#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 7.04 0.00 3.17 1.01 -1.26 -4.94 116.67 121.69 2k5q s ASP 2 Ca 0.00 1.27 0.07 0.00 0.71 0.00 0.00 52.55 54.60 2k5q s ASP 2 Cb 0.00 -2.46 0.38 0.00 1.01 0.00 0.00 42.92 41.85 2k5q s ASP 2 CO 0.00 -0.27 1.25 0.18 0.21 0.00 0.00 175.17 176.54 2k5q n LEU 3 N 4.46 0.25 -4.64 1.23 4.77 -1.26 -4.84 117.00 116.98 2k5q n LEU 3 Ca 0.03 -0.12 -0.43 0.00 -0.03 0.00 0.00 56.01 55.46 2k5q n LEU 3 Cb 0.50 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.54 2k5q n LEU 3 CO 0.48 0.06 1.31 0.20 -1.33 0.00 0.00 177.39 178.11 2k5q s ASN 4 N -1.19 6.50 -0.93 -1.43 0.01 -1.26 -3.96 114.94 112.69 2k5q s ASN 4 Ca 0.12 1.63 -0.08 0.00 -0.71 0.00 0.00 52.86 53.82 2k5q s ASN 4 Cb 0.06 -2.53 -0.01 0.00 0.41 0.00 0.00 41.25 39.17 2k5q s ASN 4 CO 0.09 -1.15 0.74 0.54 -1.51 0.00 0.00 177.10 175.80 2k5q n ARG 5 N 7.46 -1.44 -0.19 -0.60 1.74 -1.26 -4.89 116.66 117.48 2k5q n ARG 5 Ca 0.18 0.92 0.04 0.00 -0.77 0.00 0.00 57.85 58.22 2k5q n ARG 5 Cb 0.45 -4.49 0.13 0.00 -1.02 0.00 0.00 32.46 27.53 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 -2.93 1.86 -4.30 5.56 2.81 -1.25 -4.88 117.12 113.98 2k5q n MET 6 Ca -0.11 -1.08 -0.34 0.00 -1.81 0.00 0.00 57.70 54.37 2k5q n MET 6 Cb 0.59 -1.35 -0.11 0.00 -0.71 0.00 0.00 33.22 31.63 2k5q n MET 6 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2k5q s GLY 7 N -0.84 1.80 0.00 3.03 0.00 -1.26 -5.11 107.32 104.94 2k5q s GLY 7 Ca 0.20 -0.80 0.00 0.00 0.00 0.00 0.00 44.72 44.12 2k5q s GLY 7 CO 0.12 -0.16 0.00 0.28 0.00 0.00 0.00 173.10 173.33 2k5q n LYS 8 N 3.18 3.72 -2.26 2.90 4.01 -1.26 -5.02 118.16 123.43 2k5q n LYS 8 Ca -0.17 0.00 -0.39 0.00 -0.51 0.00 0.00 58.31 57.24 2k5q n LYS 8 Cb 0.53 0.00 -0.02 0.00 -0.51 0.00 0.00 35.03 35.03 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 -1.00 6.54 -0.25 4.39 1.11 -1.15 -4.91 116.67 121.40 2k5q s ASP 9 Ca 0.00 2.40 0.00 0.00 0.18 0.00 0.00 52.55 55.14 2k5q s ASP 9 Cb 0.00 -2.62 0.07 0.00 1.07 0.00 0.00 42.92 41.44 2k5q s ASP 9 CO 0.00 -0.66 -0.02 -0.70 1.18 0.00 0.00 175.17 174.97 2k5q s GLU 10 N -2.22 1.40 -0.16 8.23 2.56 -1.26 -0.72 118.70 126.52 2k5q s GLU 10 Ca 0.56 -1.03 -0.14 0.00 0.00 0.00 0.00 54.97 54.36 2k5q s GLU 10 Cb -0.32 -2.53 -0.05 0.00 2.00 0.00 0.00 34.13 33.24 2k5q s GLU 10 CO 0.41 -0.68 0.29 0.71 -0.56 0.00 0.00 175.26 175.43 2k5q s TYR 11 N 1.42 3.45 -0.51 5.30 1.51 -0.94 -4.86 117.35 122.72 2k5q s TYR 11 Ca -0.02 0.59 -0.16 0.00 -1.01 0.00 0.00 57.07 56.47 2k5q s TYR 11 Cb -0.18 -2.35 0.11 0.00 -0.11 0.00 0.00 41.96 39.43 2k5q s TYR 11 CO -0.09 0.22 0.46 0.71 -1.11 0.00 0.00 175.55 175.74 2k5q s TYR 12 N 0.52 3.25 0.48 2.71 1.51 -1.26 -1.19 117.35 123.37 2k5q s TYR 12 Ca 0.16 -1.18 0.01 0.00 -1.01 0.00 0.00 57.07 55.05 2k5q s TYR 12 Cb -0.13 -3.56 -0.00 0.00 -0.11 0.00 0.00 41.96 38.16 2k5q s TYR 12 CO 0.04 -0.94 0.04 1.33 -1.11 0.00 0.00 175.55 174.91 2k5q n VAL 13 N 5.22 0.00 -4.20 0.71 0.24 -0.91 -4.83 118.33 114.56 2k5q n VAL 13 Ca -0.13 -2.39 -0.12 0.00 -2.04 0.00 0.00 64.34 59.66 2k5q n VAL 13 Cb 0.41 0.58 -0.10 0.00 -1.47 0.00 0.00 33.84 33.26 2k5q n VAL 13 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k5q s GLN 14 N -3.75 0.93 -0.36 7.34 -2.07 -1.26 0.09 119.66 120.58 2k5q s GLN 14 Ca 0.06 -1.39 -0.28 0.00 -1.82 0.00 0.00 55.36 51.93 2k5q s GLN 14 Cb 0.00 -0.31 -0.03 0.00 -1.09 0.00 0.00 33.01 31.58 2k5q s GLN 14 CO 0.04 -0.01 2.01 0.42 -1.32 0.00 0.00 175.29 