#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 -6.34 -4.86 6.15 8.00 -1.26 -4.77 116.55 113.47 2kob n ASP 62 Ca 0.00 0.08 -0.35 0.00 0.71 0.00 0.00 54.79 55.23 2kob n ASP 62 Cb 0.00 -2.92 -0.06 0.00 -0.02 0.00 0.00 41.12 38.13 2kob n ASP 62 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2kob s SER 63 N -1.85 6.72 0.17 -2.24 0.01 -1.26 -2.57 113.70 112.67 2kob s SER 63 Ca 0.34 0.91 -0.14 0.00 1.31 0.00 0.00 55.95 58.37 2kob s SER 63 Cb -0.05 -2.22 0.05 0.00 0.21 0.00 0.00 66.02 64.01 2kob s SER 63 CO 0.84 0.14 1.81 0.15 0.41 0.00 0.00 173.24 176.59 2kob h PHE 64 N 3.65 0.67 0.00 2.43 3.57 -0.70 -0.21 116.94 126.34 2kob h PHE 64 Ca -0.49 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 60.98 2kob h PHE 64 Cb 1.19 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 39.71 2kob h PHE 64 CO 0.66 0.46 -0.16 0.78 -2.23 0.00 0.00 178.31 177.81 2kob h GLY 65 N 0.68 0.00 0.49 2.40 0.00 -1.02 0.34 103.07 105.96 2kob h GLY 65 Ca 0.18 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.46 2kob h GLY 65 CO -0.04 0.00 -0.21 -1.80 0.00 0.00 0.00 176.54 174.49 2kob h ASP 66 N 0.00 0.22 0.14 0.19 3.58 -1.49 -1.97 116.42 117.09 2kob h ASP 66 Ca -0.00 -0.72 -0.06 0.00 0.42 0.00 0.00 57.03 56.67 2kob h ASP 66 Cb 0.55 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.52 2kob h ASP 66 CO 0.02 0.91 -0.21 -0.50 -2.88 0.00 0.00 179.24 176.58 2kob h TRP 67 N -0.45 0.16 -0.74 0.28 4.06 -0.81 -1.42 115.95 117.05 2kob h TRP 67 Ca -0.02 -0.02 -0.02 0.00 2.06 0.00 0.00 58.89 60.89 2kob h TRP 67 Cb 0.93 -0.04 -0.03 0.00 -1.00 0.00 0.00 29.16 29.01 2kob h TRP 67 CO 0.16 0.37 0.38 0.00 -3.56 0.00 0.00 178.44 175.79 2kob h ALA 68 N 1.64 0.95 -0.66 1.49 0.00 -0.31 0.77 119.26 123.14 2kob h ALA 68 Ca 0.03 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2kob h ALA 68 Cb 0.47 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2kob h ALA 68 CO 0.03 0.48 0.23 1.49 0.00 0.00 0.00 179.25 181.48 2kob h GLU 69 N 1.02 1.01 -0.43 0.00 4.81 -0.63 0.28 114.58 120.64 2kob h GLU 69 Ca 0.26 -0.21 0.06 0.00 -0.13 0.00 0.00 59.36 59.34 2kob h GLU 69 Cb 0.07 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.25 2kob h GLU 69 CO -0.04 0.87 0.13 0.87 -0.73 0.00 0.00 179.01 180.12 2kob h LYS 70 N 0.95 0.28 -0.41 1.92 1.79 -0.80 -0.29 116.57 120.01 2kob h LYS 70 Ca 0.22 -0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.64 2kob h LYS 70 Cb 0.26 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.83 2kob h LYS 70 CO -0.01 0.19 0.13 0.35 -1.08 0.00 0.00 179.45 179.03 2kob h PHE 71 N 0.29 0.66 -0.09 -1.35 3.57 -0.27 -0.32 116.94 119.44 2kob h PHE 71 Ca 0.20 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.64 2kob h PHE 71 Cb 0.21 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 38.75 2kob h PHE 71 CO -0.17 0.61 0.06 -0.07 -2.23 0.00 0.00 178.31 176.51 2kob h LEU 72 N 0.53 0.10 -0.87 0.59 3.38 -0.05 0.48 115.31 119.46 2kob h LEU 72 Ca 0.13 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.01 2kob h LEU 72 Cb 0.26 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2kob h LEU 72 CO -0.00 0.09 0.01 0.50 0.09 0.00 0.00 178.44 179.13 2kob h LYS 73 N 0.10 0.85 -0.52 1.13 1.63 -1.02 0.98 116.57 119.73 2kob h LYS 73 Ca 0.03 -0.23 -0.08 0.00 -0.85 0.00 0.00 60.65 59.52 2kob h LYS 73 Cb 0.01 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 31.52 2kob h LYS 73 CO -0.01 0.84 0.01 1.03 -3.45 0.00 0.00 179.45 177.87 2kob h SER 74 N 0.79 0.89 0.54 4.20 0.87 -0.64 -2.18 113.55 118.03 2kob h SER 74 Ca 0.15 -0.30 -0.13 0.00 -1.23 0.00 0.00 61.79 60.28 2kob h SER 74 Cb 0.46 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.16 2kob h SER 74 CO 0.02 0.97 -0.61 0.50 -0.53 0.00 0.00 176.83 177.18 