#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5q s ASP 2 N 0.00 0.44 -0.00 3.17 2.15 -1.26 -5.01 116.67 116.16 2k5q s ASP 2 Ca 0.00 -0.04 0.05 0.00 0.43 0.00 0.00 52.55 52.99 2k5q s ASP 2 Cb 0.00 -0.20 -0.06 0.00 -0.30 0.00 0.00 42.92 42.36 2k5q s ASP 2 CO 0.00 -0.07 0.20 0.00 -0.17 0.00 0.00 175.17 175.13 2k5q n LEU 3 N 3.88 0.19 -0.02 -1.34 -0.00 -1.26 -4.75 117.00 113.70 2k5q n LEU 3 Ca -0.24 -0.39 -0.19 0.00 -0.00 0.00 0.00 56.01 55.18 2k5q n LEU 3 Cb 0.52 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.81 2k5q n LEU 3 CO 0.23 0.05 -0.15 0.78 -0.00 0.00 0.00 177.39 178.30 2k5q h ASN 4 N 0.00 0.25 0.00 1.45 2.35 -2.05 -3.44 115.58 114.13 2k5q h ASN 4 Ca 0.00 -0.85 0.00 0.00 -0.55 0.00 0.00 56.30 54.90 2k5q h ASN 4 Cb 0.15 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.44 2k5q h ASN 4 CO 0.00 1.41 0.00 0.54 -1.65 0.00 0.00 177.43 177.73 2k5q n ARG 5 N -4.21 0.00 0.00 0.81 3.00 -1.26 -4.85 116.66 110.15 2k5q n ARG 5 Ca -0.20 0.04 0.00 0.00 -0.01 0.00 0.00 57.85 57.68 2k5q n ARG 5 Cb 0.75 -0.29 0.00 0.00 0.00 0.00 0.00 32.46 32.92 2k5q n ARG 5 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.63 176.30 2k5q n MET 6 N -1.39 0.00 0.00 5.56 2.81 -1.26 -1.41 117.12 121.43 2k5q n MET 6 Ca 0.00 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 56.00 2k5q n MET 6 Cb 0.00 0.00 0.04 0.00 -0.71 0.00 0.00 33.22 32.55 2k5q n MET 6 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2k5q n GLY 7 N 0.00 0.49 3.69 3.03 0.00 -1.26 -4.92 105.19 106.23 2k5q n GLY 7 Ca 0.00 -0.66 -0.41 0.00 0.00 0.00 0.00 46.02 44.95 2k5q n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k5q s LYS 8 N -2.23 4.38 0.55 1.61 3.01 -0.50 -5.06 119.74 121.51 2k5q s LYS 8 Ca 0.23 0.95 -0.04 0.00 -1.01 0.00 0.00 55.97 56.10 2k5q s LYS 8 Cb 0.19 -3.50 0.01 0.00 -1.01 0.00 0.00 37.83 33.51 2k5q s LYS 8 CO 0.44 -0.11 0.83 -0.51 0.51 0.00 0.00 175.35 176.51 2k5q s ASP 9 N 0.98 5.62 -0.22 2.83 1.01 -1.26 -4.92 116.67 120.70 2k5q s ASP 9 Ca 0.38 0.55 -0.10 0.00 0.71 0.00 0.00 52.55 54.09 2k5q s ASP 9 Cb -0.17 -1.60 -0.05 0.00 1.01 0.00 0.00 42.92 42.11 2k5q s ASP 9 CO 0.16 -0.98 0.14 -1.83 0.21 0.00 0.00 175.17 172.87 2k5q s GLU 10 N -4.87 4.08 -0.05 8.23 1.03 -1.26 -3.06 118.70 122.80 2k5q s GLU 10 Ca 0.53 -0.27 -0.15 0.00 0.03 0.00 0.00 54.97 55.10 2k5q s GLU 10 Cb -0.10 -3.46 -0.05 0.00 -0.80 0.00 0.00 34.13 29.72 2k5q s GLU 10 CO 0.43 0.15 0.41 0.71 -1.33 0.00 0.00 175.26 175.63 2k5q s TYR 11 N 0.79 3.63 -0.47 4.83 1.51 -0.10 -4.81 117.35 122.73 2k5q s TYR 11 Ca 0.07 0.91 -0.26 0.00 -1.01 0.00 0.00 57.07 56.78 2k5q s TYR 11 Cb -0.13 -2.37 0.03 0.00 -0.11 0.00 0.00 41.96 39.39 2k5q s TYR 11 CO 0.02 0.46 0.97 0.71 -1.11 0.00 0.00 175.55 176.60 2k5q s TYR 12 N -0.40 2.89 -0.00 2.71 2.02 -1.24 -1.24 117.35 122.09 2k5q s TYR 12 Ca 0.23 0.41 0.06 0.00 -0.37 0.00 0.00 57.07 57.41 2k5q s TYR 12 Cb -0.16 -4.07 -0.03 0.00 -0.40 0.00 0.00 41.96 37.30 2k5q s TYR 12 CO 0.11 -1.16 -0.19 0.14 -1.57 0.00 0.00 175.55 172.88 2k5q s VAL 13 N 3.92 2.65 -0.19 0.71 -7.23 -0.74 -3.42 120.40 116.10 2k5q s VAL 13 Ca 0.39 -1.04 -0.06 0.00 -1.81 0.00 0.00 61.98 59.46 2k5q s VAL 13 Cb -0.10 -2.04 -0.03 0.00 0.56 0.00 0.00 36.38 34.77 2k5q s VAL 13 CO 0.27 0.48 0.02 -1.58 -0.31 0.00 0.00 175.10 173.98 2k5q s GLN 14 N -1.00 3.79 -0.32 4.82 0.74 -1.26 -0.98 119.66 125.45 2k5q s GLN 14 Ca 0.12 -0.44 -0.28 0.00 0.05 0.00 0.00 55.36 54.81 2k5q s GLN 14 Cb -0.10 -3.12 -0.02 0.00 1.10 0.00 0.00 33.01 30.87 2k5q s GLN 14 CO 0.02 