#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5q n ASP 2 N 0.00 1.93 -0.03 7.83 8.00 -1.26 -4.84 116.55 128.19 2k5q n ASP 2 Ca 0.00 -2.97 -0.04 0.00 0.71 0.00 0.00 54.79 52.49 2k5q n ASP 2 Cb 0.00 -0.68 -0.04 0.00 -0.02 0.00 0.00 41.12 40.38 2k5q n ASP 2 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2k5q n LEU 3 N 2.00 1.47 -0.08 0.64 4.77 -1.26 -4.72 117.00 119.82 2k5q n LEU 3 Ca 0.24 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 2k5q n LEU 3 Cb 0.41 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 2k5q n LEU 3 CO 0.23 0.37 0.42 0.59 -1.33 0.00 0.00 177.39 177.67 2k5q n ASN 4 N -2.45 0.14 -0.02 -1.43 5.03 -1.26 -2.33 115.26 112.94 2k5q n ASN 4 Ca -0.11 -1.81 0.02 0.00 0.87 0.00 0.00 54.58 53.55 2k5q n ASN 4 Cb 0.66 -0.07 0.02 0.00 -1.02 0.00 0.00 39.78 39.37 2k5q n ASN 4 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2k5q n ARG 5 N -0.41 2.27 -1.55 3.52 1.74 -1.26 -5.07 116.66 115.90 2k5q n ARG 5 Ca 0.00 -1.52 -0.30 0.00 -0.77 0.00 0.00 57.85 55.25 2k5q n ARG 5 Cb 0.04 -1.00 0.07 0.00 -1.02 0.00 0.00 32.46 30.55 2k5q n ARG 5 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2k5q s MET 6 N -1.13 2.44 0.00 5.56 -1.94 -0.98 -4.76 119.30 118.48 2k5q s MET 6 Ca 0.05 0.79 0.00 0.00 -1.71 0.00 0.00 55.69 54.82 2k5q s MET 6 Cb 0.04 -1.95 0.00 0.00 2.01 0.00 0.00 34.83 34.94 2k5q s MET 6 CO 0.00 -1.41 0.00 0.41 -0.01 0.00 0.00 175.02 174.01 2k5q n GLY 7 N -2.02 -0.52 3.55 -0.03 0.00 -1.26 -5.12 105.19 99.80 2k5q n GLY 7 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 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 0.00 3.49 0.91 1.61 3.01 -1.26 -5.02 119.74 122.47 2k5q s LYS 8 Ca 0.00 0.02 -0.14 0.00 -1.01 0.00 0.00 55.97 54.84 2k5q s LYS 8 Cb 0.00 -3.92 0.15 0.00 -1.01 0.00 0.00 37.83 33.06 2k5q s LYS 8 CO 0.00 -1.11 1.26 -0.51 0.51 0.00 0.00 175.35 175.50 2k5q s ASP 9 N 2.12 3.63 0.28 2.83 1.01 -1.09 -4.74 116.67 120.71 2k5q s ASP 9 Ca 0.32 0.50 0.10 0.00 0.71 0.00 0.00 52.55 54.18 2k5q s ASP 9 Cb -0.12 -0.74 -0.05 0.00 1.01 0.00 0.00 42.92 43.02 2k5q s ASP 9 CO 0.23 -2.43 -0.16 -1.83 0.21 0.00 0.00 175.17 171.18 2k5q s GLU 10 N -5.74 1.65 -0.05 8.23 -1.05 -1.26 -0.34 118.70 120.13 2k5q s GLU 10 Ca 0.69 -1.78 -0.02 0.00 -0.15 0.00 0.00 54.97 53.71 2k5q s GLU 10 Cb -0.07 -1.61 0.03 0.00 -0.44 0.00 0.00 34.13 32.04 2k5q s GLU 10 CO 0.51 0.25 0.08 0.71 0.95 0.00 0.00 175.26 177.77 2k5q s TYR 11 N -2.64 -0.00 -0.68 4.83 2.02 -0.25 -4.78 117.35 115.85 2k5q s TYR 11 Ca 0.29 0.34 -0.27 0.00 -0.37 0.00 0.00 57.07 57.06 2k5q s TYR 11 Cb -0.02 -0.40 0.01 0.00 -0.40 0.00 0.00 41.96 41.15 2k5q s TYR 11 CO 0.14 -0.20 1.49 0.71 -1.57 0.00 0.00 175.55 176.11 2k5q s TYR 12 N 2.10 2.07 0.64 2.71 2.02 -1.24 -0.99 117.35 124.65 2k5q s TYR 12 Ca 0.03 0.27 -0.01 0.00 -0.37 0.00 0.00 57.07 56.99 2k5q s TYR 12 Cb -0.12 -4.43 0.07 0.00 -0.40 0.00 0.00 41.96 37.08 2k5q s TYR 12 CO -0.04 -2.15 0.90 0.14 -1.57 0.00 0.00 175.55 172.83 2k5q s VAL 13 N 6.90 2.42 -0.08 0.71 -7.23 0.11 -1.95 120.40 121.28 2k5q s VAL 13 Ca 0.47 -0.55 0.01 0.00 -1.81 0.00 0.00 61.98 60.11 2k5q s VAL 13 Cb -0.10 -2.87 0.02 0.00 0.56 0.00 0.00 36.38 33.99 2k5q s VAL 13 CO 0.18 0.00 -0.10 -1.58 -0.31 0.00 0.00 175.10 173.28 2k5q s GLN 14 N -5.00 1.59 -0.84 4.82 0.74 -1.24 -0.18 119.66 119.56 2k5q s GLN 14 Ca 0.61 -0.34 -0.25 0.00 0.05 0.00 0.00 55.36 55.42 2k5q s GLN 14 Cb -0.09 -1.42 -0.10 0.00 1.10 0.00 0.00 33.01 32.50 2k5q s