#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbb h ARG 2 N 0.00 0.35 0.00 0.00 -0.00 -1.69 -3.35 114.38 109.68 2qbb h ARG 2 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.46 2qbb h ARG 2 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 29.97 29.89 2qbb h ARG 2 CO 0.00 0.23 0.00 -0.89 0.00 0.00 0.00 179.97 179.31 2qbb n ILE 3 N -4.46 0.00 0.00 2.04 5.41 -1.26 -1.67 119.36 119.42 2qbb n ILE 3 Ca 0.15 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.90 2qbb n ILE 3 Cb 0.58 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.51 2qbb n ILE 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2qbb n ALA 4 N 1.94 2.01 0.56 -1.39 0.00 -1.26 -4.69 120.51 117.68 2qbb n ALA 4 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2qbb n ALA 4 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2qbb n ALA 4 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qbb n GLY 5 N 2.01 1.28 4.52 0.00 0.00 -1.24 -4.68 105.19 107.07 2qbb n GLY 5 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2qbb n GLY 5 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2qbb n ILE 6 N 0.75 0.00 -1.48 -0.61 5.41 -0.67 -4.92 119.36 117.85 2qbb n ILE 6 Ca 0.00 0.00 -0.43 0.00 1.00 0.00 0.00 62.75 63.32 2qbb n ILE 6 Cb 0.31 0.00 -0.01 0.00 -0.71 0.00 0.00 39.64 39.24 2qbb n ILE 6 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2qbb n ASN 7 N 0.00 -0.34 -2.68 4.38 5.03 -1.11 -3.99 115.26 116.55 2qbb n ASN 7 Ca 0.00 1.02 -0.29 0.00 0.87 0.00 0.00 54.58 56.18 2qbb n ASN 7 Cb 0.00 -1.13 -0.00 0.00 -1.02 0.00 0.00 39.78 37.63 2qbb n ASN 7 CO 0.00 0.00 0.00 2.30 -1.83 0.00 0.00 177.26 177.73 2qbb n ILE 8 N -0.42 2.84 -1.98 2.41 -5.35 -1.26 -3.80 119.36 111.80 2qbb n ILE 8 Ca 0.12 -5.02 -0.25 0.00 -0.27 0.00 0.00 62.75 57.33 2qbb n ILE 8 Cb 0.35 -1.30 -0.07 0.00 -1.74 0.00 0.00 39.64 36.88 2qbb n ILE 8 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2qbb s PRO 9 N -3.64 2.28 0.29 6.28 0.04 -1.26 -4.75 135.00 134.24 2qbb s PRO 9 Ca 0.48 -0.86 0.01 0.00 0.04 0.00 0.00 61.00 60.67 2qbb s PRO 9 Cb 0.37 -5.16 -0.00 0.00 0.04 0.00 0.00 34.50 29.75 2qbb s PRO 9 CO -0.21 -4.12 0.03 -0.25 0.04 0.00 0.00 177.00 172.49 2qbb n ASP 10 N 15.23 2.34 -2.67 6.66 8.00 -1.26 -4.57 116.55 140.28 2qbb n ASP 10 Ca 0.44 -2.35 -0.20 0.00 0.71 0.00 0.00 54.79 53.39 2qbb n ASP 10 Cb 0.47 0.34 0.03 0.00 -0.02 0.00 0.00 41.12 41.94 2qbb n ASP 10 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2qbb n HIS 11 N -0.71 -1.74 0.00 1.24 8.25 -1.26 -4.87 115.22 116.13 2qbb n HIS 11 Ca -0.10 0.47 0.00 0.00 -0.26 0.00 0.00 57.72 57.83 2qbb n HIS 11 Cb 0.39 -4.09 0.00 0.00 1.12 0.00 0.00 29.99 27.41 2qbb n HIS 11 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2qbb n LYS 12 N -3.64 0.00 -4.48 -0.41 4.76 -1.26 -5.03 118.16 108.10 2qbb n LYS 12 Ca -0.10 0.00 -0.21 0.00 -2.87 0.00 0.00 58.31 55.13 2qbb n LYS 12 Cb 0.61 0.00 -0.15 0.00 -1.84 0.00 0.00 35.03 33.64 2qbb n LYS 12 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2qbb s HIS 13 N 2.81 1.06 0.24 2.13 3.76 -1.26 -4.09 115.29 119.94 2qbb s HIS 13 Ca 0.00 -0.24 -0.05 0.00 -0.15 0.00 0.00 55.06 54.62 2qbb s HIS 13 Cb 0.00 -0.72 0.43 0.00 1.11 0.00 0.00 32.58 33.41 2qbb s HIS 13 CO 0.00 -0.07 1.29 0.00 -0.85 0.00 0.00 174.74 175.10 2qbb n ALA 14 N 3.07 0.25 -1.00 -1.40 0.00 0.30 -0.29 120.51 121.44 2qbb n ALA 14 Ca -0.16 0.90 0.00 0.00 0.00 0.00 0.00 53.44 54.18 2qbb n ALA 14 Cb 0.55 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 19.43 2qbb n ALA 14 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2qbb n VAL 15 N -5.31 0.00 -0.42 0.00 0.31 -1.26 -1.69 118.33 109.96 2qbb n VAL 15 Ca 0.15 0.49 0.36 0.00 -0.01 0.00 0.00 64.34 65.32 2qbb n VAL 15 Cb 0.46 -1.05 0.61 0.00 -0.91 0.00 0.00 33.84 32.95 