#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qba n GLN 3 N 0.00 -3.35 -0.66 0.38 7.27 -1.26 -4.74 117.38 115.03 2qba n GLN 3 Ca 0.00 2.74 -0.32 0.00 0.07 0.00 0.00 57.00 59.49 2qba n GLN 3 Cb 0.00 -3.92 0.17 0.00 2.41 0.00 0.00 30.24 28.90 2qba n GLN 3 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 2qba n GLU 4 N -4.37 -1.71 0.00 3.69 -0.58 -1.26 -4.55 120.64 111.85 2qba n GLU 4 Ca -0.09 -0.49 0.00 0.00 -0.42 0.00 0.00 57.16 56.16 2qba n GLU 4 Cb 0.69 -1.68 0.00 0.00 -0.57 0.00 0.00 31.44 29.87 2qba n GLU 4 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2qba n GLN 5 N -2.10 0.00 -1.42 3.49 1.13 0.33 -4.92 117.38 113.90 2qba n GLN 5 Ca 0.01 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 2qba n GLN 5 Cb 0.61 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.96 2qba n GLN 5 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 2qba n THR 6 N 0.00 -4.84 -3.89 5.09 -1.04 -1.26 -2.16 114.28 106.18 2qba n THR 6 Ca 0.00 2.13 -0.35 0.00 -2.04 0.00 0.00 64.05 63.79 2qba n THR 6 Cb 0.00 -2.94 -0.14 0.00 -1.82 0.00 0.00 70.33 65.43 2qba n THR 6 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 2qba s MET 7 N -3.87 2.83 -0.09 -2.82 -1.94 -1.26 -2.65 119.30 109.49 2qba s MET 7 Ca 0.00 -1.00 -0.01 0.00 -1.71 0.00 0.00 55.69 52.97 2qba s MET 7 Cb 0.00 -3.14 -0.03 0.00 2.01 0.00 0.00 34.83 33.67 2qba s MET 7 CO 0.00 -0.46 -0.05 -0.51 -0.01 0.00 0.00 175.02 174.00 2qba s LEU 8 N 1.36 3.27 0.54 -0.03 1.02 -0.95 -4.92 118.68 118.98 2qba s LEU 8 Ca -0.00 -0.01 -0.18 0.00 0.02 0.00 0.00 54.13 53.96 2qba s LEU 8 Cb -0.17 -1.74 -0.06 0.00 0.02 0.00 0.00 46.19 44.24 2qba s LEU 8 CO -0.02 0.32 1.04 0.20 0.02 0.00 0.00 176.35 177.92 2qba s ASN 9 N -0.55 6.11 -0.28 2.29 0.01 -1.24 -2.76 114.94 118.52 2qba s ASN 9 Ca 0.08 1.85 -0.22 0.00 -0.71 0.00 0.00 52.86 53.87 2qba s ASN 9 Cb -0.12 -2.54 -0.01 0.00 0.41 0.00 0.00 41.25 38.99 2qba s ASN 9 CO 0.02 -0.94 0.71 -0.69 -1.51 0.00 0.00 177.10 174.69 2qba s VAL 10 N -2.24 4.89 -2.12 1.60 1.01 -1.26 -0.55 120.40 121.74 2qba s VAL 10 Ca 0.65 1.18 0.28 0.00 0.00 0.00 0.00 61.98 64.09 2qba s VAL 10 Cb -0.16 -4.04 0.73 0.00 0.00 0.00 0.00 36.38 32.91 2qba s VAL 10 CO 0.28 -0.10 1.99 0.00 0.00 0.00 0.00 175.10 177.27 2qba n ALA 11 N 5.94 2.64 -2.48 5.51 0.00 0.24 -4.80 120.51 127.56 2qba n ALA 11 Ca 0.02 -0.25 -0.23 0.00 0.00 0.00 0.00 53.44 52.98 2qba n ALA 11 Cb 0.48 -1.38 -0.11 0.00 0.00 0.00 0.00 19.45 18.45 2qba n ALA 11 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2qba s ASP 12 N -1.89 2.77 0.82 0.00 1.47 -1.26 0.15 116.67 118.72 2qba s ASP 12 Ca 0.41 -1.33 -0.10 0.00 1.18 0.00 0.00 52.55 52.71 2qba s ASP 12 Cb 0.20 -0.17 0.12 0.00 -0.34 0.00 0.00 42.92 42.73 2qba s ASP 12 CO 0.33 -0.51 1.15 0.54 0.68 0.00 0.00 175.17 177.35 2qba s ASN 13 N -3.52 4.10 0.18 2.11 2.20 -1.24 -4.67 114.94 114.10 2qba s ASN 13 Ca 0.35 0.33 0.00 0.00 -0.94 0.00 0.00 52.86 52.59 2qba s ASN 13 Cb 0.08 -0.70 0.00 0.00 -2.00 0.00 0.00 41.25 38.63 2qba s ASN 13 CO 0.15 -2.09 0.00 -1.54 -2.94 0.00 0.00 177.10 170.68 2qba n SER 14 N -3.28 -6.55 -3.65 3.54 3.41 -1.26 -4.58 113.62 101.26 2qba n SER 14 Ca 0.12 0.86 -0.24 0.00 -0.26 0.00 0.00 58.87 59.34 2qba n SER 14 Cb 0.60 -3.23 0.07 0.00 -0.26 0.00 0.00 64.21 61.39 2qba n SER 14 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qba n GLY 15 N 0.72 -0.51 0.00 5.00 0.00 -1.24 -4.70 105.19 104.46 2qba n GLY 15 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2qba n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qba n ALA 16 N -4.82 0.00 -1.09 4.61 0.00 -1.26 -4.30 120.51 113.64 2qba n ALA 16 Ca -0.03 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.52 2qba n ALA 16 Cb 0.57 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.97 2qba n ALA 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qba n ARG 17 N 0.00 -1.98 -0.86 0.00 5.12 -1.26 -1.81 116.66 115.86 2qba n ARG 17 Ca 0.00 1.53 -0.32 0.00 -1.93 0.00 0.00 57.85 