#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 0.01 -4.47 0.55 8.00 -1.26 -4.84 116.55 114.53 2kob n ASP 62 Ca 0.00 -1.28 -0.29 0.00 0.71 0.00 0.00 54.79 53.92 2kob n ASP 62 Cb 0.00 -0.63 -0.12 0.00 -0.02 0.00 0.00 41.12 40.36 2kob n ASP 62 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2kob s SER 63 N -3.98 3.80 0.29 -2.24 0.15 -1.26 -1.00 113.70 109.47 2kob s SER 63 Ca 0.46 -0.60 -0.02 0.00 0.70 0.00 0.00 55.95 56.50 2kob s SER 63 Cb -0.01 -0.49 0.45 0.00 -1.71 0.00 0.00 66.02 64.25 2kob s SER 63 CO 0.33 0.17 1.94 0.15 1.20 0.00 0.00 173.24 177.03 2kob h PHE 64 N 3.70 1.08 -0.16 3.44 3.57 -1.69 -1.78 116.94 125.11 2kob h PHE 64 Ca -0.50 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 60.97 2kob h PHE 64 Cb 1.17 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 39.54 2kob h PHE 64 CO 0.61 0.64 -0.19 0.78 -2.23 0.00 0.00 178.31 177.92 2kob h GLY 65 N 1.12 0.28 1.04 2.40 0.00 -1.57 1.00 103.07 107.34 2kob h GLY 65 Ca 0.34 -0.19 -0.12 0.00 0.00 0.00 0.00 47.33 47.37 2kob h GLY 65 CO -0.10 0.18 -0.20 -1.80 0.00 0.00 0.00 176.54 174.62 2kob h ASP 66 N 0.24 0.88 0.62 0.19 3.58 -1.59 -0.12 116.42 120.22 2kob h ASP 66 Ca 0.04 -0.40 -0.17 0.00 0.42 0.00 0.00 57.03 56.92 2kob h ASP 66 Cb 0.47 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 41.26 2kob h ASP 66 CO 0.03 1.09 -0.77 -0.50 -2.88 0.00 0.00 179.24 176.21 2kob h TRP 67 N 0.68 0.17 -0.73 0.28 4.06 -1.21 -2.65 115.95 116.53 2kob h TRP 67 Ca 0.09 -0.08 -0.02 0.00 2.06 0.00 0.00 58.89 60.94 2kob h TRP 67 Cb 0.76 -0.02 -0.03 0.00 -1.00 0.00 0.00 29.16 28.86 2kob h TRP 67 CO 0.06 0.84 0.37 0.00 -3.56 0.00 0.00 178.44 176.15 2kob h ALA 68 N 1.13 0.94 -0.20 1.49 0.00 -0.60 0.25 119.26 122.27 2kob h ALA 68 Ca -0.02 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.80 2kob h ALA 68 Cb 1.35 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.80 2kob h ALA 68 CO 0.11 0.49 -0.12 1.49 0.00 0.00 0.00 179.25 181.22 2kob h GLU 69 N 1.02 -0.10 0.00 0.00 4.22 -0.86 0.19 114.58 119.04 2kob h GLU 69 Ca 0.25 0.01 -0.07 0.00 0.08 0.00 0.00 59.36 59.63 2kob h GLU 69 Cb 0.09 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2kob h GLU 69 CO -0.04 -0.07 -0.35 0.87 -2.18 0.00 0.00 179.01 177.25 2kob h LYS 70 N -0.11 0.00 -0.02 1.92 1.57 -1.11 0.17 116.57 118.99 2kob h LYS 70 Ca 0.12 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 2kob h LYS 70 Cb 0.28 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 2kob h LYS 70 CO -0.27 0.35 -0.03 0.35 -0.57 0.00 0.00 179.45 179.28 2kob h PHE 71 N 0.00 0.07 -0.31 -1.35 3.57 -0.02 -0.08 116.94 118.81 2kob h PHE 71 Ca -0.00 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.40 2kob h PHE 71 Cb 0.91 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.62 2kob h PHE 71 CO 0.00 0.56 -0.10 -0.07 -2.23 0.00 0.00 178.31 176.47 2kob h LEU 72 N -0.44 0.51 -0.31 0.59 -0.00 -0.82 -1.07 115.31 113.76 2kob h LEU 72 Ca 0.00 -0.13 -0.02 0.00 -0.00 0.00 0.00 57.88 57.73 2kob h LEU 72 Cb 0.55 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 41.06 2kob h LEU 72 CO 0.01 0.65 0.10 0.50 -0.00 0.00 0.00 178.44 179.69 2kob h LYS 73 N 0.49 0.48 0.00 1.13 1.63 -0.63 0.11 116.57 119.79 2kob h LYS 73 Ca 0.09 -0.10 -0.08 0.00 -0.85 0.00 0.00 60.65 59.70 2kob h LYS 73 Cb 0.48 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.03 2kob h LYS 73 CO 0.03 0.53 -0.40 0.66 -3.45 0.00 0.00 179.45 176.82 2kob h SER 74 N 0.34 0.00 0.40 4.20 4.64 -0.75 -0.58 113.55 121.80 2kob h SER 74 Ca 0.10 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.22 2kob h SER 74 Cb 0.