GLN 14 CO 0.42 -0.07 2.23 0.42 -0.55 0.00 0.00 175.29 177.74 2k5q s ILE 15 N 0.99 3.18 -0.06 -2.34 -1.09 0.01 -4.71 121.20 117.17 2k5q s ILE 15 Ca -0.09 -0.15 -0.00 0.00 -2.23 0.00 0.00 60.65 58.18 2k5q s ILE 15 Cb -0.15 -3.41 -0.00 0.00 -1.58 0.00 0.00 42.46 37.32 2k5q s ILE 15 CO -0.00 -0.38 -0.00 0.71 -1.23 0.00 0.00 174.94 174.03 2k5q h THR 16 N 7.51 0.00 -3.47 2.92 1.35 -1.89 -1.22 112.91 118.12 2k5q h THR 16 Ca 0.04 -0.60 -0.60 0.00 -0.55 0.00 0.00 66.41 64.70 2k5q h THR 16 Cb 1.00 0.00 -0.11 0.00 -1.73 0.00 0.00 68.15 67.32 2k5q h THR 16 CO 1.09 0.00 0.05 0.68 -0.25 0.00 0.00 175.52 177.08 2k5q s VAL 17 N -1.34 5.05 0.20 6.82 -7.23 -1.26 -4.84 120.40 117.80 2k5q s VAL 17 Ca -0.00 1.05 0.05 0.00 -1.81 0.00 0.00 61.98 61.26 2k5q s VAL 17 Cb 0.00 -3.89 -0.05 0.00 0.56 0.00 0.00 36.38 33.00 2k5q s VAL 17 CO 0.00 0.12 -0.06 1.51 -0.31 0.00 0.00 175.10 176.37 2k5q s ASP 18 N 1.27 1.99 0.00 4.85 -4.77 -1.26 -4.71 116.67 114.04 2k5q s ASP 18 Ca 0.26 -1.12 0.00 0.00 -3.30 0.00 0.00 52.55 48.38 2k5q s ASP 18 Cb -0.16 -0.03 0.00 0.00 -1.09 0.00 0.00 42.92 41.64 2k5q s ASP 18 CO 0.10 -0.40 0.00 0.61 0.70 0.00 0.00 175.17 176.18 2k5q n GLY 19 N -0.35 0.20 3.61 2.12 0.00 -1.26 -4.94 105.19 104.56 2k5q n GLY 19 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.21 3.73 0.18 1.61 2.36 -1.26 -4.99 119.74 120.17 2k5q s LYS 20 Ca 0.00 0.87 -0.12 0.00 -2.55 0.00 0.00 55.97 54.17 2k5q s LYS 20 Cb 0.00 -3.93 -0.07 0.00 -1.05 0.00 0.00 37.83 32.78 2k5q s LYS 20 CO 0.00 -1.37 0.54 -1.21 1.55 0.00 0.00 175.35 174.87 2k5q s GLU 21 N 4.53 3.90 -0.26 4.03 2.02 -1.26 -0.29 118.70 131.36 2k5q s GLU 21 Ca 0.54 0.39 0.01 0.00 0.02 0.00 0.00 54.97 55.93 2k5q s GLU 21 Cb -0.12 -2.81 0.07 0.00 0.10 0.00 0.00 34.13 31.38 2k5q s GLU 21 CO 0.29 0.41 -0.01 0.14 0.02 0.00 0.00 175.26 176.11 2k5q s VAL 22 N -1.62 1.48 0.00 2.63 -7.23 0.05 -4.89 120.40 110.81 2k5q s VAL 22 Ca 0.42 -1.37 -0.01 0.00 -1.81 0.00 0.00 61.98 59.20 2k5q s VAL 22 Cb -0.13 -1.86 -0.05 0.00 0.56 0.00 0.00 36.38 34.90 2k5q s VAL 22 CO 0.20 -0.27 1.40 1.57 -0.31 0.00 0.00 175.10 177.69 2k5q n HIS 23 N 4.66 0.00 1.44 2.82 -0.00 -1.26 -3.07 115.22 119.81 2k5q n HIS 23 Ca -0.08 -0.61 0.14 0.00 0.46 0.00 0.00 57.72 57.63 2k5q n HIS 23 Cb 0.44 -0.59 0.58 0.00 -0.12 0.00 0.00 29.99 30.30 2k5q n HIS 23 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2k5q n SER 24 N 2.07 0.68 -3.53 0.26 2.88 -1.26 -4.36 113.62 110.36 2k5q n SER 24 Ca 0.07 -0.80 -0.27 0.00 -1.33 0.00 0.00 58.87 56.54 2k5q n SER 24 Cb 0.33 -0.02 -0.11 0.00 -0.75 0.00 0.00 64.21 63.67 2k5q n SER 24 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2k5q s LYS 25 N -2.37 1.31 -0.54 -1.46 1.02 -1.26 -4.97 119.74 111.47 2k5q s LYS 25 Ca 0.31 -2.42 0.05 0.00 0.02 0.00 0.00 55.97 53.94 2k5q s LYS 25 Cb 0.20 -1.95 0.20 0.00 -0.52 0.00 0.00 37.83 35.76 2k5q s LYS 25 CO 0.45 -1.36 0.50 0.00 -0.92 0.00 0.00 175.35 174.03 2k5q n ALA 26 N 2.65 3.18 0.38 5.17 0.00 -1.26 -4.65 120.51 125.98 2k5q n ALA 26 Ca 0.27 -3.92 -0.15 0.00 0.00 0.00 0.00 53.44 49.63 2k5q n ALA 26 Cb 0.44 -0.88 -0.07 0.00 0.00 0.00 0.00 19.45 18.94 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 4.94 -0.83 -1.36 0.00 3.32 -1.98 -3.42 116.42 117.09 2k5q h ASP 27 Ca 0.18 0.03 -0.29 0.00 0.02 0.00 0.00 57.03 56.97 2k5q h ASP 27 Cb 0.81 0.21 -0.23 0.00 0.22 0.00 0.00 39.33 40.34 2k5q h ASP 27 CO 0.59 -0.55 -0.65 -3.20 -1.72 0.00 0.00 179.24 173.71 2k5q