#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 -4.76 -4.91 0.55 8.00 -1.26 -4.95 116.55 109.22 2kob n ASP 62 Ca 0.00 0.28 -0.30 0.00 0.71 0.00 0.00 54.79 55.48 2kob n ASP 62 Cb 0.00 -3.67 -0.04 0.00 -0.02 0.00 0.00 41.12 37.39 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 -2.71 6.45 0.14 -2.24 0.01 -1.26 -0.49 113.70 113.59 2kob s SER 63 Ca 0.00 0.55 -0.15 0.00 1.31 0.00 0.00 55.95 57.65 2kob s SER 63 Cb 0.00 -2.07 0.01 0.00 0.21 0.00 0.00 66.02 64.16 2kob s SER 63 CO 0.00 -0.02 1.68 0.15 0.41 0.00 0.00 173.24 175.46 2kob h PHE 64 N 2.37 0.66 0.00 2.43 3.57 -1.06 -0.50 116.94 124.41 2kob h PHE 64 Ca -0.47 -0.05 -0.05 0.00 3.53 0.00 0.00 57.97 60.92 2kob h PHE 64 Cb 1.18 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 2kob h PHE 64 CO 0.59 0.58 -0.26 0.78 -2.23 0.00 0.00 178.31 177.77 2kob h GLY 65 N 0.55 0.00 0.71 2.40 0.00 -1.58 0.34 103.07 105.49 2kob h GLY 65 Ca 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.46 2kob h GLY 65 CO -0.01 0.00 -0.14 -1.80 0.00 0.00 0.00 176.54 174.59 2kob h ASP 66 N 0.00 -0.34 0.86 0.19 3.58 -1.66 -2.09 116.42 116.96 2kob h ASP 66 Ca -0.00 -0.16 -0.04 0.00 0.42 0.00 0.00 57.03 57.24 2kob h ASP 66 Cb 0.47 0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.60 2kob h ASP 66 CO 0.03 -0.01 -0.20 -0.50 -2.88 0.00 0.00 179.24 175.68 2kob h TRP 67 N -0.70 0.00 -0.10 0.28 4.06 -0.96 -2.85 115.95 115.68 2kob h TRP 67 Ca -0.04 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.90 2kob h TRP 67 Cb 0.48 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.64 2kob h TRP 67 CO 0.02 0.20 0.05 0.00 -3.56 0.00 0.00 178.44 175.14 2kob h ALA 68 N 1.80 0.13 -0.57 1.49 0.00 -0.17 0.79 119.26 122.73 2kob h ALA 68 Ca -0.00 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.85 2kob h ALA 68 Cb 0.69 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 2kob h ALA 68 CO 0.03 -0.30 0.36 1.49 0.00 0.00 0.00 179.25 180.82 2kob h GLU 69 N 0.03 0.69 -0.72 0.00 4.81 -1.20 0.40 114.58 118.59 2kob h GLU 69 Ca 0.03 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2kob h GLU 69 Cb 0.13 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.31 2kob h GLU 69 CO -0.00 0.46 0.46 -0.22 -0.73 0.00 0.00 179.01 178.97 2kob h LYS 70 N 0.71 0.88 -0.13 1.92 3.64 -1.28 -0.51 116.57 121.80 2kob h LYS 70 Ca 0.22 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.44 2kob h LYS 70 Cb -0.01 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.62 2kob h LYS 70 CO -0.08 0.58 -0.35 0.35 -2.27 0.00 0.00 179.45 177.68 2kob h PHE 71 N 0.90 0.60 -0.87 1.91 3.57 -0.29 -2.30 116.94 120.46 2kob h PHE 71 Ca 0.28 -0.23 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 2kob h PHE 71 Cb -0.01 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.58 2kob h PHE 71 CO -0.04 0.96 0.49 -0.07 -2.23 0.00 0.00 178.31 177.43 2kob h LEU 72 N 0.07 1.08 -0.16 0.59 4.07 0.00 -0.69 115.31 120.27 2kob h LEU 72 Ca -0.01 -0.09 -0.22 0.00 0.08 0.00 0.00 57.88 57.65 2kob h LEU 72 Cb 0.96 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 42.42 2kob h LEU 72 CO 0.08 0.85 -0.97 0.50 -1.08 0.00 0.00 178.44 177.82 2kob h LYS 73 N 1.21 0.22 0.00 1.13 3.64 -1.13 0.16 116.57 121.80 2kob h LYS 73 Ca 0.31 -0.27 -0.09 0.00 -1.27 0.00 0.00 60.65 59.33 2kob h LYS 73 Cb 0.01 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 2kob h LYS 73 CO -0.05 1.03 -0.41 0.66 -2.27 0.00 0.00 179.45 178.41 2kob h SER 74 N 0.11 0.00 0.50 4.20 4.64 -1.09 -1.02 113.55 120.89 2kob h SER 74 Ca -0.06 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.02 2kob h SER 74 Cb 1.63 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.72 2kob h SER 74 CO 0.15 0.41 -1.03 0.11 -0.87 0.00 0.00 176.83 