#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbd h ARG 2 N 0.00 1.07 0.00 0.00 -0.00 -1.67 -3.35 114.38 110.43 2qbd h ARG 2 Ca 0.00 -0.06 0.00 0.00 -0.50 0.00 0.00 59.98 59.42 2qbd h ARG 2 Cb 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 29.97 29.73 2qbd h ARG 2 CO 0.00 0.71 0.00 -0.89 0.00 0.00 0.00 179.97 179.79 2qbd n ILE 3 N -4.41 0.00 0.17 2.04 5.41 -1.26 -0.18 119.36 121.13 2qbd n ILE 3 Ca 0.09 0.00 0.02 0.00 1.00 0.00 0.00 62.75 63.86 2qbd n ILE 3 Cb 0.03 0.00 0.32 0.00 -0.71 0.00 0.00 39.64 39.28 2qbd n ILE 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2qbd h ALA 4 N -0.87 1.28 0.00 -1.39 0.00 -1.88 -3.46 119.26 112.94 2qbd h ALA 4 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2qbd h ALA 4 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2qbd h ALA 4 CO 0.00 0.53 0.00 0.41 0.00 0.00 0.00 179.25 180.19 2qbd n GLY 5 N -0.29 2.78 5.13 0.00 0.00 0.75 -5.04 105.19 108.53 2qbd n GLY 5 Ca -0.02 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2qbd n GLY 5 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2qbd n ILE 6 N 0.00 0.00 0.00 -0.61 5.41 -1.23 -4.83 119.36 118.10 2qbd n ILE 6 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2qbd n ILE 6 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 2qbd n ILE 6 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2qbd n ASN 7 N 1.00 0.00 -3.33 4.38 5.03 -1.26 -3.83 115.26 117.25 2qbd n ASN 7 Ca 0.00 0.00 -0.31 0.00 0.87 0.00 0.00 54.58 55.14 2qbd n ASN 7 Cb 0.00 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 38.73 2qbd n ASN 7 CO 0.00 0.00 0.00 2.30 -1.83 0.00 0.00 177.26 177.73 2qbd n ILE 8 N 0.00 3.70 -1.92 2.41 -5.35 -1.26 -3.86 119.36 113.10 2qbd n ILE 8 Ca 0.00 -5.60 -0.42 0.00 -0.27 0.00 0.00 62.75 56.46 2qbd n ILE 8 Cb 0.00 -1.71 -0.03 0.00 -1.74 0.00 0.00 39.64 36.16 2qbd n ILE 8 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2qbd s PRO 9 N -3.27 3.12 0.21 6.28 0.04 -1.26 -4.70 135.00 135.43 2qbd s PRO 9 Ca 0.42 1.40 -0.00 0.00 0.04 0.00 0.00 61.00 62.86 2qbd s PRO 9 Cb 0.20 -4.28 -0.04 0.00 0.04 0.00 0.00 34.50 30.42 2qbd s PRO 9 CO -0.07 -2.11 0.13 -0.51 0.04 0.00 0.00 177.00 174.48 2qbd s ASP 10 N 7.12 0.38 -1.85 6.66 1.01 -1.26 -4.53 116.67 124.19 2qbd s ASP 10 Ca 0.82 -1.40 0.00 0.00 0.71 0.00 0.00 52.55 52.68 2qbd s ASP 10 Cb -0.22 0.35 0.00 0.00 1.01 0.00 0.00 42.92 44.06 2qbd s ASP 10 CO 0.31 -0.83 0.00 1.41 0.21 0.00 0.00 175.17 176.28 2qbd n HIS 11 N -0.31 -0.02 -4.30 4.23 8.25 -1.26 -4.88 115.22 116.92 2qbd n HIS 11 Ca 0.02 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.32 2qbd n HIS 11 Cb 0.66 -3.01 -0.10 0.00 1.12 0.00 0.00 29.99 28.66 2qbd n HIS 11 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2qbd s LYS 12 N -3.52 1.37 0.27 -0.41 -0.14 -1.26 -5.04 119.74 111.01 2qbd s LYS 12 Ca 0.00 -1.73 -0.29 0.00 -1.36 0.00 0.00 55.97 52.58 2qbd s LYS 12 Cb 0.00 -0.21 -0.09 0.00 -1.68 0.00 0.00 37.83 35.85 2qbd s LYS 12 CO 0.00 -0.29 1.20 -1.01 -0.76 0.00 0.00 175.35 174.49 2qbd s HIS 13 N -3.79 3.36 0.19 3.18 3.76 -1.26 -2.88 115.29 117.85 2qbd s HIS 13 Ca 0.37 1.52 -0.17 0.00 -0.15 0.00 0.00 55.06 56.63 2qbd s HIS 13 Cb 0.08 -3.46 0.17 0.00 1.11 0.00 0.00 32.58 30.48 2qbd s HIS 13 CO 0.13 -1.19 1.33 0.00 -0.85 0.00 0.00 174.74 174.16 2qbd n ALA 14 N 1.46 -0.17 -1.00 -1.40 0.00 0.27 -1.24 120.51 118.44 2qbd n ALA 14 Ca 0.01 0.84 0.00 0.00 0.00 0.00 0.00 53.44 54.29 2qbd n ALA 14 Cb 0.44 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.54 2qbd n ALA 14 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2qbd n VAL 15 N -5.24 0.00 -0.33 0.00 0.24 -1.25 -0.25 118.33 111.50 2qbd n VAL 15 Ca 0.08 0.68 0.00 0.00 -2.04 0.00 0.00 64.34 63.06 2qbd n VAL 15 Cb 0.33 -1.39 0.06 0.00 -1.47 0.00 0.00 33.84 31.37 2qbd n VAL 