#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 -0.45 -4.60 0.55 8.00 -1.26 -4.69 116.55 114.10 2kob n ASP 62 Ca 0.00 -1.24 -0.23 0.00 0.71 0.00 0.00 54.79 54.03 2kob n ASP 62 Cb 0.00 -0.72 -0.08 0.00 -0.02 0.00 0.00 41.12 40.30 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 -4.20 4.31 0.41 -2.24 0.01 -1.26 -0.50 113.70 110.22 2kob s SER 63 Ca 0.52 -0.73 0.09 0.00 1.31 0.00 0.00 55.95 57.14 2kob s SER 63 Cb -0.02 -0.71 0.88 0.00 0.21 0.00 0.00 66.02 66.38 2kob s SER 63 CO 0.38 0.02 2.02 0.15 0.41 0.00 0.00 173.24 176.21 2kob h PHE 64 N 2.03 0.54 -0.83 2.43 3.57 -1.11 -1.76 116.94 121.82 2kob h PHE 64 Ca -0.43 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.06 2kob h PHE 64 Cb 1.25 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 39.77 2kob h PHE 64 CO 0.71 0.31 0.45 0.78 -2.23 0.00 0.00 178.31 178.33 2kob h GLY 65 N 0.56 1.25 0.95 2.40 0.00 -1.35 0.44 103.07 107.31 2kob h GLY 65 Ca 0.22 -0.57 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 2kob h GLY 65 CO -0.06 0.55 -0.10 -1.80 0.00 0.00 0.00 176.54 175.13 2kob h ASP 66 N 1.16 -0.24 -0.14 0.19 3.58 -1.57 -1.47 116.42 117.93 2kob h ASP 66 Ca 0.29 -0.04 -0.07 0.00 0.42 0.00 0.00 57.03 57.64 2kob h ASP 66 Cb 0.04 0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.14 2kob h ASP 66 CO -0.05 -0.12 -0.12 -0.50 -2.88 0.00 0.00 179.24 175.58 2kob h TRP 67 N -0.33 0.53 0.08 0.28 4.06 -1.25 0.84 115.95 120.16 2kob h TRP 67 Ca -0.03 -0.08 -0.00 0.00 2.06 0.00 0.00 58.89 60.84 2kob h TRP 67 Cb 0.26 -0.14 0.00 0.00 -1.00 0.00 0.00 29.16 28.27 2kob h TRP 67 CO -0.05 0.60 -0.04 0.00 -3.56 0.00 0.00 178.44 175.40 2kob h ALA 68 N 1.42 -0.11 -0.17 1.49 0.00 0.07 0.32 119.26 122.28 2kob h ALA 68 Ca 0.09 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 2kob h ALA 68 Cb 0.49 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2kob h ALA 68 CO 0.03 -0.51 -0.45 1.49 0.00 0.00 0.00 179.25 179.81 2kob h GLU 69 N -0.20 0.41 -0.64 0.00 4.81 -1.10 0.12 114.58 117.98 2kob h GLU 69 Ca -0.01 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 58.98 2kob h GLU 69 Cb 0.17 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 2kob h GLU 69 CO 0.02 0.78 0.34 -0.22 -0.73 0.00 0.00 179.01 179.21 2kob h LYS 70 N 0.34 0.89 -0.36 1.92 3.64 -0.64 0.18 116.57 122.55 2kob h LYS 70 Ca 0.02 -0.11 -0.03 0.00 -1.27 0.00 0.00 60.65 59.26 2kob h LYS 70 Cb 0.93 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 2kob h LYS 70 CO 0.08 0.68 0.10 0.35 -2.27 0.00 0.00 179.45 178.39 2kob h PHE 71 N 0.87 0.59 -0.70 1.91 3.57 -0.01 -0.61 116.94 122.56 2kob h PHE 71 Ca 0.22 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 2kob h PHE 71 Cb 0.05 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.59 2kob h PHE 71 CO -0.01 0.58 0.39 -0.07 -2.23 0.00 0.00 178.31 176.97 2kob h LEU 72 N 0.43 0.86 -0.49 0.59 3.38 -0.64 -1.71 115.31 117.73 2kob h LEU 72 Ca 0.11 -0.09 -0.15 0.00 0.09 0.00 0.00 57.88 57.84 2kob h LEU 72 Cb 0.28 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2kob h LEU 72 CO -0.00 0.70 -0.43 0.50 0.09 0.00 0.00 178.44 179.31 2kob h LYS 73 N 0.96 0.77 -0.09 1.13 1.63 -0.49 0.37 116.57 120.85 2kob h LYS 73 Ca 0.25 -0.42 -0.12 0.00 -0.85 0.00 0.00 60.65 59.51 2kob h LYS 73 Cb 0.02 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.66 2kob h LYS 73 CO -0.04 1.05 -0.48 0.66 -3.45 0.00 0.00 179.45 177.18 2kob h SER 74 N 0.62 0.24 0.05 4.20 4.64 -0.95 0.03 113.55 122.38 2kob h SER 74 Ca 0.04 -0.11 -0.20 0.00 -0.47 0.00 0.00 61.79 61.05 2kob h SER 74 Cb 0.99 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 2kob h SER 74 CO 0.09 0.69 -0.72 0.11 -0.87 0.00 0.00 176.83 176.13 2kob h LYS 75 N 0.18 0.60 -0.35 4.77 1.79 -1.11 0.55 116.57 123.01 2kob h LYS 75 Ca 0.01 -0.47 -0.01 0.00 -2.18 0.00 0.00 60.65 58.00 2kob h LYS 75 Cb 0.92 0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 31.65 2kob h LYS 75 CO 0.07 1.09 0.18 1.49 -1.08 0.00 0.00 179.45 181.21 2kob h GLU 76 N 0.42 0.49 -0.12 3.15 4.81 -0.58 -1.04 114.58 121.71 2kob h GLU 76 Ca -0.03 -0.06 -0.13 0.00 -0.13 0.00 0.00 59.36 59.00 2kob h GLU 76 Cb 1.31 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 2kob h GLU 76 CO 0.14 0.42 -0.51 0.00 -0.73 0.00 0.00 179.01 178.33 2kob h ALA 77 N 1.04 0.92 -0.37 2.92 0.00 -1.01 -3.10 119.26 119.67 2kob h ALA 77 Ca 0.12 -0.48 0.03 0.00 0.00 0.00 0.00 54.91 54.58 2kob h ALA 77 Cb 0.08 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2kob h ALA 77 CO -0.02 0.67 0.18 0.22 0.00 0.00 0.00 179.25 180.29 2kob h ASP 78 N 0.25 0.25 0.00 0.00 3.58 -0.48 -3.47 116.42 116.54 2kob h ASP 78 Ca 0.01 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.48 2kob h ASP 78 Cb 0.98 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 42.01 2kob h ASP 78 CO 0.08 0.18 0.00 0.61 -2.88 0.00 0.00 179.24 177.24 2kob n GLY 79 N -1.21 0.99 3.83 -0.78 0.00 -0.43 -5.08 105.19 102.51 2kob n GLY 79 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.79 4.28 0.63 1.61 -7.23 -1.08 -5.02 120.40 111.80 2kob s VAL 80 Ca 0.00 0.89 -0.18 0.00 -1.81 0.00 0.00 61.98 60.88 2kob s VAL 80 Cb 0.00 -3.60 -0.02 0.00 0.56 0.00 0.00 36.38 33.33 2kob s VAL 80 CO 0.00 -0.82 1.26 -0.44 -0.31 0.00 0.00 175.10 174.79 2kob s SER 81 N -3.50 4.77 0.21 4.85 0.01 -1.26 -4.83 113.70 113.95 2kob s SER 81 Ca 0.59 2.53 -0.10 0.00 1.31 0.00 0.00 55.95 60.28 2kob s SER 81 Cb -0.13 -2.61 0.19 0.00 0.21 0.00 0.00 66.02 63.69 2kob s SER 81 CO 0.45 -1.89 1.86 0.58 0.41 0.00 0.00 173.24 174.65 2kob h VAL 82 N 0.60 1.13 -0.93 3.43 2.07 -1.99 -1.37 116.25 119.19 2kob h VAL 82 Ca -0.51 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 66.72 2kob h VAL 82 Cb 1.32 0.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 2kob h VAL 82 CO 0.54 0.17 0.62 0.28 0.02 0.00 0.00 177.57 179.19 2kob h SER 83 N 0.93 1.04 -0.40 0.57 0.02 -1.98 0.45 113.55 114.19 2kob h SER 83 Ca 0.29 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.20 2kob h SER 83 Cb -0.01 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.26 2kob h SER 83 CO -0.10 0.74 0.15 -0.61 -1.14 0.00 0.00 176.83 175.88 2kob h GLN 84 N 1.22 0.60 -0.31 3.45 5.75 -1.66 -1.21 115.11 122.94 2kob h GLN 84 Ca 0.35 -0.11 -0.11 0.00 -0.15 0.00 0.00 58.65 58.63 2kob h GLN 84 Cb -0.08 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.36 2kob h GLN 84 CO -0.09 0.57 -0.26 1.25 -2.65 0.00 0.00 178.83 177.64 2kob h LEU 85 N 0.50 0.64 -0.27 -2.39 5.85 -0.49 -2.23 115.31 116.92 2kob h LEU 85 Ca 0.13 -0.24 -0.00 0.00 0.84 0.00 0.00 57.88 58.62 2kob h LEU 85 Cb 0.20 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2kob h LEU 85 CO -0.01 0.88 0.16 0.78 -0.34 0.00 0.00 178.44 179.92 2kob h ASN 86 N 0.55 0.32 -0.44 1.25 -0.26 0.15 0.07 115.58 117.22 2kob h ASN 86 Ca 0.07 -0.05 -0.04 0.00 -0.56 0.00 0.00 56.30 55.72 2kob h ASN 86 Cb 0.74 -0.08 -0.02 0.00 -1.06 0.00 0.00 38.32 37.89 2kob h ASN 86 CO 0.06 0.28 0.13 0.77 -1.06 0.00 0.00 177.43 177.61 2kob h SER 87 N 0.34 0.70 0.43 5.81 4.64 -1.07 0.41 113.55 124.81 2kob h SER 87 Ca 0.10 -0.11 -0.02 0.00 -0.47 0.00 0.00 61.79 61.28 2kob h SER 87 Cb 0.01 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 61.92 2kob h SER 87 CO -0.02 0.69 -0.22 1.88 -0.87 0.00 0.00 176.83 178.28 2kob h TYR 88 N 0.74 -0.58 -0.19 4.77 0.05 -1.01 -2.24 116.97 118.50 2kob h TYR 88 Ca 0.17 -0.01 -0.07 0.00 0.05 0.00 0.00 58.73 58.87 2kob h TYR 88 Cb 0.26 0.20 -0.01 0.00 1.01 0.00 0.00 