#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kff s PRO 36 N 0.00 2.71 -0.49 1.61 0.04 -1.26 -5.05 135.00 132.56 2kff s PRO 36 Ca 0.00 -0.13 -0.12 0.00 0.04 0.00 0.00 61.00 60.78 2kff s PRO 36 Cb 0.00 -2.27 0.11 0.00 0.04 0.00 0.00 34.50 32.39 2kff s PRO 36 CO 0.00 -0.83 0.40 -1.17 0.04 0.00 0.00 177.00 175.44 2kff s LEU 37 N -5.03 5.81 0.06 -3.56 2.96 -1.26 -5.06 118.68 112.61 2kff s LEU 37 Ca 0.55 -1.76 -0.20 0.00 -0.22 0.00 0.00 54.13 52.51 2kff s LEU 37 Cb -0.11 -2.10 -0.06 0.00 0.50 0.00 0.00 46.19 44.42 2kff s LEU 37 CO 0.44 -0.73 0.58 -0.83 -1.32 0.00 0.00 176.35 174.49 2kff s GLY 38 N 2.95 2.67 0.07 7.98 0.00 -1.26 -5.07 107.32 114.66 2kff s GLY 38 Ca 0.04 0.04 -0.18 0.00 0.00 0.00 0.00 44.72 44.63 2kff s GLY 38 CO 0.02 0.53 0.42 -0.56 0.00 0.00 0.00 173.10 173.50 2kff s SER 39 N -0.94 -0.28 -0.29 1.64 0.01 -1.26 -5.14 113.70 107.44 2kff s SER 39 Ca 0.29 -0.09 -0.19 0.00 1.31 0.00 0.00 55.95 57.28 2kff s SER 39 Cb -0.19 0.45 -0.02 0.00 0.21 0.00 0.00 66.02 66.47 2kff s SER 39 CO 0.19 -0.73 0.56 1.51 0.41 0.00 0.00 173.24 175.18 2kff s ASP 40 N -2.26 6.44 -1.17 2.44 -4.77 -1.26 -4.98 116.67 111.11 2kff s ASP 40 Ca -0.03 0.39 -0.09 0.00 -3.30 0.00 0.00 52.55 49.52 2kff s ASP 40 Cb 0.00 -2.30 0.23 0.00 -1.09 0.00 0.00 42.92 39.76 2kff s ASP 40 CO -0.05 -0.40 1.44 -0.67 0.70 0.00 0.00 175.17 176.19 2kff n ASP 41 N 5.72 5.55 -4.81 2.11 -0.08 -1.26 -5.01 116.55 118.77 2kff n ASP 41 Ca -0.03 -3.12 -0.38 0.00 -1.51 0.00 0.00 54.79 49.76 2kff n ASP 41 Cb 0.49 -1.43 -0.06 0.00 2.34 0.00 0.00 41.12 42.46 2kff n ASP 41 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2kff s VAL 42 N -0.46 5.12 -0.53 5.18 0.11 -1.26 -5.05 120.40 123.51 2kff s VAL 42 Ca 0.36 0.77 -0.19 0.00 -2.93 0.00 0.00 61.98 59.99 2kff s VAL 42 Cb -0.01 -3.69 0.07 0.00 -1.53 0.00 0.00 36.38 31.22 2kff s VAL 42 CO 0.00 0.52 0.66 -1.61 -3.33 0.00 0.00 175.10 171.34 2kff s GLU 43 N -0.64 3.11 -0.56 1.54 2.02 -1.26 -5.01 118.70 117.90 2kff s GLU 43 Ca 0.22 -0.98 -0.27 0.00 0.02 0.00 0.00 54.97 53.96 2kff s GLU 43 Cb -0.16 -4.14 0.03 0.00 0.10 0.00 0.00 34.13 29.97 2kff s GLU 43 CO 0.11 -1.31 1.12 -0.46 0.02 0.00 0.00 175.26 174.74 2kff s TRP 44 N 2.70 2.68 -1.89 1.61 -0.00 -1.26 -4.87 118.94 117.91 2kff s TRP 44 Ca 0.15 0.36 0.11 0.00 -0.00 0.00 0.00 56.10 56.71 2kff s TRP 44 Cb -0.20 -4.39 0.62 0.00 -0.00 0.00 0.00 33.47 29.49 2kff s TRP 44 CO 0.11 -1.48 1.11 1.33 -0.00 0.00 0.00 176.95 178.02 2kff n VAL 45 N 6.58 0.15 0.29 5.86 0.24 -1.26 -0.85 118.33 129.34 2kff n VAL 45 Ca 0.07 0.04 0.11 0.00 -2.04 0.00 0.00 64.34 62.52 2kff n VAL 45 Cb 0.49 -0.87 -0.04 0.00 -1.47 0.00 0.00 33.84 31.95 2kff n VAL 45 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 2kff n VAL 46 N -1.06 0.26 0.60 3.34 0.31 -1.26 -4.00 118.33 116.52 2kff n VAL 46 Ca 0.07 -0.40 0.09 0.00 -0.01 0.00 0.00 64.34 64.10 2kff n VAL 46 Cb 0.05 0.01 0.39 0.00 -0.91 0.00 0.00 33.84 33.37 2kff n VAL 46 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2kff n GLY 47 N 1.29 -1.15 0.09 2.92 0.00 -0.03 -2.53 105.19 105.77 2kff n GLY 47 Ca -0.00 -0.05 -0.05 0.00 0.00 0.00 0.00 46.02 45.93 2kff n GLY 47 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2kff h LYS 48 N 0.00 0.00 -0.52 1.61 2.10 -1.74 -3.32 116.57 114.71 2kff h LYS 48 Ca 0.00 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 58.33 2kff h LYS 48 Cb 0.32 0.00 -0.20 0.00 -0.90 0.00 0.00 32.23 31.46 2kff h LYS 48 CO 0.00 0.43 -0.11 -0.25 -2.00 0.00 0.00 179.45 177.53 2kff n ASP 49 N -3.00 3.56 -0.03 7.07 8.00 -1.12 -4.80 116.55 126.23 2kff n