#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 4.02 0.27 3.17 8.00 -1.26 -4.78 116.55 125.97 2k5q n ASP 2 Ca 0.00 -3.80 0.17 0.00 0.71 0.00 0.00 54.79 51.87 2k5q n ASP 2 Cb 0.00 -0.40 0.92 0.00 -0.02 0.00 0.00 41.12 41.62 2k5q n ASP 2 CO 0.00 0.00 0.00 0.17 -0.39 0.00 0.00 177.20 176.98 2k5q h LEU 3 N 1.83 0.00 -0.49 0.64 8.10 -2.06 0.42 115.31 123.75 2k5q h LEU 3 Ca 0.27 0.00 -0.15 0.00 0.11 0.00 0.00 57.88 58.10 2k5q h LEU 3 Cb 1.38 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 41.58 2k5q h LEU 3 CO 0.55 0.00 -0.74 -0.55 -4.11 0.00 0.00 178.44 173.59 2k5q h ASN 4 N 0.00 0.00 0.00 0.17 -1.07 -2.09 -3.41 115.58 109.18 2k5q h ASN 4 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.40 2k5q h ASN 4 Cb 0.18 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.43 2k5q h ASN 4 CO -0.00 0.74 -0.19 0.54 0.07 0.00 0.00 177.43 178.58 2k5q n ARG 5 N -3.62 0.10 -1.24 4.14 5.12 -0.18 -5.14 116.66 115.84 2k5q n ARG 5 Ca -0.01 0.04 0.17 0.00 -1.93 0.00 0.00 57.85 56.12 2k5q n ARG 5 Cb 0.72 -0.53 -0.04 0.00 -1.16 0.00 0.00 32.46 31.45 2k5q n ARG 5 CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 2k5q n MET 6 N -3.04 -2.50 -2.20 5.56 2.81 0.13 -5.09 117.12 112.79 2k5q n MET 6 Ca -0.03 1.65 0.00 0.00 -1.81 0.00 0.00 57.70 57.51 2k5q n MET 6 Cb 0.10 -3.05 0.00 0.00 -0.71 0.00 0.00 33.22 29.56 2k5q n MET 6 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2k5q n GLY 7 N -3.74 -0.07 2.86 3.03 0.00 -1.26 -5.10 105.19 100.91 2k5q n GLY 7 Ca 0.01 -1.50 -0.29 0.00 0.00 0.00 0.00 46.02 44.24 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 -2.00 1.24 0.22 1.61 1.02 -1.26 -5.13 119.74 115.44 2k5q s LYS 8 Ca 0.00 -0.69 -0.28 0.00 0.02 0.00 0.00 55.97 55.02 2k5q s LYS 8 Cb 0.00 -2.30 -0.09 0.00 -0.52 0.00 0.00 37.83 34.93 2k5q s LYS 8 CO 0.00 -0.58 0.88 -0.51 -0.92 0.00 0.00 175.35 174.22 2k5q s ASP 9 N 1.61 7.54 -0.02 2.83 1.01 -1.26 -4.96 116.67 123.42 2k5q s ASP 9 Ca -0.03 1.84 0.03 0.00 0.71 0.00 0.00 52.55 55.10 2k5q s ASP 9 Cb -0.17 -2.57 -0.00 0.00 1.01 0.00 0.00 42.92 41.18 2k5q s ASP 9 CO -0.07 0.17 -0.11 -1.83 0.21 0.00 0.00 175.17 173.54 2k5q s GLU 10 N -1.20 1.05 -0.07 8.23 -1.05 -1.26 -0.45 118.70 123.94 2k5q s GLU 10 Ca 0.39 -0.40 0.02 0.00 -0.15 0.00 0.00 54.97 54.84 2k5q s GLU 10 Cb -0.25 -0.99 -0.02 0.00 -0.44 0.00 0.00 34.13 32.43 2k5q s GLU 10 CO 0.30 0.20 -0.12 0.71 0.95 0.00 0.00 175.26 177.30 2k5q s TYR 11 N -0.06 2.79 -0.54 4.83 2.02 -0.33 -4.92 117.35 121.13 2k5q s TYR 11 Ca 0.01 -0.20 -0.22 0.00 -0.37 0.00 0.00 57.07 56.28 2k5q s TYR 11 Cb -0.07 -1.70 0.05 0.00 -0.40 0.00 0.00 41.96 39.84 2k5q s TYR 11 CO 0.00 0.15 0.84 0.71 -1.57 0.00 0.00 175.55 175.68 2k5q s TYR 12 N -0.52 2.87 0.30 2.71 2.02 -1.26 -1.29 117.35 122.19 2k5q s TYR 12 Ca 0.07 -0.20 0.04 0.00 -0.37 0.00 0.00 57.07 56.61 2k5q s TYR 12 Cb -0.12 -3.91 -0.06 0.00 -0.40 0.00 0.00 41.96 37.47 2k5q s TYR 12 CO 0.02 -1.26 0.03 0.14 -1.57 0.00 0.00 175.55 172.90 2k5q s VAL 13 N 3.53 1.27 0.27 0.71 -7.23 -1.02 -4.98 120.40 112.94 2k5q s VAL 13 Ca 0.25 -2.03 0.02 0.00 -1.81 0.00 0.00 61.98 58.41 2k5q s VAL 13 Cb -0.15 -2.67 -0.05 0.00 0.56 0.00 0.00 36.38 34.07 2k5q s VAL 13 CO 0.17 -0.11 0.10 0.00 -0.31 0.00 0.00 175.10 174.94 2k5q s GLN 14 N -3.85 1.46 -0.84 4.82 -2.07 -1.26 0.10 119.66 118.01 2k5q s GLN 14 Ca 0.34 -1.80 -0.25 0.00 -1.82 0.00 0.00 55.36 51.83 2k5q s GLN 14 Cb 0.07 -0.34 -0.02 0.00 -1.09 0.00 0.00 33.01 31.64 2k5q s GLN 14 