0.16 1.81 0.42 -0.55 0.00 0.00 175.29 177.16 2k5q s ILE 15 N 0.63 3.46 -0.01 -2.34 -1.09 -0.89 -4.83 121.20 116.12 2k5q s ILE 15 Ca 0.01 0.47 -0.03 0.00 -2.23 0.00 0.00 60.65 58.87 2k5q s ILE 15 Cb -0.14 -3.62 -0.01 0.00 -1.58 0.00 0.00 42.46 37.12 2k5q s ILE 15 CO 0.02 -0.39 -0.05 0.35 -1.23 0.00 0.00 174.94 173.64 2k5q n THR 16 N 7.43 0.45 -3.20 2.92 -2.24 -1.26 -3.02 114.28 115.36 2k5q n THR 16 Ca 0.23 0.24 -0.39 0.00 -2.27 0.00 0.00 64.05 61.86 2k5q n THR 16 Cb 0.47 -1.45 -0.06 0.00 -2.10 0.00 0.00 70.33 67.18 2k5q n THR 16 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2k5q s VAL 17 N -1.47 5.08 0.41 2.28 -7.23 -1.26 -5.00 120.40 113.21 2k5q s VAL 17 Ca -0.04 1.06 0.05 0.00 -1.81 0.00 0.00 61.98 61.23 2k5q s VAL 17 Cb 0.01 -3.88 -0.02 0.00 0.56 0.00 0.00 36.38 33.04 2k5q s VAL 17 CO 0.06 0.17 0.17 1.51 -0.31 0.00 0.00 175.10 176.70 2k5q s ASP 18 N 1.10 2.68 0.00 4.85 -4.77 -1.26 -4.52 116.67 114.75 2k5q s ASP 18 Ca 0.26 -1.73 0.00 0.00 -3.30 0.00 0.00 52.55 47.78 2k5q s ASP 18 Cb -0.16 0.59 0.00 0.00 -1.09 0.00 0.00 42.92 42.26 2k5q s ASP 18 CO 0.10 -1.00 0.00 0.61 0.70 0.00 0.00 175.17 175.59 2k5q n GLY 19 N -0.89 0.31 3.52 2.12 0.00 -1.26 -4.94 105.19 104.04 2k5q n GLY 19 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 2k5q n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k5q s LYS 20 N -0.86 3.40 0.07 1.61 -0.14 -1.26 -4.93 119.74 117.63 2k5q s LYS 20 Ca 0.00 -0.93 -0.30 0.00 -1.36 0.00 0.00 55.97 53.37 2k5q s LYS 20 Cb 0.00 -4.76 -0.05 0.00 -1.68 0.00 0.00 37.83 31.34 2k5q s LYS 20 CO 0.00 -2.05 1.11 -1.83 -0.76 0.00 0.00 175.35 171.82 2k5q s GLU 21 N 4.64 4.51 -1.21 1.68 -1.05 -1.26 -0.05 118.70 125.96 2k5q s GLU 21 Ca 0.37 1.66 -0.16 0.00 -0.15 0.00 0.00 54.97 56.69 2k5q s GLU 21 Cb -0.06 -3.36 0.14 0.00 -0.44 0.00 0.00 34.13 30.41 2k5q s GLU 21 CO 0.01 -0.11 1.50 0.14 0.95 0.00 0.00 175.26 177.75 2k5q s VAL 22 N 0.71 4.71 -0.26 1.83 -7.23 -0.20 -4.73 120.40 115.24 2k5q s VAL 22 Ca 0.54 -2.30 0.12 0.00 -1.81 0.00 0.00 61.98 58.53 2k5q s VAL 22 Cb -0.27 -4.99 0.51 0.00 0.56 0.00 0.00 36.38 32.19 2k5q s VAL 22 CO 0.30 -1.74 1.46 1.57 -0.31 0.00 0.00 175.10 176.38 2k5q n HIS 23 N 6.61 1.07 -0.03 2.82 -0.00 -1.26 -4.32 115.22 120.11 2k5q n HIS 23 Ca 0.39 -1.36 -0.13 0.00 -0.00 0.00 0.00 57.72 56.63 2k5q n HIS 23 Cb 0.44 -0.44 -0.07 0.00 -0.00 0.00 0.00 29.99 29.92 2k5q n HIS 23 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 2k5q h SER 24 N 1.23 -1.52 -0.12 0.26 0.87 -1.91 -3.42 113.55 108.94 2k5q h SER 24 Ca 0.16 0.20 -0.00 0.00 -1.23 0.00 0.00 61.79 60.91 2k5q h SER 24 Cb 1.61 0.62 -0.15 0.00 -0.44 0.00 0.00 62.40 64.04 2k5q h SER 24 CO 0.35 -0.44 -0.10 1.17 -0.53 0.00 0.00 176.83 177.28 2k5q n LYS 25 N -5.43 0.10 -4.22 2.24 4.81 -1.26 -5.02 118.16 109.38 2k5q n LYS 25 Ca -0.04 -0.74 -0.31 0.00 -0.87 0.00 0.00 58.31 56.35 2k5q n LYS 25 Cb 0.37 0.07 -0.09 0.00 0.02 0.00 0.00 35.03 35.40 2k5q n LYS 25 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2k5q n ALA 26 N 2.30 -2.00 0.05 3.14 0.00 -1.26 -4.73 120.51 118.02 2k5q n ALA 26 Ca 0.09 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.12 2k5q n ALA 26 Cb 0.67 -0.87 0.03 0.00 0.00 0.00 0.00 19.45 19.28 2k5q n ALA 26 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2k5q n ASP 27 N -2.68 0.00 -0.08 0.00 9.92 -1.26 -1.14 116.55 121.31 2k5q n ASP 27 Ca -0.30 0.12 0.00 0.00 -0.53 0.00 0.00 54.79 54.08 2k5q n ASP 27 Cb 0.66 -0.14 0.00 0.00 -0.64 0.00 0.00 41.12 40.99 2k5q n ASP 27 