175.60 2kob h LYS 75 N 0.00 0.31 -0.55 4.77 1.79 -0.98 0.29 116.57 122.20 2kob h LYS 75 Ca -0.00 -0.39 0.11 0.00 -2.18 0.00 0.00 60.65 58.18 2kob h LYS 75 Cb 0.75 0.13 -0.08 0.00 -1.58 0.00 0.00 32.23 31.44 2kob h LYS 75 CO 0.05 1.11 0.07 1.49 -1.08 0.00 0.00 179.45 181.09 2kob h GLU 76 N 0.15 0.19 0.00 3.15 4.81 -0.07 -0.81 114.58 122.00 2kob h GLU 76 Ca -0.09 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 2kob h GLU 76 Cb 1.70 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 31.04 2kob h GLU 76 CO 0.17 0.12 -0.29 0.00 -0.73 0.00 0.00 179.01 178.29 2kob n ALA 77 N -2.63 2.75 -0.05 2.92 0.00 -0.44 -3.70 120.51 119.36 2kob n ALA 77 Ca 0.07 -0.18 -0.04 0.00 0.00 0.00 0.00 53.44 53.30 2kob n ALA 77 Cb 0.30 -1.31 0.19 0.00 0.00 0.00 0.00 19.45 18.63 2kob n ALA 77 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2kob h ASP 78 N 0.00 0.63 0.00 0.00 3.58 0.56 -3.47 116.42 117.72 2kob h ASP 78 Ca 0.00 -0.17 0.00 0.00 0.42 0.00 0.00 57.03 57.28 2kob h ASP 78 Cb 0.63 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.51 2kob h ASP 78 CO 0.00 0.77 0.00 0.61 -2.88 0.00 0.00 179.24 177.74 2kob n GLY 79 N -0.54 -0.34 3.75 -0.78 0.00 -1.04 -5.06 105.19 101.17 2kob n GLY 79 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.62 3.17 0.84 1.61 -7.23 -1.18 -5.00 120.40 111.98 2kob s VAL 80 Ca 0.00 1.06 -0.11 0.00 -1.81 0.00 0.00 61.98 61.11 2kob s VAL 80 Cb 0.00 -3.67 0.09 0.00 0.56 0.00 0.00 36.38 33.36 2kob s VAL 80 CO 0.00 0.20 1.09 -0.55 -0.31 0.00 0.00 175.10 175.54 2kob s SER 81 N -0.12 4.07 0.53 4.85 0.15 -1.26 -4.69 113.70 117.23 2kob s SER 81 Ca 0.52 1.40 0.22 0.00 0.70 0.00 0.00 55.95 58.79 2kob s SER 81 Cb -0.36 -2.11 1.36 0.00 -1.71 0.00 0.00 66.02 63.20 2kob s SER 81 CO 0.42 -2.25 2.07 -0.37 1.20 0.00 0.00 173.24 174.31 2kob h VAL 82 N -1.28 0.83 -0.17 4.45 -1.51 -1.97 0.26 116.25 116.85 2kob h VAL 82 Ca -0.48 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 64.98 2kob h VAL 82 Cb 1.27 0.85 -0.01 0.00 -2.13 0.00 0.00 31.29 31.28 2kob h VAL 82 CO 0.57 0.00 0.08 0.77 -1.23 0.00 0.00 177.57 177.76 2kob h SER 83 N 0.00 0.22 0.10 4.19 4.64 -1.99 0.19 113.55 120.91 2kob h SER 83 Ca 0.13 -0.14 -0.21 0.00 -0.47 0.00 0.00 61.79 61.11 2kob h SER 83 Cb 0.55 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2kob h SER 83 CO -0.00 0.30 -0.79 -0.61 -0.87 0.00 0.00 176.83 174.86 2kob h GLN 84 N 0.13 0.56 -0.44 4.77 5.75 -1.51 -2.38 115.11 121.98 2kob h GLN 84 Ca 0.06 -0.48 -0.02 0.00 -0.15 0.00 0.00 58.65 58.06 2kob h GLN 84 Cb 0.14 0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.78 2kob h GLN 84 CO -0.01 1.11 0.21 1.25 -2.65 0.00 0.00 178.83 178.74 2kob h LEU 85 N 0.38 0.59 -1.19 -2.39 5.85 -0.45 -1.99 115.31 116.10 2kob h LEU 85 Ca -0.05 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.52 2kob h LEU 85 Cb 1.39 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.24 2kob h LEU 85 CO 0.15 0.55 0.33 0.78 -0.34 0.00 0.00 178.44 179.91 2kob h ASN 86 N 0.58 0.80 -0.25 1.25 2.35 -0.60 -2.51 115.58 117.19 2kob h ASN 86 Ca 0.15 -0.07 0.04 0.00 -0.55 0.00 0.00 56.30 55.88 2kob h ASN 86 Cb 0.13 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.26 2kob h ASN 86 CO -0.02 0.66 -0.00 -1.28 -1.65 0.00 0.00 177.43 175.14 2kob h SER 87 N 0.90 -0.10 -0.89 5.81 0.87 -0.84 0.12 113.55 119.42 2kob h SER 87 Ca 0.23 0.06 0.04 0.00 -1.23 0.00 0.00 61.79 60.88 2kob h SER 87 Cb 0.05 0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 62.06 2kob h SER 87 CO -0.03 -0.02 0.57 1.88 -0.53 0.00 0.00 176.83 178.70 2kob h TYR 88 N 0.07 1.07 -0.05 2.24 0.05 -1.03 -2.06 116.97 117.26 2kob h TYR 88 Ca 0.12 0.03 -0.12 0.00 0.05 0.00 0.00 58.73 58.80 2kob h TYR 88 Cb 