2kob h LYS 75 N 0.78 0.07 -0.05 2.24 1.63 0.34 0.40 116.57 121.98 2kob h LYS 75 Ca 0.15 -0.05 0.01 0.00 -0.85 0.00 0.00 60.65 59.91 2kob h LYS 75 Cb 0.51 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.14 2kob h LYS 75 CO 0.02 0.66 -0.02 1.49 -3.45 0.00 0.00 179.45 178.15 2kob h GLU 76 N 0.05 -0.02 0.00 1.90 4.81 -0.64 -2.29 114.58 118.39 2kob h GLU 76 Ca -0.01 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 2kob h GLU 76 Cb 1.09 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 2kob h GLU 76 CO 0.08 -0.01 -0.34 0.00 -0.73 0.00 0.00 179.01 178.01 2kob h ALA 77 N 1.03 1.17 -0.18 2.92 0.00 -0.98 -2.17 119.26 121.05 2kob h ALA 77 Ca 0.03 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.65 2kob h ALA 77 Cb 0.06 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2kob h ALA 77 CO -0.06 0.43 0.12 0.22 0.00 0.00 0.00 179.25 179.96 2kob h ASP 78 N 0.00 0.13 0.00 0.00 3.58 0.24 -3.47 116.42 116.90 2kob h ASP 78 Ca -0.00 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.44 2kob h ASP 78 Cb 0.73 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.75 2kob h ASP 78 CO 0.04 0.09 0.00 0.61 -2.88 0.00 0.00 179.24 177.11 2kob n GLY 79 N -1.53 0.67 3.97 -0.78 0.00 -0.81 -5.06 105.19 101.65 2kob n GLY 79 Ca 0.00 -0.27 -0.21 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.98 4.94 0.70 1.61 -7.23 -1.21 -5.08 120.40 113.15 2kob s VAL 80 Ca 0.00 -0.97 -0.15 0.00 -1.81 0.00 0.00 61.98 59.05 2kob s VAL 80 Cb 0.00 -3.74 0.02 0.00 0.56 0.00 0.00 36.38 33.22 2kob s VAL 80 CO 0.00 -0.29 1.16 -0.44 -0.31 0.00 0.00 175.10 175.21 2kob s SER 81 N -4.03 4.64 0.25 4.85 0.01 -1.26 -4.82 113.70 113.33 2kob s SER 81 Ca 0.37 2.17 -0.06 0.00 1.31 0.00 0.00 55.95 59.75 2kob s SER 81 Cb -0.09 -2.57 0.26 0.00 0.21 0.00 0.00 66.02 63.83 2kob s SER 81 CO 0.30 -1.96 1.92 1.62 0.41 0.00 0.00 173.24 175.54 2kob h VAL 82 N -0.15 1.24 0.00 3.43 3.04 -1.99 -0.28 116.25 121.54 2kob h VAL 82 Ca -0.47 -0.46 -0.03 0.00 -1.01 0.00 0.00 66.70 64.73 2kob h VAL 82 Cb 1.27 -0.20 -0.00 0.00 -2.01 0.00 0.00 31.29 30.34 2kob h VAL 82 CO 0.52 0.24 -0.16 0.28 -1.01 0.00 0.00 177.57 177.44 2kob h SER 83 N 1.33 0.00 -0.14 3.17 0.02 -1.98 -1.87 113.55 114.07 2kob h SER 83 Ca 0.37 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 61.20 2kob h SER 83 Cb -0.13 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.41 2kob h SER 83 CO -0.09 0.16 -0.35 -0.61 -1.14 0.00 0.00 176.83 174.80 2kob h GLN 84 N 0.00 0.49 -0.49 3.45 4.15 -1.46 0.66 115.11 121.90 2kob h GLN 84 Ca -0.00 -0.34 -0.04 0.00 0.77 0.00 0.00 58.65 59.04 2kob h GLN 84 Cb 0.83 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.55 2kob h GLN 84 CO 0.02 0.95 0.12 1.25 -1.93 0.00 0.00 178.83 179.24 2kob h LEU 85 N 0.10 0.68 -0.77 -2.39 7.12 -1.08 -2.35 115.31 116.63 2kob h LEU 85 Ca -0.00 -0.11 -0.10 0.00 0.13 0.00 0.00 57.88 57.80 2kob h LEU 85 Cb 0.96 -0.18 -0.02 0.00 -0.53 0.00 0.00 40.66 40.90 2kob h LEU 85 CO 0.08 0.67 -0.13 0.78 -0.13 0.00 0.00 178.44 179.71 2kob h ASN 86 N 0.71 0.80 0.36 1.25 2.35 -1.13 -2.51 115.58 117.41 2kob h ASN 86 Ca 0.16 -0.25 -0.07 0.00 -0.55 0.00 0.00 56.30 55.59 2kob h ASN 86 Cb 0.26 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 2kob h ASN 86 CO -0.00 0.94 -0.35 0.77 -1.65 0.00 0.00 177.43 177.14 2kob h SER 87 N 0.72 0.00 -0.18 5.81 4.64 -0.37 -0.85 113.55 123.32 2kob h SER 87 Ca 0.12 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.35 2kob h SER 87 Cb 0.62 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.69 2kob h SER 87 CO 0.04 0.35 -0.17 1.88 -0.87 0.00 0.00 176.83 178.05 2kob h TYR 88 N 0.00 0.66 -0.66 4.77 0.05 -1.06 -1.98 116.97 118.75 2kob h TYR 88 Ca -0.00 -0.13 -0.06 0.00 0.05 0.00 0.00 58.73 