#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 4.37 0.48 7.83 2.15 -1.26 -5.02 116.67 125.22 2k5q s ASP 2 Ca 0.00 -0.14 0.22 0.00 0.43 0.00 0.00 52.55 53.06 2k5q s ASP 2 Cb 0.00 -1.23 1.23 0.00 -0.30 0.00 0.00 42.92 42.63 2k5q s ASP 2 CO 0.00 0.30 2.02 0.17 -0.17 0.00 0.00 175.17 177.49 2k5q h LEU 3 N 5.70 0.00 -0.22 -1.34 8.10 -2.10 -1.76 115.31 123.70 2k5q h LEU 3 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.57 2k5q h LEU 3 Cb 1.18 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.40 2k5q h LEU 3 CO 0.54 0.17 0.00 0.59 -4.11 0.00 0.00 178.44 175.62 2k5q n ASN 4 N -3.88 0.24 0.10 0.17 4.13 -1.26 -1.56 115.26 113.20 2k5q n ASN 4 Ca -0.02 0.55 -0.03 0.00 1.68 0.00 0.00 54.58 56.77 2k5q n ASN 4 Cb 0.26 -0.61 -0.03 0.00 -1.54 0.00 0.00 39.78 37.86 2k5q n ASN 4 CO 0.00 0.00 0.00 0.03 0.28 0.00 0.00 177.26 177.57 2k5q h ARG 5 N 0.00 0.00 -5.01 3.52 2.47 -1.74 -3.40 114.38 110.21 2k5q h ARG 5 Ca 0.00 0.00 -0.68 0.00 -1.26 0.00 0.00 59.98 58.04 2k5q h ARG 5 Cb 0.31 0.00 -0.18 0.00 -1.65 0.00 0.00 29.97 28.46 2k5q h ARG 5 CO 0.00 0.77 0.64 -1.64 0.56 0.00 0.00 179.97 180.30 2k5q s MET 6 N -2.88 3.42 -0.42 0.04 -1.94 -0.60 -4.89 119.30 112.03 2k5q s MET 6 Ca 0.02 -1.54 0.07 0.00 -1.71 0.00 0.00 55.69 52.53 2k5q s MET 6 Cb 0.09 -4.65 0.24 0.00 2.01 0.00 0.00 34.83 32.51 2k5q s MET 6 CO 0.78 -1.73 0.58 0.41 -0.01 0.00 0.00 175.02 175.06 2k5q n GLY 7 N 5.35 2.03 0.00 -0.03 0.00 -1.26 -5.00 105.19 106.28 2k5q n GLY 7 Ca 0.13 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 45.06 2k5q n GLY 7 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2k5q n LYS 8 N 1.71 0.00 -3.67 1.61 0.00 -1.26 -4.88 118.16 111.67 2k5q n LYS 8 Ca 0.20 0.33 -0.25 0.00 0.00 0.00 0.00 58.31 58.58 2k5q n LYS 8 Cb 0.55 -1.01 -0.17 0.00 0.00 0.00 0.00 35.03 34.39 2k5q n LYS 8 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2k5q s ASP 9 N -2.20 2.14 -0.34 3.14 1.01 -1.26 -5.04 116.67 114.13 2k5q s ASP 9 Ca 0.00 -0.46 -0.08 0.00 0.71 0.00 0.00 52.55 52.72 2k5q s ASP 9 Cb 0.00 -0.32 0.02 0.00 1.01 0.00 0.00 42.92 43.63 2k5q s ASP 9 CO 0.00 -0.30 0.14 -1.83 0.21 0.00 0.00 175.17 173.38 2k5q s GLU 10 N 2.06 2.89 -0.09 8.23 -1.05 -1.26 -0.47 118.70 129.02 2k5q s GLU 10 Ca 0.02 -1.01 -0.10 0.00 -0.15 0.00 0.00 54.97 53.73 2k5q s GLU 10 Cb -0.15 -3.53 -0.05 0.00 -0.44 0.00 0.00 34.13 29.96 2k5q s GLU 10 CO -0.07 -0.59 0.24 0.71 0.95 0.00 0.00 175.26 176.50 2k5q s TYR 11 N 1.50 3.62 -0.58 4.83 2.02 -0.03 -4.85 117.35 123.85 2k5q s TYR 11 Ca 0.01 0.67 -0.19 0.00 -0.37 0.00 0.00 57.07 57.19 2k5q s TYR 11 Cb -0.18 -2.10 0.10 0.00 -0.40 0.00 0.00 41.96 39.38 2k5q s TYR 11 CO 0.04 0.64 0.69 0.71 -1.57 0.00 0.00 175.55 176.05 2k5q s TYR 12 N -0.82 3.02 0.10 2.71 2.02 -1.26 -0.96 117.35 122.15 2k5q s TYR 12 Ca 0.17 -0.95 0.09 0.00 -0.37 0.00 0.00 57.07 56.01 2k5q s TYR 12 Cb -0.13 -3.97 -0.03 0.00 -0.40 0.00 0.00 41.96 37.42 2k5q s TYR 12 CO 0.07 -1.26 -0.24 0.14 -1.57 0.00 0.00 175.55 172.69 2k5q s VAL 13 N 2.61 1.96 0.50 0.71 -7.23 -1.04 -4.82 120.40 113.10 2k5q s VAL 13 Ca 0.11 -1.56 0.07 0.00 -1.81 0.00 0.00 61.98 58.79 2k5q s VAL 13 Cb -0.24 -1.74 0.03 0.00 0.56 0.00 0.00 36.38 34.99 2k5q s VAL 13 CO 0.06 0.08 0.51 0.00 -0.31 0.00 0.00 175.10 175.45 2k5q s GLN 14 N -1.79 2.39 -0.60 4.82 -2.07 -1.26 -0.25 119.66 120.90 2k5q s GLN 14 Ca 0.10 -1.72 -0.28 0.00 -1.82 0.00 0.00 55.36 51.64 2k5q s GLN 14 Cb -0.10 -2.38 0.03 0.00 -1.09 0.00 0.00 33.01 29.47 