0.15 -0.36 -0.01 0.00 1.01 0.00 0.00 36.73 37.52 2kob h TYR 88 CO -0.20 0.61 -0.53 0.87 -1.05 0.00 0.00 178.16 177.86 2kob h LYS 89 N 1.10 0.15 -0.45 4.88 1.57 -0.95 -2.34 116.57 120.54 2kob h LYS 89 Ca 0.36 -0.09 -0.06 0.00 -1.87 0.00 0.00 60.65 58.99 2kob h LYS 89 Cb 0.03 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 2kob h LYS 89 CO -0.13 0.64 0.02 -0.91 -0.57 0.00 0.00 179.45 178.51 2kob h ASN 90 N 0.12 0.67 -0.06 0.86 2.35 -0.12 -0.93 115.58 118.47 2kob h ASN 90 Ca 0.00 -0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.59 2kob h ASN 90 Cb 0.98 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 39.17 2kob h ASN 90 CO 0.08 0.73 -0.01 1.88 -1.65 0.00 0.00 177.43 178.46 2kob h TYR 91 N 0.67 0.13 -0.06 1.19 0.05 -0.96 -1.51 116.97 116.49 2kob h TYR 91 Ca 0.14 -0.03 -0.16 0.00 0.05 0.00 0.00 58.73 58.74 2kob h TYR 91 Cb 0.38 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 38.08 2kob h TYR 91 CO 0.02 0.43 -0.65 0.00 -1.05 0.00 0.00 178.16 176.91 2kob h ARG 93 N 0.18 0.55 0.00 0.00 3.08 -1.21 -3.05 114.38 113.93 2kob h ARG 93 Ca -0.01 -0.79 0.00 0.00 0.07 0.00 0.00 59.98 59.25 2kob h ARG 93 Cb 1.17 0.27 0.00 0.00 0.08 0.00 0.00 29.97 31.49 2kob h ARG 93 CO 0.10 1.36 -0.94 0.09 -1.07 0.00 0.00 179.97 179.51 2kob n ASN 94 N -3.74 1.86 -0.02 7.04 4.13 -0.57 -4.40 115.26 119.57 2kob n ASN 94 Ca -0.13 0.33 -0.16 0.00 1.68 0.00 0.00 54.58 56.29 2kob n ASN 94 Cb 1.01 -0.74 -0.13 0.00 -1.54 0.00 0.00 39.78 38.39 2kob n ASN 94 CO 0.00 0.00 0.00 0.45 0.28 0.00 0.00 177.26 177.99 2kob h HIS 95 N -0.96 0.23 -0.37 3.10 3.86 -1.27 -3.30 115.15 116.43 2kob h HIS 95 Ca 0.00 -0.16 -0.05 0.00 -1.16 0.00 0.00 60.37 59.01 2kob h HIS 95 Cb 0.94 -0.01 -0.03 0.00 1.06 0.00 0.00 27.41 29.37 2kob h HIS 95 CO -0.41 1.07 0.06 1.28 0.86 0.00 0.00 177.93 180.80 2kob n LEU 96 N -4.44 3.99 -0.25 2.43 4.77 0.14 -4.41 117.00 119.23 2kob n LEU 96 Ca -0.11 -2.04 -0.05 0.00 -0.03 0.00 0.00 56.01 53.78 2kob n LEU 96 Cb 0.59 -0.62 0.05 0.00 -2.33 0.00 0.00 43.42 41.11 2kob n LEU 96 CO 0.40 0.52 1.16 0.77 -1.33 0.00 0.00 177.39 178.91 2kob h SER 97 N 2.07 0.78 -0.02 -1.43 4.64 -1.61 0.42 113.55 118.39 2kob h SER 97 Ca 0.06 -0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.32 2kob h SER 97 Cb 1.48 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 63.36 2kob h SER 97 CO 0.34 0.57 -0.07 1.55 -0.87 0.00 0.00 176.83 178.35 2kob h PRO 98 N 0.93 0.24 0.04 4.77 0.13 -1.88 -2.70 132.00 133.53 2kob h PRO 98 Ca 0.25 -0.05 -0.23 0.00 -0.87 0.00 0.00 66.00 65.11 2kob h PRO 98 Cb -0.10 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 30.97 2kob h PRO 98 CO -0.06 0.33 -1.08 -0.07 -0.23 0.00 0.00 178.00 176.90 2kob h LEU 99 N 0.24 0.12 -1.54 1.56 4.07 -1.69 -3.29 115.31 114.78 2kob h LEU 99 Ca 0.05 -0.13 0.15 0.00 0.08 0.00 0.00 57.88 58.02 2kob h LEU 99 Cb 0.29 -0.04 -0.05 0.00 1.08 0.00 0.00 40.66 41.94 2kob h LEU 99 CO 0.01 1.10 0.51 0.22 -1.08 0.00 0.00 178.44 179.21 2kob h TYR 100 N 0.02 0.53 -0.01 1.13 5.03 0.15 0.12 116.97 123.95 2kob h TYR 100 Ca -0.05 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.28 2kob h TYR 100 Cb 1.83 -0.17 0.00 0.00 1.55 0.00 0.00 36.73 39.94 2kob h TYR 100 CO 0.02 0.20 -0.25 -1.33 -1.32 0.00 0.00 178.16 175.48 2kob n MET 101 N -4.49 1.02 -3.26 1.82 0.00 -1.22 -1.79 117.12 109.21 2kob n MET 101 Ca 0.15 -0.65 -0.32 0.00 0.00 0.00 0.00 57.70 56.87 2kob n MET 101 Cb 0.51 -1.49 -0.06 0.00 0.00 0.00 0.00 33.22 32.19 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 -2.43 3.92 0.63 0.03 1.02 0.43 -4.93 119.74 118.41 2kob s LYS 102 Ca 0.25 0.50 -0.09 0.00 0.02 0.00 0.00 55.97 56.65 2kob s LYS 102 Cb 0.19 -2.52 -0.01 0.00 -0.52 0.00 0.00 37.83 34.98 