n ASN 28 N -4.89 -2.50 0.00 6.45 5.15 -1.26 -4.98 115.26 113.22 2k5q n ASN 28 Ca -0.12 -2.78 0.00 0.00 -0.60 0.00 0.00 54.58 51.08 2k5q n ASN 28 Cb 0.39 1.05 0.00 0.00 -0.53 0.00 0.00 39.78 40.68 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 2.80 -0.10 3.50 8.20 0.00 -1.26 -5.06 105.19 113.27 2k5q n GLY 29 Ca 0.21 -0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 2k5q n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k5q n GLN 30 N 0.00 0.12 0.00 1.61 0.00 -1.26 -4.63 117.38 113.21 2k5q n GLN 30 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.00 57.00 2k5q n GLN 30 Cb 0.00 -1.72 0.00 0.00 0.00 0.00 0.00 30.24 28.52 2k5q n GLN 30 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.06 178.23 2k5q n LYS 31 N 8.54 0.00 -3.72 2.61 4.81 -1.26 -5.11 118.16 124.03 2k5q n LYS 31 Ca 0.63 -0.13 -0.13 0.00 -0.87 0.00 0.00 58.31 57.80 2k5q n LYS 31 Cb 0.09 -0.45 -0.09 0.00 0.02 0.00 0.00 35.03 34.59 2k5q n LYS 31 CO 0.00 0.00 0.00 1.52 1.17 0.00 0.00 177.40 180.09 2k5q s TYR 32 N 0.00 -0.43 0.02 5.64 1.13 -1.26 -5.17 117.35 117.27 2k5q s TYR 32 Ca 0.00 1.01 0.01 0.00 -1.41 0.00 0.00 57.07 56.68 2k5q s TYR 32 Cb 0.00 0.16 -0.02 0.00 -1.10 0.00 0.00 41.96 41.01 2k5q s TYR 32 CO 0.00 -0.27 -0.04 0.15 -2.51 0.00 0.00 175.55 172.88 2k5q s LYS 33 N -0.08 0.32 0.45 -3.49 1.02 -1.26 -4.73 119.74 111.96 2k5q s LYS 33 Ca -0.03 -0.49 0.08 0.00 0.02 0.00 0.00 55.97 55.55 2k5q s LYS 33 Cb -0.03 -0.05 0.01 0.00 -0.52 0.00 0.00 37.83 37.24 2k5q s LYS 33 CO 0.02 -0.00 0.52 -0.51 -0.92 0.00 0.00 175.35 174.46 2k5q s ASP 34 N -1.10 5.30 0.07 2.83 1.11 -1.18 -4.93 116.67 118.78 2k5q s ASP 34 Ca -0.10 -0.65 0.05 0.00 0.18 0.00 0.00 52.55 52.03 2k5q s ASP 34 Cb -0.07 -0.43 -0.04 0.00 1.07 0.00 0.00 42.92 43.45 2k5q s ASP 34 CO -0.00 -0.82 -0.05 -0.31 1.18 0.00 0.00 175.17 175.17 2k5q s TYR 35 N -2.46 2.89 0.05 4.23 2.02 -0.81 -0.77 117.35 122.49 2k5q s TYR 35 Ca 0.52 -0.07 0.05 0.00 -0.37 0.00 0.00 57.07 57.21 2k5q s TYR 35 Cb -0.06 -1.52 -0.02 0.00 -0.40 0.00 0.00 41.96 39.95 2k5q s TYR 35 CO 0.31 0.44 -0.15 -2.00 -1.57 0.00 0.00 175.55 172.59 2k5q s GLU 36 N -2.07 0.95 -0.22 -0.62 2.12 0.60 -0.22 118.70 119.24 2k5q s GLU 36 Ca 0.22 -0.82 -0.01 0.00 0.36 0.00 0.00 54.97 54.73 2k5q s GLU 36 Cb -0.11 -0.97 0.06 0.00 0.26 0.00 0.00 34.13 33.37 2k5q s GLU 36 CO 0.14 0.24 -0.01 0.71 -0.54 0.00 0.00 175.26 175.80 2k5q s TYR 37 N -0.93 1.80 -0.42 5.30 2.02 0.15 -4.43 117.35 120.84 2k5q s TYR 37 Ca 0.01 -1.38 -0.12 0.00 -0.37 0.00 0.00 57.07 55.21 2k5q s TYR 37 Cb -0.08 -1.35 0.05 0.00 -0.40 0.00 0.00 41.96 40.18 2k5q s TYR 37 CO 0.02 -0.71 0.29 0.21 -1.57 0.00 0.00 175.55 173.78 2k5q s LYS 38 N 1.60 2.83 0.02 -0.62 2.20 -1.26 -2.57 119.74 121.93 2k5q s LYS 38 Ca -0.03 -1.24 -0.06 0.00 -0.36 0.00 0.00 55.97 54.28 2k5q s LYS 38 Cb -0.18 -3.89 -0.01 0.00 -1.51 0.00 0.00 37.83 32.24 2k5q s LYS 38 CO -0.07 -0.86 0.10 -0.48 -0.36 0.00 0.00 175.35 173.67 2k5q s LEU 39 N 1.56 1.75 -0.17 5.43 0.05 -0.95 -4.55 118.68 121.81 2k5q s LEU 39 Ca 0.03 -0.39 -0.08 0.00 0.05 0.00 0.00 54.13 53.74 2k5q s LEU 39 Cb -0.21 0.57 -0.05 0.00 -2.05 0.00 0.00 46.19 44.45 2k5q s LEU 39 CO 0.06 -0.42 0.12 -0.89 -0.55 0.00 0.00 176.35 174.67 2k5q s THR 40 N -1.91 5.30 0.03 5.48 2.01 -1.26 -0.59 115.64 124.70 2k5q s THR 40 Ca -0.11 0.14 0.06 0.00 0.31 0.00 0.00 61.69 62.09 2k5q s THR 40 Cb -0.05 -3.38 -0.03 0.00 0.01 0.00 0.00 72.50 69.05 2k5q s THR 40 CO -0.01 