CO 0.14 -0.29 1.80 0.42 -1.32 0.00 0.00 175.29 176.04 2k5q s ILE 15 N -3.68 3.52 -0.03 3.63 -1.09 -1.20 -4.81 121.20 117.54 2k5q s ILE 15 Ca 0.37 -0.25 -0.06 0.00 -2.23 0.00 0.00 60.65 58.48 2k5q s ILE 15 Cb 0.08 -4.22 -0.03 0.00 -1.58 0.00 0.00 42.46 36.70 2k5q s ILE 15 CO 0.14 -1.16 0.38 0.71 -1.23 0.00 0.00 174.94 173.78 2k5q h THR 16 N 7.02 0.00 -3.31 2.92 1.35 -1.96 -3.45 112.91 115.47 2k5q h THR 16 Ca 0.01 -0.39 -0.60 0.00 -0.55 0.00 0.00 66.41 64.88 2k5q h THR 16 Cb 1.04 0.00 -0.12 0.00 -1.73 0.00 0.00 68.15 67.35 2k5q h THR 16 CO 1.25 0.00 -0.44 0.68 -0.25 0.00 0.00 175.52 176.76 2k5q s VAL 17 N -2.27 5.37 0.38 6.82 -7.23 -1.26 -5.10 120.40 117.11 2k5q s VAL 17 Ca -0.03 0.30 0.05 0.00 -1.81 0.00 0.00 61.98 60.49 2k5q s VAL 17 Cb 0.00 -3.52 -0.07 0.00 0.56 0.00 0.00 36.38 33.35 2k5q s VAL 17 CO 0.10 0.41 0.04 1.51 -0.31 0.00 0.00 175.10 176.84 2k5q s ASP 18 N 0.48 3.22 -0.01 4.85 -4.77 -1.26 -4.78 116.67 114.40 2k5q s ASP 18 Ca 0.11 -1.41 0.00 0.00 -3.30 0.00 0.00 52.55 47.95 2k5q s ASP 18 Cb -0.12 -0.16 0.00 0.00 -1.09 0.00 0.00 42.92 41.56 2k5q s ASP 18 CO 0.00 -0.57 0.00 0.61 0.70 0.00 0.00 175.17 175.92 2k5q n GLY 19 N -0.87 0.31 3.43 2.12 0.00 -1.26 -4.91 105.19 104.00 2k5q n GLY 19 Ca -0.05 -0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 2k5q n GLY 19 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2k5q n LYS 20 N -1.47 1.44 -2.80 1.61 3.00 -1.26 -4.89 118.16 113.78 2k5q n LYS 20 Ca -0.00 -2.18 -0.43 0.00 -0.00 0.00 0.00 58.31 55.70 2k5q n LYS 20 Cb 0.19 -3.43 -0.04 0.00 0.00 0.00 0.00 35.03 31.75 2k5q n LYS 20 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 2k5q s GLU 21 N 6.12 3.35 -1.06 1.64 2.12 -1.25 -0.69 118.70 128.92 2k5q s GLU 21 Ca 0.66 -0.20 -0.24 0.00 0.36 0.00 0.00 54.97 55.55 2k5q s GLU 21 Cb 0.05 -4.05 -0.08 0.00 0.26 0.00 0.00 34.13 30.31 2k5q s GLU 21 CO 0.14 -1.53 1.95 0.14 -0.54 0.00 0.00 175.26 175.43 2k5q s VAL 22 N 4.12 3.48 -0.91 3.70 -7.23 0.26 -4.84 120.40 118.98 2k5q s VAL 22 Ca 0.32 -0.67 -0.14 0.00 -1.81 0.00 0.00 61.98 59.68 2k5q s VAL 22 Cb -0.12 -4.31 -0.09 0.00 0.56 0.00 0.00 36.38 32.42 2k5q s VAL 22 CO 0.20 -0.93 2.06 1.41 -0.31 0.00 0.00 175.10 177.53 2k5q n HIS 23 N 14.45 1.80 -0.25 2.82 -0.00 -1.26 -4.10 115.22 128.68 2k5q n HIS 23 Ca 0.43 -2.01 -0.01 0.00 -0.00 0.00 0.00 57.72 56.13 2k5q n HIS 23 Cb 0.47 -1.78 0.19 0.00 -0.00 0.00 0.00 29.99 28.86 2k5q n HIS 23 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 2k5q h SER 24 N 6.97 0.94 -4.95 0.41 0.87 -1.89 -3.48 113.55 112.42 2k5q h SER 24 Ca 0.48 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.98 2k5q h SER 24 Cb 0.43 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.16 2k5q h SER 24 CO 1.73 0.73 -0.20 1.17 -0.53 0.00 0.00 176.83 179.73 2k5q n LYS 25 N -4.37 -1.54 0.14 2.24 4.81 -1.26 -4.96 118.16 113.21 2k5q n LYS 25 Ca 0.08 1.60 0.12 0.00 -0.87 0.00 0.00 58.31 59.24 2k5q n LYS 25 Cb 0.07 -5.05 0.07 0.00 0.02 0.00 0.00 35.03 30.14 2k5q n LYS 25 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2k5q h ALA 26 N 1.01 0.67 -0.66 3.14 0.00 -1.93 -3.50 119.26 117.99 2k5q h ALA 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2k5q h ALA 26 Cb 0.92 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2k5q h ALA 26 CO 0.21 0.00 0.00 -3.47 0.00 0.00 0.00 179.25 175.99 2k5q n ASP 27 N -2.77 -0.74 0.00 0.00 2.03 -1.25 -4.82 116.55 109.00 2k5q n ASP 27 Ca 0.02 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.33 