#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 6.18 -0.20 6.12 1.01 -1.26 -4.81 116.67 123.71 2k5q s ASP 2 Ca 0.00 -0.55 0.14 0.00 0.71 0.00 0.00 52.55 52.85 2k5q s ASP 2 Cb 0.00 -2.56 0.46 0.00 1.01 0.00 0.00 42.92 41.83 2k5q s ASP 2 CO 0.00 -1.81 1.36 0.18 0.21 0.00 0.00 175.17 175.10 2k5q n LEU 3 N 9.38 3.51 -0.02 1.23 4.77 -1.26 -4.75 117.00 129.86 2k5q n LEU 3 Ca 0.07 -3.34 -0.16 0.00 -0.03 0.00 0.00 56.01 52.55 2k5q n LEU 3 Cb 0.49 -0.55 -0.10 0.00 -2.33 0.00 0.00 43.42 40.93 2k5q n LEU 3 CO 0.70 0.92 0.38 0.78 -1.33 0.00 0.00 177.39 178.85 2k5q h ASN 4 N 1.08 0.37 -3.19 -1.43 2.35 -2.11 -3.41 115.58 109.24 2k5q h ASN 4 Ca 0.07 -0.71 -0.59 0.00 -0.55 0.00 0.00 56.30 54.52 2k5q h ASN 4 Cb 1.37 -0.11 -0.40 0.00 0.05 0.00 0.00 38.32 39.23 2k5q h ASN 4 CO 0.20 1.03 -0.76 -0.13 -1.65 0.00 0.00 177.43 176.12 2k5q s ARG 5 N -3.39 0.82 0.30 0.81 0.52 -1.26 -5.13 118.95 111.63 2k5q s ARG 5 Ca -0.15 -1.30 -0.13 0.00 -0.52 0.00 0.00 55.73 53.64 2k5q s ARG 5 Cb 0.03 -2.00 -0.08 0.00 0.52 0.00 0.00 34.95 33.41 2k5q s ARG 5 CO 0.77 -1.05 0.68 -1.64 0.02 0.00 0.00 175.30 174.09 2k5q s MET 6 N 1.29 3.91 -1.35 3.54 -1.94 -1.26 -4.97 119.30 118.51 2k5q s MET 6 Ca 0.12 0.52 -0.10 0.00 -1.71 0.00 0.00 55.69 54.52 2k5q s MET 6 Cb -0.19 -2.49 -0.07 0.00 2.01 0.00 0.00 34.83 34.08 2k5q s MET 6 CO -0.17 0.18 2.58 0.41 -0.01 0.00 0.00 175.02 178.01 2k5q n GLY 7 N -0.42 3.84 3.45 -0.03 0.00 -1.26 -4.82 105.19 105.95 2k5q n GLY 7 Ca 0.02 -1.30 -0.44 0.00 0.00 0.00 0.00 46.02 44.30 2k5q n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k5q s LYS 8 N 2.79 3.79 0.70 1.61 1.02 -1.26 -4.75 119.74 123.63 2k5q s LYS 8 Ca 0.58 -2.13 -0.05 0.00 0.02 0.00 0.00 55.97 54.39 2k5q s LYS 8 Cb 0.15 -4.93 0.08 0.00 -0.52 0.00 0.00 37.83 32.61 2k5q s LYS 8 CO -0.05 -1.73 0.99 -0.51 -0.92 0.00 0.00 175.35 173.13 2k5q s ASP 9 N 3.20 4.70 -0.29 2.83 1.11 -1.25 -4.88 116.67 122.09 2k5q s ASP 9 Ca 0.35 0.21 0.03 0.00 0.18 0.00 0.00 52.55 53.32 2k5q s ASP 9 Cb -0.05 -0.81 0.17 0.00 1.07 0.00 0.00 42.92 43.30 2k5q s ASP 9 CO -0.06 -1.64 0.46 -1.83 1.18 0.00 0.00 175.17 173.29 2k5q s GLU 10 N -5.18 0.46 -0.04 8.23 -1.05 -1.26 -0.82 118.70 119.05 2k5q s GLU 10 Ca 0.62 0.25 -0.16 0.00 -0.15 0.00 0.00 54.97 55.53 2k5q s GLU 10 Cb -0.09 -0.14 -0.05 0.00 -0.44 0.00 0.00 34.13 33.41 2k5q s GLU 10 CO 0.44 -1.04 0.42 0.71 0.95 0.00 0.00 175.26 176.74 2k5q s TYR 11 N 2.63 3.66 -0.68 4.83 2.02 0.27 -4.80 117.35 125.28 2k5q s TYR 11 Ca 0.10 0.95 -0.21 0.00 -0.37 0.00 0.00 57.07 57.54 2k5q s TYR 11 Cb -0.12 -2.37 0.09 0.00 -0.40 0.00 0.00 41.96 39.16 2k5q s TYR 11 CO -0.29 0.50 0.93 0.71 -1.57 0.00 0.00 175.55 175.82 2k5q s TYR 12 N -0.55 2.80 -0.11 2.71 2.02 -1.26 -1.11 117.35 121.85 2k5q s TYR 12 Ca 0.24 -0.75 0.03 0.00 -0.37 0.00 0.00 57.07 56.21 2k5q s TYR 12 Cb -0.16 -4.23 -0.00 0.00 -0.40 0.00 0.00 41.96 37.17 2k5q s TYR 12 CO 0.12 -1.55 -0.21 0.14 -1.57 0.00 0.00 175.55 172.48 2k5q s VAL 13 N 3.58 2.26 0.41 0.71 -7.23 -0.73 -4.87 120.40 114.53 2k5q s VAL 13 Ca 0.21 -0.94 -0.19 0.00 -1.81 0.00 0.00 61.98 59.25 2k5q s VAL 13 Cb -0.17 -1.89 -0.10 0.00 0.56 0.00 0.00 36.38 34.78 2k5q s VAL 13 CO 0.07 0.55 0.91 0.00 -0.31 0.00 0.00 175.10 176.31 2k5q s GLN 14 N 0.44 4.16 -0.06 4.82 -2.07 -1.26 0.00 119.66 125.70 2k5q s GLN 14 Ca -0.15 1.01 -0.30 0.00 -1.82 0.00 0.00 55.36 54.11 2k5q s GLN 14 Cb -0.17 -2.23 -0.06 0.00 -1.09 0.00 0.00 33.01 29.46 2k5q s GLN 14 CO 