2qbb n VAL 15 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qbb n ILE 16 N -0.36 -0.23 0.03 2.52 3.06 -1.15 -0.55 119.36 122.68 2qbb n ILE 16 Ca 0.00 1.62 -0.09 0.00 -2.50 0.00 0.00 62.75 61.78 2qbb n ILE 16 Cb 0.00 -2.66 -0.07 0.00 0.54 0.00 0.00 39.64 37.45 2qbb n ILE 16 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2qbb h ALA 17 N 1.43 -0.17 -0.57 1.51 0.00 -0.76 -3.25 119.26 117.45 2qbb h ALA 17 Ca 0.79 -0.23 0.16 0.00 0.00 0.00 0.00 54.91 55.64 2qbb h ALA 17 Cb 2.55 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 20.38 2qbb h ALA 17 CO -0.42 -0.22 0.52 1.25 0.00 0.00 0.00 179.25 180.37 2qbb h LEU 18 N -0.92 0.00 -2.00 0.00 6.46 0.09 0.55 115.31 119.49 2qbb h LEU 18 Ca -0.02 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.74 2qbb h LEU 18 Cb 0.51 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.44 2qbb h LEU 18 CO 0.03 0.00 0.00 0.71 -0.62 0.00 0.00 178.44 178.56 2qbb h THR 19 N 0.00 0.00 -0.03 1.05 1.35 -1.35 -0.51 112.91 113.41 2qbb h THR 19 Ca 0.27 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 66.14 2qbb h THR 19 Cb 1.30 0.67 -0.00 0.00 -1.73 0.00 0.00 68.15 68.38 2qbb h THR 19 CO -0.00 0.00 0.05 0.28 -0.25 0.00 0.00 175.52 175.60 2qbb h SER 20 N 0.00 0.00 -2.32 5.36 0.02 -0.04 -3.41 113.55 113.16 2qbb h SER 20 Ca 0.00 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.38 2qbb h SER 20 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 2qbb h SER 20 CO 0.00 0.00 1.35 -0.63 -1.14 0.00 0.00 176.83 176.41 2qbb s ILE 21 N -4.40 3.22 0.54 3.27 1.01 -0.20 -4.81 121.20 119.83 2qbb s ILE 21 Ca -0.05 0.23 0.24 0.00 0.00 0.00 0.00 60.65 61.08 2qbb s ILE 21 Cb 0.14 -3.26 0.36 0.00 0.01 0.00 0.00 42.46 39.71 2qbb s ILE 21 CO 0.47 -0.14 1.16 -1.22 0.00 0.00 0.00 174.94 175.21 2qbb n TYR 22 N 10.29 0.00 0.64 3.97 0.53 -1.26 0.26 117.16 131.59 2qbb n TYR 22 Ca 0.25 0.00 0.09 0.00 -1.02 0.00 0.00 57.90 57.22 2qbb n TYR 22 Cb 0.45 -0.24 -0.12 0.00 -1.03 0.00 0.00 39.34 38.40 2qbb n TYR 22 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2qbb n GLY 23 N -1.62 -0.81 3.69 2.72 0.00 -1.26 -4.64 105.19 103.27 2qbb n GLY 23 Ca 0.21 -0.51 -0.26 0.00 0.00 0.00 0.00 46.02 45.46 2qbb n GLY 23 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qbb s VAL 24 N -2.93 3.87 0.08 1.61 -7.23 0.14 -4.92 120.40 111.03 2qbb s VAL 24 Ca 0.03 -1.37 0.02 0.00 -1.81 0.00 0.00 61.98 58.84 2qbb s VAL 24 Cb 0.14 -2.96 -0.01 0.00 0.56 0.00 0.00 36.38 34.11 2qbb s VAL 24 CO 0.78 -0.12 0.06 0.61 -0.31 0.00 0.00 175.10 176.12 2qbb n GLY 25 N -0.21 3.81 0.56 2.32 0.00 -1.26 -4.59 105.19 105.83 2qbb n GLY 25 Ca -0.09 -1.80 0.43 0.00 0.00 0.00 0.00 46.02 44.56 2qbb n GLY 25 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qbb h LYS 26 N 0.00 0.04 0.00 1.61 1.79 -1.95 0.33 116.57 118.39 2qbb h LYS 26 Ca -0.06 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 2qbb h LYS 26 Cb 0.29 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.93 2qbb h LYS 26 CO 0.09 0.02 -0.04 1.15 -1.08 0.00 0.00 179.45 179.60 2qbb h THR 27 N 0.04 0.00 -0.88 -0.16 2.02 -1.98 -3.16 112.91 108.79 2qbb h THR 27 Ca 0.85 -0.88 0.04 0.00 0.77 0.00 0.00 66.41 67.20 2qbb h THR 27 Cb 3.03 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 69.39 2qbb h THR 27 CO -0.24 0.00 0.57 -0.09 0.37 0.00 0.00 175.52 176.13 2qbb h ARG 28 N -0.88 1.04 -0.26 6.66 1.12 -1.76 -1.56 114.38 118.75 2qbb h ARG 28 Ca 0.00 -0.06 -0.02 0.00 -1.11 0.00 0.00 59.98 58.78 2qbb h ARG 28 Cb 0.04 -0.24 -0.01 0.00 -0.01 0.00 0.00 29.97 29.75 2qbb h ARG 28 CO 0.00 0.69 0.07 1.03 -3.11 0.00 0.00 179.97 178.65 2qbb h SER 29 N 1.08 0.39 1.15 -3.80 0.87 -0.54 -0.06 113.55 112.64 2qbb h SER 29 Ca 0.35 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 2qbb h SER 29 Cb 0.05 