57.13 2qba n ARG 17 Cb 0.00 -2.55 -0.03 0.00 -1.16 0.00 0.00 32.46 28.72 2qba n ARG 17 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2qba n ARG 18 N -3.56 0.00 -3.74 5.56 1.74 -1.26 -4.34 116.66 111.05 2qba n ARG 18 Ca -0.04 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.92 2qba n ARG 18 Cb 0.56 -0.75 -0.13 0.00 -1.02 0.00 0.00 32.46 31.11 2qba n ARG 18 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2qba s VAL 19 N -0.27 -0.04 0.08 1.55 -7.23 -1.11 -1.86 120.40 111.52 2qba s VAL 19 Ca 0.47 0.13 -0.13 0.00 -1.81 0.00 0.00 61.98 60.63 2qba s VAL 19 Cb -0.66 -0.36 -0.06 0.00 0.56 0.00 0.00 36.38 35.86 2qba s VAL 19 CO 0.33 0.05 0.46 -0.32 -0.31 0.00 0.00 175.10 175.32 2qba s MET 20 N 1.10 3.90 -0.26 4.82 1.75 -0.99 -2.23 119.30 127.39 2qba s MET 20 Ca -0.08 0.38 -0.22 0.00 -1.25 0.00 0.00 55.69 54.52 2qba s MET 20 Cb -0.09 -3.06 -0.01 0.00 2.84 0.00 0.00 34.83 34.50 2qba s MET 20 CO -0.07 0.58 0.70 0.00 -0.65 0.00 0.00 175.02 175.57 2qba n ILE 22 N 5.24 0.87 0.00 0.00 -5.35 0.92 -0.51 119.36 120.53 2qba n ILE 22 Ca 0.01 -0.93 0.00 0.00 -0.27 0.00 0.00 62.75 61.56 2qba n ILE 22 Cb 0.48 0.62 0.00 0.00 -1.74 0.00 0.00 39.64 39.00 2qba n ILE 22 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 2qba n LYS 23 N 1.19 0.00 -3.75 6.28 3.00 -1.14 -4.88 118.16 118.86 2qba n LYS 23 Ca 0.18 0.00 -0.36 0.00 -0.00 0.00 0.00 58.31 58.13 2qba n LYS 23 Cb 0.54 0.00 -0.11 0.00 0.00 0.00 0.00 35.03 35.46 2qba n LYS 23 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2qba s VAL 24 N -1.87 3.47 0.41 3.15 1.01 -1.26 -1.71 120.40 123.59 2qba s VAL 24 Ca 0.00 -2.52 -0.25 0.00 0.00 0.00 0.00 61.98 59.21 2qba s VAL 24 Cb 0.00 -3.32 -0.08 0.00 0.00 0.00 0.00 36.38 32.97 2qba s VAL 24 CO 0.00 -0.78 1.25 -0.76 0.00 0.00 0.00 175.10 174.80 2qba s LEU 25 N 0.53 4.19 0.00 3.92 1.43 -1.23 -4.70 118.68 122.83 2qba s LEU 25 Ca 0.13 2.52 0.00 0.00 -1.03 0.00 0.00 54.13 55.75 2qba s LEU 25 Cb -0.22 -3.97 0.00 0.00 0.03 0.00 0.00 46.19 42.03 2qba s LEU 25 CO -0.04 -0.80 0.00 0.61 0.23 0.00 0.00 176.35 176.35 2qba n GLY 26 N 0.66 0.45 0.00 -3.19 0.00 -1.26 -4.76 105.19 97.09 2qba n GLY 26 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2qba n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qba n GLY 27 N 0.00 1.35 3.80 -0.02 0.00 -1.26 -4.81 105.19 104.24 2qba n GLY 27 Ca 0.00 -2.12 -0.36 0.00 0.00 0.00 0.00 46.02 43.54 2qba n GLY 27 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qba s SER 28 N 0.00 7.17 0.00 1.61 0.15 -1.26 -3.78 113.70 117.59 2qba s SER 28 Ca 0.00 1.65 0.00 0.00 0.70 0.00 0.00 55.95 58.30 2qba s SER 28 Cb 0.00 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 2qba s SER 28 CO 0.00 -0.08 0.00 1.41 1.20 0.00 0.00 173.24 175.77 2qba n HIS 29 N 0.42 0.00 -1.53 3.44 8.25 -1.26 -4.85 115.22 119.69 2qba n HIS 29 Ca 0.01 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.07 2qba n HIS 29 Cb 0.51 -1.89 -0.06 0.00 1.12 0.00 0.00 29.99 29.67 2qba n HIS 29 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 2qba n ARG 30 N 0.34 0.88 0.00 -0.41 0.63 -1.25 -4.87 116.66 111.99 2qba n ARG 30 Ca 0.00 0.08 0.00 0.00 -0.92 0.00 0.00 57.85 57.01 2qba n ARG 30 Cb 0.39 -2.83 0.00 0.00 0.45 0.00 0.00 32.46 30.47 2qba n ARG 30 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2qba n ARG 31 N 8.74 0.00 -4.17 -0.14 5.12 -1.26 -4.80 116.66 120.15 2qba n ARG 31 Ca 0.44 0.06 -0.26 0.00 -1.93 0.00 0.00 57.85 56.16 2qba n ARG 31 Cb 0.37 -0.63 -0.07 0.00 -1.16 0.00 0.00 32.46 30.97 2qba n ARG 31 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 2qba s TYR 32 N -0.27 2.43 -0.12 -1.55 2.02 -1.26 -4.11 117.35 114.50 2qba s TYR 32 Ca 0.00 -0.65 -0.06 0.00 -0.37 0.00 0.00 57.07 55.99 2qba s TYR 32 Cb 0.00 -1.92 0.05 0.00 -0.40 0.00 0.00 41.96 39.69 2qba s TYR 32 CO 0.00 0.13 0.27 0.00 -1.57 0.00 0.00 175.55 174.38 2qba s ALA 33 N -2.65 -0.63 0.00 3.71 0.00 -1.26 -4.78 121.76 116.15 2qba s ALA 33 Ca 0.37 