#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kob s ASP 62 N 0.00 -0.14 0.29 0.55 1.47 -1.26 -5.15 116.67 112.44 2kob s ASP 62 Ca 0.00 -0.18 0.11 0.00 1.18 0.00 0.00 52.55 53.66 2kob s ASP 62 Cb 0.00 0.37 -0.05 0.00 -0.34 0.00 0.00 42.92 42.90 2kob s ASP 62 CO 0.00 -0.63 -0.14 -0.55 0.68 0.00 0.00 175.17 174.54 2kob s SER 63 N -2.08 3.80 0.52 2.11 0.15 -1.26 -2.75 113.70 114.18 2kob s SER 63 Ca -0.05 -1.00 0.16 0.00 0.70 0.00 0.00 55.95 55.76 2kob s SER 63 Cb -0.01 -0.40 1.26 0.00 -1.71 0.00 0.00 66.02 65.16 2kob s SER 63 CO -0.03 -0.03 2.14 0.15 1.20 0.00 0.00 173.24 176.67 2kob h PHE 64 N 2.14 0.01 -0.84 3.44 3.57 -1.58 -1.06 116.94 122.61 2kob h PHE 64 Ca -0.41 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.08 2kob h PHE 64 Cb 1.26 -0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.95 2kob h PHE 64 CO 0.78 0.01 0.49 0.78 -2.23 0.00 0.00 178.31 178.14 2kob h GLY 65 N 0.02 1.23 0.98 2.40 0.00 -1.41 0.21 103.07 106.51 2kob h GLY 65 Ca 0.00 -0.53 -0.08 0.00 0.00 0.00 0.00 47.33 46.72 2kob h GLY 65 CO 0.00 0.51 -0.04 -1.80 0.00 0.00 0.00 176.54 175.21 2kob h ASP 66 N 1.16 0.79 0.47 0.19 3.58 -1.49 -2.73 116.42 118.39 2kob h ASP 66 Ca 0.30 -0.33 -0.06 0.00 0.42 0.00 0.00 57.03 57.36 2kob h ASP 66 Cb -0.02 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 40.81 2kob h ASP 66 CO -0.05 0.93 -0.30 -0.50 -2.88 0.00 0.00 179.24 176.43 2kob h TRP 67 N 0.63 0.00 -0.04 0.28 4.06 -0.99 0.33 115.95 120.21 2kob h TRP 67 Ca 0.12 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 61.07 2kob h TRP 67 Cb 0.55 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.71 2kob h TRP 67 CO 0.04 0.30 0.02 0.00 -3.56 0.00 0.00 178.44 175.24 2kob h ALA 68 N 1.70 0.05 -0.68 1.49 0.00 -0.33 0.16 119.26 121.64 2kob h ALA 68 Ca -0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2kob h ALA 68 Cb 0.62 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2kob h ALA 68 CO 0.04 -0.39 0.34 0.93 0.00 0.00 0.00 179.25 180.16 2kob h GLU 69 N -0.05 0.96 0.07 0.00 3.07 -1.15 -0.25 114.58 117.23 2kob h GLU 69 Ca 0.01 -0.12 0.01 0.00 -0.50 0.00 0.00 59.36 58.76 2kob h GLU 69 Cb 0.11 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 27.82 2kob h GLU 69 CO -0.00 0.73 -0.13 0.87 -1.40 0.00 0.00 179.01 179.08 2kob h LYS 70 N 0.96 -0.24 -0.85 2.33 1.79 -0.56 -0.06 116.57 119.95 2kob h LYS 70 Ca 0.24 0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.70 2kob h LYS 70 Cb 0.08 0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 30.74 2kob h LYS 70 CO -0.03 -0.16 0.43 0.35 -1.08 0.00 0.00 179.45 178.95 2kob h PHE 71 N -0.25 1.20 0.15 -1.35 3.57 -0.36 0.17 116.94 120.08 2kob h PHE 71 Ca 0.02 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 2kob h PHE 71 Cb 0.27 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 38.64 2kob h PHE 71 CO -0.16 0.86 -0.07 -0.07 -2.23 0.00 0.00 178.31 176.64 2kob h LEU 72 N 1.20 -0.17 -1.11 0.59 3.38 -0.77 -1.64 115.31 116.79 2kob h LEU 72 Ca 0.29 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 58.15 2kob h LEU 72 Cb 0.09 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2kob h LEU 72 CO -0.04 -0.05 -0.23 0.50 0.09 0.00 0.00 178.44 178.71 2kob h LYS 73 N -0.29 0.00 -0.45 1.13 3.64 -0.84 0.11 116.57 119.87 2kob h LYS 73 Ca -0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2kob h LYS 73 Cb 0.23 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 2kob h LYS 73 CO 0.03 0.23 0.29 1.03 -2.27 0.00 0.00 179.45 178.77 2kob h SER 74 N 0.00 0.52 0.78 4.20 0.87 -0.30 0.24 113.55 119.86 2kob h SER 74 Ca -0.00 -0.03 -0.17 0.00 -1.23 0.00 0.00 61.79 60.36 2kob h SER 74 Cb 0.75 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.56 2kob h SER 74 