176.43 2k5q s ILE 15 N -3.56 3.26 -0.07 3.63 -1.09 -1.17 -4.87 121.20 117.33 2k5q s ILE 15 Ca 0.15 0.25 -0.03 0.00 -2.23 0.00 0.00 60.65 58.78 2k5q s ILE 15 Cb 0.05 -3.41 -0.01 0.00 -1.58 0.00 0.00 42.46 37.50 2k5q s ILE 15 CO -0.02 -0.31 -0.07 0.71 -1.23 0.00 0.00 174.94 174.03 2k5q h THR 16 N 7.04 0.00 -4.04 2.92 1.35 -1.88 -3.45 112.91 114.85 2k5q h THR 16 Ca -0.33 -0.54 -0.50 0.00 -0.55 0.00 0.00 66.41 64.48 2k5q h THR 16 Cb 1.20 0.00 -0.30 0.00 -1.73 0.00 0.00 68.15 67.32 2k5q h THR 16 CO 1.05 0.00 -0.82 0.68 -0.25 0.00 0.00 175.52 176.19 2k5q s VAL 17 N -1.56 1.16 0.17 6.82 -7.23 -1.26 -5.12 120.40 113.38 2k5q s VAL 17 Ca -0.06 -0.60 0.02 0.00 -1.81 0.00 0.00 61.98 59.54 2k5q s VAL 17 Cb 0.01 -0.99 -0.01 0.00 0.56 0.00 0.00 36.38 35.95 2k5q s VAL 17 CO 0.08 0.34 0.06 -0.90 -0.31 0.00 0.00 175.10 174.37 2k5q n ASP 18 N 2.97 1.00 0.00 4.85 5.68 -1.26 -4.42 116.55 125.37 2k5q n ASP 18 Ca -0.16 -1.90 0.00 0.00 -0.50 0.00 0.00 54.79 52.23 2k5q n ASP 18 Cb 0.54 0.44 0.00 0.00 -1.14 0.00 0.00 41.12 40.96 2k5q n ASP 18 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2k5q n GLY 19 N 0.99 1.58 3.56 6.12 0.00 -1.26 -4.93 105.19 111.25 2k5q n GLY 19 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.11 2.64 -0.51 1.61 1.02 -1.26 -4.93 119.74 118.20 2k5q s LYS 20 Ca 0.00 -0.32 -0.27 0.00 0.02 0.00 0.00 55.97 55.40 2k5q s LYS 20 Cb 0.00 -5.05 0.03 0.00 -0.52 0.00 0.00 37.83 32.29 2k5q s LYS 20 CO 0.00 -3.25 1.08 -1.83 -0.92 0.00 0.00 175.35 170.42 2k5q s GLU 21 N 6.84 3.56 -0.64 1.68 -1.05 -1.26 -0.58 118.70 127.25 2k5q s GLU 21 Ca 0.68 0.26 -0.22 0.00 -0.15 0.00 0.00 54.97 55.54 2k5q s GLU 21 Cb -0.06 -3.96 0.08 0.00 -0.44 0.00 0.00 34.13 29.74 2k5q s GLU 21 CO -0.01 -1.45 0.92 0.14 0.95 0.00 0.00 175.26 175.81 2k5q s VAL 22 N 4.37 4.42 0.00 1.83 -7.23 0.22 -4.83 120.40 119.18 2k5q s VAL 22 Ca 0.42 -0.45 0.00 0.00 -1.81 0.00 0.00 61.98 60.13 2k5q s VAL 22 Cb -0.09 -4.64 0.00 0.00 0.56 0.00 0.00 36.38 32.21 2k5q s VAL 22 CO 0.27 -1.38 0.85 1.41 -0.31 0.00 0.00 175.10 175.94 2k5q n HIS 23 N 7.45 0.00 0.04 2.82 8.25 -1.26 -3.16 115.22 129.35 2k5q n HIS 23 Ca -0.05 -0.43 -0.10 0.00 -0.26 0.00 0.00 57.72 56.89 2k5q n HIS 23 Cb 0.45 -0.28 0.07 0.00 1.12 0.00 0.00 29.99 31.35 2k5q n HIS 23 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2k5q n SER 24 N 1.11 3.55 -1.14 0.41 2.88 -1.26 -3.25 113.62 115.91 2k5q n SER 24 Ca 0.00 -2.66 0.04 0.00 -1.33 0.00 0.00 58.87 54.92 2k5q n SER 24 Cb 0.30 -0.67 0.05 0.00 -0.75 0.00 0.00 64.21 63.14 2k5q n SER 24 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2k5q n LYS 25 N -0.09 0.30 -0.15 -1.46 5.02 -1.26 -4.88 118.16 115.62 2k5q n LYS 25 Ca 0.24 -2.06 0.05 0.00 -2.02 0.00 0.00 58.31 54.51 2k5q n LYS 25 Cb 0.93 -0.39 0.13 0.00 -0.02 0.00 0.00 35.03 35.68 2k5q n LYS 25 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2k5q n ALA 26 N 0.09 2.16 0.05 7.82 0.00 -1.20 -4.68 120.51 124.75 2k5q n ALA 26 Ca 0.07 -1.14 0.18 0.00 0.00 0.00 0.00 53.44 52.55 2k5q n ALA 26 Cb 0.99 -0.38 0.68 0.00 0.00 0.00 0.00 19.45 20.74 2k5q n ALA 26 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2k5q h ASP 27 N 1.72 0.00 1.57 0.00 5.19 -1.89 0.16 116.42 123.16 2k5q h ASP 27 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2k5q h ASP 27 Cb 0.71 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.22 2k5q h ASP 27 CO 0.00 0.00 0.00 -1.13 -3.12 0.00 0.00 179.24 174.99 2k5q h ASN 28 N 0.00 