#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 6.11 0.00 7.83 -1.08 -1.26 -4.77 116.67 123.51 2k5q s ASP 2 Ca 0.00 -0.90 0.26 0.00 -0.52 0.00 0.00 52.55 51.39 2k5q s ASP 2 Cb 0.00 -2.56 0.79 0.00 -1.46 0.00 0.00 42.92 39.69 2k5q s ASP 2 CO 0.00 -1.85 1.60 0.00 0.52 0.00 0.00 175.17 175.44 2k5q n LEU 3 N 10.06 1.94 0.04 -1.34 -0.00 -1.26 -3.59 117.00 122.85 2k5q n LEU 3 Ca 0.24 -0.67 -0.22 0.00 -0.00 0.00 0.00 56.01 55.36 2k5q n LEU 3 Cb 0.50 -0.02 -0.14 0.00 -0.00 0.00 0.00 43.42 43.76 2k5q n LEU 3 CO 0.67 0.34 -0.40 0.78 -0.00 0.00 0.00 177.39 178.78 2k5q h ASN 4 N 2.98 0.48 0.00 1.45 2.35 -2.11 -3.43 115.58 117.29 2k5q h ASN 4 Ca 0.00 -0.89 -0.07 0.00 -0.55 0.00 0.00 56.30 54.79 2k5q h ASN 4 Cb 0.63 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.84 2k5q h ASN 4 CO 0.00 1.65 -0.91 0.54 -1.65 0.00 0.00 177.43 177.06 2k5q n ARG 5 N -3.85 0.31 0.00 0.81 1.74 -1.26 -5.12 116.66 109.28 2k5q n ARG 5 Ca -0.23 0.12 0.00 0.00 -0.77 0.00 0.00 57.85 56.97 2k5q n ARG 5 Cb 0.95 -1.03 0.00 0.00 -1.02 0.00 0.00 32.46 31.36 2k5q n ARG 5 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 2k5q n MET 6 N -3.95 0.00 0.00 5.56 2.81 -1.24 -5.01 117.12 115.30 2k5q n MET 6 Ca -0.14 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.75 2k5q n MET 6 Cb 0.40 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.91 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 0.00 1.20 3.03 0.00 -1.26 -5.11 105.19 103.04 2k5q n GLY 7 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2k5q n GLY 7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k5q n LYS 8 N 0.00 -3.18 -4.41 1.61 4.01 -1.26 -4.96 118.16 109.97 2k5q n LYS 8 Ca 0.00 2.46 -0.34 0.00 -0.51 0.00 0.00 58.31 59.92 2k5q n LYS 8 Cb 0.00 -3.03 -0.11 0.00 -0.51 0.00 0.00 35.03 31.38 2k5q n LYS 8 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2k5q s ASP 9 N -4.58 4.92 -0.30 4.39 1.01 -1.26 -5.07 116.67 115.78 2k5q s ASP 9 Ca 0.00 -0.04 0.01 0.00 0.71 0.00 0.00 52.55 53.24 2k5q s ASP 9 Cb 0.00 -1.62 0.09 0.00 1.01 0.00 0.00 42.92 42.40 2k5q s ASP 9 CO 0.00 0.25 0.05 -1.83 0.21 0.00 0.00 175.17 173.84 2k5q s GLU 10 N -0.11 1.20 -0.54 8.23 1.03 -1.26 -2.84 118.70 124.40 2k5q s GLU 10 Ca 0.03 -1.35 -0.20 0.00 0.03 0.00 0.00 54.97 53.48 2k5q s GLU 10 Cb -0.13 -2.58 0.06 0.00 -0.80 0.00 0.00 34.13 30.69 2k5q s GLU 10 CO 0.02 -0.88 0.72 0.71 -1.33 0.00 0.00 175.26 174.50 2k5q s TYR 11 N 1.30 2.97 -0.63 4.83 2.02 -0.19 -4.89 117.35 122.76 2k5q s TYR 11 Ca 0.07 -0.52 -0.23 0.00 -0.37 0.00 0.00 57.07 56.01 2k5q s TYR 11 Cb -0.18 -3.77 0.06 0.00 -0.40 0.00 0.00 41.96 37.67 2k5q s TYR 11 CO -0.14 -1.18 0.98 0.71 -1.57 0.00 0.00 175.55 174.34 2k5q s TYR 12 N 2.98 2.68 0.42 2.71 2.02 -1.26 -1.24 117.35 125.66 2k5q s TYR 12 Ca 0.18 -0.37 0.04 0.00 -0.37 0.00 0.00 57.07 56.54 2k5q s TYR 12 Cb -0.19 -4.25 -0.05 0.00 -0.40 0.00 0.00 41.96 37.08 2k5q s TYR 12 CO 0.12 -1.60 0.04 0.14 -1.57 0.00 0.00 175.55 172.69 2k5q s VAL 13 N 4.14 1.30 0.39 0.71 -7.23 -0.93 -4.81 120.40 113.97 2k5q s VAL 13 Ca 0.25 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.48 2k5q s VAL 13 Cb -0.15 -2.59 -0.07 0.00 0.56 0.00 0.00 36.38 34.12 2k5q s VAL 13 CO 0.13 0.00 0.02 0.00 -0.31 0.00 0.00 175.10 174.94 2k5q s GLN 14 N -3.80 1.88 -0.89 4.82 -2.07 -1.26 -0.03 119.66 118.31 2k5q s GLN 14 Ca 0.25 -2.06 -0.25 0.00 -1.82 0.00 0.00 55.36 51.48 2k5q s GLN 14 Cb 0.06 -1.43 -0.04 0.00 -1.09 0.00 0.00 33.01 30.51 2k5q s GLN 14 CO 0.12 -0.09 1.90 0.42 -1.32 0.00 0.00 175.29 176.32 2k5q s ILE 15 N -2.87 3.48 -0.03 3.63 -1.09 -1.25 -4.80 121.20 118.27 2k5q s ILE 15 Ca 0.35 -0.35 -0.00 0.00 -2.23 0.00 0.00 60.65 58.43 2k5q s ILE 15 Cb 0.10 -4.08 -0.00 0.00 -1.58 0.00 0.00 42.46 36.90 2k5q s ILE 15 CO 0.17 -1.02 -0.00 0.71 -1.23 0.00 0.00 174.94 173.57 2k5q h THR 16 N 7.19 0.00 -3.74 2.92 1.35 -1.97 -3.44 112.91 115.23 2k5q h THR 16 Ca 0.07 -0.27 -0.63 0.00 -0.55 0.00 0.00 66.41 65.03 2k5q h THR 16 Cb 1.02 0.00 -0.15 0.00 -1.73 0.00 0.00 68.15 67.29 2k5q h THR 16 CO 1.23 0.00 -0.26 0.68 -0.25 0.00 0.00 175.52 176.91 2k5q s VAL 17 N -1.16 5.19 0.17 6.82 -7.23 -1.26 -5.08 120.40 117.85 2k5q s VAL 17 Ca -0.00 0.50 0.05 0.00 -1.81 0.00 0.00 61.98 60.72 2k5q s VAL 17 Cb 0.00 -3.69 -0.05 0.00 0.56 0.00 0.00 36.38 33.20 2k5q s VAL 17 CO 0.00 0.15 -0.10 1.51 -0.31 0.00 0.00 175.10 176.35 2k5q s ASP 18 N 1.66 1.98 0.00 4.85 -4.77 -1.26 -4.66 116.67 114.47 2k5q s ASP 18 Ca 0.14 -1.04 0.00 0.00 -3.30 0.00 0.00 52.55 48.35 2k5q s ASP 18 Cb -0.16 -0.04 0.00 0.00 -1.09 0.00 0.00 42.92 41.63 2k5q s ASP 18 CO 0.10 -0.32 0.00 0.61 0.70 0.00 0.00 175.17 176.26 2k5q n GLY 19 N -0.27 0.34 3.56 2.12 0.00 -1.26 -4.93 105.19 104.75 2k5q n GLY 19 Ca -0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 2k5q n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k5q s LYS 20 N -0.76 2.61 -0.83 1.61 2.20 -1.26 -4.91 119.74 118.40 2k5q s LYS 20 Ca 0.00 -0.22 -0.26 0.00 -0.36 0.00 0.00 55.97 55.14 2k5q s LYS 20 Cb 0.00 -4.99 0.03 0.00 -1.51 0.00 0.00 37.83 31.36 2k5q s LYS 20 CO 0.00 -3.24 1.38 -1.21 -0.36 0.00 0.00 175.35 171.92 2k5q s GLU 21 N 6.91 3.28 -1.23 4.03 2.02 -1.26 -0.79 118.70 131.66 2k5q s GLU 21 Ca 0.68 -0.49 -0.20 0.00 0.02 0.00 0.00 54.97 54.98 2k5q s GLU 21 Cb -0.07 -4.60 -0.01 0.00 0.10 0.00 0.00 34.13 29.55 2k5q s GLU 21 CO 0.02 -2.23 1.86 1.33 0.02 0.00 0.00 175.26 176.26 2k5q n VAL 22 N 6.62 2.94 0.57 2.63 0.24 0.11 -4.68 118.33 126.77 2k5q n VAL 22 Ca 0.15 -3.01 0.08 0.00 -2.04 0.00 0.00 64.34 59.51 2k5q n VAL 22 Cb 0.50 -2.28 0.21 0.00 -1.47 0.00 0.00 33.84 30.80 2k5q n VAL 22 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 2k5q n HIS 23 N 10.81 0.59 -2.43 6.34 -0.00 -1.26 -3.94 115.22 125.33 2k5q n HIS 23 Ca 0.47 -0.29 -0.42 0.00 -0.00 0.00 0.00 57.72 57.48 2k5q n HIS 23 Cb 0.46 0.00 0.01 0.00 -0.00 0.00 0.00 29.99 30.45 2k5q n HIS 23 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2k5q n SER 24 N 0.84 6.19 -0.11 0.26 2.88 -1.26 -3.86 113.62 118.56 2k5q n SER 24 Ca 0.16 -3.23 0.00 0.00 -1.33 0.00 0.00 58.87 54.47 2k5q n SER 24 Cb 0.39 -1.38 0.00 0.00 -0.75 0.00 0.00 64.21 62.47 2k5q n SER 24 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2k5q n LYS 25 N 2.53 0.00 0.32 -1.46 4.81 -1.26 -5.06 118.16 118.04 2k5q n LYS 25 Ca 0.42 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.73 2k5q n LYS 25 Cb 0.32 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.31 2k5q n LYS 25 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2k5q h ALA 26 N 0.00 -1.00 -4.92 3.14 0.00 -1.90 -3.49 119.26 111.08 2k5q h ALA 26 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2k5q h ALA 26 Cb 0.50 0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.55 2k5q h ALA 26 CO 0.00 -0.94 -1.22 -3.47 0.00 0.00 0.00 179.25 173.62 2k5q n ASP 27 N -4.70 -4.04 -2.42 0.00 2.03 -1.26 -4.19 116.55 101.97 2k5q n ASP 27 Ca -0.10 1.31 -0.19 0.00 0.52 0.00 0.00 54.79 56.32 2k5q n ASP 27 Cb 0.33 -5.03 -0.01 0.00 -0.72 0.00 0.00 41.12 