15 CO 0.00 0.00 0.00 -0.29 -2.14 0.00 0.00 176.83 174.40 2qbd h ILE 16 N 0.00 0.06 -0.97 1.34 2.10 -1.89 0.54 117.51 118.69 2qbd h ILE 16 Ca 0.00 0.00 0.18 0.00 1.08 0.00 0.00 64.86 66.12 2qbd h ILE 16 Cb 0.00 0.06 -0.09 0.00 -1.09 0.00 0.00 36.82 35.70 2qbd h ILE 16 CO 0.00 0.00 0.61 0.00 -1.08 0.00 0.00 178.15 177.68 2qbd h ALA 17 N 1.49 1.80 -0.17 0.18 0.00 -1.15 0.16 119.26 121.57 2qbd h ALA 17 Ca 0.36 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.22 2qbd h ALA 17 Cb 0.61 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2qbd h ALA 17 CO -0.92 -0.13 -0.33 1.25 0.00 0.00 0.00 179.25 179.12 2qbd h LEU 18 N 0.70 0.35 -0.94 0.00 6.46 0.32 -2.25 115.31 119.96 2qbd h LEU 18 Ca 0.53 -0.13 0.00 0.00 -0.12 0.00 0.00 57.88 58.16 2qbd h LEU 18 Cb 0.90 -0.10 0.00 0.00 -0.73 0.00 0.00 40.66 40.74 2qbd h LEU 18 CO -0.30 0.66 0.00 0.35 -0.62 0.00 0.00 178.44 178.53 2qbd n THR 19 N -4.08 1.03 0.22 1.05 -2.24 0.54 -2.20 114.28 108.60 2qbd n THR 19 Ca -0.01 0.49 0.18 0.00 -2.27 0.00 0.00 64.05 62.44 2qbd n THR 19 Cb 0.44 -1.44 0.84 0.00 -2.10 0.00 0.00 70.33 68.06 2qbd n THR 19 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2qbd h SER 20 N 0.00 0.00 -2.56 3.42 0.02 -1.27 -3.42 113.55 109.75 2qbd h SER 20 Ca 0.00 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.43 2qbd h SER 20 Cb 0.16 0.00 0.04 0.00 0.14 0.00 0.00 62.40 62.74 2qbd h SER 20 CO 0.00 0.00 1.10 -0.63 -1.14 0.00 0.00 176.83 176.16 2qbd s ILE 21 N -4.46 2.40 -0.79 3.27 1.01 -0.93 -4.81 121.20 116.88 2qbd s ILE 21 Ca -0.04 0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.63 2qbd s ILE 21 Cb 0.14 -3.01 0.00 0.00 0.01 0.00 0.00 42.46 39.59 2qbd s ILE 21 CO 0.47 0.00 0.62 -1.22 0.00 0.00 0.00 174.94 174.81 2qbd n TYR 22 N 5.31 0.00 0.00 3.97 0.53 -1.26 -1.79 117.16 123.92 2qbd n TYR 22 Ca 0.17 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 57.05 2qbd n TYR 22 Cb 0.37 -0.19 0.00 0.00 -1.03 0.00 0.00 39.34 38.49 2qbd n TYR 22 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2qbd n GLY 23 N -1.12 0.73 3.77 2.72 0.00 -1.26 -4.51 105.19 105.52 2qbd n GLY 23 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2qbd n GLY 23 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qbd s VAL 24 N -1.07 4.62 0.46 1.61 -7.23 -0.74 -4.91 120.40 113.14 2qbd s VAL 24 Ca 0.00 -0.51 0.01 0.00 -1.81 0.00 0.00 61.98 59.67 2qbd s VAL 24 Cb 0.00 -3.13 0.01 0.00 0.56 0.00 0.00 36.38 33.82 2qbd s VAL 24 CO 0.00 0.31 0.05 0.61 -0.31 0.00 0.00 175.10 175.76 2qbd n GLY 25 N 1.06 3.52 0.28 2.32 0.00 -1.26 -4.63 105.19 106.47 2qbd n GLY 25 Ca -0.12 -2.35 0.02 0.00 0.00 0.00 0.00 46.02 43.57 2qbd n GLY 25 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2qbd h LYS 26 N 0.00 0.02 -0.34 1.61 3.11 -1.96 -0.28 116.57 118.72 2qbd h LYS 26 Ca -0.37 -0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.47 2qbd h LYS 26 Cb 1.14 -0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 32.35 2qbd h LYS 26 CO 0.61 0.01 0.20 1.15 -2.81 0.00 0.00 179.45 178.61 2qbd h THR 27 N 0.02 1.12 -0.47 1.00 2.02 -1.99 -1.45 112.91 113.17 2qbd h THR 27 Ca 0.37 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 67.22 2qbd h THR 27 Cb 0.59 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 2qbd h THR 27 CO -0.75 0.12 0.17 -0.09 0.37 0.00 0.00 175.52 175.34 2qbd h ARG 28 N 0.44 0.71 -0.29 6.66 1.12 -1.63 -2.89 114.38 118.51 2qbd h ARG 28 Ca 0.12 -0.14 -0.06 0.00 -1.11 0.00 0.00 59.98 58.79 2qbd h ARG 28 Cb 0.02 -0.11 -0.01 0.00 -0.01 0.00 0.00 29.97 29.86 2qbd h ARG 28 CO -0.02 0.66 -0.07 1.03 -3.11 0.00 0.00 179.97 178.46 2qbd h SER 29 N 0.62 0.56 0.33 -3.80 0.87 -1.02 0.47 113.55 111.59 2qbd h SER 29 Ca 0.15 -0.36 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 2qbd h SER 29 Cb 0.23 