0.06 -0.01 1.79 0.42 -1.32 0.00 0.00 175.29 176.24 2k5q s ILE 15 N -2.17 3.37 -0.05 3.63 -1.09 -0.07 -4.92 121.20 119.89 2k5q s ILE 15 Ca 0.60 0.45 -0.03 0.00 -2.23 0.00 0.00 60.65 59.44 2k5q s ILE 15 Cb -0.09 -3.31 -0.02 0.00 -1.58 0.00 0.00 42.46 37.46 2k5q s ILE 15 CO 0.15 -0.07 0.17 0.71 -1.23 0.00 0.00 174.94 174.67 2k5q h THR 16 N 5.78 0.00 -3.96 2.92 1.35 -1.92 -3.27 112.91 113.80 2k5q h THR 16 Ca -0.42 -0.58 -0.34 0.00 -0.55 0.00 0.00 66.41 64.53 2k5q h THR 16 Cb 1.20 0.00 -0.22 0.00 -1.73 0.00 0.00 68.15 67.40 2k5q h THR 16 CO 0.96 0.00 -0.75 0.68 -0.25 0.00 0.00 175.52 176.15 2k5q s VAL 17 N -1.79 0.76 0.41 6.82 -7.23 -1.26 -4.93 120.40 113.17 2k5q s VAL 17 Ca -0.02 -1.08 0.04 0.00 -1.81 0.00 0.00 61.98 59.11 2k5q s VAL 17 Cb 0.00 -0.77 -0.02 0.00 0.56 0.00 0.00 36.38 36.15 2k5q s VAL 17 CO 0.05 -0.26 0.15 1.51 -0.31 0.00 0.00 175.10 176.23 2k5q s ASP 18 N -1.49 2.77 0.00 4.85 -4.77 -1.26 -4.74 116.67 112.02 2k5q s ASP 18 Ca -0.06 -1.71 0.00 0.00 -3.30 0.00 0.00 52.55 47.48 2k5q s ASP 18 Cb -0.09 0.57 0.00 0.00 -1.09 0.00 0.00 42.92 42.30 2k5q s ASP 18 CO 0.01 -0.98 0.00 0.61 0.70 0.00 0.00 175.17 175.51 2k5q n GLY 19 N -0.91 0.49 3.72 2.12 0.00 -1.26 -4.99 105.19 104.36 2k5q n GLY 19 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.55 4.42 0.35 1.61 2.20 -1.26 -5.01 119.74 121.51 2k5q s LYS 20 Ca 0.00 0.84 0.07 0.00 -0.36 0.00 0.00 55.97 56.53 2k5q s LYS 20 Cb 0.00 -3.43 -0.01 0.00 -1.51 0.00 0.00 37.83 32.88 2k5q s LYS 20 CO 0.00 0.12 0.42 -1.83 -0.36 0.00 0.00 175.35 173.70 2k5q s GLU 21 N 0.60 2.91 -0.65 4.03 4.04 -1.26 -0.17 118.70 128.20 2k5q s GLU 21 Ca 0.36 -1.18 0.05 0.00 0.04 0.00 0.00 54.97 54.24 2k5q s GLU 21 Cb -0.18 -2.66 0.29 0.00 0.02 0.00 0.00 34.13 31.60 2k5q s GLU 21 CO 0.18 0.01 0.90 1.33 -1.84 0.00 0.00 175.26 175.83 2k5q n VAL 22 N -1.57 2.92 0.24 1.83 0.24 0.88 -4.75 118.33 118.11 2k5q n VAL 22 Ca 0.01 -5.43 0.07 0.00 -2.04 0.00 0.00 64.34 56.94 2k5q n VAL 22 Cb 0.59 -1.79 0.56 0.00 -1.47 0.00 0.00 33.84 31.73 2k5q n VAL 22 CO 0.00 0.00 0.00 -0.74 -2.14 0.00 0.00 176.83 173.95 2k5q h HIS 23 N 3.73 0.00 0.00 6.34 6.17 -1.85 -3.44 115.15 126.10 2k5q h HIS 23 Ca 0.18 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.26 2k5q h HIS 23 Cb 0.58 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.51 2k5q h HIS 23 CO 0.80 0.14 0.00 0.45 0.71 0.00 0.00 177.93 180.03 2k5q n SER 24 N -4.27 0.00 -0.81 3.26 2.88 -1.26 -0.38 113.62 113.04 2k5q n SER 24 Ca -0.03 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.50 2k5q n SER 24 Cb 0.21 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.65 2k5q n SER 24 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2k5q n LYS 25 N 0.00 0.00 -2.68 -1.46 2.85 -1.26 -5.05 118.16 110.56 2k5q n LYS 25 Ca 0.00 -0.80 -0.00 0.00 -1.05 0.00 0.00 58.31 56.46 2k5q n LYS 25 Cb 0.00 0.06 0.00 0.00 -0.65 0.00 0.00 35.03 34.44 2k5q n LYS 25 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2k5q n ALA 26 N 0.08 -2.25 -2.66 0.58 0.00 0.49 -5.00 120.51 111.75 2k5q n ALA 26 Ca -0.08 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.97 2k5q n ALA 26 Cb 0.70 -1.20 -0.06 0.00 0.00 0.00 0.00 19.45 18.89 2k5q n ALA 26 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k5q s ASP 27 N -2.77 6.70 0.00 0.00 1.01 -1.26 -4.51 116.67 115.85 2k5q s ASP 27 Ca 0.01 0.85 0.00 0.00 0.71 0.00 0.00 52.55 54.12 2k5q s ASP 27 Cb -0.00 -2.35 0.00 0.00 1.01 0.00 0.00 42.92 41.58 