CO 0.03 0.39 -0.81 0.11 -0.53 0.00 0.00 176.83 176.02 2kob h LYS 75 N 0.61 0.02 0.22 2.24 1.79 -0.77 0.36 116.57 121.04 2kob h LYS 75 Ca 0.16 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 2kob h LYS 75 Cb -0.05 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.59 2kob h LYS 75 CO -0.03 0.82 -0.19 1.49 -1.08 0.00 0.00 179.45 180.46 2kob h GLU 76 N 0.01 -0.41 0.00 3.15 4.22 -0.39 -0.20 114.58 120.96 2kob h GLU 76 Ca -0.01 0.03 -0.08 0.00 0.08 0.00 0.00 59.36 59.37 2kob h GLU 76 Cb 1.44 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.77 2kob h GLU 76 CO 0.11 -0.27 -0.40 0.00 -2.18 0.00 0.00 179.01 176.27 2kob h ALA 77 N 0.31 1.05 -0.07 2.92 0.00 -0.53 -3.12 119.26 119.83 2kob h ALA 77 Ca -0.01 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 2kob h ALA 77 Cb 0.38 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 2kob h ALA 77 CO -0.02 0.50 0.02 0.22 0.00 0.00 0.00 179.25 179.96 2kob h ASP 78 N 0.00 0.10 0.00 0.00 1.82 -0.57 -3.48 116.42 114.30 2kob h ASP 78 Ca -0.00 -0.20 0.00 0.00 -0.39 0.00 0.00 57.03 56.43 2kob h ASP 78 Cb 0.87 -0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.86 2kob h ASP 78 CO 0.05 0.28 0.00 0.61 -1.61 0.00 0.00 179.24 178.57 2kob n GLY 79 N -0.56 0.20 3.76 -0.78 0.00 -0.14 -5.07 105.19 102.61 2kob n GLY 79 Ca -0.06 -0.24 -0.24 0.00 0.00 0.00 0.00 46.02 45.48 2kob n GLY 79 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2kob s VAL 80 N 0.00 2.52 0.74 1.61 -7.23 -0.89 -5.04 120.40 112.10 2kob s VAL 80 Ca 0.00 -1.63 -0.09 0.00 -1.81 0.00 0.00 61.98 58.45 2kob s VAL 80 Cb 0.00 -2.99 0.06 0.00 0.56 0.00 0.00 36.38 34.01 2kob s VAL 80 CO 0.00 -0.04 1.07 -0.94 -0.31 0.00 0.00 175.10 174.88 2kob s SER 81 N -3.93 4.79 0.25 4.85 1.04 -1.26 -4.86 113.70 114.58 2kob s SER 81 Ca 0.42 0.64 -0.03 0.00 0.48 0.00 0.00 55.95 57.45 2kob s SER 81 Cb 0.01 -1.26 0.30 0.00 0.10 0.00 0.00 66.02 65.18 2kob s SER 81 CO 0.24 -1.66 1.78 0.58 0.98 0.00 0.00 173.24 175.15 2kob h VAL 82 N -0.75 1.24 -0.23 5.02 2.07 -2.00 -1.07 116.25 120.53 2kob h VAL 82 Ca -0.45 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.16 2kob h VAL 82 Cb 1.31 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 2kob h VAL 82 CO 0.63 0.34 0.15 -1.28 0.02 0.00 0.00 177.57 177.42 2kob h SER 83 N 0.87 0.27 -0.38 0.57 0.87 -1.97 0.40 113.55 114.17 2kob h SER 83 Ca 0.18 -0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.69 2kob h SER 83 Cb 0.35 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 2kob h SER 83 CO 0.00 0.22 0.13 -0.61 -0.53 0.00 0.00 176.83 176.04 2kob h GLN 84 N 0.30 0.58 -0.52 2.24 5.75 -1.89 0.33 115.11 121.91 2kob h GLN 84 Ca 0.08 -0.12 -0.03 0.00 -0.15 0.00 0.00 58.65 58.44 2kob h GLN 84 Cb -0.01 -0.09 -0.03 0.00 1.07 0.00 0.00 27.48 28.42 2kob h GLN 84 CO -0.02 0.58 0.20 -0.07 -2.65 0.00 0.00 178.83 176.87 2kob h LEU 85 N 0.47 0.68 -0.72 -2.39 3.38 -0.96 -1.67 115.31 114.09 2kob h LEU 85 Ca 0.12 -0.08 -0.13 0.00 0.09 0.00 0.00 57.88 57.88 2kob h LEU 85 Cb 0.23 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2kob h LEU 85 CO -0.01 0.62 -0.64 -1.13 0.09 0.00 0.00 178.44 177.38 2kob h ASN 86 N 0.74 0.00 -0.00 -0.43 -1.24 0.29 -0.89 115.58 114.04 2kob h ASN 86 Ca 0.18 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.19 2kob h ASN 86 Cb 0.16 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.21 2kob h ASN 86 CO -0.02 0.64 0.00 -1.28 -1.29 0.00 0.00 177.43 175.48 2kob h SER 87 N 0.00 0.01 -0.88 1.15 0.87 -0.37 -2.49 113.55 111.84 2kob h SER 87 Ca -0.01 -0.21 0.01 0.00 -1.23 0.00 0.00 61.79 60.35 2kob h SER 87 Cb 1.13 -0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.04 2kob h SER 87 CO 0.08 0.22 0.58 1.88 -0.53 0.00 0.00 