#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kff h PRO 36 N 0.00 0.00 0.00 1.61 0.13 -2.11 -3.46 132.00 128.17 2kff h PRO 36 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2kff h PRO 36 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2kff h PRO 36 CO 0.00 0.19 0.00 1.28 -0.23 0.00 0.00 178.00 179.24 2kff n LEU 37 N -3.60 0.00 0.00 1.56 4.77 -1.26 -3.79 117.00 114.68 2kff n LEU 37 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 2kff n LEU 37 Cb 0.33 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 2kff n LEU 37 CO 0.32 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 2kff n GLY 38 N 0.00 2.07 3.70 -0.72 0.00 -1.26 -4.66 105.19 104.32 2kff n GLY 38 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 2kff n GLY 38 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2kff n SER 39 N 0.00 -5.78 -4.62 1.61 7.64 -1.25 -4.91 113.62 106.31 2kff n SER 39 Ca 0.00 -0.62 -0.43 0.00 1.01 0.00 0.00 58.87 58.83 2kff n SER 39 Cb 0.00 -4.57 -0.02 0.00 -1.01 0.00 0.00 64.21 58.61 2kff n SER 39 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2kff s ASP 40 N -3.28 6.60 -0.12 6.43 2.15 -1.26 -4.99 116.67 122.20 2kff s ASP 40 Ca 0.61 1.08 0.00 0.00 0.43 0.00 0.00 52.55 54.67 2kff s ASP 40 Cb -0.28 -2.54 0.02 0.00 -0.30 0.00 0.00 42.92 39.82 2kff s ASP 40 CO 0.75 -1.16 -0.11 -0.62 -0.17 0.00 0.00 175.17 173.86 2kff s ASP 41 N 3.01 2.29 -0.42 -0.34 -1.08 -1.26 -5.10 116.67 113.78 2kff s ASP 41 Ca 0.57 -0.36 -0.24 0.00 -0.52 0.00 0.00 52.55 52.00 2kff s ASP 41 Cb -0.15 -0.95 0.02 0.00 -1.46 0.00 0.00 42.92 40.37 2kff s ASP 41 CO 0.26 -0.07 0.83 -0.69 0.52 0.00 0.00 175.17 176.01 2kff s VAL 42 N 1.48 4.62 0.11 1.11 1.01 -1.26 -5.03 120.40 122.45 2kff s VAL 42 Ca 0.02 0.71 -0.28 0.00 0.00 0.00 0.00 61.98 62.43 2kff s VAL 42 Cb -0.13 -4.32 -0.06 0.00 0.00 0.00 0.00 36.38 31.87 2kff s VAL 42 CO -0.07 -0.65 0.87 -1.83 0.00 0.00 0.00 175.10 173.43 2kff s GLU 43 N 3.36 4.64 -0.55 2.72 1.03 -1.26 -5.01 118.70 123.62 2kff s GLU 43 Ca 0.33 1.29 -0.23 0.00 0.03 0.00 0.00 54.97 56.39 2kff s GLU 43 Cb -0.12 -3.35 0.05 0.00 -0.80 0.00 0.00 34.13 29.91 2kff s GLU 43 CO 0.22 0.32 0.88 -0.46 -1.33 0.00 0.00 175.26 174.89 2kff s TRP 44 N -0.32 2.83 0.61 4.83 -0.00 -1.26 -4.76 118.94 120.88 2kff s TRP 44 Ca 0.42 -0.17 0.31 0.00 -0.00 0.00 0.00 56.10 56.66 2kff s TRP 44 Cb -0.23 -3.99 1.76 0.00 -0.00 0.00 0.00 33.47 31.01 2kff s TRP 44 CO 0.27 -1.32 2.11 0.28 -0.00 0.00 0.00 176.95 178.29 2kff h VAL 45 N 5.98 0.34 0.00 5.86 2.07 -1.93 0.27 116.25 128.84 2kff h VAL 45 Ca -0.27 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.20 2kff h VAL 45 Cb 1.08 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 2kff h VAL 45 CO 1.07 0.00 -0.25 0.58 0.02 0.00 0.00 177.57 178.99 2kff h VAL 46 N 0.00 0.49 0.00 2.57 2.07 -1.91 -3.12 116.25 116.35 2kff h VAL 46 Ca 0.07 -1.44 0.00 0.00 0.82 0.00 0.00 66.70 66.14 2kff h VAL 46 Cb 0.46 2.04 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 2kff h VAL 46 CO -0.00 0.25 0.00 1.23 0.02 0.00 0.00 177.57 179.07 2kff h GLY 47 N 3.06 0.00 0.79 2.17 0.00 -0.86 -0.97 103.07 107.25 2kff h GLY 47 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2kff h GLY 47 CO 0.03 0.00 -1.11 0.58 0.00 0.00 0.00 176.54 176.04 2kff n LYS 48 N -2.88 0.51 -0.94 4.80 -0.00 -1.18 -3.69 118.16 114.79 2kff n LYS 48 Ca 0.00 0.05 0.00 0.00 -0.00 0.00 0.00 58.31 58.36 2kff n LYS 48 Cb 0.23 -1.72 0.16 0.00 -0.00 0.00 0.00 35.03 33.71 2kff n LYS 48 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2kff