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.03 2qbd h SER 29 CO -0.01 0.79 0.00 0.50 -0.53 0.00 0.00 176.83 177.58 2qbd h LYS 30 N 0.32 0.00 0.00 2.24 3.64 -1.25 -2.74 116.57 118.78 2qbd h LYS 30 Ca 0.07 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.18 2qbd h LYS 30 Cb 0.55 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.32 2qbd h LYS 30 CO 0.03 0.00 -2.03 0.00 -2.27 0.00 0.00 179.45 175.18 2qbd n ALA 31 N -1.91 1.62 -0.26 5.00 0.00 -1.08 -4.48 120.51 119.40 2qbd n ALA 31 Ca -0.01 -0.85 -0.06 0.00 0.00 0.00 0.00 53.44 52.52 2qbd n ALA 31 Cb 0.13 0.02 0.05 0.00 0.00 0.00 0.00 19.45 19.66 2qbd n ALA 31 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2qbd h ILE 32 N 0.00 1.21 0.30 0.00 2.10 0.11 -2.19 117.51 119.05 2qbd h ILE 32 Ca -0.40 -0.51 0.00 0.00 1.08 0.00 0.00 64.86 65.03 2qbd h ILE 32 Cb 1.74 0.26 -0.02 0.00 -1.09 0.00 0.00 36.82 37.70 2qbd h ILE 32 CO -0.03 0.23 -0.32 -0.07 -1.08 0.00 0.00 178.15 176.88 2qbd h LEU 33 N 0.97 -0.87 -0.25 2.19 3.38 -1.73 -0.47 115.31 118.54 2qbd h LEU 33 Ca 0.25 0.08 0.05 0.00 0.09 0.00 0.00 57.88 58.36 2qbd h LEU 33 Cb 0.01 0.30 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 2qbd h LEU 33 CO -0.04 -0.45 -0.11 0.00 0.09 0.00 0.00 178.44 177.93 2qbd h ALA 34 N -0.11 0.10 -0.33 1.53 0.00 -1.46 0.59 119.26 119.58 2qbd h ALA 34 Ca -0.01 0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.09 2qbd h ALA 34 Cb 0.60 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2qbd h ALA 34 CO -0.07 -0.52 0.26 0.00 0.00 0.00 0.00 179.25 178.92 2qbd h ALA 35 N 1.14 2.22 -0.49 0.00 0.00 -1.15 0.59 119.26 121.57 2qbd h ALA 35 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2qbd h ALA 35 Cb 0.26 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2qbd h ALA 35 CO -0.29 -0.43 0.00 0.00 0.00 0.00 0.00 179.25 178.52 2qbd n ALA 36 N -2.53 2.42 -3.27 0.00 0.00 0.19 -4.93 120.51 112.39 2qbd n ALA 36 Ca 0.05 -0.95 -0.17 0.00 0.00 0.00 0.00 53.44 52.37 2qbd n ALA 36 Cb 0.43 -0.96 0.06 0.00 0.00 0.00 0.00 19.45 18.99 2qbd n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qbd n GLY 37 N 1.40 -0.16 3.22 0.00 0.00 0.21 -4.88 105.19 104.98 2qbd n GLY 37 Ca 0.19 0.01 -0.25 0.00 0.00 0.00 0.00 46.02 45.96 2qbd n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qbd s ILE 38 N -3.24 1.58 0.00 -0.61 -1.09 0.18 -4.97 121.20 113.05 2qbd s ILE 38 Ca 0.36 -1.04 0.00 0.00 -2.23 0.00 0.00 60.65 57.74 2qbd s ILE 38 Cb -0.16 -1.35 0.00 0.00 -1.58 0.00 0.00 42.46 39.37 2qbd s ILE 38 CO 0.54 0.29 0.00 0.00 -1.23 0.00 0.00 174.94 174.54 2qbd n ALA 39 N 2.16 0.00 0.00 9.38 0.00 -1.26 -3.05 120.51 127.74 2qbd n ALA 39 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2qbd n ALA 39 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2qbd n ALA 39 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qbd n GLU 40 N 0.00 0.38 0.00 0.00 1.02 -1.26 -4.64 120.64 116.14 2qbd n GLU 40 Ca 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.20 2qbd n GLU 40 Cb 0.00 -0.73 0.33 0.00 -0.02 0.00 0.00 31.44 31.02 2qbd n GLU 40 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2qbd n ASP 41 N -1.80 0.00 -4.70 1.62 5.68 -1.26 -1.43 116.55 114.66 2qbd n ASP 41 Ca 0.00 0.06 -0.42 0.00 -0.50 0.00 0.00 54.79 53.93 2qbd n ASP 41 Cb 0.23 -0.26 -0.03 0.00 -1.14 0.00 0.00 41.12 39.92 2qbd n ASP 41 CO 0.00 0.00 0.00 0.68 -1.33 0.00 0.00 177.20 176.55 2qbd s VAL 42 N -2.53 4.44 -0.54 2.12 -7.23 -1.26 -4.78 120.40 110.63 2qbd s VAL 42 Ca 0.13 1.75 -0.28 0.00 -1.81 0.00 0.00 61.98 61.76 2qbd s VAL 42 Cb 0.09 -4.12 0.03 0.00 0.56 0.00 0.00 36.38 32.93 2qbd s VAL 42 CO 0.19 0.05 1.23 -0.54 -0.31 0.00 0.00 175.10 175.72 2qbd s LYS 43 N 1.74 3.55 0.43 4.82 1.02 -1.26 0.96 119.74 131.00 2qbd s LYS 43 Ca 0.54 0.42 0.25 0.00 0.02 0.00 0.00 55.97 57.20 