2k5q s GLN 14 CO 0.04 -0.53 1.23 0.42 -1.32 0.00 0.00 175.29 175.14 2k5q s ILE 15 N -2.62 3.95 -0.01 3.63 -1.09 -1.21 -4.88 121.20 118.96 2k5q s ILE 15 Ca 0.47 0.81 -0.01 0.00 -2.23 0.00 0.00 60.65 59.69 2k5q s ILE 15 Cb -0.04 -4.72 -0.00 0.00 -1.58 0.00 0.00 42.46 36.12 2k5q s ILE 15 CO 0.29 -1.39 -0.02 0.35 -1.23 0.00 0.00 174.94 172.94 2k5q n THR 16 N 6.66 0.12 -3.93 2.92 -2.24 -1.26 -4.71 114.28 111.83 2k5q n THR 16 Ca 0.08 0.47 -0.35 0.00 -2.27 0.00 0.00 64.05 61.99 2k5q n THR 16 Cb 0.49 -1.57 -0.10 0.00 -2.10 0.00 0.00 70.33 67.05 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 -1.13 4.85 0.30 2.28 -7.23 -1.26 -5.11 120.40 113.09 2k5q s VAL 17 Ca -0.02 -0.01 0.05 0.00 -1.81 0.00 0.00 61.98 60.19 2k5q s VAL 17 Cb 0.00 -3.20 -0.06 0.00 0.56 0.00 0.00 36.38 33.68 2k5q s VAL 17 CO 0.03 0.43 0.01 1.51 -0.31 0.00 0.00 175.10 176.77 2k5q s ASP 18 N 0.56 2.45 0.00 4.85 -4.77 -1.26 -4.73 116.67 113.78 2k5q s ASP 18 Ca 0.04 -1.29 0.00 0.00 -3.30 0.00 0.00 52.55 48.00 2k5q s ASP 18 Cb -0.13 -0.11 0.00 0.00 -1.09 0.00 0.00 42.92 41.60 2k5q s ASP 18 CO 0.01 -0.50 0.00 0.61 0.70 0.00 0.00 175.17 175.99 2k5q n GLY 19 N -0.62 0.34 3.56 2.12 0.00 -1.26 -4.93 105.19 104.40 2k5q n GLY 19 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.79 2.90 -0.20 1.61 2.20 -1.26 -4.95 119.74 119.25 2k5q s LYS 20 Ca 0.00 -0.53 -0.29 0.00 -0.36 0.00 0.00 55.97 54.79 2k5q s LYS 20 Cb 0.00 -5.13 0.00 0.00 -1.51 0.00 0.00 37.83 31.20 2k5q s LYS 20 CO 0.00 -2.97 1.02 -1.83 -0.36 0.00 0.00 175.35 171.21 2k5q s GLU 21 N 6.34 4.30 -0.71 4.03 -1.05 -1.26 -0.47 118.70 129.88 2k5q s GLU 21 Ca 0.62 1.35 -0.06 0.00 -0.15 0.00 0.00 54.97 56.72 2k5q s GLU 21 Cb -0.05 -3.61 0.19 0.00 -0.44 0.00 0.00 34.13 30.22 2k5q s GLU 21 CO -0.03 -0.54 0.57 0.14 0.95 0.00 0.00 175.26 176.36 2k5q s VAL 22 N 2.85 4.35 -1.14 1.83 -7.23 0.05 -4.94 120.40 116.17 2k5q s VAL 22 Ca 0.45 -2.91 -0.21 0.00 -1.81 0.00 0.00 61.98 57.50 2k5q s VAL 22 Cb -0.16 -3.77 -0.06 0.00 0.56 0.00 0.00 36.38 32.95 2k5q s VAL 22 CO 0.09 -0.94 1.91 1.57 -0.31 0.00 0.00 175.10 177.42 2k5q n HIS 23 N 3.51 3.01 -2.65 2.82 -0.00 -1.26 -4.04 115.22 116.60 2k5q n HIS 23 Ca 0.11 -1.91 -0.03 0.00 -0.00 0.00 0.00 57.72 55.89 2k5q n HIS 23 Cb 0.40 -2.44 0.10 0.00 -0.00 0.00 0.00 29.99 28.05 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 11.27 -1.30 -2.71 0.26 2.88 -1.26 -5.03 113.62 117.73 2k5q n SER 24 Ca 0.47 -2.03 -0.07 0.00 -1.33 0.00 0.00 58.87 55.91 2k5q n SER 24 Cb 0.45 0.67 0.10 0.00 -0.75 0.00 0.00 64.21 64.67 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 -1.04 0.80 0.00 -1.46 4.81 -1.26 -5.12 118.16 114.89 2k5q n LYS 25 Ca -0.13 -1.59 0.00 0.00 -0.87 0.00 0.00 58.31 55.72 2k5q n LYS 25 Cb 0.80 -0.71 0.00 0.00 0.02 0.00 0.00 35.03 35.14 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 0.28 0.00 -4.70 3.14 0.00 -1.26 -4.97 120.51 112.99 2k5q n ALA 26 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.14 2k5q n ALA 26 Cb 0.73 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.11 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 0.00 3.12 0.04 0.00 9.92 -1.26 -5.04 116.55 123.33 2k5q n ASP 27 Ca 0.00 -3.15 0.12 0.00 -0.53 0.00 0.00 54.79 51.23 2k5q n ASP 27 Cb 0.00 0.42 0.49 0.00 -0.64 0.00 0.00 41.12 41.39 2k5q n ASP 27 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2k5q n ASN 28 N -1.32 0.26 0.00 -2.24 4.13 -1.26 -4.61 115.26 110.22 2k5q n ASN 28 Ca -0.19 0.54 