n ASP 49 N -2.41 2.28 -0.03 -5.58 8.00 -1.03 -4.84 116.55 112.94 2kff n ASP 49 Ca 0.00 -3.76 -0.15 0.00 0.71 0.00 0.00 54.79 51.59 2kff n ASP 49 Cb 0.52 -0.48 -0.11 0.00 -0.02 0.00 0.00 41.12 41.03 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 1.24 0.19 -0.30 -1.24 3.11 -1.26 -2.95 116.57 115.36 2kff h LYS 50 Ca 0.06 -0.18 0.09 0.00 -2.81 0.00 0.00 60.65 57.80 2kff h LYS 50 Cb 1.15 0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 32.41 2kff h LYS 50 CO 0.15 0.89 0.26 -1.35 -2.81 0.00 0.00 179.45 176.59 2kff h PRO 51 N -0.43 0.00 -0.00 1.90 0.11 -1.87 0.32 132.00 132.02 2kff h PRO 51 Ca -0.03 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.99 2kff h PRO 51 Cb 0.96 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.08 2kff h PRO 51 CO 0.05 0.00 -0.38 1.15 -0.21 0.00 0.00 178.00 178.61 2kff h THR 52 N 0.00 1.50 0.00 -1.15 2.02 -1.93 -0.29 112.91 113.06 2kff h THR 52 Ca 0.14 -1.98 -0.03 0.00 0.77 0.00 0.00 66.41 65.31 2kff h THR 52 Cb 0.67 2.69 -0.00 0.00 -1.74 0.00 0.00 68.15 69.76 2kff h THR 52 CO -0.00 0.56 -0.16 1.88 0.37 0.00 0.00 175.52 178.17 2kff h TYR 53 N -0.35 0.00 -0.14 3.16 0.05 -1.20 -2.32 116.97 116.18 2kff h TYR 53 Ca -0.05 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.63 2kff h TYR 53 Cb 1.11 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.86 2kff h TYR 53 CO 0.17 0.16 -0.32 0.22 -1.05 0.00 0.00 178.16 177.34 2kff h ASP 54 N 0.00 0.52 -0.93 3.88 3.58 -0.32 0.24 116.42 123.40 2kff h ASP 54 Ca -0.00 -0.57 0.01 0.00 0.42 0.00 0.00 57.03 56.89 2kff h ASP 54 Cb 0.64 -0.15 -0.05 0.00 1.72 0.00 0.00 39.33 41.49 2kff h ASP 54 CO 0.02 1.00 0.62 -0.08 -2.88 0.00 0.00 179.24 177.91 2kff h GLU 55 N 0.07 1.22 -0.35 0.28 4.81 -0.75 -1.72 114.58 118.14 2kff h GLU 55 Ca -0.00 -0.07 -0.14 0.00 -0.13 0.00 0.00 59.36 59.01 2kff h GLU 55 Cb 0.92 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 2kff h GLU 55 CO 0.07 0.80 -0.35 0.82 -0.73 0.00 0.00 179.01 179.62 2kff h ILE 56 N 1.25 1.28 -0.77 2.32 2.04 -1.33 -3.20 117.51 119.10 2kff h ILE 56 Ca 0.34 -1.52 -0.03 0.00 1.00 0.00 0.00 64.86 64.66 2kff h ILE 56 Cb -0.13 1.38 -0.04 0.00 -0.74 0.00 0.00 36.82 37.29 2kff h ILE 56 CO -0.08 0.50 0.38 0.15 0.00 0.00 0.00 178.15 179.10 2kff h PHE 57 N 0.67 1.10 -0.07 1.37 3.57 -0.29 -2.01 116.94 121.28 2kff h PHE 57 Ca 0.06 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2kff h PHE 57 Cb 0.91 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 39.30 2kff h PHE 57 CO 0.05 0.80 0.00 0.66 -2.23 0.00 0.00 178.31 177.59 2kff n TYR 58 N -4.39 0.16 0.23 0.41 4.01 -0.71 -2.56 117.16 114.31 2kff n TYR 58 Ca 0.07 -0.06 0.04 0.00 -0.16 0.00 0.00 57.90 57.78 2kff n TYR 58 Cb 0.13 -0.07 0.05 0.00 -0.31 0.00 0.00 39.34 39.14 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 -0.12 0.21 -0.57 -0.72 -2.24 -0.76 -4.52 114.28 105.57 2kff n THR 59 Ca 0.03 -0.60 0.08 0.00 -2.27 0.00 0.00 64.05 61.28 2kff n THR 59 Cb 0.20 1.02 0.24 0.00 -2.10 0.00 0.00 70.33 69.69 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 0.38 3.69 -2.76 3.22 4.77 -1.06 -5.02 117.00 120.22 2kff n LEU 60 Ca 0.05 -2.46 -0.07 0.00 -0.03 0.00 0.00 56.01 53.50 2kff n LEU 60 Cb 0.23 -0.42 0.01 0.00 -2.33 0.00 0.00 43.42 40.90 2kff n LEU 60 CO 0.05 0.73 -0.00 -0.24 -1.33 0.00 0.00 177.39 176.60 2kff n SER 61 N 0.29 -7.62 -4.53 -1.43 2.88 -1.26 -4.78 113.62 97.17 2kff n SER 61 Ca 0.18 0.59 -0.43 0.00 -1.33 0.00 0.00 58.87 57.88 2kff n SER 61 Cb 0.70 -5.14 -0.04 0.00 -0.75 0.00 0.00 64.21 58.98 2kff n SER 61 