2k5q n ASP 27 Cb 0.54 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.94 2k5q n ASP 27 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2k5q n ASN 28 N -3.34 0.00 0.00 1.67 5.15 -1.26 -0.98 115.26 116.50 2k5q n ASN 28 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2k5q n ASN 28 Cb 0.00 -0.79 0.00 0.00 -0.53 0.00 0.00 39.78 38.46 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 -1.85 1.88 3.64 8.20 0.00 -1.26 -5.10 105.19 110.69 2k5q n GLY 29 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2k5q n GLY 29 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2k5q s GLN 30 N -0.01 4.03 -0.56 1.61 2.00 -0.15 -5.00 119.66 121.57 2k5q s GLN 30 Ca 0.00 1.09 -0.16 0.00 -2.00 0.00 0.00 55.36 54.28 2k5q s GLN 30 Cb 0.00 -3.77 0.13 0.00 0.80 0.00 0.00 33.01 30.17 2k5q s GLN 30 CO 0.00 -0.96 0.55 0.15 -0.50 0.00 0.00 175.29 174.53 2k5q s LYS 31 N 3.77 3.02 -0.49 1.67 1.02 -1.26 -3.86 119.74 123.62 2k5q s LYS 31 Ca 0.47 -1.67 -0.18 0.00 0.02 0.00 0.00 55.97 54.62 2k5q s LYS 31 Cb -0.13 -4.30 0.06 0.00 -0.52 0.00 0.00 37.83 32.94 2k5q s LYS 31 CO 0.17 -1.37 0.52 0.71 -0.92 0.00 0.00 175.35 174.47 2k5q s TYR 32 N 1.73 3.13 -0.41 3.18 2.02 -1.26 -4.91 117.35 120.83 2k5q s TYR 32 Ca 0.05 -0.68 0.09 0.00 -0.37 0.00 0.00 57.07 56.16 2k5q s TYR 32 Cb -0.28 -3.34 0.32 0.00 -0.40 0.00 0.00 41.96 38.25 2k5q s TYR 32 CO 0.03 -0.92 0.85 1.63 -1.57 0.00 0.00 175.55 175.57 2k5q n LYS 33 N 5.75 0.94 -3.52 -0.62 5.02 -1.26 -4.01 118.16 120.46 2k5q n LYS 33 Ca -0.09 -2.75 -0.23 0.00 -2.02 0.00 0.00 58.31 53.22 2k5q n LYS 33 Cb 0.45 -1.41 -0.01 0.00 -0.02 0.00 0.00 35.03 34.04 2k5q n LYS 33 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2k5q s ASP 34 N -1.84 6.30 -0.24 4.39 1.11 -1.26 -4.79 116.67 120.33 2k5q s ASP 34 Ca 0.33 0.36 -0.13 0.00 0.18 0.00 0.00 52.55 53.28 2k5q s ASP 34 Cb 0.30 -1.99 -0.04 0.00 1.07 0.00 0.00 42.92 42.26 2k5q s ASP 34 CO -0.09 -0.24 0.28 -0.31 1.18 0.00 0.00 175.17 176.00 2k5q s TYR 35 N -2.23 3.30 -0.08 4.23 2.02 -0.30 -0.57 117.35 123.71 2k5q s TYR 35 Ca 0.38 0.37 0.01 0.00 -0.37 0.00 0.00 57.07 57.46 2k5q s TYR 35 Cb -0.09 -2.43 -0.03 0.00 -0.40 0.00 0.00 41.96 39.01 2k5q s TYR 35 CO 0.34 -0.05 -0.08 -2.00 -1.57 0.00 0.00 175.55 172.19 2k5q s GLU 36 N 1.45 2.87 -0.40 -0.62 -6.30 0.13 -0.14 118.70 115.69 2k5q s GLU 36 Ca 0.13 -0.58 0.03 0.00 -2.50 0.00 0.00 54.97 52.05 2k5q s GLU 36 Cb -0.15 -2.60 0.11 0.00 0.00 0.00 0.00 34.13 31.50 2k5q s GLU 36 CO 0.08 0.58 0.15 0.71 0.02 0.00 0.00 175.26 176.79 2k5q s TYR 37 N -0.58 2.91 -0.92 5.30 2.02 -0.69 -4.54 117.35 120.85 2k5q s TYR 37 Ca 0.09 -2.72 -0.24 0.00 -0.37 0.00 0.00 57.07 53.82 2k5q s TYR 37 Cb -0.12 -2.49 0.04 0.00 -0.40 0.00 0.00 41.96 38.99 2k5q s TYR 37 CO 0.02 -0.85 1.42 0.21 -1.57 0.00 0.00 175.55 174.78 2k5q s LYS 38 N 0.60 3.42 -0.07 -0.62 2.47 -1.26 -3.06 119.74 121.22 2k5q s LYS 38 Ca 0.14 -0.80 0.03 0.00 -1.56 0.00 0.00 55.97 53.77 2k5q s LYS 38 Cb -0.22 -4.98 -0.02 0.00 -1.46 0.00 0.00 37.83 31.15 2k5q s LYS 38 CO -0.07 -2.24 -0.14 -0.51 0.16 0.00 0.00 175.35 172.55 2k5q s LEU 39 N 5.43 2.72 -0.36 5.43 1.43 -0.37 -4.99 118.68 127.99 2k5q s LEU 39 Ca 0.44 -0.23 -0.16 0.00 -1.03 0.00 0.00 54.13 53.15 2k5q s LEU 39 Cb -0.03 -1.57 -0.00 0.00 0.03 0.00 0.00 46.19 44.62 2k5q s LEU 39 CO -0.02 0.30 0.38 -0.89 0.23 0.00 0.00 176.35 176.36 2k5q s THR 40 N -0.47 5.14 -0.13 5.49 2.01 -1.26 -0.13 115.64 126.29 2k5q s THR 