176.83 179.07 2kob h TYR 88 N -0.21 1.10 -0.59 2.24 0.05 -1.05 -1.87 116.97 116.65 2kob h TYR 88 Ca 0.00 0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.85 2kob h TYR 88 Cb 0.21 -0.37 -0.04 0.00 1.01 0.00 0.00 36.73 37.54 2kob h TYR 88 CO -0.00 0.69 0.34 0.87 -1.05 0.00 0.00 178.16 179.01 2kob h LYS 89 N 1.19 0.65 -0.51 4.88 1.57 -1.08 -1.76 116.57 121.50 2kob h LYS 89 Ca 0.33 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 59.02 2kob h LYS 89 Cb -0.12 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.02 2kob h LYS 89 CO -0.07 0.43 0.13 -0.97 -0.57 0.00 0.00 179.45 178.40 2kob h ASN 90 N 0.67 0.78 -0.20 0.86 -0.73 -0.89 -1.16 115.58 114.90 2kob h ASN 90 Ca 0.25 -0.23 -0.04 0.00 1.87 0.00 0.00 56.30 58.16 2kob h ASN 90 Cb 0.08 -0.20 -0.01 0.00 0.27 0.00 0.00 38.32 38.46 2kob h ASN 90 CO -0.13 0.80 -0.01 1.88 -0.37 0.00 0.00 177.43 179.60 2kob h TYR 91 N 0.71 0.40 0.00 0.67 -1.99 -1.16 0.11 116.97 115.71 2kob h TYR 91 Ca 0.16 -0.07 -0.10 0.00 2.00 0.00 0.00 58.73 60.72 2kob h TYR 91 Cb 0.32 -0.10 -0.01 0.00 2.00 0.00 0.00 36.73 38.94 2kob h TYR 91 CO 0.02 0.57 -0.45 0.00 -0.00 0.00 0.00 178.16 178.30 2kob n ARG 93 N -3.38 0.68 -0.10 0.00 1.74 -0.45 -3.63 116.66 111.53 2kob n ARG 93 Ca 0.01 0.07 -0.23 0.00 -0.77 0.00 0.00 57.85 56.93 2kob n ARG 93 Cb 0.63 -1.57 -0.12 0.00 -1.02 0.00 0.00 32.46 30.38 2kob n ARG 93 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2kob n ASN 94 N -2.90 1.98 0.01 0.55 4.13 0.38 -3.72 115.26 115.69 2kob n ASN 94 Ca -0.32 0.21 -0.21 0.00 1.68 0.00 0.00 54.58 55.94 2kob n ASN 94 Cb 1.11 -0.77 -0.14 0.00 -1.54 0.00 0.00 39.78 38.45 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 -0.51 0.42 -0.51 3.10 3.86 -1.38 -3.31 115.15 116.82 2kob h HIS 95 Ca -0.53 -0.30 -0.21 0.00 -1.16 0.00 0.00 60.37 58.17 2kob h HIS 95 Cb 1.71 -0.02 -0.12 0.00 1.06 0.00 0.00 27.41 30.04 2kob h HIS 95 CO 0.02 1.49 0.26 1.28 0.86 0.00 0.00 177.93 181.84 2kob n LEU 96 N -4.01 4.75 -0.13 2.43 4.77 -0.46 -4.59 117.00 119.76 2kob n LEU 96 Ca -0.23 -2.48 -0.04 0.00 -0.03 0.00 0.00 56.01 53.23 2kob n LEU 96 Cb 0.86 -0.67 0.04 0.00 -2.33 0.00 0.00 43.42 41.32 2kob n LEU 96 CO 0.41 0.71 0.89 0.77 -1.33 0.00 0.00 177.39 178.84 2kob h SER 97 N 1.15 -0.03 0.64 -1.43 4.64 -1.64 -0.04 113.55 116.84 2kob h SER 97 Ca 0.26 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 2kob h SER 97 Cb 1.87 0.11 0.00 0.00 -0.31 0.00 0.00 62.40 64.07 2kob h SER 97 CO 0.54 0.02 0.00 -2.65 -0.87 0.00 0.00 176.83 173.87 2kob n PRO 98 N -5.12 0.16 -0.06 4.77 -0.02 -1.26 -2.46 135.00 131.01 2kob n PRO 98 Ca 0.03 0.41 -0.10 0.00 -2.02 0.00 0.00 63.50 61.83 2kob n PRO 98 Cb 0.20 -1.82 -0.15 0.00 -0.02 0.00 0.00 33.50 31.71 2kob n PRO 98 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2kob n LEU 99 N -2.13 0.64 -0.04 2.45 4.77 -0.41 -4.17 117.00 118.11 2kob n LEU 99 Ca 0.02 0.20 0.13 0.00 -0.03 0.00 0.00 56.01 56.32 2kob n LEU 99 Cb 0.21 0.22 0.54 0.00 -2.33 0.00 0.00 43.42 42.06 2kob n LEU 99 CO 0.18 0.48 1.18 0.22 -1.33 0.00 0.00 177.39 178.12 2kob h TYR 100 N 0.00 0.33 -0.11 -1.77 3.20 -0.73 -0.57 116.97 117.32 2kob h TYR 100 Ca -0.42 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.46 2kob h TYR 100 Cb 2.12 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 40.28 2kob h TYR 100 CO 0.00 0.16 0.00 -0.12 -1.64 0.00 0.00 178.16 176.56 2kob n MET 101 N -4.46 2.30 -3.37 1.82 1.56 -1.25 -1.29 117.12 112.43 2kob n MET 101 Ca 0.08 -1.91 -0.35 0.00 -0.27 0.00 0.00 57.70 55.26 2kob n MET 101 Cb 0.38 -1.47 -0.06 0.00 2.15 0.00 0.00 33.22 34.22 2kob n MET 101 CO 0.00 0.00 0.00 0.15 -0.73 0.00 0.00 175.97 175.39 2kob s LYS 102 N -1.89 3.95 0.45 2.12 1.02 -0.22 -4.96 119.74 120.21 