2k5q s ASP 27 CO 0.57 -0.27 0.00 0.59 0.21 0.00 0.00 175.17 176.26 2k5q n ASN 28 N 5.02 0.00 -2.79 0.27 3.02 -1.26 -4.42 115.26 115.10 2k5q n ASN 28 Ca -0.01 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.44 2k5q n ASN 28 Cb 0.50 0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.73 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 0.00 0.74 2.40 7.41 0.00 -1.26 -5.15 105.19 109.33 2k5q n GLY 29 Ca 0.00 -0.14 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 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 0.83 0.00 -0.86 1.61 10.64 -1.26 -2.91 117.38 125.43 2k5q n GLN 30 Ca 0.09 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.26 2k5q n GLN 30 Cb 0.67 -0.77 0.00 0.00 -0.86 0.00 0.00 30.24 29.28 2k5q n GLN 30 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 2k5q n LYS 31 N 1.56 -0.27 -1.38 2.61 5.02 -1.26 -5.01 118.16 119.42 2k5q n LYS 31 Ca 0.02 0.07 -0.32 0.00 -2.02 0.00 0.00 58.31 56.06 2k5q n LYS 31 Cb 0.40 -3.49 0.08 0.00 -0.02 0.00 0.00 35.03 32.00 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 -2.37 2.58 -0.24 2.13 1.13 -1.14 -5.06 117.35 114.37 2k5q s TYR 32 Ca 0.00 1.56 -0.01 0.00 -1.41 0.00 0.00 57.07 57.20 2k5q s TYR 32 Cb 0.00 -3.08 0.07 0.00 -1.10 0.00 0.00 41.96 37.85 2k5q s TYR 32 CO 0.00 -1.78 0.03 0.15 -2.51 0.00 0.00 175.55 171.44 2k5q s LYS 33 N -4.69 0.88 -0.06 -3.49 -0.14 -1.26 -4.69 119.74 106.29 2k5q s LYS 33 Ca 0.63 -0.73 0.04 0.00 -1.36 0.00 0.00 55.97 54.55 2k5q s LYS 33 Cb -0.18 -2.18 -0.02 0.00 -1.68 0.00 0.00 37.83 33.77 2k5q s LYS 33 CO 0.52 -0.73 -0.17 -0.51 -0.76 0.00 0.00 175.35 173.70 2k5q s ASP 34 N 1.69 3.74 0.21 2.83 1.11 -1.26 -4.98 116.67 120.01 2k5q s ASP 34 Ca 0.01 -0.30 -0.15 0.00 0.18 0.00 0.00 52.55 52.29 2k5q s ASP 34 Cb -0.18 -0.86 -0.08 0.00 1.07 0.00 0.00 42.92 42.88 2k5q s ASP 34 CO -0.12 0.31 0.63 -0.31 1.18 0.00 0.00 175.17 176.85 2k5q s TYR 35 N -0.50 3.54 -0.24 4.23 2.02 -0.26 -0.08 117.35 126.06 2k5q s TYR 35 Ca 0.06 1.15 -0.04 0.00 -0.37 0.00 0.00 57.07 57.87 2k5q s TYR 35 Cb -0.12 -2.45 0.00 0.00 -0.40 0.00 0.00 41.96 39.00 2k5q s TYR 35 CO 0.01 0.31 -0.02 -2.00 -1.57 0.00 0.00 175.55 172.28 2k5q s GLU 36 N -2.31 3.19 -0.44 -0.62 2.12 0.76 -0.49 118.70 120.92 2k5q s GLU 36 Ca 0.44 -0.75 -0.07 0.00 0.36 0.00 0.00 54.97 54.95 2k5q s GLU 36 Cb -0.14 -3.07 0.11 0.00 0.26 0.00 0.00 34.13 31.29 2k5q s GLU 36 CO 0.20 -0.29 0.28 0.71 -0.54 0.00 0.00 175.26 175.61 2k5q s TYR 37 N 1.45 3.46 -0.21 5.30 2.02 -0.09 -4.65 117.35 124.63 2k5q s TYR 37 Ca 0.04 -1.99 -0.07 0.00 -0.37 0.00 0.00 57.07 54.67 2k5q s TYR 37 Cb -0.15 -3.28 -0.04 0.00 -0.40 0.00 0.00 41.96 38.09 2k5q s TYR 37 CO -0.03 -0.96 0.06 0.21 -1.57 0.00 0.00 175.55 173.27 2k5q s LYS 38 N 1.30 3.82 0.17 -0.62 2.20 -1.26 -1.80 119.74 123.56 2k5q s LYS 38 Ca 0.06 -0.41 -0.22 0.00 -0.36 0.00 0.00 55.97 55.04 2k5q s LYS 38 Cb -0.24 -3.25 0.06 0.00 -1.51 0.00 0.00 37.83 32.88 2k5q s LYS 38 CO -0.01 0.07 0.59 -0.48 -0.36 0.00 0.00 175.35 175.16 2k5q s LEU 39 N 0.91 -0.40 -0.28 5.43 0.05 -0.59 -4.70 118.68 119.10 2k5q s LEU 39 Ca 0.04 -0.14 -0.13 0.00 0.05 0.00 0.00 54.13 53.95 2k5q s LEU 39 Cb -0.14 2.51 -0.04 0.00 -2.05 0.00 0.00 46.19 46.47 2k5q s LEU 39 CO 0.03 -1.01 0.27 -0.89 -0.55 0.00 0.00 176.35 174.20 2k5q s THR 40 N -3.78 5.25 -0.29 5.48 2.01 -1.26 -1.04 115.64 122.01 2k5q s THR 40 Ca 0.03 0.29 -0.29 0.00 0.31 0.00 0.00 61.69 62.03 2k5q s THR 40 Cb -0.01 -3.62 0.01 