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 61.91 2qbb h SER 29 CO -0.11 0.51 0.00 1.17 -0.53 0.00 0.00 176.83 177.87 2qbb n LYS 30 N -4.72 0.22 -0.04 2.24 4.81 -1.08 -3.50 118.16 116.10 2qbb n LYS 30 Ca -0.03 0.29 -0.17 0.00 -0.87 0.00 0.00 58.31 57.53 2qbb n LYS 30 Cb 0.17 -1.82 -0.14 0.00 0.02 0.00 0.00 35.03 33.27 2qbb n LYS 30 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2qbb n ALA 31 N -1.77 1.19 0.21 3.14 0.00 -0.61 -4.19 120.51 118.48 2qbb n ALA 31 Ca 0.04 -0.80 0.13 0.00 0.00 0.00 0.00 53.44 52.81 2qbb n ALA 31 Cb 0.34 -0.55 0.73 0.00 0.00 0.00 0.00 19.45 19.97 2qbb n ALA 31 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2qbb h ILE 32 N 0.04 0.77 0.00 0.00 2.10 -1.04 0.47 117.51 119.84 2qbb h ILE 32 Ca -0.44 0.00 -0.02 0.00 1.08 0.00 0.00 64.86 65.49 2qbb h ILE 32 Cb 2.02 0.92 -0.00 0.00 -1.09 0.00 0.00 36.82 38.67 2qbb h ILE 32 CO 0.05 0.00 -0.07 -0.07 -1.08 0.00 0.00 178.15 176.97 2qbb h LEU 33 N 0.00 0.00 0.65 2.19 3.38 -1.73 -0.72 115.31 119.08 2qbb h LEU 33 Ca 0.06 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 2qbb h LEU 33 Cb 0.28 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.04 2qbb h LEU 33 CO -0.00 0.07 -0.31 0.00 0.09 0.00 0.00 178.44 178.29 2qbb h ALA 34 N 1.93 -0.93 0.00 1.53 0.00 -1.12 1.04 119.26 121.70 2qbb h ALA 34 Ca -0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2qbb h ALA 34 Cb 0.21 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2qbb h ALA 34 CO 0.01 -0.87 -0.21 0.00 0.00 0.00 0.00 179.25 178.17 2qbb h ALA 35 N -1.33 1.22 -0.01 0.00 0.00 -1.63 -1.77 119.26 115.74 2qbb h ALA 35 Ca -0.09 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2qbb h ALA 35 Cb 0.67 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2qbb h ALA 35 CO 0.15 0.27 -0.14 0.00 0.00 0.00 0.00 179.25 179.53 2qbb n ALA 36 N -2.30 2.84 -3.58 0.00 0.00 -0.29 -4.97 120.51 112.21 2qbb n ALA 36 Ca -0.01 -0.44 -0.24 0.00 0.00 0.00 0.00 53.44 52.75 2qbb n ALA 36 Cb 0.34 -1.12 0.05 0.00 0.00 0.00 0.00 19.45 18.71 2qbb n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qbb n GLY 37 N 1.27 -0.76 3.16 0.00 0.00 0.13 -4.82 105.19 104.18 2qbb n GLY 37 Ca 0.15 0.36 -0.21 0.00 0.00 0.00 0.00 46.02 46.32 2qbb n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qbb s ILE 38 N -3.53 1.23 0.00 -0.61 -1.09 0.31 -5.01 121.20 112.50 2qbb s ILE 38 Ca 0.29 -1.02 0.00 0.00 -2.23 0.00 0.00 60.65 57.68 2qbb s ILE 38 Cb -0.08 -1.10 0.00 0.00 -1.58 0.00 0.00 42.46 39.71 2qbb s ILE 38 CO 0.81 0.06 0.00 0.00 -1.23 0.00 0.00 174.94 174.58 2qbb n ALA 39 N 1.92 0.00 -0.01 9.38 0.00 -1.26 -4.49 120.51 126.05 2qbb n ALA 39 Ca -0.18 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.24 2qbb n ALA 39 Cb 0.54 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.98 2qbb n ALA 39 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qbb n GLU 40 N -0.15 0.06 0.00 0.00 1.02 -1.26 -4.62 120.64 115.69 2qbb n GLU 40 Ca 0.00 0.02 0.05 0.00 -0.02 0.00 0.00 57.16 57.21 2qbb n GLU 40 Cb 0.00 -0.88 0.23 0.00 -0.02 0.00 0.00 31.44 30.77 2qbb n GLU 40 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2qbb n ASP 41 N -2.78 0.00 -4.70 1.62 10.43 -1.26 -2.38 116.55 117.49 2qbb n ASP 41 Ca -0.05 0.45 -0.42 0.00 2.57 0.00 0.00 54.79 57.34 2qbb n ASP 41 Cb 0.54 -0.47 -0.03 0.00 1.84 0.00 0.00 41.12 43.00 2qbb n ASP 41 CO 0.00 0.00 0.00 0.68 -1.07 0.00 0.00 177.20 176.81 2qbb s VAL 42 N -2.95 3.33 -0.18 2.53 -7.23 -1.26 -4.81 120.40 109.84 2qbb s VAL 42 Ca 0.06 0.83 -0.29 0.00 -1.81 0.00 0.00 61.98 60.77 2qbb s VAL 42 Cb 0.07 -3.53 -0.01 0.00 0.56 0.00 0.00 36.38 33.47 2qbb s VAL 42 CO 0.19 0.02 1.23 -0.54 -0.31 0.00 0.00 175.10 175.69 2qbb s LYS 43 N 2.05 4.23 0.45 4.82 3.01 -1.26 -0.54 119.74 132.50 2qbb s LYS 43 Ca 0.67 1.61 0.23 