40 Ca 0.06 -0.01 -0.17 0.00 0.31 0.00 0.00 61.69 61.87 2k5q s THR 40 Cb -0.12 -3.87 -0.04 0.00 0.01 0.00 0.00 72.50 68.48 2k5q s THR 40 CO 0.02 -0.16 0.44 -0.83 -0.69 0.00 0.00 174.62 173.39 2k5q s GLY 41 N 1.75 2.34 -0.01 4.40 0.00 0.16 -4.89 107.32 111.08 2k5q s GLY 41 Ca 0.12 -0.25 -0.18 0.00 0.00 0.00 0.00 44.72 44.40 2k5q s GLY 41 CO 0.12 0.70 0.52 -1.36 0.00 0.00 0.00 173.10 173.08 2k5q s PHE 42 N 0.62 3.69 0.81 1.90 0.08 -1.26 -0.46 117.98 123.36 2k5q s PHE 42 Ca 0.24 1.10 -0.06 0.00 0.12 0.00 0.00 56.93 58.33 2k5q s PHE 42 Cb -0.15 -2.49 0.15 0.00 -0.57 0.00 0.00 43.02 39.97 2k5q s PHE 42 CO 0.09 0.45 1.11 0.34 -0.10 0.00 0.00 175.22 177.11 2k5q s ASP 43 N -0.49 3.92 0.37 1.36 -1.08 -0.23 -4.87 116.67 115.65 2k5q s ASP 43 Ca 0.28 -0.11 0.09 0.00 -0.52 0.00 0.00 52.55 52.29 2k5q s ASP 43 Cb -0.18 -0.15 0.73 0.00 -1.46 0.00 0.00 42.92 41.87 2k5q s ASP 43 CO 0.15 -2.17 1.88 0.11 0.52 0.00 0.00 175.17 175.66 2k5q h LYS 44 N -0.93 0.22 -0.00 4.34 1.79 -1.98 -0.44 116.57 119.56 2k5q h LYS 44 Ca -0.39 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.02 2k5q h LYS 44 Cb 1.26 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 2k5q h LYS 44 CO 0.40 0.41 -0.12 -3.47 -1.08 0.00 0.00 179.45 175.59 2k5q n ASP 45 N -4.23 0.57 0.00 0.86 2.03 -1.26 -4.89 116.55 109.63 2k5q n ASP 45 Ca -0.01 -0.67 0.00 0.00 0.52 0.00 0.00 54.79 54.63 2k5q n ASP 45 Cb 0.31 -0.04 0.00 0.00 -0.72 0.00 0.00 41.12 40.67 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 1.27 1.61 3.85 0.27 0.00 -0.17 -5.11 105.19 106.90 2k5q n GLY 46 Ca 0.15 -0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.82 3.18 -0.34 1.61 -0.14 -1.24 -4.78 119.74 117.22 2k5q s LYS 47 Ca 0.00 0.80 -0.05 0.00 -1.36 0.00 0.00 55.97 55.37 2k5q s LYS 47 Cb 0.00 -2.03 0.06 0.00 -1.68 0.00 0.00 37.83 34.18 2k5q s LYS 47 CO 0.00 -0.89 0.10 -1.83 -0.76 0.00 0.00 175.35 171.97 2k5q s GLU 48 N -5.14 2.46 -0.09 1.68 -1.05 -1.26 -1.07 118.70 114.24 2k5q s GLU 48 Ca 0.57 -1.33 0.00 0.00 -0.15 0.00 0.00 54.97 54.05 2k5q s GLU 48 Cb -0.12 -3.42 -0.03 0.00 -0.44 0.00 0.00 34.13 30.12 2k5q s GLU 48 CO 0.54 -0.74 -0.07 0.21 0.95 0.00 0.00 175.26 176.15 2k5q s LYS 49 N 1.31 2.95 -0.18 -4.83 2.20 0.39 -4.99 119.74 116.60 2k5q s LYS 49 Ca -0.01 -0.56 -0.19 0.00 -0.36 0.00 0.00 55.97 54.85 2k5q s LYS 49 Cb -0.20 -2.64 -0.03 0.00 -1.51 0.00 0.00 37.83 33.44 2k5q s LYS 49 CO 0.00 0.55 0.55 -2.00 -0.36 0.00 0.00 175.35 174.10 2k5q s GLU 50 N -0.51 4.23 0.31 4.03 2.56 -1.26 0.35 118.70 128.41 2k5q s GLU 50 Ca 0.08 0.49 0.05 0.00 0.00 0.00 0.00 54.97 55.59 2k5q s GLU 50 Cb -0.12 -3.54 -0.06 0.00 2.00 0.00 0.00 34.13 32.41 2k5q s GLU 50 CO 0.02 -0.11 -0.00 -0.51 -0.56 0.00 0.00 175.26 174.10 2k5q s LEU 51 N 1.50 2.41 -0.03 2.70 2.01 0.82 -4.16 118.68 123.92 2k5q s LEU 51 Ca 0.26 -1.29 -0.30 0.00 0.01 0.00 0.00 54.13 52.82 2k5q s LEU 51 Cb -0.16 -0.57 0.11 0.00 0.01 0.00 0.00 46.19 45.59 2k5q s LEU 51 CO 0.10 -0.46 0.93 -1.83 1.01 0.00 0.00 176.35 176.10 2k5q s GLU 52 N -3.79 0.75 -0.22 1.70 -1.05 -1.26 -1.23 118.70 113.60 2k5q s GLU 52 Ca 0.33 -0.25 -0.29 0.00 -0.15 0.00 0.00 54.97 54.61 2k5q s GLU 52 Cb 0.07 0.35 0.15 0.00 -0.44 0.00 0.00 34.13 34.26 2k5q s GLU 52 CO 0.14 -0.32 1.15 -0.59 0.95 0.00 0.00 175.26 176.59 2k5q s PHE 53 N -2.92 -0.25 -0.25 4.83 -0.71 -1.17 -4.06 117.98 113.46 2k5q s PHE 53 Ca 0.05 0.46 -0.10 0.00 -1.04 0.00 0.00 56.93 56.30 2k5q s PHE 53 Cb -0.01 0.46 -0.05 0.00 -1.21 