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2k5q n ASN 28 N -1.14 0.00 0.00 -2.24 5.15 -1.26 -5.03 115.26 110.74 2k5q n ASN 28 Ca 0.01 -1.13 0.00 0.00 -0.60 0.00 0.00 54.58 52.85 2k5q n ASN 28 Cb 0.01 -0.03 0.00 0.00 -0.53 0.00 0.00 39.78 39.23 2k5q n ASN 28 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2k5q n GLY 29 N 0.00 3.15 3.65 8.20 0.00 -0.30 -5.08 105.19 114.81 2k5q n GLY 29 Ca 0.00 -1.11 -0.24 0.00 0.00 0.00 0.00 46.02 44.67 2k5q n GLY 29 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2k5q s GLN 30 N 0.00 2.32 -1.54 1.61 0.00 -1.26 -4.95 119.66 115.84 2k5q s GLN 30 Ca 0.00 -1.33 -0.10 0.00 -0.00 0.00 0.00 55.36 53.94 2k5q s GLN 30 Cb 0.00 -2.21 -0.02 0.00 0.00 0.00 0.00 33.01 30.77 2k5q s GLN 30 CO 0.00 0.39 2.72 0.36 0.00 0.00 0.00 175.29 178.76 2k5q n LYS 31 N -0.66 3.75 -2.26 9.60 -0.00 -1.26 -4.36 118.16 122.96 2k5q n LYS 31 Ca -0.08 -2.54 -0.28 0.00 -0.00 0.00 0.00 58.31 55.42 2k5q n LYS 31 Cb 0.58 -2.84 0.03 0.00 -0.00 0.00 0.00 35.03 32.80 2k5q n LYS 31 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.40 178.92 2k5q s TYR 32 N 1.63 3.35 -0.16 5.58 1.13 -1.26 -5.04 117.35 122.60 2k5q s TYR 32 Ca 0.63 0.83 -0.04 0.00 -1.41 0.00 0.00 57.07 57.08 2k5q s TYR 32 Cb 0.17 -2.75 0.07 0.00 -1.10 0.00 0.00 41.96 38.36 2k5q s TYR 32 CO -0.07 -0.81 0.18 0.15 -2.51 0.00 0.00 175.55 172.49 2k5q s LYS 33 N -5.06 0.11 -0.11 -3.49 1.02 -1.26 -4.56 119.74 106.40 2k5q s LYS 33 Ca 0.54 0.28 -0.05 0.00 0.02 0.00 0.00 55.97 56.76 2k5q s LYS 33 Cb -0.11 -0.99 -0.04 0.00 -0.52 0.00 0.00 37.83 36.18 2k5q s LYS 33 CO 0.48 -0.53 0.09 -0.51 -0.92 0.00 0.00 175.35 173.96 2k5q s ASP 34 N 2.28 6.01 -0.48 2.83 1.01 -1.26 -4.85 116.67 122.21 2k5q s ASP 34 Ca 0.05 0.36 -0.27 0.00 0.71 0.00 0.00 52.55 53.40 2k5q s ASP 34 Cb -0.14 -1.88 0.03 0.00 1.01 0.00 0.00 42.92 41.94 2k5q s ASP 34 CO -0.09 0.40 1.04 -0.31 0.21 0.00 0.00 175.17 176.42 2k5q s TYR 35 N -0.97 2.85 0.01 4.23 2.02 0.26 -1.03 117.35 124.71 2k5q s TYR 35 Ca 0.14 0.52 -0.26 0.00 -0.37 0.00 0.00 57.07 57.10 2k5q s TYR 35 Cb -0.12 -4.23 -0.04 0.00 -0.40 0.00 0.00 41.96 37.17 2k5q s TYR 35 CO 0.03 -1.22 0.82 -2.00 -1.57 0.00 0.00 175.55 171.61 2k5q s GLU 36 N 4.17 4.51 -0.49 -0.62 2.12 0.92 -0.62 118.70 128.69 2k5q s GLU 36 Ca 0.42 1.13 -0.08 0.00 0.36 0.00 0.00 54.97 56.81 2k5q s GLU 36 Cb -0.09 -3.41 0.12 0.00 0.26 0.00 0.00 34.13 31.01 2k5q s GLU 36 CO 0.29 0.13 0.35 0.71 -0.54 0.00 0.00 175.26 176.19 2k5q s TYR 37 N 0.48 3.46 -0.47 5.30 1.51 0.17 -4.13 117.35 123.67 2k5q s TYR 37 Ca 0.42 -2.02 -0.16 0.00 -1.01 0.00 0.00 57.07 54.30 2k5q s TYR 37 Cb -0.20 -3.45 0.07 0.00 -0.11 0.00 0.00 41.96 38.27 2k5q s TYR 37 CO 0.23 -0.98 0.42 0.21 -1.11 0.00 0.00 175.55 174.32 2k5q s LYS 38 N 1.18 3.00 0.22 -0.62 2.20 -1.26 -2.27 119.74 122.20 2k5q s LYS 38 Ca 0.07 -1.28 -0.01 0.00 -0.36 0.00 0.00 55.97 54.39 2k5q s LYS 38 Cb -0.25 -4.12 -0.03 0.00 -1.51 0.00 0.00 37.83 31.92 2k5q s LYS 38 CO -0.02 -1.04 0.19 -0.48 -0.36 0.00 0.00 175.35 173.64 2k5q s LEU 39 N 1.76 1.14 -0.21 5.43 0.05 -0.33 -4.84 118.68 121.68 2k5q s LEU 39 Ca 0.05 -1.39 -0.14 0.00 0.05 0.00 0.00 54.13 52.70 2k5q s LEU 39 Cb -0.23 0.56 -0.04 0.00 -2.05 0.00 0.00 46.19 44.42 2k5q s LEU 39 CO 0.07 -0.91 0.32 -0.89 -0.55 0.00 0.00 176.35 174.39 2k5q s THR 40 N -4.04 5.26 -0.16 5.48 2.01 -1.26 -0.56 115.64 122.37 2k5q s THR 40 Ca 0.37 0.53 -0.08 0.00 0.31 0.00 0.00 61.69 62.83 2k5q s THR 40 Cb 0.06 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.87 2k5q s THR 40 CO 