36.73 38.18 2kob h TYR 88 CO 0.01 -0.36 -0.18 -0.22 -1.05 0.00 0.00 178.16 176.37 2kob h LYS 89 N -0.60 0.33 0.17 4.88 3.64 -0.58 -2.06 116.57 122.35 2kob h LYS 89 Ca -0.06 -0.10 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 2kob h LYS 89 Cb 0.47 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2kob h LYS 89 CO 0.08 0.51 -0.08 -0.97 -2.27 0.00 0.00 179.45 176.71 2kob h ASN 90 N 0.31 -0.20 -0.92 4.20 -0.73 -0.10 0.12 115.58 118.27 2kob h ASN 90 Ca 0.06 -0.17 -0.01 0.00 1.87 0.00 0.00 56.30 58.05 2kob h ASN 90 Cb 0.49 0.05 -0.04 0.00 0.27 0.00 0.00 38.32 39.09 2kob h ASN 90 CO 0.03 0.06 0.54 1.88 -0.37 0.00 0.00 177.43 179.57 2kob h TYR 91 N -0.45 1.22 -0.03 0.67 0.05 -1.26 -2.63 116.97 114.53 2kob h TYR 91 Ca -0.02 -0.01 -0.00 0.00 0.05 0.00 0.00 58.73 58.74 2kob h TYR 91 Cb 0.35 -0.40 -0.00 0.00 1.01 0.00 0.00 36.73 37.69 2kob h TYR 91 CO -0.00 0.82 0.01 0.00 -1.05 0.00 0.00 178.16 177.94 2kob n ARG 93 N -4.95 0.23 0.02 0.00 5.12 0.02 -2.41 116.66 114.70 2kob n ARG 93 Ca -0.07 0.11 -0.00 0.00 -1.93 0.00 0.00 57.85 55.96 2kob n ARG 93 Cb 0.14 -1.50 -0.00 0.00 -1.16 0.00 0.00 32.46 29.94 2kob n ARG 93 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2kob n ASN 94 N -1.33 0.62 0.11 0.55 3.02 -1.01 -4.72 115.26 112.50 2kob n ASN 94 Ca 0.08 0.08 0.11 0.00 -0.03 0.00 0.00 54.58 54.82 2kob n ASN 94 Cb 0.17 -0.21 0.01 0.00 -0.61 0.00 0.00 39.78 39.14 2kob n ASN 94 CO 0.00 0.00 0.00 0.45 -2.62 0.00 0.00 177.26 175.09 2kob h HIS 95 N -0.03 0.00 -0.52 3.10 3.86 -1.34 -3.30 115.15 116.93 2kob h HIS 95 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2kob h HIS 95 Cb 0.03 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.50 2kob h HIS 95 CO -0.01 0.05 0.00 1.28 0.86 0.00 0.00 177.93 180.11 2kob n LEU 96 N -2.74 3.54 -0.03 2.43 4.77 -0.87 -4.46 117.00 119.63 2kob n LEU 96 Ca -0.00 -1.63 -0.09 0.00 -0.03 0.00 0.00 56.01 54.25 2kob n LEU 96 Cb 0.57 -0.34 -0.03 0.00 -2.33 0.00 0.00 43.42 41.29 2kob n LEU 96 CO 0.40 0.82 0.88 0.28 -1.33 0.00 0.00 177.39 178.43 2kob h SER 97 N 4.26 -0.02 -1.00 -1.43 0.02 -1.55 0.93 113.55 114.75 2kob h SER 97 Ca 0.00 0.03 0.13 0.00 -0.84 0.00 0.00 61.79 61.12 2kob h SER 97 Cb 0.95 0.05 -0.09 0.00 0.14 0.00 0.00 62.40 63.45 2kob h SER 97 CO 0.00 0.01 0.63 1.55 -1.14 0.00 0.00 176.83 177.88 2kob h PRO 98 N 0.09 0.92 0.00 3.45 0.13 -1.86 -1.62 132.00 133.11 2kob h PRO 98 Ca 0.08 -0.06 -0.15 0.00 -0.87 0.00 0.00 66.00 65.01 2kob h PRO 98 Cb 0.09 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 30.99 2kob h PRO 98 CO -0.13 0.61 -0.73 -0.07 -0.23 0.00 0.00 178.00 177.45 2kob h LEU 99 N 0.95 0.00 -2.01 1.56 3.38 -1.72 -3.28 115.31 114.19 2kob h LEU 99 Ca 0.51 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.61 2kob h LEU 99 Cb 0.57 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 2kob h LEU 99 CO -0.29 0.73 0.30 0.22 0.09 0.00 0.00 178.44 179.49 2kob h TYR 100 N 0.00 0.00 -0.49 1.13 5.03 0.20 0.12 116.97 122.96 2kob h TYR 100 Ca -0.01 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.30 2kob h TYR 100 Cb 1.32 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.60 2kob h TYR 100 CO 0.00 0.00 0.00 -1.33 -1.32 0.00 0.00 178.16 175.51 2kob n MET 101 N -4.38 2.89 -3.64 1.82 2.81 -1.24 -1.27 117.12 114.11 2kob n MET 101 Ca 0.07 -2.34 -0.37 0.00 -1.81 0.00 0.00 57.70 53.25 2kob n MET 101 Cb 0.50 -1.43 -0.07 0.00 -0.71 0.00 0.00 33.22 31.51 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 -1.14 3.98 0.55 0.03 1.02 0.42 -4.97 119.74 119.64 2kob s LYS 102 Ca 0.34 0.06 -0.18 0.00 0.02 0.00 0.00 55.97 56.21 2kob s LYS 102 Cb 0.19 -3.33 -0.06 0.00 -0.52 0.00 0.00 37.83 34.11 2kob s LYS 102 CO 0.22 0.47 1.06 -1.12 -0.92 0.00 