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.40 2qba s ALA 33 Cb 0.03 -0.73 0.00 0.00 0.00 0.00 0.00 23.12 22.42 2qba s ALA 33 CO 0.21 -0.27 0.00 0.41 0.00 0.00 0.00 175.76 176.11 2qba n GLY 34 N 4.39 5.36 4.55 0.00 0.00 -1.26 -2.31 105.19 115.92 2qba n GLY 34 Ca -0.23 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 44.94 2qba n GLY 34 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2qba n VAL 35 N 0.00 0.00 -2.88 1.61 0.24 -1.26 -1.78 118.33 114.26 2qba n VAL 35 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.18 2qba n VAL 35 Cb 0.00 0.00 0.04 0.00 -1.47 0.00 0.00 33.84 32.41 2qba n VAL 35 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qba n GLY 36 N 0.00 1.27 3.85 7.63 0.00 -1.22 -4.13 105.19 112.59 2qba n GLY 36 Ca 0.00 -0.45 -0.22 0.00 0.00 0.00 0.00 46.02 45.35 2qba n GLY 36 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qba s ASP 37 N -1.59 4.91 -0.18 1.61 1.01 -0.73 -4.82 116.67 116.87 2qba s ASP 37 Ca 0.30 -0.83 -0.08 0.00 0.71 0.00 0.00 52.55 52.65 2qba s ASP 37 Cb 0.27 -0.53 -0.04 0.00 1.01 0.00 0.00 42.92 43.63 2qba s ASP 37 CO -0.12 -0.64 0.09 -0.63 0.21 0.00 0.00 175.17 174.08 2qba s ILE 38 N -2.51 5.07 0.02 0.77 -1.09 -1.26 -1.73 121.20 120.47 2qba s ILE 38 Ca 0.46 0.06 0.00 0.00 -2.23 0.00 0.00 60.65 58.95 2qba s ILE 38 Cb -0.02 -3.28 -0.02 0.00 -1.58 0.00 0.00 42.46 37.57 2qba s ILE 38 CO 0.27 0.48 -0.02 0.27 -1.23 0.00 0.00 174.94 174.70 2qba s ILE 39 N 0.16 0.09 -0.03 2.92 -0.00 -0.68 -3.52 121.20 120.13 2qba s ILE 39 Ca 0.07 -0.70 -0.30 0.00 -0.00 0.00 0.00 60.65 59.71 2qba s ILE 39 Cb -0.12 -0.20 -0.04 0.00 -0.00 0.00 0.00 42.46 42.10 2qba s ILE 39 CO -0.00 -0.39 1.27 -0.75 -0.00 0.00 0.00 174.94 175.07 2qba s LYS 40 N -1.13 4.33 0.33 0.37 2.47 -0.69 -1.52 119.74 123.90 2qba s LYS 40 Ca -0.12 1.77 0.10 0.00 -1.56 0.00 0.00 55.97 56.16 2qba s LYS 40 Cb -0.08 -3.56 -0.06 0.00 -1.46 0.00 0.00 37.83 32.68 2qba s LYS 40 CO -0.01 -0.49 -0.11 -1.50 0.16 0.00 0.00 175.35 173.41 2qba s ILE 41 N 2.25 2.37 -0.29 5.43 1.10 -0.16 -0.05 121.20 131.85 2qba s ILE 41 Ca 0.59 -2.23 -0.04 0.00 -0.51 0.00 0.00 60.65 58.46 2qba s ILE 41 Cb -0.27 -2.58 0.10 0.00 0.15 0.00 0.00 42.46 39.86 2qba s ILE 41 CO 0.24 -0.26 0.14 -0.89 -2.11 0.00 0.00 174.94 172.06 2qba s THR 42 N -2.57 -0.09 -0.34 4.00 2.01 0.17 -1.51 115.64 117.31 2qba s THR 42 Ca 0.32 -0.73 -0.40 0.00 0.31 0.00 0.00 61.69 61.19 2qba s THR 42 Cb 0.00 -0.97 -0.16 0.00 0.01 0.00 0.00 72.50 71.39 2qba s THR 42 CO 0.16 -0.70 1.84 -0.38 -0.69 0.00 0.00 174.62 174.86 2qba n ILE 43 N 5.25 0.23 0.19 1.82 5.41 0.13 -2.35 119.36 130.04 2qba n ILE 43 Ca -0.06 -0.08 0.06 0.00 1.00 0.00 0.00 62.75 63.68 2qba n ILE 43 Cb 0.42 -1.16 0.11 0.00 -0.71 0.00 0.00 39.64 38.31 2qba n ILE 43 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2qba n LYS 44 N 5.93 1.76 0.00 0.38 4.76 -1.15 -1.13 118.16 128.71 2qba n LYS 44 Ca 0.32 -1.68 0.00 0.00 -2.87 0.00 0.00 58.31 54.08 2qba n LYS 44 Cb 0.11 -1.28 0.00 0.00 -1.84 0.00 0.00 35.03 32.02 2qba n LYS 44 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2qba n GLU 45 N 0.70 0.00 -1.58 1.97 -0.58 -0.78 -4.92 120.64 115.46 2qba n GLU 45 Ca 0.10 0.00 0.04 0.00 -0.42 0.00 0.00 57.16 56.88 2qba n GLU 45 Cb 0.38 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 31.23 2qba n GLU 45 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2qba n ALA 46 N -1.86 -2.41 -2.07 0.62 0.00 -0.75 -4.43 120.51 109.62 2qba n ALA 46 Ca 0.00 0.60 -0.28 0.00 0.00 0.00 0.00 53.44 53.76 2qba n ALA 46 Cb 0.00 -1.51 0.02 0.00 0.00 0.00 0.00 19.45 17.96 2qba n ALA 46 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2qba s ILE 47 N -5.21 4.05 0.14 0.00 2.07 -1.26 -4.75 121.20 116.24 2qba s ILE 47 Ca 0.00 0.23 -0.23 0.00 -1.41 0.00 0.00 60.65 59.24 2qba s ILE 47 Cb 0.00 -3.60 0.00 0.00 0.13 0.00 0.00 42.46 38.99 2qba s ILE 47 CO 0.00 -0.66 1.64 1.55 -1.91 0.00 0.00 174.94 175.55 2qba h PRO 48 N -0.17 -0.27 0.00 3.50 