0.14 0.29 0.12 -0.83 -0.69 0.00 0.00 174.62 173.64 2k5q s GLY 41 N 0.99 2.05 0.10 4.40 0.00 0.65 -4.72 107.32 110.81 2k5q s GLY 41 Ca 0.15 -0.69 -0.16 0.00 0.00 0.00 0.00 44.72 44.03 2k5q s GLY 41 CO 0.06 -0.11 0.54 -1.36 0.00 0.00 0.00 173.10 172.23 2k5q s PHE 42 N -0.24 3.69 -0.06 1.90 0.40 -1.22 -1.42 117.98 121.03 2k5q s PHE 42 Ca 0.10 1.13 0.03 0.00 -0.60 0.00 0.00 56.93 57.59 2k5q s PHE 42 Cb -0.12 -2.40 0.01 0.00 0.51 0.00 0.00 43.02 41.02 2k5q s PHE 42 CO 0.01 0.51 -0.14 0.34 0.70 0.00 0.00 175.22 176.64 2k5q s ASP 43 N -1.43 1.88 0.17 1.36 2.15 0.14 -3.62 116.67 117.31 2k5q s ASP 43 Ca 0.33 -0.31 0.00 0.00 0.43 0.00 0.00 52.55 53.00 2k5q s ASP 43 Cb -0.17 -0.73 0.00 0.00 -0.30 0.00 0.00 42.92 41.72 2k5q s ASP 43 CO 0.18 0.08 0.00 0.29 -0.17 0.00 0.00 175.17 175.55 2k5q n LYS 44 N 3.55 0.00 -0.55 4.34 5.02 -1.26 -0.52 118.16 128.74 2k5q n LYS 44 Ca -0.21 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.16 2k5q n LYS 44 Cb 0.52 0.00 0.29 0.00 -0.02 0.00 0.00 35.03 35.82 2k5q n LYS 44 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2k5q n ASP 45 N 3.16 4.24 0.00 4.39 5.75 -1.26 -3.58 116.55 129.25 2k5q n ASP 45 Ca 0.00 -3.03 0.00 0.00 -0.01 0.00 0.00 54.79 51.75 2k5q n ASP 45 Cb 0.00 -0.58 0.00 0.00 -1.03 0.00 0.00 41.12 39.51 2k5q n ASP 45 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2k5q n GLY 46 N -0.30 1.52 3.76 6.12 0.00 -0.15 -4.73 105.19 111.41 2k5q n GLY 46 Ca 0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 2k5q n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k5q s LYS 47 N -0.05 2.05 -0.08 1.61 -0.14 0.32 -4.72 119.74 118.72 2k5q s LYS 47 Ca 0.00 1.11 -0.00 0.00 -1.36 0.00 0.00 55.97 55.72 2k5q s LYS 47 Cb 0.00 -1.88 0.02 0.00 -1.68 0.00 0.00 37.83 34.30 2k5q s LYS 47 CO 0.00 -1.78 -0.05 -1.83 -0.76 0.00 0.00 175.35 170.94 2k5q s GLU 48 N -4.90 1.07 0.06 1.68 -1.05 -1.26 0.23 118.70 114.52 2k5q s GLU 48 Ca 0.62 -0.11 0.08 0.00 -0.15 0.00 0.00 54.97 55.40 2k5q s GLU 48 Cb -0.17 -1.18 -0.03 0.00 -0.44 0.00 0.00 34.13 32.30 2k5q s GLU 48 CO 0.56 -0.21 -0.22 0.15 0.95 0.00 0.00 175.26 176.50 2k5q s LYS 49 N 1.51 1.38 -0.22 -4.83 3.01 -0.51 -4.99 119.74 115.08 2k5q s LYS 49 Ca -0.01 -1.02 -0.26 0.00 -1.01 0.00 0.00 55.97 53.67 2k5q s LYS 49 Cb -0.13 -1.55 -0.00 0.00 -1.01 0.00 0.00 37.83 35.13 2k5q s LYS 49 CO -0.04 0.39 0.87 -1.21 0.51 0.00 0.00 175.35 175.87 2k5q s GLU 50 N -1.37 4.22 -0.21 1.68 8.01 -1.26 -0.25 118.70 129.52 2k5q s GLU 50 Ca 0.08 1.04 -0.03 0.00 0.01 0.00 0.00 54.97 56.07 2k5q s GLU 50 Cb -0.09 -3.63 -0.01 0.00 -4.31 0.00 0.00 34.13 26.09 2k5q s GLU 50 CO 0.02 -0.50 -0.07 -0.51 0.01 0.00 0.00 175.26 174.22 2k5q s LEU 51 N 2.76 2.81 -0.15 1.80 2.01 0.27 -4.92 118.68 123.27 2k5q s LEU 51 Ca 0.37 -0.40 0.00 0.00 0.01 0.00 0.00 54.13 54.11 2k5q s LEU 51 Cb -0.15 -1.70 0.03 0.00 0.01 0.00 0.00 46.19 44.37 2k5q s LEU 51 CO 0.08 0.00 -0.10 -1.83 1.01 0.00 0.00 176.35 175.52 2k5q s GLU 52 N 1.33 1.85 -0.04 1.70 -1.05 -1.26 -1.19 118.70 120.03 2k5q s GLU 52 Ca 0.04 -0.52 0.04 0.00 -0.15 0.00 0.00 54.97 54.38 2k5q s GLU 52 Cb -0.14 -2.00 -0.00 0.00 -0.44 0.00 0.00 34.13 31.54 2k5q s GLU 52 CO -0.03 -0.32 -0.15 -0.59 0.95 0.00 0.00 175.26 175.11 2k5q s PHE 53 N 1.56 1.54 -0.43 4.83 -0.71 -0.96 -4.96 117.98 118.86 2k5q s PHE 53 Ca 0.03 -0.43 -0.19 0.00 -1.04 0.00 0.00 56.93 55.30 2k5q s PHE 53 Cb -0.14 -1.05 0.02 0.00 -1.21 0.00 0.00 43.02 40.65 2k5q s PHE 53 CO -0.09 -0.15 0.52 0.95 -1.34 0.00 0.00 175.22 175.11 2k5q s THR 54 N 0.07 