58.59 2kob h TYR 88 Cb 0.62 -0.17 -0.03 0.00 1.01 0.00 0.00 36.73 38.16 2kob h TYR 88 CO 0.00 0.74 0.19 0.87 -1.05 0.00 0.00 178.16 178.91 2kob h LYS 89 N 0.54 1.02 -0.66 4.88 1.57 -0.87 0.20 116.57 123.25 2kob h LYS 89 Ca 0.09 -0.21 0.06 0.00 -1.87 0.00 0.00 60.65 58.71 2kob h LYS 89 Cb 0.61 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.73 2kob h LYS 89 CO 0.04 0.89 0.44 -0.91 -0.57 0.00 0.00 179.45 179.34 2kob h ASN 90 N 0.98 0.61 0.02 0.86 4.21 -0.48 0.22 115.58 121.99 2kob h ASN 90 Ca 0.21 0.00 -0.13 0.00 1.21 0.00 0.00 56.30 57.60 2kob h ASN 90 Cb 0.30 -0.13 -0.01 0.00 -1.12 0.00 0.00 38.32 37.36 2kob h ASN 90 CO -0.01 0.40 -0.68 1.88 -1.29 0.00 0.00 177.43 177.74 2kob h TYR 91 N 0.70 0.07 -0.05 1.19 0.05 -0.95 -3.23 116.97 114.75 2kob h TYR 91 Ca 0.28 -0.05 -0.02 0.00 0.05 0.00 0.00 58.73 58.99 2kob h TYR 91 Cb 0.23 -0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.97 2kob h TYR 91 CO -0.00 1.26 -0.06 0.00 -1.05 0.00 0.00 178.16 178.32 2kob h ARG 93 N -0.35 0.00 0.00 0.00 2.43 -0.77 -2.66 114.38 113.02 2kob h ARG 93 Ca 0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2kob h ARG 93 Cb 0.58 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 2kob h ARG 93 CO 0.01 0.49 -0.86 -1.71 -1.51 0.00 0.00 179.97 176.40 2kob n ASN 94 N -3.19 1.67 0.07 -3.80 2.85 -1.22 -4.17 115.26 107.46 2kob n ASN 94 Ca 0.01 0.28 0.12 0.00 -0.11 0.00 0.00 54.58 54.89 2kob n ASN 94 Cb 0.75 -0.70 0.26 0.00 1.24 0.00 0.00 39.78 41.32 2kob n ASN 94 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 2kob n HIS 95 N -4.19 0.62 -0.77 1.20 8.25 -0.31 -3.44 115.22 116.58 2kob n HIS 95 Ca -0.12 0.18 0.07 0.00 -0.26 0.00 0.00 57.72 57.59 2kob n HIS 95 Cb 0.45 -0.71 0.11 0.00 1.12 0.00 0.00 29.99 30.95 2kob n HIS 95 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2kob n LEU 96 N -2.10 2.31 -0.25 2.41 4.77 0.23 -4.80 117.00 119.56 2kob n LEU 96 Ca 0.04 -2.78 -0.06 0.00 -0.03 0.00 0.00 56.01 53.18 2kob n LEU 96 Cb 0.43 -0.32 0.05 0.00 -2.33 0.00 0.00 43.42 41.25 2kob n LEU 96 CO 0.34 0.65 1.08 0.77 -1.33 0.00 0.00 177.39 178.91 2kob h SER 97 N 0.08 0.88 0.38 -1.43 4.64 -1.50 0.11 113.55 116.72 2kob h SER 97 Ca 0.00 -0.11 -0.03 0.00 -0.47 0.00 0.00 61.79 61.18 2kob h SER 97 Cb 0.88 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 62.74 2kob h SER 97 CO 0.01 0.74 -0.16 1.55 -0.87 0.00 0.00 176.83 178.09 2kob h PRO 98 N 0.96 0.00 0.00 4.77 0.13 -1.87 -2.53 132.00 133.46 2kob h PRO 98 Ca 0.24 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.32 2kob h PRO 98 Cb 0.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.19 2kob h PRO 98 CO -0.04 0.16 -1.11 -0.07 -0.23 0.00 0.00 178.00 176.72 2kob h LEU 99 N 0.00 0.00 -0.77 1.56 3.38 -1.76 -3.36 115.31 114.36 2kob h LEU 99 Ca -0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.06 2kob h LEU 99 Cb 0.40 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.08 2kob h LEU 99 CO 0.02 0.17 0.42 0.22 0.09 0.00 0.00 178.44 179.36 2kob h TYR 100 N 0.00 0.75 -0.50 1.13 5.03 -0.33 -1.13 116.97 121.92 2kob h TYR 100 Ca -0.05 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.29 2kob h TYR 100 Cb 1.17 -0.22 0.00 0.00 1.55 0.00 0.00 36.73 39.22 2kob h TYR 100 CO 0.00 0.30 0.00 0.00 -1.32 0.00 0.00 178.16 177.14 2kob n MET 101 N -4.79 2.93 -3.91 1.82 0.00 -1.25 -0.67 117.12 111.25 2kob n MET 101 Ca 0.12 -2.12 -0.22 0.00 0.00 0.00 0.00 57.70 55.49 2kob n MET 101 Cb 0.27 -1.69 -0.05 0.00 0.00 0.00 0.00 33.22 31.75 2kob n MET 101 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 2kob s LYS 102 N -1.69 2.54 0.30 3.17 1.02 -0.43 -4.98 119.74 119.67 2kob s LYS 102 Ca 0.38 -1.45 -0.27 0.00 0.02 0.00 0.00 55.97 54.64 2kob s LYS 102 Cb 0.24 -2.32 -0.10 0.00 -0.52 0.00 0.00 37.83 35.13 2kob s LYS 102 CO 0.19 0.05 0.95 -1.12 -0.92 0.00 0.00 175.35 174.50 2kob s SER 103 N -3.95 7.43 0.51 2.83 0.01 -1.26 -0.15 113.70 119.11 2kob s SER 103 Ca 0.41 1.88 0.33 0.00 1.31 0.00 0.00 55.95 59.88 2kob s SER 103 Cb -0.04 -2.59 1.47 0.00 0.21 0.00 0.00 66.02 65.08 2kob s SER 103 CO 0.25 -0.00 1.99 0.17 0.41 0.00 0.00 173.24 176.06 2kob h LEU 104 N 3.46 0.00 0.00 2.44 -0.00 -1.78 -2.23 115.31 117.19 2kob h LEU 104 Ca -0.46 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.36 2kob h LEU 104 Cb 1.19 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.84 2kob h LEU 104 CO 0.66 0.00 -0.94 0.77 -0.00 0.00 0.00 178.44 178.92 2kob h SER 105 N 0.00 0.00 0.39 0.17 4.64 -1.93 -3.31 113.55 113.52 2kob h SER 105 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2kob h SER 105 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2kob h SER 105 CO 0.00 0.22 -0.37 -1.84 -0.87 0.00 0.00 176.83 173.97 2kob n GLU 106 N -2.85 0.39 -2.26 4.77 0.28 -0.85 -4.88 120.64 115.24 2kob n GLU 106 Ca -0.02 -0.22 -0.41 0.00 -0.16 0.00 0.00 57.16 56.35 2kob n GLU 106 Cb 0.65 -1.50 -0.03 0.00 1.43 0.00 0.00 31.44 31.99 2kob n GLU 106 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2kob s ILE 107 N -2.76 3.28 -0.18 3.84 1.01 -1.15 -5.00 121.20 120.23 2kob s ILE 107 Ca 0.18 1.08 -0.13 0.00 0.00 0.00 0.00 60.65 61.78 2kob s ILE 107 Cb 0.18 -3.69 -0.05 0.00 0.01 0.00 0.00 42.46 38.92 2kob s ILE 107 CO 0.61 0.17 0.24 -0.76 0.00 0.00 0.00 174.94 175.21 2kob s LEU 108 N -0.31 4.22 0.31 2.97 1.43 -1.26 -4.98 118.68 121.06 2kob s LEU 108 Ca 0.55 0.40 0.02 0.00 -1.03 0.00 0.00 54.13 54.07 2kob s LEU 108 Cb -0.36 -2.28 0.59 0.00 0.03 0.00 0.00 46.19 44.17 2kob s LEU 108 CO 0.39 0.11 1.91 -0.65 0.23 0.00 0.00 176.35 178.34 2kob h PRO 109 N 6.76 0.93 -0.08 1.29 0.11 -1.95 -1.21 132.00 137.85 2kob h PRO 109 Ca -0.41 -0.06 -0.13 0.00 0.11 0.00 0.00 66.00 65.52 2kob h PRO 109 Cb 1.16 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 2kob h PRO 109 CO 0.75 0.61 -0.53 0.00 -0.21 0.00 0.00 178.00 178.62 2kob h ALA 110 N 1.53 0.96 -0.30 -0.75 0.00 -1.93 -1.26 119.26 117.52 2kob h ALA 110 Ca 0.39 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 2kob h ALA 110 Cb 0.27 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2kob h ALA 110 CO -0.15 0.68 0.06 0.22 0.00 0.00 0.00 179.25 180.05 2kob h ASP 111 N 0.17 0.46 -0.68 0.00 3.58 -1.67 -0.72 116.42 117.56 2kob h ASP 111 Ca 0.00 -0.25 -0.06 0.00 0.42 0.00 0.00 57.03 57.14 2kob h ASP 111 Cb 0.99 -0.12 -0.03 0.00 1.72 0.00 0.00 39.33 41.89 2kob h ASP 111 CO 0.08 0.59 0.18 0.40 -2.88 0.00 0.00 179.24 177.62 2kob h ILE 112 N 0.32 1.26 -0.57 2.25 2.04 -1.23 -2.36 117.51 119.21 2kob h ILE 112 Ca 0.09 -0.93 0.03 0.00 1.00 0.00 0.00 64.86 65.05 2kob h ILE 112 Cb 0.32 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 2kob h ILE 112 CO 0.00 0.36 0.34 -0.61 0.00 0.00 0.00 178.15 178.24 2kob h GLN 113 N 1.04 0.64 -0.51 2.37 5.75 -0.90 -0.10 115.11 123.40 2kob h GLN 113 Ca 0.22 -0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 58.65 2kob h GLN 113 Cb 0.34 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.72 2kob h GLN 113 CO -0.00 0.42 0.18 0.77 -2.65 0.00 0.00 178.83 177.56 2kob h SER 114 N 0.66 0.67 -0.10 -0.69 0.02 -0.86 0.19 113.55 113.45 2kob h SER 114 Ca 0.24 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 2kob h SER 114 Cb 0.05 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.42 2kob h SER 114 CO -0.11 0.62 0.02 0.40 -1.14 0.00 0.00 176.83 176.62 2kob h ILE 115 N 0.73 1.20 -0.60 3.27 2.04 -0.80 -0.83 117.51 122.52 2kob h ILE 115 Ca 0.17 -0.63 -0.01 0.00 1.00 0.00 0.00 64.86 65.39 2kob h ILE 115 Cb 0.18 1.