0.00 0.01 0.00 0.00 72.50 68.89 2k5q s THR 40 CO -0.10 0.18 1.12 -0.83 -0.69 0.00 0.00 174.62 174.31 2k5q s GLY 41 N 1.71 1.56 -0.10 4.40 0.00 0.12 -4.84 107.32 110.17 2k5q s GLY 41 Ca 0.10 0.06 -0.06 0.00 0.00 0.00 0.00 44.72 44.82 2k5q s GLY 41 CO 0.11 2.33 0.15 -1.36 0.00 0.00 0.00 173.10 174.33 2k5q s PHE 42 N 3.68 3.59 0.48 1.90 0.08 -1.26 -0.59 117.98 125.86 2k5q s PHE 42 Ca 0.48 0.51 -0.01 0.00 0.12 0.00 0.00 56.93 58.03 2k5q s PHE 42 Cb -0.14 -1.93 0.00 0.00 -0.57 0.00 0.00 43.02 40.38 2k5q s PHE 42 CO 0.15 0.72 0.72 0.34 -0.10 0.00 0.00 175.22 177.05 2k5q s ASP 43 N -1.20 5.76 0.52 1.36 2.15 0.47 -4.83 116.67 120.90 2k5q s ASP 43 Ca 0.17 0.36 0.26 0.00 0.43 0.00 0.00 52.55 53.77 2k5q s ASP 43 Cb -0.12 -1.53 1.39 0.00 -0.30 0.00 0.00 42.92 42.35 2k5q s ASP 43 CO 0.07 -0.79 1.95 0.11 -0.17 0.00 0.00 175.17 176.34 2k5q h LYS 44 N 0.27 0.05 -0.49 4.34 1.57 -1.97 0.28 116.57 120.61 2k5q h LYS 44 Ca -0.46 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2k5q h LYS 44 Cb 1.26 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.55 2k5q h LYS 44 CO 0.58 0.03 0.00 -0.25 -0.57 0.00 0.00 179.45 179.24 2k5q n ASP 45 N -4.36 2.95 0.00 0.86 8.00 -1.26 -4.70 116.55 118.03 2k5q n ASP 45 Ca 0.13 -1.97 0.00 0.00 0.71 0.00 0.00 54.79 53.66 2k5q n ASP 45 Cb 0.71 -0.33 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 1.39 0.68 3.73 0.44 0.00 0.09 -4.91 105.19 106.61 2k5q n GLY 46 Ca 0.19 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.92 4.64 -0.04 1.61 -0.14 -1.25 -4.80 119.74 118.84 2k5q s LYS 47 Ca 0.00 1.36 -0.09 0.00 -1.36 0.00 0.00 55.97 55.88 2k5q s LYS 47 Cb 0.00 -3.38 -0.05 0.00 -1.68 0.00 0.00 37.83 32.72 2k5q s LYS 47 CO 0.00 0.20 0.26 -1.83 -0.76 0.00 0.00 175.35 173.22 2k5q s GLU 48 N 0.09 3.61 -0.33 1.68 -1.05 -1.26 -0.39 118.70 121.05 2k5q s GLU 48 Ca 0.45 0.02 0.02 0.00 -0.15 0.00 0.00 54.97 55.31 2k5q s GLU 48 Cb -0.22 -3.15 0.15 0.00 -0.44 0.00 0.00 34.13 30.47 2k5q s GLU 48 CO 0.28 0.70 0.36 0.21 0.95 0.00 0.00 175.26 177.76 2k5q s LYS 49 N -1.36 0.49 0.15 -4.83 2.20 0.24 -4.99 119.74 111.64 2k5q s LYS 49 Ca 0.22 -0.39 -0.30 0.00 -0.36 0.00 0.00 55.97 55.14 2k5q s LYS 49 Cb -0.14 -0.59 -0.07 0.00 -1.51 0.00 0.00 37.83 35.53 2k5q s LYS 49 CO 0.11 -1.11 1.03 -2.00 -0.36 0.00 0.00 175.35 173.03 2k5q s GLU 50 N 1.99 4.65 0.16 4.03 2.12 -1.26 0.10 118.70 130.49 2k5q s GLU 50 Ca 0.13 1.58 -0.07 0.00 0.36 0.00 0.00 54.97 56.97 2k5q s GLU 50 Cb -0.14 -3.33 -0.02 0.00 0.26 0.00 0.00 34.13 30.91 2k5q s GLU 50 CO -0.19 0.15 0.23 -0.48 -0.54 0.00 0.00 175.26 174.42 2k5q s LEU 51 N -0.19 1.16 -0.04 2.70 2.34 -0.21 -4.90 118.68 119.54 2k5q s LEU 51 Ca 0.48 -0.96 -0.06 0.00 0.06 0.00 0.00 54.13 53.65 2k5q s LEU 51 Cb -0.26 0.97 0.01 0.00 -0.56 0.00 0.00 46.19 46.34 2k5q s LEU 51 CO 0.32 -0.85 0.15 -1.83 -1.06 0.00 0.00 176.35 173.07 2k5q s GLU 52 N -3.99 0.26 -0.00 1.48 4.04 -1.26 -1.54 118.70 117.69 2k5q s GLU 52 Ca 0.19 0.04 -0.09 0.00 0.04 0.00 0.00 54.97 55.15 2k5q s GLU 52 Cb 0.04 0.12 0.01 0.00 0.02 0.00 0.00 34.13 34.32 2k5q s GLU 52 CO 0.01 -0.05 0.17 -0.59 -1.84 0.00 0.00 175.26 172.96 2k5q s PHE 53 N -0.33 -0.01 0.07 4.83 -0.71 -0.74 -4.90 117.98 116.19 2k5q s PHE 53 Ca -0.04 -0.05 -0.07 0.00 -1.04 0.00 0.00 56.93 55.74 2k5q s PHE 53 Cb -0.03 -0.02 -0.05 0.00 -1.21 0.00 0.00 43.02 41.71 2k5q s PHE 53 CO 0.01 -0.30 0.33 0.95 -1.34 0.00 0.00 175.22 174.86 2k5q s THR 54 N -1.35 5.21 0.15 -4.49 -4.23 -1.26 -0.91 115.64 108.76 2k5q s THR 54 Ca -0.14 0.19 0.04 0.00 -1.18 0.00 0.00 61.69 60.60 2k5q s THR 54 Cb -0.07 -3.61 -0.04 0.00 1.34 0.00 0.00 72.50 70.12 2k5q s THR 54 CO 0.02 0.25 -0.09 0.00 -0.54 0.00 0.00 174.62 174.26 2k5q s ALA 55 N -1.43 1.46 -1.35 3.99 0.00 0.36 -4.95 121.76 119.83 2k5q s ALA 55 Ca 0.33 -1.51 0.27 0.00 0.00 0.00 0.00 51.96 51.05 2k5q s ALA 55 Cb -0.13 0.09 0.80 0.00 0.00 0.00 0.00 23.12 23.88 2k5q s ALA 55 CO 0.20 -0.12 1.60 1.04 0.00 0.00 0.00 175.76 178.48 2k5q n GLN 56 N -0.21 0.39 -3.84 0.00 6.02 -1.26 -1.11 117.38 117.37 2k5q n GLN 56 Ca -0.10 -0.19 -0.12 0.00 -0.01 0.00 0.00 57.00 56.58 2k5q n GLN 56 Cb 0.61 -1.50 -0.10 0.00 1.02 0.00 0.00 30.24 30.28 2k5q n GLN 56 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 2k5q s LYS 57 N -2.75 0.51 -0.84 -1.09 2.47 -1.26 -4.88 119.74 111.90 2k5q s LYS 57 Ca 0.19 -0.30 -0.23 0.00 -1.56 0.00 0.00 55.97 54.07 2k5q s LYS 57 Cb 0.19 0.22 0.07 0.00 -1.46 0.00 0.00 37.83 36.85 2k5q s LYS 57 CO 0.58 -0.12 1.20 -0.80 0.16 0.00 0.00 175.35 176.37 2k5q s ASN 58 N -1.26 6.38 1.00 1.43 0.01 -1.26 -4.94 114.94 116.30 2k5q s ASN 58 Ca -0.13 -1.28 -0.02 0.00 -0.71 0.00 0.00 52.86 50.72 2k5q s ASN 58 Cb -0.07 -2.48 0.02 0.00 0.41 0.00 0.00 41.25 39.14 2k5q s ASN 58 CO 0.02 -1.44 0.13 0.00 -1.51 0.00 0.00 177.10 174.30 2k5q n LEU 59 N 8.04 0.00 -4.60 0.60 -0.00 -1.26 -4.92 117.00 114.87 2k5q n LEU 59 Ca 0.14 -0.14 -0.43 0.00 -0.00 0.00 0.00 56.01 55.58 2k5q n LEU 59 Cb 0.49 -0.10 -0.03 0.00 -0.00 0.00 0.00 43.42 43.78 2k5q n LEU 59 CO 0.62 -0.63 1.68 -0.13 -0.00 0.00 0.00 177.39 178.93 2k5q s ARG 60 N -3.29 3.27 0.62 1.47 3.00 -1.26 -4.96 118.95 117.80 2k5q s ARG 60 Ca 0.08 1.73 -0.19 0.00 0.00 0.00 0.00 55.73 57.35 2k5q s ARG 60 Cb -0.00 -4.27 -0.02 0.00 0.00 0.00 0.00 34.95 30.65 2k5q s ARG 60 CO 0.05 -1.94 1.27 -1.59 0.00 0.00 0.00 175.30 173.10 2k5q s LYS 61 N 5.93 2.74 0.00 3.54 -2.85 -1.26 -2.50 119.74 125.34 2k5q s LYS 61 Ca 0.89 2.01 0.00 0.00 -1.00 0.00 0.00 55.97 57.87 2k5q s LYS 61 Cb -0.28 -1.91 0.00 0.00 -2.06 0.00 0.00 37.83 33.58 2k5q s LYS 61 CO 0.34 -1.43 0.00 -1.91 0.10 0.00 0.00 175.35 172.45 2k5q n GLU 62 N -1.71 0.00 -1.16 1.78 2.13 -1.24 -4.94 120.64 115.50 2k5q n GLU 62 Ca 0.15 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 57.68 2k5q n GLU 62 Cb 0.48 -2.21 0.17 0.00 0.27 0.00 0.00 31.44 30.15 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 -0.67 1.05 -0.02 4.31 0.00 -1.04 -4.21 121.76 121.19 2k5q s ALA 63 Ca 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 51.96 51.65 2k5q s ALA 63 Cb 0.00 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 19.94 2k5q s ALA 63 CO 0.00 -2.75 0.13 -0.06 0.00 0.00 0.00 175.76 173.07 2k5q s PHE 64 N -2.95 3.42 -0.18 0.00 0.40 -0.70 -0.90 117.98 117.07 2k5q s PHE 64 Ca 0.65 0.30 -0.01 0.00 -0.60 0.00 0.00 56.93 57.27 2k5q s PHE 64 Cb -0.19 -1.79 0.00 0.00 0.51 0.00 0.00 43.02 41.55 2k5q s PHE 64 CO 0.58 0.61 -0.14 -0.51 0.70 0.00 0.00 175.22 176.45 2k5q s LEU 65 N -1.74 2.48 -1.17 -0.37 1.43 0.10 -0.71 118.68 118.70 2k5q s LEU 65 Ca 0.24 -0.50 -0.20 0.00 -1.03 0.00 0.00 54.13 52.64 2k5q s LEU 65 Cb -0.12 -1.58 0.07 0.00 0.03 0.00 0.00 46.19 44.58 2k5q s LEU 65 CO 0.15 0.03 1.58 -0.60 0.23 0.00 0.00 176.35 177.74 2k5q s ARG 66 N 1.12 3.82 -0.20 1.70 3.52 0.13 -1.77 118.95 127.26 2k5q s ARG 66 Ca 0.00 -1.67 -0.17 0.00 -0.13 0.00 0.00 55.73 53.76 2k5q s ARG 66 Cb -0.14 -5.42 -0.03 0.00 -1.56 