#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kob n ASP 62 N 0.00 2.29 -4.93 6.15 9.92 -1.26 -5.00 116.55 123.71 2kob n ASP 62 Ca 0.00 -2.21 -0.25 0.00 -0.53 0.00 0.00 54.79 51.79 2kob n ASP 62 Cb 0.00 0.04 -0.02 0.00 -0.64 0.00 0.00 41.12 40.51 2kob n ASP 62 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2kob s SER 63 N -2.90 6.33 0.33 -2.24 0.01 -1.26 -2.41 113.70 111.56 2kob s SER 63 Ca 0.14 0.52 0.00 0.00 1.31 0.00 0.00 55.95 57.92 2kob s SER 63 Cb -0.01 -2.06 0.54 0.00 0.21 0.00 0.00 66.02 64.70 2kob s SER 63 CO 0.09 -0.26 1.99 0.15 0.41 0.00 0.00 173.24 175.62 2kob h PHE 64 N 1.04 0.91 -0.93 2.43 3.57 -0.74 -1.84 116.94 121.38 2kob h PHE 64 Ca -0.49 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.08 2kob h PHE 64 Cb 1.21 -0.31 -0.06 0.00 2.79 0.00 0.00 35.95 39.58 2kob h PHE 64 CO 0.53 0.57 0.60 0.78 -2.23 0.00 0.00 178.31 178.57 2kob h GLY 65 N 0.98 1.38 1.00 2.40 0.00 -1.61 0.43 103.07 107.65 2kob h GLY 65 Ca 0.27 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 2kob h GLY 65 CO -0.06 0.36 -0.16 -0.55 0.00 0.00 0.00 176.54 176.14 2kob h ASP 66 N 1.14 -0.38 1.42 0.19 5.19 -1.63 -2.48 116.42 119.87 2kob h ASP 66 Ca 0.38 0.01 -0.06 0.00 -0.62 0.00 0.00 57.03 56.75 2kob h ASP 66 Cb 0.06 0.10 -0.01 0.00 0.18 0.00 0.00 39.33 39.66 2kob h ASP 66 CO -0.14 -0.27 -0.27 -0.50 -3.12 0.00 0.00 179.24 174.94 2kob h TRP 67 N -0.44 0.00 -0.11 4.55 4.06 -1.26 -2.36 115.95 120.39 2kob h TRP 67 Ca -0.04 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.90 2kob h TRP 67 Cb 0.34 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.49 2kob h TRP 67 CO -0.06 0.27 0.04 0.00 -3.56 0.00 0.00 178.44 175.14 2kob h ALA 68 N 1.73 0.14 0.00 1.49 0.00 -0.01 -0.11 119.26 122.49 2kob h ALA 68 Ca -0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 2kob h ALA 68 Cb 1.06 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 2kob h ALA 68 CO 0.04 -0.26 -0.15 0.93 0.00 0.00 0.00 179.25 179.81 2kob h GLU 69 N 0.01 0.00 -0.40 0.00 5.08 -1.40 -0.67 114.58 117.20 2kob h GLU 69 Ca 0.04 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.29 2kob h GLU 69 Cb 0.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2kob h GLU 69 CO -0.00 0.15 -0.18 -0.22 -1.00 0.00 0.00 179.01 177.76 2kob h LYS 70 N 0.00 0.83 -0.54 2.33 3.64 -1.16 0.50 116.57 122.18 2kob h LYS 70 Ca -0.00 -0.35 -0.01 0.00 -1.27 0.00 0.00 60.65 59.01 2kob h LYS 70 Cb 0.83 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.59 2kob h LYS 70 CO 0.02 0.99 0.29 0.35 -2.27 0.00 0.00 179.45 178.83 2kob h PHE 71 N 0.64 0.74 -0.67 1.91 3.57 -0.53 -0.64 116.94 121.95 2kob h PHE 71 Ca 0.09 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.63 2kob h PHE 71 Cb 0.73 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 39.18 2kob h PHE 71 CO 0.06 0.54 0.38 -0.07 -2.23 0.00 0.00 178.31 176.99 2kob h LEU 72 N 0.72 0.56 -0.97 0.59 3.38 -0.96 -1.23 115.31 117.41 2kob h LEU 72 Ca 0.19 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.12 2kob h LEU 72 Cb 0.05 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2kob h LEU 72 CO -0.03 0.37 0.07 0.50 0.09 0.00 0.00 178.44 179.43 2kob h LYS 73 N 0.70 0.82 -0.18 1.13 3.64 -0.42 0.89 116.57 123.14 2kob h LYS 73 Ca 0.30 -0.19 -0.11 0.00 -1.27 0.00 0.00 60.65 59.37 2kob h LYS 73 Cb 0.18 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 2kob h LYS 73 CO -0.18 0.78 -0.38 0.66 -2.27 0.00 0.00 179.45 178.06 2kob h SER 74 N 0.78 0.42 -0.33 4.20 4.64 -0.42 -1.03 113.55 121.81 2kob h SER 74 Ca 0.16 -0.18 -0.16 0.00 -0.47 0.00 0.00 61.79 61.14 2kob h SER 74 Cb 0.37 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 2kob h SER 74 CO 0.01 0.77 -0.42 0.11 -0.87 0.00 0.00 176.83 176.43 2kob h LYS 