0.00 175.35 175.06 2kob s SER 103 N -0.21 5.93 0.39 2.83 0.01 -1.26 -0.79 113.70 120.61 2kob s SER 103 Ca 0.16 1.92 0.13 0.00 1.31 0.00 0.00 55.95 59.48 2kob s SER 103 Cb -0.13 -2.55 0.95 0.00 0.21 0.00 0.00 66.02 64.49 2kob s SER 103 CO 0.05 -1.06 1.88 -0.07 0.41 0.00 0.00 173.24 174.44 2kob h LEU 104 N 0.94 0.52 0.00 2.44 3.38 -1.07 0.25 115.31 121.78 2kob h LEU 104 Ca -0.48 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.52 2kob h LEU 104 Cb 1.23 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2kob h LEU 104 CO 0.58 0.25 0.00 -1.54 0.09 0.00 0.00 178.44 177.82 2kob n SER 105 N -4.53 0.00 -0.49 -0.43 3.41 -1.26 -2.82 113.62 107.49 2kob n SER 105 Ca 0.17 0.03 0.05 0.00 -0.26 0.00 0.00 58.87 58.86 2kob n SER 105 Cb 0.55 -0.34 0.10 0.00 -0.26 0.00 0.00 64.21 64.26 2kob n SER 105 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2kob n GLU 106 N -1.34 2.17 -3.05 4.33 4.71 0.84 -4.96 120.64 123.34 2kob n GLU 106 Ca 0.12 -1.71 -0.41 0.00 -0.01 0.00 0.00 57.16 55.15 2kob n GLU 106 Cb 0.26 -1.21 -0.06 0.00 -1.01 0.00 0.00 31.44 29.42 2kob n GLU 106 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2kob s ILE 107 N -0.94 4.88 -0.10 -3.67 1.01 -0.95 -4.84 121.20 116.58 2kob s ILE 107 Ca 0.17 0.95 -0.14 0.00 0.00 0.00 0.00 60.65 61.63 2kob s ILE 107 Cb 0.09 -4.06 -0.05 0.00 0.01 0.00 0.00 42.46 38.45 2kob s ILE 107 CO 0.13 -0.20 0.33 -0.76 0.00 0.00 0.00 174.94 174.44 2kob s LEU 108 N 2.75 4.34 0.41 2.97 1.43 -1.26 -4.98 118.68 124.33 2kob s LEU 108 Ca 0.28 0.68 0.08 0.00 -1.03 0.00 0.00 54.13 54.14 2kob s LEU 108 Cb -0.15 -2.44 0.87 0.00 0.03 0.00 0.00 46.19 44.51 2kob s LEU 108 CO 0.12 0.19 2.02 -0.65 0.23 0.00 0.00 176.35 178.27 2kob h PRO 109 N 5.87 0.55 0.00 1.29 0.11 -1.97 -0.71 132.00 137.14 2kob h PRO 109 Ca -0.46 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 2kob h PRO 109 Cb 1.19 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2kob h PRO 109 CO 0.69 0.36 -0.18 0.00 -0.21 0.00 0.00 178.00 178.66 2kob h ALA 110 N 1.71 1.04 -0.18 -0.75 0.00 -1.93 -1.64 119.26 117.50 2kob h ALA 110 Ca 0.21 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 2kob h ALA 110 Cb 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2kob h ALA 110 CO -0.05 0.23 -0.43 0.22 0.00 0.00 0.00 179.25 179.21 2kob h ASP 111 N 0.00 0.69 -0.48 0.00 3.58 -1.53 -0.52 116.42 118.16 2kob h ASP 111 Ca -0.00 -0.57 -0.13 0.00 0.42 0.00 0.00 57.03 56.75 2kob h ASP 111 Cb 0.67 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.51 2kob h ASP 111 CO 0.02 1.13 -0.19 0.40 -2.88 0.00 0.00 179.24 177.73 2kob h ILE 112 N 0.28 1.27 -0.29 2.25 2.04 -1.37 -2.26 117.51 119.43 2kob h ILE 112 Ca -0.00 -1.35 0.00 0.00 1.00 0.00 0.00 64.86 64.51 2kob h ILE 112 Cb 1.04 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 38.19 2kob h ILE 112 CO 0.09 0.47 0.19 -0.61 0.00 0.00 0.00 178.15 178.29 2kob h GLN 113 N 0.86 0.37 0.00 2.37 -0.00 -1.22 -2.08 115.11 115.42 2kob h GLN 113 Ca 0.12 -0.02 -0.05 0.00 -0.00 0.00 0.00 58.65 58.70 2kob h GLN 113 Cb 0.76 -0.08 -0.01 0.00 0.00 0.00 0.00 27.48 28.15 2kob h GLN 113 CO 0.06 0.25 -0.22 0.66 0.00 0.00 0.00 178.83 179.57 2kob h SER 114 N 0.38 0.00 -0.62 -0.69 4.64 -0.99 -1.48 113.55 114.79 2kob h SER 114 Ca 0.11 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.42 2kob h SER 114 Cb -0.04 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 2kob h SER 114 CO -0.03 0.22 0.36 0.40 -0.87 0.00 0.00 176.83 176.92 2kob h ILE 115 N 0.00 1.19 -0.27 0.95 2.04 -0.77 0.71 117.51 121.36 2kob h ILE 115 Ca -0.00 -0.45 -0.04 0.00 1.00 0.00 0.00 64.86 65.37 2kob h ILE 115 Cb 0.47 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 2kob h ILE 115 CO 0.03 0.20 0.00 0.40 