4.98 -0.05 -4.49 -4.23 -1.26 -0.66 115.64 110.00 2k5q s THR 54 Ca -0.04 -0.19 -0.08 0.00 -1.18 0.00 0.00 61.69 60.20 2k5q s THR 54 Cb -0.11 -4.12 -0.05 0.00 1.34 0.00 0.00 72.50 69.57 2k5q s THR 54 CO 0.02 -0.51 0.23 0.00 -0.54 0.00 0.00 174.62 173.82 2k5q s ALA 55 N 2.41 3.84 -1.60 3.99 0.00 0.20 -4.80 121.76 125.80 2k5q s ALA 55 Ca 0.16 -0.55 0.15 0.00 0.00 0.00 0.00 51.96 51.72 2k5q s ALA 55 Cb -0.16 -2.07 0.81 0.00 0.00 0.00 0.00 23.12 21.70 2k5q s ALA 55 CO 0.15 0.61 1.40 1.04 0.00 0.00 0.00 175.76 178.96 2k5q n GLN 56 N 1.63 0.30 -3.83 0.00 6.02 -1.26 0.92 117.38 121.15 2k5q n GLN 56 Ca -0.16 0.10 -0.08 0.00 -0.01 0.00 0.00 57.00 56.86 2k5q n GLN 56 Cb 0.54 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.30 2k5q n GLN 56 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 2k5q s LYS 57 N -2.40 2.01 -0.02 -1.09 -2.85 -1.26 -4.77 119.74 109.36 2k5q s LYS 57 Ca 0.17 -1.22 -0.25 0.00 -1.00 0.00 0.00 55.97 53.68 2k5q s LYS 57 Cb 0.10 0.61 -0.04 0.00 -2.06 0.00 0.00 37.83 36.44 2k5q s LYS 57 CO 0.21 -0.93 0.76 1.21 0.10 0.00 0.00 175.35 176.71 2k5q s ASN 58 N -3.01 7.12 0.36 0.03 3.84 -1.26 -4.79 114.94 117.23 2k5q s ASN 58 Ca 0.13 1.34 0.04 0.00 0.21 0.00 0.00 52.86 54.59 2k5q s ASN 58 Cb -0.05 -2.45 0.04 0.00 -0.55 0.00 0.00 41.25 38.24 2k5q s ASN 58 CO 0.09 -0.10 0.37 0.00 -2.79 0.00 0.00 177.10 174.67 2k5q n LEU 59 N 3.49 0.00 -4.62 3.21 -0.00 -1.26 -5.04 117.00 112.78 2k5q n LEU 59 Ca -0.01 -1.75 -0.43 0.00 -0.00 0.00 0.00 56.01 53.83 2k5q n LEU 59 Cb 0.51 -0.13 -0.03 0.00 -0.00 0.00 0.00 43.42 43.77 2k5q n LEU 59 CO 0.48 -0.54 1.62 -0.13 -0.00 0.00 0.00 177.39 178.82 2k5q s ARG 60 N -3.55 3.50 0.43 1.47 3.00 -1.26 -4.98 118.95 117.56 2k5q s ARG 60 Ca 0.28 1.88 -0.10 0.00 0.00 0.00 0.00 55.73 57.78 2k5q s ARG 60 Cb -0.02 -4.21 -0.06 0.00 0.00 0.00 0.00 34.95 30.65 2k5q s ARG 60 CO 0.18 -1.67 0.79 0.15 0.00 0.00 0.00 175.30 174.75 2k5q s LYS 61 N 5.48 3.75 -0.15 3.54 1.02 -1.26 -3.59 119.74 128.54 2k5q s LYS 61 Ca 0.86 0.47 0.00 0.00 0.02 0.00 0.00 55.97 57.32 2k5q s LYS 61 Cb -0.30 -2.36 0.00 0.00 -0.52 0.00 0.00 37.83 34.65 2k5q s LYS 61 CO 0.34 -0.09 0.00 0.39 -0.92 0.00 0.00 175.35 175.07 2k5q n GLU 62 N -1.49 -1.26 -3.30 1.68 1.02 -1.17 -5.00 120.64 111.11 2k5q n GLU 62 Ca 0.02 0.39 -0.22 0.00 -0.02 0.00 0.00 57.16 57.34 2k5q n GLU 62 Cb 0.54 -4.38 0.04 0.00 -0.02 0.00 0.00 31.44 27.62 2k5q n GLU 62 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2k5q s ALA 63 N -1.47 4.62 0.00 0.62 0.00 -1.24 -4.86 121.76 119.44 2k5q s ALA 63 Ca 0.00 -1.86 0.06 0.00 0.00 0.00 0.00 51.96 50.16 2k5q s ALA 63 Cb 0.00 -1.23 -0.03 0.00 0.00 0.00 0.00 23.12 21.86 2k5q s ALA 63 CO 0.00 -0.72 -0.18 -0.06 0.00 0.00 0.00 175.76 174.80 2k5q s PHE 64 N -2.69 2.57 -0.08 0.00 0.08 -1.09 -2.10 117.98 114.66 2k5q s PHE 64 Ca 0.53 -0.25 0.03 0.00 0.12 0.00 0.00 56.93 57.36 2k5q s PHE 64 Cb -0.05 -1.52 0.01 0.00 -0.57 0.00 0.00 43.02 40.89 2k5q s PHE 64 CO 0.33 0.19 -0.17 -0.51 -0.10 0.00 0.00 175.22 174.96 2k5q s LEU 65 N -1.09 1.84 -0.89 -0.37 1.43 -0.15 -0.61 118.68 118.83 2k5q s LEU 65 Ca 0.13 -0.40 -0.23 0.00 -1.03 0.00 0.00 54.13 52.60 2k5q s LEU 65 Cb -0.10 -1.06 0.06 0.00 0.03 0.00 0.00 46.19 45.12 2k5q s LEU 65 CO 0.03 0.09 1.28 -0.13 0.23 0.00 0.00 176.35 177.85 2k5q s ARG 66 N 0.48 3.43 -0.17 1.70 0.52 -0.05 -1.80 118.95 123.06 2k5q s ARG 66 Ca -0.15 -1.00 -0.19 0.00 -0.52 0.00 0.00 55.73 53.87 2k5q s ARG 66 Cb -0.16 -4.85 -0.03 0.00 0.52 0.00 0.00 34.95 30.43 2k5q s ARG 66 CO 0.06 -2.06 0.52 0.08 0.02 0.00 0.00 175.30 173.92 2k5q s VAL 67 N 4.60 5.12 -0.12 3.52 1.01 -0.37 -2.27 120.40 131.88 2k5q s VAL 67 Ca 0.38 0.99 -0.29 0.00 0.00 0.00 0.00 61.98 63.05 2k5q s VAL 67 Cb -0.05 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 2k5q s VAL 67 CO -0.01 0.21 1.52 -0.47 0.00 0.00 0.00 175.10 176.35 2k5q s TYR 68 N 1.38 2.27 -0.24 5.22 5.04 -0.42 -0.92 117.35 129.69 2k5q s TYR 68 Ca 0.25 0.50 -0.04 0.00 -2.44 0.00 0.00 57.07 55.35 2k5q s TYR 68 Cb -0.15 -3.80 0.00 0.00 0.35 0.00 0.00 41.96 38.36 2k5q s TYR 68 CO 0.10 -3.03 -0.03 -1.58 -1.34 0.00 0.00 175.55 169.67 2k5q s HIS 69 N 4.05 3.01 0.00 4.97 5.65 -1.17 -0.80 115.29 130.99 2k5q s HIS 69 Ca 0.67 -1.07 0.00 0.00 0.25 0.00 0.00 55.06 54.91 2k5q s HIS 69 Cb -0.28 -2.12 0.00 0.00 -1.18 0.00 0.00 32.58 29.00 2k5q s HIS 69 CO 0.25 -0.59 0.00 0.43 -0.65 0.00 0.00 174.74 174.18 2k5q n SER 70 N 4.78 0.00 -0.05 9.88 7.64 0.07 -4.38 113.62 131.56 2k5q n SER 70 Ca -0.17 -0.75 -0.14 0.00 1.01 0.00 0.00 58.87 58.82 2k5q n SER 70 Cb 0.50 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.61 2k5q n SER 70 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 2k5q h ASP 71 N 0.00 -1.69 0.00 6.43 2.03 -2.02 -3.32 116.42 117.85 2k5q h ASP 71 Ca 0.00 0.21 0.00 0.00 -0.73 0.00 0.00 57.03 56.51 2k5q h ASP 71 Cb 0.00 0.68 0.00 0.00 -0.83 0.00 0.00 39.33 39.18 2k5q h ASP 71 CO 0.00 -0.45 -0.11 0.07 -1.03 0.00 0.00 179.24 177.72 2k5q h LYS 72 N -0.51 0.00 0.00 4.15 2.10 -2.03 -3.49 116.57 116.80 2k5q h LYS 72 Ca 0.06 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.71 2k5q h LYS 72 Cb 0.65 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.98 2k5q h LYS 72 CO -0.49 0.00 0.00 1.63 -2.00 0.00 0.00 179.45 178.59 2k5q n LYS 73 N -4.15 0.00 0.00 0.07 5.02 -1.25 -5.05 118.16 112.80 2k5q n LYS 73 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 2k5q n LYS 73 Cb 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.07 2k5q n LYS 73 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2k5q n GLY 74 N -0.70 2.07 3.26 0.72 0.00 -1.26 -0.75 105.19 108.52 2k5q n GLY 74 Ca 0.00 0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 2k5q n GLY 74 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2k5q n VAL 75 N 0.00 -1.39 0.29 1.61 0.31 0.02 -4.84 118.33 114.33 2k5q n VAL 75 Ca 0.00 0.00 0.18 0.00 -0.01 0.00 0.00 64.34 64.51 2k5q n VAL 75 Cb 0.00 -2.44 0.97 0.00 -0.91 0.00 0.00 33.84 31.46 2k5q n VAL 75 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2k5q h SER 76 N -1.16 0.00 -2.83 4.52 0.02 -1.87 -3.42 113.55 108.82 2k5q h SER 76 Ca -0.47 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 60.54 2k5q h SER 76 Cb 1.32 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 63.62 2k5q h SER 76 CO 0.55 0.00 0.18 0.00 -1.14 0.00 0.00 176.83 176.42 2k5q s ALA 77 N -4.49 -2.04 -0.11 3.77 0.00 -1.26 -5.05 121.76 112.58 2k5q s ALA 77 Ca -0.05 2.32 0.04 0.00 0.00 0.00 0.00 51.96 54.27 2k5q s ALA 77 Cb 0.14 -1.54 0.00 0.00 0.00 0.00 0.00 23.12 21.72 2k5q s ALA 77 CO 0.50 -0.36 -0.23 1.67 0.00 0.00 0.00 175.76 177.33 2k5q s TRP 78 N 1.47 2.57 -0.02 0.00 1.48 -1.26 -1.30 118.94 121.88 2k5q s TRP 78 Ca -0.09 -1.11 0.07 0.00 -1.06 0.00 0.00 56.10 53.91 2k5q s TRP 78 Cb -0.04 -1.72 -0.02 0.00 -1.16 0.00 0.00 33.47 30.52 2k5q s TRP 78 CO -0.17 -0.46 -0.21 -1.21 -4.06 0.00 0.00 176.95 170.83 2k5q s GLU 79 N 0.45 2.20 -0.81 3.25 2.02 -0.96 -4.92 118.70 119.92 2k5q s GLU 79 Ca -0.16 -0.88 -0.25 0.00 0.02 0.00 0.00 54.97 53.70 2k5q s GLU 