ASP 49 Ca -0.12 -3.79 -0.13 0.00 0.71 0.00 0.00 54.79 51.46 2kff n ASP 49 Cb 0.95 -0.62 -0.11 0.00 -0.02 0.00 0.00 41.12 41.32 2kff n ASP 49 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2kff h LYS 50 N 1.35 0.00 -0.54 -1.24 3.11 -1.59 -3.18 116.57 114.48 2kff h LYS 50 Ca 0.31 -0.00 0.16 0.00 -2.81 0.00 0.00 60.65 58.30 2kff h LYS 50 Cb 1.56 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 32.77 2kff h LYS 50 CO 0.62 0.62 0.40 -1.00 -2.81 0.00 0.00 179.45 177.28 2kff h PRO 51 N -0.62 0.00 -0.34 1.90 0.13 -1.87 0.41 132.00 131.61 2kff h PRO 51 Ca -0.00 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.96 2kff h PRO 51 Cb 0.62 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.75 2kff h PRO 51 CO 0.00 0.00 -0.44 1.15 -0.23 0.00 0.00 178.00 178.48 2kff h THR 52 N 0.00 1.28 0.00 1.56 2.02 -1.94 -1.85 112.91 113.98 2kff h THR 52 Ca 0.26 -1.62 -0.03 0.00 0.77 0.00 0.00 66.41 65.78 2kff h THR 52 Cb 1.06 1.48 -0.00 0.00 -1.74 0.00 0.00 68.15 68.94 2kff h THR 52 CO -0.00 0.54 -0.16 1.88 0.37 0.00 0.00 175.52 178.14 2kff h TYR 53 N 0.71 0.00 -0.22 3.16 0.05 -0.95 -2.09 116.97 117.63 2kff h TYR 53 Ca 0.04 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.74 2kff h TYR 53 Cb 1.04 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.77 2kff h TYR 53 CO 0.06 0.16 -0.19 -0.44 -1.05 0.00 0.00 178.16 176.71 2kff h ASP 54 N 0.00 0.54 -0.81 3.88 5.19 -1.03 -0.44 116.42 123.74 2kff h ASP 54 Ca -0.00 -0.46 0.05 0.00 -0.62 0.00 0.00 57.03 56.00 2kff h ASP 54 Cb 0.67 -0.15 -0.06 0.00 0.18 0.00 0.00 39.33 39.97 2kff h ASP 54 CO 0.02 0.89 0.50 -0.08 -3.12 0.00 0.00 179.24 177.45 2kff h GLU 55 N 0.20 0.91 0.00 3.56 4.57 -0.70 -0.20 114.58 122.92 2kff h GLU 55 Ca 0.04 -0.05 -0.18 0.00 -1.18 0.00 0.00 59.36 57.98 2kff h GLU 55 Cb 0.73 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 29.08 2kff h GLU 55 CO 0.05 0.60 -0.85 0.82 -1.18 0.00 0.00 179.01 178.45 2kff h ILE 56 N 0.94 1.50 -0.12 2.32 2.04 -1.40 -3.14 117.51 119.65 2kff h ILE 56 Ca 0.35 -3.03 -0.08 0.00 1.00 0.00 0.00 64.86 63.10 2kff h ILE 56 Cb 0.12 2.68 0.00 0.00 -0.74 0.00 0.00 36.82 38.88 2kff h ILE 56 CO -0.15 0.83 -0.23 0.15 0.00 0.00 0.00 178.15 178.75 2kff h PHE 57 N 0.00 0.46 0.00 1.37 3.57 -0.27 -3.11 116.94 118.97 2kff h PHE 57 Ca -0.01 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.32 2kff h PHE 57 Cb 1.61 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 40.27 2kff h PHE 57 CO 0.00 0.85 0.00 0.66 -2.23 0.00 0.00 178.31 177.59 2kff n TYR 58 N -4.48 0.58 1.14 0.41 4.01 -0.16 -2.42 117.16 116.24 2kff n TYR 58 Ca -0.07 0.19 0.12 0.00 -0.16 0.00 0.00 57.90 57.98 2kff n TYR 58 Cb 0.43 -0.81 0.33 0.00 -0.31 0.00 0.00 39.34 38.99 2kff n TYR 58 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 2kff n THR 59 N -1.99 0.11 -0.11 -0.72 -2.24 -1.18 -3.74 114.28 104.41 2kff n THR 59 Ca 0.05 -0.41 0.06 0.00 -2.27 0.00 0.00 64.05 61.48 2kff n THR 59 Cb 0.33 0.82 0.15 0.00 -2.10 0.00 0.00 70.33 69.53 2kff n THR 59 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2kff n LEU 60 N 0.72 2.88 -2.31 3.22 4.77 -1.02 -5.03 117.00 120.24 2kff n LEU 60 Ca 0.17 -1.88 -0.04 0.00 -0.03 0.00 0.00 56.01 54.23 2kff n LEU 60 Cb 0.45 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 2kff n LEU 60 CO 0.15 0.71 -0.04 -1.20 -1.33 0.00 0.00 177.39 175.67 2kff n SER 61 N 0.60 -5.66 -4.59 -1.43 7.64 -1.25 -4.83 113.62 104.11 2kff n SER 61 Ca 0.12 0.45 -0.41 0.00 1.01 0.00 0.00 58.87 60.04 2kff n SER 61 Cb 0.42 -3.69 -0.07 0.00 -1.01 0.00 0.00 64.21 59.87 2kff n SER 61 