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 2kob h ILE 115 CO -0.01 0.18 0.34 0.40 0.00 0.00 0.00 178.15 179.05 2kob h ILE 116 N -0.06 1.19 -0.70 -0.67 1.08 -0.73 0.22 117.51 117.84 2kob h ILE 116 Ca 0.03 -0.47 0.00 0.00 -0.39 0.00 0.00 64.86 64.03 2kob h ILE 116 Cb 0.27 0.41 -0.03 0.00 -3.07 0.00 0.00 36.82 34.39 2kob h ILE 116 CO 0.00 0.21 0.45 -1.13 -0.69 0.00 0.00 178.15 176.99 2kob h ASN 117 N 0.82 0.81 -0.06 1.72 -0.00 -0.50 -1.68 115.58 116.69 2kob h ASN 117 Ca 0.21 -0.03 0.00 0.00 -0.00 0.00 0.00 56.30 56.49 2kob h ASN 117 Cb 0.03 -0.20 0.00 0.00 -0.00 0.00 0.00 38.32 38.15 2kob h ASN 117 CO -0.04 0.60 0.00 -0.62 -0.00 0.00 0.00 177.43 177.37 2kob n GLU 118 N -4.42 1.94 -2.95 6.67 1.02 -0.33 -4.68 120.64 117.89 2kob n GLU 118 Ca 0.07 -1.37 -0.43 0.00 -0.02 0.00 0.00 57.16 55.41 2kob n GLU 118 Cb 0.04 -1.47 -0.05 0.00 -0.02 0.00 0.00 31.44 29.94 2kob n GLU 118 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2kob s THR 119 N -1.95 4.63 -0.88 2.62 2.01 0.03 -4.96 115.64 117.13 2kob s THR 119 Ca 0.34 0.47 0.01 0.00 0.31 0.00 0.00 61.69 62.81 2kob s THR 119 Cb 0.20 -4.34 0.31 0.00 0.01 0.00 0.00 72.50 68.69 2kob s THR 119 CO 0.32 -0.73 1.35 0.29 -0.69 0.00 0.00 174.62 175.15 2kob n LYS 120 N 6.77 4.18 -3.14 4.92 5.02 -1.26 -4.93 118.16 129.72 2kob n LYS 120 Ca 0.03 -4.68 -0.14 0.00 -2.02 0.00 0.00 58.31 51.50 2kob n LYS 120 Cb 0.48 -2.40 -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 0.49 0.00 -4.74 -0.35 4.77 -1.26 -5.11 117.00 110.80 2kob n LEU 121 Ca 0.34 -1.38 -0.37 0.00 -0.03 0.00 0.00 56.01 54.57 2kob n LEU 121 Cb 0.34 0.15 0.06 0.00 -2.33 0.00 0.00 43.42 41.63 2kob n LEU 121 CO 0.53 -0.21 0.91 0.00 -1.33 0.00 0.00 177.39 177.29 2kob s ALA 122 N -2.38 2.49 0.45 -1.18 0.00 -1.26 -4.83 121.76 115.06 2kob s ALA 122 Ca 0.01 1.21 0.16 0.00 0.00 0.00 0.00 51.96 53.33 2kob s ALA 122 Cb -0.00 -3.54 1.09 0.00 0.00 0.00 0.00 23.12 20.67 2kob s ALA 122 CO 0.00 -1.48 1.99 1.57 0.00 0.00 0.00 175.76 177.84 2kob h LYS 123 N 0.78 0.32 -0.87 0.00 2.10 -1.98 -0.14 116.57 116.79 2kob h LYS 123 Ca -0.51 -0.02 -0.03 0.00 -2.00 0.00 0.00 60.65 58.09 2kob h LYS 123 Cb 1.32 -0.07 -0.04 0.00 -0.90 0.00 0.00 32.23 32.54 2kob h LYS 123 CO 0.54 0.21 0.43 -0.91 -2.00 0.00 0.00 179.45 177.73 2kob h ASN 124 N 0.33 1.12 -0.42 7.07 2.35 -1.99 -1.63 115.58 122.43 2kob h ASN 124 Ca 0.27 -0.13 -0.12 0.00 -0.55 0.00 0.00 56.30 55.78 2kob h ASN 124 Cb 0.61 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 2kob h ASN 124 CO -0.07 0.93 -0.19 0.74 -1.65 0.00 0.00 177.43 177.19 2kob h THR 125 N 1.23 1.28 -0.45 2.81 2.02 -1.40 -1.19 112.91 117.22 2kob h THR 125 Ca 0.30 -1.33 0.00 0.00 0.77 0.00 0.00 66.41 66.15 2kob h THR 125 Cb 0.10 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 2kob h THR 125 CO -0.04 0.45 0.30 -0.07 0.37 0.00 0.00 175.52 176.53 2kob h LEU 126 N 0.68 0.52 -0.92 2.58 3.38 -1.07 -0.33 115.31 120.15 2kob h LEU 126 Ca 0.09 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 2kob h LEU 126 Cb 0.75 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2kob h LEU 126 CO 0.06 0.37 -0.24 0.11 0.09 0.00 0.00 178.44 178.83 2kob h LYS 127 N 0.61 0.50 -0.41 1.13 1.57 -1.23 -2.38 116.57 116.37 2kob h LYS 127 Ca 0.17 -0.19 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 2kob h LYS 127 Cb -0.07 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 2kob h LYS 127 CO -0.04 0.71 0.03 0.00 -0.57 0.00 0.00 179.45 179.58 2kob h ALA 128 N 1.29 0.54 -0.76 3.86 0.00 -0.54 0.24 119.26 123.89 2kob h ALA 128 Ca 0.07 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2kob h ALA 128 Cb 0.67 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 2kob h ALA 128 CO 0.05 0.30 0.44 