#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kt7 s ASP 35 N 0.00 6.29 -0.08 7.83 2.15 -1.26 -4.96 116.67 126.65 2kt7 s ASP 35 Ca 0.00 0.54 -0.31 0.00 0.43 0.00 0.00 52.55 53.21 2kt7 s ASP 35 Cb 0.00 -2.54 0.09 0.00 -0.30 0.00 0.00 42.92 40.16 2kt7 s ASP 35 CO 0.00 -1.52 0.78 0.28 -0.17 0.00 0.00 175.17 174.54 2kt7 s THR 36 N 5.55 0.00 -1.46 1.71 -1.32 -1.26 -5.07 115.64 113.79 2kt7 s THR 36 Ca 0.55 0.00 -0.13 0.00 -1.21 0.00 0.00 61.69 60.90 2kt7 s THR 36 Cb -0.11 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 69.92 2kt7 s THR 36 CO 0.29 0.00 2.25 0.59 -2.21 0.00 0.00 174.62 175.55 2kt7 n ASN 37 N 0.81 4.37 -4.57 8.08 3.02 -1.26 -4.92 115.26 120.79 2kt7 n ASN 37 Ca -0.16 -2.85 -0.43 0.00 -0.03 0.00 0.00 54.58 51.11 2kt7 n ASN 37 Cb 0.58 -1.63 -0.04 0.00 -0.61 0.00 0.00 39.78 38.07 2kt7 n ASN 37 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2kt7 s ASN 38 N 2.89 6.50 -0.72 6.41 -0.87 -1.26 -4.99 114.94 122.90 2kt7 s ASN 38 Ca 0.48 0.12 -0.26 0.00 -1.57 0.00 0.00 52.86 51.63 2kt7 s ASN 38 Cb 0.14 -2.47 0.01 0.00 -0.02 0.00 0.00 41.25 38.91 2kt7 s ASN 38 CO -0.08 -1.11 1.55 -0.36 -2.57 0.00 0.00 177.10 174.52 2kt7 s PHE 39 N 3.92 2.04 0.18 2.20 0.40 -1.26 -4.63 117.98 120.84 2kt7 s PHE 39 Ca 0.38 0.24 0.10 0.00 -0.60 0.00 0.00 56.93 57.06 2kt7 s PHE 39 Cb -0.10 -4.40 -0.04 0.00 0.51 0.00 0.00 43.02 38.99 2kt7 s PHE 39 CO 0.26 -2.14 -0.21 0.95 0.70 0.00 0.00 175.22 174.79 2kt7 s THR 40 N 7.17 2.10 -0.35 0.64 -4.23 -1.26 -4.83 115.64 114.88 2kt7 s THR 40 Ca 0.50 -1.99 -0.03 0.00 -1.18 0.00 0.00 61.69 58.99 2kt7 s THR 40 Cb -0.09 -1.99 0.07 0.00 1.34 0.00 0.00 72.50 71.83 2kt7 s THR 40 CO 0.15 -0.22 0.09 -0.69 -0.54 0.00 0.00 174.62 173.40 2kt7 s VAL 41 N -1.87 3.19 -0.32 2.29 1.01 0.23 -2.25 120.40 122.68 2kt7 s VAL 41 Ca 0.19 -1.62 -0.18 0.00 0.00 0.00 0.00 61.98 60.37 2kt7 s VAL 41 Cb -0.07 -2.97 -0.01 0.00 0.00 0.00 0.00 36.38 33.33 2kt7 s VAL 41 CO 0.08 -0.34 0.51 -0.75 0.00 0.00 0.00 175.10 174.61 2kt7 s LYS 42 N 1.22 3.78 -0.25 2.72 2.36 0.11 0.16 119.74 129.84 2kt7 s LYS 42 Ca 0.01 0.00 -0.18 0.00 -2.55 0.00 0.00 55.97 53.25 2kt7 s LYS 42 Cb -0.21 -3.75 -0.03 0.00 -1.05 0.00 0.00 37.83 32.79 2kt7 s LYS 42 CO -0.02 -0.54 0.50 0.08 1.55 0.00 0.00 175.35 176.92 2kt7 s VAL 43 N 2.37 5.09 -0.11 4.02 1.01 0.16 -0.92 120.40 132.03 2kt7 s VAL 43 Ca 0.20 0.86 -0.04 0.00 0.00 0.00 0.00 61.98 63.00 2kt7 s VAL 43 Cb -0.15 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 2kt7 s VAL 43 CO 0.12 0.12 0.04 -1.61 0.00 0.00 0.00 175.10 173.77 2kt7 s GLU 44 N 2.11 3.21 -0.48 2.72 2.02 0.16 -1.47 118.70 126.97 2kt7 s GLU 44 Ca 0.21 -0.34 -0.05 0.00 0.02 0.00 0.00 54.97 54.81 2kt7 s GLU 44 Cb -0.16 -2.93 0.12 0.00 0.10 0.00 0.00 34.13 31.27 2kt7 s GLU 44 CO 0.09 0.66 0.30 0.71 0.02 0.00 0.00 175.26 177.04 2kt7 s TYR 45 N -0.75 3.52 0.20 1.61 1.51 -1.26 -1.02 117.35 121.16 2kt7 s TYR 45 Ca 0.12 -2.31 0.11 0.00 -1.01 0.00 0.00 57.07 53.98 2kt7 s TYR 45 Cb -0.12 -3.31 -0.04 0.00 -0.11 0.00 0.00 41.96 38.38 2kt7 s TYR 45 CO 0.02 -0.96 -0.22 0.14 -1.11 0.00 0.00 175.55 173.43 2kt7 s VAL 46 N 0.96 2.27 0.93 0.71 -7.23 -0.13 -0.64 120.40 117.27 2kt7 s VAL 46 Ca 0.09 -2.08 -0.15 0.00 -1.81 0.00 0.00 61.98 58.04 2kt7 s VAL 46 Cb -0.23 -2.10 0.17 0.00 0.56 0.00 0.00 36.38 34.77 2kt7 s VAL 46 CO -0.03 -0.20 1.26 -0.62 -0.31 0.00 0.00 175.10 175.19 2kt7 s ASP 47 N -2.81 3.41 0.00 4.85 2.15 -0.19 -0.21 