0.00 -1.01 0.00 0.00 55.97 57.47 2qbb s LYS 43 Cb -0.36 -3.75 1.22 0.00 -1.01 0.00 0.00 37.83 33.93 2qbb s LYS 43 CO 0.29 -0.70 1.83 0.82 0.51 0.00 0.00 175.35 178.10 2qbb h ILE 44 N 5.49 0.57 0.05 2.17 5.03 -1.87 -0.00 117.51 128.95 2qbb h ILE 44 Ca -0.25 -0.09 -0.00 0.00 -0.12 0.00 0.00 64.86 64.39 2qbb h ILE 44 Cb 1.10 0.27 0.00 0.00 -3.03 0.00 0.00 36.82 35.16 2qbb h ILE 44 CO 0.97 0.05 -0.02 0.77 -0.68 0.00 0.00 178.15 179.24 2qbb h SER 45 N 0.28 -0.06 0.99 1.72 4.64 -1.89 -2.91 113.55 116.31 2qbb h SER 45 Ca 0.51 -0.20 -0.01 0.00 -0.47 0.00 0.00 61.79 61.62 2qbb h SER 45 Cb 1.52 0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.62 2qbb h SER 45 CO -0.16 0.17 -0.05 1.05 -0.87 0.00 0.00 176.83 176.96 2qbb h GLU 46 N -0.29 0.00 -6.06 4.77 -0.00 -1.47 -3.46 114.58 108.07 2qbb h GLU 46 Ca -0.01 0.00 -0.79 0.00 -0.00 0.00 0.00 59.36 58.57 2qbb h GLU 46 Cb 0.26 0.00 0.04 0.00 -0.00 0.00 0.00 28.75 29.05 2qbb h GLU 46 CO 0.01 0.05 0.34 1.28 -0.00 0.00 0.00 179.01 180.69 2qbb n LEU 47 N -3.17 0.75 -4.61 3.06 4.77 -0.20 -4.91 117.00 112.69 2qbb n LEU 47 Ca 0.00 1.15 -0.29 0.00 -0.03 0.00 0.00 56.01 56.85 2qbb n LEU 47 Cb 0.33 -0.98 0.20 0.00 -2.33 0.00 0.00 43.42 40.65 2qbb n LEU 47 CO 0.29 -1.40 0.60 -0.44 -1.33 0.00 0.00 177.39 175.11 2qbb s SER 48 N 1.04 2.05 0.00 -1.43 0.01 -1.26 -4.77 113.70 109.35 2qbb s SER 48 Ca 0.94 1.35 0.00 0.00 1.31 0.00 0.00 55.95 59.55 2qbb s SER 48 Cb -1.25 -2.06 0.00 0.00 0.21 0.00 0.00 66.02 62.92 2qbb s SER 48 CO 0.61 -3.51 0.62 1.21 0.41 0.00 0.00 173.24 172.58 2qbb n GLU 49 N -4.44 0.00 -0.47 12.44 4.07 -1.26 -1.84 120.64 129.14 2qbb n GLU 49 Ca 0.05 0.41 0.40 0.00 -0.06 0.00 0.00 57.16 57.95 2qbb n GLU 49 Cb 0.56 -1.12 0.66 0.00 -0.06 0.00 0.00 31.44 31.48 2qbb n GLU 49 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2qbb n GLY 50 N -0.84 -0.82 0.21 8.31 0.00 -1.26 -0.26 105.19 110.54 2qbb n GLY 50 Ca 0.00 0.73 -0.09 0.00 0.00 0.00 0.00 46.02 46.66 2qbb n GLY 50 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2qbb h GLN 51 N 0.00 -0.20 -0.01 1.61 4.20 -1.70 0.47 115.11 119.48 2qbb h GLN 51 Ca 0.85 0.01 -0.19 0.00 0.06 0.00 0.00 58.65 59.39 2qbb h GLN 51 Cb 2.80 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 30.61 2qbb h GLN 51 CO -0.42 -0.13 -0.84 0.97 -0.67 0.00 0.00 178.83 177.74 2qbb h ILE 52 N -0.20 1.49 -0.27 2.54 6.09 -0.43 -3.25 117.51 123.48 2qbb h ILE 52 Ca 0.10 -2.55 0.06 0.00 -1.37 0.00 0.00 64.86 61.10 2qbb h ILE 52 Cb 0.35 2.41 -0.06 0.00 0.47 0.00 0.00 36.82 39.98 2qbb h ILE 52 CO -0.26 0.74 -0.15 0.44 -3.07 0.00 0.00 178.15 175.86 2qbb h ASP 53 N 0.11 -0.50 -0.97 2.19 3.45 -0.31 -1.16 116.42 119.22 2qbb h ASP 53 Ca -0.04 0.11 0.04 0.00 0.43 0.00 0.00 57.03 57.58 2qbb h ASP 53 Cb 1.45 0.26 -0.06 0.00 -0.56 0.00 0.00 39.33 40.42 2qbb h ASP 53 CO 0.13 -0.19 0.63 0.71 -1.57 0.00 0.00 179.24 178.95 2qbb h THR 54 N -0.12 1.15 0.00 0.35 1.35 -0.99 -2.45 112.91 112.20 2qbb h THR 54 Ca 0.14 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 2qbb h THR 54 Cb 0.34 -0.17 0.00 0.00 -1.73 0.00 0.00 68.15 66.59 2qbb h THR 54 CO -0.34 0.22 0.00 0.18 -0.25 0.00 0.00 175.52 175.33 2qbb n LEU 55 N -4.48 0.00 -0.31 3.87 4.77 -0.48 -0.94 117.00 119.43 2qbb n LEU 55 Ca 0.13 0.96 0.15 0.00 -0.03 0.00 0.00 56.01 57.23 2qbb n LEU 55 Cb 0.11 -0.46 0.32 0.00 -2.33 0.00 0.00 43.42 41.06 2qbb n LEU 55 CO 0.34 -0.46 0.92 0.03 -1.33 0.00 0.00 177.39 176.89 2qbb h ARG 56 N 0.00 0.14 -0.01 3.23 3.08 -1.40 -0.48 114.38 118.94 2qbb h ARG 56 Ca 0.00 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.06 2qbb h ARG 56 Cb 0.00 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 2qbb h ARG 56 CO 0.00 0.09 -0.12 0.22 -1.07 0.00 0.00 179.97 179.09 2qbb h ASP 57 N 0.14 -0.34 -0.01 7.04 3.58 -0.92 -1.31 116.42 124.60 2qbb h ASP 57 Ca 0.59 0.05 -0.14 0.00 0.42 0.00 0.00 57.03 57.95 2qbb h ASP 57 Cb 1.24 0.15 -0.01 0.00 1.72 0.00 0.00 39.33 42.43 2qbb h ASP 57 CO -0.73 -0.17 -0.44 -0.08 -2.88 0.00 0.00 179.24 174.95 2qbb h GLU 58 N -0.20 0.55 0.00 0.28 4.57 0.47 -2.76 114.58 117.49 2qbb h GLU 58 Ca 0.05 -0.29 0.00 0.00 -1.18 0.00 0.00 59.36 57.93 2qbb h GLU 58 Cb 0.25 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 2qbb h GLU 58 CO -0.12 0.88 0.00 1.55 -1.18 0.00 0.00 179.01 180.14 2qbb n VAL 59 N -4.01 0.75 0.19 0.32 3.14 -0.40 -2.78 118.33 115.54 2qbb n VAL 59 Ca -0.02 0.07 0.11 0.00 -2.96 0.00 0.00 64.34 61.54 2qbb n VAL 59 Cb 0.54 -0.99 0.57 0.00 -1.06 0.00 0.00 33.84 32.89 2qbb n VAL 59 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2qbb n ALA 60 N -1.79 1.11 -0.89 1.55 0.00 -0.51 -3.49 120.51 116.50 2qbb n ALA 60 Ca 0.03 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.65 2qbb n ALA 60 Cb 0.29 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.42 2qbb n ALA 60 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qbb n LYS 61 N -2.24 0.00 -1.61 0.00 4.76 -1.12 -4.88 118.16 113.07 2qbb n LYS 61 Ca -0.01 0.05 -0.45 0.00 -2.87 0.00 0.00 58.31 55.03 2qbb n LYS 61 Cb 0.06 -0.54 -0.02 0.00 -1.84 0.00 0.00 35.03 32.68 2qbb n LYS 61 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2qbb n PHE 62 N -0.68 1.52 -2.14 2.13 7.35 -1.23 -4.89 117.46 119.53 2qbb n PHE 62 Ca 0.00 0.64 -0.41 0.00 -0.76 0.00 0.00 57.45 56.91 2qbb n PHE 62 Cb 0.00 -2.31 -0.03 0.00 0.35 0.00 0.00 39.48 37.50 2qbb n PHE 62 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 2qbb s VAL 63 N -0.69 3.04 0.22 -2.13 1.01 -1.26 -4.97 120.40 115.62 2qbb s VAL 63 Ca 0.63 0.84 -0.06 0.00 0.00 0.00 0.00 61.98 63.40 2qbb s VAL 63 Cb -0.72 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 2qbb s VAL 63 CO 0.57 0.12 0.27 0.68 0.00 0.00 0.00 175.10 176.74 2qbb s VAL 64 N 0.26 0.00 0.00 2.92 -7.23 -1.26 -4.75 120.40 110.34 2qbb s VAL 64 Ca 0.59 -1.76 0.00 0.00 -1.81 0.00 0.00 61.98 59.00 2qbb s VAL 64 Cb -0.38 -2.39 0.00 0.00 0.56 0.00 0.00 36.38 34.17 2qbb s VAL 64 CO 0.38 0.00 0.00 -0.62 -0.31 0.00 0.00 175.10 174.55 2qbb n GLU 65 N -0.32 0.00 0.00 4.82 -0.58 -1.26 -3.40 120.64 119.90 2qbb n GLU 65 Ca 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 2qbb n GLU 65 Cb 0.64 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.51 2qbb n GLU 65 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qbb n GLY 66 N 0.00 -3.07 0.27 0.62 0.00 -1.26 -0.81 105.19 100.94 2qbb n GLY 66 Ca 0.00 0.65 0.26 0.00 0.00 0.00 0.00 46.02 46.93 2qbb n GLY 66 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qbb n ASP 67 N -1.10 0.26 0.03 1.61 8.00 -1.22 0.69 116.55 124.81 2qbb n ASP 67 Ca 0.00 1.39 -0.01 0.00 0.71 0.00 0.00 54.79 56.88 2qbb n ASP 67 Cb 0.00 -0.67 -0.01 0.00 -0.02 0.00 0.00 41.12 40.43 2qbb n ASP 67 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2qbb h LEU 68 N 0.00 -0.06 -1.62 0.64 3.38 -1.16 0.83 115.31 117.32 2qbb h LEU 68 Ca 0.70 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.67 2qbb h LEU 68 Cb 1.82 0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.58 2qbb h LEU 68 CO -0.66 -0.02 0.39 0.03 0.09 0.00 0.00 178.44 178.28 2qbb h ARG 69 N -0.14 0.00 0.00 1.13 2.47 0.06 0.62 114.38 118.53 2qbb h ARG 69 Ca -0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 2qbb h ARG 69 Cb 0.06 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.38 2qbb h ARG 69 CO 0.01 0.00 0.00 -2.13 0.56 0.00 0.00 179.97 178.41 2qbb n ARG 70 N -2.71 0.00 0.19 0.04 3.00 0.22 -4.35 116.66 113.05 2qbb n ARG 70 Ca -0.02 0.33 0.16 0.00 -0.00 0.00 0.00 57.85 58.32 2qbb n ARG 70 Cb 0.43 -0.83 0.79 0.00 0.00 0.00 0.00 32.46 32.86 2qbb n ARG 70 