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2kff s PRO 62 N -1.77 3.84 -0.00 1.43 0.04 -1.26 -4.64 135.00 132.64 2kff s PRO 62 Ca 0.12 0.23 -0.21 0.00 0.04 0.00 0.00 61.00 61.18 2kff s PRO 62 Cb -0.03 -3.75 -0.05 0.00 0.04 0.00 0.00 34.50 30.71 2kff s PRO 62 CO 0.47 -0.61 0.62 0.14 0.04 0.00 0.00 177.00 177.65 2kff s VAL 63 N 2.63 4.90 -0.70 -0.36 -7.23 0.13 -4.03 120.40 115.75 2kff s VAL 63 Ca 0.25 1.29 0.00 0.00 -1.81 0.00 0.00 61.98 61.71 2kff s VAL 63 Cb -0.15 -3.95 0.00 0.00 0.56 0.00 0.00 36.38 32.84 2kff s VAL 63 CO 0.13 0.40 0.00 -0.46 -0.31 0.00 0.00 175.10 174.86 2kff n ASN 64 N 2.80 -2.40 0.00 4.85 6.94 -1.26 -0.38 115.26 125.80 2kff n ASN 64 Ca -0.06 0.26 0.00 0.00 -0.02 0.00 0.00 54.58 54.76 2kff n ASN 64 Cb 0.51 -2.24 0.00 0.00 -2.36 0.00 0.00 39.78 35.68 2kff n ASN 64 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2kff n GLY 65 N -0.45 0.81 3.27 4.83 0.00 -1.26 -5.07 105.19 107.33 2kff n GLY 65 Ca -0.08 -0.33 -0.13 0.00 0.00 0.00 0.00 46.02 45.48 2kff n GLY 65 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2kff s LYS 66 N -0.61 0.56 0.05 1.61 2.20 0.49 -3.85 119.74 120.18 2kff s LYS 66 Ca 0.00 0.22 -0.00 0.00 -0.36 0.00 0.00 55.97 55.83 2kff s LYS 66 Cb 0.00 0.26 -0.04 0.00 -1.51 0.00 0.00 37.83 36.54 2kff s LYS 66 CO 0.00 -0.12 0.20 0.96 -0.36 0.00 0.00 175.35 176.03 2kff s ILE 67 N -0.48 5.33 0.81 5.43 -4.36 -0.58 0.21 121.20 127.56 2kff s ILE 67 Ca -0.06 -0.38 -0.12 0.00 -0.26 0.00 0.00 60.65 59.83 2kff s ILE 67 Cb -0.04 -3.58 0.08 0.00 1.25 0.00 0.00 42.46 40.17 2kff s ILE 67 CO 0.02 0.17 1.12 0.42 0.24 0.00 0.00 174.94 176.91 2kff s THR 68 N -1.47 2.72 0.46 8.37 -4.23 -1.26 -1.35 115.64 118.87 2kff s THR 68 Ca 0.33 0.23 0.12 0.00 -1.18 0.00 0.00 61.69 61.20 2kff s THR 68 Cb -0.13 -3.06 0.29 0.00 1.34 0.00 0.00 72.50 70.94 2kff s THR 68 CO 0.26 -0.30 2.07 1.23 -0.54 0.00 0.00 174.62 177.33 2kff h GLY 69 N -1.11 0.37 -0.08 3.99 0.00 -1.95 -2.77 103.07 101.53 2kff h GLY 69 Ca -0.47 -0.13 0.06 0.00 0.00 0.00 0.00 47.33 46.79 2kff h GLY 69 CO 0.62 0.11 -0.37 0.00 0.00 0.00 0.00 176.54 176.90 2kff h ALA 70 N 1.81 -0.38 -0.27 3.60 0.00 -1.93 0.14 119.26 122.23 2kff h ALA 70 Ca 0.14 0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.95 2kff h ALA 70 Cb 0.15 0.74 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 2kff h ALA 70 CO -0.03 -0.82 -0.39 -0.91 0.00 0.00 0.00 179.25 177.09 2kff h ASN 71 N -0.36 0.81 0.28 0.00 4.21 -1.81 -1.38 115.58 117.33 2kff h ASN 71 Ca 0.12 -0.51 -0.14 0.00 1.21 0.00 0.00 56.30 56.98 2kff h ASN 71 Cb 0.57 -0.23 -0.01 0.00 -1.12 0.00 0.00 38.32 37.53 2kff h ASN 71 CO -0.47 1.17 -0.56 0.00 -1.29 0.00 0.00 177.43 176.27 2kff h ALA 72 N 0.67 0.86 0.22 -0.83 0.00 -1.50 -1.75 119.26 116.92 2kff h ALA 72 Ca 0.03 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 2kff h ALA 72 Cb 0.99 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2kff h ALA 72 CO 0.09 0.70 -0.10 -0.22 0.00 0.00 0.00 179.25 179.72 2kff h LYS 73 N 0.23 -0.28 -0.24 0.00 3.64 -0.47 -1.69 116.57 117.76 2kff h LYS 73 Ca 0.00 0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 2kff h LYS 73 Cb 1.06 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.93 2kff h LYS 73 CO 0.09 -0.04 -0.00 1.57 -2.27 0.00 0.00 179.45 178.79 2kff h LYS 74 N -0.49 0.35 -0.75 1.90 2.10 -1.24 -0.74 116.57 117.71 2kff h LYS 74 Ca -0.03 -0.06 -0.03 0.00 -2.00 0.00 0.00 60.65 58.53 2kff h LYS 74 Cb 0.37 -0.06 -0.03 0.00 -0.90 0.00 0.00 32.23 31.60 2kff h LYS 74 CO 0.05 0.38 0.34 1.49 -2.00 0.00 0.00 179.45 179.71 2kff h GLU 75 N 0.34 1.09 0.00 0.07 4.57 -1.13 -1.85 114.58 117.68 2kff h GLU 75 Ca 0.08 -0.17 -0.01 0.00 -1.18 0.00 0.00 59.36 58.08 2kff h GLU 75 Cb 0.24 -0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 28.63 2kff h GLU 75 CO 0.01 0.86 -0.04 0.52 -1.18 0.00 0.00 179.01 179.18 2kff h MET 76 N 1.08 0.00 0.00 1.92 2.86 -0.26 -1.73 114.93 118.79 2kff h MET 76 Ca 0.26 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.82 2kff h MET 76 Cb 0.15 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 2kff h MET 76 CO -0.03 0.04 -0.44 -0.39 1.06 0.00 0.00 176.91 177.15 2kff h VAL 77 N 0.00 0.56 0.00 -2.22 -1.51 -0.49 -2.64 116.25 109.94 2kff h VAL 77 Ca -0.00 -1.81 0.00 0.00 -1.23 0.00 0.00 66.70 63.66 2kff h VAL 77 Cb 0.88 2.24 0.00 0.00 -2.13 0.00 0.00 31.29 32.29 2kff h VAL 77 CO 0.01 0.32 -0.40 2.29 -1.23 0.00 0.00 177.57 178.56 2kff n LYS 78 N -3.15 0.07 0.21 5.19 2.85 -0.76 -2.90 118.16 119.67 2kff n LYS 78 Ca 0.02 0.02 0.15 0.00 -1.05 0.00 0.00 58.31 57.45 2kff n LYS 78 Cb 0.68 -1.55 0.62 0.00 -0.65 0.00 0.00 35.03 34.13 2kff n LYS 78 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 177.40 178.12 2kff h SER 79 N 0.00 0.00 -0.99 -5.58 0.02 -0.94 -3.47 113.55 102.59 2kff h SER 79 Ca 0.00 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.72 2kff h SER 79 Cb 0.56 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.04 2kff h SER 79 CO 0.00 0.00 -0.24 1.17 -1.14 0.00 0.00 176.83 176.62 2kff n LYS 80 N -2.69 -0.83 -3.96 3.45 3.00 -1.14 -5.00 118.16 110.99 2kff n LYS 80 Ca 0.01 0.75 -0.28 0.00 -0.00 0.00 0.00 58.31 58.79 2kff n LYS 80 Cb 0.26 -4.79 -0.04 0.00 0.00 0.00 0.00 35.03 30.46 2kff n LYS 80 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2kff s LEU 81 N -2.85 4.27 0.40 3.14 1.43 -1.25 -5.06 118.68 118.75 2kff s LEU 81 Ca 0.00 0.16 -0.26 0.00 -1.03 0.00 0.00 54.13 53.00 2kff s LEU 81 Cb 0.00 -2.86 -0.10 0.00 0.03 0.00 0.00 46.19 43.26 2kff s LEU 81 CO 0.00 0.09 1.33 -0.81 0.23 0.00 0.00 176.35 177.19 2kff n PRO 82 N -0.25 2.12 -0.02 1.29 -0.04 -1.26 -4.82 135.00 132.01 2kff n PRO 82 Ca -0.07 0.75 0.05 0.00 -0.04 0.00 0.00 63.50 64.19 2kff n PRO 82 Cb 0.53 -2.44 0.43 0.00 -0.04 0.00 0.00 33.50 31.97 2kff n PRO 82 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 2kff h ASN 83 N 2.33 0.48 -0.26 3.54 -1.24 -1.97 -1.45 115.58 117.00 2kff h ASN 83 Ca -0.48 -0.01 0.02 0.00 0.71 0.00 0.00 56.30 56.53 2kff h ASN 83 Cb 1.28 -0.12 -0.02 0.00 0.73 0.00 0.00 38.32 40.19 2kff h ASN 83 CO 0.61 0.34 0.13 0.74 -1.29 0.00 0.00 177.43 177.96 2kff h THR 84 N 0.56 0.99 -0.64 -3.57 2.02 -1.99 0.13 112.91 110.42 2kff h THR 84 Ca 0.18 -0.10 -0.05 0.00 0.77 0.00 0.00 66.41 67.22 2kff h THR 84 Cb 0.02 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 2kff h THR 84 CO -0.04 0.05 0.22 0.58 0.37 0.00 0.00 175.52 176.70 2kff h VAL 85 N 0.28 1.24 -0.45 3.16 2.07 -1.68 -1.67 116.25 119.20 2kff h VAL 85 Ca 0.11 -0.81 0.02 0.00 0.82 0.00 0.00 66.70 66.84 2kff h VAL 85 Cb 0.03 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 2kff h VAL 85 CO -0.07 0.31 0.27 -0.07 0.02 0.00 0.00 177.57 178.02 2kff h LEU 86 N 0.91 0.43 -1.16 2.57 3.38 -0.77 0.22 115.31 120.89 2kff h LEU 86 Ca 0.21 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 2kff h LEU 86 Cb 0.26 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 2kff h LEU 86 CO -0.01 0.30 0.44 1.23 0.09 0.00 0.00 178.44 180.49 2kff h GLY 87 N 0.53 1.08 1.15 0.83 0.00 -0.53 0.72 103.07 106.85 2kff h GLY 87 Ca 0.18 -0.45 -0.16 0.00 0.00 0.00 0.00 47.33 46.91 2kff h GLY 87 CO -0.09 0.44 -0.36 0.50 0.00 0.00 0.00 176.54 177.03 2kff h LYS 88 N 