2kob s LYS 102 Ca 0.31 0.45 -0.24 0.00 0.02 0.00 0.00 55.97 56.52 2kob s LYS 102 Cb 0.21 -2.89 -0.07 0.00 -0.52 0.00 0.00 37.83 34.55 2kob s LYS 102 CO 0.31 0.46 1.24 0.45 -0.92 0.00 0.00 175.35 176.89 2kob s SER 103 N -1.81 6.07 0.11 2.83 0.15 -1.26 -1.87 113.70 117.93 2kob s SER 103 Ca 0.39 2.50 -0.23 0.00 0.70 0.00 0.00 55.95 59.32 2kob s SER 103 Cb -0.14 -2.62 -0.07 0.00 -1.71 0.00 0.00 66.02 61.48 2kob s SER 103 CO 0.19 -1.00 1.69 0.25 1.20 0.00 0.00 173.24 175.58 2kob h LEU 104 N 2.18 -0.29 -0.12 3.45 5.85 -1.82 -1.27 115.31 123.30 2kob h LEU 104 Ca -0.50 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.28 2kob h LEU 104 Cb 1.26 0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.42 2kob h LEU 104 CO 0.61 -0.13 0.00 -1.20 -0.34 0.00 0.00 178.44 177.37 2kob n SER 105 N -5.23 0.21 -1.01 1.25 7.64 -1.26 -2.78 113.62 112.45 2kob n SER 105 Ca -0.05 0.54 0.11 0.00 1.01 0.00 0.00 58.87 60.48 2kob n SER 105 Cb 0.15 -0.59 0.26 0.00 -1.01 0.00 0.00 64.21 63.02 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 -1.72 2.31 -3.27 1.43 4.71 -0.49 -4.91 120.64 118.71 2kob n GLU 106 Ca 0.05 -1.99 -0.39 0.00 -0.01 0.00 0.00 57.16 54.82 2kob n GLU 106 Cb 0.26 -1.48 -0.06 0.00 -1.01 0.00 0.00 31.44 29.16 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 -1.52 4.85 0.06 -3.67 1.01 -1.12 -4.87 121.20 115.93 2kob s ILE 107 Ca 0.37 1.18 0.04 0.00 0.00 0.00 0.00 60.65 62.25 2kob s ILE 107 Cb 0.21 -3.89 -0.04 0.00 0.01 0.00 0.00 42.46 38.75 2kob s ILE 107 CO 0.30 0.49 -0.00 -0.76 0.00 0.00 0.00 174.94 174.97 2kob s LEU 108 N -0.67 3.46 0.58 2.97 2.01 -1.26 -4.98 118.68 120.79 2kob s LEU 108 Ca 0.29 -0.13 0.34 0.00 0.01 0.00 0.00 54.13 54.64 2kob s LEU 108 Cb -0.19 -2.13 1.80 0.00 0.01 0.00 0.00 46.19 45.69 2kob s LEU 108 CO 0.17 0.21 2.18 1.55 1.01 0.00 0.00 176.35 181.47 2kob h PRO 109 N 3.73 0.00 -0.63 1.29 0.13 -1.99 -2.78 132.00 131.75 2kob h PRO 109 Ca -0.48 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 2kob h PRO 109 Cb 1.17 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 2kob h PRO 109 CO 0.59 0.05 0.22 0.00 -0.23 0.00 0.00 178.00 178.62 2kob h ALA 110 N 1.95 0.82 -0.60 -0.56 0.00 -1.94 -1.09 119.26 117.85 2kob h ALA 110 Ca -0.00 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.75 2kob h ALA 110 Cb 0.21 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 2kob h ALA 110 CO 0.01 0.48 0.36 -0.44 0.00 0.00 0.00 179.25 179.65 2kob h ASP 111 N 0.90 0.57 0.27 0.00 3.32 -1.91 -1.92 116.42 117.66 2kob h ASP 111 Ca 0.21 0.01 -0.16 0.00 0.02 0.00 0.00 57.03 57.11 2kob h ASP 111 Cb 0.26 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 2kob h ASP 111 CO -0.01 0.40 -0.62 0.40 -1.72 0.00 0.00 179.24 177.69 2kob h ILE 112 N 0.70 1.37 -0.66 0.35 2.04 -1.58 -2.14 117.51 117.59 2kob h ILE 112 Ca 0.25 -1.97 -0.07 0.00 1.00 0.00 0.00 64.86 64.06 2kob h ILE 112 Cb 0.05 1.98 -0.03 0.00 -0.74 0.00 0.00 36.82 38.08 2kob h ILE 112 CO -0.11 0.59 0.13 -0.61 0.00 0.00 0.00 178.15 178.15 2kob h GLN 113 N 0.25 1.08 -0.13 2.37 5.75 -0.81 -2.01 115.11 121.60 2kob h GLN 113 Ca -0.01 -0.28 -0.18 0.00 -0.15 0.00 0.00 58.65 58.04 2kob h GLN 113 Cb 1.14 -0.13 -0.00 0.00 1.07 0.00 0.00 27.48 29.56 2kob h GLN 113 CO 0.10 0.98 -0.66 0.66 -2.65 0.00 0.00 178.83 177.26 2kob h SER 114 N 1.00 0.60 -0.45 -0.69 4.64 -1.27 -1.35 113.55 116.03 2kob h SER 114 Ca 0.20 -0.36 0.05 0.00 -0.47 0.00 0.00 61.79 61.21 2kob h SER 114 Cb 0.41 -0.17 -0.05 0.00 -0.31 0.00 0.00 62.40 62.28 2kob h SER 114 CO 0.01 1.09 0.18 0.40 -0.87 0.00 0.00 176.83 177.64 2kob h ILE 115 N 0.37 0.89 -0.31 0.95 2.04 -1.15 0.16 117.51 120.46 2kob h ILE 115 Ca -0.02 -0.12 -0.10 0.00 1.00 0.00 0.00 64.86 65.62 2kob h