2kob s LYS 102 CO 0.50 0.22 0.99 -1.12 -0.92 0.00 0.00 175.35 175.03 2kob s SER 103 N -2.31 5.77 0.31 2.83 0.01 -1.26 -0.69 113.70 118.35 2kob s SER 103 Ca 0.51 1.06 0.06 0.00 1.31 0.00 0.00 55.95 58.90 2kob s SER 103 Cb -0.11 -2.04 0.72 0.00 0.21 0.00 0.00 66.02 64.81 2kob s SER 103 CO 0.19 -1.07 1.81 -0.07 0.41 0.00 0.00 173.24 174.51 2kob h LEU 104 N -0.34 0.79 -0.36 2.44 3.38 -1.10 0.20 115.31 120.32 2kob h LEU 104 Ca -0.45 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2kob h LEU 104 Cb 1.23 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2kob h LEU 104 CO 0.62 0.34 0.00 -1.20 0.09 0.00 0.00 178.44 178.29 2kob n SER 105 N -4.68 0.55 -0.55 -0.43 7.64 -1.26 -2.94 113.62 111.94 2kob n SER 105 Ca 0.21 -1.20 0.10 0.00 1.01 0.00 0.00 58.87 58.99 2kob n SER 105 Cb 0.51 -0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.73 2kob n SER 105 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2kob n GLU 106 N -0.56 1.58 -3.24 1.43 1.02 0.68 -4.89 120.64 116.66 2kob n GLU 106 Ca 0.22 -1.16 -0.42 0.00 -0.02 0.00 0.00 57.16 55.77 2kob n GLU 106 Cb 0.20 -1.38 -0.08 0.00 -0.02 0.00 0.00 31.44 30.16 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 -2.03 4.99 0.06 -3.67 1.01 -1.11 -4.86 121.20 115.59 2kob s ILE 107 Ca 0.18 0.10 -0.07 0.00 0.00 0.00 0.00 60.65 60.87 2kob s ILE 107 Cb 0.16 -4.03 -0.05 0.00 0.01 0.00 0.00 42.46 38.54 2kob s ILE 107 CO 0.41 -0.35 0.33 -0.76 0.00 0.00 0.00 174.94 174.57 2kob s LEU 108 N 2.42 4.34 0.55 2.97 1.43 -1.26 -4.92 118.68 124.20 2kob s LEU 108 Ca 0.18 0.63 0.23 0.00 -1.03 0.00 0.00 54.13 54.14 2kob s LEU 108 Cb -0.16 -2.92 1.46 0.00 0.03 0.00 0.00 46.19 44.60 2kob s LEU 108 CO 0.15 0.18 2.11 -0.65 0.23 0.00 0.00 176.35 178.37 2kob h PRO 109 N 3.61 0.00 -0.31 1.29 0.11 -1.97 -0.50 132.00 134.22 2kob h PRO 109 Ca -0.49 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 2kob h PRO 109 Cb 1.19 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 2kob h PRO 109 CO 0.68 0.00 -0.12 0.00 -0.21 0.00 0.00 178.00 178.35 2kob h ALA 110 N 1.88 1.22 -0.34 -0.75 0.00 -1.93 0.66 119.26 120.00 2kob h ALA 110 Ca 0.08 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 2kob h ALA 110 Cb 0.37 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2kob h ALA 110 CO -0.00 0.50 0.19 -0.44 0.00 0.00 0.00 179.25 179.50 2kob h ASP 111 N 0.49 0.43 -0.19 0.00 3.32 -1.48 0.16 116.42 119.15 2kob h ASP 111 Ca 0.09 -0.09 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 2kob h ASP 111 Cb 0.50 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.93 2kob h ASP 111 CO 0.03 0.39 -0.18 0.40 -1.72 0.00 0.00 179.24 178.16 2kob h ILE 112 N 0.43 1.33 -0.70 0.35 2.04 -1.43 -2.38 117.51 117.14 2kob h ILE 112 Ca 0.12 -1.34 0.04 0.00 1.00 0.00 0.00 64.86 64.68 2kob h ILE 112 Cb 0.06 1.78 -0.05 0.00 -0.74 0.00 0.00 36.82 37.87 2kob h ILE 112 CO -0.02 0.41 0.42 -0.61 0.00 0.00 0.00 178.15 178.35 2kob h GLN 113 N 0.12 0.78 -0.46 2.37 5.75 -0.69 0.09 115.11 123.08 2kob h GLN 113 Ca 0.03 -0.05 -0.09 0.00 -0.15 0.00 0.00 58.65 58.39 2kob h GLN 113 Cb 0.72 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 29.08 2kob h GLN 113 CO 0.05 0.51 -0.09 0.66 -2.65 0.00 0.00 178.83 177.31 2kob h SER 114 N 0.80 0.80 -0.64 -0.69 4.64 -0.66 -0.79 113.55 117.01 2kob h SER 114 Ca 0.30 -0.24 -0.04 0.00 -0.47 0.00 0.00 61.79 61.34 2kob h SER 114 Cb 0.10 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 61.94 2kob h SER 114 CO -0.14 0.92 0.24 0.40 -0.87 0.00 0.00 176.83 177.38 2kob h ILE 115 N 0.74 1.24 0.00 0.95 2.04 -0.82 0.42 117.51 122.08 2kob h ILE 115 Ca 0.13 -0.77 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 2kob h ILE 115 Cb 0.58 0.55 -0.00 0.00 -0.74 