0.00 0.00 1.68 0.00 0.00 54.58 56.61 2k5q n ASN 28 Cb 0.62 -0.60 0.00 0.00 -1.54 0.00 0.00 39.78 38.26 2k5q n ASN 28 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2k5q n GLY 29 N 0.94 0.16 3.67 7.41 0.00 -1.26 -5.10 105.19 111.01 2k5q n GLY 29 Ca 0.05 -0.13 -0.44 0.00 0.00 0.00 0.00 46.02 45.50 2k5q n GLY 29 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2k5q n GLN 30 N -1.65 2.60 -2.59 1.61 7.27 -1.26 -4.86 117.38 118.50 2k5q n GLN 30 Ca 0.00 0.95 -0.41 0.00 0.07 0.00 0.00 57.00 57.61 2k5q n GLN 30 Cb 0.00 -2.86 -0.03 0.00 2.41 0.00 0.00 30.24 29.76 2k5q n GLN 30 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 2k5q s LYS 31 N 3.94 3.53 -0.11 3.69 -0.14 -1.26 -4.33 119.74 125.06 2k5q s LYS 31 Ca 0.89 -1.03 -0.12 0.00 -1.36 0.00 0.00 55.97 54.35 2k5q s LYS 31 Cb -0.54 -5.14 -0.05 0.00 -1.68 0.00 0.00 37.83 30.42 2k5q s LYS 31 CO 0.44 -2.17 0.27 0.71 -0.76 0.00 0.00 175.35 173.85 2k5q s TYR 32 N 4.93 3.57 -0.20 3.18 1.51 -1.26 -5.09 117.35 123.99 2k5q s TYR 32 Ca 0.43 0.68 -0.04 0.00 -1.01 0.00 0.00 57.07 57.13 2k5q s TYR 32 Cb -0.02 -2.21 0.07 0.00 -0.11 0.00 0.00 41.96 39.69 2k5q s TYR 32 CO -0.06 0.50 0.08 0.15 -1.11 0.00 0.00 175.55 175.11 2k5q s LYS 33 N -0.40 0.27 0.27 -0.62 3.01 -1.26 -4.49 119.74 116.53 2k5q s LYS 33 Ca 0.18 -0.27 -0.18 0.00 -1.01 0.00 0.00 55.97 54.69 2k5q s LYS 33 Cb -0.14 -1.84 -0.09 0.00 -1.01 0.00 0.00 37.83 34.76 2k5q s LYS 33 CO 0.06 -0.72 0.74 -0.51 0.51 0.00 0.00 175.35 175.44 2k5q s ASP 34 N 2.03 6.94 -0.30 2.83 1.11 -1.26 -4.76 116.67 123.27 2k5q s ASP 34 Ca 0.02 1.37 -0.20 0.00 0.18 0.00 0.00 52.55 53.92 2k5q s ASP 34 Cb -0.16 -2.41 -0.01 0.00 1.07 0.00 0.00 42.92 41.41 2k5q s ASP 34 CO -0.13 -0.08 0.63 -0.31 1.18 0.00 0.00 175.17 176.47 2k5q s TYR 35 N -1.74 3.22 -0.58 4.23 2.02 0.34 -0.77 117.35 124.08 2k5q s TYR 35 Ca 0.48 0.61 -0.25 0.00 -0.37 0.00 0.00 57.07 57.54 2k5q s TYR 35 Cb -0.14 -2.98 0.04 0.00 -0.40 0.00 0.00 41.96 38.48 2k5q s TYR 35 CO 0.19 -0.46 1.02 -2.00 -1.57 0.00 0.00 175.55 172.73 2k5q s GLU 36 N 2.61 3.35 -0.79 -0.62 2.12 0.38 -0.98 118.70 124.77 2k5q s GLU 36 Ca 0.25 -0.18 -0.16 0.00 0.36 0.00 0.00 54.97 55.24 2k5q s GLU 36 Cb -0.15 -4.06 0.17 0.00 0.26 0.00 0.00 34.13 30.34 2k5q s GLU 36 CO 0.11 -1.59 0.83 0.71 -0.54 0.00 0.00 175.26 174.79 2k5q s TYR 37 N 4.30 3.40 -0.46 5.30 1.51 -0.45 -4.70 117.35 126.25 2k5q s TYR 37 Ca 0.33 -1.58 -0.16 0.00 -1.01 0.00 0.00 57.07 54.66 2k5q s TYR 37 Cb -0.11 -3.98 0.05 0.00 -0.11 0.00 0.00 41.96 37.81 2k5q s TYR 37 CO 0.20 -1.19 0.40 0.21 -1.11 0.00 0.00 175.55 174.06 2k5q s LYS 38 N 1.45 3.00 -0.08 -0.62 2.20 -1.26 -1.01 119.74 123.42 2k5q s LYS 38 Ca 0.20 -1.17 0.02 0.00 -0.36 0.00 0.00 55.97 54.65 2k5q s LYS 38 Cb -0.13 -4.08 -0.02 0.00 -1.51 0.00 0.00 37.83 32.09 2k5q s LYS 38 CO -0.05 -0.96 -0.14 -0.51 -0.36 0.00 0.00 175.35 173.32 2k5q s LEU 39 N 1.79 2.69 -0.72 5.43 2.01 0.11 -4.96 118.68 125.04 2k5q s LEU 39 Ca 0.06 -0.26 -0.26 0.00 0.01 0.00 0.00 54.13 53.67 2k5q s LEU 39 Cb -0.22 -1.57 0.01 0.00 0.01 0.00 0.00 46.19 44.42 2k5q s LEU 39 CO 0.09 0.27 1.53 -0.89 1.01 0.00 0.00 176.35 178.36 2k5q s THR 40 N -0.28 3.59 0.11 5.49 2.01 -1.26 -1.17 115.64 124.13 2k5q s THR 40 Ca 0.02 0.22 -0.31 0.00 0.31 0.00 0.00 61.69 61.93 2k5q s THR 40 Cb -0.13 -4.54 -0.07 0.00 0.01 0.00 0.00 72.50 67.77 2k5q s THR 40 CO 0.03 -1.48 1.29 -0.83 -0.69 0.00 0.00 174.62 172.94 2k5q s GLY 41 N 5.59 2.25 -0.14 4.40 0.00 0.30 -4.72 