35.68 2k5q n ASP 27 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2k5q n ASN 28 N 1.12 -5.45 0.00 1.67 3.02 -1.26 -4.79 115.26 109.57 2k5q n ASN 28 Ca -0.20 0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.38 2k5q n ASN 28 Cb 0.31 -4.55 0.00 0.00 -0.61 0.00 0.00 39.78 34.93 2k5q n ASN 28 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k5q n GLY 29 N -0.97 -1.80 3.46 7.41 0.00 -1.26 -5.10 105.19 106.93 2k5q n GLY 29 Ca -0.22 0.86 -0.44 0.00 0.00 0.00 0.00 46.02 46.22 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 3.75 -0.05 1.61 -2.07 -1.26 -4.65 119.66 116.99 2k5q s GLN 30 Ca 0.00 -2.00 0.10 0.00 -1.82 0.00 0.00 55.36 51.64 2k5q s GLN 30 Cb 0.00 -4.98 0.18 0.00 -1.09 0.00 0.00 33.01 27.11 2k5q s GLN 30 CO 0.00 -1.79 1.08 1.63 -1.32 0.00 0.00 175.29 174.89 2k5q n LYS 31 N 6.37 0.43 -3.99 9.60 5.02 -1.26 -5.09 118.16 129.24 2k5q n LYS 31 Ca 0.28 -1.73 -0.08 0.00 -2.02 0.00 0.00 58.31 54.76 2k5q n LYS 31 Cb 0.47 -0.73 -0.09 0.00 -0.02 0.00 0.00 35.03 34.65 2k5q n LYS 31 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 2k5q s TYR 32 N -0.93 0.35 0.03 2.13 1.13 -1.26 -5.17 117.35 113.62 2k5q s TYR 32 Ca 0.16 -0.80 -0.01 0.00 -1.41 0.00 0.00 57.07 55.01 2k5q s TYR 32 Cb 0.16 -0.25 -0.02 0.00 -1.10 0.00 0.00 41.96 40.76 2k5q s TYR 32 CO -0.03 -0.40 -0.00 0.15 -2.51 0.00 0.00 175.55 172.76 2k5q s LYS 33 N -3.46 0.42 0.08 -3.49 1.02 -1.26 -4.84 119.74 108.21 2k5q s LYS 33 Ca 0.02 -0.75 0.05 0.00 0.02 0.00 0.00 55.97 55.31 2k5q s LYS 33 Cb 0.04 0.15 -0.03 0.00 -0.52 0.00 0.00 37.83 37.47 2k5q s LYS 33 CO -0.08 -0.08 -0.13 -0.51 -0.92 0.00 0.00 175.35 173.63 2k5q s ASP 34 N -1.85 1.60 -0.18 2.83 1.11 -1.25 -5.01 116.67 113.92 2k5q s ASP 34 Ca -0.10 -0.65 -0.07 0.00 0.18 0.00 0.00 52.55 51.92 2k5q s ASP 34 Cb -0.05 -0.04 -0.04 0.00 1.07 0.00 0.00 42.92 43.87 2k5q s ASP 34 CO -0.03 -0.11 0.05 -0.31 1.18 0.00 0.00 175.17 175.95 2k5q s TYR 35 N -1.48 3.22 -0.22 4.23 2.02 -1.08 0.08 117.35 124.13 2k5q s TYR 35 Ca -0.01 0.03 -0.10 0.00 -0.37 0.00 0.00 57.07 56.62 2k5q s TYR 35 Cb -0.09 -2.07 -0.05 0.00 -0.40 0.00 0.00 41.96 39.35 2k5q s TYR 35 CO 0.02 0.12 0.13 -2.00 -1.57 0.00 0.00 175.55 172.26 2k5q s GLU 36 N 0.40 4.10 -0.47 -0.62 2.12 0.03 -0.08 118.70 124.18 2k5q s GLU 36 Ca 0.02 -0.26 0.02 0.00 0.36 0.00 0.00 54.97 55.11 2k5q s GLU 36 Cb -0.13 -3.45 0.12 0.00 0.26 0.00 0.00 34.13 30.94 2k5q s GLU 36 CO 0.01 0.17 0.22 0.71 -0.54 0.00 0.00 175.26 175.83 2k5q s TYR 37 N 0.72 3.46 -0.79 5.30 1.51 0.21 -4.40 117.35 123.35 2k5q s TYR 37 Ca 0.07 -2.95 -0.17 0.00 -1.01 0.00 0.00 57.07 53.01 2k5q s TYR 37 Cb -0.12 -2.97 0.15 0.00 -0.11 0.00 0.00 41.96 38.91 2k5q s TYR 37 CO 0.01 -0.85 0.87 0.21 -1.11 0.00 0.00 175.55 174.68 2k5q s LYS 38 N 0.30 3.44 0.02 -0.62 2.20 -1.26 -1.40 119.74 122.42 2k5q s LYS 38 Ca 0.14 -1.88 0.00 0.00 -0.36 0.00 0.00 55.97 53.87 2k5q s LYS 38 Cb -0.22 -4.55 -0.04 0.00 -1.51 0.00 0.00 37.83 31.51 2k5q s LYS 38 CO -0.04 -1.53 0.08 -0.51 -0.36 0.00 0.00 175.35 172.99 2k5q s LEU 39 N 1.78 3.88 -0.72 5.43 1.43 -0.21 -4.68 118.68 125.59 2k5q s LEU 39 Ca 0.21 0.11 -0.25 0.00 -1.03 0.00 0.00 54.13 53.17 2k5q s LEU 39 Cb -0.12 -2.35 0.04 0.00 0.03 0.00 0.00 46.19 43.79 2k5q s LEU 39 CO -0.05 0.24 1.18 -0.89 0.23 0.00 0.00 176.35 177.07 2k5q s THR 40 N -1.25 3.93 -0.07 5.49 2.01 -1.26 -0.31 115.64 124.17 2k5q s THR 40 Ca 0.25 0.11 -0.22 0.00 0.31 0.00 0.00 61.69 62.14 2k5q s THR 40 Cb -0.12 -4.85 -0.04 0.00 0.01 0.00 0.00 72.50 67.50 