0.00 0.00 6.45 -1.24 -2.02 -3.46 115.58 115.31 2k5q h ASN 28 Ca 0.20 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.21 2k5q h ASN 28 Cb 0.81 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.86 2k5q h ASN 28 CO -0.00 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.75 2k5q n GLY 29 N 0.82 1.00 3.81 1.57 0.00 0.51 -5.17 105.19 107.73 2k5q n GLY 29 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 2k5q n GLY 29 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2k5q s GLN 30 N 0.01 2.21 0.00 1.61 -1.52 -0.97 -5.08 119.66 115.92 2k5q s GLN 30 Ca 0.00 -2.21 0.00 0.00 -1.95 0.00 0.00 55.36 51.20 2k5q s GLN 30 Cb 0.00 -1.78 0.00 0.00 -0.22 0.00 0.00 33.01 31.01 2k5q s GLN 30 CO 0.00 -0.43 0.14 1.63 -0.25 0.00 0.00 175.29 176.38 2k5q n LYS 31 N -1.44 0.00 -1.61 2.91 5.02 -1.26 -4.71 118.16 117.06 2k5q n LYS 31 Ca -0.11 -0.14 -0.30 0.00 -2.02 0.00 0.00 58.31 55.74 2k5q n LYS 31 Cb 0.66 -0.48 0.07 0.00 -0.02 0.00 0.00 35.03 35.26 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 0.00 3.00 0.20 2.13 1.13 -1.26 -5.00 117.35 117.55 2k5q s TYR 32 Ca 0.00 1.21 0.06 0.00 -1.41 0.00 0.00 57.07 56.93 2k5q s TYR 32 Cb 0.00 -3.04 -0.05 0.00 -1.10 0.00 0.00 41.96 37.77 2k5q s TYR 32 CO 0.00 -1.52 -0.10 0.15 -2.51 0.00 0.00 175.55 171.57 2k5q s LYS 33 N -5.16 1.27 0.03 -3.49 3.01 -1.26 -4.49 119.74 109.66 2k5q s LYS 33 Ca 0.59 -1.58 0.04 0.00 -1.01 0.00 0.00 55.97 54.02 2k5q s LYS 33 Cb -0.14 -0.89 -0.02 0.00 -1.01 0.00 0.00 37.83 35.77 2k5q s LYS 33 CO 0.54 0.09 -0.13 -0.51 0.51 0.00 0.00 175.35 175.85 2k5q s ASP 34 N -3.28 1.57 -0.35 2.83 1.01 -1.19 -4.94 116.67 112.32 2k5q s ASP 34 Ca 0.22 -0.42 -0.26 0.00 0.71 0.00 0.00 52.55 52.81 2k5q s ASP 34 Cb 0.02 -0.10 0.01 0.00 1.01 0.00 0.00 42.92 43.86 2k5q s ASP 34 CO 0.06 0.04 0.90 -0.31 0.21 0.00 0.00 175.17 176.07 2k5q s TYR 35 N -0.79 3.12 0.16 4.23 2.02 0.65 -0.61 117.35 126.14 2k5q s TYR 35 Ca 0.01 0.83 -0.30 0.00 -0.37 0.00 0.00 57.07 57.24 2k5q s TYR 35 Cb -0.07 -3.53 -0.07 0.00 -0.40 0.00 0.00 41.96 37.88 2k5q s TYR 35 CO 0.01 -0.75 1.00 -2.00 -1.57 0.00 0.00 175.55 172.24 2k5q s GLU 36 N 3.35 4.71 -0.32 -0.62 2.12 0.25 -0.27 118.70 127.91 2k5q s GLU 36 Ca 0.37 1.54 0.01 0.00 0.36 0.00 0.00 54.97 57.26 2k5q s GLU 36 Cb -0.13 -3.32 0.10 0.00 0.26 0.00 0.00 34.13 31.04 2k5q s GLU 36 CO 0.16 0.25 0.07 0.71 -0.54 0.00 0.00 175.26 175.92 2k5q s TYR 37 N -0.37 2.61 -0.19 5.30 1.51 0.11 -4.43 117.35 121.89 2k5q s TYR 37 Ca 0.46 -2.29 -0.04 0.00 -1.01 0.00 0.00 57.07 54.20 2k5q s TYR 37 Cb -0.26 -2.24 -0.02 0.00 -0.11 0.00 0.00 41.96 39.34 2k5q s TYR 37 CO 0.32 -0.91 -0.04 0.21 -1.11 0.00 0.00 175.55 174.02 2k5q s LYS 38 N 1.30 3.50 0.21 -0.62 2.36 -1.26 -1.67 119.74 123.55 2k5q s LYS 38 Ca 0.10 -0.58 -0.17 0.00 -2.55 0.00 0.00 55.97 52.76 2k5q s LYS 38 Cb -0.18 -2.97 0.02 0.00 -1.05 0.00 0.00 37.83 33.65 2k5q s LYS 38 CO -0.17 -0.02 0.54 -0.48 1.55 0.00 0.00 175.35 176.77 2k5q s LEU 39 N 1.03 0.05 -0.33 5.43 0.05 -0.42 -4.55 118.68 119.94 2k5q s LEU 39 Ca 0.01 -0.53 -0.21 0.00 0.05 0.00 0.00 54.13 53.45 2k5q s LEU 39 Cb -0.15 2.18 -0.00 0.00 -2.05 0.00 0.00 46.19 46.17 2k5q s LEU 39 CO 0.01 -1.09 0.66 -0.89 -0.55 0.00 0.00 176.35 174.48 2k5q s THR 40 N -3.89 4.89 -0.37 5.48 2.01 -1.26 -2.33 115.64 120.16 2k5q s THR 40 Ca 0.11 0.77 -0.11 0.00 0.31 0.00 0.00 61.69 62.77 2k5q s THR 40 Cb -0.01 -4.06 0.03 0.00 0.01 0.00 0.00 72.50 68.46 2k5q s THR 40 CO -0.01 -0.25 