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2kff s PRO 62 N -2.42 3.35 -0.01 -1.46 0.04 -1.26 -4.65 135.00 128.58 2kff s PRO 62 Ca 0.21 -0.22 -0.19 0.00 0.04 0.00 0.00 61.00 60.84 2kff s PRO 62 Cb -0.06 -4.05 -0.05 0.00 0.04 0.00 0.00 34.50 30.37 2kff s PRO 62 CO 0.73 -1.52 0.56 0.14 0.04 0.00 0.00 177.00 176.94 2kff s VAL 63 N 4.07 4.94 -1.92 -0.36 -7.23 0.40 -3.63 120.40 116.67 2kff s VAL 63 Ca 0.32 1.16 0.00 0.00 -1.81 0.00 0.00 61.98 61.65 2kff s VAL 63 Cb -0.12 -3.89 0.00 0.00 0.56 0.00 0.00 36.38 32.93 2kff s VAL 63 CO 0.20 0.44 0.00 0.59 -0.31 0.00 0.00 175.10 176.01 2kff n ASN 64 N 2.65 -5.24 0.00 4.85 3.02 -1.26 -1.48 115.26 117.80 2kff n ASN 64 Ca -0.08 0.41 0.00 0.00 -0.03 0.00 0.00 54.58 54.88 2kff n ASN 64 Cb 0.51 -4.36 0.00 0.00 -0.61 0.00 0.00 39.78 35.32 2kff n ASN 64 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2kff n GLY 65 N -0.74 0.60 3.00 7.41 0.00 -1.24 -5.02 105.19 109.21 2kff n GLY 65 Ca -0.19 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.72 2kff n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kff s LYS 66 N -0.18 0.37 0.00 1.61 1.02 -0.55 -4.12 119.74 117.90 2kff s LYS 66 Ca 0.00 -0.58 -0.07 0.00 0.02 0.00 0.00 55.97 55.34 2kff s LYS 66 Cb 0.00 -0.07 -0.05 0.00 -0.52 0.00 0.00 37.83 37.19 2kff s LYS 66 CO 0.00 -0.00 0.27 0.96 -0.92 0.00 0.00 175.35 175.66 2kff s ILE 67 N -1.22 5.29 0.79 2.17 -4.36 -0.10 -0.46 121.20 123.31 2kff s ILE 67 Ca -0.11 0.21 -0.11 0.00 -0.26 0.00 0.00 60.65 60.38 2kff s ILE 67 Cb -0.09 -3.57 0.07 0.00 1.25 0.00 0.00 42.46 40.12 2kff s ILE 67 CO -0.00 0.39 1.09 0.42 0.24 0.00 0.00 174.94 177.07 2kff s THR 68 N -1.28 3.27 0.47 8.37 -4.23 -1.26 -1.70 115.64 119.28 2kff s THR 68 Ca 0.27 0.41 0.17 0.00 -1.18 0.00 0.00 61.69 61.36 2kff s THR 68 Cb -0.13 -2.97 0.34 0.00 1.34 0.00 0.00 72.50 71.08 2kff s THR 68 CO 0.15 -0.54 2.00 1.23 -0.54 0.00 0.00 174.62 176.93 2kff h GLY 69 N -1.15 0.35 -0.00 3.99 0.00 -1.96 -2.64 103.07 101.66 2kff h GLY 69 Ca -0.45 -0.10 0.01 0.00 0.00 0.00 0.00 47.33 46.78 2kff h GLY 69 CO 0.54 0.06 -0.23 0.00 0.00 0.00 0.00 176.54 176.91 2kff h ALA 70 N 1.74 -0.69 -0.39 3.60 0.00 -1.93 0.11 119.26 121.71 2kff h ALA 70 Ca 0.24 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.96 2kff h ALA 70 Cb 0.62 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 2kff h ALA 70 CO -0.05 -0.75 -0.36 -0.91 0.00 0.00 0.00 179.25 177.18 2kff h ASN 71 N -0.28 0.96 -0.67 0.00 2.35 -1.82 -1.42 115.58 114.69 2kff h ASN 71 Ca 0.01 -0.43 -0.05 0.00 -0.55 0.00 0.00 56.30 55.28 2kff h ASN 71 Cb 0.30 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 2kff h ASN 71 CO -0.15 1.21 0.21 0.00 -1.65 0.00 0.00 177.43 177.05 2kff h ALA 72 N 0.83 0.88 -0.66 -0.83 0.00 -1.49 -2.17 119.26 115.83 2kff h ALA 72 Ca 0.07 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 2kff h ALA 72 Cb 0.94 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2kff h ALA 72 CO 0.09 0.56 0.31 -0.22 0.00 0.00 0.00 179.25 179.99 2kff h LYS 73 N 0.98 0.95 -0.08 0.00 3.64 -0.50 -1.80 116.57 119.76 2kff h LYS 73 Ca 0.22 -0.14 0.04 0.00 -1.27 0.00 0.00 60.65 59.49 2kff h LYS 73 Cb 0.30 -0.17 -0.06 0.00 -0.41 0.00 0.00 32.23 31.89 2kff h LYS 73 CO -0.01 0.76 -0.34 0.87 -2.27 0.00 0.00 179.45 178.46 2kff h LYS 74 N 0.92 -0.43 -0.38 1.90 1.57 -0.85 0.41 116.57 119.70 2kff h LYS 74 Ca 0.23 0.03 0.02 0.00 -1.87 0.00 0.00 60.65 59.05 2kff h LYS 74 Cb 0.12 0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.51 2kff h LYS 74 CO -0.03 -0.29 0.22 1.49 -0.57 0.00 