ILE 115 Cb 1.23 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 2kob h ILE 115 CO 0.12 0.07 -0.22 0.40 0.00 0.00 0.00 178.15 178.52 2kob h ILE 116 N 0.36 1.26 -0.57 -0.67 1.08 -1.27 -0.53 117.51 117.18 2kob h ILE 116 Ca 0.21 -1.26 -0.09 0.00 -0.39 0.00 0.00 64.86 63.33 2kob h ILE 116 Cb 0.18 1.27 -0.02 0.00 -3.07 0.00 0.00 36.82 35.18 2kob h ILE 116 CO -0.19 0.41 0.01 -1.13 -0.69 0.00 0.00 178.15 176.56 2kob h ASN 117 N 0.52 0.97 1.46 1.72 -1.24 -0.40 -3.07 115.58 115.54 2kob h ASN 117 Ca 0.08 -0.30 0.00 0.00 0.71 0.00 0.00 56.30 56.79 2kob h ASN 117 Cb 0.67 -0.26 0.00 0.00 0.73 0.00 0.00 38.32 39.45 2kob h ASN 117 CO 0.05 1.03 -0.47 -0.33 -1.29 0.00 0.00 177.43 176.42 2kob h GLU 118 N 0.88 0.00 -6.15 6.67 5.08 -0.57 -3.42 114.58 117.07 2kob h GLU 118 Ca 0.16 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.93 2kob h GLU 118 Cb 0.53 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.68 2kob h GLU 118 CO 0.03 0.00 0.62 0.99 -1.00 0.00 0.00 179.01 179.65 2kob s THR 119 N -3.27 4.53 -0.76 1.13 2.01 -0.22 -4.98 115.64 114.08 2kob s THR 119 Ca 0.04 1.08 -0.04 0.00 0.31 0.00 0.00 61.69 63.08 2kob s THR 119 Cb 0.08 -4.38 0.19 0.00 0.01 0.00 0.00 72.50 68.40 2kob s THR 119 CO 0.72 -0.65 0.62 -1.59 -0.69 0.00 0.00 174.62 173.03 2kob s LYS 120 N 3.61 2.97 0.20 4.92 -2.85 -1.26 -4.87 119.74 122.47 2kob s LYS 120 Ca 0.38 -2.83 0.03 0.00 -1.00 0.00 0.00 55.97 52.55 2kob s LYS 120 Cb -0.11 -3.90 -0.01 0.00 -2.06 0.00 0.00 37.83 31.75 2kob s LYS 120 CO 0.22 -1.22 0.10 1.28 0.10 0.00 0.00 175.35 175.82 2kob n LEU 121 N 3.06 0.00 -4.72 2.77 4.77 -1.26 -5.13 117.00 116.49 2kob n LEU 121 Ca 0.14 -1.65 -0.39 0.00 -0.03 0.00 0.00 56.01 54.08 2kob n LEU 121 Cb 0.38 0.63 0.04 0.00 -2.33 0.00 0.00 43.42 42.14 2kob n LEU 121 CO 0.35 -0.26 0.91 0.00 -1.33 0.00 0.00 177.39 177.06 2kob n ALA 122 N -1.93 1.38 0.01 -1.18 0.00 -1.26 -4.79 120.51 112.74 2kob n ALA 122 Ca -0.08 0.15 0.03 0.00 0.00 0.00 0.00 53.44 53.55 2kob n ALA 122 Cb 0.32 -2.31 0.41 0.00 0.00 0.00 0.00 19.45 17.87 2kob n ALA 122 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2kob h LYS 123 N 1.52 0.51 0.00 0.00 2.10 -1.92 0.67 116.57 119.45 2kob h LYS 123 Ca -0.50 -0.04 -0.06 0.00 -2.00 0.00 0.00 60.65 58.04 2kob h LYS 123 Cb 1.31 -0.11 -0.01 0.00 -0.90 0.00 0.00 32.23 32.52 2kob h LYS 123 CO 0.57 0.38 -0.31 -2.95 -2.00 0.00 0.00 179.45 175.14 2kob h ASN 124 N 0.52 0.00 0.56 7.07 -1.07 -1.95 -0.39 115.58 120.32 2kob h ASN 124 Ca 0.14 0.00 -0.25 0.00 0.07 0.00 0.00 56.30 56.26 2kob h ASN 124 Cb 0.01 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.26 2kob h ASN 124 CO -0.02 0.31 -1.09 0.74 0.07 0.00 0.00 177.43 177.44 2kob h THR 125 N 0.00 1.48 -0.44 6.14 2.02 -1.27 -1.25 112.91 119.60 2kob h THR 125 Ca -0.00 -2.84 -0.11 0.00 0.77 0.00 0.00 66.41 64.23 2kob h THR 125 Cb 0.67 2.72 -0.02 0.00 -1.74 0.00 0.00 68.15 69.78 2kob h THR 125 CO 0.04 0.83 -0.18 -0.07 0.37 0.00 0.00 175.52 176.52 2kob h LEU 126 N 0.12 0.85 -1.12 2.58 3.38 -0.78 -1.63 115.31 118.71 2kob h LEU 126 Ca -0.10 -0.29 -0.07 0.00 0.09 0.00 0.00 57.88 57.51 2kob h LEU 126 Cb 1.78 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 42.29 2kob h LEU 126 CO 0.18 1.02 -0.34 0.11 0.09 0.00 0.00 178.44 179.49 2kob h LYS 127 N 0.75 0.00 -0.49 1.13 1.57 -1.04 -0.56 116.57 117.93 2kob h LYS 127 Ca 0.11 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.79 2kob h LYS 127 Cb 0.70 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 2kob h LYS 127 CO 0.05 0.34 -0.08 0.00 -0.57 0.00 0.00 179.45 179.19 2kob h ALA 128 N 1.66 0.67 -0.45 3.86 0.00 -0.64 0.33 119.26 124.69 2kob h ALA 128 Ca -0.00 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.52 2kob