0.20 -0.83 -0.69 0.00 0.00 174.62 173.05 2k5q s GLY 41 N 1.72 1.93 -0.21 4.40 0.00 0.44 -4.91 107.32 110.69 2k5q s GLY 41 Ca 0.26 -1.74 -0.04 0.00 0.00 0.00 0.00 44.72 43.20 2k5q s GLY 41 CO 0.14 0.85 -0.03 -0.11 0.00 0.00 0.00 173.10 173.94 2k5q s PHE 42 N 1.54 2.98 0.26 1.90 -0.12 -1.26 -0.15 117.98 123.12 2k5q s PHE 42 Ca 0.02 -0.74 -0.07 0.00 -0.05 0.00 0.00 56.93 56.09 2k5q s PHE 42 Cb -0.19 -2.08 0.03 0.00 -0.63 0.00 0.00 43.02 40.14 2k5q s PHE 42 CO 0.06 -0.41 0.46 -3.47 -0.05 0.00 0.00 175.22 171.81 2k5q n ASP 43 N 4.51 -1.33 0.00 1.98 2.03 -0.93 -4.74 116.55 118.07 2k5q n ASP 43 Ca -0.18 -2.14 0.00 0.00 0.52 0.00 0.00 54.79 52.99 2k5q n ASP 43 Cb 0.51 2.28 0.00 0.00 -0.72 0.00 0.00 41.12 43.19 2k5q n ASP 43 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2k5q n LYS 44 N -0.37 0.00 -1.73 -0.67 3.00 -1.26 -3.28 118.16 113.85 2k5q n LYS 44 Ca -0.04 0.00 -0.04 0.00 -0.00 0.00 0.00 58.31 58.23 2k5q n LYS 44 Cb 0.40 0.00 0.03 0.00 0.00 0.00 0.00 35.03 35.45 2k5q n LYS 44 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2k5q n ASP 45 N 3.91 -1.07 -0.54 3.14 2.03 -1.26 -5.02 116.55 117.74 2k5q n ASP 45 Ca 0.00 -1.90 0.00 0.00 0.52 0.00 0.00 54.79 53.41 2k5q n ASP 45 Cb 0.00 0.43 0.00 0.00 -0.72 0.00 0.00 41.12 40.83 2k5q n ASP 45 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k5q n GLY 46 N -0.68 0.75 3.25 0.27 0.00 -1.21 -5.03 105.19 102.55 2k5q n GLY 46 Ca -0.20 -0.46 -0.26 0.00 0.00 0.00 0.00 46.02 45.11 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 -3.40 1.40 -0.01 1.61 1.02 -1.21 -4.96 119.74 114.18 2k5q s LYS 47 Ca 0.00 -0.95 -0.12 0.00 0.02 0.00 0.00 55.97 54.92 2k5q s LYS 47 Cb 0.00 -1.51 -0.05 0.00 -0.52 0.00 0.00 37.83 35.74 2k5q s LYS 47 CO 0.00 0.39 0.35 -1.21 -0.92 0.00 0.00 175.35 173.95 2k5q s GLU 48 N -1.19 3.79 0.03 1.68 2.02 -1.26 -2.20 118.70 121.56 2k5q s GLU 48 Ca 0.07 0.25 0.01 0.00 0.02 0.00 0.00 54.97 55.33 2k5q s GLU 48 Cb -0.09 -3.18 -0.02 0.00 0.10 0.00 0.00 34.13 30.94 2k5q s GLU 48 CO 0.02 0.69 -0.05 0.21 0.02 0.00 0.00 175.26 176.15 2k5q s LYS 49 N -1.21 0.38 -0.48 1.61 2.20 0.79 -4.94 119.74 118.09 2k5q s LYS 49 Ca 0.23 -0.61 -0.25 0.00 -0.36 0.00 0.00 55.97 54.98 2k5q s LYS 49 Cb -0.15 -0.08 0.03 0.00 -1.51 0.00 0.00 37.83 36.12 2k5q s LYS 49 CO 0.12 -0.00 0.90 -2.00 -0.36 0.00 0.00 175.35 174.02 2k5q s GLU 50 N -1.37 3.46 -0.10 4.03 2.12 -1.26 -0.42 118.70 125.16 2k5q s GLU 50 Ca -0.12 0.01 0.02 0.00 0.36 0.00 0.00 54.97 55.23 2k5q s GLU 50 Cb -0.09 -3.96 -0.02 0.00 0.26 0.00 0.00 34.13 30.32 2k5q s GLU 50 CO -0.00 -1.27 -0.15 -0.51 -0.54 0.00 0.00 175.26 172.79 2k5q s LEU 51 N 3.72 2.66 -0.21 2.70 2.01 -0.98 -4.97 118.68 123.61 2k5q s LEU 51 Ca 0.34 -0.31 -0.04 0.00 0.01 0.00 0.00 54.13 54.13 2k5q s LEU 51 Cb -0.11 -1.57 0.11 0.00 0.01 0.00 0.00 46.19 44.63 2k5q s LEU 51 CO 0.24 0.23 0.36 -1.83 1.01 0.00 0.00 176.35 176.36 2k5q s GLU 52 N -0.01 0.30 0.21 1.70 -1.05 -1.26 -1.31 118.70 117.28 2k5q s GLU 52 Ca -0.04 0.69 0.08 0.00 -0.15 0.00 0.00 54.97 55.55 2k5q s GLU 52 Cb -0.14 -0.23 -0.05 0.00 -0.44 0.00 0.00 34.13 33.27 2k5q s GLU 52 CO 0.04 -0.48 -0.15 -0.59 0.95 0.00 0.00 175.26 175.03 2k5q s PHE 53 N 2.53 1.79 -0.21 4.83 -0.71 -0.67 -4.91 117.98 120.62 2k5q s PHE 53 Ca 0.06 -0.53 -0.01 0.00 -1.04 0.00 0.00 56.93 55.41 2k5q s PHE 53 Cb -0.14 -0.83 0.01 0.00 -1.21 0.00 0.00 43.02 40.86 2k5q s PHE 53 CO -0.14 0.40 -0.12 0.95 -1.34 0.00 0.00 175.22 174.98 