1.02 0.93 -0.50 4.80 1.57 -0.39 -1.70 116.57 122.31 2kff h LYS 88 Ca 0.27 -0.48 -0.09 0.00 -1.87 0.00 0.00 60.65 58.48 2kff h LYS 88 Cb -0.02 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 2kff h LYS 88 CO -0.05 1.13 -0.04 0.82 -0.57 0.00 0.00 179.45 180.75 2kff h ILE 89 N 0.77 1.25 -0.35 1.86 2.04 -0.17 -1.55 117.51 121.37 2kff h ILE 89 Ca 0.07 -1.11 -0.01 0.00 1.00 0.00 0.00 64.86 64.81 2kff h ILE 89 Cb 0.95 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 2kff h ILE 89 CO 0.09 0.39 0.18 -0.25 0.00 0.00 0.00 178.15 178.57 2kff h TRP 90 N 0.80 0.49 -0.71 1.37 2.91 -0.69 0.16 115.95 120.27 2kff h TRP 90 Ca 0.14 -0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.16 2kff h TRP 90 Cb 0.53 -0.16 -0.04 0.00 -0.51 0.00 0.00 29.16 28.99 2kff h TRP 90 CO 0.03 0.40 0.47 -0.22 -1.03 0.00 0.00 178.44 178.10 2kff h LYS 91 N 0.44 0.92 -0.29 2.65 3.64 -0.97 0.38 116.57 123.34 2kff h LYS 91 Ca 0.12 -0.06 -0.14 0.00 -1.27 0.00 0.00 60.65 59.31 2kff h LYS 91 Cb 0.08 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 31.69 2kff h LYS 91 CO -0.02 0.61 -0.35 -0.07 -2.27 0.00 0.00 179.45 177.35 2kff h LEU 92 N 0.95 0.81 -0.09 5.20 3.38 -0.90 -3.33 115.31 121.33 2kff h LEU 92 Ca 0.27 -0.49 -0.14 0.00 0.09 0.00 0.00 57.88 57.60 2kff h LEU 92 Cb -0.08 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.45 2kff h LEU 92 CO -0.06 1.13 -0.50 0.00 0.09 0.00 0.00 178.44 179.10 2kff h ALA 93 N 0.70 0.18 -1.25 1.53 0.00 0.08 -3.38 119.26 117.11 2kff h ALA 93 Ca 0.04 -0.51 -0.69 0.00 0.00 0.00 0.00 54.91 53.75 2kff h ALA 93 Cb 0.93 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 18.59 2kff h ALA 93 CO 0.08 0.37 1.75 0.34 0.00 0.00 0.00 179.25 181.79 2kff s ASP 94 N -6.67 6.88 0.08 0.00 2.15 0.13 -4.37 116.67 114.87 2kff s ASP 94 Ca -0.13 -2.54 -0.17 0.00 0.43 0.00 0.00 52.55 50.14 2kff s ASP 94 Cb 0.05 -2.50 -0.10 0.00 -0.30 0.00 0.00 42.92 40.07 2kff s ASP 94 CO 0.82 -1.04 1.41 0.58 -0.17 0.00 0.00 175.17 176.78 2kff h VAL 95 N 5.36 1.31 0.00 1.11 2.07 -1.79 -3.00 116.25 121.31 2kff h VAL 95 Ca 0.36 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 66.56 2kff h VAL 95 Cb 0.89 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 2kff h VAL 95 CO 1.36 0.41 0.00 -2.24 0.02 0.00 0.00 177.57 177.12 2kff h ASP 96 N 0.26 0.00 -5.66 0.57 3.04 -1.96 -3.47 116.42 109.21 2kff h ASP 96 Ca 0.05 0.00 -0.31 0.00 -3.24 0.00 0.00 57.03 53.53 2kff h ASP 96 Cb 0.72 0.00 0.16 0.00 -1.04 0.00 0.00 39.33 39.17 2kff h ASP 96 CO 0.05 0.00 -0.85 0.29 -2.04 0.00 0.00 179.24 176.69 2kff n LYS 97 N -2.77 -3.31 -0.25 4.15 5.02 -1.13 -4.93 118.16 114.94 2kff n LYS 97 Ca 0.03 0.79 0.08 0.00 -2.02 0.00 0.00 58.31 57.18 2kff n LYS 97 Cb 0.39 -5.55 0.22 0.00 -0.02 0.00 0.00 35.03 30.06 2kff n LYS 97 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2kff n ASP 98 N -3.12 3.33 -0.01 4.39 5.75 -1.26 -4.94 116.55 120.70 2kff n ASP 98 Ca -0.14 -2.02 -0.00 0.00 -0.01 0.00 0.00 54.79 52.62 2kff n ASP 98 Cb 0.63 -0.33 -0.00 0.00 -1.03 0.00 0.00 41.12 40.39 2kff n ASP 98 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2kff n GLY 99 N 0.92 0.31 3.03 6.12 0.00 -1.26 -4.96 105.19 109.34 2kff n GLY 99 Ca 0.16 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 46.09 2kff n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2kff s LEU 100 N -0.02 2.31 -0.40 0.99 1.43 -1.26 -3.91 118.68 117.82 2kff s LEU 100 Ca 0.00 -0.65 -0.15 0.00 -1.03 0.00 0.00 54.13 52.30 2kff s LEU 100 Cb 0.00 0.08 0.02 0.00 0.03 0.00 0.00 46.19 46.32 2kff s LEU 100 CO 0.00 -0.37 0.30 -0.76 0.23 0.00 0.00 