#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbd n LYS 13 N 0.00 3.83 -2.40 2.89 5.02 -1.26 -5.12 118.16 121.12 2qbd n LYS 13 Ca 0.00 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.26 2qbd n LYS 13 Cb 0.00 -0.64 -0.02 0.00 -0.02 0.00 0.00 35.03 34.35 2qbd n LYS 13 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2qbd n GLN 14 N -0.50 -4.73 -0.05 1.97 1.13 -1.14 -5.00 117.38 109.06 2qbd n GLN 14 Ca 0.00 3.50 -0.05 0.00 -1.94 0.00 0.00 57.00 58.51 2qbd n GLN 14 Cb 0.02 -4.70 -0.07 0.00 0.11 0.00 0.00 30.24 25.60 2qbd n GLN 14 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2qbd n VAL 15 N 1.70 0.63 0.00 5.09 0.31 -0.85 -5.00 118.33 120.21 2qbd n VAL 15 Ca -0.19 -0.35 0.00 0.00 -0.01 0.00 0.00 64.34 63.80 2qbd n VAL 15 Cb 0.29 -0.80 0.00 0.00 -0.91 0.00 0.00 33.84 32.42 2qbd n VAL 15 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2qbd n SER 16 N -2.48 0.00 -3.21 4.52 7.64 -0.71 -4.77 113.62 114.62 2qbd n SER 16 Ca -0.16 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.76 2qbd n SER 16 Cb 0.77 -0.38 -0.02 0.00 -1.01 0.00 0.00 64.21 63.57 2qbd n SER 16 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2qbd s ASP 17 N -1.17 -0.65 0.00 6.43 -4.77 -1.25 0.19 116.67 115.46 2qbd s ASP 17 Ca 0.00 0.51 0.00 0.00 -3.30 0.00 0.00 52.55 49.76 2qbd s ASP 17 Cb 0.00 1.59 0.00 0.00 -1.09 0.00 0.00 42.92 43.42 2qbd s ASP 17 CO 0.00 -0.12 0.00 0.61 0.70 0.00 0.00 175.17 176.36 2qbd n GLY 18 N 5.34 4.95 3.09 2.12 0.00 -1.07 -4.41 105.19 115.21 2qbd n GLY 18 Ca -0.06 -1.07 -0.09 0.00 0.00 0.00 0.00 46.02 44.80 2qbd n GLY 18 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qbd s VAL 19 N 3.33 0.15 -0.18 1.61 -7.23 0.34 -1.93 120.40 116.49 2qbd s VAL 19 Ca 0.00 -1.25 0.01 0.00 -1.81 0.00 0.00 61.98 58.93 2qbd s VAL 19 Cb 0.00 -0.97 0.03 0.00 0.56 0.00 0.00 36.38 36.01 2qbd s VAL 19 CO 0.00 -0.69 -0.12 0.00 -0.31 0.00 0.00 175.10 173.98 2qbd s ALA 20 N -2.81 1.94 0.04 1.32 0.00 0.62 -0.91 121.76 121.96 2qbd s ALA 20 Ca -0.03 -1.09 -0.09 0.00 0.00 0.00 0.00 51.96 50.75 2qbd s ALA 20 Cb -0.00 -1.19 -0.05 0.00 0.00 0.00 0.00 23.12 21.87 2qbd s ALA 20 CO -0.06 -0.65 0.35 -1.01 0.00 0.00 0.00 175.76 174.39 2qbd s HIS 21 N 1.43 3.59 -0.17 0.00 3.76 -0.95 -0.14 115.29 122.82 2qbd s HIS 21 Ca 0.01 0.72 -0.01 0.00 -0.15 0.00 0.00 55.06 55.63 2qbd s HIS 21 Cb -0.15 -2.10 0.05 0.00 1.11 0.00 0.00 32.58 31.49 2qbd s HIS 21 CO -0.09 0.57 -0.02 0.42 -0.85 0.00 0.00 174.74 174.76 2qbd s ILE 22 N -1.33 0.90 -1.22 0.60 1.01 -0.39 -1.61 121.20 119.16 2qbd s ILE 22 Ca 0.30 -0.56 -0.13 0.00 0.00 0.00 0.00 60.65 60.26 2qbd s ILE 22 Cb -0.14 -1.17 0.18 0.00 0.01 0.00 0.00 42.46 41.34 2qbd s ILE 22 CO 0.17 0.04 1.50 1.57 0.00 0.00 0.00 174.94 178.22 2qbd n HIS 23 N 4.94 4.64 -1.90 3.97 -0.00 -0.43 -2.80 115.22 123.63 2qbd n HIS 23 Ca -0.11 -3.28 -0.39 0.00 0.46 0.00 0.00 57.72 54.40 2qbd n HIS 23 Cb 0.48 -2.13 -0.03 0.00 -0.12 0.00 0.00 29.99 28.19 2qbd n HIS 23 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2qbd n ALA 24 N 5.21 3.56 -2.27 1.57 0.00 -0.92 -3.42 120.51 124.23 2qbd n ALA 24 Ca 0.37 -3.52 -0.39 0.00 0.00 0.00 0.00 53.44 49.90 2qbd n ALA 24 Cb 0.41 -3.57 -0.06 0.00 0.00 0.00 0.00 19.45 16.24 2qbd n ALA 24 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2qbd s SER 25 N 4.71 7.07 0.57 0.00 1.04 -0.35 -2.68 113.70 124.06 2qbd s SER 25 Ca 0.57 1.27 0.13 0.00 0.48 0.00 0.00 55.95 58.39 2qbd s SER 25 Cb 0.08 -2.36 0.69 0.00 0.10 0.00 0.00 66.02 64.52 2qbd s SER 25 CO 0.06 0.27 1.34 -0.26 0.98 0.00 0.00 173.24 175.63 2qbd h PHE 26 N 4.57 0.00 0.00 5.02 0.04 -1.92 -2.05 116.94 122.60 2qbd h PHE 26 Ca -0.49 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.07 2qbd h PHE 26 Cb 1.21 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.33 2qbd h PHE 26 CO 0.68 0.00 -1.76 0.09 -0.60 0.00 