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 2qbb h GLU 71 N 0.00 0.00 -0.08 -0.14 4.81 0.11 -0.33 114.58 118.96 2qbb h GLU 71 Ca 0.00 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.25 2qbb h GLU 71 Cb 0.00 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 2qbb h GLU 71 CO 0.00 0.00 0.15 0.97 -0.73 0.00 0.00 179.01 179.40 2qbb h ILE 72 N 0.00 0.25 0.00 2.32 6.09 0.08 0.37 117.51 126.62 2qbb h ILE 72 Ca 0.09 0.00 -0.20 0.00 -1.37 0.00 0.00 64.86 63.37 2qbb h ILE 72 Cb 0.44 0.87 -0.03 0.00 0.47 0.00 0.00 36.82 38.56 2qbb h ILE 72 CO -0.00 0.00 -1.20 0.28 -3.07 0.00 0.00 178.15 174.16 2qbb h SER 73 N 0.00 0.00 -0.09 2.19 0.02 -1.24 -3.29 113.55 111.14 2qbb h SER 73 Ca 0.04 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 61.02 2qbb h SER 73 Cb 0.34 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.84 2qbb h SER 73 CO -0.00 0.81 -0.14 0.24 -1.14 0.00 0.00 176.83 176.60 2qbb h MET 74 N 0.00 -0.18 0.45 3.45 2.86 -0.32 0.94 114.93 122.12 2qbb h MET 74 Ca -0.12 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 2qbb h MET 74 Cb 1.73 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 33.42 2qbb h MET 74 CO 0.08 -0.12 -0.31 0.66 1.06 0.00 0.00 176.91 178.28 2qbb h SER 75 N -0.19 -0.81 -0.34 1.22 4.64 -1.66 0.11 113.55 116.52 2qbb h SER 75 Ca 0.08 0.06 0.04 0.00 -0.47 0.00 0.00 61.79 61.50 2qbb h SER 75 Cb 0.30 0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 62.60 2qbb h SER 75 CO -0.20 -0.48 0.10 0.40 -0.87 0.00 0.00 176.83 175.78 2qbb h ILE 76 N -0.74 0.87 -0.52 0.95 2.04 -1.57 -2.08 117.51 116.46 2qbb h ILE 76 Ca -0.05 -0.08 0.10 0.00 1.00 0.00 0.00 64.86 65.83 2qbb h ILE 76 Cb 0.63 0.62 -0.08 0.00 -0.74 0.00 0.00 36.82 37.24 2qbb h ILE 76 CO 0.02 0.04 0.04 0.50 0.00 0.00 0.00 178.15 178.75 2qbb h LYS 77 N 0.23 0.15 -0.01 2.37 3.64 0.12 -2.51 116.57 120.56 2qbb h LYS 77 Ca 0.16 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2qbb h LYS 77 Cb 0.16 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.94 2qbb h LYS 77 CO -0.19 0.10 -0.01 0.00 -2.27 0.00 0.00 179.45 177.08 2qbb h ARG 78 N 0.15 -0.01 -0.90 1.90 3.08 -0.05 0.21 114.38 118.77 2qbb h ARG 78 Ca 0.26 0.00 0.24 0.00 0.07 0.00 0.00 59.98 60.55 2qbb h ARG 78 Cb 0.39 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 30.28 2qbb h ARG 78 CO -0.40 -0.00 0.07 -0.07 -1.07 0.00 0.00 179.97 178.49 2qbb h LEU 79 N -0.01 -0.34 0.48 3.04 3.38 -1.44 0.70 115.31 121.13 2qbb h LEU 79 Ca 0.00 0.24 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 2qbb h LEU 79 Cb 0.01 0.40 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2qbb h LEU 79 CO -0.01 -0.27 -0.42 0.24 0.09 0.00 0.00 178.44 178.07 2qbb h MET 80 N 0.08 -0.84 -0.65 1.13 2.86 -0.67 -0.30 114.93 116.53 2qbb h MET 80 Ca 0.54 0.06 0.00 0.00 -2.06 0.00 0.00 59.70 58.24 2qbb h MET 80 Cb 1.08 0.19 0.00 0.00 0.06 0.00 0.00 31.60 32.93 2qbb h MET 80 CO -0.80 -0.56 0.00 -0.40 1.06 0.00 0.00 176.91 176.21 2qbb n ASP 81 N -4.96 0.65 -0.11 1.22 3.85 0.59 -3.19 116.55 114.60 2qbb n ASP 81 Ca -0.11 -1.92 -0.18 0.00 -0.71 0.00 0.00 54.79 51.87 2qbb n ASP 81 Cb 0.39 -0.32 -0.09 0.00 -1.35 0.00 0.00 41.12 39.75 2qbb n ASP 81 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.20 176.08 2qbb n LEU 82 N -0.15 2.31 0.00 -2.12 0.00 0.23 -5.00 117.00 112.26 2qbb n LEU 82 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 56.01 56.08 2qbb n LEU 82 Cb 0.16 -0.68 0.00 0.00 0.00 0.00 0.00 43.42 42.90 2qbb n LEU 82 CO 0.00 0.66 0.00 0.61 0.00 0.00 0.00 177.39 178.66 2qbb n GLY 83 N 2.11 1.93 3.75 -3.96 0.00 -0.26 -5.04 105.19 103.73 2qbb n GLY 83 Ca -0.39 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.38 2qbb n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbb h TYR 85 N 2.16 0.27 0.16 0.00 3.20 -1.98 -0.16 116.97 120.63 2qbb h TYR 85 Ca -0.47 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.40 2qbb h TYR 85 Cb 1.22 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 39.41 2qbb h TYR 85 CO 0.60 0.01 -0.08 0.00 -1.64 0.00 0.00 178.16 177.05 2qbb h ARG 86 N 0.15 -0.21 -0.59 1.82 3.08 -1.94 -2.18 114.38 114.52 2qbb h ARG 86 Ca 0.60 0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.72 2qbb h ARG 86 Cb 2.03 0.05 -0.06 0.00 0.08 0.00 0.00 29.97 32.07 2qbb h ARG 86 CO -0.14 -0.14 0.28 0.78 -1.07 0.00 0.00 179.97 179.69 2qbb h GLY 87 N -0.21 0.84 -0.24 0.04 0.00 -1.55 -1.55 103.07 100.40 2qbb h GLY 87 Ca -0.02 -0.19 0.28 0.00 0.00 0.00 0.00 47.33 47.40 2qbb h GLY 87 CO 0.03 0.09 0.66 1.41 0.00 0.00 0.00 176.54 178.73 2qbb h LEU 88 N 0.53 0.49 -0.14 3.11 3.38 -1.06 0.35 115.31 121.97 2qbb h LEU 88 Ca 0.27 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.34 2qbb h LEU 88 Cb 0.23 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2qbb h LEU 88 CO -0.21 0.06 0.04 0.03 0.09 0.00 0.00 178.44 178.45 2qbb h ARG 89 N 0.41 0.22 -0.26 1.13 2.47 -0.60 -3.06 114.38 114.69 2qbb h ARG 89 Ca 0.63 -0.05 0.05 0.00 -1.26 0.00 0.00 59.98 59.36 2qbb h ARG 89 Cb 1.53 -0.03 -0.05 0.00 -1.65 0.00 0.00 29.97 29.77 2qbb h ARG 89 CO -0.37 0.35 -0.07 0.45 0.56 0.00 0.00 179.97 180.89 2qbb h HIS 90 N 0.04 -0.15 -0.92 3.04 3.86 -0.87 0.70 115.15 120.85 2qbb h HIS 90 Ca 0.04 0.02 0.07 0.00 -1.16 0.00 0.00 60.37 59.34 2qbb h HIS 90 Cb 0.22 0.11 -0.06 0.00 1.06 0.00 0.00 27.41 28.73 2qbb h HIS 90 CO -0.00 -0.12 0.58 0.07 0.86 0.00 0.00 177.93 179.32 2qbb h ARG 91 N -0.01 1.01 -0.00 2.45 -0.00 -1.51 0.24 114.38 116.56 2qbb h ARG 91 Ca 0.13 -0.06 0.00 0.00 -0.00 0.00 0.00 59.98 60.04 2qbb h ARG 91 Cb 0.20 -0.23 0.00 0.00 -0.00 0.00 0.00 29.97 29.94 2qbb h ARG 91 CO -0.27 0.67 -0.01 0.54 -0.00 0.00 0.00 179.97 180.90 2qbb n ARG 92 N -4.58 1.04 -1.18 0.08 5.12 -0.89 -4.89 116.66 111.36 2qbb n ARG 92 Ca 0.14 -0.21 -0.06 0.00 -1.93 0.00 0.00 57.85 55.78 2qbb n ARG 92 Cb 0.19 -1.50 -0.03 0.00 -1.16 0.00 0.00 32.46 29.97 2qbb n ARG 92 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qbb n GLY 93 N 1.09 0.67 3.88 -0.13 0.00 0.85 -4.97 105.19 106.59 2qbb n GLY 93 Ca 0.21 -0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2qbb n GLY 93 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qbb s LEU 94 N -1.45 3.84 0.05 0.99 1.43 -0.35 -3.05 118.68 120.14 2qbb s LEU 94 Ca 0.00 1.05 -0.33 0.00 -1.03 0.00 0.00 54.13 53.81 2qbb s LEU 94 Cb 0.00 -3.93 -0.12 0.00 0.03 0.00 0.00 46.19 42.17 2qbb s LEU 94 CO 0.00 -0.39 1.76 -0.81 0.23 0.00 0.00 176.35 177.14 2qbb n PRO 95 N -1.36 2.32 0.03 1.29 -0.04 -1.26 -4.31 135.00 131.67 2qbb n PRO 95 Ca 0.02 0.85 -0.17 0.00 -0.04 0.00 0.00 63.50 64.15 2qbb n PRO 95 Cb 0.54 -2.68 -0.14 0.00 -0.04 0.00 0.00 33.50 31.18 2qbb n PRO 95 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2qbb h VAL 96 N 4.60 0.95 0.00 0.52 2.07 -1.91 -3.33 116.25 119.15 2qbb h VAL 96 Ca -0.47 -2.64 0.00 0.00 0.82 0.00 0.00 66.70 64.41 2qbb h VAL 96 Cb 1.25 2.63 0.00 0.00 -1.52 0.00 0.00 31.29 33.65 2qbb h VAL 96 CO 0.93 0.78 0.00 0.54 0.02 0.00 0.00 177.57 179.84 2qbb n ARG 97 N -3.39 0.32 -3.10 1.57 3.00 -1.26 -4.79 116.66 109.02 2qbb n ARG 97 Ca -0.21 0.00 -0.07 0.00 -0.01 0.00 0.00 57.85 57.56 2qbb n ARG 97 Cb 1.05 -1.15 0.01 0.00 0.00 0.00 0.00 32.46 32.36 2qbb n ARG 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2qbb n GLY 98 N 0.32 -1.19 3.06 -0.13 0.00 -1.25 -5.05 105.19 100.94 2qbb n GLY 98 Ca 0.00 0.76 -0.22 0.00 0.00 0.00 0.00 46.02 46.56 2qbb n GLY 98 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qbb n GLN 99 N -1.33 0.86 -3.08 1.61 3.00 -1.26 -5.09 117.38 112.10 2qbb n GLN 99 Ca -0.00 -2.82 -0.43 0.00 -0.01 0.00 0.00 