116.67 123.87 2kt7 s ASP 47 Ca 0.21 0.48 0.00 0.00 0.43 0.00 0.00 52.55 53.67 2kt7 s ASP 47 Cb -0.07 -0.69 0.01 0.00 -0.30 0.00 0.00 42.92 41.87 2kt7 s ASP 47 CO 0.10 -2.57 0.90 0.00 -0.17 0.00 0.00 175.17 173.43 2kt7 n ALA 48 N -3.70 1.12 0.97 3.66 0.00 -0.18 -0.55 120.51 121.83 2kt7 n ALA 48 Ca 0.12 -0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.69 2kt7 n ALA 48 Cb 0.60 -1.00 0.41 0.00 0.00 0.00 0.00 19.45 19.45 2kt7 n ALA 48 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2kt7 n ASP 49 N -1.39 0.31 0.00 0.00 8.00 -1.26 -4.92 116.55 117.28 2kt7 n ASP 49 Ca 0.00 0.11 0.00 0.00 0.71 0.00 0.00 54.79 55.62 2kt7 n ASP 49 Cb 0.00 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.00 2kt7 n ASP 49 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2kt7 n GLY 50 N 1.49 1.10 3.79 0.44 0.00 0.29 -5.05 105.19 107.24 2kt7 n GLY 50 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 2kt7 n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kt7 s ALA 51 N -2.72 3.59 0.62 4.61 0.00 -1.26 -4.82 121.76 121.78 2kt7 s ALA 51 Ca 0.00 -0.16 -0.16 0.00 0.00 0.00 0.00 51.96 51.64 2kt7 s ALA 51 Cb 0.00 -2.53 -0.02 0.00 0.00 0.00 0.00 23.12 20.57 2kt7 s ALA 51 CO 0.00 0.28 1.08 -1.83 0.00 0.00 0.00 175.76 175.29 2kt7 s GLU 52 N -0.43 3.13 0.00 0.00 -1.05 -1.26 -1.02 118.70 118.07 2kt7 s GLU 52 Ca 0.25 1.28 0.00 0.00 -0.15 0.00 0.00 54.97 56.35 2kt7 s GLU 52 Cb -0.17 -2.00 0.00 0.00 -0.44 0.00 0.00 34.13 31.52 2kt7 s GLU 52 CO 0.13 -0.97 0.55 0.44 0.95 0.00 0.00 175.26 176.37 2kt7 n ILE 53 N -2.15 0.29 -3.60 1.83 -5.35 0.19 -4.78 119.36 105.78 2kt7 n ILE 53 Ca 0.09 -0.36 -0.14 0.00 -0.27 0.00 0.00 62.75 62.07 2kt7 n ILE 53 Cb 0.52 1.04 -0.07 0.00 -1.74 0.00 0.00 39.64 39.40 2kt7 n ILE 53 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2kt7 s ALA 54 N -0.29 -1.83 0.13 -1.28 0.00 -1.20 -5.05 121.76 112.24 2kt7 s ALA 54 Ca 0.00 1.75 -0.34 0.00 0.00 0.00 0.00 51.96 53.38 2kt7 s ALA 54 Cb 0.00 -0.85 -0.17 0.00 0.00 0.00 0.00 23.12 22.10 2kt7 s ALA 54 CO 0.00 -0.32 1.00 -2.30 0.00 0.00 0.00 175.76 174.14 2kt7 n PRO 55 N 1.89 0.62 -2.37 0.00 -0.02 -1.26 -4.35 135.00 129.50 2kt7 n PRO 55 Ca -0.15 0.22 -0.28 0.00 -2.02 0.00 0.00 63.50 61.27 2kt7 n PRO 55 Cb 0.56 -1.61 0.01 0.00 -0.02 0.00 0.00 33.50 32.44 2kt7 n PRO 55 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2kt7 s SER 56 N -0.22 6.09 0.30 2.55 1.04 -1.26 -4.76 113.70 117.44 2kt7 s SER 56 Ca 0.76 1.01 0.09 0.00 0.48 0.00 0.00 55.95 58.30 2kt7 s SER 56 Cb -0.97 -2.18 -0.06 0.00 0.10 0.00 0.00 66.02 62.90 2kt7 s SER 56 CO 0.54 -0.78 -0.12 -1.81 0.98 0.00 0.00 173.24 172.06 2kt7 s ASP 57 N -4.17 3.41 -0.24 7.02 1.11 -0.54 -4.97 116.67 118.28 2kt7 s ASP 57 Ca 0.51 -1.14 -0.04 0.00 0.18 0.00 0.00 52.55 52.06 2kt7 s ASP 57 Cb -0.11 -0.28 0.08 0.00 1.07 0.00 0.00 42.92 43.68 2kt7 s ASP 57 CO 0.47 -0.17 0.10 -0.89 1.18 0.00 0.00 175.17 175.87 2kt7 s THR 58 N -2.69 0.15 -0.30 -1.27 2.01 -1.26 0.37 115.64 112.65 2kt7 s THR 58 Ca 0.30 -0.64 -0.22 0.00 0.31 0.00 0.00 61.69 61.44 2kt7 s THR 58 Cb 0.01 -0.96 -0.00 0.00 0.01 0.00 0.00 72.50 71.55 2kt7 s THR 58 CO 0.14 -0.51 0.72 -0.76 -0.69 0.00 0.00 174.62 173.52 2kt7 s LEU 59 N 2.01 4.11 0.00 4.42 1.43 0.12 -4.89 118.68 125.88 2kt7 s LEU 59 Ca 0.06 0.59 0.25 0.00 -1.03 0.00 0.00 54.13 54.00 2kt7 s LEU 59 Cb -0.16 -2.97 0.41 0.00 0.03 0.00 0.00 46.19 43.50 2kt7 s LEU 59 CO -0.23 -0.54 1.38 1.07 0.23 0.00 0.00 