2qbd s LYS 43 Cb -0.23 -4.00 1.28 0.00 -0.52 0.00 0.00 37.83 34.35 2qbd s LYS 43 CO 0.23 -1.63 1.71 -0.84 -0.92 0.00 0.00 175.35 173.90 2qbd h ILE 44 N 6.24 0.34 0.48 2.17 -0.00 -1.83 0.84 117.51 125.74 2qbd h ILE 44 Ca -0.25 -0.08 -0.01 0.00 -0.00 0.00 0.00 64.86 64.52 2qbd h ILE 44 Cb 1.07 0.09 -0.02 0.00 -0.00 0.00 0.00 36.82 37.95 2qbd h ILE 44 CO 1.16 0.04 -0.46 0.77 -0.00 0.00 0.00 178.15 179.66 2qbd h SER 45 N 0.23 -1.25 -0.09 2.16 4.64 -1.82 -1.90 113.55 115.53 2qbd h SER 45 Ca 0.69 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 62.11 2qbd h SER 45 Cb 2.04 0.41 0.00 0.00 -0.31 0.00 0.00 62.40 64.54 2qbd h SER 45 CO -0.33 -0.62 0.00 -1.84 -0.87 0.00 0.00 176.83 173.17 2qbd n GLU 46 N -5.54 1.31 -1.77 4.77 -0.00 -0.42 -4.91 120.64 114.08 2qbd n GLU 46 Ca -0.12 -0.47 -0.38 0.00 -0.00 0.00 0.00 57.16 56.19 2qbd n GLU 46 Cb 0.44 -1.29 0.05 0.00 -0.00 0.00 0.00 31.44 30.64 2qbd n GLU 46 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 2qbd s LEU 47 N -1.45 3.81 0.18 -1.84 1.98 0.16 -4.91 118.68 116.60 2qbd s LEU 47 Ca 0.25 2.75 -0.32 0.00 -2.89 0.00 0.00 54.13 53.93 2qbd s LEU 47 Cb 0.13 -4.33 -0.11 0.00 0.66 0.00 0.00 46.19 42.54 2qbd s LEU 47 CO 0.20 -1.64 1.70 -0.44 -1.89 0.00 0.00 176.35 174.28 2qbd s SER 48 N -1.01 6.44 0.15 3.68 0.01 -1.26 -4.89 113.70 116.82 2qbd s SER 48 Ca 0.73 2.78 -0.28 0.00 1.31 0.00 0.00 55.95 60.50 2qbd s SER 48 Cb -0.40 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.22 2qbd s SER 48 CO 0.47 -0.94 1.57 -0.08 0.41 0.00 0.00 173.24 174.66 2qbd h GLU 49 N 7.13 -0.31 -1.02 12.44 4.57 -1.95 -0.07 114.58 135.37 2qbd h GLU 49 Ca -0.43 0.02 0.26 0.00 -1.18 0.00 0.00 59.36 58.02 2qbd h GLU 49 Cb 1.20 0.07 -0.12 0.00 -0.16 0.00 0.00 28.75 29.75 2qbd h GLU 49 CO 0.95 -0.21 0.61 0.78 -1.18 0.00 0.00 179.01 179.96 2qbd h GLY 50 N -0.32 1.76 2.00 1.92 0.00 -2.01 0.68 103.07 107.10 2qbd h GLY 50 Ca 0.13 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.18 2qbd h GLY 50 CO -0.60 -0.23 0.00 -1.06 0.00 0.00 0.00 176.54 174.65 2qbd n GLN 51 N -4.83 0.20 0.04 4.80 6.02 -0.06 -2.50 117.38 121.04 2qbd n GLN 51 Ca 0.27 0.46 -0.21 0.00 -0.01 0.00 0.00 57.00 57.51 2qbd n GLN 51 Cb 0.79 -1.90 -0.14 0.00 1.02 0.00 0.00 30.24 30.00 2qbd n GLN 51 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 2qbd h ILE 52 N 0.00 1.37 0.00 5.09 5.03 0.65 -3.27 117.51 126.38 2qbd h ILE 52 Ca 0.00 -2.51 0.00 0.00 -0.12 0.00 0.00 64.86 62.23 2qbd h ILE 52 Cb 0.32 3.07 0.00 0.00 -3.03 0.00 0.00 36.82 37.17 2qbd h ILE 52 CO 0.00 0.72 0.19 0.44 -0.68 0.00 0.00 178.15 178.82 2qbd h ASP 53 N -0.33 0.00 0.01 1.72 5.19 -1.26 -1.26 116.42 120.50 2qbd h ASP 53 Ca -0.19 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.17 2qbd h ASP 53 Cb 1.70 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.22 2qbd h ASP 53 CO 0.13 0.00 -0.19 0.74 -3.12 0.00 0.00 179.24 176.80 2qbd h THR 54 N 0.00 1.63 -0.09 0.35 2.02 -1.60 -3.16 112.91 112.06 2qbd h THR 54 Ca 0.00 -2.10 0.03 0.00 0.77 0.00 0.00 66.41 65.11 2qbd h THR 54 Cb 0.38 3.01 -0.06 0.00 -1.74 0.00 0.00 68.15 69.74 2qbd h THR 54 CO 0.00 0.56 -0.54 -0.07 0.37 0.00 0.00 175.52 175.85 2qbd h LEU 55 N -0.68 -1.69 -0.83 2.58 3.38 -1.32 -1.45 115.31 115.30 2qbd h LEU 55 Ca -0.03 0.20 0.16 0.00 0.09 0.00 0.00 57.88 58.30 2qbd h LEU 55 Cb 1.03 0.65 -0.16 0.00 0.09 0.00 0.00 40.66 42.27 2qbd h LEU 55 CO 0.04 -0.49 -0.22 -0.09 0.09 0.00 0.00 178.44 177.76 2qbd h ARG 56 N -0.61 -0.01 -0.39 1.13 2.43 -1.66 0.34 114.38 115.61 2qbd h ARG 56 Ca 0.02 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.25 2qbd h ARG 56 Cb 0.69 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.19 2qbd h ARG 56 CO -0.41 -0.01 0.09 -0.44 -1.51 0.00 0.00 179.97 177.70 2qbd h ASP 57 N -0.01 0.04 0.72 -3.80 5.19 -1.24 -1.55 