0.13 -1.98 -3.39 132.00 129.81 2qba h PRO 48 Ca -0.46 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2qba h PRO 48 Cb 1.24 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2qba h PRO 48 CO 0.62 -0.18 0.00 0.54 -0.23 0.00 0.00 178.00 178.75 2qba n ARG 49 N -5.37 0.00 0.00 0.86 1.74 -1.26 -5.01 116.66 107.63 2qba n ARG 49 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 2qba n ARG 49 Cb 0.28 -0.09 0.00 0.00 -1.02 0.00 0.00 32.46 31.63 2qba n ARG 49 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qba n GLY 50 N 2.81 0.81 0.00 -0.13 0.00 -1.26 -4.50 105.19 102.92 2qba n GLY 50 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.23 2qba n GLY 50 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2qba n LYS 51 N 0.00 0.62 -3.52 1.61 4.81 -1.26 -4.90 118.16 115.52 2qba n LYS 51 Ca 0.00 -0.18 -0.27 0.00 -0.87 0.00 0.00 58.31 56.99 2qba n LYS 51 Cb 0.00 -0.61 -0.14 0.00 0.02 0.00 0.00 35.03 34.30 2qba n LYS 51 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 2qba s VAL 52 N -0.14 -0.10 0.88 3.15 -7.23 -1.26 -4.96 120.40 110.74 2qba s VAL 52 Ca 0.00 -0.78 -0.12 0.00 -1.81 0.00 0.00 61.98 59.27 2qba s VAL 52 Cb 0.00 -0.99 0.12 0.00 0.56 0.00 0.00 36.38 36.07 2qba s VAL 52 CO 0.00 -0.71 1.10 -1.59 -0.31 0.00 0.00 175.10 173.59 2qba s LYS 53 N 2.07 1.39 1.13 4.82 0.00 -1.26 -3.66 119.74 124.23 2qba s LYS 53 Ca 0.10 0.64 -0.14 0.00 0.00 0.00 0.00 55.97 56.57 2qba s LYS 53 Cb -0.16 -1.84 0.23 0.00 0.00 0.00 0.00 37.83 36.06 2qba s LYS 53 CO -0.34 -2.10 0.81 0.36 0.00 0.00 0.00 175.35 174.08 2qba n LYS 54 N -3.76 -1.99 -0.89 1.78 0.00 -1.26 -3.36 118.16 108.68 2qba n LYS 54 Ca 0.07 -0.55 0.00 0.00 -0.00 0.00 0.00 58.31 57.83 2qba n LYS 54 Cb 0.56 -2.09 0.00 0.00 -0.00 0.00 0.00 35.03 33.50 2qba n LYS 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2qba n GLY 55 N 1.14 0.45 3.80 2.58 0.00 -0.29 -4.99 105.19 107.89 2qba n GLY 55 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 2qba n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qba s ASP 56 N -2.31 7.16 -0.23 1.61 1.01 -1.21 -4.87 116.67 117.81 2qba s ASP 56 Ca 0.00 1.53 0.02 0.00 0.71 0.00 0.00 52.55 54.81 2qba s ASP 56 Cb 0.00 -2.46 0.04 0.00 1.01 0.00 0.00 42.92 41.51 2qba s ASP 56 CO 0.00 0.04 -0.14 -0.69 0.21 0.00 0.00 175.17 174.59 2qba s VAL 57 N -1.49 2.19 0.00 -1.27 1.01 -1.26 -0.69 120.40 118.89 2qba s VAL 57 Ca 0.43 -1.36 0.00 0.00 0.00 0.00 0.00 61.98 61.05 2qba s VAL 57 Cb -0.18 -2.16 0.00 0.00 0.00 0.00 0.00 36.38 34.05 2qba s VAL 57 CO 0.22 0.18 0.00 0.00 0.00 0.00 0.00 175.10 175.50 2qba n LEU 58 N 4.51 0.00 -3.95 3.92 -0.00 -0.57 -4.98 117.00 115.93 2qba n LEU 58 Ca -0.17 0.00 -0.10 0.00 -0.00 0.00 0.00 56.01 55.75 2qba n LEU 58 Cb 0.45 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.77 2qba n LEU 58 CO 0.23 0.00 -0.29 -1.59 -0.00 0.00 0.00 177.39 175.74 2qba s LYS 59 N 3.93 0.41 0.19 1.47 -2.85 -1.26 -0.99 119.74 120.64 2qba s LYS 59 Ca 0.00 -0.60 -0.03 0.00 -1.00 0.00 0.00 55.97 54.34 2qba s LYS 59 Cb 0.00 0.15 -0.03 0.00 -2.06 0.00 0.00 37.83 35.89 2qba s LYS 59 CO 0.00 -0.08 0.16 0.00 0.10 0.00 0.00 175.35 175.53 2qba s ALA 60 N -1.70 0.88 -0.27 0.59 0.00 -0.57 -0.98 121.76 119.71 2qba s ALA 60 Ca -0.13 -1.52 -0.02 0.00 0.00 0.00 0.00 51.96 50.29 2qba s ALA 60 Cb -0.07 1.22 0.03 0.00 0.00 0.00 0.00 23.12 24.30 2qba s ALA 60 CO -0.01 -0.60 -0.04 0.14 0.00 0.00 0.00 175.76 175.25 2qba s VAL 61 N -4.11 2.93 0.01 0.00 -7.23 -0.11 -1.68 120.40 110.20 2qba s VAL 61 Ca 0.33 -1.14 -0.31 0.00 -1.81 0.00 0.00 61.98 59.05 2qba s VAL 61 Cb 0.06 -2.56 -0.10 0.00 0.56 0.00 0.00 36.38 34.35 2qba s VAL 61 CO 0.09 0.09 1.95 0.52 -0.31 0.00 0.00 175.10 177.45 2qba n VAL 62 N 4.66 0.73 -0.13 1.32 0.31 -0.70 -1.85 118.33 122.67 2qba n VAL 62 Ca -0.15 -0.13 -0.22 0.00 -0.01 0.00 0.00 64.34 63.83 2qba n VAL 62 Cb 0.46 -2.22 -0.10 0.00 -0.91 0.00 0.00 33.84 31.07 2qba n VAL 62 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2qba