176.35 178.26 2kt7 n THR 60 N 5.45 0.00 -2.31 5.49 5.66 -1.26 -0.60 114.28 126.71 2kt7 n THR 60 Ca 0.02 -0.39 -0.41 0.00 -3.05 0.00 0.00 64.05 60.21 2kt7 n THR 60 Cb 0.48 1.17 -0.03 0.00 -1.55 0.00 0.00 70.33 70.40 2kt7 n THR 60 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2kt7 s ASP 61 N -2.08 7.00 0.13 1.09 1.01 -1.26 -4.94 116.67 117.62 2kt7 s ASP 61 Ca 0.29 2.28 -0.29 0.00 0.71 0.00 0.00 52.55 55.55 2kt7 s ASP 61 Cb 0.20 -2.60 -0.06 0.00 1.01 0.00 0.00 42.92 41.47 2kt7 s ASP 61 CO 0.35 -0.45 1.59 0.22 0.21 0.00 0.00 175.17 177.09 2kt7 h TYR 62 N 5.48 -1.15 -2.33 4.23 3.20 -1.94 -3.22 116.97 121.23 2kt7 h TYR 62 Ca -0.44 0.04 -0.71 0.00 3.14 0.00 0.00 58.73 60.76 2kt7 h TYR 62 Cb 1.21 0.52 -0.18 0.00 1.54 0.00 0.00 36.73 39.83 2kt7 h TYR 62 CO 0.63 -0.47 1.02 -1.58 -1.64 0.00 0.00 178.16 176.12 2kt7 s HIS 63 N -5.90 3.27 -0.11 -3.82 2.46 -1.26 0.16 115.29 110.08 2kt7 s HIS 63 Ca -0.16 -1.68 -0.30 0.00 0.47 0.00 0.00 55.06 53.40 2kt7 s HIS 63 Cb 0.09 -4.29 -0.01 0.00 -0.13 0.00 0.00 32.58 28.24 2kt7 s HIS 63 CO 0.64 -1.45 1.02 1.52 -2.47 0.00 0.00 174.74 174.00 2kt7 s TYR 64 N 2.24 3.48 -0.24 3.88 1.13 0.53 -4.90 117.35 123.48 2kt7 s TYR 64 Ca 0.36 1.57 0.01 0.00 -1.41 0.00 0.00 57.07 57.60 2kt7 s TYR 64 Cb -0.04 -3.21 0.06 0.00 -1.10 0.00 0.00 41.96 37.67 2kt7 s TYR 64 CO -0.06 -0.30 -0.05 0.08 -2.51 0.00 0.00 175.55 172.71 2kt7 s VAL 65 N 2.12 1.54 0.66 -3.49 1.01 -1.26 -1.15 120.40 119.84 2kt7 s VAL 65 Ca 0.48 -1.26 -0.01 0.00 0.00 0.00 0.00 61.98 61.19 2kt7 s VAL 65 Cb -0.18 -1.82 0.08 0.00 0.00 0.00 0.00 36.38 34.46 2kt7 s VAL 65 CO 0.17 -0.13 0.93 -0.55 0.00 0.00 0.00 175.10 175.52 2kt7 s SER 66 N 1.38 4.71 0.01 3.32 0.15 -0.63 -5.03 113.70 117.62 2kt7 s SER 66 Ca -0.05 -0.08 -0.03 0.00 0.70 0.00 0.00 55.95 56.49 2kt7 s SER 66 Cb -0.19 -0.51 -0.01 0.00 -1.71 0.00 0.00 66.02 63.60 2kt7 s SER 66 CO -0.07 -1.59 0.04 0.42 1.20 0.00 0.00 173.24 173.24 2kt7 s THR 67 N -3.05 0.08 0.70 6.45 -4.23 -1.26 -4.96 115.64 109.38 2kt7 s THR 67 Ca 0.62 -0.67 -0.12 0.00 -1.18 0.00 0.00 61.69 60.34 2kt7 s THR 67 Cb -0.08 -0.29 0.17 0.00 1.34 0.00 0.00 72.50 73.65 2kt7 s THR 67 CO 0.42 -0.37 0.63 -0.81 -0.54 0.00 0.00 174.62 173.96 2kt7 n PRO 68 N 1.82 -2.20 -3.99 3.99 -0.04 -1.26 -5.07 135.00 128.24 2kt7 n PRO 68 Ca -0.21 -1.01 -0.16 0.00 -0.04 0.00 0.00 63.50 62.08 2kt7 n PRO 68 Cb 0.56 -0.93 -0.15 0.00 -0.04 0.00 0.00 33.50 32.93 2kt7 n PRO 68 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2kt7 s LYS 69 N -4.43 0.32 -1.14 0.54 1.02 -1.26 -5.07 119.74 109.71 2kt7 s LYS 69 Ca 0.41 -0.02 -0.22 0.00 0.02 0.00 0.00 55.97 56.16 2kt7 s LYS 69 Cb -0.04 -0.40 -0.09 0.00 -0.52 0.00 0.00 37.83 36.78 2kt7 s LYS 69 CO 0.31 -0.04 1.92 -0.40 -0.92 0.00 0.00 175.35 176.22 2kt7 n ASP 70 N 3.65 3.14 -4.66 2.83 5.75 -1.26 -4.92 116.55 121.08 2kt7 n ASP 70 Ca -0.21 -2.71 -0.41 0.00 -0.01 0.00 0.00 54.79 51.45 2kt7 n ASP 70 Cb 0.54 -1.66 -0.05 0.00 -1.03 0.00 0.00 41.12 38.92 2kt7 n ASP 70 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2kt7 s ILE 71 N 9.81 4.92 -0.22 2.12 1.01 -1.26 -5.00 121.20 132.59 2kt7 s ILE 71 Ca 0.66 1.42 -0.29 0.00 0.00 0.00 0.00 60.65 62.45 2kt7 s ILE 71 Cb 0.02 -4.05 -0.06 0.00 0.01 0.00 0.00 42.46 38.38 2kt7 s ILE 71 CO 0.13 0.03 2.21 -0.81 0.00 0.00 0.00 174.94 176.50 2kt7 n PRO 72 N 5.41 1.93 -0.24 2.79 -0.04 -1.26 -1.28 135.00 142.32 2kt7 n PRO 72 Ca 0.02 0.54 0.00 0.00 -0.04 0.00 