0.00 0.00 36.82 37.20 2kob h ILE 115 CO 0.04 0.30 -0.16 0.40 0.00 0.00 0.00 178.15 178.73 2kob h ILE 116 N 0.90 0.75 0.12 -0.67 1.08 -0.61 -0.07 117.51 119.01 2kob h ILE 116 Ca 0.21 -0.64 -0.33 0.00 -0.39 0.00 0.00 64.86 63.71 2kob h ILE 116 Cb 0.23 1.39 -0.01 0.00 -3.07 0.00 0.00 36.82 35.36 2kob h ILE 116 CO -0.01 0.16 -1.72 -1.13 -0.69 0.00 0.00 178.15 174.75 2kob h ASN 117 N 0.00 0.41 1.07 1.72 -1.24 -0.37 -3.37 115.58 113.80 2kob h ASN 117 Ca -0.00 -0.68 -0.19 0.00 0.71 0.00 0.00 56.30 56.14 2kob h ASN 117 Cb 0.37 -0.13 -0.03 0.00 0.73 0.00 0.00 38.32 39.26 2kob h ASN 117 CO 0.02 1.58 -0.91 -0.33 -1.29 0.00 0.00 177.43 176.50 2kob h GLU 118 N 0.07 0.00 -6.52 6.67 4.39 0.05 -3.42 114.58 115.83 2kob h GLU 118 Ca -0.32 0.00 -0.57 0.00 0.34 0.00 0.00 59.36 58.82 2kob h GLU 118 Cb 2.04 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 30.64 2kob h GLU 118 CO 0.14 0.91 1.02 0.99 -1.16 0.00 0.00 179.01 180.91 2kob s THR 119 N -2.77 4.01 -0.39 1.13 2.01 -0.06 -4.87 115.64 114.69 2kob s THR 119 Ca 0.01 1.06 0.02 0.00 0.31 0.00 0.00 61.69 63.10 2kob s THR 119 Cb 0.10 -4.26 0.51 0.00 0.01 0.00 0.00 72.50 68.86 2kob s THR 119 CO 0.81 -0.73 1.79 0.29 -0.69 0.00 0.00 174.62 176.08 2kob n LYS 120 N 7.85 2.06 -1.49 4.92 5.02 -1.26 -4.90 118.16 130.36 2kob n LYS 120 Ca 0.15 -2.46 -0.12 0.00 -2.02 0.00 0.00 58.31 53.86 2kob n LYS 120 Cb 0.48 -1.96 0.07 0.00 -0.02 0.00 0.00 35.03 33.59 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 -0.77 0.00 -4.73 -0.35 4.32 -1.26 -5.05 117.00 109.16 2kob n LEU 121 Ca 0.49 -1.01 -0.35 0.00 -0.02 0.00 0.00 56.01 55.12 2kob n LEU 121 Cb 1.32 -0.36 0.08 0.00 -1.62 0.00 0.00 43.42 42.84 2kob n LEU 121 CO 0.52 -0.79 0.83 0.00 -1.22 0.00 0.00 177.39 176.72 2kob s ALA 122 N -3.16 2.23 0.28 -1.18 0.00 -1.26 -4.85 121.76 113.82 2kob s ALA 122 Ca 0.34 0.97 -0.01 0.00 0.00 0.00 0.00 51.96 53.27 2kob s ALA 122 Cb -0.02 -3.49 0.46 0.00 0.00 0.00 0.00 23.12 20.08 2kob s ALA 122 CO 0.23 -1.72 1.88 -0.22 0.00 0.00 0.00 175.76 175.94 2kob h LYS 123 N 0.06 1.08 -0.42 0.00 1.63 -1.96 -1.88 116.57 115.07 2kob h LYS 123 Ca -0.49 -0.07 0.06 0.00 -0.85 0.00 0.00 60.65 59.30 2kob h LYS 123 Cb 1.31 -0.24 -0.05 0.00 -0.60 0.00 0.00 32.23 32.64 2kob h LYS 123 CO 0.51 0.72 0.13 -0.91 -3.45 0.00 0.00 179.45 176.45 2kob h ASN 124 N 1.12 0.12 -0.53 4.20 4.21 -1.93 -0.70 115.58 122.07 2kob h ASN 124 Ca 0.43 0.05 0.01 0.00 1.21 0.00 0.00 56.30 58.01 2kob h ASN 124 Cb 0.23 0.05 -0.03 0.00 -1.12 0.00 0.00 38.32 37.45 2kob h ASN 124 CO -0.18 0.10 0.33 0.74 -1.29 0.00 0.00 177.43 177.14 2kob h THR 125 N 0.29 1.10 -0.76 2.81 2.02 -1.71 0.43 112.91 117.09 2kob h THR 125 Ca 0.20 -0.23 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 2kob h THR 125 Cb 0.20 0.37 -0.04 0.00 -1.74 0.00 0.00 68.15 66.94 2kob h THR 125 CO -0.22 0.12 0.42 -0.07 0.37 0.00 0.00 175.52 176.15 2kob h LEU 126 N 0.67 0.95 -0.79 2.58 3.38 -1.12 -0.73 115.31 120.24 2kob h LEU 126 Ca 0.20 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 2kob h LEU 126 Cb -0.03 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 2kob h LEU 126 CO -0.07 0.77 -0.09 0.11 0.09 0.00 0.00 178.44 179.25 2kob h LYS 127 N 1.05 0.81 -0.34 1.13 1.57 -0.57 -2.71 116.57 117.52 2kob h LYS 127 Ca 0.27 -0.27 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 2kob h LYS 127 Cb 0.03 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 2kob h LYS 127 CO -0.04 0.88 -0.21 0.00 -0.57 0.00 0.00 179.45 179.50 2kob h ALA 128 N 1.16 1.00 0.13 3.86 0.00 -0.38 -0.06 119.26 124.97 2kob h ALA 128 Ca 0.13 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2kob h ALA 128 Cb 0.58 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2kob