0.00 0.00 43.02 42.21 2k5q s PHE 53 CO -0.08 -0.21 0.14 0.95 -1.34 0.00 0.00 175.22 174.69 2k5q s THR 54 N -0.87 5.09 -0.13 -4.49 -4.23 -1.26 -1.70 115.64 108.05 2k5q s THR 54 Ca 0.03 0.09 -0.09 0.00 -1.18 0.00 0.00 61.69 60.53 2k5q s THR 54 Cb -0.01 -3.38 -0.05 0.00 1.34 0.00 0.00 72.50 70.40 2k5q s THR 54 CO -0.04 0.33 0.19 0.00 -0.54 0.00 0.00 174.62 174.56 2k5q s ALA 55 N 1.31 3.78 0.21 3.99 0.00 0.81 -4.93 121.76 126.92 2k5q s ALA 55 Ca 0.07 -0.58 0.07 0.00 0.00 0.00 0.00 51.96 51.52 2k5q s ALA 55 Cb -0.14 -2.12 0.13 0.00 0.00 0.00 0.00 23.12 20.99 2k5q s ALA 55 CO 0.06 0.43 1.48 1.96 0.00 0.00 0.00 175.76 179.69 2k5q h GLN 56 N 5.54 0.09 -5.73 0.00 7.50 -1.95 -0.79 115.11 119.76 2k5q h GLN 56 Ca -0.50 -0.08 -0.53 0.00 0.50 0.00 0.00 58.65 58.04 2k5q h GLN 56 Cb 1.20 0.02 -0.14 0.00 0.05 0.00 0.00 27.48 28.61 2k5q h GLN 56 CO 0.65 0.80 -0.70 0.15 -1.50 0.00 0.00 178.83 178.23 2k5q s LYS 57 N -3.35 1.58 -1.14 1.46 1.02 -1.26 -4.76 119.74 113.29 2k5q s LYS 57 Ca -0.02 -1.77 -0.21 0.00 0.02 0.00 0.00 55.97 53.99 2k5q s LYS 57 Cb 0.11 -1.37 0.05 0.00 -0.52 0.00 0.00 37.83 36.10 2k5q s LYS 57 CO 0.80 0.14 1.61 1.21 -0.92 0.00 0.00 175.35 178.19 2k5q s ASN 58 N -3.46 6.56 1.13 2.83 3.84 -1.26 -4.89 114.94 119.69 2k5q s ASN 58 Ca 0.29 -1.87 -0.13 0.00 0.21 0.00 0.00 52.86 51.35 2k5q s ASN 58 Cb 0.01 -2.57 0.19 0.00 -0.55 0.00 0.00 41.25 38.33 2k5q s ASN 58 CO 0.12 -1.45 0.77 0.00 -2.79 0.00 0.00 177.10 173.75 2k5q n LEU 59 N 9.01 0.00 -4.55 3.21 -0.00 -1.26 -4.88 117.00 118.53 2k5q n LEU 59 Ca 0.41 -0.82 -0.44 0.00 -0.00 0.00 0.00 56.01 55.16 2k5q n LEU 59 Cb 0.49 -0.68 -0.04 0.00 -0.00 0.00 0.00 43.42 43.19 2k5q n LEU 59 CO 0.71 -1.64 1.89 0.54 -0.00 0.00 0.00 177.39 178.88 2k5q n ARG 60 N -3.55 1.55 -0.02 1.47 1.74 -1.26 -4.85 116.66 111.73 2k5q n ARG 60 Ca 0.10 0.37 -0.05 0.00 -0.77 0.00 0.00 57.85 57.50 2k5q n ARG 60 Cb 0.39 -3.06 0.16 0.00 -1.02 0.00 0.00 32.46 28.93 2k5q n ARG 60 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2k5q h LYS 61 N 15.23 0.59 -0.20 5.56 1.57 -1.93 -2.65 116.57 134.74 2k5q h LYS 61 Ca -0.34 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.21 2k5q h LYS 61 Cb 1.27 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.54 2k5q h LYS 61 CO 1.02 0.79 0.00 0.39 -0.57 0.00 0.00 179.45 181.08 2k5q n GLU 62 N -4.12 1.61 -2.77 3.15 4.71 -1.26 -3.22 120.64 118.75 2k5q n GLU 62 Ca -0.00 -0.93 -0.31 0.00 -0.01 0.00 0.00 57.16 55.91 2k5q n GLU 62 Cb 0.42 -1.30 -0.04 0.00 -1.01 0.00 0.00 31.44 29.51 2k5q n GLU 62 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2k5q s ALA 63 N -1.74 3.27 -0.36 0.62 0.00 -1.00 -4.84 121.76 117.71 2k5q s ALA 63 Ca 0.26 -0.06 -0.13 0.00 0.00 0.00 0.00 51.96 52.02 2k5q s ALA 63 Cb 0.13 -2.83 -0.00 0.00 0.00 0.00 0.00 23.12 20.42 2k5q s ALA 63 CO 0.20 -0.02 0.25 -0.06 0.00 0.00 0.00 175.76 176.12 2k5q s PHE 64 N -2.39 3.23 -0.27 0.00 0.40 0.15 -3.63 117.98 115.48 2k5q s PHE 64 Ca 0.54 -0.40 -0.20 0.00 -0.60 0.00 0.00 56.93 56.27 2k5q s PHE 64 Cb -0.10 -2.50 -0.02 0.00 0.51 0.00 0.00 43.02 40.91 2k5q s PHE 64 CO 0.29 -0.45 0.62 -0.51 0.70 0.00 0.00 175.22 175.87 2k5q s LEU 65 N 1.69 4.08 -1.01 -0.37 1.43 0.28 -1.58 118.68 123.20 2k5q s LEU 65 Ca 0.05 0.63 -0.23 0.00 -1.03 0.00 0.00 54.13 53.56 2k5q s LEU 65 Cb -0.18 -2.84 0.06 0.00 0.03 0.00 0.00 46.19 43.26 2k5q s LEU 65 CO 0.10 -0.39 1.42 -0.13 0.23 0.00 0.00 176.35 177.58 2k5q s ARG 66 N 2.52 3.59 0.25 1.70 0.52 0.92 -2.43 118.95 126.01 2k5q s ARG 66 Ca 0.26 -1.17 -0.27 0.00 -0.52 0.00 0.00 55.73 54.03 2k5q s ARG 66 Cb -0.15 -5.32 -0.09 0.00 0.52 0.00 0.00 34.95 29.91 2k5q s ARG 66 CO 0.09 -2.17 0.88 0.14 0.02 0.00 0.00 175.30 174.26 2k5q s VAL 67 N 4.80 4.23 -0.22 3.52 -7.23 -0.41 -1.85 120.40 123.24 2k5q s VAL 67 Ca 0.45 1.84 -0.19 0.00 -1.81 0.00 0.00 61.98 62.27 2k5q s VAL 67 Cb -0.00 -4.14 -0.03 0.00 0.56 0.00 0.00 36.38 32.77 2k5q s VAL 67 CO -0.10 0.36 0.57 -0.47 -0.31 0.00 0.00 175.10 175.15 2k5q s TYR 68 N -1.35 3.34 -0.97 2.82 5.04 -0.69 -1.19 117.35 124.36 2k5q s TYR 68 Ca 0.43 0.80 -0.24 0.00 -2.44 0.00 0.00 57.07 55.63 2k5q s TYR 68 Cb -0.22 -2.74 0.00 0.00 0.35 0.00 0.00 41.96 39.35 2k5q s TYR 68 CO 0.27 -0.18 1.71 -1.58 -1.34 0.00 0.00 175.55 174.43 2k5q s HIS 69 N 1.94 2.17 0.55 4.97 5.65 0.40 -3.82 115.29 127.15 2k5q s HIS 69 Ca 0.25 -0.11 -0.14 0.00 0.25 0.00 0.00 55.06 55.31 2k5q s HIS 69 Cb -0.16 -4.37 -0.06 0.00 -1.18 0.00 0.00 32.58 26.81 2k5q s HIS 69 CO 0.10 -1.83 1.00 -1.12 -0.65 0.00 0.00 174.74 172.24 2k5q s SER 70 N 6.50 6.48 0.23 9.88 0.01 -1.26 -4.50 113.70 131.03 2k5q s SER 70 Ca 0.58 1.51 -0.06 0.00 1.31 0.00 0.00 55.95 59.30 2k5q s SER 70 Cb -0.03 -2.49 0.34 0.00 0.21 0.00 0.00 66.02 64.04 2k5q s SER 70 CO -0.05 -0.69 1.80 -0.78 0.41 0.00 0.00 173.24 173.93 2k5q h ASP 71 N 0.46 0.59 -0.05 2.44 3.58 -1.99 -0.90 116.42 120.55 2k5q h ASP 71 Ca -0.46 0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.04 2k5q h ASP 71 Cb 1.19 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 42.17 2k5q h ASP 71 CO 0.62 0.35 0.00 2.29 -2.88 0.00 0.00 179.24 179.62 2k5q n LYS 72 N -4.78 1.14 -1.16 0.28 -0.00 -1.26 -5.02 118.16 107.36 2k5q n LYS 72 Ca 0.12 -0.22 0.14 0.00 -0.00 0.00 0.00 58.31 58.35 2k5q n LYS 72 Cb 0.25 -1.17 -0.07 0.00 -0.00 0.00 0.00 35.03 34.04 2k5q n LYS 72 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2k5q n LYS 73 N -0.43 -2.61 -1.24 -1.58 0.00 -0.34 -4.90 118.16 107.05 2k5q n LYS 73 Ca 0.08 2.06 -0.07 0.00 0.00 0.00 0.00 58.31 60.38 2k5q n LYS 73 Cb 0.08 -3.08 -0.03 0.00 0.00 0.00 0.00 35.03 32.01 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 -3.92 0.84 0.96 3.14 0.00 -1.26 -4.81 105.19 100.15 2k5q n GLY 74 Ca -0.06 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.88 -3.58 -0.02 1.61 0.31 -1.25 -4.03 118.33 108.51 2k5q n VAL 75 Ca -0.07 1.43 0.02 0.00 -0.01 0.00 0.00 64.34 65.71 2k5q n VAL 75 Cb 0.23 -2.03 -0.07 0.00 -0.91 0.00 0.00 33.84 31.06 2k5q n VAL 75 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2k5q n SER 76 N -0.76 2.94 -3.50 4.52 2.88 -1.25 -4.92 113.62 113.53 2k5q n SER 76 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 2k5q n SER 76 Cb 0.00 1.18 -0.03 0.00 -0.75 0.00 0.00 64.21 64.61 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 -2.49 -1.37 -0.02 -1.46 0.00 -1.26 -5.08 121.76 110.08 2k5q s ALA 77 Ca -0.04 0.32 -0.10 0.00 0.00 0.00 0.00 51.96 52.14 2k5q s ALA 77 Cb 0.05 0.81 0.01 0.00 0.00 0.00 0.00 23.12 23.99 2k5q s ALA 77 CO 0.36 -0.72 0.22 1.67 0.00 0.00 0.00 175.76 177.30 2k5q s TRP 78 N -3.72 -0.10 -0.08 0.00 1.48 -1.26 -1.71 118.94 113.55 2k5q s TRP 78 Ca 0.01 0.16 -0.00 0.00 -1.06 0.00 0.00 56.10 55.21 2k5q s TRP 78 Cb -0.00 0.03 -0.03 0.00 -1.16 0.00 0.00 33.47 32.31 2k5q s TRP 78 CO -0.12 -0.30 -0.05 -1.21 -4.06 0.00 0.00 176.95 171.21 2k5q s GLU 79 N -1.08 2.90 -0.46 3.25 2.02 -0.77 -4.92 118.70 119.64 2k5q s GLU 79 Ca -0.12 -0.51 -0.16 