0.00 179.45 180.28 2kff h GLU 75 N -0.45 0.44 0.00 3.15 4.57 -1.15 0.15 114.58 121.29 2kff h GLU 75 Ca 0.08 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.19 2kff h GLU 75 Cb 0.57 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.05 2kff h GLU 75 CO -0.33 0.29 -0.22 0.52 -1.18 0.00 0.00 179.01 178.10 2kff h MET 76 N 0.45 0.00 -0.08 1.92 2.86 -0.90 -0.54 114.93 118.65 2kff h MET 76 Ca 0.15 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 57.58 2kff h MET 76 Cb 0.01 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.67 2kff h MET 76 CO -0.07 0.22 -0.82 0.28 1.06 0.00 0.00 176.91 177.57 2kff h VAL 77 N 0.00 1.34 -0.01 -2.22 2.07 0.93 -2.79 116.25 115.57 2kff h VAL 77 Ca -0.00 -2.15 0.00 0.00 0.82 0.00 0.00 66.70 65.36 2kff h VAL 77 Cb 0.40 2.16 0.00 0.00 -1.52 0.00 0.00 31.29 32.33 2kff h VAL 77 CO 0.03 0.66 0.00 0.29 0.02 0.00 0.00 177.57 178.57 2kff n LYS 78 N -3.85 1.06 0.01 1.57 4.01 0.41 -2.00 118.16 119.37 2kff n LYS 78 Ca -0.07 -0.09 0.12 0.00 -0.51 0.00 0.00 58.31 57.76 2kff n LYS 78 Cb 0.77 -1.36 0.54 0.00 -0.51 0.00 0.00 35.03 34.46 2kff n LYS 78 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 2kff n SER 79 N -0.76 0.04 -0.89 4.39 7.64 -0.30 -4.91 113.62 118.84 2kff n SER 79 Ca 0.17 0.51 -0.11 0.00 1.01 0.00 0.00 58.87 60.45 2kff n SER 79 Cb 0.10 -0.52 -0.04 0.00 -1.01 0.00 0.00 64.21 62.74 2kff n SER 79 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2kff n LYS 80 N -1.54 -0.77 -3.95 1.43 4.01 -0.84 -5.00 118.16 111.49 2kff n LYS 80 Ca 0.06 0.83 -0.28 0.00 -0.51 0.00 0.00 58.31 58.42 2kff n LYS 80 Cb 0.30 -4.81 -0.04 0.00 -0.51 0.00 0.00 35.03 29.97 2kff n LYS 80 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2kff s LEU 81 N -2.56 4.27 0.36 -0.35 1.43 -1.26 -5.07 118.68 115.51 2kff s LEU 81 Ca 0.00 0.17 -0.27 0.00 -1.03 0.00 0.00 54.13 53.00 2kff s LEU 81 Cb 0.00 -2.86 -0.12 0.00 0.03 0.00 0.00 46.19 43.24 2kff s LEU 81 CO 0.00 0.10 1.21 -0.81 0.23 0.00 0.00 176.35 177.08 2kff n PRO 82 N -0.22 1.88 0.24 1.29 -0.04 -1.26 -4.84 135.00 132.04 2kff n PRO 82 Ca -0.07 0.66 0.08 0.00 -0.04 0.00 0.00 63.50 64.13 2kff n PRO 82 Cb 0.53 -2.24 0.57 0.00 -0.04 0.00 0.00 33.50 32.32 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 2.23 0.00 -0.29 3.54 -1.24 -1.97 -1.28 115.58 116.57 2kff h ASN 83 Ca -0.45 0.00 -0.06 0.00 0.71 0.00 0.00 56.30 56.49 2kff h ASN 83 Cb 1.30 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.34 2kff h ASN 83 CO 0.61 0.17 -0.06 0.71 -1.29 0.00 0.00 177.43 177.57 2kff h THR 84 N 0.00 1.28 -0.52 -3.57 1.35 -1.99 0.17 112.91 109.63 2kff h THR 84 Ca -0.00 -1.07 -0.01 0.00 -0.55 0.00 0.00 66.41 64.78 2kff h THR 84 Cb 0.33 1.39 -0.02 0.00 -1.73 0.00 0.00 68.15 68.11 2kff h THR 84 CO 0.02 0.34 0.29 0.58 -0.25 0.00 0.00 175.52 176.51 2kff h VAL 85 N 0.32 1.17 -0.83 6.82 2.07 -1.75 -1.40 116.25 122.65 2kff h VAL 85 Ca 0.08 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.16 2kff h VAL 85 Cb 0.53 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 2kff h VAL 85 CO 0.03 0.18 0.51 -0.07 0.02 0.00 0.00 177.57 178.24 2kff h LEU 86 N 0.70 0.99 -0.17 2.57 3.38 -1.10 -0.33 115.31 121.35 2kff h LEU 86 Ca 0.18 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.12 2kff h LEU 86 Cb 0.04 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 2kff h LEU 86 CO -0.03 0.76 -0.02 1.23 0.09 0.00 0.00 178.44 180.47 2kff h GLY 87 N 1.13 0.14 0.61 0.83 0.00 -0.27 -1.34 103.07 104.17 2kff h GLY 87 Ca 0.30 0.03 0.03 0.00 0.00 0.00 0.00 47.33 47.69 2kff h GLY 