2k5q s THR 54 N -2.82 2.67 0.03 -4.49 -4.23 -1.26 0.08 115.64 105.62 2k5q s THR 54 Ca 0.23 -0.83 -0.05 0.00 -1.18 0.00 0.00 61.69 59.85 2k5q s THR 54 Cb -0.02 -2.22 -0.05 0.00 1.34 0.00 0.00 72.50 71.55 2k5q s THR 54 CO 0.08 0.41 0.27 0.00 -0.54 0.00 0.00 174.62 174.84 2k5q s ALA 55 N 1.35 3.87 0.04 3.99 0.00 0.62 -4.80 121.76 126.84 2k5q s ALA 55 Ca 0.04 -0.62 0.21 0.00 0.00 0.00 0.00 51.96 51.59 2k5q s ALA 55 Cb -0.14 -2.03 0.67 0.00 0.00 0.00 0.00 23.12 21.61 2k5q s ALA 55 CO -0.08 0.68 1.72 1.96 0.00 0.00 0.00 175.76 180.04 2k5q h GLN 56 N 3.69 0.00 -6.79 0.00 7.50 -1.92 0.19 115.11 117.77 2k5q h GLN 56 Ca -0.49 0.00 -0.67 0.00 0.50 0.00 0.00 58.65 57.99 2k5q h GLN 56 Cb 1.19 0.00 -0.22 0.00 0.05 0.00 0.00 27.48 28.50 2k5q h GLN 56 CO 0.68 0.29 -0.86 0.21 -1.50 0.00 0.00 178.83 177.66 2k5q s LYS 57 N -3.47 1.36 -0.23 1.46 2.20 -1.26 -4.78 119.74 115.02 2k5q s LYS 57 Ca 0.02 -1.33 -0.29 0.00 -0.36 0.00 0.00 55.97 54.01 2k5q s LYS 57 Cb 0.09 -1.82 -0.02 0.00 -1.51 0.00 0.00 37.83 34.57 2k5q s LYS 57 CO 0.67 0.43 1.50 1.21 -0.36 0.00 0.00 175.35 178.80 2k5q s ASN 58 N -2.05 6.51 1.02 1.43 3.84 -1.26 -4.89 114.94 119.54 2k5q s ASN 58 Ca 0.13 1.53 -0.07 0.00 0.21 0.00 0.00 52.86 54.66 2k5q s ASN 58 Cb -0.10 -2.53 0.10 0.00 -0.55 0.00 0.00 41.25 38.16 2k5q s ASN 58 CO 0.06 -1.16 0.53 0.18 -2.79 0.00 0.00 177.10 173.92 2k5q n LEU 59 N 8.03 0.00 -4.21 3.21 4.77 -1.26 -5.06 117.00 122.49 2k5q n LEU 59 Ca 0.17 -0.58 -0.28 0.00 -0.03 0.00 0.00 56.01 55.29 2k5q n LEU 59 Cb 0.45 -0.42 0.26 0.00 -2.33 0.00 0.00 43.42 41.39 2k5q n LEU 59 CO 0.64 -0.98 0.29 0.54 -1.33 0.00 0.00 177.39 176.54 2k5q n ARG 60 N -2.27 -4.04 0.00 3.23 1.74 -1.26 -5.05 116.66 109.00 2k5q n ARG 60 Ca 0.07 -1.19 0.00 0.00 -0.77 0.00 0.00 57.85 55.95 2k5q n ARG 60 Cb 0.24 -1.86 0.00 0.00 -1.02 0.00 0.00 32.46 29.82 2k5q n ARG 60 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2k5q n LYS 61 N -4.85 0.00 -2.00 5.56 4.01 -1.26 -4.81 118.16 114.81 2k5q n LYS 61 Ca 0.10 0.00 -0.42 0.00 -0.51 0.00 0.00 58.31 57.48 2k5q n LYS 61 Cb 0.54 0.00 -0.00 0.00 -0.51 0.00 0.00 35.03 35.06 2k5q n LYS 61 CO 0.00 0.00 0.00 -1.91 -1.11 0.00 0.00 177.40 174.38 2k5q n GLU 62 N -2.20 2.86 -3.63 1.97 2.13 -1.26 -4.04 120.64 116.47 2k5q n GLU 62 Ca 0.00 -2.79 -0.07 0.00 0.66 0.00 0.00 57.16 54.96 2k5q n GLU 62 Cb 0.00 -3.35 -0.02 0.00 0.27 0.00 0.00 31.44 28.34 2k5q n GLU 62 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2k5q s ALA 63 N 3.87 -1.61 0.30 4.31 0.00 -1.26 -5.03 121.76 122.33 2k5q s ALA 63 Ca 0.51 0.37 0.07 0.00 0.00 0.00 0.00 51.96 52.90 2k5q s ALA 63 Cb 0.10 0.67 -0.02 0.00 0.00 0.00 0.00 23.12 23.86 2k5q s ALA 63 CO -0.01 -0.89 0.34 -0.06 0.00 0.00 0.00 175.76 175.14 2k5q s PHE 64 N -3.45 3.11 -0.13 0.00 0.40 -1.16 -3.05 117.98 113.70 2k5q s PHE 64 Ca 0.08 -0.18 -0.06 0.00 -0.60 0.00 0.00 56.93 56.16 2k5q s PHE 64 Cb -0.02 -1.73 0.06 0.00 0.51 0.00 0.00 43.02 41.84 2k5q s PHE 64 CO -0.03 0.25 0.30 -1.17 0.70 0.00 0.00 175.22 175.27 2k5q s LEU 65 N -4.01 0.02 -0.22 -0.37 0.20 0.11 -1.48 118.68 112.94 2k5q s LEU 65 Ca 0.39 0.66 -0.21 0.00 0.69 0.00 0.00 54.13 55.66 2k5q s LEU 65 Cb -0.08 0.90 -0.02 0.00 -0.43 0.00 0.00 46.19 46.56 2k5q s LEU 65 CO 0.28 -0.20 0.65 -0.13 -0.29 0.00 0.00 176.35 176.66 2k5q s ARG 66 N 1.72 4.17 -0.22 1.98 0.52 0.51 -2.14 118.95 125.49 2k5q s ARG 66 Ca -0.06 0.62 -0.03 0.00 -0.52 0.00 0.00 55.73 55.74 2k5q s ARG 66 Cb -0.11 -3.61 -0.01 0.00 0.52 0.00 0.00 34.95 31.75 2k5q s ARG 66 CO -0.10 -0.32 -0.06 0.14 0.02 0.00 0.00 175.30 174.98 2k5q s VAL 67 N 2.20 3.26 -0.64 3.52 -7.23 -0.33 -0.75 120.40 120.43 2k5q s VAL 67 Ca 0.28 -0.53 -0.26 0.00 -1.81 0.00 0.00 61.98 59.66 2k5q s VAL 67 Cb -0.16 -2.48 -0.02 0.00 0.56 0.00 0.00 36.38 34.29 2k5q s VAL 67 CO 0.09 0.43 1.86 -0.47 -0.31 0.00 0.00 175.10 176.71 2k5q s TYR 68 N 1.46 1.68 -0.79 2.82 6.14 0.31 -2.21 117.35 126.76 2k5q s TYR 68 Ca 0.06 0.76 -0.26 0.00 0.64 0.00 0.00 57.07 58.27 2k5q s TYR 68 Cb -0.14 -4.09 0.03 0.00 0.42 0.00 0.00 41.96 38.18 2k5q s TYR 68 CO -0.04 -2.26 1.31 -1.58 0.64 0.00 0.00 175.55 173.61 2k5q s HIS 69 N 9.12 2.33 0.15 4.97 5.65 0.10 -1.83 115.29 135.78 2k5q s HIS 69 Ca 0.67 -0.19 0.01 0.00 0.25 0.00 0.00 55.06 55.80 2k5q s HIS 69 Cb -0.12 -4.64 -0.04 0.00 -1.18 0.00 0.00 32.58 26.60 2k5q s HIS 69 CO 0.19 -2.05 0.30 0.45 -0.65 0.00 0.00 174.74 172.98 2k5q s SER 70 N 3.95 6.36 0.41 9.88 0.15 -1.26 -2.91 113.70 130.28 2k5q s SER 70 Ca 0.37 0.26 0.28 0.00 0.70 0.00 0.00 55.95 57.56 2k5q s SER 70 Cb -0.07 -1.95 1.48 0.00 -1.71 0.00 0.00 66.02 63.77 2k5q s SER 70 CO 0.11 0.04 1.87 0.44 1.20 0.00 0.00 173.24 176.90 2k5q h ASP 71 N 2.26 0.00 0.70 5.45 5.19 -2.00 -0.48 116.42 127.54 2k5q h ASP 71 Ca -0.48 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.93 2k5q h ASP 71 Cb 1.19 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.70 2k5q h ASP 71 CO 0.70 0.00 0.00 2.29 -3.12 0.00 0.00 179.24 179.11 2k5q n LYS 72 N -2.51 0.04 -0.93 3.56 2.85 -1.26 -5.03 118.16 114.88 2k5q n LYS 72 Ca -0.01 0.21 0.13 0.00 -1.05 0.00 0.00 58.31 57.59 2k5q n LYS 72 Cb 0.09 -1.57 -0.03 0.00 -0.65 0.00 0.00 35.03 32.86 2k5q n LYS 72 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2k5q n LYS 73 N -1.64 -1.89 -0.84 -1.58 5.02 -0.19 -4.90 118.16 112.13 2k5q n LYS 73 Ca 0.04 1.27 0.00 0.00 -2.02 0.00 0.00 58.31 57.61 2k5q n LYS 73 Cb 0.23 -2.30 0.00 0.00 -0.02 0.00 0.00 35.03 32.94 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 -3.17 0.58 1.45 0.72 0.00 -1.26 -4.60 105.19 98.92 2k5q n GLY 74 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.10 -7.02 0.11 1.61 0.31 -1.26 -4.84 118.33 105.14 2k5q n VAL 75 Ca 0.00 2.14 -0.20 0.00 -0.01 0.00 0.00 64.34 66.27 2k5q n VAL 75 Cb 0.03 -3.55 -0.15 0.00 -0.91 0.00 0.00 33.84 29.26 2k5q n VAL 75 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 2k5q h SER 76 N 2.57 0.60 -5.05 4.52 0.87 -1.61 -3.48 113.55 111.96 2k5q h SER 76 Ca 0.00 -0.70 -0.06 0.00 -1.23 0.00 0.00 61.79 59.80 2k5q h SER 76 Cb 0.00 -0.19 -0.14 0.00 -0.44 0.00 0.00 62.40 61.62 2k5q h SER 76 CO 0.00 1.56 -0.04 0.00 -0.53 0.00 0.00 176.83 177.82 2k5q s ALA 77 N -2.62 -1.08 -0.07 6.23 0.00 -1.26 -5.02 121.76 117.93 2k5q s ALA 77 Ca -0.08 0.22 -0.02 0.00 0.00 0.00 0.00 51.96 52.08 2k5q s ALA 77 Cb 0.06 0.55 0.03 0.00 0.00 0.00 0.00 23.12 23.76 2k5q s ALA 77 CO 0.90 -0.57 0.01 1.67 0.00 0.00 0.00 175.76 177.77 2k5q s TRP 78 N -3.16 0.58 -0.19 0.00 1.48 -1.26 -0.53 118.94 115.86 2k5q s TRP 78 Ca -0.01 -0.13 -0.05 0.00 -1.06 0.00 0.00 56.10 54.85 2k5q s TRP 78 Cb 0.00 -0.76 -0.02 0.00 -1.16 0.00 0.00 33.47 31.53 2k5q s TRP 78 CO -0.07 -0.32 -0.01 -1.21 -4.06 0.00 0.00 176.95 171.27 2k5q s GLU 79 N 2.00 3.62 -0.23 3.25 0.41 0.07 -4.97 118.70 122.85 2k5q s GLU 79 Ca 0.05 -0.53 -0.22 0.00 -0.41 0.00 0.00 54.97 53.86 2k5q s GLU 79 Cb -0.12 -3.03 -0.02 0.00 -1.78 0.00 0.00 34.13 29.18 