0.50 -0.12 -0.83 -0.69 0.00 0.00 174.62 173.46 2k5q s GLY 41 N -0.05 1.67 -0.15 4.40 0.00 0.22 -3.70 107.32 109.71 2k5q s GLY 41 Ca 0.09 -1.13 0.02 0.00 0.00 0.00 0.00 44.72 43.70 2k5q s GLY 41 CO 0.00 -1.02 -0.20 -1.36 0.00 0.00 0.00 173.10 170.52 2k5q s PHE 42 N -0.99 2.71 0.32 1.90 0.40 -0.82 -1.34 117.98 120.16 2k5q s PHE 42 Ca 0.16 -1.29 -0.08 0.00 -0.60 0.00 0.00 56.93 55.12 2k5q s PHE 42 Cb -0.11 -1.85 0.03 0.00 0.51 0.00 0.00 43.02 41.61 2k5q s PHE 42 CO 0.07 -0.60 0.57 -3.47 0.70 0.00 0.00 175.22 172.49 2k5q n ASP 43 N 4.13 -1.64 0.00 1.36 2.03 -0.73 -3.64 116.55 118.06 2k5q n ASP 43 Ca -0.20 -2.47 0.00 0.00 0.52 0.00 0.00 54.79 52.65 2k5q n ASP 43 Cb 0.51 2.82 0.00 0.00 -0.72 0.00 0.00 41.12 43.73 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 -0.47 0.00 -2.77 -0.67 0.00 -1.26 -2.45 118.16 110.54 2k5q n LYS 44 Ca -0.04 0.00 -0.09 0.00 0.00 0.00 0.00 58.31 58.18 2k5q n LYS 44 Cb 0.50 0.00 0.05 0.00 0.00 0.00 0.00 35.03 35.58 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 3.04 -2.77 -2.87 3.14 2.03 -1.26 -4.95 116.55 112.91 2k5q n ASP 45 Ca 0.00 -3.31 -0.19 0.00 0.52 0.00 0.00 54.79 51.82 2k5q n ASP 45 Cb 0.00 1.75 0.06 0.00 -0.72 0.00 0.00 41.12 42.21 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 1.58 -0.24 3.43 0.27 0.00 -1.23 -5.01 105.19 103.98 2k5q n GLY 46 Ca 0.09 0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 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 -5.95 3.51 0.20 1.61 -0.14 -1.03 -4.96 119.74 112.99 2k5q s LYS 47 Ca 0.43 -0.61 0.05 0.00 -1.36 0.00 0.00 55.97 54.48 2k5q s LYS 47 Cb -0.19 -2.77 -0.04 0.00 -1.68 0.00 0.00 37.83 33.16 2k5q s LYS 47 CO 0.53 0.22 0.21 -1.83 -0.76 0.00 0.00 175.35 173.73 2k5q s GLU 48 N 0.37 3.09 -0.24 1.68 1.03 -1.26 -1.78 118.70 121.59 2k5q s GLU 48 Ca -0.08 -0.86 -0.15 0.00 0.03 0.00 0.00 54.97 53.92 2k5q s GLU 48 Cb -0.15 -2.72 0.07 0.00 -0.80 0.00 0.00 34.13 30.53 2k5q s GLU 48 CO 0.04 0.46 0.60 0.21 -1.33 0.00 0.00 175.26 175.25 2k5q s LYS 49 N -3.47 0.62 -0.36 -4.83 2.20 -0.45 -4.95 119.74 108.50 2k5q s LYS 49 Ca 0.33 1.06 -0.21 0.00 -0.36 0.00 0.00 55.97 56.79 2k5q s LYS 49 Cb -0.09 0.12 0.00 0.00 -1.51 0.00 0.00 37.83 36.36 2k5q s LYS 49 CO 0.26 -0.14 0.65 -1.21 -0.36 0.00 0.00 175.35 174.54 2k5q s GLU 50 N 1.39 3.66 0.12 4.03 2.02 -1.26 -0.61 118.70 128.05 2k5q s GLU 50 Ca -0.08 0.05 0.03 0.00 0.02 0.00 0.00 54.97 54.98 2k5q s GLU 50 Cb -0.06 -3.82 -0.04 0.00 0.10 0.00 0.00 34.13 30.32 2k5q s GLU 50 CO -0.15 -0.77 0.19 -0.51 0.02 0.00 0.00 175.26 174.04 2k5q s LEU 51 N 2.76 4.09 -0.10 1.80 2.01 0.24 -4.94 118.68 124.54 2k5q s LEU 51 Ca 0.25 0.07 0.01 0.00 0.01 0.00 0.00 54.13 54.47 2k5q s LEU 51 Cb -0.14 -2.70 0.02 0.00 0.01 0.00 0.00 46.19 43.38 2k5q s LEU 51 CO 0.15 0.10 -0.10 -1.83 1.01 0.00 0.00 176.35 175.68 2k5q s GLU 52 N -2.91 1.69 0.11 1.70 -1.05 -1.26 -2.23 118.70 114.74 2k5q s GLU 52 Ca 0.33 -0.36 -0.14 0.00 -0.15 0.00 0.00 54.97 54.65 2k5q s GLU 52 Cb -0.11 -1.57 0.02 0.00 -0.44 0.00 0.00 34.13 32.03 2k5q s GLU 52 CO 0.26 -0.13 0.33 -0.59 0.95 0.00 0.00 175.26 176.07 2k5q s PHE 53 N 1.23 -0.09 0.13 4.83 -0.71 -1.06 -4.88 117.98 117.42 2k5q s PHE 53 Ca -0.04 -0.25 0.08 0.00 -1.04 0.00 0.00 56.93 55.69 2k5q s PHE 53 Cb -0.14 0.15 -0.04 0.00 -1.21 0.00 0.00 43.02 41.78 2k5q s PHE 53 CO -0.03 -0.64 -0.14 0.95 -1.34 0.00 0.00 175.22 174.02 2k5q s THR 54 N -3.71 3.05 0.11 -4.49 -4.23 -1.26 -0.68 115.64 104.43 2k5q s