116.42 115.76 2qbd h ASP 57 Ca 0.39 0.06 -0.26 0.00 -0.62 0.00 0.00 57.03 56.60 2qbd h ASP 57 Cb 0.61 0.08 -0.00 0.00 0.18 0.00 0.00 39.33 40.19 2qbd h ASP 57 CO -0.86 0.06 -1.18 -0.08 -3.12 0.00 0.00 179.24 174.06 2qbd h GLU 58 N 0.23 0.21 0.00 3.56 4.81 -0.58 -3.21 114.58 119.60 2qbd h GLU 58 Ca 0.19 -0.35 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 2qbd h GLU 58 Cb 0.21 0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.72 2qbd h GLU 58 CO -0.23 1.16 0.00 -0.24 -0.73 0.00 0.00 179.01 178.97 2qbd h VAL 59 N 0.06 0.00 0.00 0.32 3.04 -0.23 -2.34 116.25 117.10 2qbd h VAL 59 Ca -0.10 -0.34 0.00 0.00 -1.01 0.00 0.00 66.70 65.25 2qbd h VAL 59 Cb 1.91 1.20 0.00 0.00 -2.01 0.00 0.00 31.29 32.40 2qbd h VAL 59 CO 0.19 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.75 2qbd h ALA 60 N 2.12 1.00 -0.24 3.17 0.00 -1.28 -2.92 119.26 121.11 2qbd h ALA 60 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2qbd h ALA 60 Cb 0.40 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2qbd h ALA 60 CO 0.00 0.00 -0.10 0.87 0.00 0.00 0.00 179.25 180.02 2qbd h LYS 61 N 0.00 0.49 -7.04 0.00 1.79 -1.60 -3.44 116.57 106.77 2qbd h LYS 61 Ca 0.00 -0.20 -0.44 0.00 -2.18 0.00 0.00 60.65 57.82 2qbd h LYS 61 Cb 0.38 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 30.99 2qbd h LYS 61 CO 0.00 0.74 0.34 0.12 -1.08 0.00 0.00 179.45 179.57 2qbd s PHE 62 N -4.65 3.34 0.15 -1.35 5.36 -1.10 -5.03 117.98 114.69 2qbd s PHE 62 Ca -0.13 1.63 -0.29 0.00 -0.96 0.00 0.00 56.93 57.17 2qbd s PHE 62 Cb 0.07 -2.87 -0.07 0.00 -0.34 0.00 0.00 43.02 39.82 2qbd s PHE 62 CO 0.77 -0.11 0.91 0.08 -1.46 0.00 0.00 175.22 175.42 2qbd s VAL 63 N -2.11 4.39 0.34 3.12 1.01 -1.26 -5.00 120.40 120.88 2qbd s VAL 63 Ca 0.61 1.99 0.03 0.00 0.00 0.00 0.00 61.98 64.61 2qbd s VAL 63 Cb -0.10 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 31.95 2qbd s VAL 63 CO 0.14 0.40 0.12 0.68 0.00 0.00 0.00 175.10 176.44 2qbd s VAL 64 N -0.46 0.61 0.00 2.92 -7.23 -1.26 -4.71 120.40 110.27 2qbd s VAL 64 Ca 0.43 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 2qbd s VAL 64 Cb -0.24 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.18 2qbd s VAL 64 CO 0.29 0.00 0.00 -1.84 -0.31 0.00 0.00 175.10 173.24 2qbd n GLU 65 N -0.70 0.00 0.00 4.82 0.00 -1.26 -1.17 120.64 122.33 2qbd n GLU 65 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.14 2qbd n GLU 65 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.09 2qbd n GLU 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2qbd n GLY 66 N 0.00 -1.15 0.24 -1.84 0.00 -1.26 -1.43 105.19 99.75 2qbd n GLY 66 Ca 0.00 0.25 0.17 0.00 0.00 0.00 0.00 46.02 46.43 2qbd n GLY 66 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2qbd h ASP 67 N 0.00 0.00 0.00 1.61 3.32 -1.90 -2.74 116.42 116.71 2qbd h ASP 67 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2qbd h ASP 67 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2qbd h ASP 67 CO 0.00 0.00 0.00 -0.11 -1.72 0.00 0.00 179.24 177.41 2qbd n LEU 68 N -2.69 0.83 -0.35 1.55 0.00 -0.31 -2.09 117.00 113.93 2qbd n LEU 68 Ca -0.01 0.32 0.27 0.00 0.00 0.00 0.00 56.01 56.59 2qbd n LEU 68 Cb 0.11 0.00 0.57 0.00 0.00 0.00 0.00 43.42 44.10 2qbd n LEU 68 CO 0.17 0.00 1.24 0.03 0.00 0.00 0.00 177.39 178.83 2qbd h ARG 69 N 0.00 0.27 0.06 1.96 3.08 -1.32 0.33 114.38 118.76 2qbd h ARG 69 Ca 0.00 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.06 2qbd h ARG 69 Cb 0.00 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 29.95 2qbd h ARG 69 CO 0.00 0.18 -0.29 -0.09 -1.07 0.00 0.00 179.97 178.70 2qbd h ARG 70 N 0.28 -0.45 0.04 0.04 9.65 -1.55 -2.05 114.38 120.33 2qbd h ARG 70 Ca 0.64 0.03 -0.27 0.00 -1.10 0.00 0.00 59.98 59.28 2qbd h ARG 70 Cb 1.84 0.10 0.02 0.00 -1.39 0.00 0.00 29.97 30.54 2qbd h ARG 70 