0.00 0.00 0.00 178.15 178.78 2kob h ILE 116 N 0.85 1.16 0.00 -0.67 1.08 -0.86 -1.00 117.51 118.07 2kob h ILE 116 Ca 0.22 -0.64 -0.15 0.00 -0.39 0.00 0.00 64.86 63.90 2kob h ILE 116 Cb 0.01 0.96 -0.02 0.00 -3.07 0.00 0.00 36.82 34.69 2kob h ILE 116 CO -0.04 0.22 -0.71 -1.13 -0.69 0.00 0.00 178.15 175.79 2kob h ASN 117 N 0.39 0.00 0.55 1.72 -0.00 -0.80 -2.97 115.58 114.47 2kob h ASN 117 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.39 2kob h ASN 117 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.58 2kob h ASN 117 CO 0.01 0.71 -0.35 -1.84 -0.00 0.00 0.00 177.43 175.96 2kob n GLU 118 N -3.57 0.15 -2.68 6.67 -0.00 0.18 -4.74 120.64 116.64 2kob n GLU 118 Ca -0.00 -0.08 -0.43 0.00 -0.00 0.00 0.00 57.16 56.65 2kob n GLU 118 Cb 0.72 -1.50 -0.02 0.00 -0.00 0.00 0.00 31.44 30.64 2kob n GLU 118 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 2kob s THR 119 N -2.90 4.60 -0.45 3.84 2.01 -0.44 -4.91 115.64 117.39 2kob s THR 119 Ca 0.15 1.77 0.02 0.00 0.31 0.00 0.00 61.69 63.94 2kob s THR 119 Cb 0.18 -4.35 0.57 0.00 0.01 0.00 0.00 72.50 68.92 2kob s THR 119 CO 0.63 -0.35 1.88 0.29 -0.69 0.00 0.00 174.62 176.39 2kob n LYS 120 N 6.60 2.23 -2.20 4.92 5.02 -1.26 -4.92 118.16 128.54 2kob n LYS 120 Ca 0.11 -2.81 -0.11 0.00 -2.02 0.00 0.00 58.31 53.48 2kob n LYS 120 Cb 0.47 -2.10 0.04 0.00 -0.02 0.00 0.00 35.03 33.41 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 -0.95 0.00 -4.81 -0.35 4.32 -1.26 -5.10 117.00 108.85 2kob n LEU 121 Ca 0.55 -1.46 -0.30 0.00 -0.02 0.00 0.00 56.01 54.78 2kob n LEU 121 Cb 1.38 -0.23 0.09 0.00 -1.62 0.00 0.00 43.42 43.04 2kob n LEU 121 CO 0.60 -0.61 0.71 0.00 -1.22 0.00 0.00 177.39 176.87 2kob s ALA 122 N -2.41 2.28 0.22 -1.18 0.00 -1.26 -4.82 121.76 114.59 2kob s ALA 122 Ca 0.34 -0.19 -0.10 0.00 0.00 0.00 0.00 51.96 52.01 2kob s ALA 122 Cb -0.03 -3.11 0.18 0.00 0.00 0.00 0.00 23.12 20.16 2kob s ALA 122 CO 0.21 -1.70 1.89 -0.22 0.00 0.00 0.00 175.76 175.94 2kob h LYS 123 N -1.07 1.03 -0.34 0.00 3.64 -1.99 -0.69 116.57 117.15 2kob h LYS 123 Ca -0.47 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 58.81 2kob h LYS 123 Cb 1.27 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.83 2kob h LYS 123 CO 0.59 0.68 0.04 -2.95 -2.27 0.00 0.00 179.45 175.55 2kob h ASN 124 N 1.07 0.48 -0.01 4.20 -1.07 -1.97 -1.44 115.58 116.83 2kob h ASN 124 Ca 0.29 -0.08 -0.20 0.00 0.07 0.00 0.00 56.30 56.38 2kob h ASN 124 Cb -0.11 -0.12 0.00 0.00 -2.07 0.00 0.00 38.32 36.02 2kob h ASN 124 CO -0.07 0.52 -0.73 0.74 0.07 0.00 0.00 177.43 177.96 2kob h THR 125 N 0.50 1.31 -0.15 6.14 2.02 -1.70 -2.04 112.91 119.00 2kob h THR 125 Ca 0.11 -1.99 0.01 0.00 0.77 0.00 0.00 66.41 65.31 2kob h THR 125 Cb 0.26 1.98 -0.01 0.00 -1.74 0.00 0.00 68.15 68.64 2kob h THR 125 CO 0.00 0.62 0.05 -0.07 0.37 0.00 0.00 175.52 176.50 2kob h LEU 126 N 0.46 0.07 -0.76 2.58 3.38 -0.54 -2.28 115.31 118.22 2kob h LEU 126 Ca -0.04 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2kob h LEU 126 Cb 1.33 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.08 2kob h LEU 126 CO 0.14 0.06 -0.02 0.07 0.09 0.00 0.00 178.44 178.78 2kob h LYS 127 N 0.13 0.00 -0.49 1.13 2.10 -1.31 -2.35 116.57 115.78 2kob h LYS 127 Ca 0.06 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.63 2kob h LYS 127 Cb 0.03 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.34 2kob h LYS 127 CO -0.06 0.02 -0.03 0.00 -2.00 0.00 0.00 179.45 177.38 2kob h ALA 128 N 1.98 0.66 -0.68 0.07 0.00 -0.85 0.20 119.26 120.64 2kob h ALA 128 Ca -0.00 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 2kob h ALA 128 Cb 0.76 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2kob h ALA 128 CO 0.00 0.50 0.14 0.82 0.00 0.00 0.00 