2k5q s GLU 79 CO -0.05 0.06 0.69 -2.00 -0.49 0.00 0.00 175.26 173.47 2k5q s GLU 80 N 0.86 4.17 0.36 1.61 2.12 -1.26 -0.37 118.70 126.19 2k5q s GLU 80 Ca 0.00 0.69 0.04 0.00 0.36 0.00 0.00 54.97 56.06 2k5q s GLU 80 Cb -0.14 -3.62 -0.01 0.00 0.26 0.00 0.00 34.13 30.61 2k5q s GLU 80 CO 0.02 -0.37 0.14 1.33 -0.54 0.00 0.00 175.26 175.83 2k5q n VAL 81 N 5.01 0.00 -4.27 3.70 0.24 -0.55 -4.97 118.33 117.49 2k5q n VAL 81 Ca 0.01 -2.12 -0.25 0.00 -2.04 0.00 0.00 64.34 59.94 2k5q n VAL 81 Cb 0.49 0.78 -0.08 0.00 -1.47 0.00 0.00 33.84 33.55 2k5q n VAL 81 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2k5q s LYS 82 N -3.38 2.14 0.53 7.34 1.02 -1.26 -2.99 119.74 123.14 2k5q s LYS 82 Ca 0.19 -1.81 0.32 0.00 0.02 0.00 0.00 55.97 54.70 2k5q s LYS 82 Cb 0.01 -1.94 1.32 0.00 -0.52 0.00 0.00 37.83 36.70 2k5q s LYS 82 CO 0.14 0.02 1.97 1.57 -0.92 0.00 0.00 175.35 178.13 2k5q h LYS 83 N 1.64 0.00 0.00 1.68 5.09 -1.96 -2.23 116.57 120.80 2k5q h LYS 83 Ca -0.43 0.00 -0.01 0.00 0.09 0.00 0.00 60.65 60.30 2k5q h LYS 83 Cb 1.25 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 33.58 2k5q h LYS 83 CO 0.69 0.04 -0.06 -0.44 -2.09 0.00 0.00 179.45 177.60 2k5q h ASP 84 N 0.00 0.00 -0.30 7.07 5.19 -2.01 -2.92 116.42 123.45 2k5q h ASP 84 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2k5q h ASP 84 Cb 0.53 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.04 2k5q h ASP 84 CO 0.01 0.06 0.00 -0.62 -3.12 0.00 0.00 179.24 175.56 2k5q n GLU 85 N -3.22 2.22 -3.95 3.56 1.02 -0.84 -4.91 120.64 114.52 2k5q n GLU 85 Ca -0.00 -1.85 -0.31 0.00 -0.02 0.00 0.00 57.16 54.98 2k5q n GLU 85 Cb 0.28 -1.47 -0.05 0.00 -0.02 0.00 0.00 31.44 30.19 2k5q n GLU 85 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2k5q s LEU 86 N -1.51 4.22 0.44 -4.62 1.43 -1.11 -5.01 118.68 112.52 2k5q s LEU 86 Ca 0.36 0.19 -0.25 0.00 -1.03 0.00 0.00 54.13 53.40 2k5q s LEU 86 Cb 0.21 -2.84 -0.09 0.00 0.03 0.00 0.00 46.19 43.50 2k5q s LEU 86 CO 0.29 0.17 1.30 -0.81 0.23 0.00 0.00 176.35 177.53 2k5q n PRO 87 N 0.30 1.95 -0.07 1.29 -0.04 -1.26 -4.89 135.00 132.28 2k5q n PRO 87 Ca -0.06 0.70 0.16 0.00 -0.04 0.00 0.00 63.50 64.26 2k5q n PRO 87 Cb 0.51 -2.44 0.58 0.00 -0.04 0.00 0.00 33.50 32.11 2k5q n PRO 87 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k5q h ALA 88 N 2.04 2.25 -0.72 0.55 0.00 -1.96 -1.30 119.26 120.12 2k5q h ALA 88 Ca -0.49 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 54.51 2k5q h ALA 88 Cb 1.29 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 19.01 2k5q h ALA 88 CO 0.60 -0.41 0.47 0.87 0.00 0.00 0.00 179.25 180.78 2k5q h LYS 89 N 0.24 0.59 -0.46 0.00 1.79 -1.89 0.24 116.57 117.08 2k5q h LYS 89 Ca 0.30 -0.04 -0.13 0.00 -2.18 0.00 0.00 60.65 58.60 2k5q h LYS 89 Cb 0.84 -0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 31.34 2k5q h LYS 89 CO -0.06 0.39 -0.22 0.28 -1.08 0.00 0.00 179.45 178.76 2k5q h VAL 90 N 0.61 1.27 0.00 0.50 2.07 -1.41 0.23 116.25 119.51 2k5q h VAL 90 Ca 0.33 -1.38 -0.13 0.00 0.82 0.00 0.00 66.70 66.35 2k5q h VAL 90 Cb 0.48 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 2k5q h VAL 90 CO -0.11 0.47 -0.64 0.50 0.02 0.00 0.00 177.57 177.80 2k5q h LYS 91 N 0.81 0.00 0.00 1.57 3.64 -1.41 -3.32 116.57 117.86 2k5q h LYS 91 Ca 0.10 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.27 2k5q h LYS 91 Cb 0.79 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.58 2k5q h LYS 91 CO 0.07 0.57 -1.49 -1.91 -2.27 