2k5q s THR 40 CO 0.16 -1.73 0.63 -0.83 -0.69 0.00 0.00 174.62 172.16 2k5q s GLY 41 N 3.76 2.56 -0.30 4.40 0.00 0.23 -4.88 107.32 113.09 2k5q s GLY 41 Ca 0.31 0.04 -0.20 0.00 0.00 0.00 0.00 44.72 44.87 2k5q s GLY 41 CO 0.13 1.03 0.63 -1.36 0.00 0.00 0.00 173.10 173.52 2k5q s PHE 42 N 0.65 3.21 0.79 1.90 0.40 -1.26 -0.55 117.98 123.13 2k5q s PHE 42 Ca 0.34 0.58 -0.11 0.00 -0.60 0.00 0.00 56.93 57.13 2k5q s PHE 42 Cb -0.17 -2.98 0.07 0.00 0.51 0.00 0.00 43.02 40.44 2k5q s PHE 42 CO 0.16 -0.47 1.10 0.34 0.70 0.00 0.00 175.22 177.05 2k5q s ASP 43 N 1.64 4.54 0.42 1.36 -1.08 0.72 -4.76 116.67 119.51 2k5q s ASP 43 Ca 0.25 1.28 0.13 0.00 -0.52 0.00 0.00 52.55 53.69 2k5q s ASP 43 Cb -0.15 -2.02 0.99 0.00 -1.46 0.00 0.00 42.92 40.28 2k5q s ASP 43 CO 0.12 -1.94 1.96 0.11 0.52 0.00 0.00 175.17 175.94 2k5q h LYS 44 N -1.07 0.46 0.00 4.34 1.57 -1.94 0.92 116.57 120.86 2k5q h LYS 44 Ca -0.47 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2k5q h LYS 44 Cb 1.27 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2k5q h LYS 44 CO 0.60 0.30 0.00 -0.25 -0.57 0.00 0.00 179.45 179.53 2k5q n ASP 45 N -4.48 0.00 0.00 0.86 8.00 -1.26 -4.85 116.55 114.83 2k5q n ASP 45 Ca 0.11 -0.92 0.00 0.00 0.71 0.00 0.00 54.79 54.69 2k5q n ASP 45 Cb 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.49 2k5q n ASP 45 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2k5q n GLY 46 N 0.65 0.75 3.81 0.44 0.00 0.32 -5.05 105.19 106.10 2k5q n GLY 46 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.37 3.15 -0.41 1.61 1.02 -1.25 -4.74 119.74 118.75 2k5q s LYS 47 Ca 0.00 1.11 -0.05 0.00 0.02 0.00 0.00 55.97 57.05 2k5q s LYS 47 Cb 0.00 -2.01 0.10 0.00 -0.52 0.00 0.00 37.83 35.39 2k5q s LYS 47 CO 0.00 -0.94 0.21 -1.83 -0.92 0.00 0.00 175.35 171.87 2k5q s GLU 48 N -4.47 2.25 -0.00 1.68 -1.05 -1.26 -0.20 118.70 115.65 2k5q s GLU 48 Ca 0.61 -1.67 0.00 0.00 -0.15 0.00 0.00 54.97 53.77 2k5q s GLU 48 Cb -0.15 -3.63 -0.04 0.00 -0.44 0.00 0.00 34.13 29.87 2k5q s GLU 48 CO 0.44 -1.01 0.04 0.15 0.95 0.00 0.00 175.26 175.84 2k5q s LYS 49 N 1.25 2.93 -0.33 -4.83 1.02 0.29 -4.93 119.74 115.14 2k5q s LYS 49 Ca 0.05 -0.54 -0.17 0.00 0.02 0.00 0.00 55.97 55.33 2k5q s LYS 49 Cb -0.23 -2.77 -0.01 0.00 -0.52 0.00 0.00 37.83 34.30 2k5q s LYS 49 CO -0.02 0.64 0.47 -1.83 -0.92 0.00 0.00 175.35 173.69 2k5q s GLU 50 N -1.65 3.69 -0.45 1.68 4.04 -1.26 0.78 118.70 125.52 2k5q s GLU 50 Ca 0.21 -0.15 -0.14 0.00 0.04 0.00 0.00 54.97 54.94 2k5q s GLU 50 Cb -0.12 -3.78 0.07 0.00 0.02 0.00 0.00 34.13 30.33 2k5q s GLU 50 CO 0.12 -0.55 0.36 -0.51 -1.84 0.00 0.00 175.26 172.83 2k5q s LEU 51 N 2.28 5.47 -0.31 1.83 2.01 0.57 -4.92 118.68 125.61 2k5q s LEU 51 Ca 0.17 -1.34 -0.13 0.00 0.01 0.00 0.00 54.13 52.84 2k5q s LEU 51 Cb -0.16 -2.13 -0.03 0.00 0.01 0.00 0.00 46.19 43.88 2k5q s LEU 51 CO 0.12 -0.61 0.28 -1.83 1.01 0.00 0.00 176.35 175.33 2k5q s GLU 52 N 1.59 3.72 -0.01 1.70 -1.05 -1.26 -1.05 118.70 122.35 2k5q s GLU 52 Ca 0.04 -0.38 -0.00 0.00 -0.15 0.00 0.00 54.97 54.47 2k5q s GLU 52 Cb -0.24 -3.74 0.00 0.00 -0.44 0.00 0.00 34.13 29.71 2k5q s GLU 52 CO 0.06 -0.37 0.01 -0.59 0.95 0.00 0.00 175.26 175.32 2k5q s PHE 53 N 1.88 -0.01 0.15 4.83 -0.71 -0.49 -4.71 117.98 118.91 2k5q s PHE 53 Ca 0.09 0.04 -0.16 0.00 -1.04 0.00 0.00 56.93 55.86 2k5q s PHE 53 Cb -0.17 0.00 -0.07 0.00 -1.21 0.00 0.00 43.02 41.58 2k5q s PHE 53 CO 0.11 -0.01 0.58 0.95 -1.34 0.00 0.00 175.22 175.51 2k5q s THR 54 N 0.02 4.79 0.28 -4.49 -4.23 -1.26 -0.62 115.64 