THR 54 Ca 0.03 -1.49 0.04 0.00 -1.18 0.00 0.00 61.69 59.09 2k5q s THR 54 Cb 0.03 -2.43 -0.04 0.00 1.34 0.00 0.00 72.50 71.40 2k5q s THR 54 CO -0.11 0.05 -0.10 0.00 -0.54 0.00 0.00 174.62 173.92 2k5q s ALA 55 N -1.30 1.22 0.32 3.99 0.00 0.69 -4.98 121.76 121.70 2k5q s ALA 55 Ca 0.20 -1.27 0.05 0.00 0.00 0.00 0.00 51.96 50.94 2k5q s ALA 55 Cb -0.10 0.02 0.53 0.00 0.00 0.00 0.00 23.12 23.57 2k5q s ALA 55 CO 0.12 -0.04 1.80 0.37 0.00 0.00 0.00 175.76 178.01 2k5q h GLN 56 N 3.38 0.43 -4.76 0.00 4.15 -1.98 -2.15 115.11 114.19 2k5q h GLN 56 Ca -0.37 -0.13 -0.34 0.00 0.77 0.00 0.00 58.65 58.57 2k5q h GLN 56 Cb 1.19 -0.04 -0.14 0.00 0.21 0.00 0.00 27.48 28.69 2k5q h GLN 56 CO 0.55 0.59 -0.58 0.15 -1.93 0.00 0.00 178.83 177.62 2k5q s LYS 57 N -4.64 1.43 -0.55 1.69 1.02 -1.26 -4.69 119.74 112.74 2k5q s LYS 57 Ca -0.07 -1.79 -0.28 0.00 0.02 0.00 0.00 55.97 53.85 2k5q s LYS 57 Cb 0.14 0.13 0.03 0.00 -0.52 0.00 0.00 37.83 37.61 2k5q s LYS 57 CO 0.77 -0.45 1.24 1.21 -0.92 0.00 0.00 175.35 177.20 2k5q s ASN 58 N -3.27 6.41 0.00 2.83 2.47 -1.26 -4.89 114.94 117.23 2k5q s ASN 58 Ca 0.38 0.23 0.00 0.00 0.42 0.00 0.00 52.86 53.89 2k5q s ASN 58 Cb 0.06 -2.55 0.00 0.00 -1.45 0.00 0.00 41.25 37.31 2k5q s ASN 58 CO 0.17 -1.49 0.47 0.18 -3.72 0.00 0.00 177.10 172.71 2k5q n LEU 59 N 8.59 0.00 -3.19 3.21 4.77 -1.26 -4.95 117.00 124.16 2k5q n LEU 59 Ca 0.10 0.47 0.04 0.00 -0.03 0.00 0.00 56.01 56.59 2k5q n LEU 59 Cb 0.49 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.55 2k5q n LEU 59 CO 0.71 0.00 0.79 -0.60 -1.33 0.00 0.00 177.39 176.97 2k5q s ARG 60 N -0.94 0.08 0.66 3.23 3.00 -1.26 -5.18 118.95 118.55 2k5q s ARG 60 Ca 0.00 0.18 -0.12 0.00 -1.00 0.00 0.00 55.73 54.79 2k5q s ARG 60 Cb 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 34.95 35.05 2k5q s ARG 60 CO 0.00 -0.06 1.06 -1.59 0.00 0.00 0.00 175.30 174.71 2k5q s LYS 61 N 2.50 3.08 0.00 5.12 -2.85 -1.26 -3.95 119.74 122.37 2k5q s LYS 61 Ca -0.03 1.03 0.00 0.00 -1.00 0.00 0.00 55.97 55.97 2k5q s LYS 61 Cb -0.05 -2.01 0.00 0.00 -2.06 0.00 0.00 37.83 33.71 2k5q s LYS 61 CO -0.13 -0.99 0.00 0.39 0.10 0.00 0.00 175.35 174.72 2k5q n GLU 62 N -2.77 -0.05 -3.04 1.78 1.02 -0.46 -4.96 120.64 112.16 2k5q n GLU 62 Ca 0.08 0.01 -0.18 0.00 -0.02 0.00 0.00 57.16 57.05 2k5q n GLU 62 Cb 0.53 -3.44 0.02 0.00 -0.02 0.00 0.00 31.44 28.53 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 -2.57 4.57 0.36 0.62 0.00 -1.25 -4.82 121.76 118.68 2k5q s ALA 63 Ca 0.00 -1.82 -0.01 0.00 0.00 0.00 0.00 51.96 50.13 2k5q s ALA 63 Cb 0.00 -1.55 -0.03 0.00 0.00 0.00 0.00 23.12 21.53 2k5q s ALA 63 CO 0.00 -0.46 0.59 -0.06 0.00 0.00 0.00 175.76 175.83 2k5q s PHE 64 N -2.45 3.51 -0.25 0.00 0.08 -1.04 -0.81 117.98 117.01 2k5q s PHE 64 Ca 0.57 0.45 -0.11 0.00 0.12 0.00 0.00 56.93 57.95 2k5q s PHE 64 Cb -0.08 -1.98 0.09 0.00 -0.57 0.00 0.00 43.02 40.48 2k5q s PHE 64 CO 0.35 0.06 0.57 -1.17 -0.10 0.00 0.00 175.22 174.93 2k5q s LEU 65 N -4.33 -0.76 -0.58 -0.37 0.20 0.75 -1.47 118.68 112.12 2k5q s LEU 65 Ca 0.41 1.31 -0.28 0.00 0.69 0.00 0.00 54.13 56.26 2k5q s LEU 65 Cb -0.10 1.96 0.03 0.00 -0.43 0.00 0.00 46.19 47.66 2k5q s LEU 65 CO 0.37 -0.22 1.17 -0.60 -0.29 0.00 0.00 176.35 176.77 2k5q s ARG 66 N 2.07 3.49 -0.14 1.98 3.52 0.18 0.07 118.95 130.12 2k5q s ARG 66 Ca -0.07 0.18 -0.18 0.00 -0.13 0.00 0.00 55.73 55.53 2k5q s ARG 66 Cb -0.09 -4.02 -0.04 0.00 -1.56 0.00 0.00 34.95 29.24 2k5q s ARG 66 CO -0.17 -1.67 0.45 