75 N 0.34 0.89 -0.48 4.77 1.79 -0.73 0.13 116.57 123.27 2kob h LYS 75 Ca 0.03 -0.48 0.04 0.00 -2.18 0.00 0.00 60.65 58.06 2kob h LYS 75 Cb 0.83 0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 31.46 2kob h LYS 75 CO 0.07 1.13 0.24 1.49 -1.08 0.00 0.00 179.45 181.29 2kob h GLU 76 N 0.72 0.45 0.00 3.15 4.81 -0.49 -1.77 114.58 121.46 2kob h GLU 76 Ca 0.05 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 2kob h GLU 76 Cb 1.01 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.29 2kob h GLU 76 CO 0.10 0.30 -0.04 0.00 -0.73 0.00 0.00 179.01 178.64 2kob h ALA 77 N 1.27 0.98 0.19 2.92 0.00 -1.13 -3.33 119.26 120.16 2kob h ALA 77 Ca 0.21 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2kob h ALA 77 Cb 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2kob h ALA 77 CO -0.16 0.01 -0.09 0.22 0.00 0.00 0.00 179.25 179.23 2kob h ASP 78 N 0.00 -0.22 0.00 0.00 3.58 0.04 -3.48 116.42 116.33 2kob h ASP 78 Ca -0.00 -0.27 0.00 0.00 0.42 0.00 0.00 57.03 57.18 2kob h ASP 78 Cb 1.01 0.06 0.00 0.00 1.72 0.00 0.00 39.33 42.11 2kob h ASP 78 CO 0.00 0.19 0.00 0.61 -2.88 0.00 0.00 179.24 177.16 2kob n GLY 79 N -0.07 -0.10 3.36 -0.78 0.00 -0.74 -5.08 105.19 101.78 2kob n GLY 79 Ca -0.09 -0.22 -0.27 0.00 0.00 0.00 0.00 46.02 45.44 2kob n GLY 79 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2kob s VAL 80 N 0.00 2.08 0.86 1.61 -7.23 -1.21 -5.07 120.40 111.44 2kob s VAL 80 Ca 0.00 -1.70 -0.12 0.00 -1.81 0.00 0.00 61.98 58.35 2kob s VAL 80 Cb 0.00 -1.86 0.11 0.00 0.56 0.00 0.00 36.38 35.19 2kob s VAL 80 CO 0.00 0.03 1.13 -0.55 -0.31 0.00 0.00 175.10 175.40 2kob s SER 81 N -2.04 3.99 0.11 4.85 0.15 -1.26 -4.75 113.70 114.76 2kob s SER 81 Ca 0.12 1.02 -0.22 0.00 0.70 0.00 0.00 55.95 57.56 2kob s SER 81 Cb -0.10 -1.62 -0.07 0.00 -1.71 0.00 0.00 66.02 62.52 2kob s SER 81 CO 0.06 -2.25 1.70 0.58 1.20 0.00 0.00 173.24 174.52 2kob h VAL 82 N -1.29 0.75 -0.02 4.45 2.07 -2.01 0.13 116.25 120.33 2kob h VAL 82 Ca -0.49 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.04 2kob h VAL 82 Cb 1.31 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 31.84 2kob h VAL 82 CO 0.62 0.00 0.02 0.28 0.02 0.00 0.00 177.57 178.51 2kob h SER 83 N -0.12 0.00 0.05 0.57 0.02 -1.97 0.40 113.55 112.49 2kob h SER 83 Ca 0.06 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.94 2kob h SER 83 Cb 0.20 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.75 2kob h SER 83 CO -0.14 0.00 -0.33 -0.61 -1.14 0.00 0.00 176.83 174.61 2kob h GLN 84 N 0.00 0.10 -0.55 3.45 5.75 -1.63 -1.97 115.11 120.26 2kob h GLN 84 Ca 0.01 -0.17 -0.05 0.00 -0.15 0.00 0.00 58.65 58.29 2kob h GLN 84 Cb 0.05 0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.64 2kob h GLN 84 CO -0.00 1.08 0.14 1.25 -2.65 0.00 0.00 178.83 178.65 2kob h LEU 85 N -0.79 0.83 -1.32 -2.39 5.85 -0.40 -1.12 115.31 115.97 2kob h LEU 85 Ca -0.06 -0.23 -0.04 0.00 0.84 0.00 0.00 57.88 58.38 2kob h LEU 85 Cb 1.23 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 2kob h LEU 85 CO 0.04 0.85 0.01 -1.13 -0.34 0.00 0.00 178.44 177.87 2kob h ASN 86 N 0.78 0.43 -0.38 1.25 -1.24 -0.32 -0.18 115.58 115.91 2kob h ASN 86 Ca 0.17 -0.07 -0.02 0.00 0.71 0.00 0.00 56.30 57.09 2kob h ASN 86 Cb 0.34 -0.11 -0.02 0.00 0.73 0.00 0.00 38.32 39.26 2kob h ASN 86 CO 0.00 0.49 0.15 -1.28 -1.29 0.00 0.00 177.43 175.50 2kob h SER 87 N 0.45 0.53 -0.67 1.15 0.87 -0.72 0.13 113.55 115.30 2kob h SER 87 Ca 0.10 -0.17 0.03 0.00 -1.23 0.00 0.00 61.79 60.51 2kob h SER 87 Cb 0.28 -0.14 -0.04 0.00 -0.44 0.00 0.00 62.40 62.06 2kob h SER 87 CO 0.01 0.56 0.42 1.88 -0.53 0.00 0.00 176.83 179.16 2kob h TYR 88 N 0.48 0.79 -0.74 2.24 0.05 -0.39 -1.30 116.97 118.09 2kob h TYR 88 Ca 0.13 