110.13 2k5q s THR 54 Ca -0.00 0.97 0.06 0.00 -1.18 0.00 0.00 61.69 61.54 2k5q s THR 54 Cb -0.00 -3.78 -0.06 0.00 1.34 0.00 0.00 72.50 70.00 2k5q s THR 54 CO -0.00 0.29 -0.04 0.00 -0.54 0.00 0.00 174.62 174.34 2k5q s ALA 55 N -1.41 2.27 -0.14 3.99 0.00 0.88 -4.96 121.76 122.40 2k5q s ALA 55 Ca 0.37 -1.90 0.15 0.00 0.00 0.00 0.00 51.96 50.58 2k5q s ALA 55 Cb -0.16 0.29 -0.02 0.00 0.00 0.00 0.00 23.12 23.23 2k5q s ALA 55 CO 0.19 -0.13 1.23 -0.56 0.00 0.00 0.00 175.76 176.49 2k5q h GLN 56 N 2.29 0.00 -4.71 0.00 3.07 -1.97 -2.85 115.11 110.94 2k5q h GLN 56 Ca -0.40 0.00 -0.30 0.00 0.09 0.00 0.00 58.65 58.05 2k5q h GLN 56 Cb 1.23 0.00 -0.15 0.00 0.08 0.00 0.00 27.48 28.65 2k5q h GLN 56 CO 0.67 0.44 -0.61 0.15 0.09 0.00 0.00 178.83 179.58 2k5q s LYS 57 N -2.94 1.32 -0.55 0.06 1.02 -1.26 -4.87 119.74 112.51 2k5q s LYS 57 Ca 0.02 -1.71 -0.27 0.00 0.02 0.00 0.00 55.97 54.02 2k5q s LYS 57 Cb 0.08 0.09 -0.01 0.00 -0.52 0.00 0.00 37.83 37.48 2k5q s LYS 57 CO 0.77 -0.38 1.67 -0.80 -0.92 0.00 0.00 175.35 175.69 2k5q s ASN 58 N -3.23 5.71 0.60 2.83 0.01 -1.26 -4.90 114.94 114.71 2k5q s ASN 58 Ca 0.38 0.44 -0.19 0.00 -0.71 0.00 0.00 52.86 52.79 2k5q s ASN 58 Cb 0.07 -2.54 -0.03 0.00 0.41 0.00 0.00 41.25 39.16 2k5q s ASN 58 CO 0.14 -2.01 1.25 -0.76 -1.51 0.00 0.00 177.10 174.21 2k5q s LEU 59 N 7.50 3.66 -0.27 0.60 1.43 -1.26 -4.84 118.68 125.50 2k5q s LEU 59 Ca 0.62 2.50 -0.30 0.00 -1.03 0.00 0.00 54.13 55.93 2k5q s LEU 59 Cb -0.13 -4.56 -0.07 0.00 0.03 0.00 0.00 46.19 41.45 2k5q s LEU 59 CO 0.24 -1.71 2.22 0.54 0.23 0.00 0.00 176.35 177.88 2k5q n ARG 60 N -1.60 1.66 -1.83 1.70 1.74 -1.26 -4.93 116.66 112.14 2k5q n ARG 60 Ca 0.14 0.44 -0.41 0.00 -0.77 0.00 0.00 57.85 57.25 2k5q n ARG 60 Cb 0.49 -3.01 -0.01 0.00 -1.02 0.00 0.00 32.46 28.91 2k5q n ARG 60 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2k5q s LYS 61 N 6.40 4.14 -0.04 5.56 1.02 -1.26 -1.60 119.74 133.96 2k5q s LYS 61 Ca 1.04 2.53 0.00 0.00 0.02 0.00 0.00 55.97 59.56 2k5q s LYS 61 Cb -0.49 -3.01 0.00 0.00 -0.52 0.00 0.00 37.83 33.81 2k5q s LYS 61 CO 0.39 -0.54 0.00 0.39 -0.92 0.00 0.00 175.35 174.67 2k5q n GLU 62 N 1.29 -0.62 -3.52 1.68 -0.58 -1.26 -5.01 120.64 112.62 2k5q n GLU 62 Ca 0.04 0.19 -0.27 0.00 -0.42 0.00 0.00 57.16 56.71 2k5q n GLU 62 Cb 0.39 -3.68 -0.03 0.00 -0.57 0.00 0.00 31.44 27.55 2k5q n GLU 62 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2k5q s ALA 63 N -1.72 3.74 -0.31 0.62 0.00 -0.63 -4.88 121.76 118.58 2k5q s ALA 63 Ca 0.00 -0.76 -0.11 0.00 0.00 0.00 0.00 51.96 51.08 2k5q s ALA 63 Cb 0.00 -2.11 -0.03 0.00 0.00 0.00 0.00 23.12 20.98 2k5q s ALA 63 CO 0.00 0.28 0.19 -0.06 0.00 0.00 0.00 175.76 176.17 2k5q s PHE 64 N -2.03 3.21 -0.27 0.00 0.40 0.51 -3.78 117.98 116.01 2k5q s PHE 64 Ca 0.40 -0.17 -0.17 0.00 -0.60 0.00 0.00 56.93 56.39 2k5q s PHE 64 Cb -0.11 -2.40 -0.03 0.00 0.51 0.00 0.00 43.02 40.99 2k5q s PHE 64 CO 0.31 -0.31 0.49 -0.51 0.70 0.00 0.00 175.22 175.90 2k5q s LEU 65 N 1.71 4.07 -0.99 -0.37 1.43 0.95 -0.58 118.68 124.89 2k5q s LEU 65 Ca 0.06 0.44 -0.22 0.00 -1.03 0.00 0.00 54.13 53.38 2k5q s LEU 65 Cb -0.17 -2.62 0.07 0.00 0.03 0.00 0.00 46.19 43.50 2k5q s LEU 65 CO 0.09 -0.28 1.38 -0.60 0.23 0.00 0.00 176.35 177.16 2k5q s ARG 66 N 2.28 3.58 -0.18 1.70 3.52 0.34 -2.19 118.95 128.00 2k5q s ARG 66 Ca 0.20 -1.23 -0.25 0.00 -0.13 0.00 0.00 55.73 54.32 2k5q s ARG 66 Cb -0.16 -5.23 -0.01 0.00 -1.56 0.00 0.00 34.95 27.99 2k5q s ARG 66 CO 0.10 -2.11 0.83 0.08 -0.81 0.00 0.00 175.30 