0.00 178.31 176.71 2qbd n ASN 27 N -2.47 2.91 -4.06 2.17 3.02 -1.26 -4.89 115.26 110.68 2qbd n ASN 27 Ca -0.01 -0.07 -0.09 0.00 -0.03 0.00 0.00 54.58 54.39 2qbd n ASN 27 Cb 0.64 -0.13 -0.09 0.00 -0.61 0.00 0.00 39.78 39.59 2qbd n ASN 27 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2qbd s ASN 28 N -5.22 0.29 -0.05 6.41 3.04 -0.77 -3.81 114.94 114.83 2qbd s ASN 28 Ca -0.17 -1.01 -0.00 0.00 0.04 0.00 0.00 52.86 51.71 2qbd s ASN 28 Cb 0.05 0.30 0.03 0.00 -1.54 0.00 0.00 41.25 40.08 2qbd s ASN 28 CO 0.32 -0.72 0.01 -0.89 -3.04 0.00 0.00 177.10 172.77 2qbd s THR 29 N -3.97 0.23 -0.02 -5.21 2.01 -1.26 -1.21 115.64 106.21 2qbd s THR 29 Ca 0.16 0.13 0.05 0.00 0.31 0.00 0.00 61.69 62.33 2qbd s THR 29 Cb 0.07 -0.37 -0.01 0.00 0.01 0.00 0.00 72.50 72.20 2qbd s THR 29 CO -0.04 0.20 -0.16 0.27 -0.69 0.00 0.00 174.62 174.20 2qbd s ILE 30 N 1.49 1.27 -0.13 1.82 -4.36 -1.22 -0.21 121.20 119.86 2qbd s ILE 30 Ca -0.03 -0.68 0.00 0.00 -0.26 0.00 0.00 60.65 59.68 2qbd s ILE 30 Cb -0.13 -1.07 -0.01 0.00 1.25 0.00 0.00 42.46 42.50 2qbd s ILE 30 CO -0.03 0.36 -0.14 0.68 0.24 0.00 0.00 174.94 176.05 2qbd s VAL 31 N -0.31 2.90 -0.27 8.37 -7.23 0.13 -1.32 120.40 122.67 2qbd s VAL 31 Ca 0.05 -0.71 0.02 0.00 -1.81 0.00 0.00 61.98 59.53 2qbd s VAL 31 Cb -0.07 -2.21 0.07 0.00 0.56 0.00 0.00 36.38 34.73 2qbd s VAL 31 CO -0.00 0.52 -0.04 -0.89 -0.31 0.00 0.00 175.10 174.39 2qbd s THR 32 N 0.46 1.80 -0.06 5.32 2.01 -0.63 -0.19 115.64 124.34 2qbd s THR 32 Ca -0.10 -1.58 -0.27 0.00 0.31 0.00 0.00 61.69 60.05 2qbd s THR 32 Cb -0.16 -2.10 -0.03 0.00 0.01 0.00 0.00 72.50 70.23 2qbd s THR 32 CO 0.05 -0.23 0.86 -0.63 -0.69 0.00 0.00 174.62 173.98 2qbd s ILE 33 N 1.23 4.93 0.03 1.82 -1.09 0.79 -2.23 121.20 126.68 2qbd s ILE 33 Ca -0.02 1.77 -0.15 0.00 -2.23 0.00 0.00 60.65 60.01 2qbd s ILE 33 Cb -0.19 -4.19 0.03 0.00 -1.58 0.00 0.00 42.46 36.53 2qbd s ILE 33 CO -0.08 0.15 0.34 0.28 -1.23 0.00 0.00 174.94 174.40 2qbd s THR 34 N 1.23 0.07 1.15 2.92 -1.32 -0.09 0.21 115.64 119.82 2qbd s THR 34 Ca 0.44 -0.58 -0.13 0.00 -1.21 0.00 0.00 61.69 60.22 2qbd s THR 34 Cb -0.19 -0.88 0.28 0.00 -1.51 0.00 0.00 72.50 70.20 2qbd s THR 34 CO 0.21 -0.32 1.03 1.51 -2.21 0.00 0.00 174.62 174.84 2qbd s ASP 35 N -1.90 1.05 0.00 8.08 1.47 -1.17 0.13 116.67 124.32 2qbd s ASP 35 Ca -0.07 1.53 0.02 0.00 1.18 0.00 0.00 52.55 55.21 2qbd s ASP 35 Cb -0.02 -2.29 0.10 0.00 -0.34 0.00 0.00 42.92 40.37 2qbd s ASP 35 CO -0.01 -4.16 0.75 0.54 0.68 0.00 0.00 175.17 172.97 2qbd n ARG 36 N -4.89 0.04 -0.02 2.11 1.74 -1.26 -1.92 116.66 112.46 2qbd n ARG 36 Ca 0.03 0.15 -0.21 0.00 -0.77 0.00 0.00 57.85 57.06 2qbd n ARG 36 Cb 0.54 -1.50 -0.13 0.00 -1.02 0.00 0.00 32.46 30.35 2qbd n ARG 36 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2qbd h GLN 37 N 0.00 0.18 0.00 5.56 1.08 -1.97 -3.49 115.11 116.48 2qbd h GLN 37 Ca 0.00 -0.31 0.00 0.00 -1.45 0.00 0.00 58.65 56.89 2qbd h GLN 37 Cb 0.01 0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 2qbd h GLN 37 CO 0.00 1.15 0.00 0.41 -0.95 0.00 0.00 178.83 179.44 2qbd n GLY 38 N 1.69 1.28 3.59 3.46 0.00 -0.81 -5.09 105.19 109.32 2qbd n GLY 38 Ca -0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 2qbd n GLY 38 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qbd s ASN 39 N -0.44 5.33 0.32 1.61 0.01 -1.26 -4.81 114.94 115.70 2qbd s ASN 39 Ca 0.00 1.69 -0.29 0.00 -0.71 0.00 0.00 52.86 53.55 2qbd s ASN 39 Cb 0.00 -2.51 -0.12 0.00 0.41 0.00 0.00 41.25 39.03 2qbd s ASN 39 CO 0.00 -2.09 1.38 0.00 -1.51 0.00 0.00 177.10 174.88 2qbd n ALA 40 N 12.25 1.57 -0.04 0.60 0.00 -1.26 -3.07 120.51 130.56 2qbd n ALA 40 Ca 0.30 0.37 -0.01 0.00 0.00 0.00 0.00 53.44 54.10 2qbd n ALA 40 Cb 0.47 -2.31 -0.10 0.00 0.00 0.00 0.00 19.45 17.51 2qbd n ALA 40 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qbd n LEU 41 N 1.17 0.00 0.00 0.00 4.77 