n VAL 63 N 5.45 1.41 -4.23 2.52 0.31 -0.60 -3.40 118.33 119.79 2qba n VAL 63 Ca 0.21 -0.46 -0.22 0.00 -0.01 0.00 0.00 64.34 63.86 2qba n VAL 63 Cb 0.38 -1.58 -0.17 0.00 -0.91 0.00 0.00 33.84 31.56 2qba n VAL 63 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2qba s ARG 64 N -2.48 1.12 0.16 5.55 3.00 -0.93 -4.63 118.95 120.74 2qba s ARG 64 Ca -0.34 -0.19 0.08 0.00 0.00 0.00 0.00 55.73 55.28 2qba s ARG 64 Cb 0.11 -1.08 -0.04 0.00 0.00 0.00 0.00 34.95 33.94 2qba s ARG 64 CO 0.51 -0.09 -0.18 0.95 0.00 0.00 0.00 175.30 176.50 2qba s THR 65 N 1.00 1.76 0.22 0.02 -4.23 -1.26 -0.36 115.64 112.78 2qba s THR 65 Ca -0.09 -1.87 0.10 0.00 -1.18 0.00 0.00 61.69 58.65 2qba s THR 65 Cb -0.14 -1.79 -0.06 0.00 1.34 0.00 0.00 72.50 71.85 2qba s THR 65 CO -0.00 -0.31 1.53 0.11 -0.54 0.00 0.00 174.62 175.42 2qba h LYS 66 N 3.34 0.00 0.00 3.99 1.57 -1.85 -2.71 116.57 120.91 2qba h LYS 66 Ca -0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 2qba h LYS 66 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.51 2qba h LYS 66 CO 0.50 0.69 0.00 -0.22 -0.57 0.00 0.00 179.45 179.85 2qba h LYS 67 N 0.00 0.00 0.00 3.15 3.11 -1.95 -3.43 116.57 117.45 2qba h LYS 67 Ca -0.01 0.00 0.11 0.00 -2.81 0.00 0.00 60.65 57.95 2qba h LYS 67 Cb 1.25 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 32.46 2qba h LYS 67 CO 0.09 0.00 -0.15 0.41 -2.81 0.00 0.00 179.45 176.99 2qba n GLY 68 N -0.74 -1.75 3.04 5.01 0.00 -1.03 -4.89 105.19 104.83 2qba n GLY 68 Ca -0.00 -1.25 -0.13 0.00 0.00 0.00 0.00 46.02 44.64 2qba n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qba s VAL 69 N -0.85 -0.00 0.07 1.61 1.01 0.25 -4.79 120.40 117.70 2qba s VAL 69 Ca 0.00 0.01 0.05 0.00 0.00 0.00 0.00 61.98 62.04 2qba s VAL 69 Cb 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 36.38 36.11 2qba s VAL 69 CO 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 175.10 174.97 2qba s ARG 70 N 0.17 0.80 0.25 2.72 1.70 -1.26 -1.03 118.95 122.29 2qba s ARG 70 Ca -0.01 -0.94 0.12 0.00 -0.47 0.00 0.00 55.73 54.43 2qba s ARG 70 Cb -0.02 -0.79 -0.05 0.00 -0.57 0.00 0.00 34.95 33.53 2qba s ARG 70 CO -0.00 0.17 -0.19 1.03 -1.08 0.00 0.00 175.30 175.23 2qba s ARG 71 N -1.72 1.69 0.00 3.89 1.81 -1.19 -4.98 118.95 118.45 2qba s ARG 71 Ca -0.03 -1.66 0.00 0.00 -1.72 0.00 0.00 55.73 52.32 2qba s ARG 71 Cb -0.10 -1.83 0.00 0.00 -0.45 0.00 0.00 34.95 32.57 2qba s ARG 71 CO 0.02 0.35 0.00 -2.30 -0.68 0.00 0.00 175.30 172.70 2qba n PRO 72 N -0.38 0.00 0.14 3.54 -0.02 -1.26 0.54 135.00 137.56 2qba n PRO 72 Ca -0.07 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.51 2qba n PRO 72 Cb 0.59 0.00 0.17 0.00 -0.02 0.00 0.00 33.50 34.24 2qba n PRO 72 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 2qba h ASP 73 N 0.00 0.00 0.00 2.55 2.03 -2.06 -3.43 116.42 115.51 2qba h ASP 73 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2qba h ASP 73 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 2qba h ASP 73 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.82 2qba n GLY 74 N -1.57 2.95 3.50 7.15 0.00 0.19 -5.05 105.19 112.36 2qba n GLY 74 Ca 0.08 -0.48 -0.39 0.00 0.00 0.00 0.00 46.02 45.23 2qba n GLY 74 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qba n SER 75 N 0.48 -0.53 -4.33 1.61 3.41 -1.26 -4.68 113.62 108.33 2qba n SER 75 Ca 0.00 0.82 -0.17 0.00 -0.26 0.00 0.00 58.87 59.25 2qba n SER 75 Cb 0.00 -1.21 -0.10 0.00 -0.26 0.00 0.00 64.21 62.64 2qba n SER 75 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2qba s VAL 76 N -1.59 1.36 -0.07 -3.33 1.01 -1.26 -3.19 120.40 113.33 2qba s VAL 76 Ca 0.68 -2.10 -0.01 0.00 0.00 0.00 0.00 61.98 60.54 2qba s VAL 76 Cb -0.49 -2.14 0.03 0.00 0.00 0.00 0.00 36.38 33.79 2qba s VAL 76 CO 0.55 -0.52 0.01 0.27 0.00 0.00 0.00 175.10 175.41 2qba s ILE 77 N -3.21 0.30 -0.17 2.22 -4.36 -0.20 -4.95 121.20 110.83 2qba s ILE 77 Ca 0.23 0.17 -0.01 0.00 -0.26 0.00 0.00 60.65 60.78 2qba s ILE 77 Cb 0.03 -0.47 0.05 0.00 1.25 0.00 0.00 