179.25 180.71 2kob h ILE 129 N 0.74 1.26 -0.60 0.00 2.04 -1.15 0.86 117.51 120.67 2kob h ILE 129 Ca 0.13 -1.00 0.08 0.00 1.00 0.00 0.00 64.86 65.07 2kob h ILE 129 Cb 0.56 0.60 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 2kob h ILE 129 CO 0.03 0.38 0.26 -0.09 0.00 0.00 0.00 178.15 178.73 2kob h ARG 130 N 1.04 0.46 -0.17 2.37 9.65 -1.14 0.09 114.38 126.68 2kob h ARG 130 Ca 0.21 -0.03 -0.03 0.00 -1.10 0.00 0.00 59.98 59.03 2kob h ARG 130 Cb 0.40 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.87 2kob h ARG 130 CO 0.01 0.30 -0.02 -0.91 2.80 0.00 0.00 179.97 182.15 2kob h ASN 131 N 0.47 0.31 0.19 -3.80 2.35 -0.14 -2.21 115.58 112.75 2kob h ASN 131 Ca 0.29 -0.34 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 2kob h ASN 131 Cb 0.30 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 2kob h ASN 131 CO -0.25 0.58 -0.18 0.74 -1.65 0.00 0.00 177.43 176.67 2kob h THR 132 N 0.04 0.61 -0.60 2.81 2.02 -0.52 -1.99 112.91 115.28 2kob h THR 132 Ca 0.05 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.22 2kob h THR 132 Cb 0.43 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 67.42 2kob h THR 132 CO 0.01 0.00 0.36 0.00 0.37 0.00 0.00 175.52 176.26 2kob h ALA 133 N 0.38 1.50 -0.00 6.16 0.00 -1.04 -2.50 119.26 123.76 2kob h ALA 133 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2kob h ALA 133 Cb 0.37 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2kob h ALA 133 CO -0.04 0.43 0.00 1.03 0.00 0.00 0.00 179.25 180.68 2kob h SER 134 N 0.83 0.00 -0.75 0.00 0.87 -0.97 -1.55 113.55 111.98 2kob h SER 134 Ca 0.22 -0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.78 2kob h SER 134 Cb -0.03 -0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 61.89 2kob h SER 134 CO -0.04 0.02 0.50 1.56 -0.53 0.00 0.00 176.83 178.33 2kob h GLN 135 N -0.01 0.94 -0.19 2.24 4.20 -0.95 0.68 115.11 122.02 2kob h GLN 135 Ca 0.00 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.63 2kob h GLN 135 Cb 0.02 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.57 2kob h GLN 135 CO -0.00 0.62 0.05 0.82 -0.67 0.00 0.00 178.83 179.65 2kob h ILE 136 N 0.97 1.20 -0.32 2.54 2.04 -1.14 -2.20 117.51 120.61 2kob h ILE 136 Ca 0.29 -0.65 -0.08 0.00 1.00 0.00 0.00 64.86 65.41 2kob h ILE 136 Cb -0.04 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 2kob h ILE 136 CO -0.07 0.20 -0.14 -0.26 0.00 0.00 0.00 178.15 177.89 2kob h PHE 137 N 0.12 0.60 -0.79 1.37 0.04 -0.61 -2.55 116.94 115.14 2kob h PHE 137 Ca 0.06 -0.10 -0.02 0.00 2.80 0.00 0.00 57.97 60.71 2kob h PHE 137 Cb 0.27 -0.16 -0.04 0.00 2.20 0.00 0.00 35.95 38.22 2kob h PHE 137 CO 0.01 0.67 0.40 0.00 -0.60 0.00 0.00 178.31 178.79 2kob h ARG 138 N 0.51 1.11 -0.67 1.51 3.08 -0.73 -0.82 114.38 118.37 2kob h ARG 138 Ca 0.09 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 2kob h ARG 138 Cb 0.53 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 2kob h ARG 138 CO 0.03 0.84 0.41 1.25 -1.07 0.00 0.00 179.97 181.43 2kob h LEU 139 N 1.11 0.79 -0.54 3.04 5.85 -0.98 0.20 115.31 124.78 2kob h LEU 139 Ca 0.27 -0.04 -0.15 0.00 0.84 0.00 0.00 57.88 58.81 2kob h LEU 139 Cb 0.07 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 2kob h LEU 139 CO -0.04 0.60 -0.39 0.00 -0.34 0.00 0.00 178.44 178.27 2kob h ALA 140 N 1.53 0.72 -0.44 1.25 0.00 -1.13 -2.06 119.26 119.14 2kob h ALA 140 Ca 0.24 -0.45 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 2kob h ALA 140 Cb -0.05 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2kob h ALA 140 CO -0.05 0.66 0.18 0.82 0.00 0.00 0.00 179.25 180.86 2kob h ILE 141 N 0.61 1.20 0.00 0.00 2.04 -0.14 0.22 117.51 121.44 2kob h ILE 141 Ca 0.05 -0.63 -0.02 0.00 1.00 0.00 0.00 64.86 65.26 2kob h ILE 