 0.51 -0.09 0.25 -0.13 0.00 0.00 178.44 178.98 2k4p h LEU 78 N -0.82 -0.29 -1.03 2.25 5.85 -1.61 0.40 115.31 120.05 2k4p h LEU 78 Ca -0.01 0.07 0.19 0.00 0.84 0.00 0.00 57.88 58.97 2k4p h LEU 78 Cb 0.58 0.16 -0.10 0.00 0.37 0.00 0.00 40.66 41.67 2k4p h LEU 78 CO 0.02 -0.12 0.61 -0.07 -0.34 0.00 0.00 178.44 178.55 2k4p h LEU 79 N -0.07 0.77 -0.45 2.25 3.38 -1.66 0.19 115.31 119.72 2k4p h LEU 79 Ca 0.10 0.09 -0.18 0.00 0.09 0.00 0.00 57.88 57.98 2k4p h LEU 79 Cb 0.22 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2k4p h LEU 79 CO -0.22 0.28 -0.74 -0.78 0.09 0.00 0.00 178.44 177.07 2k4p h ASP 80 N 0.76 0.34 1.10 -0.43 1.82 -1.17 -3.05 116.42 115.77 2k4p h ASP 80 Ca 0.57 -0.23 -0.03 0.00 -0.39 0.00 0.00 57.03 56.95 2k4p h ASP 80 Cb 0.91 -0.10 -0.00 0.00 0.68 0.00 0.00 39.33 40.81 2k4p h ASP 80 CO -0.37 0.96 -0.16 0.74 -1.61 0.00 0.00 179.24 178.80 2k4p h THR 81 N 0.19 0.38 0.55 2.25 2.02 0.14 -2.83 112.91 115.60 2k4p h THR 81 Ca -0.03 -1.02 -0.03 0.00 0.77 0.00 0.00 66.41 66.10 2k4p h THR 81 Cb 1.30 1.77 0.01 0.00 -1.74 0.00 0.00 68.15 69.49 2k4p h THR 81 CO 0.12 0.16 -0.27 -0.07 0.37 0.00 0.00 175.52 175.83 2k4p h LEU 82 N 0.00 -0.63 -1.48 2.58 3.38 -0.74 -2.61 115.31 115.81 2k4p h LEU 82 Ca -0.00 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 2k4p h LEU 82 Cb 0.75 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 2k4p h LEU 82 CO 0.02 -0.35 -0.21 1.56 0.09 0.00 0.00 178.44 179.56 2k4p h GLN 83 N -0.89 0.00 0.37 1.13 4.20 -1.64 0.43 115.11 118.70 2k4p h GLN 83 Ca -0.08 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 2k4p h GLN 83 Cb 0.62 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.41 2k4p h GLN 83 CO 0.12 0.21 -0.18 1.25 -0.67 0.00 0.00 178.83 179.57 2k4p h LEU 84 N 0.00 -0.42 -3.85 1.46 5.85 -1.31 -3.28 115.31 113.76 2k4p h LEU 84 Ca -0.00 0.01 -0.59 0.00 0.84 0.00 0.00 57.88 58.15 2k4p h LEU 84 Cb 0.57 0.11 -0.33 0.00 0.37 0.00 0.00 40.66 41.37 2k4p h LEU 84 CO 0.03 -0.30 0.13 -1.20 -0.34 0.00 0.00 178.44 176.75 2k4p n SER 85 N -3.34 6.08 0.00 1.25 7.64 -1.00 -5.11 113.62 119.15 2k4p n SER 85 Ca -0.06 -3.77 0.00 0.00 1.01 0.00 0.00 58.87 56.05 2k4p n SER 85 Cb 0.20 -0.70 0.00 0.00 -1.01 0.00 0.00 64.21 62.70 2k4p n SER 85 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20