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 2kob h SER 74 CO -0.00 0.40 -0.82 0.11 -0.87 0.00 0.00 176.83 175.65 2kob h LYS 75 N 0.00 0.31 -0.69 4.77 1.79 -0.95 0.24 116.57 122.05 2kob h LYS 75 Ca -0.00 -0.30 -0.04 0.00 -2.18 0.00 0.00 60.65 58.13 2kob h LYS 75 Cb 0.82 0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 31.52 2kob h LYS 75 CO 0.05 0.98 0.29 1.49 -1.08 0.00 0.00 179.45 181.18 2kob h GLU 76 N 0.19 1.02 0.00 3.15 4.57 -0.25 -1.59 114.58 121.67 2kob h GLU 76 Ca -0.04 -0.18 0.00 0.00 -1.18 0.00 0.00 59.36 57.96 2kob h GLU 76 Cb 1.42 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.84 2kob h GLU 76 CO 0.13 0.84 -0.06 0.00 -1.18 0.00 0.00 179.01 178.75 2kob n ALA 77 N -2.39 2.47 -0.05 2.92 0.00 -0.27 -3.67 120.51 119.52 2kob n ALA 77 Ca 0.05 -0.13 -0.14 0.00 0.00 0.00 0.00 53.44 53.22 2kob n ALA 77 Cb 0.17 -1.43 -0.12 0.00 0.00 0.00 0.00 19.45 18.07 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 0.05 0.00 0.00 3.58 0.39 -3.49 116.42 116.94 2kob h ASP 78 Ca 0.00 -0.86 0.00 0.00 0.42 0.00 0.00 57.03 56.59 2kob h ASP 78 Cb 0.50 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.54 2kob h ASP 78 CO 0.00 0.90 0.00 0.61 -2.88 0.00 0.00 179.24 177.87 2kob n GLY 79 N 1.24 1.86 3.75 -0.78 0.00 -0.70 -5.06 105.19 105.50 2kob n GLY 79 Ca -0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.86 3.01 0.34 1.61 -7.23 -1.18 -4.96 120.40 110.13 2kob s VAL 80 Ca 0.00 0.40 -0.29 0.00 -1.81 0.00 0.00 61.98 60.28 2kob s VAL 80 Cb 0.00 -2.85 -0.12 0.00 0.56 0.00 0.00 36.38 33.97 2kob s VAL 80 CO 0.00 -0.36 1.48 -0.24 -0.31 0.00 0.00 175.10 175.67 2kob n SER 81 N -3.10 3.56 -0.05 4.85 2.88 -1.26 -4.80 113.62 115.71 2kob n SER 81 Ca 0.10 1.20 0.07 0.00 -1.33 0.00 0.00 58.87 58.91 2kob n SER 81 Cb 0.52 -1.58 0.45 0.00 -0.75 0.00 0.00 64.21 62.85 2kob n SER 81 CO 0.00 0.00 0.00 1.62 -1.23 0.00 0.00 175.04 175.43 2kob h VAL 82 N 2.98 1.02 -0.28 2.46 3.04 -1.98 0.45 116.25 123.94 2kob h VAL 82 Ca -0.49 -0.18 -0.11 0.00 -1.01 0.00 0.00 66.70 64.92 2kob h VAL 82 Cb 1.25 0.46 -0.01 0.00 -2.01 0.00 0.00 31.29 30.98 2kob h VAL 82 CO 0.68 0.09 -0.24 -1.28 -1.01 0.00 0.00 177.57 175.82 2kob h SER 83 N 0.51 0.70 -0.49 3.17 0.87 -1.99 0.20 113.55 116.52 2kob h SER 83 Ca 0.21 -0.45 -0.06 0.00 -1.23 0.00 0.00 61.79 60.25 2kob h SER 83 Cb 0.20 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 2kob h SER 83 CO -0.06 1.01 0.08 -0.61 -0.53 0.00 0.00 176.83 176.72 2kob h GLN 84 N 0.40 0.88 -0.44 2.24 5.75 -1.59 -1.13 115.11 121.22 2kob h GLN 84 Ca 0.05 -0.21 -0.07 0.00 -0.15 0.00 0.00 58.65 58.27 2kob h GLN 84 Cb 0.79 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 29.21 2kob h GLN 84 CO 0.06 0.82 0.01 1.25 -2.65 0.00 0.00 178.83 178.33 2kob h LEU 85 N 0.83 0.74 -1.14 -2.39 5.85 -0.00 -1.65 115.31 117.55 2kob h LEU 85 Ca 0.17 -0.30 0.02 0.00 0.84 0.00 0.00 57.88 58.61 2kob h LEU 85 Cb 0.38 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.17 2kob h LEU 85 CO 0.01 0.86 0.58 0.78 -0.34 0.00 0.00 178.44 180.33 2kob h ASN 86 N 0.60 0.99 -0.17 1.25 2.35 -0.60 0.10 115.58 120.10 2kob h ASN 86 Ca 0.13 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.85 2kob h ASN 86 Cb 0.47 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.59 2kob h ASN 86 CO 0.02 0.71 0.11 -1.28 -1.65 0.00 0.00 177.43 175.33 2kob h SER 87 N 1.16 0.20 -0.44 5.81 0.87 -0.87 0.17 113.55 120.46 2kob h SER 87 Ca 0.33 -0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.85 2kob h SER 87 Cb -0.09 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 61.80 2kob h SER 87 CO -0.08 0.18 0.24 1.88 -0.53 0.00 0.00 176.83 178.52 2kob h TYR 88 N 0.21 0.60 -0.87 2.24 0.05 -0.71 -1.58 116.97 116.92 2kob h TYR 88 Ca 0.06 -0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.82 