87 CO -0.06 -0.04 -0.10 0.50 0.00 0.00 0.00 176.54 176.84 2kff h LYS 88 N 0.03 -0.11 -0.80 4.80 1.57 -0.72 -1.46 116.57 119.88 2kff h LYS 88 Ca 0.08 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.95 2kff h LYS 88 Cb 0.11 0.03 -0.07 0.00 0.08 0.00 0.00 32.23 32.37 2kff h LYS 88 CO -0.15 -0.07 0.45 0.82 -0.57 0.00 0.00 179.45 179.93 2kff h ILE 89 N -0.12 0.92 -0.45 1.86 2.04 -0.81 -0.50 117.51 120.46 2kff h ILE 89 Ca 0.08 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 2kff h ILE 89 Cb 0.23 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.36 2kff h ILE 89 CO -0.18 0.14 0.24 -0.25 0.00 0.00 0.00 178.15 178.10 2kff h TRP 90 N 0.78 0.63 0.00 1.37 2.91 -0.88 0.28 115.95 121.04 2kff h TRP 90 Ca 0.38 -0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.37 2kff h TRP 90 Cb 0.32 -0.20 -0.00 0.00 -0.51 0.00 0.00 29.16 28.77 2kff h TRP 90 CO -0.06 0.49 -0.05 0.87 -1.03 0.00 0.00 178.44 178.66 2kff h LYS 91 N 0.59 0.00 0.07 2.65 1.57 -0.06 0.14 116.57 121.53 2kff h LYS 91 Ca 0.16 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.57 2kff h LYS 91 Cb 0.08 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.35 2kff h LYS 91 CO -0.02 0.05 -2.12 1.28 -0.57 0.00 0.00 179.45 178.07 2kff n LEU 92 N -3.44 2.32 -0.04 2.94 4.77 -0.60 -4.47 117.00 118.48 2kff n LEU 92 Ca -0.02 0.13 -0.16 0.00 -0.03 0.00 0.00 56.01 55.93 2kff n LEU 92 Cb 0.17 -0.79 -0.07 0.00 -2.33 0.00 0.00 43.42 40.40 2kff n LEU 92 CO 0.26 0.79 0.39 0.00 -1.33 0.00 0.00 177.39 177.51 2kff h ALA 93 N 0.24 0.27 -0.90 -1.18 0.00 0.16 -3.35 119.26 114.51 2kff h ALA 93 Ca -0.46 -0.50 -0.69 0.00 0.00 0.00 0.00 54.91 53.26 2kff h ALA 93 Cb 2.01 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 19.68 2kff h ALA 93 CO 0.04 0.45 2.18 -3.47 0.00 0.00 0.00 179.25 178.44 2kff n ASP 94 N -4.18 4.89 -0.00 0.00 2.03 0.42 -4.44 116.55 115.26 2kff n ASP 94 Ca -0.07 -2.92 -0.08 0.00 0.52 0.00 0.00 54.79 52.24 2kff n ASP 94 Cb 0.60 -1.71 0.08 0.00 -0.72 0.00 0.00 41.12 39.37 2kff n ASP 94 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2kff h VAL 95 N 5.27 1.31 0.00 5.18 2.07 -1.85 -2.54 116.25 125.69 2kff h VAL 95 Ca 0.44 -1.65 0.00 0.00 0.82 0.00 0.00 66.70 66.31 2kff h VAL 95 Cb 0.85 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 2kff h VAL 95 CO 1.47 0.52 -0.23 -0.90 0.02 0.00 0.00 177.57 178.45 2kff n ASP 96 N -4.00 0.33 -3.47 0.57 5.75 -1.26 -4.96 116.55 109.51 2kff n ASP 96 Ca -0.02 0.22 -0.18 0.00 -0.01 0.00 0.00 54.79 54.80 2kff n ASP 96 Cb 0.55 -0.22 0.02 0.00 -1.03 0.00 0.00 41.12 40.44 2kff n ASP 96 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2kff n LYS 97 N -1.65 -1.40 -0.08 0.11 5.02 -0.96 -4.92 118.16 114.27 2kff n LYS 97 Ca 0.06 0.92 0.03 0.00 -2.02 0.00 0.00 58.31 57.30 2kff n LYS 97 Cb 0.36 -4.33 0.07 0.00 -0.02 0.00 0.00 35.03 31.11 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 -2.39 2.39 0.00 4.39 5.75 -1.26 -4.95 116.55 120.48 2kff n ASP 98 Ca -0.12 -1.94 0.00 0.00 -0.01 0.00 0.00 54.79 52.72 2kff n ASP 98 Cb 0.59 -0.11 0.00 0.00 -1.03 0.00 0.00 41.12 40.57 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 0.04 0.65 3.31 6.12 0.00 -1.26 -4.97 105.19 109.08 2kff n GLY 99 Ca 0.06 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.91 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 0.00 2.22 -0.20 0.99 1.43 -1.26 -3.84 118.68 118.01 2kff s LEU 100 Ca 0.00 -1.19 0.02 0.00 -1.03 0.00 0.00 54.13 51.93 2kff s LEU 100 Cb 0.00 -0.25 0.03 0.00 0.03 0.00 0.00 46.19 46.01 2kff s LEU 100 CO 0.00 -0.50 -0.16 -0.76 0.23 0.00 0.00 176.35 175.16 2kff s LEU 101 N -3.27 2.51 0.00 1.79 1.43 -0.69 -4.85 118.68 115.59 2kff s LEU 101 Ca 0.26 -0.88 -0.12 0.00 -1.03 0.00 0.00 54.13 52.36 2kff s LEU 101 Cb 0.05 -1.47 0.17 0.00 0.03 0.00 0.00 46.19 44.97 2kff s LEU 101 CO 0.07 -0.07 0.91 -0.90 0.23 0.00 0.00 176.35 176.59 2kff n ASP 102 N 4.58 -0.18 0.20 2.29 5.68 -1.26 -0.92 116.55 126.93 2kff n ASP 102 Ca -0.18 -1.29 0.04 0.00 -0.50 0.00 0.00 54.79 52.86 2kff n ASP 102 Cb 0.47 -0.72 0.42 0.00 -1.14 0.00 0.00 41.12 40.16 2kff n ASP 102 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 2kff h ASP 103 N -1.37 0.00 0.20 -1.12 2.03 -1.99 0.18 116.42 114.36 2kff h ASP 103 Ca -0.30 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 55.99 2kff h ASP 103 Cb 0.84 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.34 2kff h ASP 103 CO 0.21 0.31 -0.10 -0.33 -1.03 0.00 0.00 179.24 178.30 2kff h GLU 104 N 0.00 -0.26 -0.78 4.15 5.08 -1.95 -1.95 114.58 118.86 2kff h GLU 104 Ca -0.00 0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 2kff h GLU 104 Cb 0.56 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 2kff h GLU 104 CO 0.04 0.12 0.32 0.93 -1.00 0.00 0.00 179.01 179.42 2kff h GLU 105 N -0.75 1.16 -0.39 2.33 5.08 -1.71 -0.42 114.58 119.87 2kff h GLU 105 Ca -0.03 -0.20 -0.15 0.00 -1.00 0.00 0.00 59.36 57.98 2kff h GLU 105 Cb 0.50 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2kff h GLU 105 CO 0.05 0.93 -0.34 0.35 -1.00 0.00 0.00 179.01 179.00 2kff h PHE 106 N 1.14 1.10 -0.29 4.33 3.57 -0.73 -1.56 116.94 124.50 2kff h PHE 106 Ca 0.26 -0.32 -0.04 0.00 3.53 0.00 0.00 57.97 61.41 2kff h PHE 106 Cb 0.20 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 2kff h PHE 106 CO 0.02 1.14 0.03 0.00 -2.23 0.00 0.00 178.31 177.26 2kff h ALA 107 N 0.78 1.50 -0.12 2.41 0.00 -0.91 0.46 119.26 123.39 2kff h ALA 107 Ca 0.07 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2kff h ALA 107 Cb 0.93 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2kff h ALA 107 CO 0.09 0.36 0.04 1.25 0.00 0.00 0.00 179.25 180.99 2kff h LEU 108 N 0.42 0.17 -0.38 0.00 7.12 -0.75 -1.35 115.31 120.54 2kff h LEU 108 Ca 0.10 -0.19 0.05 0.00 0.13 0.00 0.00 57.88 57.97 2kff h LEU 108 Cb 0.24 -0.04 -0.05 0.00 -0.53 0.00 0.00 40.66 40.28 2kff h LEU 108 CO 0.00 0.32 0.10 0.00 -0.13 0.00 0.00 178.44 178.74 2kff h ALA 109 N 0.86 0.43 0.00 1.25 0.00 -0.56 -0.34 119.26 120.90 2kff h ALA 109 Ca 0.04 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2kff h ALA 109 Cb 0.21 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2kff h ALA 109 CO -0.00 -0.30 -0.14 -0.91 0.00 0.00 0.00 179.25 177.90 2kff h ASN 110 N 0.24 0.00 0.75 0.00 -0.26 -0.81 0.04 115.58 115.55 2kff h ASN 110 Ca 0.18 0.00 -0.25 0.00 -0.56 0.00 0.00 56.30 55.67 2kff h ASN 110 Cb 0.19 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.44 2kff h ASN 110 CO -0.22 0.14 -1.21 -0.74 -1.06 0.00 0.00 177.43 174.34 2kff h HIS 111 N 0.00 0.25 -0.22 1.19 2.76 -0.17 0.20 115.15 119.16 2kff h HIS 111 Ca -0.00 -0.18 -0.17 0.00 -2.20 0.00 0.00 60.37 57.82 2kff h HIS 111 Cb 0.27 -0.01 -0.00 0.00 1.55 0.00 0.00 27.41 29.22 2kff h HIS 111 CO 0.00 1.16 -0.54 -0.07 -1.30 0.00 0.00 177.93 177.18 2kff h LEU 112 N 0.04 0.72 -0.76 0.26 3.38 -0.57 -1.87 115.31 116.51 2kff h LEU 112 Ca -0.11 -0.38 -0.13 0.00 0.09 0.00 0.00 57.88 57.35 2kff h LEU 112 Cb 1.90 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 42.43 2kff h LEU 112 CO 0.16 1.12 -0.53 0.40 0.09 0.00 0.00 178.44 179.68 2kff h ILE 113 