57.00 53.74 2qbb n GLN 99 Cb 0.52 0.39 -0.06 0.00 0.00 0.00 0.00 30.24 31.08 2qbb n GLN 99 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.06 176.08 2qbb s ARG 100 N -3.76 3.41 0.43 -1.09 1.70 -1.26 -4.91 118.95 113.46 2qbb s ARG 100 Ca 0.21 -0.21 0.23 0.00 -0.47 0.00 0.00 55.73 55.49 2qbb s ARG 100 Cb -0.02 -3.91 0.33 0.00 -0.57 0.00 0.00 34.95 30.79 2qbb s ARG 100 CO 0.13 -0.96 1.59 1.79 -1.08 0.00 0.00 175.30 176.77 2qbb h THR 101 N 5.84 0.00 -1.00 4.99 1.35 -1.98 -3.29 112.91 118.82 2qbb h THR 101 Ca -0.26 -0.99 0.16 0.00 -0.55 0.00 0.00 66.41 64.78 2qbb h THR 101 Cb 1.10 1.97 -0.10 0.00 -1.73 0.00 0.00 68.15 69.39 2qbb h THR 101 CO 0.89 0.00 0.61 0.50 -0.25 0.00 0.00 175.52 177.27 2qbb h LYS 102 N 0.00 0.82 -3.29 4.72 3.64 -2.05 -3.44 116.57 116.96 2qbb h LYS 102 Ca 0.00 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.29 2qbb h LYS 102 Cb 1.00 -0.18 -0.13 0.00 -0.41 0.00 0.00 32.23 32.51 2qbb h LYS 102 CO 0.00 0.54 0.00 0.95 -2.27 0.00 0.00 179.45 178.67 2qbb s THR 103 N -5.90 0.05 -0.29 1.00 -4.23 -1.24 -5.06 115.64 99.97 2qbb s THR 103 Ca -0.12 -0.45 -0.01 0.00 -1.18 0.00 0.00 61.69 59.93 2qbb s THR 103 Cb 0.24 -1.15 0.01 0.00 1.34 0.00 0.00 72.50 72.94 2qbb s THR 103 CO 0.80 -0.23 0.03 0.59 -0.54 0.00 0.00 174.62 175.27 2qbb n ASN 104 N -0.27 -7.17 -0.02 3.99 4.13 -1.26 -4.72 115.26 109.94 2qbb n ASN 104 Ca -0.16 1.42 0.00 0.00 1.68 0.00 0.00 54.58 57.52 2qbb n ASN 104 Cb 0.64 -5.31 0.00 0.00 -1.54 0.00 0.00 39.78 33.57 2qbb n ASN 104 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2qbb n ALA 105 N 0.81 0.94 -0.37 5.41 0.00 -1.26 -4.77 120.51 121.26 2qbb n ALA 105 Ca -0.05 0.00 0.31 0.00 0.00 0.00 0.00 53.44 53.70 2qbb n ALA 105 Cb 0.07 0.00 0.62 0.00 0.00 0.00 0.00 19.45 20.14 2qbb n ALA 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qbb h ARG 106 N 0.00 0.19 0.32 0.00 2.47 -1.79 -0.62 114.38 114.95 2qbb h ARG 106 Ca 0.00 -0.01 -0.02 0.00 -1.26 0.00 0.00 59.98 58.69 2qbb h ARG 106 Cb 0.91 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 29.19 2qbb h ARG 106 CO 0.00 0.13 -0.15 1.15 0.56 0.00 0.00 179.97 181.65 2qbb h THR 107 N 0.20 0.00 0.01 2.04 2.02 -1.93 -3.34 112.91 111.91 2qbb h THR 107 Ca 0.66 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 67.47 2qbb h THR 107 Cb 2.07 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 68.48 2qbb h THR 107 CO -0.24 0.00 -0.04 -0.09 0.37 0.00 0.00 175.52 175.52 2qbb h ARG 108 N -0.80 -0.06 -7.10 6.66 9.65 -1.71 -3.44 114.38 117.58 2qbb h ARG 108 Ca -0.04 0.00 -0.46 0.00 -1.10 0.00 0.00 59.98 58.38 2qbb h ARG 108 Cb 0.33 0.01 0.08 0.00 -1.39 0.00 0.00 29.97 29.00 2qbb h ARG 108 CO 0.07 -0.04 0.10 -1.59 2.80 0.00 0.00 179.97 181.31 2qbb s LYS 109 N -3.22 1.88 0.94 0.20 -2.85 -0.30 -4.86 119.74 111.53 2qbb s LYS 109 Ca -0.01 -0.91 -0.12 0.00 -1.00 0.00 0.00 55.97 53.92 2qbb s LYS 109 Cb 0.00 -2.33 0.05 0.00 -2.06 0.00 0.00 37.83 33.50 2qbb s LYS 109 CO 0.05 -1.31 0.54 0.41 0.10 0.00 0.00 175.35 175.14 2qbb n GLY 110 N -2.78 -1.71 0.00 0.59 0.00 -1.26 -4.37 105.19 95.66 2qbb n GLY 110 Ca 0.13 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.41 2qbb n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qbb n PRO 111 N -2.14 0.00 -4.12 1.61 -0.04 -1.25 -4.52 135.00 124.55 2qbb n PRO 111 Ca 0.08 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.19 2qbb n PRO 111 Cb 0.53 -0.34 -0.13 0.00 -0.04 0.00 0.00 33.50 33.53 2qbb n PRO 111 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2qbb s ARG 112 N 0.00 3.57 0.00 0.54 1.81 -1.26 -4.79 118.95 118.82 2qbb s ARG 112 Ca 0.00 -0.55 0.05 0.00 -1.72 0.00 0.00 55.73 53.51 2qbb s ARG 112 Cb 0.00 -3.03 0.04 0.00 -0.45 0.00 0.00 34.95 31.51 2qbb s ARG 112 CO 0.00 0.01 0.65 1.63 -0.68 0.00 0.00 175.30 176.91