0.13 -4.93 117.00 118.14 2qbd n LEU 41 Ca 0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 2qbd n LEU 41 Cb 0.36 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 2qbd n LEU 41 CO 0.63 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 2qbd n GLY 42 N 2.03 1.30 3.39 -0.72 0.00 -0.89 -4.78 105.19 105.52 2qbd n GLY 42 Ca -0.12 -0.61 -0.10 0.00 0.00 0.00 0.00 46.02 45.19 2qbd n GLY 42 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2qbd s TRP 43 N -2.00 0.59 0.09 1.61 1.48 -1.26 -0.15 118.94 119.30 2qbd s TRP 43 Ca 0.00 -0.91 -0.12 0.00 -1.06 0.00 0.00 56.10 54.01 2qbd s TRP 43 Cb 0.00 -0.11 0.01 0.00 -1.16 0.00 0.00 33.47 32.22 2qbd s TRP 43 CO 0.00 -0.79 0.27 0.00 -4.06 0.00 0.00 176.95 172.37 2qbd s ALA 44 N -4.03 -0.52 -0.11 2.67 0.00 0.73 -4.75 121.76 115.76 2qbd s ALA 44 Ca 0.25 -0.35 -0.09 0.00 0.00 0.00 0.00 51.96 51.77 2qbd s ALA 44 Cb 0.03 0.53 0.03 0.00 0.00 0.00 0.00 23.12 23.70 2qbd s ALA 44 CO 0.06 -0.54 0.28 -0.08 0.00 0.00 0.00 175.76 175.49 2qbd s THR 45 N -3.64 -0.00 0.22 0.00 -1.32 -1.26 0.18 115.64 109.82 2qbd s THR 45 Ca 0.03 0.01 -0.08 0.00 -1.21 0.00 0.00 61.69 60.43 2qbd s THR 45 Cb 0.03 -0.40 0.16 0.00 -1.51 0.00 0.00 72.50 70.78 2qbd s THR 45 CO -0.10 0.00 1.74 0.00 -2.21 0.00 0.00 174.62 174.05 2qbd h ALA 46 N 5.83 0.83 -0.80 11.08 0.00 -0.84 0.12 119.26 135.48 2qbd h ALA 46 Ca -0.27 0.10 0.09 0.00 0.00 0.00 0.00 54.91 54.82 2qbd h ALA 46 Cb 1.19 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 19.00 2qbd h ALA 46 CO 0.33 -0.21 0.52 0.78 0.00 0.00 0.00 179.25 180.68 2qbd h GLY 47 N 0.40 1.08 1.52 0.00 0.00 -1.80 -1.61 103.07 102.65 2qbd h GLY 47 Ca 0.33 -0.32 -0.09 0.00 0.00 0.00 0.00 47.33 47.26 2qbd h GLY 47 CO -0.34 0.19 -0.78 -1.33 0.00 0.00 0.00 176.54 174.29 2qbd h GLY 48 N 0.77 0.00 -1.11 4.60 0.00 -1.46 -3.33 103.07 102.54 2qbd h GLY 48 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.70 2qbd h GLY 48 CO -0.14 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.84 2qbd n SER 49 N -3.01 0.59 0.00 0.19 7.64 0.28 -4.88 113.62 114.43 2qbd n SER 49 Ca -0.01 -0.97 0.00 0.00 1.01 0.00 0.00 58.87 58.89 2qbd n SER 49 Cb 0.70 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.66 2qbd n SER 49 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qbd n GLY 50 N 0.31 1.34 3.37 0.23 0.00 -1.25 -4.98 105.19 104.21 2qbd n GLY 50 Ca 0.00 -0.83 -0.41 0.00 0.00 0.00 0.00 46.02 44.78 2qbd n GLY 50 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2qbd n PHE 51 N 0.00 -1.44 -4.44 1.61 1.16 -1.26 -4.94 117.46 108.14 2qbd n PHE 51 Ca 0.00 0.57 -0.21 0.00 -1.87 0.00 0.00 57.45 55.94 2qbd n PHE 51 Cb 0.00 -1.87 -0.10 0.00 -1.61 0.00 0.00 39.48 35.90 2qbd n PHE 51 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 2qbd s ARG 52 N -1.34 1.60 0.00 3.97 1.81 -1.26 -4.15 118.95 119.57 2qbd s ARG 52 Ca 0.62 -1.85 0.00 0.00 -1.72 0.00 0.00 55.73 52.78 2qbd s ARG 52 Cb -0.59 -1.04 0.00 0.00 -0.45 0.00 0.00 34.95 32.88 2qbd s ARG 52 CO 0.60 -0.06 0.00 0.41 -0.68 0.00 0.00 175.30 175.57 2qbd n GLY 53 N -0.64 1.71 0.18 -3.53 0.00 -1.26 -0.64 105.19 101.01 2qbd n GLY 53 Ca -0.04 0.49 0.07 0.00 0.00 0.00 0.00 46.02 46.54 2qbd n GLY 53 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2qbd h SER 54 N 0.00 0.00 0.00 1.61 4.64 -1.97 -1.60 113.55 116.24 2qbd h SER 54 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qbd h SER 54 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2qbd h SER 54 CO 0.00 0.00 -0.69 -1.14 -0.87 0.00 0.00 176.83 174.13 2qbd n ARG 55 N -2.11 2.51 0.02 4.77 0.00 0.19 -4.64 116.66 117.40 2qbd n ARG 55 Ca -0.01 -0.01 0.13 0.00 -0.00 0.00 0.00 57.85 57.96 2qbd n ARG 55 Cb 0.37 -0.86 0.33 0.00 0.00 0.00 0.00 32.46 32.30 2qbd n ARG 55 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 2qbd n LYS 56 N -1.36 0.08 -1.14 -0.14 2.85 -0.62 -3.89 