CO -0.28 -0.30 -1.10 1.49 2.80 0.00 0.00 179.97 182.58 2qbd h GLU 71 N -0.47 0.59 -1.11 0.20 4.81 -0.45 -3.10 114.58 115.04 2qbd h GLU 71 Ca 0.05 -0.69 0.31 0.00 -0.13 0.00 0.00 59.36 58.89 2qbd h GLU 71 Cb 0.53 0.21 -0.06 0.00 0.63 0.00 0.00 28.75 30.06 2qbd h GLU 71 CO -0.21 1.29 0.77 0.97 -0.73 0.00 0.00 179.01 181.10 2qbd h ILE 72 N 0.30 0.46 0.12 2.32 2.10 -0.22 0.16 117.51 122.74 2qbd h ILE 72 Ca -0.14 -0.04 -0.22 0.00 1.08 0.00 0.00 64.86 65.54 2qbd h ILE 72 Cb 1.75 0.32 0.01 0.00 -1.09 0.00 0.00 36.82 37.81 2qbd h ILE 72 CO 0.21 0.02 -1.05 0.28 -1.08 0.00 0.00 178.15 176.53 2qbd h SER 73 N 0.13 0.39 -0.84 2.19 0.02 -1.40 -3.32 113.55 110.72 2qbd h SER 73 Ca 0.56 -0.89 0.17 0.00 -0.84 0.00 0.00 61.79 60.78 2qbd h SER 73 Cb 1.97 -0.13 -0.16 0.00 0.14 0.00 0.00 62.40 64.22 2qbd h SER 73 CO -0.11 1.47 -0.22 0.24 -1.14 0.00 0.00 176.83 177.08 2qbd h MET 74 N -0.40 -0.00 0.37 3.45 2.86 -0.63 0.13 114.93 120.71 2qbd h MET 74 Ca -0.21 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.42 2qbd h MET 74 Cb 1.65 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 33.28 2qbd h MET 74 CO 0.09 -0.00 -0.52 0.66 1.06 0.00 0.00 176.91 178.20 2qbd h SER 75 N -0.00 -1.47 -0.52 1.22 4.64 -1.50 -0.61 113.55 115.30 2qbd h SER 75 Ca 0.40 0.13 0.08 0.00 -0.47 0.00 0.00 61.79 61.93 2qbd h SER 75 Cb 0.61 0.51 -0.10 0.00 -0.31 0.00 0.00 62.40 63.10 2qbd h SER 75 CO -0.86 -0.63 -0.42 0.40 -0.87 0.00 0.00 176.83 174.44 2qbd h ILE 76 N -0.92 0.11 -0.71 0.95 2.04 -1.10 0.32 117.51 118.20 2qbd h ILE 76 Ca -0.04 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.95 2qbd h ILE 76 Cb 0.84 0.11 -0.13 0.00 -0.74 0.00 0.00 36.82 36.89 2qbd h ILE 76 CO -0.14 0.00 -0.24 0.50 0.00 0.00 0.00 178.15 178.27 2qbd h LYS 77 N -0.25 -0.05 0.00 2.37 3.64 -0.36 0.66 116.57 122.58 2qbd h LYS 77 Ca 0.17 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 2qbd h LYS 77 Cb 0.57 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 2qbd h LYS 77 CO -0.65 -0.03 0.00 -2.13 -2.27 0.00 0.00 179.45 174.37 2qbd n ARG 78 N -5.47 0.00 0.30 1.90 0.63 0.08 0.77 116.66 114.87 2qbd n ARG 78 Ca 0.08 0.80 0.19 0.00 -0.92 0.00 0.00 57.85 58.00 2qbd n ARG 78 Cb 0.37 -1.47 1.00 0.00 0.45 0.00 0.00 32.46 32.82 2qbd n ARG 78 CO 0.00 0.00 0.00 1.37 -2.51 0.00 0.00 177.63 176.49 2qbd h LEU 79 N 0.00 0.00 0.16 6.15 8.10 -1.22 -2.55 115.31 125.95 2qbd h LEU 79 Ca 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.98 2qbd h LEU 79 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.22 2qbd h LEU 79 CO 0.00 0.00 -0.08 -0.03 -4.11 0.00 0.00 178.44 174.22 2qbd h MET 80 N 0.00 -0.21 -2.04 0.17 4.05 0.11 -3.15 114.93 113.87 2qbd h MET 80 Ca 0.02 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.43 2qbd h MET 80 Cb 0.28 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.12 2qbd h MET 80 CO -0.00 -0.14 -0.03 -0.40 0.23 0.00 0.00 176.91 176.57 2qbd n ASP 81 N -3.32 4.15 0.00 1.39 3.85 0.23 -2.89 116.55 119.97 2qbd n ASP 81 Ca -0.03 -2.13 0.00 0.00 -0.71 0.00 0.00 54.79 51.93 2qbd n ASP 81 Cb 0.09 -0.92 0.00 0.00 -1.35 0.00 0.00 41.12 38.94 2qbd n ASP 81 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.20 176.08 2qbd n LEU 82 N 1.77 2.01 0.00 -2.12 0.00 -1.03 -4.95 117.00 112.69 2qbd n LEU 82 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.06 2qbd n LEU 82 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.86 2qbd n LEU 82 CO 0.02 0.33 0.00 0.61 0.00 0.00 0.00 177.39 178.36 2qbd n GLY 83 N 2.86 0.90 3.83 -3.96 0.00 -1.14 -5.10 105.19 102.58 2qbd n GLY 83 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2qbd n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbd h TYR 85 N 0.59 0.65 0.03 0.00 3.20 -1.99 -0.76 116.97 118.70 2qbd h TYR 85 Ca -0.46 0.04 0.03 0.00 3.14 0.00 0.00 58.73 