2kob h TYR 88 Cb 0.01 -0.19 -0.04 0.00 1.01 0.00 0.00 36.73 37.52 2kob h TYR 88 CO -0.06 0.46 0.49 0.87 -1.05 0.00 0.00 178.16 178.87 2kob h LYS 89 N 0.58 1.20 -0.54 4.88 1.57 -0.58 -1.58 116.57 122.09 2kob h LYS 89 Ca 0.16 -0.13 -0.07 0.00 -1.87 0.00 0.00 60.65 58.74 2kob h LYS 89 Cb 0.05 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.10 2kob h LYS 89 CO -0.02 0.86 0.08 -0.97 -0.57 0.00 0.00 179.45 178.83 2kob h ASN 90 N 1.21 0.87 -0.49 0.86 -1.24 -0.28 0.10 115.58 116.62 2kob h ASN 90 Ca 0.31 -0.26 -0.05 0.00 0.71 0.00 0.00 56.30 57.01 2kob h ASN 90 Cb -0.00 -0.23 -0.02 0.00 0.73 0.00 0.00 38.32 38.80 2kob h ASN 90 CO -0.05 0.91 0.12 1.88 -1.29 0.00 0.00 177.43 179.00 2kob h TYR 91 N 0.79 0.82 0.02 0.67 0.05 -0.93 -0.55 116.97 117.85 2kob h TYR 91 Ca 0.16 -0.10 -0.20 0.00 0.05 0.00 0.00 58.73 58.65 2kob h TYR 91 Cb 0.42 -0.23 0.02 0.00 1.01 0.00 0.00 36.73 37.94 2kob h TYR 91 CO 0.03 0.74 -0.78 0.00 -1.05 0.00 0.00 178.16 177.10 2kob h ARG 93 N 0.03 0.37 0.00 0.00 2.43 -0.83 -3.19 114.38 113.19 2kob h ARG 93 Ca -0.10 -0.58 -0.45 0.00 -0.81 0.00 0.00 59.98 58.04 2kob h ARG 93 Cb 1.49 0.21 -0.07 0.00 -0.42 0.00 0.00 29.97 31.18 2kob h ARG 93 CO 0.15 1.26 -2.48 0.09 -1.51 0.00 0.00 179.97 177.48 2kob n ASN 94 N -3.62 1.86 0.06 -3.80 4.13 -0.22 -4.06 115.26 109.61 2kob n ASN 94 Ca -0.10 0.32 -0.12 0.00 1.68 0.00 0.00 54.58 56.36 2kob n ASN 94 Cb 1.01 -0.78 -0.13 0.00 -1.54 0.00 0.00 39.78 38.34 2kob n ASN 94 CO 0.00 0.00 0.00 -0.74 0.28 0.00 0.00 177.26 176.80 2kob h HIS 95 N -0.94 0.22 -0.64 3.10 2.76 -1.22 -3.21 115.15 115.22 2kob h HIS 95 Ca -0.67 -0.16 -0.12 0.00 -2.20 0.00 0.00 60.37 57.21 2kob h HIS 95 Cb 1.59 -0.01 -0.07 0.00 1.55 0.00 0.00 27.41 30.47 2kob h HIS 95 CO -0.08 1.16 0.15 1.28 -1.30 0.00 0.00 177.93 179.13 2kob n LEU 96 N -3.38 5.73 -0.22 0.26 4.77 0.72 -4.65 117.00 120.24 2kob n LEU 96 Ca -0.08 -2.95 0.01 0.00 -0.03 0.00 0.00 56.01 52.96 2kob n LEU 96 Cb 1.00 -0.71 0.12 0.00 -2.33 0.00 0.00 43.42 41.50 2kob n LEU 96 CO 0.49 0.71 1.01 0.77 -1.33 0.00 0.00 177.39 179.04 2kob h SER 97 N 3.06 0.30 -0.62 -1.43 4.64 -1.61 0.43 113.55 118.33 2kob h SER 97 Ca 0.15 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2kob h SER 97 Cb 2.11 0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 64.21 2kob h SER 97 CO 0.61 0.17 0.40 -0.65 -0.87 0.00 0.00 176.83 176.48 2kob h PRO 98 N 0.47 0.82 0.01 4.77 0.11 -1.88 -2.88 132.00 133.41 2kob h PRO 98 Ca 0.33 -0.06 -0.20 0.00 0.11 0.00 0.00 66.00 66.18 2kob h PRO 98 Cb 0.40 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 2kob h PRO 98 CO -0.30 0.56 -0.88 -0.07 -0.21 0.00 0.00 178.00 177.09 2kob h LEU 99 N 0.84 0.22 -1.68 2.35 3.38 -1.74 -3.11 115.31 115.57 2kob h LEU 99 Ca 0.22 -0.18 0.06 0.00 0.09 0.00 0.00 57.88 58.07 2kob h LEU 99 Cb -0.07 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 2kob h LEU 99 CO -0.05 1.00 0.32 0.22 0.09 0.00 0.00 178.44 180.02 2kob h TYR 100 N 0.09 0.39 -0.60 1.13 3.20 0.05 -0.28 116.97 120.95 2kob h TYR 100 Ca -0.04 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.84 2kob h TYR 100 Cb 1.52 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 39.66 2kob h TYR 100 CO 0.03 0.21 0.00 -1.33 -1.64 0.00 0.00 178.16 175.43 2kob n MET 101 N -4.47 3.52 -3.58 1.82 2.81 -1.14 -1.96 117.12 114.12 2kob n MET 101 Ca 0.06 -2.79 -0.20 0.00 -1.81 0.00 0.00 57.70 52.96 2kob n MET 101 Cb 0.25 -1.80 -0.01 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 -1.77 3.24 0.16 0.03 1.02 -0.12 -5.03 119.74 117.28 2kob s LYS 102 Ca 0.48 -0.84 -0.30 0.00 0.02 0.00 0.00 55.97 55.33 2kob s LYS 102 Cb 0.30 -2.81 -0.07 0.00 -0.52 0.00 0.00 37.83 34.73 2kob s