h ALA 128 CO 0.04 0.59 -0.11 0.82 0.00 0.00 0.00 179.25 180.59 2kob h ILE 129 N 0.57 0.76 -0.49 0.00 2.04 -0.86 0.81 117.51 120.34 2kob h ILE 129 Ca 0.08 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.92 2kob h ILE 129 Cb 0.68 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 2kob h ILE 129 CO 0.05 0.00 0.21 -0.09 0.00 0.00 0.00 178.15 178.32 2kob h ARG 130 N -0.25 0.72 -0.39 2.37 2.43 -1.36 -2.24 114.38 115.66 2kob h ARG 130 Ca -0.00 -0.12 0.04 0.00 -0.81 0.00 0.00 59.98 59.08 2kob h ARG 130 Cb 0.23 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.62 2kob h ARG 130 CO -0.02 0.63 0.17 -0.97 -1.51 0.00 0.00 179.97 178.28 2kob h ASN 131 N 0.65 0.23 -0.08 -3.80 -1.24 -0.77 0.15 115.58 110.73 2kob h ASN 131 Ca 0.16 0.03 -0.00 0.00 0.71 0.00 0.00 56.30 57.20 2kob h ASN 131 Cb 0.17 -0.01 -0.00 0.00 0.73 0.00 0.00 38.32 39.20 2kob h ASN 131 CO -0.02 0.18 0.04 0.74 -1.29 0.00 0.00 177.43 177.08 2kob h THR 132 N 0.36 1.07 -0.69 -3.57 2.02 -0.71 -2.14 112.91 109.25 2kob h THR 132 Ca 0.17 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 67.13 2kob h THR 132 Cb 0.11 1.06 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 2kob h THR 132 CO -0.14 0.06 0.31 0.00 0.37 0.00 0.00 175.52 176.12 2kob h ALA 133 N 0.96 0.89 -0.76 6.16 0.00 -1.12 -2.55 119.26 122.84 2kob h ALA 133 Ca 0.03 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.78 2kob h ALA 133 Cb 0.06 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 2kob h ALA 133 CO -0.00 0.48 0.50 1.03 0.00 0.00 0.00 179.25 181.26 2kob h SER 134 N 0.97 0.88 -0.28 0.00 0.87 -0.52 -0.74 113.55 114.74 2kob h SER 134 Ca 0.23 -0.02 -0.07 0.00 -1.23 0.00 0.00 61.79 60.70 2kob h SER 134 Cb 0.16 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.88 2kob h SER 134 CO -0.03 0.64 -0.04 1.56 -0.53 0.00 0.00 176.83 178.43 2kob h GLN 135 N 1.04 0.64 -0.38 2.24 4.20 -1.15 -0.09 115.11 121.62 2kob h GLN 135 Ca 0.28 -0.17 -0.05 0.00 0.06 0.00 0.00 58.65 58.77 2kob h GLN 135 Cb -0.12 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.57 2kob h GLN 135 CO -0.06 0.69 0.05 0.82 -0.67 0.00 0.00 178.83 179.67 2kob h ILE 136 N 0.60 1.24 -0.84 2.54 2.04 -0.94 -1.73 117.51 120.43 2kob h ILE 136 Ca 0.12 -0.87 -0.03 0.00 1.00 0.00 0.00 64.86 65.08 2kob h ILE 136 Cb 0.45 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 37.57 2kob h ILE 136 CO 0.02 0.30 0.42 -0.26 0.00 0.00 0.00 178.15 178.63 2kob h PHE 137 N 0.47 1.18 -0.56 1.37 0.04 -0.75 -2.30 116.94 116.40 2kob h PHE 137 Ca 0.11 -0.04 0.03 0.00 2.80 0.00 0.00 57.97 60.87 2kob h PHE 137 Cb 0.38 -0.37 -0.04 0.00 2.20 0.00 0.00 35.95 38.12 2kob h PHE 137 CO 0.03 0.84 0.34 0.00 -0.60 0.00 0.00 178.31 178.91 2kob h ARG 138 N 1.18 0.64 -0.73 1.51 3.08 -0.77 -0.09 114.38 119.20 2kob h ARG 138 Ca 0.29 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.33 2kob h ARG 138 Cb 0.08 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 29.95 2kob h ARG 138 CO -0.04 0.43 0.48 1.25 -1.07 0.00 0.00 179.97 181.02 2kob h LEU 139 N 0.66 0.78 -0.45 3.04 5.85 -0.84 0.21 115.31 124.56 2kob h LEU 139 Ca 0.23 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.82 2kob h LEU 139 Cb 0.03 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 2kob h LEU 139 CO -0.10 0.54 -0.17 0.00 -0.34 0.00 0.00 178.44 178.37 2kob h ALA 140 N 1.57 0.63 -0.53 1.25 0.00 -0.82 -2.41 119.26 118.95 2kob h ALA 140 Ca 0.28 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2kob h ALA 140 Cb 0.01 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2kob h ALA 140 CO -0.08 0.58 0.31 0.82 0.00 0.00 0.00 179.25 180.88 2kob h ILE 141 N 0.76 1.17 -0.71 0.00 2.04 0.21 0.26 117.51 121.22 2kob h ILE 141 Ca 0.11 -0.39 