107.32 114.99 2k5q s GLY 41 Ca 0.49 1.00 -0.12 0.00 0.00 0.00 0.00 44.72 46.09 2k5q s GLY 41 CO 0.15 2.16 0.26 -1.36 0.00 0.00 0.00 173.10 174.30 2k5q s PHE 42 N 0.87 3.50 0.66 1.90 0.08 -1.26 0.15 117.98 123.88 2k5q s PHE 42 Ca 0.60 0.59 -0.12 0.00 0.12 0.00 0.00 56.93 58.12 2k5q s PHE 42 Cb -0.34 -2.25 -0.01 0.00 -0.57 0.00 0.00 43.02 39.85 2k5q s PHE 42 CO 0.31 0.36 1.05 0.34 -0.10 0.00 0.00 175.22 177.18 2k5q s ASP 43 N 0.09 5.62 0.31 1.36 2.15 -1.07 -4.72 116.67 120.41 2k5q s ASP 43 Ca 0.16 1.62 0.07 0.00 0.43 0.00 0.00 52.55 54.83 2k5q s ASP 43 Cb -0.13 -2.50 0.78 0.00 -0.30 0.00 0.00 42.92 40.77 2k5q s ASP 43 CO 0.04 -1.28 1.77 0.11 -0.17 0.00 0.00 175.17 175.64 2k5q h LYS 44 N -0.39 0.70 0.57 4.34 1.57 -1.97 -1.59 116.57 119.80 2k5q h LYS 44 Ca -0.44 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.27 2k5q h LYS 44 Cb 1.21 -0.16 0.01 0.00 0.08 0.00 0.00 32.23 33.36 2k5q h LYS 44 CO 0.58 0.46 -0.27 0.22 -0.57 0.00 0.00 179.45 179.87 2k5q h ASP 45 N 0.72 -0.65 0.00 0.86 3.58 -2.03 -3.48 116.42 115.43 2k5q h ASP 45 Ca 0.59 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 58.01 2k5q h ASP 45 Cb 0.97 0.17 0.00 0.00 1.72 0.00 0.00 39.33 42.19 2k5q h ASP 45 CO -0.40 -0.34 0.00 0.61 -2.88 0.00 0.00 179.24 176.23 2k5q n GLY 46 N -0.90 0.00 3.63 -0.78 0.00 -0.60 -5.14 105.19 101.40 2k5q n GLY 46 Ca -0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.63 2k5q n GLY 46 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k5q n LYS 47 N 0.00 0.74 -5.29 1.61 5.02 -1.25 -4.88 118.16 114.10 2k5q n LYS 47 Ca 0.00 -3.40 -0.31 0.00 -2.02 0.00 0.00 58.31 52.58 2k5q n LYS 47 Cb 0.00 0.54 -0.16 0.00 -0.02 0.00 0.00 35.03 35.39 2k5q n LYS 47 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2k5q s GLU 48 N -4.06 2.22 -0.05 1.97 1.03 -1.26 -2.60 118.70 115.96 2k5q s GLU 48 Ca 0.21 -0.92 -0.06 0.00 0.03 0.00 0.00 54.97 54.23 2k5q s GLU 48 Cb -0.02 -2.08 0.01 0.00 -0.80 0.00 0.00 34.13 31.25 2k5q s GLU 48 CO 0.13 0.52 0.15 0.21 -1.33 0.00 0.00 175.26 174.94 2k5q s LYS 49 N -0.51 0.23 -0.35 -4.83 2.47 0.12 -4.93 119.74 111.94 2k5q s LYS 49 Ca 0.07 0.12 -0.21 0.00 -1.56 0.00 0.00 55.97 54.38 2k5q s LYS 49 Cb -0.11 0.10 0.00 0.00 -1.46 0.00 0.00 37.83 36.37 2k5q s LYS 49 CO 0.00 -0.04 0.68 -2.00 0.16 0.00 0.00 175.35 174.15 2k5q s GLU 50 N -0.15 3.71 0.08 4.03 2.56 -1.26 0.11 118.70 127.78 2k5q s GLU 50 Ca -0.02 0.15 0.09 0.00 0.00 0.00 0.00 54.97 55.19 2k5q s GLU 50 Cb -0.02 -3.80 -0.03 0.00 2.00 0.00 0.00 34.13 32.27 2k5q s GLU 50 CO 0.00 -0.76 -0.25 -0.51 -0.56 0.00 0.00 175.26 173.19 2k5q s LEU 51 N 2.81 2.23 -0.13 2.70 2.01 -0.32 -4.92 118.68 123.07 2k5q s LEU 51 Ca 0.26 -0.63 -0.05 0.00 0.01 0.00 0.00 54.13 53.72 2k5q s LEU 51 Cb -0.14 -1.14 0.06 0.00 0.01 0.00 0.00 46.19 44.97 2k5q s LEU 51 CO 0.15 0.19 0.28 -0.70 1.01 0.00 0.00 176.35 177.28 2k5q s GLU 52 N -1.55 0.20 -0.06 1.70 -6.30 -1.26 0.08 118.70 111.52 2k5q s GLU 52 Ca 0.11 0.68 0.01 0.00 -2.50 0.00 0.00 54.97 53.27 2k5q s GLU 52 Cb -0.10 -0.05 0.02 0.00 0.00 0.00 0.00 34.13 34.01 2k5q s GLU 52 CO 0.03 -0.22 -0.05 -0.59 0.02 0.00 0.00 175.26 174.45 2k5q s PHE 53 N 1.88 0.88 -0.38 5.30 -0.71 -0.18 -4.32 117.98 120.46 2k5q s PHE 53 Ca -0.04 -0.28 -0.16 0.00 -1.04 0.00 0.00 56.93 55.40 2k5q s PHE 53 Cb -0.11 -0.78 0.00 0.00 -1.21 0.00 0.00 43.02 40.93 2k5q s PHE 53 CO -0.09 -0.24 0.41 0.95 -1.34 0.00 0.00 175.22 174.91 2k5q s THR 54 N 1.08 5.11 0.11 -4.49 -4.23 -1.26 -1.34 115.64 110.63 2k5q s THR 54 Ca -0.08 -0.11 -0.02 0.00 -1.18 0.00 0.00 61.69 60.30 2k5q s THR 54 Cb -0.14 -3.94 -0.05 0.00 1.34 0.00 0.00 72.50 69.71 2k5q s THR 54 CO -0.01 -0.26 0.30 0.00 -0.54 0.00 0.00 174.62 174.11 2k5q s ALA 55 N 2.12 3.91 -0.54 3.99 0.00 -0.15 -4.74 121.76 126.33 2k5q s ALA 55 Ca 0.13 -0.75 0.26 0.00 0.00 0.00 0.00 51.96 51.59 2k5q s ALA 55 Cb -0.17 -1.95 0.75 0.00 0.00 0.00 0.00 23.12 21.75 2k5q s ALA 55 CO 0.13 0.70 1.74 -0.56 0.00 0.00 0.00 175.76 177.77 2k5q h GLN 56 N 2.78 0.00 -4.30 0.00 3.07 -1.91 1.00 115.11 115.75 2k5q h GLN 56 Ca -0.46 0.00 -0.14 0.00 0.09 0.00 0.00 58.65 58.14 2k5q h GLN 56 Cb 1.17 0.00 -0.15 0.00 0.08 0.00 0.00 27.48 28.58 2k5q h GLN 56 CO 0.73 0.00 -0.68 0.15 0.09 0.00 0.00 178.83 179.12 2k5q s LYS 57 N -3.21 0.67 -0.06 0.06 1.02 -1.26 -4.85 119.74 112.11 2k5q s LYS 57 Ca 0.08 -1.26 -0.30 0.00 0.02 0.00 0.00 55.97 54.52 2k5q s LYS 57 Cb 0.10 0.17 -0.06 0.00 -0.52 0.00 0.00 37.83 37.52 2k5q s LYS 57 CO 0.59 -0.12 1.75 1.21 -0.92 0.00 0.00 175.35 177.86 2k5q s ASN 58 N -2.95 6.53 0.00 2.83 2.47 -1.26 -4.94 114.94 117.62 2k5q s ASN 58 Ca 0.09 2.27 0.00 0.00 0.42 0.00 0.00 52.86 55.64 2k5q s ASN 58 Cb 0.08 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.35 2k5q s ASN 58 CO -0.08 -1.04 0.00 0.18 -3.72 0.00 0.00 177.10 172.44 2k5q n LEU 59 N 7.57 0.24 0.00 3.21 4.77 -1.26 -5.08 117.00 126.45 2k5q n LEU 59 Ca 0.19 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 2k5q n LEU 59 Cb 0.43 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 2k5q n LEU 59 CO 0.64 0.00 0.00 0.54 -1.33 0.00 0.00 177.39 177.24 2k5q n ARG 60 N -0.04 2.36 0.00 3.23 3.00 -1.26 -5.14 116.66 118.81 2k5q n ARG 60 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 2k5q n ARG 60 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 2k5q n ARG 60 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2k5q n LYS 61 N 0.00 0.00 0.11 5.56 5.02 -1.26 -4.85 118.16 122.74 2k5q n LYS 61 Ca 0.00 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.41 2k5q n LYS 61 Cb 0.00 0.00 0.09 0.00 -0.02 0.00 0.00 35.03 35.10 2k5q n LYS 61 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 2k5q h GLU 62 N 0.00 0.00 -7.05 1.97 4.81 -1.99 -3.21 114.58 109.11 2k5q h GLU 62 Ca 0.00 0.00 -0.50 0.00 -0.13 0.00 0.00 59.36 58.73 2k5q h GLU 62 Cb 0.00 0.00 0.07 0.00 0.63 0.00 0.00 28.75 29.45 2k5q h GLU 62 CO 0.00 0.00 0.46 0.00 -0.73 0.00 0.00 179.01 178.74 2k5q s ALA 63 N -3.27 2.80 0.28 2.92 0.00 -1.26 -4.73 121.76 118.50 2k5q s ALA 63 Ca 0.03 0.88 0.04 0.00 0.00 0.00 0.00 51.96 52.91 2k5q s ALA 63 Cb 0.10 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 2k5q s ALA 63 CO 0.74 -0.75 0.43 -0.06 0.00 0.00 0.00 175.76 176.13 2k5q s PHE 64 N -1.67 3.44 -0.03 0.00 0.40 -0.74 -3.39 117.98 115.98 2k5q s PHE 64 Ca 0.69 0.08 0.03 0.00 -0.60 0.00 0.00 56.93 57.13 2k5q s PHE 64 Cb -0.26 -1.71 0.00 0.00 0.51 0.00 0.00 43.02 41.56 2k5q s PHE 64 CO 0.30 0.30 -0.10 -0.51 0.70 0.00 0.00 175.22 175.91 2k5q s LEU 65 N -4.10 1.79 -1.00 -0.37 1.43 0.65 -1.17 118.68 115.90 2k5q s LEU 65 Ca 0.37 -0.21 -0.23 0.00 -1.03 0.00 0.00 54.13 53.03 2k5q s LEU 65 Cb -0.09 -0.60 0.06 0.00 0.03 0.00 0.00 46.19 45.58 2k5q s LEU 65 CO 0.31 0.07 1.42 -0.13 0.23 0.00 0.00 176.35 178.25 2k5q s ARG 66 N 0.20 3.57 -0.12 1.70 0.52 0.09 -2.51 118.95 122.40 2k5q s ARG 66 Ca -0.04 -1.13 -0.24 0.00 -0.52 0.00 0.00 55.73 53.81 2k5q s ARG 66 Cb -0.09 -5.27 -0.03 0.00 