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.93 2kob h TYR 88 Cb 0.20 -0.26 -0.04 0.00 1.01 0.00 0.00 36.73 37.64 2kob h TYR 88 CO -0.00 0.46 0.46 0.87 -1.05 0.00 0.00 178.16 178.90 2kob h LYS 89 N 0.83 1.00 -0.59 4.88 1.57 -0.73 -1.96 116.57 121.57 2kob h LYS 89 Ca 0.26 -0.08 0.05 0.00 -1.87 0.00 0.00 60.65 59.01 2kob h LYS 89 Cb -0.00 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 32.04 2kob h LYS 89 CO -0.10 0.69 0.32 -0.97 -0.57 0.00 0.00 179.45 178.82 2kob h ASN 90 N 1.01 0.46 -0.06 0.86 -1.24 0.05 0.23 115.58 116.89 2kob h ASN 90 Ca 0.27 0.03 -0.00 0.00 0.71 0.00 0.00 56.30 57.30 2kob h ASN 90 Cb -0.06 -0.06 -0.00 0.00 0.73 0.00 0.00 38.32 38.93 2kob h ASN 90 CO -0.05 0.31 0.02 1.88 -1.29 0.00 0.00 177.43 178.30 2kob h TYR 91 N 0.60 0.10 -0.48 0.67 0.05 -0.90 0.20 116.97 117.21 2kob h TYR 91 Ca 0.26 -0.01 -0.07 0.00 0.05 0.00 0.00 58.73 58.97 2kob h TYR 91 Cb 0.16 -0.03 -0.02 0.00 1.01 0.00 0.00 36.73 37.85 2kob h TYR 91 CO -0.09 0.24 0.03 0.00 -1.05 0.00 0.00 178.16 177.28 2kob h ARG 93 N 0.68 0.00 0.13 0.00 2.43 -0.54 -3.22 114.38 113.86 2kob h ARG 93 Ca 0.14 0.00 -0.36 0.00 -0.81 0.00 0.00 59.98 58.95 2kob h ARG 93 Cb 0.47 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 2kob h ARG 93 CO 0.02 0.89 -1.92 -0.97 -1.51 0.00 0.00 179.97 176.48 2kob h ASN 94 N -1.00 0.43 0.49 -3.80 -1.24 -0.72 -3.14 115.58 106.59 2kob h ASN 94 Ca -0.07 -0.94 -0.30 0.00 0.71 0.00 0.00 56.30 55.70 2kob h ASN 94 Cb 0.97 -0.14 -0.02 0.00 0.73 0.00 0.00 38.32 39.86 2kob h ASN 94 CO -0.05 1.83 -1.55 0.45 -1.29 0.00 0.00 177.43 176.83 2kob h HIS 95 N 0.02 0.32 -0.59 0.67 3.86 -1.10 -3.34 115.15 114.99 2kob h HIS 95 Ca -0.41 -0.23 -0.25 0.00 -1.16 0.00 0.00 60.37 58.32 2kob h HIS 95 Cb 2.01 -0.01 -0.15 0.00 1.06 0.00 0.00 27.41 30.32 2kob h HIS 95 CO 0.08 1.30 0.20 1.28 0.86 0.00 0.00 177.93 181.66 2kob n LEU 96 N -3.37 5.22 -0.18 2.43 4.77 0.13 -4.75 117.00 121.25 2kob n LEU 96 Ca -0.16 -3.50 -0.05 0.00 -0.03 0.00 0.00 56.01 52.28 2kob n LEU 96 Cb 1.03 -0.70 0.02 0.00 -2.33 0.00 0.00 43.42 41.44 2kob n LEU 96 CO 0.48 1.02 0.66 0.28 -1.33 0.00 0.00 177.39 178.50 2kob h SER 97 N 1.51 -0.98 0.62 -1.43 0.02 -1.63 0.93 113.55 112.58 2kob h SER 97 Ca 0.31 0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 61.46 2kob h SER 97 Cb 2.10 0.51 -0.00 0.00 0.14 0.00 0.00 62.40 65.14 2kob h SER 97 CO 0.63 -0.28 -0.03 1.55 -1.14 0.00 0.00 176.83 177.56 2kob h PRO 98 N -0.14 0.00 0.00 3.45 0.13 -1.90 -2.54 132.00 131.00 2kob h PRO 98 Ca 0.24 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 65.15 2kob h PRO 98 Cb 0.52 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.62 2kob h PRO 98 CO -0.63 0.03 -1.46 -0.07 -0.23 0.00 0.00 178.00 175.64 2kob h LEU 99 N 0.00 0.00 -1.83 1.56 4.07 -1.40 -3.37 115.31 114.35 2kob h LEU 99 Ca -0.00 0.00 0.06 0.00 0.08 0.00 0.00 57.88 58.02 2kob h LEU 99 Cb 0.34 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.06 2kob h LEU 99 CO 0.00 0.78 0.25 0.22 -1.08 0.00 0.00 178.44 178.61 2kob h TYR 100 N 0.00 0.21 -0.61 1.13 3.20 -0.45 0.65 116.97 121.11 2kob h TYR 100 Ca -0.19 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.68 2kob h TYR 100 Cb 1.77 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.97 2kob h TYR 100 CO 0.00 0.11 0.00 -1.33 -1.64 0.00 0.00 178.16 175.30 2kob n MET 101 N -4.47 3.49 -4.00 1.82 2.81 -1.25 -2.00 117.12 113.51 2kob n MET 101 Ca 0.05 -2.79 -0.30 0.00 -1.81 0.00 0.00 57.70 52.85 2kob n MET 101 Cb 0.28 -1.79 -0.05 0.00 -0.71 0.00 0.00 33.22 30.95 2kob n MET 101 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2kob s LYS 102 N -1.73 3.11 0.71 0.03 1.02 0.22 -4.97 119.74 118.14 2kob s LYS 102 Ca 0.48 -0.63 -0.11 0.00 0.02 0.00 0.00 55.97 55.73 2kob s LYS 