42.46 43.32 2qba s ILE 77 CO 0.06 0.25 -0.02 0.00 0.24 0.00 0.00 174.94 175.47 2qba s ARG 78 N 1.97 1.14 -0.45 0.37 1.70 -1.26 -0.58 118.95 121.83 2qba s ARG 78 Ca 0.04 -0.46 -0.29 0.00 -0.47 0.00 0.00 55.73 54.55 2qba s ARG 78 Cb -0.12 -1.97 0.02 0.00 -0.57 0.00 0.00 34.95 32.31 2qba s ARG 78 CO -0.05 -0.49 1.18 -0.06 -1.08 0.00 0.00 175.30 174.81 2qba s PHE 79 N 1.71 2.77 -1.05 5.89 0.40 -1.19 -4.91 117.98 121.59 2qba s PHE 79 Ca 0.00 0.75 -0.26 0.00 -0.60 0.00 0.00 56.93 56.82 2qba s PHE 79 Cb -0.16 -4.35 -0.21 0.00 0.51 0.00 0.00 43.02 38.82 2qba s PHE 79 CO -0.07 -1.37 2.14 0.16 0.70 0.00 0.00 175.22 176.78 2qba s ASP 80 N 2.66 3.59 0.00 1.36 -4.77 -1.26 -3.77 116.67 114.48 2qba s ASP 80 Ca 0.50 -0.89 0.00 0.00 -3.30 0.00 0.00 52.55 48.86 2qba s ASP 80 Cb -0.09 -2.59 0.00 0.00 -1.09 0.00 0.00 42.92 39.15 2qba s ASP 80 CO 0.30 -4.55 0.00 0.61 0.70 0.00 0.00 175.17 172.24 2qba n GLY 81 N 6.22 2.70 3.63 2.12 0.00 -1.26 -5.05 105.19 113.55 2qba n GLY 81 Ca 0.42 -0.07 -0.30 0.00 0.00 0.00 0.00 46.02 46.07 2qba n GLY 81 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qba s ASN 82 N 0.00 2.46 -0.29 1.61 0.01 -1.26 -4.56 114.94 112.92 2qba s ASN 82 Ca 0.00 2.03 -0.35 0.00 -0.71 0.00 0.00 52.86 53.83 2qba s ASN 82 Cb 0.00 -2.51 0.17 0.00 0.41 0.00 0.00 41.25 39.33 2qba s ASN 82 CO 0.00 -3.36 1.38 0.00 -1.51 0.00 0.00 177.10 173.61 2qba s ALA 83 N -2.61 -2.17 0.34 0.60 0.00 0.51 -3.72 121.76 114.71 2qba s ALA 83 Ca 0.67 1.92 -0.11 0.00 0.00 0.00 0.00 51.96 54.43 2qba s ALA 83 Cb -0.23 -0.88 0.03 0.00 0.00 0.00 0.00 23.12 22.03 2qba s ALA 83 CO 0.60 -0.42 0.63 0.00 0.00 0.00 0.00 175.76 176.57 2qba s VAL 85 N -2.98 0.90 1.05 0.00 1.01 -0.77 0.80 120.40 120.42 2qba s VAL 85 Ca 0.21 -0.23 -0.12 0.00 0.00 0.00 0.00 61.98 61.84 2qba s VAL 85 Cb -0.03 -0.93 0.22 0.00 0.00 0.00 0.00 36.38 35.64 2qba s VAL 85 CO 0.13 0.34 1.07 -0.76 0.00 0.00 0.00 175.10 175.89 2qba s LEU 86 N 1.57 1.62 -0.22 3.92 1.43 -1.26 -0.93 118.68 124.80 2qba s LEU 86 Ca 0.02 1.69 -0.27 0.00 -1.03 0.00 0.00 54.13 54.53 2qba s LEU 86 Cb -0.13 -3.81 0.11 0.00 0.03 0.00 0.00 46.19 42.39 2qba s LEU 86 CO -0.06 -3.64 0.94 -1.48 0.23 0.00 0.00 176.35 172.34 2qba s LEU 87 N -6.88 -0.49 0.02 1.79 2.34 -0.15 -3.61 118.68 111.69 2qba s LEU 87 Ca 0.67 0.81 -0.31 0.00 0.06 0.00 0.00 54.13 55.36 2qba s LEU 87 Cb -0.23 2.03 -0.16 0.00 -0.56 0.00 0.00 46.19 47.27 2qba s LEU 87 CO 0.61 -0.27 0.79 -3.20 -1.06 0.00 0.00 176.35 173.23 2qba n ASN 88 N 1.74 -0.14 0.00 1.48 4.05 -0.31 -4.09 115.26 117.99 2qba n ASN 88 Ca -0.13 0.92 0.00 0.00 0.45 0.00 0.00 54.58 55.82 2qba n ASN 88 Cb 0.56 -0.74 0.00 0.00 1.23 0.00 0.00 39.78 40.84 2qba n ASN 88 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 2qba n ASN 89 N 1.25 0.00 0.00 1.20 4.05 -1.26 -2.18 115.26 118.32 2qba n ASN 89 Ca 0.16 0.51 0.00 0.00 0.45 0.00 0.00 54.58 55.69 2qba n ASN 89 Cb 0.08 -0.28 0.00 0.00 1.23 0.00 0.00 39.78 40.81 2qba n ASN 89 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 177.26 173.75 2qba n ASN 90 N -1.35 0.00 -2.46 1.20 6.94 -1.26 -3.10 115.26 115.23 2qba n ASN 90 Ca 0.00 0.05 -0.03 0.00 -0.02 0.00 0.00 54.58 54.58 2qba n ASN 90 Cb 0.00 -0.05 0.08 0.00 -2.36 0.00 0.00 39.78 37.44 2qba n ASN 90 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 2qba n SER 91 N -0.87 -1.25 0.00 0.53 7.64 -1.25 -5.16 113.62 113.25 2qba n SER 91 Ca 0.00 -1.95 0.00 0.00 1.01 0.00 0.00 58.87 57.93 2qba n SER 91 Cb 0.04 0.71 0.00 0.00 -1.01 0.00 0.00 64.21 63.95 2qba n SER 91 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2qba n GLU 92 N -0.81 0.00 -1.67 1.43 -0.58 -0.93 -4.89 120.64 113.19 2qba n GLU 92 Ca -0.12 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.62 2qba n GLU 92 Cb 0.76 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.63 2qba n GLU 92 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2qba n GLN 93 N 0.00 -4.57 -0.96 3.49 1.13 -1.26 -3.46 117.38 111.76 2qba n GLN 