0.52 0.00 0.00 34.95 30.08 2k5q s ARG 66 CO 0.01 -2.17 0.74 0.08 0.02 0.00 0.00 175.30 173.97 2k5q s VAL 67 N 4.84 4.98 -0.12 3.52 1.01 -0.14 -2.85 120.40 131.64 2k5q s VAL 67 Ca 0.44 1.47 -0.21 0.00 0.00 0.00 0.00 61.98 63.69 2k5q s VAL 67 Cb -0.01 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 2k5q s VAL 67 CO -0.09 0.15 0.59 -0.47 0.00 0.00 0.00 175.10 175.28 2k5q s TYR 68 N 1.47 3.49 -0.12 5.22 5.04 -0.36 -0.85 117.35 131.25 2k5q s TYR 68 Ca 0.36 1.01 -0.18 0.00 -2.44 0.00 0.00 57.07 55.83 2k5q s TYR 68 Cb -0.17 -2.70 -0.04 0.00 0.35 0.00 0.00 41.96 39.40 2k5q s TYR 68 CO 0.15 0.05 0.47 -1.58 -1.34 0.00 0.00 175.55 173.29 2k5q s HIS 69 N 1.04 3.51 0.19 4.97 5.65 0.39 -2.70 115.29 128.33 2k5q s HIS 69 Ca 0.30 0.87 -0.01 0.00 0.25 0.00 0.00 55.06 56.47 2k5q s HIS 69 Cb -0.16 -2.54 -0.04 0.00 -1.18 0.00 0.00 32.58 28.66 2k5q s HIS 69 CO 0.13 0.17 0.13 -1.54 -0.65 0.00 0.00 174.74 172.97 2k5q s SER 70 N 0.62 0.18 -0.01 9.88 1.04 -0.36 -4.30 113.70 120.74 2k5q s SER 70 Ca 0.25 -1.33 -0.02 0.00 0.48 0.00 0.00 55.95 55.34 2k5q s SER 70 Cb -0.15 0.37 -0.01 0.00 0.10 0.00 0.00 66.02 66.33 2k5q s SER 70 CO 0.10 -0.82 0.23 0.44 0.98 0.00 0.00 173.24 174.16 2k5q h ASP 71 N 2.66 -0.05 0.25 7.02 5.19 -1.98 -2.83 116.42 126.68 2k5q h ASP 71 Ca -0.35 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.06 2k5q h ASP 71 Cb 1.24 0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.76 2k5q h ASP 71 CO 0.54 0.04 -0.15 2.29 -3.12 0.00 0.00 179.24 178.84 2k5q n LYS 72 N -2.58 0.89 -0.02 3.56 2.85 -1.26 -3.64 118.16 117.97 2k5q n LYS 72 Ca -0.01 -0.43 0.00 0.00 -1.05 0.00 0.00 58.31 56.83 2k5q n LYS 72 Cb 0.02 -1.49 -0.06 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 -0.68 1.55 0.00 -1.58 5.02 -1.26 -5.03 118.16 116.19 2k5q n LYS 73 Ca 0.14 -0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 2k5q n LYS 73 Cb 0.31 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 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 2.33 1.47 3.02 0.72 0.00 -1.07 -4.72 105.19 106.94 2k5q n GLY 74 Ca -0.06 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 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 1.57 -0.12 1.61 1.01 -1.25 -1.22 120.40 122.00 2k5q s VAL 75 Ca 0.00 -0.64 0.17 0.00 0.00 0.00 0.00 61.98 61.51 2k5q s VAL 75 Cb 0.00 -1.48 -0.18 0.00 0.00 0.00 0.00 36.38 34.72 2k5q s VAL 75 CO 0.00 0.44 0.64 -0.24 0.00 0.00 0.00 175.10 175.95 2k5q n SER 76 N 4.77 0.62 -3.63 3.32 2.88 -1.10 -4.98 113.62 115.50 2k5q n SER 76 Ca -0.17 0.27 -0.03 0.00 -1.33 0.00 0.00 58.87 57.62 2k5q n SER 76 Cb 0.50 0.49 -0.01 0.00 -0.75 0.00 0.00 64.21 64.44 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 -2.89 -1.97 -0.17 -1.46 0.00 -1.26 -5.03 121.76 108.98 2k5q s ALA 77 Ca -0.05 0.76 -0.12 0.00 0.00 0.00 0.00 51.96 52.55 2k5q s ALA 77 Cb 0.09 0.36 0.05 0.00 0.00 0.00 0.00 23.12 23.62 2k5q s ALA 77 CO 0.83 -0.90 0.43 1.67 0.00 0.00 0.00 175.76 177.79 2k5q s TRP 78 N -2.79 -0.57 0.05 0.00 1.48 -1.26 -1.22 118.94 114.64 2k5q s TRP 78 Ca 0.11 1.27 0.09 0.00 -1.06 0.00 0.00 56.10 56.51 2k5q s TRP 78 Cb 0.01 0.24 -0.03 0.00 -1.16 0.00 0.00 33.47 32.53 2k5q s TRP 78 CO -0.03 -0.30 -0.25 -1.21 -4.06 0.00 0.00 176.95 171.10 2k5q s GLU 79 N 0.92 1.66 -0.02 3.25 2.02 -1.13 -4.90 118.70 120.51 2k5q s GLU 79 Ca -0.06 -1.09 -0.30 0.00 0.02 0.00 0.00 54.97 53.55 2k5q s GLU 79 Cb -0.06 -1.85 -0.04 0.00 0.10 0.00 0.00 34.13 32.29 2k5q s GLU 79 CO -0.08 