102 Cb 0.30 -2.84 0.02 0.00 -0.52 0.00 0.00 37.83 34.79 2kob s LYS 102 CO 0.24 0.57 1.07 0.45 -0.92 0.00 0.00 175.35 176.75 2kob s SER 103 N -2.60 5.27 0.54 2.83 0.15 -1.26 -0.15 113.70 118.47 2kob s SER 103 Ca 0.32 1.49 0.21 0.00 0.70 0.00 0.00 55.95 58.67 2kob s SER 103 Cb -0.12 -2.35 1.41 0.00 -1.71 0.00 0.00 66.02 63.25 2kob s SER 103 CO 0.25 -1.50 2.14 -0.07 1.20 0.00 0.00 173.24 175.26 2kob h LEU 104 N -0.76 0.00 -0.19 3.45 3.38 -1.78 0.52 115.31 119.94 2kob h LEU 104 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 2kob h LEU 104 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2kob h LEU 104 CO 0.58 0.00 -0.30 -0.24 0.09 0.00 0.00 178.44 178.57 2kob n SER 105 N -4.35 0.59 -0.29 -0.43 2.88 -1.26 -3.69 113.62 107.07 2kob n SER 105 Ca -0.01 -0.41 0.11 0.00 -1.33 0.00 0.00 58.87 57.23 2kob n SER 105 Cb 0.19 0.07 0.09 0.00 -0.75 0.00 0.00 64.21 63.81 2kob n SER 105 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2kob n GLU 106 N -1.15 0.76 -3.33 -1.46 1.02 0.16 -4.88 120.64 111.76 2kob n GLU 106 Ca 0.09 -0.58 -0.39 0.00 -0.02 0.00 0.00 57.16 56.26 2kob n GLU 106 Cb 0.33 -1.49 -0.08 0.00 -0.02 0.00 0.00 31.44 30.18 2kob n GLU 106 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2kob s ILE 107 N -2.64 5.15 0.01 -3.67 1.01 -1.14 -4.88 121.20 115.04 2kob s ILE 107 Ca 0.17 0.74 -0.08 0.00 0.00 0.00 0.00 60.65 61.48 2kob s ILE 107 Cb 0.18 -3.76 -0.05 0.00 0.01 0.00 0.00 42.46 38.84 2kob s ILE 107 CO 0.63 0.17 0.29 -0.76 0.00 0.00 0.00 174.94 175.28 2kob s LEU 108 N 1.83 4.38 0.20 2.97 1.43 -1.26 -4.85 118.68 123.38 2kob s LEU 108 Ca 0.19 0.63 -0.10 0.00 -1.03 0.00 0.00 54.13 53.82 2kob s LEU 108 Cb -0.15 -2.66 0.24 0.00 0.03 0.00 0.00 46.19 43.64 2kob s LEU 108 CO 0.09 0.26 1.77 -0.65 0.23 0.00 0.00 176.35 178.05 2kob h PRO 109 N 4.10 0.48 0.00 1.29 0.11 -1.95 -1.71 132.00 134.32 2kob h PRO 109 Ca -0.50 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.53 2kob h PRO 109 Cb 1.20 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2kob h PRO 109 CO 0.65 0.31 -0.24 0.00 -0.21 0.00 0.00 178.00 178.51 2kob h ALA 110 N 1.37 1.12 -0.31 -0.75 0.00 -1.89 -1.27 119.26 117.53 2kob h ALA 110 Ca 0.29 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 2kob h ALA 110 Cb 0.28 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2kob h ALA 110 CO -0.24 0.30 0.01 0.22 0.00 0.00 0.00 179.25 179.54 2kob h ASP 111 N 0.00 0.52 -0.42 0.00 3.58 -1.72 0.16 116.42 118.53 2kob h ASP 111 Ca -0.00 -0.30 -0.15 0.00 0.42 0.00 0.00 57.03 57.00 2kob h ASP 111 Cb 0.65 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.55 2kob h ASP 111 CO 0.03 0.69 -0.32 0.40 -2.88 0.00 0.00 179.24 177.16 2kob h ILE 112 N 0.33 1.27 -0.71 2.25 2.04 -1.25 -2.77 117.51 118.67 2kob h ILE 112 Ca 0.09 -1.49 0.04 0.00 1.00 0.00 0.00 64.86 64.50 2kob h ILE 112 Cb 0.42 1.27 -0.05 0.00 -0.74 0.00 0.00 36.82 37.72 2kob h ILE 112 CO 0.01 0.51 0.44 -0.61 0.00 0.00 0.00 178.15 178.50 2kob h GLN 113 N 0.81 0.82 -0.17 2.37 -0.00 -1.00 -0.16 115.11 117.77 2kob h GLN 113 Ca 0.08 -0.05 0.04 0.00 -0.00 0.00 0.00 58.65 58.72 2kob h GLN 113 Cb 0.91 -0.18 -0.04 0.00 0.00 0.00 0.00 27.48 28.17 2kob h GLN 113 CO 0.08 0.54 -0.06 1.03 0.00 0.00 0.00 178.83 180.43 2kob h SER 114 N 0.84 -0.21 -0.60 -0.69 0.87 -0.57 0.83 113.55 114.03 2kob h SER 114 Ca 0.29 0.06 0.03 0.00 -1.23 0.00 0.00 61.79 60.95 2kob h SER 114 Cb 0.06 0.13 -0.04 0.00 -0.44 0.00 0.00 62.40 62.11 2kob h SER 114 CO -0.13 -0.08 0.36 0.40 -0.53 0.00 0.00 176.83 176.85 2kob h ILE 115 N -0.03 1.04 -0.72 2.23 2.04 -1.09 0.45 117.51 121.43 2kob h ILE 115 Ca 0.09 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.68 2kob h ILE 115 Cb 0.16 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 