93 Ca 0.00 3.48 -0.34 0.00 -1.94 0.00 0.00 57.00 58.20 2qba n GLN 93 Cb 0.00 -4.16 0.10 0.00 0.11 0.00 0.00 30.24 26.29 2qba n GLN 93 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 2qba n PRO 94 N -1.90 -0.08 -0.04 -1.09 -0.04 -1.26 -1.16 135.00 129.42 2qba n PRO 94 Ca 0.00 0.02 -0.02 0.00 -0.04 0.00 0.00 63.50 63.46 2qba n PRO 94 Cb 0.29 -1.79 -0.09 0.00 -0.04 0.00 0.00 33.50 31.86 2qba n PRO 94 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 2qba n ILE 95 N -3.13 0.56 -2.46 0.52 3.06 -1.24 -4.35 119.36 112.32 2qba n ILE 95 Ca 0.07 -0.43 -0.23 0.00 -2.50 0.00 0.00 62.75 59.67 2qba n ILE 95 Cb 0.52 -0.43 0.05 0.00 0.54 0.00 0.00 39.64 40.33 2qba n ILE 95 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 2qba s GLY 96 N -4.12 1.77 -0.21 4.50 0.00 -1.26 -5.03 107.32 102.97 2qba s GLY 96 Ca -0.05 -1.17 -0.20 0.00 0.00 0.00 0.00 44.72 43.29 2qba s GLY 96 CO 0.48 -0.83 0.15 -1.30 0.00 0.00 0.00 173.10 171.60 2qba n THR 97 N -2.60 1.55 -4.10 0.90 -2.24 -1.26 -4.98 114.28 101.55 2qba n THR 97 Ca 0.08 -0.10 -0.22 0.00 -2.27 0.00 0.00 64.05 61.54 2qba n THR 97 Cb 0.60 -2.00 -0.04 0.00 -2.10 0.00 0.00 70.33 66.78 2qba n THR 97 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2qba s ARG 98 N -2.39 2.97 -0.09 -0.78 1.81 -1.26 -5.08 118.95 114.13 2qba s ARG 98 Ca -0.30 -1.03 0.02 0.00 -1.72 0.00 0.00 55.73 52.71 2qba s ARG 98 Cb 0.07 -2.59 0.01 0.00 -0.45 0.00 0.00 34.95 31.99 2qba s ARG 98 CO 0.59 0.41 -0.15 0.42 -0.68 0.00 0.00 175.30 175.88 2qba s ILE 99 N -2.11 1.42 0.44 1.52 1.09 -1.26 -3.59 121.20 118.71 2qba s ILE 99 Ca 0.33 -0.63 0.03 0.00 -1.10 0.00 0.00 60.65 59.27 2qba s ILE 99 Cb -0.08 -1.28 0.00 0.00 -1.06 0.00 0.00 42.46 40.04 2qba s ILE 99 CO 0.25 0.42 0.64 -0.36 -0.10 0.00 0.00 174.94 175.79 2qba s PHE 100 N 0.72 3.09 0.60 3.97 0.40 0.39 -4.65 117.98 122.49 2qba s PHE 100 Ca -0.13 0.02 0.00 0.00 -0.60 0.00 0.00 56.93 56.22 2qba s PHE 100 Cb -0.16 -2.33 0.00 0.00 0.51 0.00 0.00 43.02 41.04 2qba s PHE 100 CO 0.03 -0.39 0.00 0.41 0.70 0.00 0.00 175.22 175.97 2qba n GLY 101 N -2.01 -3.90 3.77 4.36 0.00 -1.26 -4.79 105.19 101.36 2qba n GLY 101 Ca 0.03 -0.90 -0.33 0.00 0.00 0.00 0.00 46.02 44.81 2qba n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qba s PRO 102 N -5.13 2.90 0.00 1.61 0.04 -1.26 -4.62 135.00 128.53 2qba s PRO 102 Ca 0.00 1.44 0.00 0.00 0.04 0.00 0.00 61.00 62.48 2qba s PRO 102 Cb 0.00 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.58 2qba s PRO 102 CO 0.00 -1.18 0.00 1.33 0.04 0.00 0.00 177.00 177.19 2qba n VAL 103 N -2.21 0.00 -4.26 -0.36 0.24 -1.20 -4.83 118.33 105.72 2qba n VAL 103 Ca 0.11 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.27 2qba n VAL 103 Cb 0.52 -0.32 -0.10 0.00 -1.47 0.00 0.00 33.84 32.46 2qba n VAL 103 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2qba s THR 104 N 1.36 0.83 -1.21 3.34 -4.23 -1.00 -4.25 115.64 110.47 2qba s THR 104 Ca 0.00 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.74 2qba s THR 104 Cb 0.00 -2.09 0.30 0.00 1.34 0.00 0.00 72.50 72.05 2qba s THR 104 CO 0.00 -0.51 1.76 -2.11 -0.54 0.00 0.00 174.62 173.21 2qba n ARG 105 N -0.26 0.17 0.26 3.99 0.00 -1.19 -2.89 116.66 116.74 2qba n ARG 105 Ca -0.07 0.08 0.14 0.00 -0.00 0.00 0.00 57.85 58.01 2qba n ARG 105 Cb 0.63 -1.50 0.70 0.00 -0.00 0.00 0.00 32.46 32.29 2qba n ARG 105 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2qba h GLU 106 N 0.00 0.00 -0.15 2.89 3.07 -1.96 -2.24 114.58 116.20 2qba h GLU 106 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2qba h GLU 106 Cb 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 2qba h GLU 106 CO 0.00 0.10 0.00 1.28 -1.40 0.00 0.00 179.01 178.99 2qba n LEU 107 N -3.37 2.14 -0.39 1.33 4.32 -1.14 -4.26 117.00 115.62 2qba n LEU 107 Ca -0.01 -0.83 0.00 0.00 -0.02 0.00 0.00 56.01 55.15 2qba n LEU 107 Cb 0.29 -0.09 0.00 0.00 -1.62 0.00 0.00 43.42 42.00 2qba n LEU 107 CO 0.29 0.41 0.18 -2.11 -1.22 0.00 0.00 177.39 174.95 