0.00 0.00 179.45 174.42 2k5q n GLU 92 N -3.23 0.54 -0.07 1.90 2.13 0.78 -4.88 120.64 117.82 2k5q n GLU 92 Ca 0.01 0.38 -0.11 0.00 0.66 0.00 0.00 57.16 58.09 2k5q n GLU 92 Cb 0.78 -1.58 -0.06 0.00 0.27 0.00 0.00 31.44 30.85 2k5q n GLU 92 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2k5q n LYS 93 N -4.41 0.32 -1.04 5.31 3.00 0.29 -5.07 118.16 116.56 2k5q n LYS 93 Ca -0.31 0.10 0.00 0.00 -0.00 0.00 0.00 58.31 58.10 2k5q n LYS 93 Cb 0.63 -1.18 0.00 0.00 0.00 0.00 0.00 35.03 34.49 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 -3.14 -3.77 0.00 3.14 0.00 0.53 -4.87 117.00 108.90 2k5q n LEU 94 Ca -0.25 1.38 0.00 0.00 0.00 0.00 0.00 56.01 57.14 2k5q n LEU 94 Cb 0.73 -1.54 0.00 0.00 0.00 0.00 0.00 43.42 42.61 2k5q n LEU 94 CO 0.09 -0.59 0.00 0.61 0.00 0.00 0.00 177.39 177.50 2k5q n GLY 95 N 0.53 3.13 3.90 -3.96 0.00 -1.26 -5.03 105.19 102.49 2k5q n GLY 95 Ca 0.00 -0.90 -0.28 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.21 4.51 0.00 1.61 -7.23 -1.26 -3.91 120.40 113.92 2k5q s VAL 96 Ca 0.00 0.38 0.00 0.00 -1.81 0.00 0.00 61.98 60.55 2k5q s VAL 96 Cb 0.00 -3.76 0.00 0.00 0.56 0.00 0.00 36.38 33.18 2k5q s VAL 96 CO 0.00 -0.85 0.00 2.29 -0.31 0.00 0.00 175.10 176.23 2k5q n LYS 97 N -2.52 0.00 -4.03 4.82 2.85 -1.26 -4.27 118.16 113.75 2k5q n LYS 97 Ca 0.03 -0.00 -0.35 0.00 -1.05 0.00 0.00 58.31 56.94 2k5q n LYS 97 Cb 0.55 -0.40 -0.09 0.00 -0.65 0.00 0.00 35.03 34.45 2k5q n LYS 97 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 2k5q s LEU 98 N 0.00 3.85 0.00 -5.58 2.96 -1.26 -4.97 118.68 113.69 2k5q s LEU 98 Ca 0.00 0.13 0.00 0.00 -0.22 0.00 0.00 54.13 54.04 2k5q s LEU 98 Cb 0.00 -1.96 0.00 0.00 0.50 0.00 0.00 46.19 44.73 2k5q s LEU 98 CO 0.00 0.23 0.00 -0.62 -1.32 0.00 0.00 176.35 174.64 2k5q n GLU 99 N 3.19 0.00 -2.99 1.98 -0.58 -1.26 -4.87 120.64 116.11 2k5q n GLU 99 Ca -0.17 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.52 2k5q n GLU 99 Cb 0.53 0.00 0.01 0.00 -0.57 0.00 0.00 31.44 31.40 2k5q n GLU 99 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2k5q n HIS 100 N -0.53 -2.37 -3.96 -0.32 8.25 -1.26 -5.01 115.22 110.02 2k5q n HIS 100 Ca 0.00 1.02 -0.34 0.00 -0.26 0.00 0.00 57.72 58.15 2k5q n HIS 100 Cb 0.00 -2.70 -0.14 0.00 1.12 0.00 0.00 29.99 28.27 2k5q n HIS 100 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2k5q s HIS 101 N -1.51 3.32 -0.32 4.41 3.76 -1.26 -4.85 115.29 118.85 2k5q s HIS 101 Ca 0.07 -2.13 -0.06 0.00 -0.15 0.00 0.00 55.06 52.79 2k5q s HIS 101 Cb -0.01 -2.18 0.01 0.00 1.11 0.00 0.00 32.58 31.51 2k5q s HIS 101 CO 0.51 -0.85 0.23 0.72 -0.85 0.00 0.00 174.74 174.50 2k5q n HIS 102 N 4.53 -3.30 -2.19 1.40 8.25 -1.26 -4.91 115.22 117.75 2k5q n HIS 102 Ca -0.12 1.41 -0.42 0.00 -0.26 0.00 0.00 57.72 58.33 2k5q n HIS 102 Cb 0.43 -3.73 -0.03 0.00 1.12 0.00 0.00 29.99 27.78 2k5q n HIS 102 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2k5q s HIS 103 N -1.86 2.05 -0.72 4.41 2.46 -1.26 -4.91 115.29 115.46 2k5q s HIS 103 Ca 0.10 0.63 -0.26 0.00 0.47 0.00 0.00 55.06 56.00 2k5q s HIS 103 Cb -0.03 -4.23 -0.06 0.00 -0.13 0.00 0.00 32.58 28.13 2k5q s HIS 103 CO 0.68 -2.36 2.10 -1.01 -2.47 0.00 0.00 174.74 171.68 2k5q s HIS 104 N 6.70 1.49 0.00 3.88 3.76 -1.26 -5.28 115.29 124.58 2k5q s HIS 104 Ca 0.67 1.13 0.00 0.00 -0.15 0.00 0.00 55.06 56.71 2k5q s HIS 104 Cb -0.16 -3.85 0.00 0.00 1.11 0.00 0.00 32.58 29.69 2k5q s HIS 104 CO 0.29 -2.03 0.00 1.58 -0.85 0.00 0.00 174.74 173.74