36.50 2kob h ILE 115 CO -0.19 0.13 0.32 0.40 0.00 0.00 0.00 178.15 178.80 2kob h ILE 116 N 0.69 1.24 -0.14 -0.67 1.08 -0.53 0.11 117.51 119.29 2kob h ILE 116 Ca 0.25 -0.72 -0.13 0.00 -0.39 0.00 0.00 64.86 63.87 2kob h ILE 116 Cb 0.06 0.38 -0.01 0.00 -3.07 0.00 0.00 36.82 34.18 2kob h ILE 116 CO -0.12 0.30 -0.47 -1.13 -0.69 0.00 0.00 178.15 176.04 2kob h ASN 117 N 1.02 0.37 1.80 1.72 -1.24 -0.28 -2.79 115.58 116.17 2kob h ASN 117 Ca 0.24 -0.17 -0.04 0.00 0.71 0.00 0.00 56.30 57.04 2kob h ASN 117 Cb 0.17 -0.10 -0.01 0.00 0.73 0.00 0.00 38.32 39.10 2kob h ASN 117 CO -0.03 0.79 -0.20 -0.33 -1.29 0.00 0.00 177.43 176.37 2kob h GLU 118 N 0.28 0.00 -6.60 6.67 4.39 -0.60 -3.41 114.58 115.30 2kob h GLU 118 Ca 0.02 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 59.15 2kob h GLU 118 Cb 0.93 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.52 2kob h GLU 118 CO 0.08 0.19 0.96 0.99 -1.16 0.00 0.00 179.01 180.07 2kob s THR 119 N -3.11 4.15 -0.87 1.13 2.01 0.34 -4.95 115.64 114.33 2kob s THR 119 Ca 0.06 1.20 -0.00 0.00 0.31 0.00 0.00 61.69 63.25 2kob s THR 119 Cb 0.06 -4.45 0.23 0.00 0.01 0.00 0.00 72.50 68.35 2kob s THR 119 CO 0.70 -0.86 0.81 0.29 -0.69 0.00 0.00 174.62 174.88 2kob n LYS 120 N 7.78 2.70 -3.11 4.92 5.02 -1.26 -4.90 118.16 129.31 2kob n LYS 120 Ca 0.13 -4.51 -0.11 0.00 -2.02 0.00 0.00 58.31 51.80 2kob n LYS 120 Cb 0.48 -2.39 -0.03 0.00 -0.02 0.00 0.00 35.03 33.07 2kob n LYS 120 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2kob n LEU 121 N 2.03 0.00 -4.73 -0.35 4.32 -1.26 -5.13 117.00 111.87 2kob n LEU 121 Ca 0.23 -1.46 -0.38 0.00 -0.02 0.00 0.00 56.01 54.39 2kob n LEU 121 Cb 0.37 0.51 0.06 0.00 -1.62 0.00 0.00 43.42 42.74 2kob n LEU 121 CO 0.39 -0.23 0.94 0.00 -1.22 0.00 0.00 177.39 177.27 2kob n ALA 122 N -2.08 1.33 0.26 -1.18 0.00 -1.26 -4.82 120.51 112.76 2kob n ALA 122 Ca -0.07 0.05 0.08 0.00 0.00 0.00 0.00 53.44 53.50 2kob n ALA 122 Cb 0.28 -2.34 0.64 0.00 0.00 0.00 0.00 19.45 18.04 2kob n ALA 122 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2kob h LYS 123 N 0.88 0.00 -0.81 0.00 1.57 -1.93 0.27 116.57 116.56 2kob h LYS 123 Ca -0.51 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.28 2kob h LYS 123 Cb 1.33 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.60 2kob h LYS 123 CO 0.55 0.04 0.53 -0.97 -0.57 0.00 0.00 179.45 179.03 2kob h ASN 124 N 0.00 0.92 -0.23 0.86 -0.00 -1.99 0.17 115.58 115.31 2kob h ASN 124 Ca -0.00 -0.02 -0.19 0.00 -0.00 0.00 0.00 56.30 56.08 2kob h ASN 124 Cb 0.07 -0.23 0.00 0.00 -0.00 0.00 0.00 38.32 38.16 2kob h ASN 124 CO 0.00 0.67 -0.61 0.74 -0.00 0.00 0.00 177.43 178.23 2kob h THR 125 N 1.09 1.28 -0.82 -3.57 2.02 -1.31 -2.17 112.91 109.43 2kob h THR 125 Ca 0.30 -1.80 -0.02 0.00 0.77 0.00 0.00 66.41 65.66 2kob h THR 125 Cb -0.12 1.72 -0.04 0.00 -1.74 0.00 0.00 68.15 67.98 2kob h THR 125 CO -0.07 0.58 0.44 -0.07 0.37 0.00 0.00 175.52 176.77 2kob h LEU 126 N 0.63 1.03 -1.24 2.58 3.38 -0.91 -1.88 115.31 118.89 2kob h LEU 126 Ca -0.00 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 2kob h LEU 126 Cb 1.22 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 2kob h LEU 126 CO 0.13 0.84 -0.25 0.11 0.09 0.00 0.00 178.44 179.36 2kob h LYS 127 N 1.14 0.20 -0.52 1.13 1.57 -0.88 -1.41 116.57 117.80 2kob h LYS 127 Ca 0.29 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.99 2kob h LYS 127 Cb 0.05 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 2kob h LYS 127 CO -0.04 0.45 0.26 0.00 -0.57 0.00 0.00 179.45 179.54 2kob h ALA 128 N 1.56 0.67 -0.35 3.86 0.00 -0.68 0.31 119.26 124.64 2kob h ALA 128 Ca 0.03 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 2kob h ALA 128 Cb 0.55 