118.16 113.95 2qbd n LYS 56 Ca -0.00 0.03 -0.16 0.00 -1.05 0.00 0.00 58.31 57.13 2qbd n LYS 56 Cb 0.03 -1.56 0.23 0.00 -0.65 0.00 0.00 35.03 33.09 2qbd n LYS 56 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2qbd n SER 57 N -1.67 4.17 -4.84 -5.58 2.88 -1.12 -4.62 113.62 102.84 2qbd n SER 57 Ca 0.05 -3.46 -0.21 0.00 -1.33 0.00 0.00 58.87 53.92 2qbd n SER 57 Cb 0.36 -0.80 -0.04 0.00 -0.75 0.00 0.00 64.21 62.99 2qbd n SER 57 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2qbd s THR 58 N -3.18 3.80 0.35 2.46 -4.23 -1.25 -4.69 115.64 108.90 2qbd s THR 58 Ca 0.56 -1.40 0.03 0.00 -1.18 0.00 0.00 61.69 59.70 2qbd s THR 58 Cb 0.46 -3.24 0.25 0.00 1.34 0.00 0.00 72.50 71.31 2qbd s THR 58 CO 0.12 -0.23 1.99 1.55 -0.54 0.00 0.00 174.62 177.51 2qbd h PRO 59 N 1.34 0.75 -0.94 3.99 0.13 -1.93 -2.05 132.00 133.30 2qbd h PRO 59 Ca -0.46 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 2qbd h PRO 59 Cb 1.25 -0.16 -0.05 0.00 0.13 0.00 0.00 31.00 32.17 2qbd h PRO 59 CO 0.59 0.53 0.59 0.35 -0.23 0.00 0.00 178.00 179.84 2qbd h PHE 60 N 0.77 1.20 -0.52 1.56 -0.00 -1.95 -3.01 116.94 114.99 2qbd h PHE 60 Ca 0.20 0.01 0.09 0.00 -0.00 0.00 0.00 57.97 58.28 2qbd h PHE 60 Cb -0.02 -0.40 -0.10 0.00 -0.00 0.00 0.00 35.95 35.42 2qbd h PHE 60 CO 0.00 0.78 -0.37 0.00 -0.00 0.00 0.00 178.31 178.72 2qbd h ALA 61 N 1.33 -0.19 -0.59 2.41 0.00 -1.64 0.18 119.26 120.76 2qbd h ALA 61 Ca 0.34 0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.41 2qbd h ALA 61 Cb -0.11 0.82 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 2qbd h ALA 61 CO -0.07 -0.75 0.39 0.00 0.00 0.00 0.00 179.25 178.82 2qbd h ALA 62 N 0.78 1.73 0.36 0.00 0.00 -1.60 -2.18 119.26 118.35 2qbd h ALA 62 Ca 0.19 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2qbd h ALA 62 Cb 0.56 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2qbd h ALA 62 CO -0.64 0.20 -0.26 0.37 0.00 0.00 0.00 179.25 178.92 2qbd h GLN 63 N 0.65 -0.58 -0.18 0.00 4.15 -0.95 0.74 115.11 118.96 2qbd h GLN 63 Ca 0.24 0.04 0.05 0.00 0.77 0.00 0.00 58.65 59.75 2qbd h GLN 63 Cb 0.14 0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 2qbd h GLN 63 CO -0.07 -0.39 0.20 -0.24 -1.93 0.00 0.00 178.83 176.41 2qbd h VAL 64 N -0.60 0.44 0.13 2.39 3.04 -1.38 -1.01 116.25 119.27 2qbd h VAL 64 Ca -0.05 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.64 2qbd h VAL 64 Cb 0.49 0.83 0.00 0.00 -2.01 0.00 0.00 31.29 30.61 2qbd h VAL 64 CO 0.02 0.00 -0.06 0.00 -1.01 0.00 0.00 177.57 176.52 2qbd h ALA 65 N 1.76 -0.18 -0.37 3.17 0.00 -0.78 -2.79 119.26 120.08 2qbd h ALA 65 Ca 0.08 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 54.97 2qbd h ALA 65 Cb 0.49 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.28 2qbd h ALA 65 CO -0.00 -0.17 -0.09 0.00 0.00 0.00 0.00 179.25 178.99 2qbd h ALA 66 N -0.88 0.25 -0.16 0.00 0.00 0.89 0.14 119.26 119.50 2qbd h ALA 66 Ca -0.02 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2qbd h ALA 66 Cb 0.26 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2qbd h ALA 66 CO 0.03 -0.45 0.11 1.05 0.00 0.00 0.00 179.25 179.99 2qbd h GLU 67 N 0.01 0.21 0.00 0.00 4.11 -1.34 -0.37 114.58 117.19 2qbd h GLU 67 Ca 0.18 -0.01 -0.11 0.00 0.07 0.00 0.00 59.36 59.49 2qbd h GLU 67 Cb 0.27 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2qbd h GLU 67 CO -0.37 0.14 -0.51 -0.09 0.07 0.00 0.00 179.01 178.24 2qbd h ARG 68 N 0.21 0.00 0.00 1.06 2.43 -0.54 -2.95 114.38 114.59 2qbd h ARG 68 Ca 0.06 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.14 2qbd h ARG 68 Cb -0.01 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 2qbd h ARG 68 CO -0.01 0.51 -0.44 0.00 -1.51 0.00 0.00 179.97 178.52 2qbd h ALA 70 N 1.56 0.08 0.00 0.00 0.00 -1.33 -2.65 119.26 116.93 2qbd h ALA 70 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2qbd h ALA 70 Cb 0.88 