0.00 0.00 34.95 27.79 2k5q s ARG 66 CO -0.05 -2.19 0.47 0.08 -0.81 0.00 0.00 175.30 172.81 2k5q s VAL 67 N 4.33 5.14 0.21 7.11 1.01 -0.27 -1.56 120.40 136.38 2k5q s VAL 67 Ca 0.49 0.86 -0.30 0.00 0.00 0.00 0.00 61.98 63.04 2k5q s VAL 67 Cb 0.02 -3.80 -0.08 0.00 0.00 0.00 0.00 36.38 32.51 2k5q s VAL 67 CO -0.00 0.20 0.93 -0.47 0.00 0.00 0.00 175.10 175.76 2k5q s TYR 68 N 1.52 3.95 -0.21 5.22 5.04 -0.32 -0.56 117.35 131.99 2k5q s TYR 68 Ca 0.22 1.88 -0.11 0.00 -2.44 0.00 0.00 57.07 56.62 2k5q s TYR 68 Cb -0.15 -2.98 -0.05 0.00 0.35 0.00 0.00 41.96 39.13 2k5q s TYR 68 CO 0.09 0.42 0.17 -1.58 -1.34 0.00 0.00 175.55 173.31 2k5q s HIS 69 N -0.97 3.39 -0.02 4.97 5.65 0.00 -4.16 115.29 124.16 2k5q s HIS 69 Ca 0.42 0.35 0.01 0.00 0.25 0.00 0.00 55.06 56.09 2k5q s HIS 69 Cb -0.25 -2.23 0.01 0.00 -1.18 0.00 0.00 32.58 28.92 2k5q s HIS 69 CO 0.31 0.21 -0.03 -1.12 -0.65 0.00 0.00 174.74 173.46 2k5q s SER 70 N 0.59 0.58 0.06 9.88 0.01 -0.32 -3.96 113.70 120.55 2k5q s SER 70 Ca 0.10 -0.08 0.07 0.00 1.31 0.00 0.00 55.95 57.35 2k5q s SER 70 Cb -0.12 -0.17 -0.23 0.00 0.21 0.00 0.00 66.02 65.71 2k5q s SER 70 CO 0.01 -0.00 1.04 0.44 0.41 0.00 0.00 173.24 175.14 2k5q h ASP 71 N 6.54 0.07 -0.02 2.44 5.19 -1.90 -1.35 116.42 127.40 2k5q h ASP 71 Ca -0.33 -0.09 -0.12 0.00 -0.62 0.00 0.00 57.03 55.87 2k5q h ASP 71 Cb 1.17 -0.02 0.01 0.00 0.18 0.00 0.00 39.33 40.67 2k5q h ASP 71 CO 0.49 1.07 -0.46 0.11 -3.12 0.00 0.00 179.24 177.34 2k5q h LYS 72 N 0.01 0.34 -0.14 3.56 1.57 -2.01 -3.36 116.57 116.54 2k5q h LYS 72 Ca -0.12 -0.34 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2k5q h LYS 72 Cb 1.88 0.09 0.00 0.00 0.08 0.00 0.00 32.23 34.28 2k5q h LYS 72 CO 0.12 1.02 0.00 1.17 -0.57 0.00 0.00 179.45 181.19 2k5q n LYS 73 N -4.33 1.91 0.00 3.15 0.00 -1.26 -5.05 118.16 112.58 2k5q n LYS 73 Ca -0.10 -1.51 0.00 0.00 0.00 0.00 0.00 58.31 56.71 2k5q n LYS 73 Cb 0.60 -1.14 0.00 0.00 0.00 0.00 0.00 35.03 34.48 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 0.18 1.45 2.92 3.14 0.00 -0.51 -4.52 105.19 107.84 2k5q n GLY 74 Ca 0.06 0.34 -0.30 0.00 0.00 0.00 0.00 46.02 46.11 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 1.44 -0.34 1.61 1.01 -1.26 -1.17 120.40 121.69 2k5q s VAL 75 Ca 0.00 -1.21 0.23 0.00 0.00 0.00 0.00 61.98 61.00 2k5q s VAL 75 Cb 0.00 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 2k5q s VAL 75 CO 0.00 -0.15 1.06 -1.20 0.00 0.00 0.00 175.10 174.81 2k5q n SER 76 N 4.70 0.75 -3.61 3.32 7.64 -1.26 -4.98 113.62 120.17 2k5q n SER 76 Ca -0.11 0.21 -0.06 0.00 1.01 0.00 0.00 58.87 59.92 2k5q n SER 76 Cb 0.44 0.52 -0.05 0.00 -1.01 0.00 0.00 64.21 64.11 2k5q n SER 76 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k5q s ALA 77 N -3.32 -2.04 -0.03 -0.43 0.00 -1.26 -5.07 121.76 109.61 2k5q s ALA 77 Ca 0.01 1.74 -0.04 0.00 0.00 0.00 0.00 51.96 53.67 2k5q s ALA 77 Cb 0.11 -1.19 0.01 0.00 0.00 0.00 0.00 23.12 22.04 2k5q s ALA 77 CO 0.79 -0.26 0.11 1.67 0.00 0.00 0.00 175.76 178.07 2k5q s TRP 78 N -0.86 -0.06 -0.02 0.00 1.48 -1.26 -1.17 118.94 117.04 2k5q s TRP 78 Ca 0.04 0.16 0.05 0.00 -1.06 0.00 0.00 56.10 55.28 2k5q s TRP 78 Cb -0.01 0.01 -0.03 0.00 -1.16 0.00 0.00 33.47 32.28 2k5q s TRP 78 CO -0.04 -0.11 -0.16 -1.21 -4.06 0.00 0.00 176.95 171.37 2k5q s GLU 79 N -0.32 2.36 -0.25 3.25 0.41 -0.60 -4.93 118.70 118.62 2k5q s GLU 79 Ca -0.04 -0.79 -0.25 0.00 -0.41 0.00 0.00 54.97 53.48 2k5q s GLU 79 Cb -0.03 -2.30 -0.00 0.00 -1.78 