0.08 -0.81 0.00 0.00 175.30 173.19 2k5q s VAL 67 N 4.86 5.20 -0.42 7.11 1.01 -0.16 -0.61 120.40 137.38 2k5q s VAL 67 Ca 0.41 0.89 -0.22 0.00 0.00 0.00 0.00 61.98 63.06 2k5q s VAL 67 Cb -0.08 -3.79 0.02 0.00 0.00 0.00 0.00 36.38 32.53 2k5q s VAL 67 CO 0.24 0.32 0.73 -0.47 0.00 0.00 0.00 175.10 175.93 2k5q s TYR 68 N 0.73 3.05 -0.27 5.22 6.14 -0.03 -1.09 117.35 131.10 2k5q s TYR 68 Ca 0.24 0.22 -0.12 0.00 0.64 0.00 0.00 57.07 58.06 2k5q s TYR 68 Cb -0.15 -3.48 -0.05 0.00 0.42 0.00 0.00 41.96 38.71 2k5q s TYR 68 CO 0.09 -0.86 0.22 -1.58 0.64 0.00 0.00 175.55 174.06 2k5q s HIS 69 N 3.08 3.25 0.35 4.97 5.65 0.53 -1.50 115.29 131.63 2k5q s HIS 69 Ca 0.28 0.20 0.08 0.00 0.25 0.00 0.00 55.06 55.87 2k5q s HIS 69 Cb -0.13 -2.39 -0.04 0.00 -1.18 0.00 0.00 32.58 28.84 2k5q s HIS 69 CO 0.20 -0.11 0.19 -1.12 -0.65 0.00 0.00 174.74 173.25 2k5q s SER 70 N 1.55 4.82 0.00 9.88 0.01 -0.10 -2.67 113.70 127.20 2k5q s SER 70 Ca 0.09 -0.73 0.00 0.00 1.31 0.00 0.00 55.95 56.61 2k5q s SER 70 Cb -0.15 -0.75 0.00 0.00 0.21 0.00 0.00 66.02 65.33 2k5q s SER 70 CO 0.09 -0.35 0.87 0.47 0.41 0.00 0.00 173.24 174.73 2k5q n ASP 71 N -1.23 0.00 -0.05 2.44 8.00 -1.26 -2.59 116.55 121.85 2k5q n ASP 71 Ca -0.02 0.87 -0.06 0.00 0.71 0.00 0.00 54.79 56.29 2k5q n ASP 71 Cb 0.61 -0.37 -0.14 0.00 -0.02 0.00 0.00 41.12 41.20 2k5q n ASP 71 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 2k5q n LYS 72 N -1.81 0.66 0.23 -1.24 2.85 -1.26 -4.18 118.16 113.41 2k5q n LYS 72 Ca 0.00 0.09 0.11 0.00 -1.05 0.00 0.00 58.31 57.46 2k5q n LYS 72 Cb 0.00 -1.64 0.52 0.00 -0.65 0.00 0.00 35.03 33.26 2k5q n LYS 72 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 2k5q h LYS 73 N 0.00 0.00 0.00 -1.58 3.64 -2.01 -3.47 116.57 113.15 2k5q h LYS 73 Ca -0.37 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 2k5q h LYS 73 Cb 1.97 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.79 2k5q h LYS 73 CO 0.04 0.19 0.00 0.41 -2.27 0.00 0.00 179.45 177.82 2k5q n GLY 74 N 0.03 1.88 2.89 5.01 0.00 -1.07 -4.74 105.19 109.20 2k5q n GLY 74 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 1.01 -0.09 1.61 1.01 -1.26 -0.92 120.40 121.76 2k5q s VAL 75 Ca 0.00 -0.39 -0.09 0.00 0.00 0.00 0.00 61.98 61.51 2k5q s VAL 75 Cb 0.00 -1.10 -0.28 0.00 0.00 0.00 0.00 36.38 35.00 2k5q s VAL 75 CO 0.00 0.27 0.49 0.28 0.00 0.00 0.00 175.10 176.14 2k5q h SER 76 N 8.17 0.50 -2.93 3.32 0.02 -1.56 -3.48 113.55 117.60 2k5q h SER 76 Ca -0.27 -0.95 0.00 0.00 -0.84 0.00 0.00 61.79 59.73 2k5q h SER 76 Cb 1.12 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.50 2k5q h SER 76 CO 0.40 1.83 0.33 0.00 -1.14 0.00 0.00 176.83 178.25 2k5q n ALA 77 N -2.94 -1.95 -3.42 3.77 0.00 -1.26 -5.04 120.51 109.66 2k5q n ALA 77 Ca -0.29 -1.24 -0.15 0.00 0.00 0.00 0.00 53.44 51.76 2k5q n ALA 77 Cb 1.06 0.95 -0.08 0.00 0.00 0.00 0.00 19.45 21.38 2k5q n ALA 77 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 2k5q s TRP 78 N -2.09 -0.53 -0.02 0.00 1.48 -1.26 -0.85 118.94 115.68 2k5q s TRP 78 Ca 0.17 1.11 0.06 0.00 -1.06 0.00 0.00 56.10 56.38 2k5q s TRP 78 Cb -0.05 0.24 -0.01 0.00 -1.16 0.00 0.00 33.47 32.49 2k5q s TRP 78 CO 0.11 -0.41 -0.19 -1.21 -4.06 0.00 0.00 176.95 171.19 2k5q s GLU 79 N -0.50 1.60 -0.20 3.25 2.02 0.22 -4.98 118.70 120.10 2k5q s GLU 79 Ca -0.06 -0.69 -0.11 0.00 0.02 0.00 0.00 54.97 54.13 2k5q s GLU 79 Cb -0.03 -1.53 -0.05 0.00 0.10 0.00 0.00 34.13 32.62 2k5q s GLU 79 CO 0.04 0.41 0.17 -2.00 0.02 0.00 