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2kob h ALA 128 CO 0.04 0.23 -0.07 0.82 0.00 0.00 0.00 179.25 180.27 2kob h ILE 129 N 0.70 1.27 -0.07 0.00 2.04 -1.24 -1.97 117.51 118.25 2kob h ILE 129 Ca 0.18 -1.11 0.03 0.00 1.00 0.00 0.00 64.86 64.96 2kob h ILE 129 Cb 0.11 1.28 -0.04 0.00 -0.74 0.00 0.00 36.82 37.43 2kob h ILE 129 CO -0.02 0.37 -0.13 -0.09 0.00 0.00 0.00 178.15 178.27 2kob h ARG 130 N 0.46 -0.18 0.35 2.37 9.65 -0.93 -0.83 114.38 125.26 2kob h ARG 130 Ca 0.09 0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.97 2kob h ARG 130 Cb 0.56 0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 29.17 2kob h ARG 130 CO 0.03 -0.12 -0.23 -0.91 2.80 0.00 0.00 179.97 181.54 2kob h ASN 131 N -0.19 -0.58 -0.31 -3.80 2.35 -0.36 -1.03 115.58 111.66 2kob h ASN 131 Ca 0.07 0.04 0.07 0.00 -0.55 0.00 0.00 56.30 55.92 2kob h ASN 131 Cb 0.29 0.18 -0.07 0.00 0.05 0.00 0.00 38.32 38.77 2kob h ASN 131 CO -0.18 -0.36 -0.12 0.74 -1.65 0.00 0.00 177.43 175.86 2kob h THR 132 N -0.56 0.60 -0.14 2.81 2.02 -1.21 0.10 112.91 116.53 2kob h THR 132 Ca -0.03 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 2kob h THR 132 Cb 0.47 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 2kob h THR 132 CO 0.02 0.00 0.08 0.00 0.37 0.00 0.00 175.52 175.99 2kob h ALA 133 N 1.21 0.18 -0.54 6.16 0.00 -1.04 -2.35 119.26 122.88 2kob h ALA 133 Ca 0.16 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2kob h ALA 133 Cb 0.30 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2kob h ALA 133 CO -0.35 -0.29 0.21 0.66 0.00 0.00 0.00 179.25 179.48 2kob h SER 134 N 0.14 0.71 -0.26 0.00 4.64 -0.74 -2.40 113.55 115.63 2kob h SER 134 Ca 0.05 -0.09 -0.09 0.00 -0.47 0.00 0.00 61.79 61.19 2kob h SER 134 Cb 0.06 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 61.95 2kob h SER 134 CO -0.01 0.65 -0.13 1.56 -0.87 0.00 0.00 176.83 178.03 2kob h GLN 135 N 0.78 0.68 -0.25 4.77 1.08 -0.68 -0.89 115.11 120.60 2kob h GLN 135 Ca 0.19 -0.22 -0.05 0.00 -1.45 0.00 0.00 58.65 57.12 2kob h GLN 135 Cb 0.16 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.52 2kob h GLN 135 CO -0.02 0.78 -0.03 0.82 -0.95 0.00 0.00 178.83 179.44 2kob h ILE 136 N 0.61 1.27 -0.26 2.54 2.04 -0.94 -1.51 117.51 121.26 2kob h ILE 136 Ca 0.10 -0.98 -0.06 0.00 1.00 0.00 0.00 64.86 64.93 2kob h ILE 136 Cb 0.58 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 38.06 2kob h ILE 136 CO 0.04 0.31 -0.07 -0.26 0.00 0.00 0.00 178.15 178.17 2kob h PHE 137 N 0.22 0.56 -0.21 1.37 0.04 -1.31 -2.15 116.94 115.47 2kob h PHE 137 Ca 0.07 -0.12 -0.06 0.00 2.80 0.00 0.00 57.97 60.65 2kob h PHE 137 Cb 0.46 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.46 2kob h PHE 137 CO 0.04 0.72 -0.15 0.07 -0.60 0.00 0.00 178.31 178.39 2kob h ARG 138 N 0.24 0.34 -0.67 1.51 0.11 -1.19 -0.48 114.38 114.25 2kob h ARG 138 Ca 0.06 -0.09 -0.05 0.00 0.10 0.00 0.00 59.98 60.00 2kob h ARG 138 Cb 0.54 -0.04 -0.03 0.00 1.11 0.00 0.00 29.97 31.55 2kob h ARG 138 CO 0.03 0.49 0.22 1.25 0.10 0.00 0.00 179.97 182.05 2kob h LEU 139 N 0.32 0.97 -0.91 0.08 5.85 -1.11 0.73 115.31 121.23 2kob h LEU 139 Ca 0.06 -0.20 -0.07 0.00 0.84 0.00 0.00 57.88 58.51 2kob h LEU 139 Cb 0.45 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 2kob h LEU 139 CO 0.03 0.92 0.08 0.00 -0.34 0.00 0.00 178.44 179.12 2kob h ALA 140 N 1.09 1.10 -0.55 1.25 0.00 -0.68 -2.40 119.26 119.06 2kob h ALA 140 Ca 0.22 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2kob h ALA 140 Cb 0.29 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2kob h ALA 140 CO -0.01 0.58 0.19 0.82 0.00 0.00 0.00 179.25 180.84 2kob h ILE 141 N 0.83 1.23 0.00 0.00 2.04 -0.54 0.17 117.51 121.25 2kob h ILE 141 Ca 0.17 -0.75 0.00 0.00 1.00 0.00 0.00 64.86 65.28 2kob