LYS 102 CO 0.23 0.16 0.94 -1.12 -0.92 0.00 0.00 175.35 174.64 2kob s SER 103 N -4.11 7.55 0.22 2.83 0.01 -1.26 -2.60 113.70 116.34 2kob s SER 103 Ca 0.41 1.84 -0.07 0.00 1.31 0.00 0.00 55.95 59.45 2kob s SER 103 Cb -0.09 -2.59 0.33 0.00 0.21 0.00 0.00 66.02 63.87 2kob s SER 103 CO 0.31 0.04 1.79 0.25 0.41 0.00 0.00 173.24 176.04 2kob h LEU 104 N 4.94 0.50 -0.01 2.44 5.85 -1.35 -2.29 115.31 125.38 2kob h LEU 104 Ca -0.44 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.33 2kob h LEU 104 Cb 1.21 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.20 2kob h LEU 104 CO 0.70 0.29 -0.19 -1.20 -0.34 0.00 0.00 178.44 177.70 2kob n SER 105 N -4.84 0.21 0.11 1.25 7.64 -1.26 -3.38 113.62 113.35 2kob n SER 105 Ca 0.11 0.16 0.07 0.00 1.01 0.00 0.00 58.87 60.22 2kob n SER 105 Cb 0.26 -0.19 0.01 0.00 -1.01 0.00 0.00 64.21 63.28 2kob n SER 105 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 2kob h GLU 106 N 0.03 0.00 -6.54 1.43 -0.00 -1.80 -3.46 114.58 104.23 2kob h GLU 106 Ca 0.00 0.00 -0.52 0.00 -0.00 0.00 0.00 59.36 58.84 2kob h GLU 106 Cb 0.49 0.00 0.04 0.00 -0.00 0.00 0.00 28.75 29.28 2kob h GLU 106 CO 0.00 0.14 1.08 0.42 -0.00 0.00 0.00 179.01 180.65 2kob s ILE 107 N -3.17 2.46 0.09 -1.06 1.01 -1.21 -4.99 121.20 114.32 2kob s ILE 107 Ca 0.01 0.07 0.06 0.00 0.00 0.00 0.00 60.65 60.79 2kob s ILE 107 Cb 0.08 -3.04 -0.04 0.00 0.01 0.00 0.00 42.46 39.47 2kob s ILE 107 CO 0.77 0.00 -0.09 -1.48 0.00 0.00 0.00 174.94 174.14 2kob s LEU 108 N 2.40 3.10 0.29 2.97 2.34 -1.26 -4.82 118.68 123.69 2kob s LEU 108 Ca 0.79 -0.34 0.01 0.00 0.06 0.00 0.00 54.13 54.66 2kob s LEU 108 Cb -0.46 -1.88 0.55 0.00 -0.56 0.00 0.00 46.19 43.84 2kob s LEU 108 CO 0.35 0.19 1.85 -0.65 -1.06 0.00 0.00 176.35 177.03 2kob h PRO 109 N 3.69 0.98 -0.89 1.48 0.11 -1.95 -2.34 132.00 133.08 2kob h PRO 109 Ca -0.49 -0.06 0.03 0.00 0.11 0.00 0.00 66.00 65.60 2kob h PRO 109 Cb 1.17 -0.22 -0.05 0.00 0.11 0.00 0.00 31.00 32.01 2kob h PRO 109 CO 0.53 0.65 0.59 0.00 -0.21 0.00 0.00 178.00 179.55 2kob h ALA 110 N 1.53 1.43 -0.24 -0.75 0.00 -1.96 0.27 119.26 119.54 2kob h ALA 110 Ca 0.48 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.31 2kob h ALA 110 Cb 0.45 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2kob h ALA 110 CO -0.25 0.48 -0.01 0.22 0.00 0.00 0.00 179.25 179.69 2kob h ASP 111 N 1.12 0.43 -0.51 0.00 3.58 -1.84 -0.13 116.42 119.07 2kob h ASP 111 Ca 0.35 -0.32 -0.09 0.00 0.42 0.00 0.00 57.03 57.39 2kob h ASP 111 Cb 0.01 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 40.92 2kob h ASP 111 CO -0.10 0.65 0.00 0.40 -2.88 0.00 0.00 179.24 177.31 2kob h ILE 112 N 0.21 1.26 -0.84 2.25 2.04 -1.37 -2.67 117.51 118.39 2kob h ILE 112 Ca 0.07 -1.09 -0.02 0.00 1.00 0.00 0.00 64.86 64.81 2kob h ILE 112 Cb 0.44 0.83 -0.04 0.00 -0.74 0.00 0.00 36.82 37.30 2kob h ILE 112 CO 0.02 0.39 0.44 -0.61 0.00 0.00 0.00 178.15 178.38 2kob h GLN 113 N 0.88 1.18 -0.60 2.37 5.75 -0.21 -2.20 115.11 122.27 2kob h GLN 113 Ca 0.16 -0.15 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 2kob h GLN 113 Cb 0.51 -0.22 -0.03 0.00 1.07 0.00 0.00 27.48 28.81 2kob h GLN 113 CO 0.03 0.89 0.39 1.03 -2.65 0.00 0.00 178.83 178.52 2kob h SER 114 N 1.18 0.70 -0.98 -0.69 0.87 -0.77 -0.73 113.55 113.12 2kob h SER 114 Ca 0.29 -0.03 0.12 0.00 -1.23 0.00 0.00 61.79 60.94 2kob h SER 114 Cb 0.07 -0.18 -0.08 0.00 -0.44 0.00 0.00 62.40 61.77 2kob h SER 114 CO -0.04 0.52 0.62 0.40 -0.53 0.00 0.00 176.83 177.80 2kob h ILE 115 N 0.82 0.93 -0.37 2.23 2.04 -1.08 0.18 117.51 122.25 2kob h ILE 115 Ca 0.22 -0.33 -0.17 0.00 1.00 0.00 0.00 64.86 65.58 2kob h ILE 115 Cb -0.08 -0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 