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2qbd h ALA 70 CO 0.06 0.03 0.00 -3.47 0.00 0.00 0.00 179.25 175.87 2qbd n ASP 71 N -4.58 0.00 -0.01 0.00 4.64 -1.17 0.11 116.55 115.55 2qbd n ASP 71 Ca -0.09 -0.14 -0.02 0.00 -1.38 0.00 0.00 54.79 53.17 2qbd n ASP 71 Cb 0.42 0.00 -0.02 0.00 -1.04 0.00 0.00 41.12 40.48 2qbd n ASP 71 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2qbd n ALA 72 N -0.70 1.93 -0.03 -1.67 0.00 -1.14 -4.80 120.51 114.11 2qbd n ALA 72 Ca 0.01 -0.16 0.01 0.00 0.00 0.00 0.00 53.44 53.30 2qbd n ALA 72 Cb 0.00 0.27 -0.10 0.00 0.00 0.00 0.00 19.45 19.62 2qbd n ALA 72 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2qbd n VAL 73 N -2.27 0.38 0.28 0.00 0.24 -0.29 -4.40 118.33 112.27 2qbd n VAL 73 Ca -0.05 -0.41 0.17 0.00 -2.04 0.00 0.00 64.34 62.01 2qbd n VAL 73 Cb 0.58 -0.18 0.82 0.00 -1.47 0.00 0.00 33.84 33.58 2qbd n VAL 73 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2qbd h LYS 74 N 0.00 0.00 0.00 7.34 1.57 0.60 0.92 116.57 127.00 2qbd h LYS 74 Ca -0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 2qbd h LYS 74 Cb 1.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.44 2qbd h LYS 74 CO 0.01 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.28 2qbd n GLU 75 N -3.12 0.55 -0.05 3.15 -0.58 -1.26 -1.72 120.64 117.61 2qbd n GLU 75 Ca 0.00 0.00 0.11 0.00 -0.42 0.00 0.00 57.16 56.85 2qbd n GLU 75 Cb 0.42 -1.20 0.12 0.00 -0.57 0.00 0.00 31.44 30.21 2qbd n GLU 75 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2qbd n TYR 76 N -0.70 0.12 -2.82 -0.32 4.02 0.32 -2.95 117.16 114.82 2qbd n TYR 76 Ca 0.05 -0.06 -0.10 0.00 -0.01 0.00 0.00 57.90 57.78 2qbd n TYR 76 Cb 0.02 -0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.37 2qbd n TYR 76 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qbd n GLY 77 N 1.31 0.29 3.78 2.72 0.00 -0.70 -2.01 105.19 110.58 2qbd n GLY 77 Ca 0.15 -0.33 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 2qbd n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qbd s ILE 78 N -3.02 4.07 0.08 -0.61 -1.09 -1.26 -1.73 121.20 117.64 2qbd s ILE 78 Ca 0.20 1.67 0.00 0.00 -2.23 0.00 0.00 60.65 60.29 2qbd s ILE 78 Cb -0.09 -3.90 0.00 0.00 -1.58 0.00 0.00 42.46 36.89 2qbd s ILE 78 CO 0.25 0.09 0.00 0.29 -1.23 0.00 0.00 174.94 174.34 2qbd n LYS 79 N 0.36 0.00 -4.24 2.79 4.76 0.51 -4.83 118.16 117.51 2qbd n LYS 79 Ca 0.03 0.00 -0.25 0.00 -2.87 0.00 0.00 58.31 55.22 2qbd n LYS 79 Cb 0.50 -0.46 -0.08 0.00 -1.84 0.00 0.00 35.03 33.15 2qbd n LYS 79 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2qbd s ASN 80 N -5.67 4.31 -0.29 4.39 -0.87 0.24 0.04 114.94 117.09 2qbd s ASN 80 Ca 0.00 -1.05 -0.20 0.00 -1.57 0.00 0.00 52.86 50.04 2qbd s ASN 80 Cb 0.00 -0.51 0.18 0.00 -0.02 0.00 0.00 41.25 40.90 2qbd s ASN 80 CO 0.00 -0.41 1.23 -1.48 -2.57 0.00 0.00 177.10 173.87 2qbd s LEU 81 N -3.82 -0.19 0.74 0.60 2.34 -0.97 -2.60 118.68 114.78 2qbd s LEU 81 Ca 0.38 0.33 -0.11 0.00 0.06 0.00 0.00 54.13 54.79 2qbd s LEU 81 Cb 0.03 1.31 0.05 0.00 -0.56 0.00 0.00 46.19 47.02 2qbd s LEU 81 CO 0.21 -0.05 1.11 -1.61 -1.06 0.00 0.00 176.35 174.95 2qbd s GLU 82 N 0.73 2.40 -0.07 1.48 2.02 -0.81 -3.63 118.70 120.82 2qbd s GLU 82 Ca -0.03 0.20 0.04 0.00 0.02 0.00 0.00 54.97 55.21 2qbd s GLU 82 Cb -0.04 -2.02 -0.00 0.00 0.10 0.00 0.00 34.13 32.17 2qbd s GLU 82 CO -0.12 -1.28 -0.21 0.08 0.02 0.00 0.00 175.26 173.75 2qbd s VAL 83 N -3.42 1.79 -0.42 2.63 1.01 0.22 -0.28 120.40 121.93 2qbd s VAL 83 Ca 0.60 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.70 2qbd s VAL 83 Cb -0.11 -1.54 0.11 0.00 0.00 0.00 0.00 36.38 34.84 2qbd s VAL 83 CO 0.49 0.50 0.17 -0.04 0.00 0.00 0.00 175.10 176.23 2qbd s MET 84 N 0.20 1.83 -0.16 2.72 -1.94 0.80 -2.05 119.30 120.70 2qbd s MET 84 Ca -0.11 -2.08 -0.10 0.00 -1.71 0.00 0.00 55.69 51.69 2qbd s MET 84 Cb -0.15 -3.39 -0.05 0.00 2.01 0.00 