0.82 0.00 0.00 0.00 179.25 180.86 2kob h ILE 129 N 0.54 1.22 -0.14 0.00 2.04 -0.97 -0.26 117.51 119.93 2kob h ILE 129 Ca 0.12 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 2kob h ILE 129 Cb 0.44 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2kob h ILE 129 CO 0.02 0.24 0.04 -0.09 0.00 0.00 0.00 178.15 178.35 2kob h ARG 130 N 1.05 0.22 0.13 2.37 9.65 -1.08 -1.82 114.38 124.91 2kob h ARG 130 Ca 0.27 -0.05 0.01 0.00 -1.10 0.00 0.00 59.98 59.11 2kob h ARG 130 Cb -0.01 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 28.53 2kob h ARG 130 CO -0.05 0.37 -0.15 -0.91 2.80 0.00 0.00 179.97 182.03 2kob h ASN 131 N 0.03 -0.41 0.03 -3.80 -0.26 -0.28 0.39 115.58 111.27 2kob h ASN 131 Ca 0.04 0.04 0.03 0.00 -0.56 0.00 0.00 56.30 55.85 2kob h ASN 131 Cb 0.25 0.15 -0.04 0.00 -1.06 0.00 0.00 38.32 37.62 2kob h ASN 131 CO 0.00 -0.23 -0.25 0.74 -1.06 0.00 0.00 177.43 176.63 2kob h THR 132 N -0.33 0.43 -0.77 2.81 2.02 -1.04 -2.18 112.91 113.86 2kob h THR 132 Ca 0.01 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.15 2kob h THR 132 Cb 0.32 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 2kob h THR 132 CO -0.05 0.00 0.32 0.00 0.37 0.00 0.00 175.52 176.16 2kob h ALA 133 N 0.41 1.12 -0.17 6.16 0.00 -1.19 -2.31 119.26 123.28 2kob h ALA 133 Ca 0.05 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 2kob h ALA 133 Cb 0.47 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2kob h ALA 133 CO -0.20 0.64 -0.18 0.66 0.00 0.00 0.00 179.25 180.16 2kob h SER 134 N 1.11 0.27 1.37 0.00 4.64 -0.56 -1.78 113.55 118.60 2kob h SER 134 Ca 0.26 -0.07 -0.13 0.00 -0.47 0.00 0.00 61.79 61.38 2kob h SER 134 Cb 0.18 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.18 2kob h SER 134 CO -0.02 0.48 -0.60 1.56 -0.87 0.00 0.00 176.83 177.37 2kob h GLN 135 N 0.26 0.00 -0.23 4.77 4.20 -1.05 -1.39 115.11 121.68 2kob h GLN 135 Ca 0.05 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.73 2kob h GLN 135 Cb 0.48 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 2kob h GLN 135 CO 0.03 0.60 0.03 0.82 -0.67 0.00 0.00 178.83 179.65 2kob h ILE 136 N 0.00 1.23 -0.67 2.54 2.04 -0.85 -1.22 117.51 120.58 2kob h ILE 136 Ca -0.01 -0.78 -0.07 0.00 1.00 0.00 0.00 64.86 65.01 2kob h ILE 136 Cb 1.45 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 38.81 2kob h ILE 136 CO 0.08 0.24 0.14 -0.26 0.00 0.00 0.00 178.15 178.35 2kob h PHE 137 N 0.18 1.14 0.00 1.37 0.04 -1.31 -2.69 116.94 115.67 2kob h PHE 137 Ca 0.07 -0.15 -0.05 0.00 2.80 0.00 0.00 57.97 60.64 2kob h PHE 137 Cb 0.33 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 38.16 2kob h PHE 137 CO 0.02 0.95 -0.23 0.07 -0.60 0.00 0.00 178.31 178.53 2kob h ARG 138 N 1.01 0.00 -0.23 1.51 0.11 -1.15 -0.49 114.38 115.14 2kob h ARG 138 Ca 0.21 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 60.19 2kob h ARG 138 Cb 0.40 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.47 2kob h ARG 138 CO 0.01 0.23 -0.29 1.25 0.10 0.00 0.00 179.97 181.27 2kob h LEU 139 N 0.00 0.45 -0.37 0.08 5.85 -0.89 0.09 115.31 120.53 2kob h LEU 139 Ca -0.00 -0.16 -0.19 0.00 0.84 0.00 0.00 57.88 58.37 2kob h LEU 139 Cb 0.55 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2kob h LEU 139 CO 0.03 0.72 -0.80 0.00 -0.34 0.00 0.00 178.44 178.06 2kob h ALA 140 N 1.31 0.58 -0.18 1.25 0.00 -1.08 -2.77 119.26 118.37 2kob h ALA 140 Ca 0.05 -0.66 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 2kob h ALA 140 Cb 0.70 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2kob h ALA 140 CO 0.05 0.83 0.09 0.82 0.00 0.00 0.00 179.25 181.04 2kob h ILE 141 N 0.18 1.13 0.00 0.00 2.04 -0.61 0.21 117.51 120.46 2kob h ILE 141 Ca -0.04 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.46 