35.87 2kob h ILE 115 CO -0.05 0.18 -0.41 0.40 0.00 0.00 0.00 178.15 178.27 2kob h ILE 116 N 0.97 1.27 -0.15 -0.67 1.08 -0.97 -0.40 117.51 118.64 2kob h ILE 116 Ca 0.48 -1.59 -0.09 0.00 -0.39 0.00 0.00 64.86 63.27 2kob h ILE 116 Cb 0.48 1.41 -0.01 0.00 -3.07 0.00 0.00 36.82 35.63 2kob h ILE 116 CO -0.24 0.53 -0.30 -1.13 -0.69 0.00 0.00 178.15 176.31 2kob h ASN 117 N 0.76 0.30 0.78 1.72 -1.24 0.23 -2.96 115.58 115.16 2kob h ASN 117 Ca 0.05 -0.10 -0.25 0.00 0.71 0.00 0.00 56.30 56.72 2kob h ASN 117 Cb 1.01 -0.08 -0.03 0.00 0.73 0.00 0.00 38.32 39.95 2kob h ASN 117 CO 0.10 0.59 -1.28 -0.33 -1.29 0.00 0.00 177.43 175.22 2kob h GLU 118 N 0.26 0.03 -5.89 6.67 5.08 -0.64 -3.45 114.58 116.64 2kob h GLU 118 Ca 0.04 -0.05 -0.59 0.00 -1.00 0.00 0.00 59.36 57.76 2kob h GLU 118 Cb 0.67 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.86 2kob h GLU 118 CO 0.05 0.85 0.52 0.99 -1.00 0.00 0.00 179.01 180.41 2kob s THR 119 N -2.66 4.82 -0.78 1.13 2.01 -0.17 -4.99 115.64 114.99 2kob s THR 119 Ca -0.02 1.68 -0.05 0.00 0.31 0.00 0.00 61.69 63.62 2kob s THR 119 Cb 0.09 -4.16 0.20 0.00 0.01 0.00 0.00 72.50 68.64 2kob s THR 119 CO 0.83 -0.07 0.65 -0.54 -0.69 0.00 0.00 174.62 174.80 2kob s LYS 120 N 2.71 3.09 0.27 4.92 -0.14 -1.26 -4.86 119.74 124.47 2kob s LYS 120 Ca 0.38 -2.84 0.00 0.00 -1.36 0.00 0.00 55.97 52.15 2kob s LYS 120 Cb -0.16 -3.97 -0.00 0.00 -1.68 0.00 0.00 37.83 32.02 2kob s LYS 120 CO 0.09 -1.23 0.00 1.28 -0.76 0.00 0.00 175.35 174.73 2kob n LEU 121 N 3.09 0.00 -4.75 3.17 4.77 -1.26 -5.10 117.00 116.92 2kob n LEU 121 Ca 0.15 -1.73 -0.42 0.00 -0.03 0.00 0.00 56.01 53.98 2kob n LEU 121 Cb 0.39 0.21 -0.00 0.00 -2.33 0.00 0.00 43.42 41.69 2kob n LEU 121 CO 0.35 -0.25 1.08 0.00 -1.33 0.00 0.00 177.39 177.24 2kob n ALA 122 N -2.12 2.06 0.07 -1.18 0.00 -1.26 -4.80 120.51 113.28 2kob n ALA 122 Ca -0.11 0.35 0.03 0.00 0.00 0.00 0.00 53.44 53.71 2kob n ALA 122 Cb 0.35 -2.37 0.41 0.00 0.00 0.00 0.00 19.45 17.83 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 3.04 0.38 -0.60 0.00 1.57 -1.99 0.12 116.57 119.09 2kob h LYS 123 Ca -0.49 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.15 2kob h LYS 123 Cb 1.25 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 2kob h LYS 123 CO 0.65 0.37 0.04 -0.91 -0.57 0.00 0.00 179.45 179.03 2kob h ASN 124 N 0.37 0.98 -0.16 0.86 2.35 -1.89 -2.77 115.58 115.31 2kob h ASN 124 Ca 0.09 -0.25 -0.15 0.00 -0.55 0.00 0.00 56.30 55.44 2kob h ASN 124 Cb 0.18 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 2kob h ASN 124 CO -0.00 1.01 -0.41 0.74 -1.65 0.00 0.00 177.43 177.12 2kob h THR 125 N 0.93 1.29 -0.04 2.81 2.02 -1.30 -2.06 112.91 116.56 2kob h THR 125 Ca 0.18 -1.59 0.02 0.00 0.77 0.00 0.00 66.41 65.79 2kob h THR 125 Cb 0.49 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.38 2kob h THR 125 CO 0.02 0.51 -0.11 -0.07 0.37 0.00 0.00 175.52 176.25 2kob h LEU 126 N 0.57 -0.32 -1.25 2.58 3.38 -0.68 -0.14 115.31 119.45 2kob h LEU 126 Ca 0.05 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 2kob h LEU 126 Cb 0.95 0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.84 2kob h LEU 126 CO 0.09 -0.15 -0.07 0.07 0.09 0.00 0.00 178.44 178.46 2kob h LYS 127 N -0.17 0.00 -0.30 1.13 2.10 -1.49 -2.45 116.57 115.40 2kob h LYS 127 Ca 0.05 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.60 2kob h LYS 127 Cb 0.24 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.56 2kob h LYS 127 CO -0.13 0.07 -0.22 0.00 -2.00 0.00 0.00 179.45 177.17 2kob h ALA 128 N 1.93 0.43 0.00 0.07 0.00 -0.54 0.26 119.26 121.42 2kob h ALA 128 Ca -0.00 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 2kob h ALA 128 Cb 0.62 