0.00 175.26 173.90 2k5q s GLU 80 N -0.43 4.18 0.00 1.61 -6.30 -1.26 0.47 118.70 116.97 2k5q s GLU 80 Ca 0.07 -0.17 0.02 0.00 -2.50 0.00 0.00 54.97 52.39 2k5q s GLU 80 Cb -0.08 -3.45 -0.01 0.00 0.00 0.00 0.00 34.13 30.59 2k5q s GLU 80 CO -0.01 0.23 -0.06 0.14 0.02 0.00 0.00 175.26 175.59 2k5q s VAL 81 N 0.56 0.42 0.67 3.70 -7.23 -0.54 -4.96 120.40 113.02 2k5q s VAL 81 Ca 0.10 -0.36 -0.11 0.00 -1.81 0.00 0.00 61.98 59.79 2k5q s VAL 81 Cb -0.12 -0.38 -0.01 0.00 0.56 0.00 0.00 36.38 36.43 2k5q s VAL 81 CO 0.01 0.03 1.05 -0.54 -0.31 0.00 0.00 175.10 175.34 2k5q s LYS 82 N -0.37 3.14 0.23 4.82 1.02 -1.26 -2.51 119.74 124.81 2k5q s LYS 82 Ca -0.00 0.82 -0.07 0.00 0.02 0.00 0.00 55.97 56.74 2k5q s LYS 82 Cb -0.03 -2.02 0.26 0.00 -0.52 0.00 0.00 37.83 35.51 2k5q s LYS 82 CO -0.00 -0.92 1.87 -0.22 -0.92 0.00 0.00 175.35 175.16 2k5q h LYS 83 N -0.58 1.00 0.00 1.68 3.11 -1.95 -1.80 116.57 118.03 2k5q h LYS 83 Ca -0.44 -0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.34 2k5q h LYS 83 Cb 1.21 -0.23 0.00 0.00 -1.00 0.00 0.00 32.23 32.21 2k5q h LYS 83 CO 0.59 0.66 0.00 -0.44 -2.81 0.00 0.00 179.45 177.46 2k5q h ASP 84 N 1.03 0.00 0.68 4.20 3.32 -2.02 -1.82 116.42 121.81 2k5q h ASP 84 Ca 0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.39 2k5q h ASP 84 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 2k5q h ASP 84 CO -0.12 0.00 -0.10 -0.62 -1.72 0.00 0.00 179.24 176.68 2k5q n GLU 85 N -2.78 0.26 -4.00 3.56 1.02 -0.68 -4.82 120.64 113.20 2k5q n GLU 85 Ca -0.00 -0.06 -0.36 0.00 -0.02 0.00 0.00 57.16 56.72 2k5q n GLU 85 Cb 0.20 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.05 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 -2.78 4.19 0.45 -4.62 1.43 -0.69 -4.99 118.68 111.66 2k5q s LEU 86 Ca 0.20 0.39 -0.24 0.00 -1.03 0.00 0.00 54.13 53.45 2k5q s LEU 86 Cb 0.19 -2.01 -0.07 0.00 0.03 0.00 0.00 46.19 44.33 2k5q s LEU 86 CO 0.53 0.40 1.24 -2.16 0.23 0.00 0.00 176.35 176.59 2k5q s PRO 87 N -1.00 3.76 0.60 1.29 0.04 -1.26 -4.90 135.00 133.53 2k5q s PRO 87 Ca 0.15 1.99 0.28 0.00 0.04 0.00 0.00 61.00 63.46 2k5q s PRO 87 Cb -0.12 -2.54 1.40 0.00 0.04 0.00 0.00 34.50 33.28 2k5q s PRO 87 CO 0.04 -0.61 1.81 0.00 0.04 0.00 0.00 177.00 178.27 2k5q h ALA 88 N 2.24 2.17 -0.19 8.56 0.00 -1.97 -1.14 119.26 128.92 2k5q h ALA 88 Ca -0.50 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.45 2k5q h ALA 88 Cb 1.25 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2k5q h ALA 88 CO 0.61 -0.81 0.19 0.87 0.00 0.00 0.00 179.25 180.11 2k5q h LYS 89 N 0.00 0.00 0.00 0.00 6.56 -1.98 0.23 116.57 121.38 2k5q h LYS 89 Ca 0.22 0.00 -0.07 0.00 -1.06 0.00 0.00 60.65 59.74 2k5q h LYS 89 Cb 1.36 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 33.01 2k5q h LYS 89 CO -0.00 0.00 -0.33 -0.39 -2.06 0.00 0.00 179.45 176.67 2k5q h VAL 90 N 0.00 0.98 0.05 0.50 -1.51 -1.57 -2.94 116.25 111.76 2k5q h VAL 90 Ca 0.09 -1.25 -0.36 0.00 -1.23 0.00 0.00 66.70 63.95 2k5q h VAL 90 Cb 0.46 1.73 -0.05 0.00 -2.13 0.00 0.00 31.29 31.30 2k5q h VAL 90 CO -0.00 0.32 -2.16 1.17 -1.23 0.00 0.00 177.57 175.68 2k5q n LYS 91 N -3.77 0.70 0.31 5.19 4.81 0.52 -3.24 118.16 122.68 2k5q n LYS 91 Ca -0.01 0.20 0.19 0.00 -0.87 0.00 0.00 58.31 57.82 2k5q n LYS 91 Cb 0.42 -1.64 1.00 0.00 0.02 0.00 0.00 35.03 34.83 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 0.03 0.00 0.00 1.64 5.08 -0.82 -2.09 114.58 118.42 2k5q h GLU 92 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 2k5q h GLU 92 Cb 2.