0.47 1.15 -2.00 0.02 0.00 0.00 175.26 174.83 2k5q s GLU 80 N -1.29 4.41 0.02 1.61 2.12 -1.26 -0.73 118.70 123.58 2k5q s GLU 80 Ca 0.11 1.64 -0.02 0.00 0.36 0.00 0.00 54.97 57.06 2k5q s GLU 80 Cb -0.10 -3.48 -0.02 0.00 0.26 0.00 0.00 34.13 30.79 2k5q s GLU 80 CO 0.02 -0.33 0.01 0.14 -0.54 0.00 0.00 175.26 174.56 2k5q s VAL 81 N 1.71 0.12 0.31 3.70 -7.23 -0.32 -4.95 120.40 113.74 2k5q s VAL 81 Ca 0.55 -0.97 -0.17 0.00 -1.81 0.00 0.00 61.98 59.58 2k5q s VAL 81 Cb -0.25 -0.45 -0.09 0.00 0.56 0.00 0.00 36.38 36.15 2k5q s VAL 81 CO 0.24 -0.53 0.77 -0.54 -0.31 0.00 0.00 175.10 174.73 2k5q s LYS 82 N -1.76 4.11 0.00 4.82 1.02 -1.26 -1.79 119.74 124.88 2k5q s LYS 82 Ca -0.13 0.80 0.20 0.00 0.02 0.00 0.00 55.97 56.87 2k5q s LYS 82 Cb -0.07 -2.51 1.03 0.00 -0.52 0.00 0.00 37.83 35.76 2k5q s LYS 82 CO -0.02 0.19 1.69 0.36 -0.92 0.00 0.00 175.35 176.65 2k5q n LYS 83 N -0.12 1.24 -0.00 1.68 -0.00 -1.26 -3.02 118.16 116.68 2k5q n LYS 83 Ca 0.03 -0.35 0.06 0.00 -0.00 0.00 0.00 58.31 58.04 2k5q n LYS 83 Cb 0.53 -1.34 -0.08 0.00 -0.00 0.00 0.00 35.03 34.15 2k5q n LYS 83 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2k5q n ASP 84 N -0.44 0.69 0.00 -5.58 8.00 -1.26 -4.44 116.55 113.52 2k5q n ASP 84 Ca 0.15 -0.76 0.11 0.00 0.71 0.00 0.00 54.79 54.99 2k5q n ASP 84 Cb 0.15 1.03 -0.02 0.00 -0.02 0.00 0.00 41.12 42.26 2k5q n ASP 84 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 2k5q n GLU 85 N -1.34 0.03 -1.99 -1.24 0.28 -1.17 -4.97 120.64 110.24 2k5q n GLU 85 Ca 0.02 -0.01 -0.31 0.00 -0.16 0.00 0.00 57.16 56.70 2k5q n GLU 85 Cb 0.21 -1.51 0.00 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 -3.09 3.32 0.39 -1.84 1.43 -1.24 -5.01 118.68 112.64 2k5q s LEU 86 Ca 0.08 1.46 -0.24 0.00 -1.03 0.00 0.00 54.13 54.40 2k5q s LEU 86 Cb 0.16 -4.48 -0.12 0.00 0.03 0.00 0.00 46.19 41.78 2k5q s LEU 86 CO 0.83 -0.82 0.82 -2.65 0.23 0.00 0.00 176.35 174.75 2k5q n PRO 87 N -2.48 1.00 -0.07 1.29 -0.02 -1.26 -4.85 135.00 128.60 2k5q n PRO 87 Ca 0.06 0.36 0.24 0.00 -2.02 0.00 0.00 63.50 62.14 2k5q n PRO 87 Cb 0.54 -1.77 0.72 0.00 -0.02 0.00 0.00 33.50 32.97 2k5q n PRO 87 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2k5q h ALA 88 N 1.30 2.59 0.00 3.55 0.00 -1.97 -0.34 119.26 124.38 2k5q h ALA 88 Ca -0.41 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 2k5q h ALA 88 Cb 1.37 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 2k5q h ALA 88 CO 0.55 -0.88 -0.03 0.87 0.00 0.00 0.00 179.25 179.76 2k5q h LYS 89 N 0.00 0.00 0.22 0.00 6.56 -1.97 -0.62 116.57 120.75 2k5q h LYS 89 Ca 0.32 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.90 2k5q h LYS 89 Cb 1.37 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.03 2k5q h LYS 89 CO -0.00 0.03 -0.10 0.28 -2.06 0.00 0.00 179.45 177.60 2k5q h VAL 90 N 0.00 0.84 0.00 0.50 2.07 -1.39 -1.32 116.25 116.96 2k5q h VAL 90 Ca -0.00 -0.31 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 2k5q h VAL 90 Cb 0.16 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2k5q h VAL 90 CO 0.00 0.07 -0.18 0.11 0.02 0.00 0.00 177.57 177.60 2k5q h LYS 91 N -0.45 0.00 -0.08 1.57 1.57 -1.60 0.13 116.57 117.72 2k5q h LYS 91 Ca -0.03 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.59 2k5q h LYS 91 Cb 0.34 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 2k5q h LYS 91 CO 0.05 0.18 -0.65 1.49 -0.57 0.00 0.00 179.45 179.94 2k5q h GLU 92 N 0.00 0.31 0.00 3.15 4.81 -0.85 -3.41 114.58 118.59 2k5q h GLU 92 Ca -0.00 -0.23 -0.08 0.00 -0.13 0.00 0.00 59.36 58.92 2k5q h GLU 92 Cb 0.62 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 2k5q h GLU 92 CO 0.02 0.86 -0.93 1.63 -0.73 0.00 0.00 179.01 179.86 2k5q n LYS 93 N -3.85 0.27 -2.25 1.92 5.02 -0.52 -4.87 118.16 113.87 2k5q n LYS 93 Ca -0.03 0.11 -0.43 0.00 -2.02 0.00 0.00 58.31 55.94 2k5q n LYS 93 Cb 0.66 -0.97 -0.02 0.00 -0.02 0.00 0.00 35.03 34.67 2k5q n LYS 93 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2k5q s LEU 94 N -7.20 3.54 -0.44 -0.35 0.20 0.46 -3.75 118.68 111.13 2k5q s LEU 94 Ca -0.16 0.88 -0.00 0.00 0.69 0.00 0.00 54.13 55.54 2k5q s LEU 94 Cb 0.04 -3.46 -0.00 0.00 -0.43 0.00 0.00 46.19 42.33 2k5q s LEU 94 CO 0.22 -1.56 0.37 0.61 -0.29 0.00 0.00 176.35 175.71 2k5q n GLY 95 N 5.21 0.14 3.77 7.98 0.00 -1.26 -4.60 105.19 116.42 2k5q n GLY 95 Ca 0.18 -0.22 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.14 2.64 0.09 1.61 1.01 -1.25 -4.84 120.40 116.53 2k5q s VAL 96 Ca 0.02 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.63 2k5q s VAL 96 Cb -0.00 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 32.98 2k5q s VAL 96 CO 0.27 0.14 0.00 1.17 0.00 0.00 0.00 175.10 176.68 2k5q n LYS 97 N 1.09 0.00 -3.74 2.72 4.81 -1.26 -5.08 118.16 116.70 2k5q n LYS 97 Ca 0.01 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 57.08 2k5q n LYS 97 Cb 0.41 0.00 -0.12 0.00 0.02 0.00 0.00 35.03 35.35 2k5q n LYS 97 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2k5q s LEU 98 N -5.39 4.84 0.00 3.14 1.43 -1.26 -5.02 118.68 116.42 2k5q s LEU 98 Ca 0.00 -1.60 -0.01 0.00 -1.03 0.00 0.00 54.13 51.49 2k5q s LEU 98 Cb 0.00 -1.86 -0.00 0.00 0.03 0.00 0.00 46.19 44.35 2k5q s LEU 98 CO 0.00 -0.46 0.90 -0.08 0.23 0.00 0.00 176.35 176.94 2k5q h GLU 99 N 8.18 -0.03 -5.10 1.70 4.81 -2.02 -3.49 114.58 118.64 2k5q h GLU 99 Ca -0.19 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.04 2k5q h GLU 99 Cb 1.07 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.45 2k5q h GLU 99 CO 0.67 -0.02 -0.55 0.72 -0.73 0.00 0.00 179.01 179.11 2k5q n HIS 100 N -2.08 -3.35 -2.78 0.92 8.25 -1.26 -4.94 115.22 109.98 2k5q n HIS 100 Ca -0.00 1.37 -0.43 0.00 -0.26 0.00 0.00 57.72 58.40 2k5q n HIS 100 Cb 0.01 -3.91 -0.04 0.00 1.12 0.00 0.00 29.99 27.17 2k5q n HIS 100 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2k5q s HIS 101 N -2.33 2.75 -0.09 4.41 -3.43 -1.26 -5.00 115.29 110.33 2k5q s HIS 101 Ca 0.19 0.09 -0.08 0.00 -0.80 0.00 0.00 55.06 54.46 2k5q s HIS 101 Cb -0.05 -4.18 0.03 0.00 -1.43 0.00 0.00 32.58 26.94 2k5q s HIS 101 CO 0.72 -1.41 0.25 -1.58 -2.00 0.00 0.00 174.74 170.72 2k5q s HIS 102 N 4.19 -0.28 0.03 0.38 2.46 -1.26 -5.17 115.29 115.64 2k5q s HIS 102 Ca 0.33 0.68 0.03 0.00 0.47 0.00 0.00 55.06 56.57 2k5q s HIS 102 Cb -0.11 0.09 -0.02 0.00 -0.13 0.00 0.00 32.58 32.41 2k5q s HIS 102 CO 0.21 -0.14 -0.09 -1.01 -2.47 0.00 0.00 174.74 171.24 2k5q s HIS 103 N 0.19 0.79 0.00 3.88 3.76 -1.26 -5.02 115.29 117.63 2k5q s HIS 103 Ca -0.01 -0.36 0.00 0.00 -0.15 0.00 0.00 55.06 54.55 2k5q s HIS 103 Cb -0.02 -0.47 0.00 0.00 1.11 0.00 0.00 32.58 33.19 2k5q s HIS 103 CO -0.00 -0.03 0.00 1.58 -0.85 0.00 0.00 174.74 175.44 2k5q n HIS 104 N 1.94 0.00 -1.40 1.40 -0.00 -1.26 -5.36 115.22 110.54 2k5q n HIS 104 Ca -0.19 0.00 0.00 0.00 0.46 0.00 0.00 57.72 57.99 2k5q n HIS 104 Cb 0.55 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.42 2k5q n HIS 104 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38