2kob h ILE 141 Cb 1.39 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 38.51 2kob h ILE 141 CO 0.13 0.12 0.00 1.05 0.00 0.00 0.00 178.15 179.45 2kob h GLU 142 N 0.16 0.00 -0.22 2.37 4.11 -1.02 0.13 114.58 120.11 2kob h GLU 142 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.49 2kob h GLU 142 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2kob h GLU 142 CO -0.01 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.16 2kob n ASN 143 N -2.54 3.03 -1.37 3.06 3.02 -0.93 -4.95 115.26 114.58 2kob n ASN 143 Ca 0.01 -1.94 -0.17 0.00 -0.03 0.00 0.00 54.58 52.45 2kob n ASN 143 Cb 0.25 -0.13 -0.07 0.00 -0.61 0.00 0.00 39.78 39.21 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 1.27 -1.22 0.04 3.52 1.74 0.03 -4.85 116.66 117.19 2kob n ARG 144 Ca 0.17 1.10 -0.16 0.00 -0.77 0.00 0.00 57.85 58.20 2kob n ARG 144 Cb 0.57 -5.35 -0.06 0.00 -1.02 0.00 0.00 32.46 26.60 2kob n ARG 144 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2kob h ALA 145 N 0.05 0.32 -3.11 7.54 0.00 -0.89 -3.45 119.26 119.71 2kob h ALA 145 Ca -0.36 -0.67 -0.17 0.00 0.00 0.00 0.00 54.91 53.71 2kob h ALA 145 Cb 1.14 -0.00 -0.26 0.00 0.00 0.00 0.00 17.79 18.67 2kob h ALA 145 CO 0.52 0.75 -0.44 -1.50 0.00 0.00 0.00 179.25 178.58 2kob s ILE 146 N -3.42 -0.01 -0.24 0.00 2.07 -1.17 -5.01 121.20 113.43 2kob s ILE 146 Ca -0.08 0.03 0.16 0.00 -1.41 0.00 0.00 60.65 59.35 2kob s ILE 146 Cb 0.08 -0.36 0.66 0.00 0.13 0.00 0.00 42.46 42.98 2kob s ILE 146 CO 0.89 0.01 1.57 -0.90 -1.91 0.00 0.00 174.94 174.60 2kob n ASP 147 N 3.22 4.71 -3.88 4.50 5.75 -1.26 -3.03 116.55 126.55 2kob n ASP 147 Ca -0.15 -2.96 -0.24 0.00 -0.01 0.00 0.00 54.79 51.43 2kob n ASP 147 Cb 0.57 -0.60 -0.17 0.00 -1.03 0.00 0.00 41.12 39.89 2kob n ASP 147 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 2kob s PHE 148 N -2.76 1.10 -0.51 2.11 5.36 -1.26 -5.09 117.98 116.93 2kob s PHE 148 Ca 0.48 -0.44 -0.08 0.00 -0.96 0.00 0.00 56.93 55.92 2kob s PHE 148 Cb 0.37 -0.97 0.13 0.00 -0.34 0.00 0.00 43.02 42.21 2kob s PHE 148 CO 0.12 -0.36 0.38 1.21 -1.46 0.00 0.00 175.22 175.11 2kob s ASN 149 N 1.48 5.69 0.21 6.13 3.84 -1.26 -4.93 114.94 126.10 2kob s ASN 149 Ca -0.01 -2.10 0.22 0.00 0.21 0.00 0.00 52.86 51.19 2kob s ASN 149 Cb -0.13 -1.99 0.92 0.00 -0.55 0.00 0.00 41.25 39.50 2kob s ASN 149 CO -0.04 -0.63 1.68 -0.81 -2.79 0.00 0.00 177.10 174.50 2kob n PRO 150 N 4.64 0.17 0.27 0.43 -0.04 -1.26 -2.43 135.00 136.77 2kob n PRO 150 Ca -0.04 0.38 0.17 0.00 -0.04 0.00 0.00 63.50 63.97 2kob n PRO 150 Cb 0.41 -1.81 0.63 0.00 -0.04 0.00 0.00 33.50 32.69 2kob n PRO 150 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kob h ALA 151 N 2.32 1.00 0.00 0.55 0.00 -1.94 -2.57 119.26 118.62 2kob h ALA 151 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2kob h ALA 151 Cb 0.36 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2kob h ALA 151 CO 0.00 0.00 -0.10 0.22 0.00 0.00 0.00 179.25 179.37 2kob h ASP 152 N 0.00 0.00 -0.10 0.00 3.58 -1.90 -2.65 116.42 115.35 2kob h ASP 152 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2kob h ASP 152 Cb 0.56 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.61 2kob h ASP 152 CO 0.00 0.10 0.00 -1.22 -2.88 0.00 0.00 179.24 175.24 2kob n TYR 153 N -3.22 0.11 -2.92 0.28 4.01 -0.97 -4.74 117.16 109.71 2kob n TYR 153 Ca 0.01 -0.05 -0.43 0.00 -0.16 0.00 0.00 57.90 57.26 2kob n TYR 153 Cb 0.39 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.37 2kob n TYR 153 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2kob s VAL 154 N -1.89 4.52 -0.15 -0.72 1.01 -1.00 -4.92 120.40 117.25 2kob s VAL 154 Ca 0.35 0.17 -0.29 0.00 0.00 0.00 0.00 61.98 62.21 2kob s VAL 154 Cb 0.20 -4.46 -0.01 0.00 0.00 0.00 0.00 