0.09 0.00 1.00 0.00 0.00 64.86 65.67 2kob h ILE 141 Cb 0.74 0.47 -0.07 0.00 -0.74 0.00 0.00 36.82 37.21 2kob h ILE 141 CO 0.06 0.17 0.35 -0.33 0.00 0.00 0.00 178.15 178.41 2kob h GLU 142 N 0.71 0.58 -0.54 2.37 4.39 -0.50 -0.71 114.58 120.88 2kob h GLU 142 Ca 0.19 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.85 2kob h GLU 142 Cb 0.01 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.53 2kob h GLU 142 CO -0.03 0.39 0.00 0.09 -1.16 0.00 0.00 179.01 178.29 2kob n ASN 143 N -4.87 2.56 -2.40 1.42 3.02 -0.92 -4.89 115.26 109.18 2kob n ASN 143 Ca 0.11 -2.19 -0.19 0.00 -0.03 0.00 0.00 54.58 52.28 2kob n ASN 143 Cb 0.28 -0.39 0.01 0.00 -0.61 0.00 0.00 39.78 39.07 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 0.48 -2.73 -0.02 3.52 1.74 -0.27 -4.88 116.66 114.50 2kob n ARG 144 Ca 0.13 0.88 -0.08 0.00 -0.77 0.00 0.00 57.85 58.01 2kob n ARG 144 Cb 0.48 -5.49 -0.14 0.00 -1.02 0.00 0.00 32.46 26.29 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 0.90 0.76 -2.56 7.54 0.00 -0.72 -3.48 119.26 121.70 2kob h ALA 145 Ca -0.46 -1.44 -0.10 0.00 0.00 0.00 0.00 54.91 52.90 2kob h ALA 145 Cb 1.33 0.46 -0.16 0.00 0.00 0.00 0.00 17.79 19.42 2kob h ALA 145 CO 0.53 1.57 -0.36 -1.50 0.00 0.00 0.00 179.25 179.48 2kob s ILE 146 N -2.61 0.11 -0.10 0.00 2.07 -1.19 -4.97 121.20 114.51 2kob s ILE 146 Ca -0.04 -0.92 0.15 0.00 -1.41 0.00 0.00 60.65 58.43 2kob s ILE 146 Cb 0.08 -1.01 0.22 0.00 0.13 0.00 0.00 42.46 41.89 2kob s ILE 146 CO 0.82 -0.51 1.11 -0.67 -1.91 0.00 0.00 174.94 173.79 2kob n ASP 147 N 0.51 2.04 -3.77 4.50 2.03 -1.26 -3.66 116.55 116.93 2kob n ASP 147 Ca -0.18 -2.82 -0.11 0.00 0.52 0.00 0.00 54.79 52.19 2kob n ASP 147 Cb 0.60 -0.35 -0.08 0.00 -0.72 0.00 0.00 41.12 40.57 2kob n ASP 147 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 2kob s PHE 148 N -2.33 -0.07 -0.41 -0.67 -0.71 -1.26 -5.11 117.98 107.41 2kob s PHE 148 Ca 0.25 -0.07 0.03 0.00 -1.04 0.00 0.00 56.93 56.09 2kob s PHE 148 Cb 0.22 0.07 0.11 0.00 -1.21 0.00 0.00 43.02 42.21 2kob s PHE 148 CO 0.02 -0.49 0.15 1.21 -1.34 0.00 0.00 175.22 174.77 2kob s ASN 149 N -2.05 4.74 0.42 1.98 3.84 -1.26 -4.95 114.94 117.66 2kob s ASN 149 Ca -0.05 -2.41 0.09 0.00 0.21 0.00 0.00 52.86 50.70 2kob s ASN 149 Cb -0.01 -1.67 0.93 0.00 -0.55 0.00 0.00 41.25 39.95 2kob s ASN 149 CO -0.03 -0.36 2.05 -0.65 -2.79 0.00 0.00 177.10 175.32 2kob h PRO 150 N 7.34 0.47 -0.09 0.43 0.11 -1.97 -1.71 132.00 136.58 2kob h PRO 150 Ca -0.06 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.91 2kob h PRO 150 Cb 0.99 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.98 2kob h PRO 150 CO 0.60 0.31 -0.44 0.00 -0.21 0.00 0.00 178.00 178.25 2kob h ALA 151 N 1.76 1.10 0.00 -0.75 0.00 -1.93 -2.03 119.26 117.41 2kob h ALA 151 Ca 0.16 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 2kob h ALA 151 Cb 0.05 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 2kob h ALA 151 CO -0.04 0.61 -0.15 0.22 0.00 0.00 0.00 179.25 179.89 2kob h ASP 152 N 0.16 0.00 1.38 0.00 3.58 -1.67 -2.31 116.42 117.57 2kob h ASP 152 Ca 0.01 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2kob h ASP 152 Cb 0.85 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.90 2kob h ASP 152 CO 0.07 0.15 -0.23 0.22 -2.88 0.00 0.00 179.24 176.57 2kob h TYR 153 N 0.00 0.00 -3.21 0.28 3.20 -1.13 -3.44 116.97 112.67 2kob h TYR 153 Ca -0.00 0.00 -0.53 0.00 3.14 0.00 0.00 58.73 61.34 2kob h TYR 153 Cb 0.66 0.00 0.03 0.00 1.54 0.00 0.00 36.73 38.96 2kob h TYR 153 CO 0.00 0.00 0.70 0.08 -1.64 0.00 0.00 178.16 177.30 2kob s VAL 154 N -3.15 3.20 -0.24 1.81 1.01 -0.87 -5.01 120.40 117.15 2kob s VAL 154 Ca 0.08 0.93 -0.05 0.00 0.00 0.00 0.00 61.98 62.93 2kob s VAL 154 