61.47 2qbd h TYR 85 Cb 1.20 -0.15 -0.05 0.00 1.54 0.00 0.00 36.73 39.27 2qbd h TYR 85 CO 0.62 -0.04 -0.33 0.00 -1.64 0.00 0.00 178.16 176.77 2qbd h ARG 86 N 0.40 -0.49 0.32 1.82 3.08 -1.91 -0.84 114.38 116.77 2qbd h ARG 86 Ca 0.56 0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.63 2qbd h ARG 86 Cb 1.05 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.21 2qbd h ARG 86 CO -0.52 -0.32 -0.21 0.78 -1.07 0.00 0.00 179.97 178.63 2qbd h GLY 87 N -0.50 -0.53 -0.48 0.04 0.00 -1.14 -2.62 103.07 97.84 2qbd h GLY 87 Ca 0.05 0.23 0.20 0.00 0.00 0.00 0.00 47.33 47.81 2qbd h GLY 87 CO -0.25 -0.21 0.06 1.41 0.00 0.00 0.00 176.54 177.56 2qbd h LEU 88 N -0.51 -0.29 -0.91 3.11 3.38 -1.07 0.31 115.31 119.33 2qbd h LEU 88 Ca -0.03 0.21 0.08 0.00 0.09 0.00 0.00 57.88 58.23 2qbd h LEU 88 Cb 0.43 0.35 -0.07 0.00 0.09 0.00 0.00 40.66 41.46 2qbd h LEU 88 CO 0.02 -0.20 0.56 0.03 0.09 0.00 0.00 178.44 178.95 2qbd h ARG 89 N 0.12 0.96 0.51 1.13 2.47 -0.79 -1.86 114.38 116.91 2qbd h ARG 89 Ca 0.48 -0.06 -0.02 0.00 -1.26 0.00 0.00 59.98 59.12 2qbd h ARG 89 Cb 0.90 -0.22 0.00 0.00 -1.65 0.00 0.00 29.97 29.01 2qbd h ARG 89 CO -0.71 0.63 -0.24 0.45 0.56 0.00 0.00 179.97 180.66 2qbd h HIS 90 N 0.98 -0.63 -0.54 3.04 3.86 -0.11 0.15 115.15 121.90 2qbd h HIS 90 Ca 0.41 -0.01 0.10 0.00 -1.16 0.00 0.00 60.37 59.71 2qbd h HIS 90 Cb 0.27 0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.92 2qbd h HIS 90 CO -0.03 -0.33 0.37 0.07 0.86 0.00 0.00 177.93 178.87 2qbd h ARG 91 N -0.85 0.30 0.00 2.45 -0.00 -1.34 0.18 114.38 115.13 2qbd h ARG 91 Ca -0.07 -0.02 0.00 0.00 -0.00 0.00 0.00 59.98 59.89 2qbd h ARG 91 Cb 0.59 -0.07 0.00 0.00 -0.00 0.00 0.00 29.97 30.49 2qbd h ARG 91 CO 0.11 0.20 -0.21 0.54 -0.00 0.00 0.00 179.97 180.62 2qbd n ARG 92 N -4.46 0.19 -1.31 0.08 5.12 -0.71 -4.93 116.66 110.64 2qbd n ARG 92 Ca 0.09 0.11 -0.08 0.00 -1.93 0.00 0.00 57.85 56.04 2qbd n ARG 92 Cb 0.39 -1.68 -0.03 0.00 -1.16 0.00 0.00 32.46 29.98 2qbd n ARG 92 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qbd n GLY 93 N 1.38 0.91 3.93 -0.13 0.00 0.62 -5.03 105.19 106.88 2qbd n GLY 93 Ca 0.05 -0.67 -0.22 0.00 0.00 0.00 0.00 46.02 45.18 2qbd n GLY 93 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qbd s LEU 94 N -1.84 4.20 -0.13 0.99 1.43 0.15 -3.97 118.68 119.51 2qbd s LEU 94 Ca 0.00 0.01 -0.30 0.00 -1.03 0.00 0.00 54.13 52.81 2qbd s LEU 94 Cb 0.00 -2.75 -0.08 0.00 0.03 0.00 0.00 46.19 43.39 2qbd s LEU 94 CO 0.00 -0.04 2.09 -0.81 0.23 0.00 0.00 176.35 177.82 2qbd n PRO 95 N -1.20 2.18 0.04 1.29 -0.04 -1.26 -4.41 135.00 131.60 2qbd n PRO 95 Ca -0.08 0.71 -0.14 0.00 -0.04 0.00 0.00 63.50 63.95 2qbd n PRO 95 Cb 0.57 -3.00 -0.03 0.00 -0.04 0.00 0.00 33.50 31.00 2qbd n PRO 95 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2qbd h VAL 96 N 6.43 1.35 0.00 0.52 2.07 -1.90 -3.06 116.25 121.65 2qbd h VAL 96 Ca -0.43 -2.20 0.00 0.00 0.82 0.00 0.00 66.70 64.88 2qbd h VAL 96 Cb 1.25 2.20 0.00 0.00 -1.52 0.00 0.00 31.29 33.22 2qbd h VAL 96 CO 0.96 0.67 0.19 0.03 0.02 0.00 0.00 177.57 179.44 2qbd h ARG 97 N 0.34 0.00 -2.03 1.57 -0.00 -1.98 -3.46 114.38 108.83 2qbd h ARG 97 Ca -0.06 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.42 2qbd h ARG 97 Cb 1.45 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.42 2qbd h ARG 97 CO 0.15 0.00 0.00 0.41 0.00 0.00 0.00 179.97 180.53 2qbd n GLY 98 N -1.25 0.58 0.00 0.04 0.00 -1.16 -5.12 105.19 98.28 2qbd n GLY 98 Ca -0.02 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.58 2qbd n GLY 98 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qbd n GLN 99 N -0.88 3.78 -3.99 1.61 3.00 -1.26 -5.10 117.38 114.54 2qbd n GLN 99 Ca 0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.65 2qbd n GLN 99 Cb 0.34 0.00 -0.14 0.00 0.00 0.00 0.00 30.24 30.43 2qbd