2qba n ARG 108 N 0.64 0.60 -2.22 3.23 1.85 -0.84 -4.04 116.66 115.87 2qba n ARG 108 Ca 0.17 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.64 2qba n ARG 108 Cb 0.43 -1.23 -0.01 0.00 -1.05 0.00 0.00 32.46 30.59 2qba n ARG 108 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2qba s SER 109 N -0.62 6.38 0.00 2.89 1.04 -1.26 -4.82 113.70 117.31 2qba s SER 109 Ca 0.00 2.41 0.00 0.00 0.48 0.00 0.00 55.95 58.84 2qba s SER 109 Cb 0.00 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.50 2qba s SER 109 CO 0.00 -0.78 0.07 -0.62 0.98 0.00 0.00 173.24 172.89 2qba n GLU 110 N -0.04 0.09 -0.03 4.02 4.71 -1.26 -1.47 120.64 126.65 2qba n GLU 110 Ca 0.05 0.00 -0.04 0.00 -0.01 0.00 0.00 57.16 57.16 2qba n GLU 110 Cb 0.46 -1.03 -0.04 0.00 -1.01 0.00 0.00 31.44 29.83 2qba n GLU 110 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2qba n LYS 111 N 0.03 1.30 -0.29 3.49 4.76 -1.26 -4.65 118.16 121.55 2qba n LYS 111 Ca 0.00 0.02 0.09 0.00 -2.87 0.00 0.00 58.31 55.55 2qba n LYS 111 Cb 0.01 -1.14 0.24 0.00 -1.84 0.00 0.00 35.03 32.30 2qba n LYS 111 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2qba n PHE 112 N -2.52 0.75 -0.32 2.13 0.99 -0.54 -4.66 117.46 113.29 2qba n PHE 112 Ca -0.11 -0.51 0.20 0.00 -0.00 0.00 0.00 57.45 57.03 2qba n PHE 112 Cb 0.65 -0.03 0.40 0.00 -1.00 0.00 0.00 39.48 39.51 2qba n PHE 112 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.76 177.28 2qba h MET 113 N 3.17 0.11 -1.05 -1.08 2.86 -1.52 0.18 114.93 117.60 2qba h MET 113 Ca 0.00 -0.01 0.27 0.00 -2.06 0.00 0.00 59.70 57.91 2qba h MET 113 Cb 0.89 -0.02 -0.09 0.00 0.06 0.00 0.00 31.60 32.43 2qba h MET 113 CO 0.01 0.07 0.68 -0.22 1.06 0.00 0.00 176.91 178.51 2qba h LYS 114 N 0.11 0.35 0.00 1.72 1.63 -1.89 -2.51 116.57 115.98 2qba h LYS 114 Ca 0.68 -0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 60.44 2qba h LYS 114 Cb 1.54 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 33.09 2qba h LYS 114 CO -0.76 0.23 -0.11 0.97 -3.45 0.00 0.00 179.45 176.34 2qba h ILE 115 N 0.36 1.39 0.00 2.00 2.10 -1.32 -3.30 117.51 118.73 2qba h ILE 115 Ca 0.59 -2.08 0.00 0.00 1.08 0.00 0.00 64.86 64.45 2qba h ILE 115 Cb 1.56 2.66 0.00 0.00 -1.09 0.00 0.00 36.82 39.95 2qba h ILE 115 CO -0.28 0.47 0.01 2.30 -1.08 0.00 0.00 178.15 179.57 2qba n ILE 116 N -4.63 1.87 -0.13 2.19 -6.64 -1.10 -1.81 119.36 109.12 2qba n ILE 116 Ca -0.10 0.53 -0.10 0.00 -1.77 0.00 0.00 62.75 61.30 2qba n ILE 116 Cb 0.41 -1.53 0.11 0.00 -1.44 0.00 0.00 39.64 37.19 2qba n ILE 116 CO 0.00 0.00 0.00 -1.54 -1.77 0.00 0.00 176.55 173.24 2qba n SER 117 N -1.57 3.40 -4.16 7.28 3.41 -0.96 -4.86 113.62 116.16 2qba n SER 117 Ca -0.00 -2.79 -0.29 0.00 -0.26 0.00 0.00 58.87 55.53 2qba n SER 117 Cb 0.01 -0.67 -0.17 0.00 -0.26 0.00 0.00 64.21 63.13 2qba n SER 117 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2qba s LEU 118 N -1.67 1.94 0.00 1.04 1.02 -0.75 -5.07 118.68 115.19 2qba s LEU 118 Ca 0.29 -0.47 0.00 0.00 0.02 0.00 0.00 54.13 53.98 2qba s LEU 118 Cb 0.24 -1.20 0.00 0.00 0.02 0.00 0.00 46.19 45.25 2qba s LEU 118 CO 0.06 0.12 0.00 0.00 0.02 0.00 0.00 176.35 176.56 2qba n ALA 119 N 3.56 0.00 0.00 4.21 0.00 -1.26 -4.47 120.51 122.55 2qba n ALA 119 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2qba n ALA 119 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2qba n ALA 119 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2qba n PRO 120 N 0.00 0.00 -1.72 0.00 -0.02 -1.26 -4.96 135.00 127.05 2qba n PRO 120 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2qba n PRO 120 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2qba n PRO 120 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2qba n GLU 121 N 0.00 0.00 0.00 -0.52 1.02 -1.26 -4.91 120.64 114.97 2qba n GLU 121 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2qba n GLU 121 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2qba n GLU 121 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59