0.00 0.02 0.00 0.00 54.97 54.21 2k5q s GLU 79 Cb -0.06 -2.67 0.05 0.00 0.10 0.00 0.00 34.13 31.55 2k5q s GLU 79 CO 0.02 0.63 0.40 -2.00 0.02 0.00 0.00 175.26 174.34 2k5q s GLU 80 N -0.71 3.00 0.40 1.61 2.12 -1.26 -0.06 118.70 123.80 2k5q s GLU 80 Ca 0.11 -1.17 0.04 0.00 0.36 0.00 0.00 54.97 54.31 2k5q s GLU 80 Cb -0.11 -4.08 -0.03 0.00 0.26 0.00 0.00 34.13 30.17 2k5q s GLU 80 CO 0.02 -0.96 0.11 0.14 -0.54 0.00 0.00 175.26 174.03 2k5q s VAL 81 N 1.80 0.70 0.43 3.70 -7.23 -0.62 -5.00 120.40 114.18 2k5q s VAL 81 Ca 0.06 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.29 2k5q s VAL 81 Cb -0.22 -2.41 -0.06 0.00 0.56 0.00 0.00 36.38 34.25 2k5q s VAL 81 CO 0.09 0.00 0.05 -0.54 -0.31 0.00 0.00 175.10 174.38 2k5q s LYS 82 N -3.75 2.05 0.13 4.82 3.01 -1.26 0.35 119.74 125.09 2k5q s LYS 82 Ca 0.25 -2.12 0.08 0.00 -1.01 0.00 0.00 55.97 53.17 2k5q s LYS 82 Cb 0.03 -1.68 0.43 0.00 -1.01 0.00 0.00 37.83 35.61 2k5q s LYS 82 CO 0.14 -0.13 1.21 0.36 0.51 0.00 0.00 175.35 177.43 2k5q n LYS 83 N -1.09 0.05 0.18 1.68 0.00 -1.26 -2.66 118.16 115.07 2k5q n LYS 83 Ca -0.07 0.52 0.13 0.00 -0.00 0.00 0.00 58.31 58.89 2k5q n LYS 83 Cb 0.67 -1.73 0.62 0.00 -0.00 0.00 0.00 35.03 34.59 2k5q n LYS 83 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 2k5q h ASP 84 N 0.00 0.00 -0.02 -5.58 5.19 -2.01 -0.86 116.42 113.13 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 0.11 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.62 2k5q h ASP 84 CO 0.00 0.00 -0.09 -1.84 -3.12 0.00 0.00 179.24 174.19 2k5q n GLU 85 N -2.43 1.79 -3.38 3.56 0.28 -1.09 -4.98 120.64 114.39 2k5q n GLU 85 Ca 0.00 -1.56 -0.37 0.00 -0.16 0.00 0.00 57.16 55.06 2k5q n GLU 85 Cb 0.15 -1.40 -0.06 0.00 1.43 0.00 0.00 31.44 31.56 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 -1.85 4.28 -0.09 -1.84 1.43 -0.33 -5.06 118.68 115.22 2k5q s LEU 86 Ca 0.23 0.75 -0.30 0.00 -1.03 0.00 0.00 54.13 53.77 2k5q s LEU 86 Cb 0.17 -2.61 -0.03 0.00 0.03 0.00 0.00 46.19 43.75 2k5q s LEU 86 CO 0.31 0.05 1.34 -2.16 0.23 0.00 0.00 176.35 176.12 2k5q s PRO 87 N 0.48 4.26 0.63 1.29 0.04 -1.26 -4.91 135.00 135.53 2k5q s PRO 87 Ca 0.23 1.81 0.26 0.00 0.04 0.00 0.00 61.00 63.34 2k5q s PRO 87 Cb -0.15 -3.71 1.31 0.00 0.04 0.00 0.00 34.50 31.99 2k5q s PRO 87 CO 0.09 -0.65 1.74 0.00 0.04 0.00 0.00 177.00 178.22 2k5q h ALA 88 N 8.17 1.90 -0.83 8.56 0.00 -1.97 -1.37 119.26 133.73 2k5q h ALA 88 Ca -0.33 -0.01 0.21 0.00 0.00 0.00 0.00 54.91 54.78 2k5q h ALA 88 Cb 1.14 0.02 -0.13 0.00 0.00 0.00 0.00 17.79 18.82 2k5q h ALA 88 CO 0.93 -0.70 0.20 0.87 0.00 0.00 0.00 179.25 180.55 2k5q h LYS 89 N 0.00 0.21 -0.56 0.00 1.57 -1.99 -0.09 116.57 115.71 2k5q h LYS 89 Ca 0.13 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 2k5q h LYS 89 Cb 1.25 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.48 2k5q h LYS 89 CO -0.00 0.14 0.19 -0.24 -0.57 0.00 0.00 179.45 178.97 2k5q h VAL 90 N 0.22 1.21 0.00 0.50 3.04 -1.65 0.84 116.25 120.40 2k5q h VAL 90 Ca 0.50 -0.70 -0.04 0.00 -1.01 0.00 0.00 66.70 65.46 2k5q h VAL 90 Cb 0.96 0.58 -0.01 0.00 -2.01 0.00 0.00 31.29 30.81 2k5q h VAL 90 CO -0.62 0.27 -0.17 0.50 -1.01 0.00 0.00 177.57 176.53 2k5q h LYS 91 N 0.81 0.00 0.00 4.17 3.64 -1.24 0.55 116.57 124.50 2k5q h LYS 91 Ca 0.19 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.41 2k5q h LYS 91 Cb 0.20 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 2k5q h LYS 91 CO -0.01 0.17 -0.92 0.93 -2.27 0.00 0.00 179.45 