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2kob h ALA 128 CO 0.01 0.39 -0.29 0.82 0.00 0.00 0.00 179.25 180.18 2kob h ILE 129 N 0.43 1.15 0.01 0.00 2.04 -0.75 -0.43 117.51 119.96 2kob h ILE 129 Ca 0.06 -1.00 -0.18 0.00 1.00 0.00 0.00 64.86 64.74 2kob h ILE 129 Cb 0.77 1.55 0.01 0.00 -0.74 0.00 0.00 36.82 38.41 2kob h ILE 129 CO 0.06 0.28 -0.71 0.03 0.00 0.00 0.00 178.15 177.81 2kob h ARG 130 N 0.00 0.47 -0.09 2.37 2.47 -1.25 -2.64 114.38 115.72 2kob h ARG 130 Ca -0.00 -0.52 0.03 0.00 -1.26 0.00 0.00 59.98 58.23 2kob h ARG 130 Cb 0.52 0.15 -0.04 0.00 -1.65 0.00 0.00 29.97 28.96 2kob h ARG 130 CO 0.04 1.16 -0.12 -0.97 0.56 0.00 0.00 179.97 180.64 2kob h ASN 131 N -0.01 -0.37 -0.37 7.04 -0.73 -0.12 0.29 115.58 121.32 2kob h ASN 131 Ca -0.09 0.07 0.06 0.00 1.87 0.00 0.00 56.30 58.21 2kob h ASN 131 Cb 1.42 0.17 -0.05 0.00 0.27 0.00 0.00 38.32 40.13 2kob h ASN 131 CO 0.14 -0.16 0.04 0.74 -0.37 0.00 0.00 177.43 177.81 2kob h THR 132 N -0.16 0.77 -0.75 -3.57 2.02 -1.18 -0.20 112.91 109.83 2kob h THR 132 Ca 0.07 -0.05 -0.04 0.00 0.77 0.00 0.00 66.41 67.16 2kob h THR 132 Cb 0.27 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 67.25 2kob h THR 132 CO -0.18 0.03 0.29 0.00 0.37 0.00 0.00 175.52 176.03 2kob h ALA 133 N 1.30 1.10 -0.65 6.16 0.00 -1.06 -2.47 119.26 123.64 2kob h ALA 133 Ca 0.18 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2kob h ALA 133 Cb 0.23 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2kob h ALA 133 CO -0.27 0.64 0.18 1.03 0.00 0.00 0.00 179.25 180.83 2kob h SER 134 N 1.09 0.94 -0.73 0.00 0.87 0.37 -1.42 113.55 114.68 2kob h SER 134 Ca 0.25 -0.18 -0.01 0.00 -1.23 0.00 0.00 61.79 60.62 2kob h SER 134 Cb 0.21 -0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 61.89 2kob h SER 134 CO -0.02 0.90 0.42 1.56 -0.53 0.00 0.00 176.83 179.16 2kob h GLN 135 N 0.97 1.01 -0.24 2.24 1.08 -0.64 0.20 115.11 119.72 2kob h GLN 135 Ca 0.21 -0.10 -0.02 0.00 -1.45 0.00 0.00 58.65 57.29 2kob h GLN 135 Cb 0.31 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.52 2kob h GLN 135 CO -0.00 0.72 0.06 0.82 -0.95 0.00 0.00 178.83 179.48 2kob h ILE 136 N 1.02 1.21 -0.73 2.54 2.04 -0.93 0.10 117.51 122.76 2kob h ILE 136 Ca 0.26 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.43 2kob h ILE 136 Cb -0.01 1.20 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 2kob h ILE 136 CO -0.05 0.22 0.43 -0.26 0.00 0.00 0.00 178.15 178.50 2kob h PHE 137 N 0.22 0.97 -0.37 1.37 0.04 -0.81 -2.24 116.94 116.12 2kob h PHE 137 Ca 0.08 -0.01 0.03 0.00 2.80 0.00 0.00 57.97 60.87 2kob h PHE 137 Cb 0.28 -0.32 -0.03 0.00 2.20 0.00 0.00 35.95 38.08 2kob h PHE 137 CO 0.01 0.66 0.17 0.00 -0.60 0.00 0.00 178.31 178.55 2kob h ARG 138 N 1.00 0.34 -0.83 1.51 3.08 -0.37 0.72 114.38 119.84 2kob h ARG 138 Ca 0.26 -0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.38 2kob h ARG 138 Cb -0.02 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 29.89 2kob h ARG 138 CO -0.05 0.23 0.54 1.25 -1.07 0.00 0.00 179.97 180.87 2kob h LEU 139 N 0.35 0.74 -0.31 3.04 5.85 -0.64 0.25 115.31 124.60 2kob h LEU 139 Ca 0.16 0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.79 2kob h LEU 139 Cb 0.08 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 2kob h LEU 139 CO -0.12 0.45 -0.20 0.00 -0.34 0.00 0.00 178.44 178.23 2kob h ALA 140 N 1.57 0.44 -0.90 1.25 0.00 -0.75 -2.89 119.26 117.98 2kob h ALA 140 Ca 0.38 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2kob h ALA 140 Cb 0.36 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 2kob h ALA 140 CO -0.15 0.38 0.58 0.82 0.00 0.00 0.00 179.25 180.89 2kob h ILE 141 N 0.43 1.24 -0.24 0.00 2.04 0.53 0.26 117.51 121.78 