141 Cb 0.94 0.79 -0.00 0.00 -0.74 0.00 0.00 36.82 37.80 2kob h ILE 141 CO 0.09 0.23 -0.09 -0.33 0.00 0.00 0.00 178.15 178.05 2kob h GLU 142 N 0.58 0.00 -0.68 2.37 5.08 -0.50 -0.19 114.58 121.23 2kob h GLU 142 Ca 0.15 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.45 2kob h GLU 142 Cb 0.20 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 2kob h GLU 142 CO -0.01 0.09 0.07 0.09 -1.00 0.00 0.00 179.01 178.24 2kob n ASN 143 N -4.15 4.96 -4.16 1.42 3.02 -0.79 -4.92 115.26 110.65 2kob n ASN 143 Ca -0.03 -2.88 -0.36 0.00 -0.03 0.00 0.00 54.58 51.28 2kob n ASN 143 Cb 0.17 -0.68 -0.07 0.00 -0.61 0.00 0.00 39.78 38.59 2kob n ASN 143 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 2kob n ARG 144 N 0.37 -0.91 0.00 3.52 0.00 -0.08 -4.79 116.66 114.77 2kob n ARG 144 Ca 0.27 0.12 -0.12 0.00 -0.00 0.00 0.00 57.85 58.12 2kob n ARG 144 Cb 1.13 -4.35 -0.14 0.00 -0.00 0.00 0.00 32.46 29.11 2kob n ARG 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2kob h ALA 145 N 0.97 0.59 -2.84 2.89 0.00 -0.79 -3.47 119.26 116.61 2kob h ALA 145 Ca -0.51 -1.35 -0.15 0.00 0.00 0.00 0.00 54.91 52.91 2kob h ALA 145 Cb 1.25 0.44 -0.27 0.00 0.00 0.00 0.00 17.79 19.22 2kob h ALA 145 CO 0.76 1.43 -0.35 -1.50 0.00 0.00 0.00 179.25 179.59 2kob s ILE 146 N -2.60 -0.02 -0.31 0.00 2.07 -1.18 -4.92 121.20 114.25 2kob s ILE 146 Ca -0.08 0.07 0.11 0.00 -1.41 0.00 0.00 60.65 59.34 2kob s ILE 146 Cb 0.08 -0.50 0.71 0.00 0.13 0.00 0.00 42.46 42.87 2kob s ILE 146 CO 0.82 0.03 1.74 -0.67 -1.91 0.00 0.00 174.94 174.95 2kob n ASP 147 N 3.77 4.57 -3.97 4.50 2.03 -1.26 -3.44 116.55 122.75 2kob n ASP 147 Ca -0.20 -3.25 -0.20 0.00 0.52 0.00 0.00 54.79 51.66 2kob n ASP 147 Cb 0.55 -0.72 -0.16 0.00 -0.72 0.00 0.00 41.12 40.08 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 -3.00 0.92 -0.39 -0.67 5.36 -1.26 -5.11 117.98 113.83 2kob s PHE 148 Ca 0.53 -0.25 0.00 0.00 -0.96 0.00 0.00 56.93 56.25 2kob s PHE 148 Cb 0.43 -0.70 0.11 0.00 -0.34 0.00 0.00 43.02 42.51 2kob s PHE 148 CO 0.12 -0.15 0.15 1.21 -1.46 0.00 0.00 175.22 175.09 2kob s ASN 149 N 0.47 5.03 0.48 6.13 3.84 -1.26 -4.96 114.94 124.68 2kob s ASN 149 Ca -0.07 -2.13 0.23 0.00 0.21 0.00 0.00 52.86 51.10 2kob s ASN 149 Cb -0.11 -1.74 1.24 0.00 -0.55 0.00 0.00 41.25 40.09 2kob s ASN 149 CO 0.01 -0.46 2.00 -0.65 -2.79 0.00 0.00 177.10 175.21 2kob h PRO 150 N 7.81 0.00 0.00 0.43 0.11 -1.97 -2.58 132.00 135.80 2kob h PRO 150 Ca -0.09 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.01 2kob h PRO 150 Cb 1.03 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 2kob h PRO 150 CO 0.62 0.17 -0.04 0.00 -0.21 0.00 0.00 178.00 178.54 2kob h ALA 151 N 1.83 1.02 0.00 -0.75 0.00 -1.92 -2.60 119.26 116.83 2kob h ALA 151 Ca -0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2kob h ALA 151 Cb 0.42 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2kob h ALA 151 CO 0.02 0.05 -0.20 0.22 0.00 0.00 0.00 179.25 179.34 2kob h ASP 152 N 0.00 0.00 0.31 0.00 3.58 -1.86 -2.12 116.42 116.34 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 0.53 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.58 2kob h ASP 152 CO 0.01 0.20 -0.20 -1.22 -2.88 0.00 0.00 179.24 175.15 2kob n TYR 153 N -4.27 0.00 -2.56 0.28 4.02 -0.98 -4.77 117.16 108.88 2kob n TYR 153 Ca -0.02 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.44 2kob n TYR 153 Cb 0.26 -0.16 -0.02 0.00 -0.02 0.00 0.00 39.34 39.40 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 -2.52 4.05 -0.05 -0.72 1.01 -0.80 -4.98 120.40 116.39 2kob s VAL 154 Ca 0.25 0.99 -0.18 0.00 0.00 0.00 0.00 61.98 63.04 2kob s VAL 154 Cb 0.19 -4.65 -0.05 0.00 0.00 0.00 0.00 36.38 31.88 2kob s VAL 154 CO 0.51 -1.21 0.50 -0.13 