36.38 32.11 2kob s VAL 154 CO 0.31 -0.98 1.17 -0.60 0.00 0.00 0.00 175.10 174.99 2kob s ARG 155 N 3.59 4.28 -0.25 2.72 6.06 -1.26 -5.00 118.95 129.09 2kob s ARG 155 Ca 0.28 1.56 -0.20 0.00 -2.50 0.00 0.00 55.73 54.86 2kob s ARG 155 Cb -0.14 -3.67 -0.02 0.00 0.06 0.00 0.00 34.95 31.19 2kob s ARG 155 CO 0.19 -0.60 0.61 0.42 -2.50 0.00 0.00 175.30 173.42 2kob s ILE 156 N 3.01 5.00 0.27 4.11 -1.09 -1.26 -4.99 121.20 126.25 2kob s ILE 156 Ca 0.51 1.10 -0.29 0.00 -2.23 0.00 0.00 60.65 59.74 2kob s ILE 156 Cb -0.20 -3.92 -0.09 0.00 -1.58 0.00 0.00 42.46 36.66 2kob s ILE 156 CO 0.14 0.04 1.24 -2.16 -1.23 0.00 0.00 174.94 172.97 2kob s PRO 157 N 2.45 4.46 0.00 2.79 0.04 -1.26 -4.93 135.00 138.55 2kob s PRO 157 Ca 0.26 2.02 0.19 0.00 0.04 0.00 0.00 61.00 63.51 2kob s PRO 157 Cb -0.16 -3.15 0.35 0.00 0.04 0.00 0.00 34.50 31.58 2kob s PRO 157 CO 0.09 -0.07 1.29 1.63 0.04 0.00 0.00 177.00 179.97 2kob n LYS 158 N 1.52 2.26 0.00 4.56 5.02 -1.26 -4.98 118.16 125.27 2kob n LYS 158 Ca 0.02 -2.08 0.00 0.00 -2.02 0.00 0.00 58.31 54.23 2kob n LYS 158 Cb 0.43 -1.43 0.00 0.00 -0.02 0.00 0.00 35.03 34.01 2kob n LYS 158 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2kob n ILE 159 N 1.21 0.00 -4.44 -0.18 -0.00 -1.26 -4.78 119.36 109.91 2kob n ILE 159 Ca 0.16 0.00 -0.23 0.00 -0.00 0.00 0.00 62.75 62.69 2kob n ILE 159 Cb 0.53 0.00 -0.09 0.00 -0.00 0.00 0.00 39.64 40.08 2kob n ILE 159 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2kob s ALA 160 N 0.00 2.50 -1.46 -1.39 0.00 -1.26 -4.78 121.76 115.37 2kob s ALA 160 Ca 0.00 -1.57 -0.05 0.00 0.00 0.00 0.00 51.96 50.33 2kob s ALA 160 Cb 0.00 0.85 0.01 0.00 0.00 0.00 0.00 23.12 23.98 2kob s ALA 160 CO 0.00 -0.38 0.70 1.28 0.00 0.00 0.00 175.76 177.36 2kob n LEU 161 N -0.76 -2.80 -4.65 0.00 4.77 -1.26 -4.99 117.00 107.31 2kob n LEU 161 Ca -0.03 -0.33 -0.29 0.00 -0.03 0.00 0.00 56.01 55.33 2kob n LEU 161 Cb 0.65 -2.90 0.18 0.00 -2.33 0.00 0.00 43.42 39.03 2kob n LEU 161 CO 0.37 0.31 0.63 -1.83 -1.33 0.00 0.00 177.39 175.53 2kob s GLU 162 N -5.78 0.40 -0.48 3.23 -1.05 -1.26 -4.98 118.70 108.78 2kob s GLU 162 Ca 0.35 0.69 0.05 0.00 -0.15 0.00 0.00 54.97 55.90 2kob s GLU 162 Cb -0.15 -1.72 0.40 0.00 -0.44 0.00 0.00 34.13 32.22 2kob s GLU 162 CO 0.43 -2.79 1.12 1.58 0.95 0.00 0.00 175.26 176.55 2kob n HIS 163 N -4.24 3.51 0.00 4.83 -0.00 -1.26 -4.66 115.22 113.39 2kob n HIS 163 Ca 0.05 -3.23 0.00 0.00 -0.00 0.00 0.00 57.72 54.54 2kob n HIS 163 Cb 0.56 -0.19 0.00 0.00 -0.00 0.00 0.00 29.99 30.36 2kob n HIS 163 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2kob n HIS 164 N -0.44 0.00 -0.03 1.57 8.25 -1.26 -5.08 115.22 118.23 2kob n HIS 164 Ca 0.38 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.69 2kob n HIS 164 Cb 0.60 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.62 2kob n HIS 164 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2kob h HIS 165 N 0.00 0.44 -3.50 4.41 2.76 -2.01 -3.39 115.15 113.86 2kob h HIS 165 Ca 0.00 -0.19 -0.60 0.00 -2.20 0.00 0.00 60.37 57.38 2kob h HIS 165 Cb 0.00 -0.07 -0.10 0.00 1.55 0.00 0.00 27.41 28.79 2kob h HIS 165 CO 0.00 0.93 0.51 -3.38 -1.30 0.00 0.00 177.93 174.69 2kob s HIS 166 N -3.61 3.10 0.10 5.26 -3.43 -1.26 -5.00 115.29 110.45 2kob s HIS 166 Ca -0.14 0.70 -0.19 0.00 -0.80 0.00 0.00 55.06 54.63 2kob s HIS 166 Cb 0.03 -3.53 0.04 0.00 -1.43 0.00 0.00 32.58 27.70 2kob s HIS 166 CO 0.77 -0.77 0.46 -3.38 -2.00 0.00 0.00 174.74 169.82 2kob s HIS 167 N 3.30 -0.32 -2.68 0.38 -3.43 -1.26 -5.21 115.29 106.08 2kob s HIS 167 Ca 0.35 0.15 0.27 0.00 -0.80 0.00 0.00 55.06 55.02 2kob s HIS 167 Cb -0.13 0.32 0.74 0.00 -1.43 0.00 0.00 32.58 32.09 2kob s HIS 167 CO 0.17 -0.69 1.57 0.72 -2.00 0.00 0.00 174.74 174.52