2kob h ILE 141 Ca 0.06 -0.46 -0.02 0.00 1.00 0.00 0.00 64.86 65.44 2kob h ILE 141 Cb 0.75 -0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 2kob h ILE 141 CO 0.06 0.24 0.08 -0.33 0.00 0.00 0.00 178.15 178.19 2kob h GLU 142 N 1.23 0.33 -0.39 2.37 5.08 -0.46 0.41 114.58 123.15 2kob h GLU 142 Ca 0.33 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 2kob h GLU 142 Cb -0.11 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.07 2kob h GLU 142 CO -0.07 0.29 0.00 0.09 -1.00 0.00 0.00 179.01 178.33 2kob n ASN 143 N -4.42 2.81 -2.48 1.42 3.02 -0.81 -4.93 115.26 109.87 2kob n ASN 143 Ca 0.00 -1.92 -0.21 0.00 -0.03 0.00 0.00 54.58 52.42 2kob n ASN 143 Cb 0.14 -0.25 -0.00 0.00 -0.61 0.00 0.00 39.78 39.05 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 1.05 -2.11 0.00 3.52 1.74 0.13 -4.85 116.66 116.14 2kob n ARG 144 Ca 0.18 1.00 0.13 0.00 -0.77 0.00 0.00 57.85 58.39 2kob n ARG 144 Cb 0.48 -5.69 0.43 0.00 -1.02 0.00 0.00 32.46 26.67 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 -2.23 2.98 -3.52 7.54 0.00 0.81 -4.85 120.51 121.25 2kob n ALA 145 Ca -0.23 -0.24 -0.18 0.00 0.00 0.00 0.00 53.44 52.79 2kob n ALA 145 Cb 0.68 -1.28 -0.06 0.00 0.00 0.00 0.00 19.45 18.79 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 -2.94 0.00 -0.15 0.00 2.07 -1.23 -4.70 121.20 114.24 2kob s ILE 146 Ca 0.14 0.00 0.18 0.00 -1.41 0.00 0.00 60.65 59.56 2kob s ILE 146 Cb 0.18 -1.00 0.37 0.00 0.13 0.00 0.00 42.46 42.15 2kob s ILE 146 CO 0.61 0.00 1.25 -0.67 -1.91 0.00 0.00 174.94 174.21 2kob n ASP 147 N 0.86 2.90 -3.80 4.50 2.03 -1.26 -4.03 116.55 117.75 2kob n ASP 147 Ca -0.19 -3.05 -0.13 0.00 0.52 0.00 0.00 54.79 51.94 2kob n ASP 147 Cb 0.57 -0.47 -0.14 0.00 -0.72 0.00 0.00 41.12 40.36 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 -2.83 -0.08 -0.45 -0.67 5.36 -1.26 -5.11 117.98 112.95 2kob s PHE 148 Ca 0.35 0.27 0.01 0.00 -0.96 0.00 0.00 56.93 56.60 2kob s PHE 148 Cb 0.30 -0.08 0.12 0.00 -0.34 0.00 0.00 43.02 43.02 2kob s PHE 148 CO 0.05 -0.09 0.20 1.21 -1.46 0.00 0.00 175.22 175.13 2kob s ASN 149 N 0.67 4.84 0.40 6.13 3.84 -1.26 -4.96 114.94 124.59 2kob s ASN 149 Ca -0.05 -2.46 0.09 0.00 0.21 0.00 0.00 52.86 50.65 2kob s ASN 149 Cb -0.07 -1.72 0.81 0.00 -0.55 0.00 0.00 41.25 39.73 2kob s ASN 149 CO -0.03 -0.38 1.94 -0.65 -2.79 0.00 0.00 177.10 175.20 2kob h PRO 150 N 7.34 0.27 0.00 0.43 0.11 -1.95 -2.39 132.00 135.81 2kob h PRO 150 Ca -0.07 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.99 2kob h PRO 150 Cb 0.98 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.05 2kob h PRO 150 CO 0.64 0.36 -0.01 0.00 -0.21 0.00 0.00 178.00 178.78 2kob h ALA 151 N 1.67 1.00 0.00 -0.75 0.00 -1.94 -2.66 119.26 116.58 2kob h ALA 151 Ca 0.06 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 2kob h ALA 151 Cb 0.30 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2kob h ALA 151 CO 0.01 0.01 -0.24 0.22 0.00 0.00 0.00 179.25 179.25 2kob h ASP 152 N 0.00 0.00 0.23 0.00 3.58 -1.82 -2.68 116.42 115.73 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 0.60 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.65 2kob h ASP 152 CO 0.00 0.24 -0.49 -1.22 -2.88 0.00 0.00 179.24 174.89 2kob n TYR 153 N -3.60 0.00 -2.46 0.28 4.01 -1.00 -4.89 117.16 109.50 2kob n TYR 153 Ca -0.01 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.30 2kob n TYR 153 Cb 0.38 -0.12 -0.02 0.00 -0.31 0.00 0.00 39.34 39.27 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 -2.73 4.27 0.31 -0.72 1.01 -1.01 -5.00 120.40 116.52 2kob s VAL 154 Ca 0.17 1.48 -0.26 0.00 0.00 0.00 0.00 61.98 63.37 2kob s VAL 154 Cb 0.18 -4.14 -0.10 0.00 0.00 0.00 0.00 36.38 32.33 2kob s VAL 154 CO 