h ILE 141 Cb 0.39 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.15 2kob h ILE 141 CO 0.01 0.28 0.00 -0.62 0.00 0.00 0.00 178.15 177.82 2kob n GLU 142 N -4.47 0.05 -0.20 2.37 1.02 0.20 -1.50 120.64 118.11 2kob n GLU 142 Ca 0.03 0.24 0.06 0.00 -0.02 0.00 0.00 57.16 57.47 2kob n GLU 142 Cb 0.18 -1.50 0.15 0.00 -0.02 0.00 0.00 31.44 30.25 2kob n GLU 142 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2kob n ASN 143 N -1.44 2.90 -1.88 1.62 3.02 -0.79 -4.98 115.26 113.72 2kob n ASN 143 Ca 0.04 -2.47 -0.19 0.00 -0.03 0.00 0.00 54.58 51.93 2kob n ASN 143 Cb 0.14 -0.30 -0.04 0.00 -0.61 0.00 0.00 39.78 38.97 2kob n ASN 143 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2kob n ARG 144 N -0.32 -1.43 0.06 3.52 1.74 -0.56 -4.86 116.66 114.80 2kob n ARG 144 Ca 0.13 1.01 0.04 0.00 -0.77 0.00 0.00 57.85 58.26 2kob n ARG 144 Cb 0.56 -5.46 -0.05 0.00 -1.02 0.00 0.00 32.46 26.48 2kob n ARG 144 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2kob n ALA 145 N -0.68 2.17 -3.44 7.54 0.00 0.52 -4.96 120.51 121.66 2kob n ALA 145 Ca -0.21 -0.43 -0.13 0.00 0.00 0.00 0.00 53.44 52.66 2kob n ALA 145 Cb 0.65 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.07 2kob n ALA 145 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2kob s ILE 146 N -3.10 0.00 -0.13 0.00 2.07 -1.21 -4.47 121.20 114.37 2kob s ILE 146 Ca -0.02 -0.00 0.15 0.00 -1.41 0.00 0.00 60.65 59.36 2kob s ILE 146 Cb 0.09 -1.00 0.37 0.00 0.13 0.00 0.00 42.46 42.05 2kob s ILE 146 CO 0.81 -0.00 1.18 -0.67 -1.91 0.00 0.00 174.94 174.34 2kob n ASP 147 N -0.07 1.50 -3.79 4.50 2.03 -1.26 -3.78 116.55 115.68 2kob n ASP 147 Ca -0.17 -3.14 -0.14 0.00 0.52 0.00 0.00 54.79 51.85 2kob n ASP 147 Cb 0.63 -0.43 -0.15 0.00 -0.72 0.00 0.00 41.12 40.45 2kob n ASP 147 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 2kob s PHE 148 N -2.11 -0.04 -0.54 -0.67 5.36 -1.26 -5.11 117.98 113.61 2kob s PHE 148 Ca 0.33 0.22 -0.01 0.00 -0.96 0.00 0.00 56.93 56.51 2kob s PHE 148 Cb 0.33 -0.13 0.14 0.00 -0.34 0.00 0.00 43.02 43.02 2kob s PHE 148 CO -0.07 -0.09 0.33 1.21 -1.46 0.00 0.00 175.22 175.14 2kob s ASN 149 N 0.82 4.98 0.47 6.13 3.84 -1.26 -4.94 114.94 124.98 2kob s ASN 149 Ca -0.07 -2.71 0.19 0.00 0.21 0.00 0.00 52.86 50.49 2kob s ASN 149 Cb -0.09 -1.78 1.14 0.00 -0.55 0.00 0.00 41.25 39.96 2kob s ASN 149 CO -0.03 -0.36 2.00 -0.65 -2.79 0.00 0.00 177.10 175.26 2kob h PRO 150 N 7.11 0.00 0.00 0.43 0.11 -1.93 -2.51 132.00 135.20 2kob h PRO 150 Ca -0.05 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.04 2kob h PRO 150 Cb 0.96 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 2kob h PRO 150 CO 0.69 0.19 -0.09 0.00 -0.21 0.00 0.00 178.00 178.58 2kob h ALA 151 N 1.81 0.99 0.00 -0.75 0.00 -1.92 -2.45 119.26 116.94 2kob h ALA 151 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2kob h ALA 151 Cb 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2kob h ALA 151 CO 0.02 0.11 0.00 0.22 0.00 0.00 0.00 179.25 179.61 2kob h ASP 152 N 0.00 0.00 -0.14 0.00 1.82 -1.83 -2.63 116.42 113.64 2kob h ASP 152 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2kob h ASP 152 Cb 0.74 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.75 2kob h ASP 152 CO 0.01 0.00 0.00 -1.22 -1.61 0.00 0.00 179.24 176.42 2kob n TYR 153 N -2.63 0.16 -2.78 0.28 4.02 -0.92 -4.87 117.16 110.42 2kob n TYR 153 Ca 0.04 -0.08 -0.43 0.00 -0.01 0.00 0.00 57.90 57.42 2kob n TYR 153 Cb 0.40 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.69 2kob n TYR 153 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2kob s VAL 154 N -1.84 4.62 0.09 -0.72 1.01 -0.99 -4.86 120.40 117.71 2kob s VAL 154 Ca 0.34 1.39 -0.30 0.00 0.00 0.00 0.00 61.98 63.41 2kob s VAL 154 Cb 0.20 -4.31 -0.06 0.00 0.00 0.00 0.00 36.38 32.21 2kob s VAL 154 CO 0.30 -0.43 1.04 -0.60 0.00 0.00 0.00 175.10 175.41 2kob s ARG 155 N 3.39 4.59 -0.26 2.72 3.52 -1.26 -5.03 118.95 126.62 2kob s ARG 155 Ca 0.39 1.56 -0.14 0.00 -0.13 0.00 0.00 55.73 57.42 2kob s ARG 155 Cb -0.13 -3.37 -0.04 0.00 -1.56 0.00 0.00 34.95 29.85 2kob s ARG 155 CO 0.16 0.03 0.32 0.42 -0.81 0.00 0.00 175.30 175.42 2kob s ILE 156 N 0.38 5.22 0.25 4.11 -1.09 -1.26 -4.88 121.20 123.93 2kob s ILE 156 Ca 0.51 0.46 -0.31 0.00 -2.23 0.00 0.00 60.65 59.08 2kob s ILE 156 Cb -0.25 -3.65 -0.12 0.00 -1.58 0.00 0.00 42.46 36.86 2kob s ILE 156 CO 0.30 0.20 1.67 -2.65 -1.23 0.00 0.00 174.94 173.23 2kob n PRO 157 N 5.14 2.75 -0.51 2.79 -0.02 -1.26 -4.87 135.00 139.01 2kob n PRO 157 Ca -0.10 0.99 0.05 0.00 -2.02 0.00 0.00 63.50 62.41 2kob n PRO 157 Cb 0.51 -2.80 0.24 0.00 -0.02 0.00 0.00 33.50 31.43 2kob n PRO 157 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2kob n LYS 158 N 3.08 3.23 -2.59 -0.52 5.02 -1.26 -4.89 118.16 120.24 2kob n LYS 158 Ca 0.12 -1.89 -0.43 0.00 -2.02 0.00 0.00 58.31 54.10 2kob n LYS 158 Cb 0.36 -1.90 -0.02 0.00 -0.02 0.00 0.00 35.03 33.45 2kob n LYS 158 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2kob s ILE 159 N -2.00 4.09 0.03 -0.18 1.01 -1.26 -5.00 121.20 117.89 2kob s ILE 159 Ca 0.33 1.03 -0.05 0.00 0.00 0.00 0.00 60.65 61.96 2kob s ILE 159 Cb 0.24 -4.68 -0.05 0.00 0.01 0.00 0.00 42.46 37.99 2kob s ILE 159 CO 0.11 -1.21 0.26 0.00 0.00 0.00 0.00 174.94 174.10 2kob s ALA 160 N 4.77 3.88 -1.62 9.38 0.00 -1.26 -4.95 121.76 131.97 2kob s ALA 160 Ca 0.45 -0.64 0.05 0.00 0.00 0.00 0.00 51.96 51.82 2kob s ALA 160 Cb -0.07 -2.01 0.18 0.00 0.00 0.00 0.00 23.12 21.22 2kob s ALA 160 CO 0.28 0.69 1.04 1.28 0.00 0.00 0.00 175.76 179.05 2kob n LEU 161 N 0.83 1.40 0.00 0.00 4.77 -1.26 -5.01 117.00 117.73 2kob n LEU 161 Ca -0.09 -0.70 0.09 0.00 -0.03 0.00 0.00 56.01 55.28 2kob n LEU 161 Cb 0.52 -0.26 -0.02 0.00 -2.33 0.00 0.00 43.42 41.33 2kob n LEU 161 CO 0.44 0.28 -0.12 1.21 -1.33 0.00 0.00 177.39 177.87 2kob n GLU 162 N 0.09 -1.34 -1.15 3.23 4.07 -1.26 -3.69 120.64 120.58 2kob n GLU 162 Ca 0.07 0.89 -0.25 0.00 -0.06 0.00 0.00 57.16 57.81 2kob n GLU 162 Cb 0.27 -1.64 -0.10 0.00 -0.06 0.00 0.00 31.44 29.90 2kob n GLU 162 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 2kob n HIS 163 N -2.70 1.13 -0.07 4.31 8.25 -1.26 -4.36 115.22 120.52 2kob n HIS 163 Ca 0.00 -2.24 -0.13 0.00 -0.26 0.00 0.00 57.72 55.09 2kob n HIS 163 Cb 0.30 -2.01 -0.10 0.00 1.12 0.00 0.00 29.99 29.30 2kob n HIS 163 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2kob h HIS 164 N 3.92 0.00 -3.35 4.41 2.76 -2.01 -3.45 115.15 117.43 2kob h HIS 164 Ca 0.51 0.00 -0.51 0.00 -2.20 0.00 0.00 60.37 58.17 2kob h HIS 164 Cb 0.94 0.00 -0.34 0.00 1.55 0.00 0.00 27.41 29.55 2kob h HIS 164 CO 1.83 0.91 -0.81 -1.58 -1.30 0.00 0.00 177.93 176.98 2kob s HIS 165 N -2.15 1.42 -0.72 5.26 2.46 -1.26 -5.09 115.29 115.20 2kob s HIS 165 Ca -0.18 -0.57 -0.24 0.00 0.47 0.00 0.00 55.06 54.54 2kob s HIS 165 Cb -0.00 -1.09 0.06 0.00 -0.13 0.00 0.00 32.58 31.42 2kob s HIS 165 CO 0.55 -0.34 1.09 -1.58 -2.47 0.00 0.00 174.74 171.99 2kob s HIS 166 N 0.99 2.58 -0.45 3.88 2.46 -1.26 -4.98 115.29 118.51 2kob s HIS 166 Ca -0.09 -0.47 -0.29 0.00 0.47 0.00 0.00 55.06 54.68 2kob s HIS 166 Cb -0.15 -4.41 0.02 0.00 -0.13 0.00 0.00 32.58 27.91 2kob s HIS 166 CO -0.00 -1.78 1.26 -1.58 -2.47 0.00 0.00 174.74 170.16 2kob s HIS 167 N 4.52 2.64 -1.52 3.88 5.04 -1.26 -5.25 115.29 123.33 2kob s HIS 167 Ca 0.28 0.70 0.12 0.00 -1.54 0.00 0.00 55.06 54.62 2kob s HIS 167 Cb -0.13 -4.39 0.10 0.00 0.04 0.00 0.00 32.58 28.21 2kob s HIS 167 CO 0.09 -1.58 0.89 -2.39 -2.34 0.00 0.00 174.74 169.41