h ALA 128 Cb 0.78 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2kob h ALA 128 CO 0.04 0.56 0.07 0.82 0.00 0.00 0.00 179.25 180.74 2kob h ILE 129 N 0.78 1.25 -0.09 0.00 2.04 -0.96 0.01 117.51 120.54 2kob h ILE 129 Ca 0.13 -0.91 0.02 0.00 1.00 0.00 0.00 64.86 65.09 2kob h ILE 129 Cb 0.63 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 2kob h ILE 129 CO 0.04 0.32 -0.01 -0.09 0.00 0.00 0.00 178.15 178.41 2kob h ARG 130 N 0.61 0.01 0.28 2.37 9.65 -0.92 -1.52 114.38 124.85 2kob h ARG 130 Ca 0.14 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.02 2kob h ARG 130 Cb 0.39 -0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.95 2kob h ARG 130 CO 0.01 0.01 -0.32 -0.97 2.80 0.00 0.00 179.97 181.50 2kob h ASN 131 N 0.01 -0.88 0.10 -3.80 -1.24 -0.20 -1.09 115.58 108.48 2kob h ASN 131 Ca 0.04 0.08 0.02 0.00 0.71 0.00 0.00 56.30 57.15 2kob h ASN 131 Cb 0.06 0.31 -0.03 0.00 0.73 0.00 0.00 38.32 39.39 2kob h ASN 131 CO -0.08 -0.44 -0.21 0.74 -1.29 0.00 0.00 177.43 176.14 2kob h THR 132 N -0.64 0.52 -0.61 -3.57 2.02 -0.86 -0.51 112.91 109.25 2kob h THR 132 Ca -0.01 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.13 2kob h THR 132 Cb 0.60 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 2kob h THR 132 CO -0.09 0.00 0.21 0.00 0.37 0.00 0.00 175.52 176.01 2kob h ALA 133 N 0.41 1.22 -0.35 6.16 0.00 -1.28 -2.51 119.26 122.91 2kob h ALA 133 Ca 0.03 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 2kob h ALA 133 Cb 0.42 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2kob h ALA 133 CO -0.13 0.56 -0.00 1.03 0.00 0.00 0.00 179.25 180.71 2kob h SER 134 N 0.89 0.61 -0.20 0.00 0.87 -0.63 -2.39 113.55 112.70 2kob h SER 134 Ca 0.20 -0.31 -0.03 0.00 -1.23 0.00 0.00 61.79 60.42 2kob h SER 134 Cb 0.23 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 2kob h SER 134 CO -0.01 0.77 0.03 1.56 -0.53 0.00 0.00 176.83 178.65 2kob h GLN 135 N 0.43 0.43 -0.12 2.24 4.20 -0.87 0.15 115.11 121.57 2kob h GLN 135 Ca 0.10 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 2kob h GLN 135 Cb 0.46 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 2kob h GLN 135 CO 0.02 0.43 0.04 0.82 -0.67 0.00 0.00 178.83 179.48 2kob h ILE 136 N 0.42 1.16 -0.46 2.54 2.04 -1.17 -0.30 117.51 121.74 2kob h ILE 136 Ca 0.10 -0.49 -0.09 0.00 1.00 0.00 0.00 64.86 65.37 2kob h ILE 136 Cb 0.23 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 2kob h ILE 136 CO 0.00 0.15 -0.08 -0.26 0.00 0.00 0.00 178.15 177.96 2kob h PHE 137 N 0.03 0.89 -0.98 1.37 0.04 -0.91 -1.98 116.94 115.40 2kob h PHE 137 Ca 0.04 -0.16 0.01 0.00 2.80 0.00 0.00 57.97 60.66 2kob h PHE 137 Cb 0.19 -0.23 -0.05 0.00 2.20 0.00 0.00 35.95 38.06 2kob h PHE 137 CO -0.01 0.86 0.65 0.00 -0.60 0.00 0.00 178.31 179.21 2kob h ARG 138 N 0.74 1.29 -0.72 1.51 3.08 -0.56 0.32 114.38 120.04 2kob h ARG 138 Ca 0.13 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 2kob h ARG 138 Cb 0.57 -0.29 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 2kob h ARG 138 CO 0.03 0.85 0.30 1.25 -1.07 0.00 0.00 179.97 181.34 2kob h LEU 139 N 1.33 0.96 -0.64 3.04 5.85 -0.61 0.20 115.31 125.43 2kob h LEU 139 Ca 0.36 -0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.90 2kob h LEU 139 Cb -0.15 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.60 2kob h LEU 139 CO -0.08 0.84 0.21 0.00 -0.34 0.00 0.00 178.44 179.07 2kob h ALA 140 N 1.30 0.84 -0.71 1.25 0.00 -0.56 -0.70 119.26 120.69 2kob h ALA 140 Ca 0.24 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2kob h ALA 140 Cb 0.17 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2kob h ALA 140 CO -0.02 0.51 0.23 0.82 0.00 0.00 0.00 179.25 180.79 2kob h ILE 141 N 0.92 1.25 -0.89 0.00 2.04 -0.34 0.35 117.51 120.85 2kob h ILE 141 Ca 0.21 -0.85 -0.01 0.00 1.00 0.00 0.00 64.86 65.21 2kob h ILE 141 Cb 0.29 0.46 -0.04 0.00 -0.74 0.00 0.00 36.82 36.78 2kob h ILE 141 CO -0.01 0.33 0.53 -0.33 0.00 0.00 0.00 178.15 178.68 2kob h GLU 142 N 1.04 1.20 -0.02 2.37 5.08 -0.13 0.71 114.58 124.83 2kob h GLU 142 Ca 0.23 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2kob h GLU 142 Cb 0.27 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2kob h GLU 142 CO -0.01 0.84 0.00 0.09 -1.00 0.00 0.00 179.01 178.93 2kob n ASN 143 N -4.36 0.75 -3.74 1.42 5.03 -0.31 -4.92 115.26 109.13 2kob n ASN 143 Ca 0.10 -1.32 -0.25 0.00 0.87 0.00 0.00 54.58 53.99 2kob n ASN 143 Cb 0.06 -0.01 0.04 0.00 -1.02 0.00 0.00 39.78 38.85 2kob n ASN 143 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2kob n ARG 144 N -0.38 -5.77 -0.08 3.52 1.74 0.24 -4.92 116.66 111.00 2kob n ARG 144 Ca 0.20 0.66 -0.11 0.00 -0.77 0.00 0.00 57.85 57.83 2kob n ARG 144 Cb 0.22 -5.47 -0.06 0.00 -1.02 0.00 0.00 32.46 26.13 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 0.93 0.10 -3.14 7.54 0.00 -0.64 -3.47 119.26 120.58 2kob h ALA 145 Ca -0.59 -0.71 -0.65 0.00 0.00 0.00 0.00 54.91 52.96 2kob h ALA 145 Cb 1.37 0.50 -0.09 0.00 0.00 0.00 0.00 17.79 19.56 2kob h ALA 145 CO 0.60 0.49 -0.59 -1.50 0.00 0.00 0.00 179.25 178.25 2kob s ILE 146 N -2.21 4.64 -1.51 0.00 2.07 -1.24 -5.00 121.20 117.96 2kob s ILE 146 Ca -0.19 -0.57 0.27 0.00 -1.41 0.00 0.00 60.65 58.76 2kob s ILE 146 Cb 0.03 -3.17 0.27 0.00 0.13 0.00 0.00 42.46 39.72 2kob s ILE 146 CO 0.37 0.25 1.65 -0.67 -1.91 0.00 0.00 174.94 174.63 2kob n ASP 147 N 0.85 0.67 -3.89 4.50 2.03 -1.26 -4.09 116.55 115.37 2kob n ASP 147 Ca -0.11 -0.56 -0.09 0.00 0.52 0.00 0.00 54.79 54.55 2kob n ASP 147 Cb 0.52 0.05 -0.04 0.00 -0.72 0.00 0.00 41.12 40.93 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 -2.63 0.07 -0.37 -0.67 -0.71 -1.26 -5.08 117.98 107.33 2kob s PHE 148 Ca 0.22 -0.46 -0.01 0.00 -1.04 0.00 0.00 56.93 55.64 2kob s PHE 148 Cb 0.19 0.40 0.09 0.00 -1.21 0.00 0.00 43.02 42.50 2kob s PHE 148 CO 0.54 -1.05 0.12 1.21 -1.34 0.00 0.00 175.22 174.70 2kob s ASN 149 N -2.95 5.06 0.46 1.98 2.47 -1.26 -4.89 114.94 115.80 2kob s ASN 149 Ca 0.16 -1.90 0.31 0.00 0.42 0.00 0.00 52.86 51.85 2kob s ASN 149 Cb -0.02 -1.75 1.38 0.00 -1.45 0.00 0.00 41.25 39.40 2kob s ASN 149 CO 0.05 -0.44 1.93 1.55 -3.72 0.00 0.00 177.10 176.47 2kob h PRO 150 N 7.93 0.00 0.00 0.43 0.13 -1.97 -2.50 132.00 136.03 2kob h PRO 150 Ca -0.13 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.00 2kob h PRO 150 Cb 1.04 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.17 2kob h PRO 150 CO 0.62 0.00 -0.02 0.00 -0.23 0.00 0.00 178.00 178.37 2kob h ALA 151 N 2.08 1.00 0.00 -0.56 0.00 -1.93 -2.70 119.26 117.16 2kob h ALA 151 Ca 0.00 -0.02 0.00 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 0.03 0.00 0.22 0.00 0.00 0.00 179.25 179.50 2kob h ASP 152 N 0.00 0.00 -0.13 0.00 3.58 -1.85 -2.68 116.42 115.34 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 0.59 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.64 2kob h ASP 152 CO 0.00 0.00 0.00 -1.22 -2.88 0.00 0.00 179.24 175.14 2kob n TYR 153 N -2.36 0.15 -3.19 0.28 4.02 -1.02 -4.86 117.16 110.19 2kob n TYR 153 Ca 0.03 -0.08 -0.40 0.00 -0.01 0.00 0.00 57.90 57.44 2kob n TYR 153 Cb 0.30 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.55 2kob n TYR 153 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2kob s VAL 154 N -1.85 5.05 0.09 -0.72 1.01 -1.01 -5.01 120.40 117.96 2kob s VAL 154 Ca 0.34 1.01 -0.29 0.00 0.00 0.00 0.00 61.98 63.05 2kob s VAL 154 Cb 0.20 -3.88 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 2kob s VAL 154 