79 Cb -0.17 -2.16 0.04 0.00 0.10 0.00 0.00 34.13 31.94 2k5q s GLU 79 CO 0.07 0.57 1.28 -2.00 0.02 0.00 0.00 175.26 175.20 2k5q s GLU 80 N -0.81 3.30 -0.04 1.61 2.12 -1.26 -0.87 118.70 122.75 2k5q s GLU 80 Ca 0.11 -0.60 -0.01 0.00 0.36 0.00 0.00 54.97 54.83 2k5q s GLU 80 Cb -0.10 -4.52 -0.04 0.00 0.26 0.00 0.00 34.13 29.74 2k5q s GLU 80 CO 0.00 -2.11 0.05 0.14 -0.54 0.00 0.00 175.26 172.81 2k5q s VAL 81 N 5.23 4.63 0.44 3.70 -7.23 0.22 -5.00 120.40 122.38 2k5q s VAL 81 Ca 0.36 -0.30 0.06 0.00 -1.81 0.00 0.00 61.98 60.29 2k5q s VAL 81 Cb -0.07 -3.05 -0.04 0.00 0.56 0.00 0.00 36.38 33.79 2k5q s VAL 81 CO 0.07 0.47 0.17 -0.54 -0.31 0.00 0.00 175.10 174.96 2k5q s LYS 82 N -1.36 2.20 0.00 4.82 3.01 -1.26 -2.69 119.74 124.46 2k5q s LYS 82 Ca 0.18 -1.97 0.00 0.00 -1.01 0.00 0.00 55.97 53.18 2k5q s LYS 82 Cb -0.12 -1.90 0.00 0.00 -1.01 0.00 0.00 37.83 34.81 2k5q s LYS 82 CO 0.09 -0.21 0.86 0.36 0.51 0.00 0.00 175.35 176.96 2k5q n LYS 83 N -1.28 0.00 -0.34 1.68 0.00 -1.26 -2.71 118.16 114.25 2k5q n LYS 83 Ca -0.04 0.36 0.03 0.00 -0.00 0.00 0.00 58.31 58.66 2k5q n LYS 83 Cb 0.65 -1.64 0.18 0.00 -0.00 0.00 0.00 35.03 34.21 2k5q n LYS 83 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 2k5q h ASP 84 N 0.00 0.93 -0.02 -5.58 5.19 -2.03 -2.69 116.42 112.21 2k5q h ASP 84 Ca 0.00 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 2k5q h ASP 84 Cb 0.28 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 39.62 2k5q h ASP 84 CO 0.00 0.57 -0.02 -1.84 -3.12 0.00 0.00 179.24 174.83 2k5q n GLU 85 N -4.58 2.16 -2.98 3.56 0.28 -1.10 -4.94 120.64 113.05 2k5q n GLU 85 Ca 0.15 -1.72 -0.41 0.00 -0.16 0.00 0.00 57.16 55.02 2k5q n GLU 85 Cb 0.22 -1.46 -0.05 0.00 1.43 0.00 0.00 31.44 31.58 2k5q n GLU 85 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2k5q s LEU 86 N -2.02 4.18 0.09 -1.84 1.43 -1.02 -5.03 118.68 114.47 2k5q s LEU 86 Ca 0.29 1.06 -0.31 0.00 -1.03 0.00 0.00 54.13 54.15 2k5q s LEU 86 Cb 0.20 -3.10 -0.08 0.00 0.03 0.00 0.00 46.19 43.23 2k5q s LEU 86 CO 0.32 -0.33 1.60 -2.16 0.23 0.00 0.00 176.35 176.01 2k5q s PRO 87 N 1.93 4.22 0.34 1.29 0.04 -1.26 -4.90 135.00 136.64 2k5q s PRO 87 Ca 0.35 2.29 0.13 0.00 0.04 0.00 0.00 61.00 63.81 2k5q s PRO 87 Cb -0.16 -3.48 1.06 0.00 0.04 0.00 0.00 34.50 31.96 2k5q s PRO 87 CO 0.12 -0.68 1.62 0.00 0.04 0.00 0.00 177.00 178.11 2k5q h ALA 88 N 7.87 1.80 -0.47 8.56 0.00 -1.95 0.12 119.26 135.20 2k5q h ALA 88 Ca -0.42 0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 2k5q h ALA 88 Cb 1.20 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 19.26 2k5q h ALA 88 CO 0.92 -0.68 0.20 0.87 0.00 0.00 0.00 179.25 180.56 2k5q h LYS 89 N 0.16 0.66 0.00 0.00 1.57 -1.97 0.57 116.57 117.56 2k5q h LYS 89 Ca 0.72 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 59.41 2k5q h LYS 89 Cb 1.70 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.89 2k5q h LYS 89 CO -0.71 0.54 -0.03 -0.24 -0.57 0.00 0.00 179.45 178.44 2k5q h VAL 90 N 0.66 0.12 0.00 0.50 3.04 -1.10 0.30 116.25 119.78 2k5q h VAL 90 Ca 0.16 -0.34 -0.12 0.00 -1.01 0.00 0.00 66.70 65.39 2k5q h VAL 90 Cb 0.11 1.30 -0.02 0.00 -2.01 0.00 0.00 31.29 30.67 2k5q h VAL 90 CO -0.02 0.03 -1.36 1.17 -1.01 0.00 0.00 177.57 176.38 2k5q n LYS 91 N -3.20 0.54 -0.17 4.17 4.81 -0.77 -2.98 118.16 120.56 2k5q n LYS 91 Ca -0.01 0.24 -0.05 0.00 -0.87 0.00 0.00 58.31 57.62 2k5q n LYS 91 Cb 0.21 -1.46 0.14 0.00 0.02 0.00 0.00 35.03 33.94 2k5q n LYS 91 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2k5q h GLU 92 N -1.00 