176.35 175.76 2kff s LEU 101 N -1.90 5.01 1.04 1.79 1.43 -0.46 -4.88 118.68 120.72 2kff s LEU 101 Ca -0.08 -0.81 -0.14 0.00 -1.03 0.00 0.00 54.13 52.06 2kff s LEU 101 Cb -0.05 -2.18 0.21 0.00 0.03 0.00 0.00 46.19 44.20 2kff s LEU 101 CO -0.03 -0.43 1.11 -0.62 0.23 0.00 0.00 176.35 176.60 2kff s ASP 102 N 1.70 2.28 0.21 2.29 -1.08 -1.26 -1.53 116.67 119.27 2kff s ASP 102 Ca 0.06 0.99 -0.10 0.00 -0.52 0.00 0.00 52.55 52.97 2kff s ASP 102 Cb -0.19 -1.53 0.19 0.00 -1.46 0.00 0.00 42.92 39.94 2kff s ASP 102 CO 0.10 -3.32 1.85 -0.78 0.52 0.00 0.00 175.17 173.54 2kff h ASP 103 N -2.03 0.72 -0.51 -0.34 3.58 -1.98 0.31 116.42 116.17 2kff h ASP 103 Ca -0.52 -0.00 -0.01 0.00 0.42 0.00 0.00 57.03 56.92 2kff h ASP 103 Cb 1.32 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 42.19 2kff h ASP 103 CO 0.52 0.50 0.29 -0.33 -2.88 0.00 0.00 179.24 177.34 2kff h GLU 104 N 0.86 0.71 -0.46 0.28 5.08 -1.93 -1.71 114.58 117.41 2kff h GLU 104 Ca 0.28 -0.08 -0.13 0.00 -1.00 0.00 0.00 59.36 58.43 2kff h GLU 104 Cb 0.02 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 2kff h GLU 104 CO -0.11 0.55 -0.23 0.93 -1.00 0.00 0.00 179.01 179.16 2kff h GLU 105 N 0.69 0.95 -0.36 2.33 5.08 -1.48 -1.45 114.58 120.34 2kff h GLU 105 Ca 0.18 -0.41 -0.10 0.00 -1.00 0.00 0.00 59.36 58.04 2kff h GLU 105 Cb 0.04 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 2kff h GLU 105 CO -0.03 1.07 -0.16 0.35 -1.00 0.00 0.00 179.01 179.24 2kff h PHE 106 N 0.82 0.85 -0.58 4.33 3.57 -0.31 -0.32 116.94 125.29 2kff h PHE 106 Ca 0.10 -0.21 0.01 0.00 3.53 0.00 0.00 57.97 61.41 2kff h PHE 106 Cb 0.79 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.31 2kff h PHE 106 CO 0.05 0.93 0.38 0.00 -2.23 0.00 0.00 178.31 177.44 2kff h ALA 107 N 0.79 0.75 -0.40 2.41 0.00 -1.11 0.30 119.26 122.00 2kff h ALA 107 Ca 0.08 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2kff h ALA 107 Cb 0.70 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2kff h ALA 107 CO 0.05 0.16 0.20 1.25 0.00 0.00 0.00 179.25 180.91 2kff h LEU 108 N 0.77 0.51 -0.33 0.00 5.85 -1.12 -1.86 115.31 119.13 2kff h LEU 108 Ca 0.22 -0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.86 2kff h LEU 108 Cb -0.07 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.80 2kff h LEU 108 CO -0.06 0.47 0.12 0.00 -0.34 0.00 0.00 178.44 178.63 2kff h ALA 109 N 1.06 0.38 0.00 1.25 0.00 -0.35 -1.40 119.26 120.19 2kff h ALA 109 Ca 0.14 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 2kff h ALA 109 Cb 0.09 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2kff h ALA 109 CO -0.02 -0.28 -0.38 -0.91 0.00 0.00 0.00 179.25 177.67 2kff h ASN 110 N 0.26 0.00 -0.28 0.00 -0.26 -0.83 -0.26 115.58 114.22 2kff h ASN 110 Ca 0.15 0.00 -0.13 0.00 -0.56 0.00 0.00 56.30 55.76 2kff h ASN 110 Cb 0.11 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.36 2kff h ASN 110 CO -0.14 0.38 -0.28 -0.74 -1.06 0.00 0.00 177.43 175.58 2kff h HIS 111 N 0.00 0.91 -0.28 1.19 2.76 -0.68 -0.36 115.15 118.69 2kff h HIS 111 Ca -0.00 -0.23 -0.13 0.00 -2.20 0.00 0.00 60.37 57.81 2kff h HIS 111 Cb 0.72 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.46 2kff h HIS 111 CO 0.00 0.98 -0.36 -0.07 -1.30 0.00 0.00 177.93 177.18 2kff h LEU 112 N 0.67 0.65 -0.60 0.26 3.38 -0.66 -1.65 115.31 117.37 2kff h LEU 112 Ca 0.08 -0.28 0.02 0.00 0.09 0.00 0.00 57.88 57.79 2kff h LEU 112 Cb 0.81 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 2kff h LEU 112 CO 0.07 0.95 0.38 0.40 0.09 0.00 0.00 178.44 180.33 2kff h ILE 113 N 0.52 1.11 -0.20 1.22 1.08 -0.78 -1.91 117.51 118.54 