N 0.50 1.36 0.04 1.22 2.04 -1.02 -2.08 117.51 119.57 2kff h ILE 113 Ca 0.01 -1.80 0.03 0.00 1.00 0.00 0.00 64.86 64.10 2kff h ILE 113 Cb 1.10 1.87 -0.05 0.00 -0.74 0.00 0.00 36.82 39.00 2kff h ILE 113 CO 0.11 0.53 -0.32 0.50 0.00 0.00 0.00 178.15 178.97 2kff h LYS 114 N 0.19 -0.48 -0.40 2.37 1.63 -0.25 0.28 116.57 119.91 2kff h LYS 114 Ca 0.00 0.03 -0.08 0.00 -0.85 0.00 0.00 60.65 59.75 2kff h LYS 114 Cb 0.99 0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 32.72 2kff h LYS 114 CO 0.08 -0.32 -0.09 -0.39 -3.45 0.00 0.00 179.45 175.28 2kff h VAL 115 N -0.50 1.25 -0.82 2.00 -1.51 -1.29 -1.49 116.25 113.90 2kff h VAL 115 Ca 0.05 -1.09 0.03 0.00 -1.23 0.00 0.00 66.70 64.46 2kff h VAL 115 Cb 0.56 1.04 -0.05 0.00 -2.13 0.00 0.00 31.29 30.72 2kff h VAL 115 CO -0.24 0.37 0.52 0.11 -1.23 0.00 0.00 177.57 177.10 2kff h LYS 116 N 0.64 0.99 0.00 5.19 1.79 -1.03 0.57 116.57 124.72 2kff h LYS 116 Ca 0.11 -0.06 -0.02 0.00 -2.18 0.00 0.00 60.65 58.50 2kff h LYS 116 Cb 0.53 -0.22 -0.00 0.00 -1.58 0.00 0.00 32.23 30.95 2kff h LYS 116 CO 0.03 0.65 -0.12 -0.07 -1.08 0.00 0.00 179.45 178.87 2kff h LEU 117 N 1.02 0.00 -0.05 2.94 3.38 0.42 -1.46 115.31 121.56 2kff h LEU 117 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 2kff h LEU 117 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2kff h LEU 117 CO -0.11 0.12 -0.11 -0.62 0.09 0.00 0.00 178.44 177.80 2kff n GLU 118 N -3.29 0.22 -1.15 1.13 1.02 -0.64 -4.90 120.64 113.03 2kff n GLU 118 Ca 0.00 -0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 2kff n GLU 118 Cb 0.35 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.27 2kff n GLU 118 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kff n GLY 119 N 1.42 1.07 3.85 0.62 0.00 -0.55 -5.09 105.19 106.51 2kff n GLY 119 Ca 0.10 -0.51 -0.24 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.01 2.17 -0.10 1.61 3.76 0.15 -5.02 115.29 115.85 2kff s HIS 120 Ca 0.00 -0.69 -0.01 0.00 -0.15 0.00 0.00 55.06 54.21 2kff s HIS 120 Cb 0.00 -1.99 -0.03 0.00 1.11 0.00 0.00 32.58 31.67 2kff s HIS 120 CO 0.00 -0.20 -0.04 -1.21 -0.85 0.00 0.00 174.74 172.44 2kff s GLU 121 N -4.14 3.10 0.18 1.40 0.41 -1.26 -4.13 118.70 114.26 2kff s GLU 121 Ca 0.39 -0.51 -0.27 0.00 -0.41 0.00 0.00 54.97 54.18 2kff s GLU 121 Cb -0.01 -2.74 -0.08 0.00 -1.78 0.00 0.00 34.13 29.52 2kff s GLU 121 CO 0.23 0.53 0.82 -0.48 -0.49 0.00 0.00 175.26 175.88 2kff s LEU 122 N -0.44 4.60 0.25 1.80 0.05 -1.26 -4.94 118.68 118.75 2kff s LEU 122 Ca 0.07 1.72 0.19 0.00 0.05 0.00 0.00 54.13 56.16 2kff s LEU 122 Cb -0.12 -3.38 0.96 0.00 -2.05 0.00 0.00 46.19 41.60 2kff s LEU 122 CO 0.02 0.18 1.58 -2.65 -0.55 0.00 0.00 176.35 174.93 2kff n PRO 123 N 1.66 0.13 -1.32 1.48 -0.02 -1.26 -4.81 135.00 130.86 2kff n PRO 123 Ca -0.04 0.56 -0.11 0.00 -2.02 0.00 0.00 63.50 61.89 2kff n PRO 123 Cb 0.48 -1.87 -0.05 0.00 -0.02 0.00 0.00 33.50 32.05 2kff n PRO 123 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kff n ALA 124 N -1.73 -0.17 -2.29 3.55 0.00 -1.26 -4.96 120.51 113.64 2kff n ALA 124 Ca -0.00 0.18 -0.16 0.00 0.00 0.00 0.00 53.44 53.46 2kff n ALA 124 Cb 0.08 -1.59 -0.10 0.00 0.00 0.00 0.00 19.45 17.83 2kff n ALA 124 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2kff s ASP 125 N -2.53 1.06 -0.57 0.00 -4.77 -1.26 -5.03 116.67 103.57 2kff s ASP 125 Ca 0.00 -1.45 0.00 0.00 -3.30 0.00 0.00 52.55 47.81 2kff s ASP 125 Cb 0.00 0.29 0.15 0.00 -1.09 0.00 0.00 42.92 42.27 2kff s ASP 125 CO 0.00 -0.81 0.35 -0.76 0.70 0.00 0.00 175.17 174.65 2kff s LEU 126 N -3.30 