0.00 63.50 64.02 2kt7 n PRO 72 Cb 0.49 -3.18 0.00 0.00 -0.04 0.00 0.00 33.50 30.77 2kt7 n PRO 72 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2kt7 n GLY 73 N 5.78 0.88 3.09 0.55 0.00 -1.26 -5.05 105.19 109.17 2kt7 n GLY 73 Ca 0.30 -0.01 -0.19 0.00 0.00 0.00 0.00 46.02 46.12 2kt7 n GLY 73 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2kt7 s TYR 74 N -2.00 1.02 -0.19 1.61 2.02 -0.40 -0.52 117.35 118.88 2kt7 s TYR 74 Ca 0.00 -0.30 -0.01 0.00 -0.37 0.00 0.00 57.07 56.40 2kt7 s TYR 74 Cb 0.00 -0.62 0.01 0.00 -0.40 0.00 0.00 41.96 40.95 2kt7 s TYR 74 CO 0.00 0.00 -0.15 0.21 -1.57 0.00 0.00 175.55 174.04 2kt7 s LYS 75 N -0.84 3.13 -0.28 -0.62 2.20 -0.67 -4.54 119.74 118.13 2kt7 s LYS 75 Ca 0.01 -0.76 -0.32 0.00 -0.36 0.00 0.00 55.97 54.54 2kt7 s LYS 75 Cb -0.06 -2.71 -0.08 0.00 -1.51 0.00 0.00 37.83 33.46 2kt7 s LYS 75 CO 0.01 -0.18 2.20 -0.11 -0.36 0.00 0.00 175.35 176.90 2kt7 n LEU 76 N 4.62 2.71 0.20 5.43 7.94 -1.26 -0.04 117.00 136.60 2kt7 n LEU 76 Ca -0.20 0.33 -0.10 0.00 -1.11 0.00 0.00 56.01 54.92 2kt7 n LEU 76 Cb 0.50 -1.41 -0.05 0.00 0.53 0.00 0.00 43.42 42.99 2kt7 n LEU 76 CO 0.27 -0.69 0.30 -0.09 -1.11 0.00 0.00 177.39 176.07 2kt7 h ARG 77 N 13.59 -0.54 -2.98 1.96 2.43 -0.61 -3.47 114.38 124.76 2kt7 h ARG 77 Ca -0.34 0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 58.79 2kt7 h ARG 77 Cb 1.28 0.12 -0.16 0.00 -0.42 0.00 0.00 29.97 30.79 2kt7 h ARG 77 CO 0.99 -0.29 -0.05 -1.83 -1.51 0.00 0.00 179.97 177.28 2kt7 s GLU 78 N -3.71 0.97 -0.25 0.20 -1.05 -1.18 -5.05 118.70 108.63 2kt7 s GLU 78 Ca -0.10 -0.36 -0.12 0.00 -0.15 0.00 0.00 54.97 54.24 2kt7 s GLU 78 Cb 0.01 0.44 -0.05 0.00 -0.44 0.00 0.00 34.13 34.09 2kt7 s GLU 78 CO 0.34 -0.35 0.25 0.42 0.95 0.00 0.00 175.26 176.87 2kt7 s ILE 79 N -2.61 5.28 0.58 1.83 1.01 -1.26 -3.38 121.20 122.65 2kt7 s ILE 79 Ca -0.04 0.34 -0.20 0.00 0.00 0.00 0.00 60.65 60.74 2kt7 s ILE 79 Cb -0.01 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 2kt7 s ILE 79 CO -0.03 0.26 1.28 -0.81 0.00 0.00 0.00 174.94 175.64 2kt7 n PRO 80 N 4.76 1.42 0.27 2.79 -0.04 -1.26 -4.87 135.00 138.07 2kt7 n PRO 80 Ca -0.12 0.53 0.18 0.00 -0.04 0.00 0.00 63.50 64.05 2kt7 n PRO 80 Cb 0.52 -2.50 0.93 0.00 -0.04 0.00 0.00 33.50 32.41 2kt7 n PRO 80 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 2kt7 h HIS 81 N 1.06 0.00 -2.17 0.54 2.07 -1.97 -2.70 115.15 111.98 2kt7 h HIS 81 Ca -0.50 0.00 -0.77 0.00 -2.85 0.00 0.00 60.37 56.24 2kt7 h HIS 81 Cb 1.32 0.00 -0.29 0.00 2.57 0.00 0.00 27.41 31.01 2kt7 h HIS 81 CO 0.43 0.00 0.83 -1.71 -3.07 0.00 0.00 177.93 174.41 2kt7 n ASN 82 N -3.39 7.05 -0.03 3.10 5.15 -1.26 -4.55 115.26 121.32 2kt7 n ASN 82 Ca -0.00 -3.73 -0.03 0.00 -0.60 0.00 0.00 54.58 50.22 2kt7 n ASN 82 Cb 0.27 -1.06 -0.04 0.00 -0.53 0.00 0.00 39.78 38.42 2kt7 n ASN 82 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2kt7 n ALA 83 N -0.21 1.86 -3.67 5.20 0.00 -1.02 -4.54 120.51 118.14 2kt7 n ALA 83 Ca 0.47 -0.36 -0.19 0.00 0.00 0.00 0.00 53.44 53.36 2kt7 n ALA 83 Cb 0.28 0.14 -0.16 0.00 0.00 0.00 0.00 19.45 19.70 2kt7 n ALA 83 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2kt7 s THR 84 N -2.13 0.35 -2.79 0.00 -4.23 -1.26 -1.60 115.64 103.98 2kt7 s THR 84 Ca -0.03 -0.01 0.00 0.00 -1.18 0.00 0.00 61.69 60.48 2kt7 s THR 84 Cb 0.02 -0.41 0.00 0.00 1.34 0.00 0.00 72.50 73.44 2kt7 s THR 84 CO 0.22 0.18 0.00 0.61 -0.54 0.00 0.00 174.62 175.10 2kt7 n GLY 