0.00 34.83 33.25 2qbd s MET 84 CO 0.05 -1.03 0.18 0.08 -0.01 0.00 0.00 175.02 174.29 2qbd s VAL 85 N 0.63 5.39 -0.08 -6.03 1.01 -1.02 -1.26 120.40 119.05 2qbd s VAL 85 Ca 0.12 0.30 -0.05 0.00 0.00 0.00 0.00 61.98 62.35 2qbd s VAL 85 Cb -0.21 -3.50 0.03 0.00 0.00 0.00 0.00 36.38 32.70 2qbd s VAL 85 CO -0.05 0.48 0.20 -1.59 0.00 0.00 0.00 175.10 174.14 2qbd s LYS 86 N -0.03 0.19 0.00 2.72 -2.85 -1.12 0.62 119.74 119.26 2qbd s LYS 86 Ca 0.12 0.39 0.00 0.00 -1.00 0.00 0.00 55.97 55.48 2qbd s LYS 86 Cb -0.12 -0.05 0.00 0.00 -2.06 0.00 0.00 37.83 35.60 2qbd s LYS 86 CO 0.01 -0.11 0.00 0.41 0.10 0.00 0.00 175.35 175.76 2qbd n GLY 87 N 3.74 1.42 0.00 0.59 0.00 -1.26 -2.17 105.19 107.51 2qbd n GLY 87 Ca -0.21 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.11 2qbd n GLY 87 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qbd n PRO 88 N 1.44 1.21 -1.23 1.61 -0.04 -1.09 -4.60 135.00 132.31 2qbd n PRO 88 Ca 0.00 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.61 2qbd n PRO 88 Cb 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.41 2qbd n PRO 88 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qbd n GLY 89 N 5.00 -1.93 3.37 0.55 0.00 -1.26 -4.36 105.19 106.56 2qbd n GLY 89 Ca 0.00 -0.86 -0.30 0.00 0.00 0.00 0.00 46.02 44.86 2qbd n GLY 89 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qbd n PRO 90 N -3.74 -3.73 -1.00 1.61 -0.04 -1.26 -3.64 135.00 123.20 2qbd n PRO 90 Ca -0.02 -1.64 0.00 0.00 -0.04 0.00 0.00 63.50 61.80 2qbd n PRO 90 Cb 0.64 -1.71 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 2qbd n PRO 90 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qbd n GLY 91 N -5.08 0.07 0.19 0.55 0.00 -1.26 -4.75 105.19 94.91 2qbd n GLY 91 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.96 2qbd n GLY 91 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2qbd h ARG 92 N 0.14 0.69 0.00 1.61 2.43 -1.81 -3.26 114.38 114.17 2qbd h ARG 92 Ca 0.00 -0.74 -0.23 0.00 -0.81 0.00 0.00 59.98 58.20 2qbd h ARG 92 Cb 0.86 0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 30.58 2qbd h ARG 92 CO 0.00 1.32 -1.85 0.39 -1.51 0.00 0.00 179.97 178.32 2qbd n GLU 93 N -3.88 0.72 -0.21 0.20 1.02 -1.26 -4.62 120.64 112.61 2qbd n GLU 93 Ca -0.11 0.07 0.01 0.00 -0.02 0.00 0.00 57.16 57.11 2qbd n GLU 93 Cb 0.87 -1.30 0.10 0.00 -0.02 0.00 0.00 31.44 31.09 2qbd n GLU 93 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2qbd h SER 94 N 0.00 -0.33 -0.43 1.62 0.87 -1.89 -1.84 113.55 111.54 2qbd h SER 94 Ca -0.33 0.16 0.08 0.00 -1.23 0.00 0.00 61.79 60.46 2qbd h SER 94 Cb 1.57 0.30 -0.07 0.00 -0.44 0.00 0.00 62.40 63.76 2qbd h SER 94 CO -0.04 -0.14 0.03 0.00 -0.53 0.00 0.00 176.83 176.16 2qbd h THR 95 N 0.09 0.70 0.28 2.23 1.03 -1.82 -2.67 112.91 112.75 2qbd h THR 95 Ca 0.32 -0.05 0.00 0.00 -0.01 0.00 0.00 66.41 66.68 2qbd h THR 95 Cb 0.53 0.54 -0.02 0.00 -1.07 0.00 0.00 68.15 68.13 2qbd h THR 95 CO -0.56 0.03 -0.27 0.40 -0.01 0.00 0.00 175.52 175.11 2qbd h ILE 96 N 0.15 0.43 -0.21 0.00 2.04 -1.60 -1.84 117.51 116.48 2qbd h ILE 96 Ca 0.21 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.10 2qbd h ILE 96 Cb 0.30 0.43 -0.05 0.00 -0.74 0.00 0.00 36.82 36.76 2qbd h ILE 96 CO -0.33 0.00 -0.41 0.03 0.00 0.00 0.00 178.15 177.44 2qbd h ARG 97 N -0.57 -0.34 -0.88 2.37 2.47 -1.23 -0.25 114.38 115.94 2qbd h ARG 97 Ca -0.01 0.02 0.18 0.00 -1.26 0.00 0.00 59.98 58.91 2qbd h ARG 97 Cb 0.52 0.08 -0.11 0.00 -1.65 0.00 0.00 29.97 28.82 2qbd h ARG 97 CO -0.05 -0.23 0.44 0.00 0.56 0.00 0.00 179.97 180.69 2qbd h ALA 98 N -0.48 1.38 0.49 0.04 0.00 -1.46 0.47 119.26 119.70 2qbd h ALA 98 Ca 0.04 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2qbd h ALA 98 Cb 0.47 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2qbd h ALA 98 CO -0.39 -0.17 -0.51 1.25 0.00 0.00 0.00 179.25 179.43 2qbd h LEU 99 N 0.56 -1.39 -0.72 0.00 5.85 -0.27 -1.37 115.31 117.97 2qbd h LEU 99 Ca 0.51 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 59.34 2qbd h LEU 99 Cb 0.82 0.46 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 2qbd h LEU 99 CO -0.42 -0.67 0.43 -1.13 -0.34 0.00 0.00 178.44 176.31 2qbd h ASN 100 N -1.00 0.88 0.04 1.25 -0.73 -0.27 -1.50 115.58 114.26 2qbd h ASN 100 Ca -0.06 -0.07 0.00 0.00 1.87 0.00 0.00 56.30 58.04 2qbd h ASN 100 Cb 0.87 -0.22 0.00 0.00 0.27 0.00 0.00 38.32 39.24 2qbd h ASN 100 CO -0.07 0.70 0.00 0.00 -0.37 0.00 0.00 177.43 177.68 2qbd n ALA 101 N -2.33 1.07 1.34 1.57 0.00 0.16 -0.78 120.51 121.53 2qbd n ALA 101 Ca 0.06 0.12 0.07 0.00 0.00 0.00 0.00 53.44 53.70 2qbd n ALA 101 Cb 0.07 -1.21 0.27 0.00 0.00 0.00 0.00 19.45 18.58 2qbd n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qbd n ALA 102 N -1.68 2.50 0.00 0.00 0.00 -0.55 -4.87 120.51 115.92 2qbd n ALA 102 Ca -0.01 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.02 2qbd n ALA 102 Cb 0.03 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.42 2qbd n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qbd n GLY 103 N 0.96 2.99 3.69 0.00 0.00 0.04 -5.03 105.19 107.84 2qbd n GLY 103 Ca 0.12 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.61 2qbd n GLY 103 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qbd n PHE 104 N -2.00 2.19 -2.27 1.61 3.72 -1.21 -4.84 117.46 114.66 2qbd n PHE 104 Ca 0.00 0.25 -0.33 0.00 -0.05 0.00 0.00 57.45 57.32 2qbd n PHE 104 Cb 0.00 -2.57 -0.04 0.00 -0.94 0.00 0.00 39.48 35.93 2qbd n PHE 104 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2qbd s ARG 105 N 3.93 3.00 0.98 -1.08 6.06 0.11 -4.55 118.95 127.39 2qbd s ARG 105 Ca 0.96 -0.62 -0.11 0.00 -2.50 0.00 0.00 55.73 53.46 2qbd s ARG 105 Cb -0.87 -5.16 0.18 0.00 0.06 0.00 0.00 34.95 29.16 2qbd s ARG 105 CO 0.58 -2.86 1.10 -1.50 -2.50 0.00 0.00 175.30 170.13 2qbd s ILE 106 N 7.87 2.19 0.30 4.11 2.07 -1.26 -2.30 121.20 134.19 2qbd s ILE 106 Ca 0.59 0.06 0.00 0.00 -1.41 0.00 0.00 60.65 59.90 2qbd s ILE 106 Cb -0.04 -2.16 0.00 0.00 0.13 0.00 0.00 42.46 40.39 2qbd s ILE 106 CO -0.04 -0.08 0.00 0.35 -1.91 0.00 0.00 174.94 173.26 2qbd n THR 107 N -4.36 0.00 -4.92 4.00 -2.24 -1.24 -4.80 114.28 100.73 2qbd n THR 107 Ca 0.09 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.58 2qbd n THR 107 Cb 0.53 -0.27 -0.17 0.00 -2.10 0.00 0.00 70.33 68.32 2qbd n THR 107 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2qbd s ASN 108 N -3.78 2.44 -0.29 3.42 -0.87 -1.26 -5.04 114.94 109.55 2qbd s ASN 108 Ca 0.00 -0.43 0.03 0.00 -1.57 0.00 0.00 52.86 50.89 2qbd s ASN 108 Cb 0.00 -1.04 0.08 0.00 -0.02 0.00 0.00 41.25 40.26 2qbd s ASN 108 CO 0.00 0.11 -0.04 -0.63 -2.57 0.00 0.00 177.10 173.98 2qbd s ILE 109 N 0.40 2.07 -0.04 0.60 1.01 -1.26 0.71 121.20 124.69 2qbd s ILE 109 Ca -0.14 -1.83 0.04 0.00 0.00 0.00 0.00 60.65 58.71 2qbd s ILE 109 Cb -0.16 -2.34 -0.00 0.00 0.01 0.00 0.00 42.46 39.97 2qbd s ILE 109 CO 0.06 -0.27 -0.16 0.42 0.00 0.00 0.00 174.94 174.98 2qbd s THR 110 N 1.09 1.37 -0.21 2.92 -4.23 -0.87 -5.00 115.64 110.71 2qbd s THR 110 Ca -0.01 -0.69 -0.26 0.00 -1.18 0.00 0.00 61.69 59.56 2qbd s THR 110 Cb -0.19 -1.17 -0.01 0.00 1.34 0.00 0.00 72.50 72.47 2qbd s THR 110 CO -0.07 0.40 0.88 -0.62 -0.54 0.00 0.00 174.62 174.66 2qbd s ASP 111 N 0.01 6.95 -0.13 3.99 2.15 -1.26 -2.42 116.67 125.96 2qbd s ASP 111 Ca -0.03 1.18 0.15 0.00 0.43 0.00 0.00 52.55 54.28 2qbd s ASP 111 Cb -0.11 -2.47 0.49 0.00 -0.30 0.00 0.00 42.92 40.54 2qbd s ASP 111 CO 0.02 -0.50 1.40 1.33 -0.17 0.00 0.00 175.17 177.25 2qbd n VAL 112 N 5.03 1.93 -1.64 1.11 0.24 0.20 -4.94 118.33 120.27 2qbd n VAL 112 Ca 0.06 -1.58 -0.48 0.00 -2.04 0.00 0.00 64.34 60.31 2qbd n VAL 112 Cb 0.48 -0.03 -0.05 0.00 -1.47 0.00 0.00 33.84 32.78 2qbd n VAL 112 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2qbd