0.00 0.00 0.00 175.10 174.78 2kob s ARG 155 N 4.85 4.25 -0.32 2.72 0.52 -1.26 -5.05 118.95 124.66 2kob s ARG 155 Ca 0.46 0.54 -0.19 0.00 -0.52 0.00 0.00 55.73 56.02 2kob s ARG 155 Cb -0.08 -3.36 -0.01 0.00 0.52 0.00 0.00 34.95 32.02 2kob s ARG 155 CO 0.28 0.34 0.57 0.42 0.02 0.00 0.00 175.30 176.93 2kob s ILE 156 N -0.01 4.98 0.84 1.52 -1.09 -1.26 -5.05 121.20 121.13 2kob s ILE 156 Ca 0.27 0.63 -0.11 0.00 -2.23 0.00 0.00 60.65 59.21 2kob s ILE 156 Cb -0.16 -3.97 0.10 0.00 -1.58 0.00 0.00 42.46 36.84 2kob s ILE 156 CO 0.13 -0.16 1.14 -2.16 -1.23 0.00 0.00 174.94 172.66 2kob s PRO 157 N 2.50 1.61 0.00 2.79 0.04 -1.26 -4.97 135.00 135.71 2kob s PRO 157 Ca 0.22 1.45 0.00 0.00 0.04 0.00 0.00 61.00 62.71 2kob s PRO 157 Cb -0.15 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.59 2kob s PRO 157 CO 0.12 -2.17 0.10 1.63 0.04 0.00 0.00 177.00 176.72 2kob n LYS 158 N -3.76 3.26 -4.93 4.56 4.01 -1.26 -4.97 118.16 115.07 2kob n LYS 158 Ca 0.11 -0.10 -0.27 0.00 -0.51 0.00 0.00 58.31 57.54 2kob n LYS 158 Cb 0.52 -0.49 -0.15 0.00 -0.51 0.00 0.00 35.03 34.40 2kob n LYS 158 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2kob s ILE 159 N -0.49 1.70 -0.12 -0.18 1.09 -1.26 -5.07 121.20 116.86 2kob s ILE 159 Ca 0.00 -1.01 -0.30 0.00 -1.10 0.00 0.00 60.65 58.24 2kob s ILE 159 Cb 0.00 -1.43 -0.08 0.00 -1.06 0.00 0.00 42.46 39.89 2kob s ILE 159 CO 0.00 0.40 2.09 0.00 -0.10 0.00 0.00 174.94 177.32 2kob n ALA 160 N 2.32 1.52 -1.54 9.38 0.00 -1.26 -4.96 120.51 125.98 2kob n ALA 160 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2kob n ALA 160 Cb 0.53 -2.75 0.00 0.00 0.00 0.00 0.00 19.45 17.23 2kob n ALA 160 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2kob n LEU 161 N 9.38 0.00 -0.11 0.00 4.77 -1.26 -4.80 117.00 124.98 2kob n LEU 161 Ca 0.26 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.23 2kob n LEU 161 Cb 0.39 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.48 2kob n LEU 161 CO 0.69 0.00 -0.01 -0.62 -1.33 0.00 0.00 177.39 176.11 2kob n GLU 162 N 0.00 -0.65 -3.12 3.23 1.02 -1.26 -4.96 120.64 114.91 2kob n GLU 162 Ca 0.00 0.29 -0.45 0.00 -0.02 0.00 0.00 57.16 56.98 2kob n GLU 162 Cb 0.00 -3.86 -0.04 0.00 -0.02 0.00 0.00 31.44 27.53 2kob n GLU 162 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2kob s HIS 163 N -1.78 3.14 -0.57 -0.32 2.46 -1.26 -5.01 115.29 111.95 2kob s HIS 163 Ca 0.00 -1.20 -0.15 0.00 0.47 0.00 0.00 55.06 54.18 2kob s HIS 163 Cb 0.00 -4.03 0.14 0.00 -0.13 0.00 0.00 32.58 28.56 2kob s HIS 163 CO 0.00 -1.28 0.52 -1.58 -2.47 0.00 0.00 174.74 169.93 2kob s HIS 164 N 2.28 3.33 0.00 3.88 2.46 -1.26 -4.88 115.29 121.10 2kob s HIS 164 Ca 0.16 -1.44 0.00 0.00 0.47 0.00 0.00 55.06 54.24 2kob s HIS 164 Cb -0.19 -3.77 0.00 0.00 -0.13 0.00 0.00 32.58 28.49 2kob s HIS 164 CO 0.01 -1.01 0.00 1.58 -2.47 0.00 0.00 174.74 172.85 2kob n HIS 165 N 5.04 0.00 0.00 3.88 -0.00 -1.26 -4.33 115.22 118.56 2kob n HIS 165 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.62 2kob n HIS 165 Cb 0.41 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.40 2kob n HIS 165 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2kob n HIS 166 N 0.00 0.00 -2.17 1.57 -0.00 -1.26 -5.11 115.22 108.25 2kob n HIS 166 Ca 0.00 0.00 -0.41 0.00 0.46 0.00 0.00 57.72 57.77 2kob n HIS 166 Cb 0.00 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 29.84 2kob n HIS 166 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2kob s HIS 167 N 0.00 1.97 0.00 1.57 2.46 -1.26 -5.29 115.29 114.75 2kob s HIS 167 Ca 0.00 0.64 0.00 0.00 0.47 0.00 0.00 55.06 56.17 2kob s HIS 167 Cb 0.00 -4.22 0.00 0.00 -0.13 0.00 0.00 32.58 28.23 2kob s HIS 167 CO 0.00 -2.36 0.42 1.58 -2.47 0.00 0.00 174.74 171.91