85 N 4.13 -0.83 3.68 3.99 0.00 -0.30 -5.02 105.19 110.83 2kt7 n GLY 85 Ca -0.25 -0.95 -0.33 0.00 0.00 0.00 0.00 46.02 44.50 2kt7 n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kt7 s ASN 86 N -4.00 5.10 -0.74 1.61 4.22 -1.26 -0.34 114.94 119.52 2kt7 s ASN 86 Ca 0.00 -0.00 -0.26 0.00 -2.14 0.00 0.00 52.86 50.46 2kt7 s ASN 86 Cb 0.00 -1.33 -0.05 0.00 1.28 0.00 0.00 41.25 41.14 2kt7 s ASN 86 CO 0.00 0.29 2.02 -0.63 -2.04 0.00 0.00 177.10 176.74 2kt7 s ILE 87 N -1.06 3.31 -0.14 0.54 1.01 0.12 -4.71 121.20 120.28 2kt7 s ILE 87 Ca 0.19 -0.08 0.17 0.00 0.00 0.00 0.00 60.65 60.93 2kt7 s ILE 87 Cb -0.11 -3.76 -0.24 0.00 0.01 0.00 0.00 42.46 38.36 2kt7 s ILE 87 CO 0.09 -0.72 0.30 0.35 0.00 0.00 0.00 174.94 174.97 2kt7 n THR 88 N 7.77 1.26 -4.64 2.92 -2.24 -1.26 -4.98 114.28 113.11 2kt7 n THR 88 Ca 0.34 -0.79 -0.29 0.00 -2.27 0.00 0.00 64.05 61.04 2kt7 n THR 88 Cb 0.49 -0.55 -0.10 0.00 -2.10 0.00 0.00 70.33 68.07 2kt7 n THR 88 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2kt7 s ASP 89 N -5.53 3.76 0.30 3.42 1.01 -1.26 -5.17 116.67 113.20 2kt7 s ASP 89 Ca -0.08 -1.46 0.07 0.00 0.71 0.00 0.00 52.55 51.78 2kt7 s ASP 89 Cb 0.08 -0.08 -0.03 0.00 1.01 0.00 0.00 42.92 43.90 2kt7 s ASP 89 CO 0.84 -0.60 0.32 0.28 0.21 0.00 0.00 175.17 176.22 2kt7 s THR 90 N -2.83 4.22 -1.21 -1.27 -1.32 -1.26 -4.58 115.64 107.38 2kt7 s THR 90 Ca 0.27 -1.23 -0.07 0.00 -1.21 0.00 0.00 61.69 59.44 2kt7 s THR 90 Cb 0.07 -3.42 0.01 0.00 -1.51 0.00 0.00 72.50 67.65 2kt7 s THR 90 CO 0.13 -0.25 0.97 0.61 -2.21 0.00 0.00 174.62 173.88 2kt7 n GLY 91 N -1.39 -0.36 3.62 6.08 0.00 -1.18 -4.95 105.19 107.01 2kt7 n GLY 91 Ca -0.04 0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 2kt7 n GLY 91 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2kt7 s ILE 92 N -3.25 4.32 -0.23 -0.61 1.01 -0.96 -4.90 121.20 116.58 2kt7 s ILE 92 Ca 0.48 1.44 -0.13 0.00 0.00 0.00 0.00 60.65 62.44 2kt7 s ILE 92 Cb -0.21 -4.51 -0.05 0.00 0.01 0.00 0.00 42.46 37.71 2kt7 s ILE 92 CO 0.59 -0.77 0.26 -0.63 0.00 0.00 0.00 174.94 174.39 2kt7 s ILE 93 N 4.14 5.29 -0.46 2.92 1.01 -1.26 0.06 121.20 132.90 2kt7 s ILE 93 Ca 0.47 0.38 -0.10 0.00 0.00 0.00 0.00 60.65 61.40 2kt7 s ILE 93 Cb -0.10 -3.59 0.10 0.00 0.01 0.00 0.00 42.46 38.88 2kt7 s ILE 93 CO 0.25 0.29 0.33 -0.69 0.00 0.00 0.00 174.94 175.12 2kt7 s VAL 94 N 1.28 4.41 -0.41 2.92 1.01 -0.09 -4.95 120.40 124.57 2kt7 s VAL 94 Ca 0.12 -1.53 -0.15 0.00 0.00 0.00 0.00 61.98 60.42 2kt7 s VAL 94 Cb -0.14 -3.78 0.02 0.00 0.00 0.00 0.00 36.38 32.48 2kt7 s VAL 94 CO 0.07 -0.65 0.30 -0.13 0.00 0.00 0.00 175.10 174.69 2kt7 s ARG 95 N 1.44 2.96 -0.23 2.72 0.52 -1.26 0.39 118.95 125.49 2kt7 s ARG 95 Ca 0.04 -1.04 -0.23 0.00 -0.52 0.00 0.00 55.73 53.97 2kt7 s ARG 95 Cb -0.25 -3.98 -0.01 0.00 0.52 0.00 0.00 34.95 31.23 2kt7 s ARG 95 CO 0.02 -0.77 0.76 0.71 0.02 0.00 0.00 175.30 176.04 2kt7 s TYR 96 N 1.67 3.32 -0.09 -0.53 1.51 -0.19 -4.33 117.35 118.72 2kt7 s TYR 96 Ca 0.05 1.05 -0.20 0.00 -1.01 0.00 0.00 57.07 56.96 2kt7 s TYR 96 Cb -0.19 -2.97 -0.04 0.00 -0.11 0.00 0.00 41.96 38.65 2kt7 s TYR 96 CO 0.10 -0.34 0.55 0.42 -1.11 0.00 0.00 175.55 175.17 2kt7 s ILE 97 N 2.58 5.13 0.22 2.71 -1.09 -1.22 -0.96 121.20 128.56 2kt7 s ILE 97 Ca 0.33 1.11 0.11 0.00 -2.23 0.00 0.00 60.65 59.97 2kt7 s ILE 97 Cb -0.16 -3.89 -0.05 0.00 -1.58 0.00 0.00 42.46 36.79 2kt7 s ILE 97 CO 0.08 0.32 -0.22 -0.31 -1.23 0.00 0.00 174.94 173.58 2kt7 s