Cb 0.11 -3.59 -0.01 0.00 0.00 0.00 0.00 36.38 32.88 2kob s VAL 154 CO 0.65 0.11 0.01 -0.60 0.00 0.00 0.00 175.10 175.28 2kob s ARG 155 N 0.42 3.45 0.04 2.72 6.06 -1.26 -5.03 118.95 125.35 2kob s ARG 155 Ca 0.61 -0.59 -0.30 0.00 -2.50 0.00 0.00 55.73 52.94 2kob s ARG 155 Cb -0.37 -3.16 -0.07 0.00 0.06 0.00 0.00 34.95 31.40 2kob s ARG 155 CO 0.35 -0.22 1.61 0.42 -2.50 0.00 0.00 175.30 174.96 2kob s ILE 156 N 1.53 3.22 0.42 4.11 -1.09 -1.26 -5.00 121.20 123.14 2kob s ILE 156 Ca 0.06 0.62 -0.24 0.00 -2.23 0.00 0.00 60.65 58.85 2kob s ILE 156 Cb -0.15 -3.40 -0.08 0.00 -1.58 0.00 0.00 42.46 37.26 2kob s ILE 156 CO -0.00 -0.01 1.18 -2.84 -1.23 0.00 0.00 174.94 172.04 2kob s PRO 157 N 2.77 3.94 0.00 2.79 0.02 -1.26 -3.79 135.00 139.47 2kob s PRO 157 Ca 0.72 1.85 0.00 0.00 0.02 0.00 0.00 61.00 63.59 2kob s PRO 157 Cb -0.38 -2.59 0.00 0.00 0.02 0.00 0.00 34.50 31.55 2kob s PRO 157 CO 0.31 -0.42 0.00 1.63 -0.33 0.00 0.00 177.00 178.19 2kob n LYS 158 N -0.11 0.00 0.00 5.54 5.02 -1.26 -4.76 118.16 122.59 2kob n LYS 158 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 2kob n LYS 158 Cb 0.47 -0.06 0.00 0.00 -0.02 0.00 0.00 35.03 35.42 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 0.00 0.00 -1.69 -0.18 -0.00 -1.25 -4.86 119.36 111.38 2kob n ILE 159 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 62.75 62.45 2kob n ILE 159 Cb 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 39.64 39.71 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 2.52 -0.15 -1.39 0.00 -1.26 -4.99 121.76 116.50 2kob s ALA 160 Ca 0.00 -0.26 0.11 0.00 0.00 0.00 0.00 51.96 51.80 2kob s ALA 160 Cb 0.00 -3.07 0.20 0.00 0.00 0.00 0.00 23.12 20.25 2kob s ALA 160 CO 0.00 -1.48 1.13 1.47 0.00 0.00 0.00 175.76 176.88 2kob n LEU 161 N -3.25 2.40 -4.53 0.00 -0.00 -1.26 -4.93 117.00 105.42 2kob n LEU 161 Ca 0.07 -2.57 -0.43 0.00 -0.00 0.00 0.00 56.01 53.09 2kob n LEU 161 Cb 0.57 -0.26 -0.04 0.00 -0.00 0.00 0.00 43.42 43.69 2kob n LEU 161 CO 0.57 0.63 0.82 -0.70 -0.00 0.00 0.00 177.39 178.70 2kob s GLU 162 N -1.98 3.38 -0.35 1.47 2.12 -1.26 -5.00 118.70 117.07 2kob s GLU 162 Ca 0.20 -0.15 -0.08 0.00 0.36 0.00 0.00 54.97 55.30 2kob s GLU 162 Cb 0.16 -4.04 0.04 0.00 0.26 0.00 0.00 34.13 30.55 2kob s GLU 162 CO 0.03 -1.51 0.14 -1.58 -0.54 0.00 0.00 175.26 171.80 2kob s HIS 163 N 4.14 3.25 0.04 5.30 5.65 -1.26 -4.87 115.29 127.55 2kob s HIS 163 Ca 0.33 -1.29 0.00 0.00 0.25 0.00 0.00 55.06 54.35 2kob s HIS 163 Cb -0.11 -2.34 0.00 0.00 -1.18 0.00 0.00 32.58 28.94 2kob s HIS 163 CO 0.21 -0.71 0.00 1.58 -0.65 0.00 0.00 174.74 175.17 2kob n HIS 164 N 4.87 -0.21 -0.90 3.88 -0.00 -1.26 -5.16 115.22 116.44 2kob n HIS 164 Ca -0.12 0.04 0.00 0.00 -0.00 0.00 0.00 57.72 57.64 2kob n HIS 164 Cb 0.45 0.15 0.00 0.00 -0.00 0.00 0.00 29.99 30.59 2kob n HIS 164 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2kob n HIS 165 N -2.77 -2.48 -2.80 1.57 -0.00 -1.26 -4.71 115.22 102.77 2kob n HIS 165 Ca 0.00 1.33 -0.43 0.00 0.46 0.00 0.00 57.72 59.08 2kob n HIS 165 Cb 0.00 -2.36 0.01 0.00 -0.12 0.00 0.00 29.99 27.52 2kob n HIS 165 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2kob n HIS 166 N -1.49 2.51 -3.22 1.57 -0.00 -1.26 -4.69 115.22 108.64 2kob n HIS 166 Ca 0.00 -2.66 -0.22 0.00 0.46 0.00 0.00 57.72 55.30 2kob n HIS 166 Cb 0.12 -1.48 -0.07 0.00 -0.12 0.00 0.00 29.99 28.45 2kob n HIS 166 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2kob n HIS 167 N 2.14 -1.47 -0.09 1.57 8.25 -1.26 -5.38 115.22 118.98 2kob n HIS 167 Ca 0.30 -2.94 0.00 0.00 -0.26 0.00 0.00 57.72 54.82 2kob n HIS 167 Cb 0.34 0.44 0.00 0.00 1.12 0.00 0.00 29.99 31.89 2kob n HIS 167 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70