173.38 2k5q s VAL 67 N 4.51 4.88 -0.14 7.11 1.01 -0.37 -2.06 120.40 135.34 2k5q s VAL 67 Ca 0.43 1.61 -0.21 0.00 0.00 0.00 0.00 61.98 63.81 2k5q s VAL 67 Cb -0.01 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 2k5q s VAL 67 CO -0.09 0.02 0.63 -0.47 0.00 0.00 0.00 175.10 175.19 2k5q s TYR 68 N 2.23 3.46 -0.13 5.22 5.04 0.13 -1.02 117.35 132.29 2k5q s TYR 68 Ca 0.38 1.04 -0.29 0.00 -2.44 0.00 0.00 57.07 55.75 2k5q s TYR 68 Cb -0.16 -2.77 -0.02 0.00 0.35 0.00 0.00 41.96 39.36 2k5q s TYR 68 CO 0.12 -0.04 1.28 -1.58 -1.34 0.00 0.00 175.55 173.99 2k5q s HIS 69 N 1.35 2.86 0.40 4.97 5.65 -1.13 -3.63 115.29 125.76 2k5q s HIS 69 Ca 0.31 0.99 0.04 0.00 0.25 0.00 0.00 55.06 56.65 2k5q s HIS 69 Cb -0.16 -3.52 -0.03 0.00 -1.18 0.00 0.00 32.58 27.69 2k5q s HIS 69 CO 0.13 -1.79 0.12 0.45 -0.65 0.00 0.00 174.74 172.99 2k5q s SER 70 N 1.95 2.78 -0.21 9.88 0.15 0.39 -4.79 113.70 123.85 2k5q s SER 70 Ca 0.57 -1.65 -0.16 0.00 0.70 0.00 0.00 55.95 55.41 2k5q s SER 70 Cb -0.23 0.45 -0.10 0.00 -1.71 0.00 0.00 66.02 64.42 2k5q s SER 70 CO 0.18 -0.90 -0.19 0.47 1.20 0.00 0.00 173.24 173.99 2k5q n ASP 71 N -1.24 1.90 -0.33 5.45 9.92 -1.26 -3.53 116.55 127.46 2k5q n ASP 71 Ca -0.06 0.41 0.15 0.00 -0.53 0.00 0.00 54.79 54.76 2k5q n ASP 71 Cb 0.65 -0.84 0.34 0.00 -0.64 0.00 0.00 41.12 40.63 2k5q n ASP 71 CO 0.00 0.00 0.00 0.07 0.13 0.00 0.00 177.20 177.40 2k5q h LYS 72 N -1.00 0.53 0.00 -1.24 2.10 -1.99 -3.21 116.57 111.76 2k5q h LYS 72 Ca -0.32 -0.03 -0.13 0.00 -2.00 0.00 0.00 60.65 58.17 2k5q h LYS 72 Cb 1.19 -0.12 -0.21 0.00 -0.90 0.00 0.00 32.23 32.19 2k5q h LYS 72 CO -0.19 0.35 -0.57 1.17 -2.00 0.00 0.00 179.45 178.21 2k5q n LYS 73 N -4.92 0.00 0.00 0.07 3.00 -1.26 -5.01 118.16 110.03 2k5q n LYS 73 Ca 0.24 -1.29 0.00 0.00 -0.00 0.00 0.00 58.31 57.26 2k5q n LYS 73 Cb 0.67 0.18 0.00 0.00 0.00 0.00 0.00 35.03 35.89 2k5q n LYS 73 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2k5q n GLY 74 N 0.19 1.19 3.43 3.14 0.00 -1.22 -4.87 105.19 107.06 2k5q n GLY 74 Ca -0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 2k5q n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k5q s VAL 75 N 0.00 2.62 0.00 1.61 1.01 -1.26 -0.46 120.40 123.92 2k5q s VAL 75 Ca 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 61.98 60.64 2k5q s VAL 75 Cb 0.00 -2.11 0.00 0.00 0.00 0.00 0.00 36.38 34.27 2k5q s VAL 75 CO 0.00 0.28 0.00 -0.24 0.00 0.00 0.00 175.10 175.14 2k5q n SER 76 N 1.40 0.91 -3.98 3.32 2.88 -1.24 -4.84 113.62 112.07 2k5q n SER 76 Ca -0.16 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.26 2k5q n SER 76 Cb 0.52 0.04 -0.12 0.00 -0.75 0.00 0.00 64.21 63.90 2k5q n SER 76 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k5q s ALA 77 N -1.21 0.26 -0.10 -1.46 0.00 -1.26 -5.06 121.76 112.93 2k5q s ALA 77 Ca 0.00 -0.47 -0.16 0.00 0.00 0.00 0.00 51.96 51.33 2k5q s ALA 77 Cb 0.00 0.06 0.04 0.00 0.00 0.00 0.00 23.12 23.21 2k5q s ALA 77 CO 0.00 -0.05 0.41 1.67 0.00 0.00 0.00 175.76 177.78 2k5q s TRP 78 N -0.96 -0.38 0.01 0.00 1.48 -1.26 -0.70 118.94 117.13 2k5q s TRP 78 Ca -0.09 0.83 0.06 0.00 -1.06 0.00 0.00 56.10 55.84 2k5q s TRP 78 Cb -0.07 0.16 -0.03 0.00 -1.16 0.00 0.00 33.47 32.37 2k5q s TRP 78 CO -0.00 -0.32 -0.16 -1.21 -4.06 0.00 0.00 176.95 171.19 2k5q s GLU 79 N -0.45 2.24 -0.76 3.25 2.02 -0.87 -4.91 118.70 119.23 2k5q s GLU 79 Ca -0.06 -0.87 -0.13 0.00 0.02 0.00 0.00 54.97 53.93 2k5q s GLU 79 Cb -0.03 -2.26 0.20 0.00 0.10 0.00 0.00 34.13 32.13 2k5q s GLU 79 CO 0.03 0.57 