TYR 98 N 0.59 2.31 -0.32 3.97 1.51 0.71 0.13 117.35 126.25 2kt7 s TYR 98 Ca 0.30 -0.35 -0.10 0.00 -1.01 0.00 0.00 57.07 55.91 2kt7 s TYR 98 Cb -0.16 -1.11 -0.01 0.00 -0.11 0.00 0.00 41.96 40.57 2kt7 s TYR 98 CO 0.13 0.56 0.17 -0.51 -1.11 0.00 0.00 175.55 174.79 2kt7 s ASP 99 N -2.90 5.64 -0.04 2.29 1.01 0.95 -1.01 116.67 122.61 2kt7 s ASP 99 Ca 0.23 -0.54 -0.31 0.00 0.71 0.00 0.00 52.55 52.65 2kt7 s ASP 99 Cb -0.07 -2.02 -0.09 0.00 1.01 0.00 0.00 42.92 41.74 2kt7 s ASP 99 CO 0.11 -0.21 2.00 1.17 0.21 0.00 0.00 175.17 178.46 2kt7 n LYS 100 N 5.00 2.55 -2.87 8.23 4.81 -1.26 -1.67 118.16 132.96 2kt7 n LYS 100 Ca -0.14 0.90 -0.42 0.00 -0.87 0.00 0.00 58.31 57.79 2kt7 n LYS 100 Cb 0.49 -2.96 -0.04 0.00 0.02 0.00 0.00 35.03 32.53 2kt7 n LYS 100 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2kt7 s ILE 101 N 5.09 4.68 0.02 3.15 1.01 0.32 -4.90 121.20 130.57 2kt7 s ILE 101 Ca 0.92 1.18 -0.08 0.00 0.00 0.00 0.00 60.65 62.68 2kt7 s ILE 101 Cb -0.48 -4.25 -0.30 0.00 0.01 0.00 0.00 42.46 37.44 2kt7 s ILE 101 CO 0.43 -0.40 0.94 0.40 0.00 0.00 0.00 174.94 176.31 2kt7 h ILE 102 N 5.71 1.24 -1.80 2.92 5.03 -1.91 -3.47 117.51 125.24 2kt7 h ILE 102 Ca -0.24 -2.81 0.05 0.00 -0.12 0.00 0.00 64.86 61.75 2kt7 h ILE 102 Cb 1.09 2.88 -0.03 0.00 -3.03 0.00 0.00 36.82 37.73 2kt7 h ILE 102 CO 0.94 0.84 -0.52 -0.67 -0.68 0.00 0.00 178.15 178.06 2kt7 n ASP 103 N -3.56 -4.06 -1.61 1.72 2.03 -1.26 -4.59 116.55 105.23 2kt7 n ASP 103 Ca -0.16 0.87 -0.10 0.00 0.52 0.00 0.00 54.79 55.92 2kt7 n ASP 103 Cb 1.06 -2.11 0.04 0.00 -0.72 0.00 0.00 41.12 39.39 2kt7 n ASP 103 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2kt7 n VAL 104 N -2.35 2.17 -0.26 5.18 0.24 -1.26 -4.57 118.33 117.47 2kt7 n VAL 104 Ca -0.01 -1.00 -0.01 0.00 -2.04 0.00 0.00 64.34 61.27 2kt7 n VAL 104 Cb 0.27 -1.13 0.00 0.00 -1.47 0.00 0.00 33.84 31.51 2kt7 n VAL 104 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2kt7 n SER 105 N 0.35 5.00 -4.55 -1.34 2.88 -1.26 -4.82 113.62 109.87 2kt7 n SER 105 Ca 0.20 -2.39 -0.41 0.00 -1.33 0.00 0.00 58.87 54.94 2kt7 n SER 105 Cb 0.71 -1.01 -0.03 0.00 -0.75 0.00 0.00 64.21 63.13 2kt7 n SER 105 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2kt7 s TYR 106 N -0.16 2.58 -0.09 0.66 2.02 -1.26 -4.98 117.35 116.12 2kt7 s TYR 106 Ca 0.03 -0.87 0.00 0.00 -0.37 0.00 0.00 57.07 55.86 2kt7 s TYR 106 Cb 0.02 -4.66 -0.03 0.00 -0.40 0.00 0.00 41.96 36.90 2kt7 s TYR 106 CO 0.00 -1.90 -0.08 0.54 -1.57 0.00 0.00 175.55 172.54 2kt7 s VAL 107 N 4.79 3.57 -0.42 0.71 0.11 -1.26 -5.03 120.40 122.87 2kt7 s VAL 107 Ca 0.44 -0.51 0.05 0.00 -2.93 0.00 0.00 61.98 59.03 2kt7 s VAL 107 Cb -0.01 -2.48 0.59 0.00 -1.53 0.00 0.00 36.38 32.95 2kt7 s VAL 107 CO -0.09 0.57 1.77 0.47 -3.33 0.00 0.00 175.10 174.49 2kt7 n ASP 108 N 2.62 3.88 0.03 3.54 9.92 -1.26 -4.63 116.55 130.65 2kt7 n ASP 108 Ca -0.18 -3.70 -0.13 0.00 -0.53 0.00 0.00 54.79 50.25 2kt7 n ASP 108 Cb 0.53 -0.78 -0.02 0.00 -0.64 0.00 0.00 41.12 40.21 2kt7 n ASP 108 CO 0.00 0.00 0.00 1.05 0.13 0.00 0.00 177.20 178.38 2kt7 h GLU 109 N 1.17 0.56 -6.23 -1.24 4.11 -2.01 -3.45 114.58 107.48 2kt7 h GLU 109 Ca 0.50 -0.48 -0.57 0.00 0.07 0.00 0.00 59.36 58.88 2kt7 h GLU 109 Cb 2.20 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 31.52 2kt7 h GLU 109 CO 0.94 1.11 -0.14 0.95 0.07 0.00 0.00 179.01 181.93 2kt7 s THR 110 N -3.60 4.94 -1.34 -1.06 -4.23 -1.26 -4.99 115.64 104.10 2kt7 s THR 110 