2kff h ILE 113 Ca 0.05 -0.26 -0.02 0.00 -0.39 0.00 0.00 64.86 64.25 2kff h ILE 113 Cb 0.86 0.28 -0.01 0.00 -3.07 0.00 0.00 36.82 34.89 2kff h ILE 113 CO 0.07 0.14 0.07 0.50 -0.69 0.00 0.00 178.15 178.24 2kff h LYS 114 N 0.76 0.31 -0.49 2.37 3.64 -0.73 -1.53 116.57 120.89 2kff h LYS 114 Ca 0.23 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.49 2kff h LYS 114 Cb -0.03 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 2kff h LYS 114 CO -0.08 0.40 0.07 -0.39 -2.27 0.00 0.00 179.45 177.18 2kff h VAL 115 N 0.15 1.23 -0.78 2.00 -1.51 -1.21 0.32 116.25 116.45 2kff h VAL 115 Ca 0.07 -0.88 0.07 0.00 -1.23 0.00 0.00 66.70 64.73 2kff h VAL 115 Cb 0.22 0.78 -0.06 0.00 -2.13 0.00 0.00 31.29 30.09 2kff h VAL 115 CO -0.00 0.32 0.45 0.11 -1.23 0.00 0.00 177.57 177.22 2kff h LYS 116 N 0.74 0.78 -0.11 5.19 1.79 -1.15 0.13 116.57 123.95 2kff h LYS 116 Ca 0.16 -0.05 -0.15 0.00 -2.18 0.00 0.00 60.65 58.43 2kff h LYS 116 Cb 0.35 -0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 30.82 2kff h LYS 116 CO 0.01 0.52 -0.58 -0.07 -1.08 0.00 0.00 179.45 178.25 2kff h LEU 117 N 0.81 0.40 -0.68 2.94 3.38 -0.06 -2.35 115.31 119.74 2kff h LEU 117 Ca 0.35 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2kff h LEU 117 Cb 0.24 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2kff h LEU 117 CO -0.20 0.88 0.00 -0.62 0.09 0.00 0.00 178.44 178.59 2kff n GLU 118 N -3.91 0.16 -0.61 1.13 -0.58 0.98 -4.86 120.64 112.95 2kff n GLU 118 Ca -0.03 0.43 0.00 0.00 -0.42 0.00 0.00 57.16 57.14 2kff n GLU 118 Cb 0.61 -1.83 0.00 0.00 -0.57 0.00 0.00 31.44 29.64 2kff n GLU 118 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2kff n GLY 119 N -0.15 0.64 3.91 0.62 0.00 -0.74 -5.06 105.19 104.41 2kff n GLY 119 Ca 0.02 -0.50 -0.20 0.00 0.00 0.00 0.00 46.02 45.34 2kff n GLY 119 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2kff s HIS 120 N -2.00 3.06 0.09 1.61 3.76 0.39 -5.01 115.29 117.19 2kff s HIS 120 Ca 0.00 -0.22 -0.20 0.00 -0.15 0.00 0.00 55.06 54.49 2kff s HIS 120 Cb 0.00 -1.80 -0.07 0.00 1.11 0.00 0.00 32.58 31.82 2kff s HIS 120 CO 0.00 0.18 0.59 -1.83 -0.85 0.00 0.00 174.74 172.83 2kff s GLU 121 N -4.04 4.23 -0.17 1.40 -1.05 -1.26 -4.01 118.70 113.79 2kff s GLU 121 Ca 0.41 0.77 -0.03 0.00 -0.15 0.00 0.00 54.97 55.96 2kff s GLU 121 Cb -0.08 -3.20 -0.02 0.00 -0.44 0.00 0.00 34.13 30.39 2kff s GLU 121 CO 0.28 0.61 -0.05 -0.48 0.95 0.00 0.00 175.26 176.58 2kff s LEU 122 N -1.21 3.08 0.26 1.83 0.05 -1.26 -4.97 118.68 116.45 2kff s LEU 122 Ca 0.31 -0.23 0.25 0.00 0.05 0.00 0.00 54.13 54.51 2kff s LEU 122 Cb -0.19 -1.75 0.91 0.00 -2.05 0.00 0.00 46.19 43.11 2kff s LEU 122 CO 0.20 0.11 1.75 1.55 -0.55 0.00 0.00 176.35 179.41 2kff h PRO 123 N 7.12 0.00 -0.48 1.48 0.14 -2.02 -3.45 132.00 134.79 2kff h PRO 123 Ca -0.33 0.00 -0.21 0.00 0.14 0.00 0.00 66.00 65.61 2kff h PRO 123 Cb 1.19 0.00 -0.08 0.00 0.14 0.00 0.00 31.00 32.25 2kff h PRO 123 CO 0.60 0.00 -0.19 0.00 0.14 0.00 0.00 178.00 178.56 2kff n ALA 124 N -1.80 -0.15 -2.43 -0.56 0.00 -1.26 -5.02 120.51 109.29 2kff n ALA 124 Ca 0.04 0.16 -0.22 0.00 0.00 0.00 0.00 53.44 53.42 2kff n ALA 124 Cb 0.33 -1.28 -0.11 0.00 0.00 0.00 0.00 19.45 18.39 2kff n ALA 124 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2kff s ASP 125 N -2.81 2.82 -0.45 0.00 1.01 -1.26 -4.97 116.67 111.02 2kff s ASP 125 Ca 0.00 -0.92 0.01 0.00 0.71 0.00 0.00 52.55 52.34 2kff s ASP 125 Cb 0.00 -0.18 0.12 0.00 1.01 0.00 0.00 42.92 43.87 2kff s ASP 125 CO 0.00 -0.05 0.21 -0.76 0.21 0.00 0.00 175.17 174.79 2kff s LEU 126 N -2.93 4.91 0.72 1.23 1.43 -1.26 -5.08 118.68 117.70 2kff s LEU 126 Ca 0.19 -2.42 -0.14 0.00 -1.03 0.00 0.00 54.13 50.73 2kff s LEU 126 Cb -0.05 -1.73 0.03 0.00 0.03 0.00 0.00 46.19 44.47 2kff s LEU 126 CO 0.08 -0.40 1.16 -2.16 0.23 0.00 0.00 176.35 175.26 2kff s PRO 127 N 0.55 2.31 0.58 1.29 0.04 -1.26 -4.90 135.00 133.61 2kff s PRO 127 Ca 0.12 1.58 0.29 0.00 0.04 0.00 0.00 61.00 63.04 2kff s PRO 127 Cb -0.22 -1.87 1.47 0.00 0.04 0.00 0.00 34.50 33.92 2kff s PRO 127 CO -0.04 -1.66 1.89 -1.35 0.04 0.00 0.00 177.00 175.88 2kff h PRO 128 N -0.32 0.00 -0.70 0.56 0.11 -1.99 0.58 132.00 130.24 2kff h PRO 128 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2kff h PRO 128 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2kff h PRO 128 CO 0.51 0.00 0.00 -2.39 -0.21 0.00 0.00 178.00 175.91 2kff n HIS 129 N -3.85 1.14 -0.50 0.65 1.44 -1.26 -3.34 115.22 109.50 2kff n HIS 129 Ca 0.10 -0.41 0.00 0.00 -2.01 0.00 0.00 57.72 55.40 2kff n HIS 129 Cb 0.73 -0.29 0.00 0.00 0.12 0.00 0.00 29.99 30.55 2kff n HIS 129 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2kff n LEU 130 N 0.44 0.67 -4.60 2.39 4.77 0.19 -4.27 117.00 116.60 2kff n LEU 130 Ca 0.16 -0.67 -0.42 0.00 -0.03 0.00 0.00 56.01 55.05 2kff n LEU 130 Cb 0.75 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.78 2kff n LEU 130 CO 0.18 0.17 0.54 -0.69 -1.33 0.00 0.00 177.39 176.26 2kff s VAL 131 N -0.17 4.81 0.20 4.08 1.01 -1.21 -4.97 120.40 124.15 2kff s VAL 131 Ca 0.00 1.05 -0.32 0.00 0.00 0.00 0.00 61.98 62.71 2kff s VAL 131 Cb 0.00 -4.13 -0.14 0.00 0.00 0.00 0.00 36.38 32.10 2kff s VAL 131 CO 0.00 -0.27 1.32 -2.65 0.00 0.00 0.00 175.10 173.50 2kff n PRO 132 N 6.18 1.66 0.27 2.72 -0.02 -1.26 -4.89 135.00 139.67 2kff n PRO 132 Ca 0.03 0.59 0.16 0.00 -2.02 0.00 0.00 63.50 62.26 2kff n PRO 132 Cb 0.48 -2.19 0.65 0.00 -0.02 0.00 0.00 33.50 32.42 2kff n PRO 132 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2kff h PRO 133 N 4.00 0.00 -0.28 0.52 0.11 -1.95 -2.92 132.00 131.48 2kff h PRO 133 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2kff h PRO 133 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2kff h PRO 133 CO 0.74 0.05 0.00 0.45 -0.21 0.00 0.00 178.00 179.03 2kff n SER 134 N -3.16 1.65 -0.37 -2.05 2.88 -1.26 -2.24 113.62 109.07 2kff n SER 134 Ca 0.00 -1.93 0.04 0.00 -1.33 0.00 0.00 58.87 55.66 2kff n SER 134 Cb 0.33 -0.19 0.06 0.00 -0.75 0.00 0.00 64.21 63.66 2kff n SER 134 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2kff n LYS 135 N 0.38 1.06 -4.30 -1.46 4.01 -1.10 -4.99 118.16 111.76 2kff n LYS 135 Ca 0.12 -1.29 -0.31 0.00 -0.51 0.00 0.00 58.31 56.32 2kff n LYS 135 Cb 0.28 -1.17 -0.09 0.00 -0.51 0.00 0.00 35.03 33.53 2kff n LYS 135 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 2kff s ARG 136 N -0.79 2.47 0.08 1.97 0.52 -0.95 -5.07 118.95 117.18 2kff s ARG 136 Ca 0.12 -0.82 -0.32 0.00 -0.52 0.00 0.00 55.73 54.19 2kff s ARG 136 Cb 0.07 -2.48 -0.11 0.00 0.52 0.00 0.00 34.95 32.96 2kff s ARG 136 CO 0.11 0.56 1.83 0.54 0.02 0.00 0.00 175.30 178.36 2kff n ARG 137 N 1.08 2.62 -3.84 3.54 1.74 -1.26 -4.95 116.66 115.59 2kff n ARG 137 Ca -0.14 0.95 -0.36 0.00 -0.77 0.00 0.00 57.85 57.54 2kff n ARG 137 Cb 0.52 -2.83 -0.13 0.00 -1.02 0.00 0.00 32.46 29.00 2kff n ARG 137 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 2kff s HIS 138 N 2.93 3.40 0.00 -1.55 2.46 -1.26 -5.13 115.29 116.14 2kff s HIS 138 Ca 0.84 -2.04 0.00 0.00 0.47 0.00 0.00 55.06 54.33 2kff s HIS 138 Cb -0.54 -2.57 0.00 0.00 -0.13 0.00 0.00 32.58 29.35 2kff s HIS 138 CO 0.40 -0.86 0.00 0.39 -2.47 0.00 0.00 174.74 172.20