CO 0.30 0.10 0.92 -0.60 0.00 0.00 0.00 175.10 175.82 2kob s ARG 155 N 2.08 4.64 -0.17 2.72 3.52 -1.26 -5.05 118.95 125.43 2kob s ARG 155 Ca 0.24 1.37 -0.06 0.00 -0.13 0.00 0.00 55.73 57.16 2kob s ARG 155 Cb -0.16 -3.38 -0.04 0.00 -1.56 0.00 0.00 34.95 29.82 2kob s ARG 155 CO 0.09 0.20 0.02 0.42 -0.81 0.00 0.00 175.30 175.22 2kob s ILE 156 N 0.09 4.41 0.22 4.11 -1.09 -1.26 -4.99 121.20 122.69 2kob s ILE 156 Ca 0.46 -0.17 -0.32 0.00 -2.23 0.00 0.00 60.65 58.39 2kob s ILE 156 Cb -0.22 -2.97 -0.12 0.00 -1.58 0.00 0.00 42.46 37.57 2kob s ILE 156 CO 0.28 0.48 1.70 -2.16 -1.23 0.00 0.00 174.94 174.01 2kob s PRO 157 N 0.32 4.13 -0.01 2.79 0.04 -1.26 -4.90 135.00 136.11 2kob s PRO 157 Ca 0.00 2.60 0.19 0.00 0.04 0.00 0.00 61.00 63.83 2kob s PRO 157 Cb -0.13 -3.07 -0.22 0.00 0.04 0.00 0.00 34.50 31.12 2kob s PRO 157 CO 0.01 -0.73 0.71 1.63 0.04 0.00 0.00 177.00 178.66 2kob n LYS 158 N 3.73 0.80 -3.71 4.56 5.02 -1.26 -4.80 118.16 122.50 2kob n LYS 158 Ca 0.15 -0.04 -0.38 0.00 -2.02 0.00 0.00 58.31 56.02 2kob n LYS 158 Cb 0.36 -1.39 -0.11 0.00 -0.02 0.00 0.00 35.03 33.86 2kob n LYS 158 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2kob s ILE 159 N -2.89 3.66 -0.18 -0.18 1.09 -1.26 -5.04 121.20 116.41 2kob s ILE 159 Ca 0.04 -1.71 -0.05 0.00 -1.10 0.00 0.00 60.65 57.83 2kob s ILE 159 Cb 0.14 -3.35 0.09 0.00 -1.06 0.00 0.00 42.46 38.28 2kob s ILE 159 CO 0.77 -0.56 0.31 0.00 -0.10 0.00 0.00 174.94 175.37 2kob s ALA 160 N 1.28 -0.75 0.00 9.38 0.00 -1.26 -5.11 121.76 125.29 2kob s ALA 160 Ca 0.04 0.91 0.00 0.00 0.00 0.00 0.00 51.96 52.91 2kob s ALA 160 Cb -0.23 -1.30 0.00 0.00 0.00 0.00 0.00 23.12 21.59 2kob s ALA 160 CO -0.01 -0.92 0.00 1.28 0.00 0.00 0.00 175.76 176.10 2kob n LEU 161 N 5.36 0.00 -4.81 0.00 4.77 -1.26 -4.74 117.00 116.31 2kob n LEU 161 Ca -0.06 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.59 2kob n LEU 161 Cb 0.50 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.52 2kob n LEU 161 CO 0.04 -0.29 0.66 -1.83 -1.33 0.00 0.00 177.39 174.64 2kob s GLU 162 N 0.00 4.22 -0.78 3.23 -1.05 -1.26 -5.00 118.70 118.06 2kob s GLU 162 Ca 0.00 1.18 0.02 0.00 -0.15 0.00 0.00 54.97 56.02 2kob s GLU 162 Cb 0.00 -2.24 0.31 0.00 -0.44 0.00 0.00 34.13 31.76 2kob s GLU 162 CO 0.00 -0.05 1.20 -2.39 0.95 0.00 0.00 175.26 174.98 2kob n HIS 163 N -0.54 3.39 0.50 4.83 1.44 -1.26 -4.82 115.22 118.75 2kob n HIS 163 Ca 0.07 -3.47 0.03 0.00 -2.01 0.00 0.00 57.72 52.34 2kob n HIS 163 Cb 0.53 -0.79 0.14 0.00 0.12 0.00 0.00 29.99 29.99 2kob n HIS 163 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11 2kob n HIS 164 N 0.26 0.68 -4.11 -1.40 -0.00 -1.26 -4.74 115.22 104.65 2kob n HIS 164 Ca 0.34 -0.25 -0.18 0.00 -0.00 0.00 0.00 57.72 57.64 2kob n HIS 164 Cb 0.35 -0.19 -0.16 0.00 -0.00 0.00 0.00 29.99 30.00 2kob n HIS 164 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2kob s HIS 165 N -1.65 0.54 -0.08 1.57 3.76 -1.26 -5.14 115.29 113.02 2kob s HIS 165 Ca 0.20 -0.11 -0.29 0.00 -0.15 0.00 0.00 55.06 54.71 2kob s HIS 165 Cb 0.14 -0.46 0.07 0.00 1.11 0.00 0.00 32.58 33.44 2kob s HIS 165 CO 0.08 -0.10 0.66 -3.38 -0.85 0.00 0.00 174.74 171.14 2kob s HIS 166 N 0.53 -0.64 0.80 1.40 -3.43 -1.26 -5.17 115.29 107.51 2kob s HIS 166 Ca -0.06 1.18 -0.10 0.00 -0.80 0.00 0.00 55.06 55.27 2kob s HIS 166 Cb -0.10 0.37 0.10 0.00 -1.43 0.00 0.00 32.58 31.52 2kob s HIS 166 CO -0.00 -0.56 1.14 -3.38 -2.00 0.00 0.00 174.74 169.94 2kob s HIS 167 N -0.97 2.63 -2.91 0.38 -3.43 -1.26 -5.30 115.29 104.43 2kob s HIS 167 Ca -0.10 0.52 0.25 0.00 -0.80 0.00 0.00 55.06 54.93 2kob s HIS 167 Cb -0.01 -3.49 0.35 0.00 -1.43 0.00 0.00 32.58 28.00 2kob s HIS 167 CO 0.08 -1.81 1.35 1.58 -2.00 0.00 0.00 174.74 173.94