Ca -0.07 0.71 -0.16 0.00 -1.18 0.00 0.00 61.69 60.98 2kt7 s THR 110 Cb 0.09 -3.71 0.02 0.00 1.34 0.00 0.00 72.50 70.25 2kt7 s THR 110 CO 0.87 0.28 2.10 0.61 -0.54 0.00 0.00 174.62 177.94 2kt7 n GLY 111 N 0.90 3.78 0.07 3.99 0.00 -1.26 -4.68 105.19 107.98 2kt7 n GLY 111 Ca -0.07 -1.51 -0.07 0.00 0.00 0.00 0.00 46.02 44.38 2kt7 n GLY 111 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2kt7 h LYS 112 N 6.61 0.00 -3.16 1.61 3.64 -1.95 -3.46 116.57 119.87 2kt7 h LYS 112 Ca 0.52 0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 59.35 2kt7 h LYS 112 Cb 0.69 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 32.11 2kt7 h LYS 112 CO 1.80 0.31 -0.77 -0.51 -2.27 0.00 0.00 179.45 178.01 2kt7 s ASP 113 N -5.91 3.67 -0.49 4.20 1.01 -1.26 -5.04 116.67 112.85 2kt7 s ASP 113 Ca -0.12 -1.39 0.07 0.00 0.71 0.00 0.00 52.55 51.82 2kt7 s ASP 113 Cb 0.01 -0.57 0.26 0.00 1.01 0.00 0.00 42.92 43.63 2kt7 s ASP 113 CO 0.27 -0.42 0.65 0.00 0.21 0.00 0.00 175.17 175.88 2kt7 n LEU 114 N 5.07 1.83 -4.68 1.23 -0.00 -1.26 -5.09 117.00 114.10 2kt7 n LEU 114 Ca -0.05 -5.06 -0.35 0.00 -0.00 0.00 0.00 56.01 50.56 2kt7 n LEU 114 Cb 0.43 0.08 -0.09 0.00 -0.00 0.00 0.00 43.42 43.84 2kt7 n LEU 114 CO 0.08 2.10 -0.24 -0.22 -0.00 0.00 0.00 177.39 179.10 2kt7 s LEU 115 N -1.89 3.90 -0.40 1.47 2.96 -1.26 -5.04 118.68 118.41 2kt7 s LEU 115 Ca 0.38 0.15 -0.33 0.00 -0.22 0.00 0.00 54.13 54.10 2kt7 s LEU 115 Cb 0.18 -1.97 -0.11 0.00 0.50 0.00 0.00 46.19 44.78 2kt7 s LEU 115 CO -0.07 0.22 2.25 -2.65 -1.32 0.00 0.00 176.35 174.78 2kt7 n PRO 116 N 3.23 1.05 -3.01 0.98 -0.02 -1.26 -4.93 135.00 131.05 2kt7 n PRO 116 Ca -0.17 0.25 -0.40 0.00 -2.02 0.00 0.00 63.50 61.16 2kt7 n PRO 116 Cb 0.53 -2.55 -0.05 0.00 -0.02 0.00 0.00 33.50 31.41 2kt7 n PRO 116 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2kt7 s VAL 117 N 8.04 4.96 -0.89 -1.45 0.11 -1.26 -5.00 120.40 124.91 2kt7 s VAL 117 Ca 1.10 1.53 -0.25 0.00 -2.93 0.00 0.00 61.98 61.44 2kt7 s VAL 117 Cb -0.78 -4.08 0.02 0.00 -1.53 0.00 0.00 36.38 30.01 2kt7 s VAL 117 CO 0.46 0.27 1.54 -0.69 -3.33 0.00 0.00 175.10 173.35 2kt7 s VAL 118 N 0.61 3.72 0.02 2.04 1.01 -1.26 -4.94 120.40 121.59 2kt7 s VAL 118 Ca 0.39 -0.29 -0.07 0.00 0.00 0.00 0.00 61.98 62.01 2kt7 s VAL 118 Cb -0.19 -4.71 -0.00 0.00 0.00 0.00 0.00 36.38 31.48 2kt7 s VAL 118 CO 0.20 -1.63 0.12 -1.83 0.00 0.00 0.00 175.10 171.96 2kt7 s GLU 119 N 5.76 0.52 -1.01 2.72 -1.05 -1.26 -5.10 118.70 119.28 2kt7 s GLU 119 Ca 0.50 -0.53 -0.23 0.00 -0.15 0.00 0.00 54.97 54.56 2kt7 s GLU 119 Cb -0.05 0.21 0.05 0.00 -0.44 0.00 0.00 34.13 33.90 2kt7 s GLU 119 CO 0.01 -0.13 1.47 0.42 0.95 0.00 0.00 175.26 177.98 2kt7 s ILE 120 N -1.82 3.90 0.06 1.83 1.09 -1.26 -4.98 121.20 120.02 2kt7 s ILE 120 Ca -0.11 -0.73 -0.30 0.00 -1.10 0.00 0.00 60.65 58.40 2kt7 s ILE 120 Cb -0.05 -5.02 -0.05 0.00 -1.06 0.00 0.00 42.46 36.28 2kt7 s ILE 120 CO -0.01 -1.90 1.12 0.27 -0.10 0.00 0.00 174.94 174.32 2kt7 s ILE 121 N 5.18 4.26 0.04 2.92 -4.36 -1.26 -5.05 121.20 122.94 2kt7 s ILE 121 Ca 0.47 1.66 0.03 0.00 -0.26 0.00 0.00 60.65 62.55 2kt7 s ILE 121 Cb -0.00 -4.06 -0.02 0.00 1.25 0.00 0.00 42.46 39.62 2kt7 s ILE 121 CO -0.09 0.15 -0.10 0.54 0.24 0.00 0.00 174.94 175.68 2kt7 s ASN 122 N 0.89 1.13 0.00 4.36 2.20 -1.26 -5.14 114.94 117.12 2kt7 s ASN 122 Ca 0.56 -0.49 0.00 0.00 -0.94 0.00 0.00 52.86 51.99 2kt7 s ASN 122 Cb -0.27 -0.02 0.00 0.00 -2.00 0.00 0.00 41.25 38.96 