4.83 0.73 2.11 1.43 -1.26 -5.01 118.68 118.22 2kff s LEU 126 Ca 0.37 -2.91 -0.14 0.00 -1.03 0.00 0.00 54.13 50.42 2kff s LEU 126 Cb 0.07 -1.76 0.04 0.00 0.03 0.00 0.00 46.19 44.57 2kff s LEU 126 CO 0.15 -0.31 1.18 -2.16 0.23 0.00 0.00 176.35 175.44 2kff s PRO 127 N -0.14 2.16 0.61 1.29 0.04 -1.26 -4.51 135.00 133.19 2kff s PRO 127 Ca 0.17 1.67 0.27 0.00 0.04 0.00 0.00 61.00 63.15 2kff s PRO 127 Cb -0.23 -1.85 1.36 0.00 0.04 0.00 0.00 34.50 33.83 2kff s PRO 127 CO -0.02 -1.80 1.78 -1.35 0.04 0.00 0.00 177.00 175.65 2kff h PRO 128 N -0.38 0.00 -0.33 0.56 0.11 -1.99 0.35 132.00 130.31 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 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2kff h PRO 128 CO 0.50 0.00 0.00 -2.39 -0.21 0.00 0.00 178.00 175.90 2kff n HIS 129 N -3.43 0.43 0.00 0.65 1.44 -1.26 -4.21 115.22 108.84 2kff n HIS 129 Ca 0.08 -0.22 0.00 0.00 -2.01 0.00 0.00 57.72 55.57 2kff n HIS 129 Cb 0.75 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.86 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 1.11 1.00 -4.67 2.39 4.77 0.10 -3.43 117.00 118.28 2kff n LEU 130 Ca 0.18 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.73 2kff n LEU 130 Cb 0.51 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.58 2kff n LEU 130 CO 0.15 0.17 0.97 0.54 -1.33 0.00 0.00 177.39 177.88 2kff s VAL 131 N -1.82 4.49 0.17 4.08 0.11 0.04 -4.96 120.40 122.52 2kff s VAL 131 Ca 0.00 1.79 -0.33 0.00 -2.93 0.00 0.00 61.98 60.51 2kff s VAL 131 Cb 0.00 -4.15 -0.13 0.00 -1.53 0.00 0.00 36.38 30.57 2kff s VAL 131 CO 0.00 -0.11 1.67 -0.81 -3.33 0.00 0.00 175.10 172.52 2kff n PRO 132 N 6.07 2.47 0.00 1.54 -0.04 -1.26 -4.86 135.00 138.92 2kff n PRO 132 Ca 0.12 0.89 0.04 0.00 -0.04 0.00 0.00 63.50 64.52 2kff n PRO 132 Cb 0.46 -2.71 0.21 0.00 -0.04 0.00 0.00 33.50 31.42 2kff n PRO 132 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2kff n PRO 133 N 3.89 0.11 0.07 0.54 -0.04 -1.26 -2.58 135.00 135.73 2kff n PRO 133 Ca 0.17 0.22 0.12 0.00 -0.04 0.00 0.00 63.50 63.97 2kff n PRO 133 Cb 0.32 -1.50 0.46 0.00 -0.04 0.00 0.00 33.50 32.74 2kff n PRO 133 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2kff n SER 134 N -1.31 0.45 -0.11 3.54 3.41 -1.26 -2.83 113.62 115.52 2kff n SER 134 Ca 0.04 0.57 0.10 0.00 -0.26 0.00 0.00 58.87 59.31 2kff n SER 134 Cb 0.07 -0.68 0.15 0.00 -0.26 0.00 0.00 64.21 63.49 2kff n SER 134 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2kff n LYS 135 N -1.95 1.33 -4.55 4.33 4.01 -1.06 -5.01 118.16 115.25 2kff n LYS 135 Ca 0.05 -2.61 -0.33 0.00 -0.51 0.00 0.00 58.31 54.90 2kff n LYS 135 Cb 0.32 -1.51 -0.11 0.00 -0.51 0.00 0.00 35.03 33.22 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 -2.89 2.71 0.01 1.97 0.52 -1.13 -5.04 118.95 115.10 2kff s ARG 136 Ca 0.32 -0.59 -0.02 0.00 -0.52 0.00 0.00 55.73 54.92 2kff s ARG 136 Cb 0.28 -2.58 -0.01 0.00 0.52 0.00 0.00 34.95 33.16 2kff s ARG 136 CO 0.03 0.65 0.02 1.03 0.02 0.00 0.00 175.30 177.04 2kff s ARG 137 N -1.01 0.31 0.00 3.54 0.52 -1.26 -5.04 118.95 116.01 2kff s ARG 137 Ca 0.14 -0.47 0.03 0.00 -0.52 0.00 0.00 55.73 54.92 2kff s ARG 137 Cb -0.11 0.12 -0.01 0.00 0.52 0.00 0.00 34.95 35.47 2kff s ARG 137 CO 0.04 -0.06 -0.10 -1.58 0.02 0.00 0.00 175.30 173.62 2kff s HIS 138 N -1.23 0.90 -0.79 -0.53 5.65 -1.26 -5.27 115.29 112.76 2kff s HIS 138 Ca -0.13 -0.21 0.06 0.00 0.25 0.00 0.00 55.06 55.03 2kff s HIS 138 Cb -0.08 -0.57 0.05 0.00 -1.18 0.00 0.00 32.58 30.80 2kff s HIS 138 CO -0.00 -0.01 0.70 -1.91 -0.65 0.00 0.00 174.74 172.87