0.64 -0.33 0.93 0.00 0.00 0.00 0.00 175.10 176.34 2kob s ARG 155 N 3.81 4.58 -0.11 2.72 1.70 -1.26 -5.06 118.95 125.33 2kob s ARG 155 Ca 0.54 1.31 0.02 0.00 -0.47 0.00 0.00 55.73 57.12 2kob s ARG 155 Cb -0.18 -2.84 -0.01 0.00 -0.57 0.00 0.00 34.95 31.35 2kob s ARG 155 CO 0.18 0.31 -0.16 0.42 -1.08 0.00 0.00 175.30 174.97 2kob s ILE 156 N -1.58 2.81 0.09 4.99 -1.09 -1.26 -5.04 121.20 120.13 2kob s ILE 156 Ca 0.49 -0.76 -0.31 0.00 -2.23 0.00 0.00 60.65 57.84 2kob s ILE 156 Cb -0.19 -2.14 -0.07 0.00 -1.58 0.00 0.00 42.46 38.48 2kob s ILE 156 CO 0.24 0.54 1.31 -2.16 -1.23 0.00 0.00 174.94 173.65 2kob s PRO 157 N 0.15 4.37 0.00 2.79 0.04 -1.26 -4.88 135.00 136.20 2kob s PRO 157 Ca -0.08 1.95 0.07 0.00 0.04 0.00 0.00 61.00 62.97 2kob s PRO 157 Cb -0.15 -3.29 0.11 0.00 0.04 0.00 0.00 34.50 31.21 2kob s PRO 157 CO 0.05 -0.36 0.92 0.36 0.04 0.00 0.00 177.00 178.01 2kob n LYS 158 N 3.92 0.00 -2.87 4.56 2.85 -1.26 -4.82 118.16 120.55 2kob n LYS 158 Ca 0.10 -1.00 -0.42 0.00 -1.05 0.00 0.00 58.31 55.94 2kob n LYS 158 Cb 0.44 0.01 -0.04 0.00 -0.65 0.00 0.00 35.03 34.79 2kob n LYS 158 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 2kob s ILE 159 N 0.00 4.84 0.05 0.58 1.01 -1.26 -5.04 121.20 121.39 2kob s ILE 159 Ca 0.09 1.65 0.04 0.00 0.00 0.00 0.00 60.65 62.43 2kob s ILE 159 Cb 0.10 -4.15 -0.02 0.00 0.01 0.00 0.00 42.46 38.40 2kob s ILE 159 CO -0.04 -0.03 -0.12 0.00 0.00 0.00 0.00 174.94 174.75 2kob s ALA 160 N 2.49 0.97 -2.00 9.38 0.00 -1.26 -5.01 121.76 126.32 2kob s ALA 160 Ca 0.38 -0.85 0.21 0.00 0.00 0.00 0.00 51.96 51.70 2kob s ALA 160 Cb -0.16 -0.08 0.50 0.00 0.00 0.00 0.00 23.12 23.37 2kob s ALA 160 CO 0.10 0.13 1.42 1.28 0.00 0.00 0.00 175.76 178.69 2kob n LEU 161 N 1.59 3.57 -5.00 0.00 4.77 -1.26 -4.90 117.00 115.77 2kob n LEU 161 Ca -0.20 -1.77 -0.23 0.00 -0.03 0.00 0.00 56.01 53.77 2kob n LEU 161 Cb 0.55 -0.35 0.12 0.00 -2.33 0.00 0.00 43.42 41.41 2kob n LEU 161 CO 0.22 0.84 0.56 -1.61 -1.33 0.00 0.00 177.39 176.07 2kob s GLU 162 N -1.18 1.58 -0.77 3.23 8.01 -1.26 -4.98 118.70 123.33 2kob s GLU 162 Ca 0.40 -1.30 -0.25 0.00 0.01 0.00 0.00 54.97 53.83 2kob s GLU 162 Cb 0.22 -2.35 -0.06 0.00 -4.31 0.00 0.00 34.13 27.63 2kob s GLU 162 CO 0.30 -1.52 2.05 -3.38 0.01 0.00 0.00 175.26 172.72 2kob s HIS 163 N -3.14 1.58 -2.76 1.61 -3.43 -1.26 -4.73 115.29 103.16 2kob s HIS 163 Ca 0.68 1.00 0.24 0.00 -0.80 0.00 0.00 55.06 56.18 2kob s HIS 163 Cb -0.04 -3.90 0.25 0.00 -1.43 0.00 0.00 32.58 27.46 2kob s HIS 163 CO 0.45 -1.93 1.29 1.58 -2.00 0.00 0.00 174.74 174.13 2kob n HIS 164 N 14.71 0.00 -2.55 0.38 -0.00 -1.26 -4.91 115.22 121.59 2kob n HIS 164 Ca 0.36 0.00 -0.28 0.00 0.46 0.00 0.00 57.72 58.26 2kob n HIS 164 Cb 0.48 -0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.35 2kob n HIS 164 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2kob s HIS 165 N -2.09 3.56 0.20 1.57 3.76 -1.26 -5.10 115.29 115.92 2kob s HIS 165 Ca 0.27 0.85 -0.01 0.00 -0.15 0.00 0.00 55.06 56.03 2kob s HIS 165 Cb 0.20 -2.36 -0.04 0.00 1.11 0.00 0.00 32.58 31.49 2kob s HIS 165 CO 0.36 -0.34 0.13 -3.38 -0.85 0.00 0.00 174.74 170.66 2kob s HIS 166 N -2.79 1.16 0.44 1.40 -3.43 -1.26 -5.15 115.29 105.66 2kob s HIS 166 Ca 0.48 -1.37 -0.21 0.00 -0.80 0.00 0.00 55.06 53.16 2kob s HIS 166 Cb -0.10 -0.56 -0.10 0.00 -1.43 0.00 0.00 32.58 30.38 2kob s HIS 166 CO 0.46 -0.63 0.99 -1.01 -2.00 0.00 0.00 174.74 172.54 2kob s HIS 167 N -4.15 3.22 0.00 0.38 3.76 -1.26 -5.31 115.29 111.93 2kob s HIS 167 Ca 0.39 1.61 0.00 0.00 -0.15 0.00 0.00 55.06 56.91 2kob s HIS 167 Cb 0.07 -2.94 0.00 0.00 1.11 0.00 0.00 32.58 30.82 2kob s HIS 167 CO 0.12 -0.37 0.42 0.72 -0.85 0.00 0.00 174.74 174.78