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.27 2k5q h GLU 92 CO 0.02 0.02 -0.97 1.63 -1.00 0.00 0.00 179.01 178.71 2k5q n LYS 93 N -3.23 1.55 -3.88 2.33 5.02 -1.11 -4.88 118.16 113.96 2k5q n LYS 93 Ca -0.02 -0.03 -0.26 0.00 -2.02 0.00 0.00 58.31 55.97 2k5q n LYS 93 Cb 0.15 -1.27 -0.17 0.00 -0.02 0.00 0.00 35.03 33.73 2k5q n LYS 93 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2k5q s LEU 94 N -3.06 1.08 0.00 -0.35 1.43 -0.79 -4.77 118.68 112.23 2k5q s LEU 94 Ca 0.03 -0.27 0.00 0.00 -1.03 0.00 0.00 54.13 52.86 2k5q s LEU 94 Cb 0.11 -0.77 0.00 0.00 0.03 0.00 0.00 46.19 45.56 2k5q s LEU 94 CO 0.64 -0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.70 2k5q n GLY 95 N 4.98 1.12 3.45 -3.19 0.00 -1.26 -4.52 105.19 105.77 2k5q n GLY 95 Ca -0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 2k5q n GLY 95 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k5q s VAL 96 N -2.00 3.82 -0.20 1.61 1.01 -1.26 -5.10 120.40 118.27 2k5q s VAL 96 Ca 0.00 -0.37 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 2k5q s VAL 96 Cb 0.00 -2.69 -0.01 0.00 0.00 0.00 0.00 36.38 33.68 2k5q s VAL 96 CO 0.00 0.47 -0.06 -1.59 0.00 0.00 0.00 175.10 173.91 2k5q s LYS 97 N 0.69 3.40 0.40 2.72 0.00 -1.26 -5.03 119.74 120.66 2k5q s LYS 97 Ca -0.02 -0.63 0.00 0.00 0.00 0.00 0.00 55.97 55.33 2k5q s LYS 97 Cb -0.14 -2.93 0.00 0.00 0.00 0.00 0.00 37.83 34.76 2k5q s LYS 97 CO 0.02 -0.08 0.00 -0.11 0.00 0.00 0.00 175.35 175.18 2k5q n LEU 98 N 4.45 0.00 -3.08 2.77 7.94 -1.26 -4.94 117.00 122.88 2k5q n LEU 98 Ca -0.18 1.02 -0.15 0.00 -1.11 0.00 0.00 56.01 55.60 2k5q n LEU 98 Cb 0.51 -2.99 0.01 0.00 0.53 0.00 0.00 43.42 41.48 2k5q n LEU 98 CO 0.29 -2.01 0.01 1.21 -1.11 0.00 0.00 177.39 175.78 2k5q n GLU 99 N -3.08 -2.09 -2.74 1.96 2.13 -1.26 -4.90 120.64 110.66 2k5q n GLU 99 Ca 0.01 1.81 -0.42 0.00 0.66 0.00 0.00 57.16 59.21 2k5q n GLU 99 Cb 0.43 -4.70 -0.04 0.00 0.27 0.00 0.00 31.44 27.40 2k5q n GLU 99 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 2k5q s HIS 100 N -2.44 2.66 -0.18 4.31 3.76 -1.26 -4.97 115.29 117.17 2k5q s HIS 100 Ca 0.23 -0.01 -0.31 0.00 -0.15 0.00 0.00 55.06 54.83 2k5q s HIS 100 Cb -0.05 -4.29 -0.08 0.00 1.11 0.00 0.00 32.58 29.28 2k5q s HIS 100 CO 0.80 -1.55 2.13 0.72 -0.85 0.00 0.00 174.74 175.98 2k5q n HIS 101 N 7.99 2.05 -2.39 1.40 -0.00 -1.26 -4.89 115.22 118.11 2k5q n HIS 101 Ca 0.03 -0.08 -0.37 0.00 -0.00 0.00 0.00 57.72 57.30 2k5q n HIS 101 Cb 0.48 -2.70 -0.03 0.00 -0.00 0.00 0.00 29.99 27.74 2k5q n HIS 101 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2k5q s HIS 102 N 6.86 2.32 -0.72 4.41 3.76 -1.26 -4.95 115.29 125.71 2k5q s HIS 102 Ca 0.99 -0.43 -0.27 0.00 -0.15 0.00 0.00 55.06 55.20 2k5q s HIS 102 Cb -0.50 -4.49 0.03 0.00 1.11 0.00 0.00 32.58 28.73 2k5q s HIS 102 CO 0.41 -1.84 1.29 -1.58 -0.85 0.00 0.00 174.74 172.18 2k5q s HIS 103 N 6.63 2.28 0.74 1.40 2.46 -1.26 -5.01 115.29 122.53 2k5q s HIS 103 Ca 0.54 0.01 -0.04 0.00 0.47 0.00 0.00 55.06 56.04 2k5q s HIS 103 Cb -0.02 -4.60 0.12 0.00 -0.13 0.00 0.00 32.58 27.95 2k5q s HIS 103 CO -0.05 -2.06 1.03 -3.38 -2.47 0.00 0.00 174.74 167.81 2k5q s HIS 104 N 5.81 1.95 -2.66 3.88 -3.43 -1.26 -5.34 115.29 114.24 2k5q s HIS 104 Ca 0.37 -0.02 0.21 0.00 -0.80 0.00 0.00 55.06 54.82 2k5q s HIS 104 Cb -0.08 -3.20 0.17 0.00 -1.43 0.00 0.00 32.58 28.04 2k5q s HIS 104 CO 0.16 -1.73 1.17 0.72 -2.00 0.00 0.00 174.74 173.06