0.69 -2.00 0.02 0.00 0.00 175.26 174.57 2k5q s GLU 80 N -1.18 3.39 0.50 1.61 2.12 -1.26 -0.50 118.70 123.37 2k5q s GLU 80 Ca 0.14 -2.33 0.05 0.00 0.36 0.00 0.00 54.97 53.18 2k5q s GLU 80 Cb -0.11 -4.34 0.00 0.00 0.26 0.00 0.00 34.13 29.95 2k5q s GLU 80 CO 0.04 -1.28 0.26 0.14 -0.54 0.00 0.00 175.26 173.87 2k5q s VAL 81 N 0.40 1.75 0.41 3.70 -7.23 0.25 -4.93 120.40 114.75 2k5q s VAL 81 Ca 0.15 -1.64 0.07 0.00 -1.81 0.00 0.00 61.98 58.75 2k5q s VAL 81 Cb -0.15 -2.40 -0.07 0.00 0.56 0.00 0.00 36.38 34.32 2k5q s VAL 81 CO -0.06 0.00 0.04 -1.59 -0.31 0.00 0.00 175.10 173.17 2k5q s LYS 82 N -4.09 2.00 0.63 4.82 -2.85 -1.26 -0.37 119.74 118.62 2k5q s LYS 82 Ca 0.30 -2.08 0.39 0.00 -1.00 0.00 0.00 55.97 53.58 2k5q s LYS 82 Cb 0.00 -1.69 2.15 0.00 -2.06 0.00 0.00 37.83 36.23 2k5q s LYS 82 CO 0.18 -0.06 2.31 1.57 0.10 0.00 0.00 175.35 179.44 2k5q h LYS 83 N 1.71 0.00 0.00 1.78 -0.00 -1.90 0.68 116.57 118.85 2k5q h LYS 83 Ca -0.44 0.00 -0.01 0.00 -0.00 0.00 0.00 60.65 60.21 2k5q h LYS 83 Cb 1.24 0.00 -0.00 0.00 -0.00 0.00 0.00 32.23 33.47 2k5q h LYS 83 CO 0.79 0.01 -0.02 -0.44 -0.00 0.00 0.00 179.45 179.79 2k5q h ASP 84 N 0.00 0.00 0.00 7.07 5.19 -2.00 -2.87 116.42 123.81 2k5q h ASP 84 Ca -0.00 0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 56.28 2k5q h ASP 84 Cb 0.04 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.53 2k5q h ASP 84 CO 0.00 0.02 -0.76 -0.33 -3.12 0.00 0.00 179.24 175.05 2k5q h GLU 85 N 0.00 0.00 -5.23 3.56 4.39 -1.27 -3.46 114.58 112.58 2k5q h GLU 85 Ca -0.00 0.00 -0.65 0.00 0.34 0.00 0.00 59.36 59.05 2k5q h GLU 85 Cb 0.08 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 28.57 2k5q h GLU 85 CO 0.00 0.88 -0.06 -0.51 -1.16 0.00 0.00 179.01 178.17 2k5q s LEU 86 N -8.03 4.35 0.91 1.33 1.43 -1.08 -5.07 118.68 112.52 2k5q s LEU 86 Ca -0.24 -0.04 -0.11 0.00 -1.03 0.00 0.00 54.13 52.72 2k5q s LEU 86 Cb 0.03 -2.58 0.14 0.00 0.03 0.00 0.00 46.19 43.81 2k5q s LEU 86 CO 0.57 -0.48 1.11 -2.16 0.23 0.00 0.00 176.35 175.62 2k5q s PRO 87 N 2.38 1.06 0.65 1.29 0.04 -1.26 -4.65 135.00 134.51 2k5q s PRO 87 Ca 0.18 1.23 0.29 0.00 0.04 0.00 0.00 61.00 62.74 2k5q s PRO 87 Cb -0.15 -1.76 1.53 0.00 0.04 0.00 0.00 34.50 34.16 2k5q s PRO 87 CO 0.13 -2.50 1.88 0.00 0.04 0.00 0.00 177.00 176.56 2k5q h ALA 88 N -1.76 1.56 -1.35 8.56 0.00 -1.98 -1.53 119.26 122.78 2k5q h ALA 88 Ca -0.47 -0.00 0.39 0.00 0.00 0.00 0.00 54.91 54.83 2k5q h ALA 88 Cb 1.27 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.99 2k5q h ALA 88 CO 0.47 -0.45 0.94 0.87 0.00 0.00 0.00 179.25 181.08 2k5q h LYS 89 N 0.00 0.08 0.95 0.00 6.56 -1.97 0.12 116.57 122.30 2k5q h LYS 89 Ca 0.05 -0.00 -0.05 0.00 -1.06 0.00 0.00 60.65 59.59 2k5q h LYS 89 Cb 0.83 -0.02 0.01 0.00 -0.57 0.00 0.00 32.23 32.48 2k5q h LYS 89 CO -0.00 0.05 -0.46 0.28 -2.06 0.00 0.00 179.45 177.27 2k5q h VAL 90 N 0.09 0.05 0.00 0.50 2.07 -1.61 -0.34 116.25 117.00 2k5q h VAL 90 Ca 0.69 -0.03 -0.08 0.00 0.82 0.00 0.00 66.70 68.10 2k5q h VAL 90 Cb 2.50 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 32.30 2k5q h VAL 90 CO -0.14 0.00 -0.40 0.11 0.02 0.00 0.00 177.57 177.17 2k5q h LYS 91 N -1.30 0.00 0.12 1.57 1.57 -1.33 -0.61 116.57 116.58 2k5q h LYS 91 Ca -0.13 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.49 2k5q h LYS 91 Cb 0.98 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.31 2k5q h LYS 91 CO 0.21 0.40 -0.68 0.93 -0.57 0.00 0.00 179.45 179.74 2k5q h GLU 92 N 0.00 0.25 0.00 3.15 5.08 -0.89 -3.42 114.58 118.75 