2kt7 s ASN 122 CO 0.29 -0.10 0.00 -0.24 -2.94 0.00 0.00 177.10 174.11 2kt7 n SER 123 N 1.69 0.00 0.00 3.54 2.88 -1.26 -5.04 113.62 115.43 2kt7 n SER 123 Ca -0.20 -0.30 0.00 0.00 -1.33 0.00 0.00 58.87 57.04 2kt7 n SER 123 Cb 0.55 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 2kt7 n SER 123 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2kt7 n GLU 124 N 0.00 0.00 0.00 -1.46 2.13 -1.26 -4.45 120.64 115.60 2kt7 n GLU 124 Ca 0.00 0.00 0.05 0.00 0.66 0.00 0.00 57.16 57.87 2kt7 n GLU 124 Cb 0.00 0.00 0.24 0.00 0.27 0.00 0.00 31.44 31.95 2kt7 n GLU 124 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2kt7 n ALA 125 N 0.00 1.52 0.77 4.31 0.00 -1.26 -3.56 120.51 122.29 2kt7 n ALA 125 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 53.44 53.38 2kt7 n ALA 125 Cb 0.00 -1.18 0.02 0.00 0.00 0.00 0.00 19.45 18.30 2kt7 n ALA 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kt7 n ALA 126 N -1.47 2.80 -2.09 0.00 0.00 -1.26 -4.90 120.51 113.59 2kt7 n ALA 126 Ca 0.03 -0.29 -0.40 0.00 0.00 0.00 0.00 53.44 52.78 2kt7 n ALA 126 Cb 0.12 -1.04 -0.06 0.00 0.00 0.00 0.00 19.45 18.48 2kt7 n ALA 126 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2kt7 s VAL 127 N -0.53 4.44 -0.58 0.00 -7.23 -1.23 -5.03 120.40 110.23 2kt7 s VAL 127 Ca 0.06 1.78 -0.12 0.00 -1.81 0.00 0.00 61.98 61.89 2kt7 s VAL 127 Cb 0.05 -4.18 0.15 0.00 0.56 0.00 0.00 36.38 32.96 2kt7 s VAL 127 CO 0.01 0.46 0.50 -0.76 -0.31 0.00 0.00 175.10 175.00 2kt7 s LEU 128 N -0.73 6.08 1.20 1.32 2.01 -1.26 -5.08 118.68 122.22 2kt7 s LEU 128 Ca 0.38 -2.09 -0.20 0.00 0.01 0.00 0.00 54.13 52.24 2kt7 s LEU 128 Cb -0.23 -2.12 0.29 0.00 0.01 0.00 0.00 46.19 44.15 2kt7 s LEU 128 CO 0.27 -0.71 1.15 -1.83 1.01 0.00 0.00 176.35 176.24 2kt7 s GLU 129 N 1.12 -1.26 0.21 1.70 -1.05 -1.26 -5.11 118.70 113.04 2kt7 s GLU 129 Ca 0.08 -0.25 -0.05 0.00 -0.15 0.00 0.00 54.97 54.60 2kt7 s GLU 129 Cb -0.24 -1.61 0.02 0.00 -0.44 0.00 0.00 34.13 31.86 2kt7 s GLU 129 CO -0.01 -3.70 0.36 -2.39 0.95 0.00 0.00 175.26 170.47 2kt7 n HIS 130 N -4.72 -1.42 -4.19 4.83 1.44 -1.26 -5.19 115.22 104.72 2kt7 n HIS 130 Ca 0.15 -1.15 -0.14 0.00 -2.01 0.00 0.00 57.72 54.57 2kt7 n HIS 130 Cb 0.60 0.42 -0.11 0.00 0.12 0.00 0.00 29.99 31.02 2kt7 n HIS 130 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 2kt7 s HIS 131 N -4.63 1.07 0.35 -1.40 2.46 -1.26 -5.17 115.29 106.71 2kt7 s HIS 131 Ca 0.12 -0.70 0.05 0.00 0.47 0.00 0.00 55.06 55.00 2kt7 s HIS 131 Cb -0.02 -0.58 -0.01 0.00 -0.13 0.00 0.00 32.58 31.84 2kt7 s HIS 131 CO 0.09 -0.00 0.50 -1.01 -2.47 0.00 0.00 174.74 171.85 2kt7 s HIS 132 N -2.70 3.18 0.05 3.88 3.76 -1.26 -5.13 115.29 117.06 2kt7 s HIS 132 Ca 0.08 -0.10 0.04 0.00 -0.15 0.00 0.00 55.06 54.93 2kt7 s HIS 132 Cb -0.01 -2.01 -0.02 0.00 1.11 0.00 0.00 32.58 31.64 2kt7 s HIS 132 CO -0.00 -0.03 -0.12 -1.01 -0.85 0.00 0.00 174.74 172.73 2kt7 s HIS 133 N -2.23 0.99 -0.23 1.40 3.76 -1.26 -5.14 115.29 112.59 2kt7 s HIS 133 Ca 0.44 -0.41 0.02 0.00 -0.15 0.00 0.00 55.06 54.97 2kt7 s HIS 133 Cb -0.10 -0.58 0.04 0.00 1.11 0.00 0.00 32.58 33.06 2kt7 s HIS 133 CO 0.32 0.00 -0.14 -1.01 -0.85 0.00 0.00 174.74 173.06 2kt7 s HIS 134 N -1.08 3.06 0.00 1.40 3.76 -1.26 -5.38 115.29 115.79 2kt7 s HIS 134 Ca -0.03 -2.05 0.00 0.00 -0.15 0.00 0.00 55.06 52.83 2kt7 s HIS 134 Cb -0.09 -1.91 0.00 0.00 1.11 0.00 0.00 32.58 31.69 2kt7 s HIS 134 CO 0.01 -0.85 0.00 0.72 -0.85 0.00 0.00 174.74 173.77