0.00 0.00 34.13 30.02 2k5q s GLU 79 CO 0.00 0.60 0.85 -2.00 -0.49 0.00 0.00 175.26 174.22 2k5q s GLU 80 N -0.93 4.16 -0.06 1.61 2.12 -1.26 0.19 118.70 124.54 2k5q s GLU 80 Ca 0.12 0.95 0.02 0.00 0.36 0.00 0.00 54.97 56.43 2k5q s GLU 80 Cb -0.11 -3.66 0.01 0.00 0.26 0.00 0.00 34.13 30.64 2k5q s GLU 80 CO 0.02 -0.56 -0.10 0.14 -0.54 0.00 0.00 175.26 174.22 2k5q s VAL 81 N 2.92 0.94 0.59 3.70 -7.23 0.11 -4.95 120.40 116.48 2k5q s VAL 81 Ca 0.36 -0.37 -0.08 0.00 -1.81 0.00 0.00 61.98 60.07 2k5q s VAL 81 Cb -0.15 -0.88 -0.02 0.00 0.56 0.00 0.00 36.38 35.89 2k5q s VAL 81 CO 0.08 0.31 0.95 -0.54 -0.31 0.00 0.00 175.10 175.59 2k5q s LYS 82 N 0.68 3.32 0.18 4.82 1.02 -1.26 -1.73 119.74 126.78 2k5q s LYS 82 Ca -0.13 0.40 -0.13 0.00 0.02 0.00 0.00 55.97 56.13 2k5q s LYS 82 Cb -0.15 -2.19 0.18 0.00 -0.52 0.00 0.00 37.83 35.15 2k5q s LYS 82 CO 0.03 -0.57 1.73 -0.22 -0.92 0.00 0.00 175.35 175.39 2k5q h LYS 83 N -0.20 0.26 0.00 1.68 3.11 -1.94 -0.51 116.57 118.98 2k5q h LYS 83 Ca -0.45 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.37 2k5q h LYS 83 Cb 1.22 -0.06 0.00 0.00 -1.00 0.00 0.00 32.23 32.39 2k5q h LYS 83 CO 0.62 0.17 0.00 -0.25 -2.81 0.00 0.00 179.45 177.18 2k5q n ASP 84 N -5.07 0.39 0.11 4.20 8.00 -1.26 -2.13 116.55 120.78 2k5q n ASP 84 Ca 0.05 0.57 -0.03 0.00 0.71 0.00 0.00 54.79 56.09 2k5q n ASP 84 Cb 0.22 -0.66 0.05 0.00 -0.02 0.00 0.00 41.12 40.72 2k5q n ASP 84 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2k5q h GLU 85 N 0.00 0.00 -6.17 -1.24 5.08 -1.46 -3.45 114.58 107.34 2k5q h GLU 85 Ca 0.00 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.78 2k5q h GLU 85 Cb 0.43 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.64 2k5q h GLU 85 CO 0.00 0.75 -0.19 -0.51 -1.00 0.00 0.00 179.01 178.06 2k5q s LEU 86 N -7.11 4.36 0.37 1.33 1.43 -0.91 -5.00 118.68 113.15 2k5q s LEU 86 Ca 0.00 0.91 -0.28 0.00 -1.03 0.00 0.00 54.13 53.73 2k5q s LEU 86 Cb 0.11 -3.03 -0.10 0.00 0.03 0.00 0.00 46.19 43.20 2k5q s LEU 86 CO 0.78 0.17 1.37 -2.84 0.23 0.00 0.00 176.35 176.05 2k5q s PRO 87 N -1.83 4.15 0.59 1.29 0.02 -1.26 -4.90 135.00 133.05 2k5q s PRO 87 Ca 0.34 2.32 0.29 0.00 0.02 0.00 0.00 61.00 63.97 2k5q s PRO 87 Cb -0.15 -2.94 1.69 0.00 0.02 0.00 0.00 34.50 33.13 2k5q s PRO 87 CO 0.18 -0.40 2.12 0.00 -0.33 0.00 0.00 177.00 178.56 2k5q h ALA 88 N 3.03 1.75 0.00 -1.55 0.00 -1.96 -0.59 119.26 119.94 2k5q h ALA 88 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2k5q h ALA 88 Cb 1.24 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2k5q h ALA 88 CO 0.64 -0.26 0.06 0.87 0.00 0.00 0.00 179.25 180.56 2k5q h LYS 89 N 0.00 0.00 0.04 0.00 1.57 -2.00 -2.27 116.57 113.91 2k5q h LYS 89 Ca 0.08 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.55 2k5q h LYS 89 Cb 0.44 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 2k5q h LYS 89 CO -0.00 0.00 -1.70 0.28 -0.57 0.00 0.00 179.45 177.45 2k5q n VAL 90 N -2.26 1.62 0.07 0.50 0.31 -0.23 -4.28 118.33 114.05 2k5q n VAL 90 Ca -0.01 -0.30 -0.11 0.00 -0.01 0.00 0.00 64.34 63.90 2k5q n VAL 90 Cb 0.10 -1.89 -0.08 0.00 -0.91 0.00 0.00 33.84 31.05 2k5q n VAL 90 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2k5q h LYS 91 N -0.59 -0.23 0.00 5.55 3.64 -1.52 -0.74 116.57 122.67 2k5q h LYS 91 Ca -0.42 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 2k5q h LYS 91 Cb 1.61 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.48 2k5q h LYS 91 CO -0.13 0.19 0.00 0.93 -2.27 