2k5q h GLU 92 Ca -0.00 -0.43 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2k5q h GLU 92 Cb 1.04 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2k5q h GLU 92 CO 0.05 1.21 -0.65 1.63 -1.00 0.00 0.00 179.01 180.25 2k5q n LYS 93 N -4.20 0.45 0.00 2.33 4.01 -0.14 -5.05 118.16 115.57 2k5q n LYS 93 Ca -0.13 0.40 0.00 0.00 -0.51 0.00 0.00 58.31 58.07 2k5q n LYS 93 Cb 0.77 -1.55 0.00 0.00 -0.51 0.00 0.00 35.03 33.74 2k5q n LYS 93 CO 0.00 0.00 0.00 -0.11 -1.11 0.00 0.00 177.40 176.18 2k5q n LEU 94 N -4.44 0.00 0.00 -0.35 0.00 -0.27 -4.97 117.00 106.97 2k5q n LEU 94 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.92 2k5q n LEU 94 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.76 2k5q n LEU 94 CO 0.14 0.00 0.00 0.61 0.00 0.00 0.00 177.39 178.14 2k5q n GLY 95 N 0.00 1.75 3.70 -3.96 0.00 -1.02 -4.73 105.19 100.94 2k5q n GLY 95 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2k5q n GLY 95 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2k5q n VAL 96 N 0.00 3.58 -3.14 1.61 0.24 -1.26 -4.90 118.33 114.46 2k5q n VAL 96 Ca 0.00 -0.37 -0.39 0.00 -2.04 0.00 0.00 64.34 61.53 2k5q n VAL 96 Cb 0.00 -1.33 -0.06 0.00 -1.47 0.00 0.00 33.84 30.98 2k5q n VAL 96 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2k5q s LYS 97 N -3.65 4.30 -0.40 7.34 -0.14 -1.26 -5.02 119.74 120.92 2k5q s LYS 97 Ca 0.78 0.65 0.02 0.00 -1.36 0.00 0.00 55.97 56.06 2k5q s LYS 97 Cb -0.34 -3.51 0.16 0.00 -1.68 0.00 0.00 37.83 32.45 2k5q s LYS 97 CO 0.45 -0.07 0.29 -0.48 -0.76 0.00 0.00 175.35 174.78 2k5q s LEU 98 N 1.32 1.40 0.00 3.17 2.34 -1.26 -4.90 118.68 120.74 2k5q s LEU 98 Ca 0.30 -2.71 0.00 0.00 0.06 0.00 0.00 54.13 51.78 2k5q s LEU 98 Cb -0.16 -0.48 0.00 0.00 -0.56 0.00 0.00 46.19 44.98 2k5q s LEU 98 CO 0.12 -0.23 0.00 -1.84 -1.06 0.00 0.00 176.35 173.35 2k5q n GLU 99 N 3.33 1.10 -2.13 1.48 0.28 -1.26 -5.03 120.64 118.42 2k5q n GLU 99 Ca 0.21 0.00 -0.19 0.00 -0.16 0.00 0.00 57.16 57.03 2k5q n GLU 99 Cb 0.42 -0.26 -0.03 0.00 1.43 0.00 0.00 31.44 33.01 2k5q n GLU 99 CO 0.00 0.00 0.00 1.58 -0.16 0.00 0.00 177.13 178.55 2k5q n HIS 100 N -0.32 -0.64 -2.81 -1.84 -0.00 -1.26 -4.94 115.22 103.41 2k5q n HIS 100 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.29 2k5q n HIS 100 Cb 0.00 -3.52 -0.04 0.00 -0.00 0.00 0.00 29.99 26.43 2k5q n HIS 100 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2k5q s HIS 101 N -2.87 2.80 -0.30 1.57 5.04 -1.26 -4.90 115.29 115.37 2k5q s HIS 101 Ca 0.00 0.11 -0.15 0.00 -1.54 0.00 0.00 55.06 53.48 2k5q s HIS 101 Cb 0.00 -4.10 0.18 0.00 0.04 0.00 0.00 32.58 28.70 2k5q s HIS 101 CO 0.00 -1.32 1.15 -1.58 -2.34 0.00 0.00 174.74 170.65 2k5q s HIS 102 N 4.01 -0.20 -0.10 3.88 2.46 -1.26 -5.14 115.29 118.95 2k5q s HIS 102 Ca 0.33 0.14 -0.29 0.00 0.47 0.00 0.00 55.06 55.71 2k5q s HIS 102 Cb -0.11 0.04 -0.04 0.00 -0.13 0.00 0.00 32.58 32.34 2k5q s HIS 102 CO 0.21 -0.11 1.50 -1.58 -2.47 0.00 0.00 174.74 172.29 2k5q s HIS 103 N 2.98 2.31 -0.19 3.88 2.46 -1.26 -4.99 115.29 120.49 2k5q s HIS 103 Ca 0.20 0.50 -0.04 0.00 0.47 0.00 0.00 55.06 56.19 2k5q s HIS 103 Cb -0.03 -3.76 0.06 0.00 -0.13 0.00 0.00 32.58 28.73 2k5q s HIS 103 CO -0.18 -3.03 0.08 -3.38 -2.47 0.00 0.00 174.74 165.76 2k5q s HIS 104 N 3.83 0.45 0.00 3.88 -3.43 -1.26 -5.27 115.29 113.48 2k5q s HIS 104 Ca 0.66 -0.53 0.00 0.00 -0.80 0.00 0.00 55.06 54.40 2k5q s HIS 104 Cb -0.29 -0.81 0.00 0.00 -1.43 0.00 0.00 32.58 30.05 2k5q s HIS 104 CO 0.24 -0.57 0.00 0.72 -2.00 0.00 0.00 174.74 173.13