0.92 0.09 1.64 5.08 -0.97 -3.23 114.58 117.11 2k5q h GLU 92 Ca -0.18 -0.21 -0.37 0.00 -1.00 0.00 0.00 59.36 57.60 2k5q h GLU 92 Cb 1.13 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.23 2k5q h GLU 92 CO -0.11 0.85 -2.09 1.17 -1.00 0.00 0.00 179.01 177.83 2k5q n LYS 93 N -4.24 0.72 -0.84 2.33 3.00 0.01 -5.06 118.16 114.08 2k5q n LYS 93 Ca 0.04 0.25 0.00 0.00 -0.00 0.00 0.00 58.31 58.60 2k5q n LYS 93 Cb 0.26 -1.66 0.00 0.00 0.00 0.00 0.00 35.03 33.63 2k5q n LYS 93 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 2k5q n LEU 94 N -3.49 -3.58 -0.67 3.14 0.00 -0.70 -4.92 117.00 106.77 2k5q n LEU 94 Ca -0.36 1.49 -0.02 0.00 0.00 0.00 0.00 56.01 57.12 2k5q n LEU 94 Cb 1.01 -0.90 0.01 0.00 0.00 0.00 0.00 43.42 43.54 2k5q n LEU 94 CO 0.37 -0.20 0.01 0.61 0.00 0.00 0.00 177.39 178.18 2k5q n GLY 95 N -0.21 0.71 3.68 -3.96 0.00 -1.25 -5.00 105.19 99.17 2k5q n GLY 95 Ca 0.00 -0.64 -0.32 0.00 0.00 0.00 0.00 46.02 45.06 2k5q n GLY 95 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2k5q s VAL 96 N -2.84 4.12 -0.16 1.61 -7.23 -1.26 -4.64 120.40 110.00 2k5q s VAL 96 Ca 0.04 -0.70 -0.29 0.00 -1.81 0.00 0.00 61.98 59.23 2k5q s VAL 96 Cb -0.02 -2.87 -0.06 0.00 0.56 0.00 0.00 36.38 33.99 2k5q s VAL 96 CO 0.05 0.31 2.06 -1.59 -0.31 0.00 0.00 175.10 175.62 2k5q s LYS 97 N -1.75 3.48 0.01 4.82 -2.85 -1.26 -4.81 119.74 117.38 2k5q s LYS 97 Ca 0.21 2.10 -0.30 0.00 -1.00 0.00 0.00 55.97 56.98 2k5q s LYS 97 Cb -0.12 -4.27 -0.08 0.00 -2.06 0.00 0.00 37.83 31.31 2k5q s LYS 97 CO 0.12 -1.70 1.84 -0.48 0.10 0.00 0.00 175.35 175.23 2k5q s LEU 98 N 6.85 4.39 -0.32 2.77 -0.00 -1.23 -4.92 118.68 126.22 2k5q s LEU 98 Ca 0.93 2.51 -0.09 0.00 -0.00 0.00 0.00 54.13 57.47 2k5q s LEU 98 Cb -0.34 -3.53 0.19 0.00 -0.00 0.00 0.00 46.19 42.50 2k5q s LEU 98 CO 0.36 -1.00 1.03 -0.70 -0.00 0.00 0.00 176.35 176.04 2k5q s GLU 99 N 4.18 0.19 0.07 1.48 2.12 -1.26 -4.97 118.70 120.51 2k5q s GLU 99 Ca 0.82 0.02 0.19 0.00 0.36 0.00 0.00 54.97 56.37 2k5q s GLU 99 Cb -0.39 0.04 -0.13 0.00 0.26 0.00 0.00 34.13 33.91 2k5q s GLU 99 CO 0.37 -0.30 0.78 0.72 -0.54 0.00 0.00 175.26 176.29 2k5q n HIS 100 N 4.33 0.75 0.00 5.30 8.25 -1.26 -4.99 115.22 127.61 2k5q n HIS 100 Ca 0.07 0.24 0.00 0.00 -0.26 0.00 0.00 57.72 57.77 2k5q n HIS 100 Cb 0.61 -0.95 0.00 0.00 1.12 0.00 0.00 29.99 30.77 2k5q n HIS 100 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2k5q n HIS 101 N -2.71 0.00 -1.47 4.41 -0.00 -1.26 -4.86 115.22 109.33 2k5q n HIS 101 Ca -0.08 0.00 -0.45 0.00 -0.00 0.00 0.00 57.72 57.19 2k5q n HIS 101 Cb 0.73 0.00 -0.09 0.00 -0.00 0.00 0.00 29.99 30.63 2k5q n HIS 101 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2k5q n HIS 102 N 0.00 1.24 -1.94 1.57 -0.00 -1.26 -4.73 115.22 110.10 2k5q n HIS 102 Ca 0.00 0.30 0.00 0.00 0.46 0.00 0.00 57.72 58.48 2k5q n HIS 102 Cb 0.00 -2.50 0.00 0.00 -0.12 0.00 0.00 29.99 27.37 2k5q n HIS 102 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2k5q n HIS 103 N 11.32 0.00 -3.46 1.57 8.25 -1.26 -5.01 115.22 126.64 2k5q n HIS 103 Ca 0.48 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.70 2k5q n HIS 103 Cb 0.23 -0.05 -0.12 0.00 1.12 0.00 0.00 29.99 31.18 2k5q n HIS 103 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2k5q s HIS 104 N 0.00 0.12 0.00 4.41 -3.43 -1.26 -5.31 115.29 109.82 2k5q s HIS 104 Ca 0.00 -0.87 0.00 0.00 -0.80 0.00 0.00 55.06 53.39 2k5q s HIS 104 Cb 0.00 -0.72 0.00 0.00 -1.43 0.00 0.00 32.58 30.43 2k5q s HIS 104 CO 0.00 -0.87 0.00 0.72 -2.00 0.00 0.00 174.74 172.59