0.00 0.00 179.45 178.17 2k5q h GLU 92 N -0.82 0.00 0.00 1.90 3.07 -1.72 -3.08 114.58 113.92 2k5q h GLU 92 Ca -0.02 0.00 -0.06 0.00 -0.50 0.00 0.00 59.36 58.78 2k5q h GLU 92 Cb 0.52 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.42 2k5q h GLU 92 CO 0.04 0.00 -0.50 0.87 -1.40 0.00 0.00 179.01 178.02 2k5q h LYS 93 N 0.00 0.00 0.00 2.33 6.56 -1.74 -3.48 116.57 120.25 2k5q h LYS 93 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2k5q h LYS 93 Cb 0.26 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.92 2k5q h LYS 93 CO 0.00 0.42 0.00 -0.11 -2.06 0.00 0.00 179.45 177.70 2k5q n LEU 94 N -4.61 0.00 0.00 2.94 0.00 -0.29 -3.03 117.00 112.02 2k5q n LEU 94 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.89 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 -0.99 0.28 3.83 -3.96 0.00 -1.26 -4.92 105.19 98.17 2k5q n GLY 95 Ca 0.00 -0.29 -0.30 0.00 0.00 0.00 0.00 46.02 45.43 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 0.00 3.31 -0.17 1.61 -7.23 -1.17 -4.55 120.40 112.19 2k5q s VAL 96 Ca 0.00 0.43 0.14 0.00 -1.81 0.00 0.00 61.98 60.74 2k5q s VAL 96 Cb 0.00 -3.24 0.43 0.00 0.56 0.00 0.00 36.38 34.13 2k5q s VAL 96 CO 0.00 -0.56 1.20 1.17 -0.31 0.00 0.00 175.10 176.61 2k5q n LYS 97 N -3.28 1.44 -3.88 4.82 4.81 -1.26 -4.72 118.16 116.10 2k5q n LYS 97 Ca 0.07 -3.11 -0.11 0.00 -0.87 0.00 0.00 58.31 54.29 2k5q n LYS 97 Cb 0.56 -1.33 -0.11 0.00 0.02 0.00 0.00 35.03 34.17 2k5q n LYS 97 CO 0.00 0.00 0.00 -0.48 1.17 0.00 0.00 177.40 178.09 2k5q s LEU 98 N -2.60 1.69 0.00 3.14 -0.00 -1.26 -5.11 118.68 114.54 2k5q s LEU 98 Ca 0.38 -0.10 0.00 0.00 -0.00 0.00 0.00 54.13 54.41 2k5q s LEU 98 Cb 0.38 0.46 0.00 0.00 -0.00 0.00 0.00 46.19 47.03 2k5q s LEU 98 CO -0.08 -0.24 0.00 -0.62 -0.00 0.00 0.00 176.35 175.41 2k5q n GLU 99 N 2.05 0.00 -2.80 1.48 1.02 -1.26 -4.91 120.64 116.23 2k5q n GLU 99 Ca -0.19 0.05 -0.13 0.00 -0.02 0.00 0.00 57.16 56.87 2k5q n GLU 99 Cb 0.57 -0.38 0.01 0.00 -0.02 0.00 0.00 31.44 31.62 2k5q n GLU 99 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 2k5q n HIS 100 N -1.97 1.06 -2.14 -0.32 -0.00 -1.26 -5.04 115.22 105.53 2k5q n HIS 100 Ca 0.00 -3.10 -0.38 0.00 -0.00 0.00 0.00 57.72 54.23 2k5q n HIS 100 Cb 0.00 -0.38 -0.03 0.00 -0.00 0.00 0.00 29.99 29.59 2k5q n HIS 100 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2k5q n HIS 101 N 0.01 3.60 -3.73 1.57 -0.00 -1.26 -4.84 115.22 110.57 2k5q n HIS 101 Ca 0.15 -2.32 -0.12 0.00 0.46 0.00 0.00 57.72 55.89 2k5q n HIS 101 Cb 0.76 -2.52 -0.13 0.00 -0.12 0.00 0.00 29.99 27.98 2k5q n HIS 101 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2k5q s HIS 102 N 6.28 -0.35 0.22 1.57 3.76 -1.26 -5.15 115.29 120.36 2k5q s HIS 102 Ca 0.58 0.83 -0.30 0.00 -0.15 0.00 0.00 55.06 56.01 2k5q s HIS 102 Cb 0.05 0.08 -0.09 0.00 1.11 0.00 0.00 32.58 33.72 2k5q s HIS 102 CO 0.08 -0.23 1.38 -3.38 -0.85 0.00 0.00 174.74 171.73 2k5q s HIS 103 N 1.13 3.14 -0.06 1.40 -3.43 -1.26 -4.92 115.29 111.29 2k5q s HIS 103 Ca -0.08 1.11 0.25 0.00 -0.80 0.00 0.00 55.06 55.54 2k5q s HIS 103 Cb -0.09 -3.71 0.44 0.00 -1.43 0.00 0.00 32.58 27.79 2k5q s HIS 103 CO -0.08 -2.29 1.16 -2.39 -2.00 0.00 0.00 174.74 169.15 2k5q n HIS 104 N 2.52 0.26 -0.83 0.38 1.44 -1.26 -5.31 115.22 112.43 2k5q n HIS 104 Ca 0.07 -0.86 0.00 0.00 -2.01 0.00 0.00 57.72 54.91 2k5q n HIS 104 Cb 0.41 -0.17 0.00 0.00 0.12 0.00 0.00 29.99 30.35 2k5q n HIS 104 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25