177.35 2k5q h GLU 92 N 0.00 0.00 0.09 1.90 5.08 -0.36 -3.39 114.58 117.91 2k5q h GLU 92 Ca -0.00 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.01 2k5q h GLU 92 Cb 0.88 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.11 2k5q h GLU 92 CO 0.02 0.57 -1.91 1.17 -1.00 0.00 0.00 179.01 177.86 2k5q n LYS 93 N -3.16 0.71 -1.71 2.33 3.00 0.20 -4.90 118.16 114.63 2k5q n LYS 93 Ca -0.03 0.31 -0.43 0.00 -0.00 0.00 0.00 58.31 58.17 2k5q n LYS 93 Cb 0.83 -1.70 -0.03 0.00 0.00 0.00 0.00 35.03 34.13 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 -3.67 3.92 0.00 3.14 7.94 0.16 -2.98 117.00 125.50 2k5q n LEU 94 Ca -0.34 1.06 0.00 0.00 -1.11 0.00 0.00 56.01 55.62 2k5q n LEU 94 Cb 0.97 -1.56 0.00 0.00 0.53 0.00 0.00 43.42 43.36 2k5q n LEU 94 CO 0.36 0.14 0.00 0.61 -1.11 0.00 0.00 177.39 177.39 2k5q n GLY 95 N 3.93 2.98 2.97 -3.96 0.00 -1.26 -4.95 105.19 104.90 2k5q n GLY 95 Ca 0.16 -1.07 -0.25 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.05 1.03 -0.24 1.61 -7.23 -1.16 -5.13 120.40 109.23 2k5q s VAL 96 Ca 0.00 -0.38 -0.09 0.00 -1.81 0.00 0.00 61.98 59.70 2k5q s VAL 96 Cb 0.00 -0.98 -0.04 0.00 0.56 0.00 0.00 36.38 35.91 2k5q s VAL 96 CO 0.00 0.34 0.13 -0.75 -0.31 0.00 0.00 175.10 174.51 2k5q s LYS 97 N 0.99 3.93 -0.04 4.82 2.20 -1.26 -4.96 119.74 125.42 2k5q s LYS 97 Ca -0.09 -0.34 -0.03 0.00 -0.36 0.00 0.00 55.97 55.15 2k5q s LYS 97 Cb -0.15 -3.46 0.02 0.00 -1.51 0.00 0.00 37.83 32.73 2k5q s LYS 97 CO -0.00 -0.01 0.11 -0.48 -0.36 0.00 0.00 175.35 174.60 2k5q s LEU 98 N 1.22 1.43 0.05 5.43 2.34 -1.26 -5.07 118.68 122.82 2k5q s LEU 98 Ca 0.06 0.22 -0.12 0.00 0.06 0.00 0.00 54.13 54.34 2k5q s LEU 98 Cb -0.14 0.33 -0.30 0.00 -0.56 0.00 0.00 46.19 45.52 2k5q s LEU 98 CO 0.05 -0.06 1.08 -0.08 -1.06 0.00 0.00 176.35 176.28 2k5q h GLU 99 N 6.27 0.51 -1.94 1.48 4.81 -2.06 -3.51 114.58 120.14 2k5q h GLU 99 Ca -0.29 -0.78 0.23 0.00 -0.13 0.00 0.00 59.36 58.39 2k5q h GLU 99 Cb 1.19 0.28 -0.07 0.00 0.63 0.00 0.00 28.75 30.77 2k5q h GLU 99 CO 0.44 1.36 -0.40 0.72 -0.73 0.00 0.00 179.01 180.40 2k5q n HIS 100 N -3.71 -2.18 -3.83 0.92 8.25 -1.26 -4.86 115.22 108.55 2k5q n HIS 100 Ca -0.14 1.11 -0.30 0.00 -0.26 0.00 0.00 57.72 58.13 2k5q n HIS 100 Cb 1.03 -1.98 -0.15 0.00 1.12 0.00 0.00 29.99 30.02 2k5q n HIS 100 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2k5q s HIS 101 N -2.15 2.45 -0.19 4.41 2.46 -1.26 -5.09 115.29 115.92 2k5q s HIS 101 Ca 0.00 -2.21 -0.32 0.00 0.47 0.00 0.00 55.06 53.00 2k5q s HIS 101 Cb 0.00 -2.15 -0.09 0.00 -0.13 0.00 0.00 32.58 30.21 2k5q s HIS 101 CO 0.00 -0.90 2.09 1.58 -2.47 0.00 0.00 174.74 175.04 2k5q n HIS 102 N 4.60 2.03 -2.45 3.88 -0.00 -1.26 -4.93 115.22 117.09 2k5q n HIS 102 Ca 0.00 -0.01 -0.37 0.00 -0.00 0.00 0.00 57.72 57.34 2k5q n HIS 102 Cb 0.42 -2.67 -0.03 0.00 -0.00 0.00 0.00 29.99 27.71 2k5q n HIS 102 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2k5q s HIS 103 N 6.46 3.19 -0.11 1.57 -3.43 -1.26 -5.05 115.29 116.66 2k5q s HIS 103 Ca 1.00 1.62 -0.04 0.00 -0.80 0.00 0.00 55.06 56.83 2k5q s HIS 103 Cb -0.58 -3.22 -0.04 0.00 -1.43 0.00 0.00 32.58 27.31 2k5q s HIS 103 CO 0.44 -0.88 0.04 -1.58 -2.00 0.00 0.00 174.74 170.77 2k5q s HIS 104 N -1.56 3.28 0.00 0.38 5.04 -1.26 -5.35 115.29 115.81 2k5q s HIS 104 Ca 0.58 0.23 0.00 0.00 -1.54 0.00 0.00 55.06 54.33 2k5q s HIS 104 Cb -0.25 -1.88 0.00 0.00 0.04 0.00 0.00 32.58 30.48 2k5q s HIS 104 CO 0.31 0.46 0.29 1.58 -2.34 0.00 0.00 174.74 175.04