n THR 113 N -0.08 0.14 -2.07 3.34 -1.04 -1.20 -4.82 114.28 108.54 2qbd n THR 113 Ca 0.19 -0.03 -0.42 0.00 -2.04 0.00 0.00 64.05 61.75 2qbd n THR 113 Cb 0.78 -1.24 -0.03 0.00 -1.82 0.00 0.00 70.33 68.02 2qbd n THR 113 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2qbd s PRO 114 N 0.57 4.26 -0.35 -2.82 0.04 -1.26 -4.94 135.00 130.50 2qbd s PRO 114 Ca 0.79 2.18 0.00 0.00 0.04 0.00 0.00 61.00 64.02 2qbd s PRO 114 Cb -0.78 -3.37 0.14 0.00 0.04 0.00 0.00 34.50 30.52 2qbd s PRO 114 CO 0.43 -0.57 0.23 0.96 0.04 0.00 0.00 177.00 178.08 2qbd s ILE 115 N 1.74 0.03 0.28 0.56 -5.25 -1.26 -5.03 121.20 112.26 2qbd s ILE 115 Ca 0.68 -1.48 -0.29 0.00 -0.99 0.00 0.00 60.65 58.57 2qbd s ILE 115 Cb -0.38 -1.03 -0.10 0.00 2.95 0.00 0.00 42.46 43.90 2qbd s ILE 115 CO 0.30 -0.89 1.28 -2.16 -1.79 0.00 0.00 174.94 171.68 2qbd s PRO 116 N 1.26 4.40 -0.09 0.37 0.04 -1.26 -4.89 135.00 134.83 2qbd s PRO 116 Ca 0.17 2.11 -0.06 0.00 0.04 0.00 0.00 61.00 63.25 2qbd s PRO 116 Cb -0.21 -3.13 -0.25 0.00 0.04 0.00 0.00 34.50 30.95 2qbd s PRO 116 CO -0.04 -0.16 3.46 0.72 0.04 0.00 0.00 177.00 181.01 2qbd n HIS 117 N 1.55 0.13 -1.79 0.56 8.25 -1.26 -4.57 115.22 118.09 2qbd n HIS 117 Ca 0.02 -1.52 -0.01 0.00 -0.26 0.00 0.00 57.72 55.95 2qbd n HIS 117 Cb 0.42 -1.59 0.00 0.00 1.12 0.00 0.00 29.99 29.94 2qbd n HIS 117 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2qbd n ASN 118 N 2.58 -3.31 0.00 0.41 5.03 -1.26 -5.10 115.26 113.61 2qbd n ASN 118 Ca 0.43 0.19 0.00 0.00 0.87 0.00 0.00 54.58 56.07 2qbd n ASN 118 Cb 0.84 -1.96 0.00 0.00 -1.02 0.00 0.00 39.78 37.64 2qbd n ASN 118 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2qbd n GLY 119 N -0.24 1.43 3.62 7.41 0.00 -1.26 -5.11 105.19 111.04 2qbd n GLY 119 Ca 0.02 -0.09 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 2qbd n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbd s ARG 121 N -4.56 3.49 0.66 0.00 3.52 -1.26 -5.07 118.95 115.73 2qbd s ARG 121 Ca 0.67 -0.47 -0.18 0.00 -0.13 0.00 0.00 55.73 55.62 2qbd s ARG 121 Cb -0.23 -3.83 -0.01 0.00 -1.56 0.00 0.00 34.95 29.32 2qbd s ARG 121 CO 0.60 -0.57 1.27 -0.35 -0.81 0.00 0.00 175.30 175.44 2qbd n PRO 122 N 5.40 1.05 -2.37 5.12 -0.04 -1.26 -4.96 135.00 137.95 2qbd n PRO 122 Ca -0.09 0.42 -0.39 0.00 -0.04 0.00 0.00 63.50 63.40 2qbd n PRO 122 Cb 0.49 -2.51 -0.03 0.00 -0.04 0.00 0.00 33.50 31.41 2qbd n PRO 122 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2qbd s PRO 123 N -3.37 4.25 0.00 0.54 0.04 -1.26 -4.99 135.00 130.20 2qbd s PRO 123 Ca 0.82 1.81 0.00 0.00 0.04 0.00 0.00 61.00 63.67 2qbd s PRO 123 Cb -0.38 -2.82 0.00 0.00 0.04 0.00 0.00 34.50 31.34 2qbd s PRO 123 CO 0.41 -0.14 0.91 1.63 0.04 0.00 0.00 177.00 179.85 2qbd n LYS 124 N 0.40 0.00 -0.31 4.56 5.02 -1.26 -4.94 118.16 121.63 2qbd n LYS 124 Ca 0.03 0.51 0.04 0.00 -2.02 0.00 0.00 58.31 56.87 2qbd n LYS 124 Cb 0.46 -1.41 -0.01 0.00 -0.02 0.00 0.00 35.03 34.05 2qbd n LYS 124 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2qbd n LYS 125 N -1.91 -0.63 0.00 1.97 5.02 -1.26 -4.91 118.16 116.44 2qbd n LYS 125 Ca 0.00 0.42 0.00 0.00 -2.02 0.00 0.00 58.31 56.71 2qbd n LYS 125 Cb 0.00 -0.77 0.00 0.00 -0.02 0.00 0.00 35.03 34.24 2qbd n LYS 125 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qbd n ARG 126 N -1.89 0.00 -2.98 1.97 5.12 -1.26 -4.97 116.66 112.65 2qbd n ARG 126 Ca 0.00 0.00 -0.15 0.00 -1.93 0.00 0.00 57.85 55.77 2qbd n ARG 126 Cb 0.14 0.00 -0.02 0.00 -1.16 0.00 0.00 32.46 31.43 2qbd n ARG 126 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 2qbd n ARG 127 N 1.42 0.63 0.00 5.56 0.00 -1.26 -5.27 116.66 117.74 2qbd n ARG 127 Ca 0.00 -2.46 0.00 0.00 -0.00 0.00 0.00 57.85 55.39 2qbd n ARG 127 Cb 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 32.46 31.04 2qbd n ARG 127 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96