n GLN 99 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.06 176.08 2qbd s ARG 100 N 3.67 3.29 0.03 -1.09 1.70 -1.26 -4.99 118.95 120.30 2qbd s ARG 100 Ca 0.00 -0.68 0.01 0.00 -0.47 0.00 0.00 55.73 54.60 2qbd s ARG 100 Cb 0.00 -2.89 -0.26 0.00 -0.57 0.00 0.00 34.95 31.23 2qbd s ARG 100 CO 0.00 -0.18 0.95 1.79 -1.08 0.00 0.00 175.30 176.78 2qbd h THR 101 N 5.75 1.27 -1.05 4.99 1.35 -1.99 -3.31 112.91 119.92 2qbd h THR 101 Ca -0.42 -2.95 0.31 0.00 -0.55 0.00 0.00 66.41 62.80 2qbd h THR 101 Cb 1.16 2.75 -0.04 0.00 -1.73 0.00 0.00 68.15 70.28 2qbd h THR 101 CO 0.61 0.81 0.81 0.50 -0.25 0.00 0.00 175.52 178.00 2qbd h LYS 102 N 0.04 0.00 -2.28 4.72 3.64 -2.06 -3.41 116.57 117.23 2qbd h LYS 102 Ca -0.19 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.12 2qbd h LYS 102 Cb 1.96 0.00 -0.20 0.00 -0.41 0.00 0.00 32.23 33.57 2qbd h LYS 102 CO 0.15 0.00 0.03 0.99 -2.27 0.00 0.00 179.45 178.35 2qbd s THR 103 N -4.87 0.01 -0.05 1.00 2.01 -1.25 -5.09 115.64 107.41 2qbd s THR 103 Ca -0.05 -0.08 -0.04 0.00 0.31 0.00 0.00 61.69 61.84 2qbd s THR 103 Cb 0.21 -0.87 0.01 0.00 0.01 0.00 0.00 72.50 71.86 2qbd s THR 103 CO 0.75 -0.04 0.07 0.59 -0.69 0.00 0.00 174.62 175.30 2qbd n ASN 104 N 1.74 -4.93 0.00 3.53 4.13 -1.26 -4.61 115.26 113.87 2qbd n ASN 104 Ca -0.17 1.23 0.00 0.00 1.68 0.00 0.00 54.58 57.32 2qbd n ASN 104 Cb 0.56 -4.14 0.00 0.00 -1.54 0.00 0.00 39.78 34.66 2qbd n ASN 104 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2qbd n ALA 105 N 1.32 0.03 0.08 5.41 0.00 -1.26 -4.60 120.51 121.49 2qbd n ALA 105 Ca -0.12 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.48 2qbd n ALA 105 Cb 0.19 0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.06 2qbd n ALA 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qbd h ARG 106 N 0.00 0.00 0.00 0.00 2.47 -1.79 0.26 114.38 115.32 2qbd h ARG 106 Ca 0.00 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2qbd h ARG 106 Cb 0.15 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.47 2qbd h ARG 106 CO 0.00 0.00 -0.00 1.15 0.56 0.00 0.00 179.97 181.68 2qbd h THR 107 N 0.00 0.00 -0.61 2.04 2.02 -1.94 -3.38 112.91 111.05 2qbd h THR 107 Ca 0.22 -0.89 -0.01 0.00 0.77 0.00 0.00 66.41 66.50 2qbd h THR 107 Cb 2.01 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.39 2qbd h THR 107 CO -0.00 0.00 0.33 -0.09 0.37 0.00 0.00 175.52 176.13 2qbd h ARG 108 N -0.90 0.85 -6.14 6.66 9.65 -1.52 -3.44 114.38 119.54 2qbd h ARG 108 Ca -0.00 -0.10 -0.54 0.00 -1.10 0.00 0.00 59.98 58.24 2qbd h ARG 108 Cb 0.00 -0.17 -0.03 0.00 -1.39 0.00 0.00 29.97 28.39 2qbd h ARG 108 CO 0.00 0.65 -0.29 -1.59 2.80 0.00 0.00 179.97 181.54 2qbd s LYS 109 N -5.85 2.35 1.15 0.20 -2.85 0.77 -4.76 119.74 110.75 2qbd s LYS 109 Ca -0.13 -1.80 -0.15 0.00 -1.00 0.00 0.00 55.97 52.89 2qbd s LYS 109 Cb 0.13 -2.29 0.26 0.00 -2.06 0.00 0.00 37.83 33.88 2qbd s LYS 109 CO 0.78 -0.53 1.05 0.20 0.10 0.00 0.00 175.35 176.95 2qbd s GLY 110 N -4.31 1.54 0.00 0.59 0.00 -1.26 -4.37 107.32 99.51 2qbd s GLY 110 Ca 0.44 -0.47 0.00 0.00 0.00 0.00 0.00 44.72 44.68 2qbd s GLY 110 CO 0.27 0.28 0.00 -1.55 0.00 0.00 0.00 173.10 172.10 2qbd n PRO 111 N -4.72 0.00 -3.94 2.90 -0.04 -1.26 -4.49 135.00 123.45 2qbd n PRO 111 Ca 0.06 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.21 2qbd n PRO 111 Cb 0.57 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.99 2qbd n PRO 111 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2qbd s ARG 112 N 0.00 3.35 -0.36 0.54 1.81 -1.26 -4.89 118.95 118.15 2qbd s ARG 112 Ca 0.00 -0.45 0.14 0.00 -1.72 0.00 0.00 55.73 53.70 2qbd s ARG 112 Cb 0.00 -3.00 0.41 0.00 -0.45 0.00 0.00 34.95 31.91 2qbd s ARG 112 CO 0.00 0.62 1.02 1.63 -0.68 0.00 0.00 175.30 177.89 2qbd n LYS 113 N 0.48 1.11 0.00 3.54 4.01 -1.26 -5.27 118.16 120.77 2qbd n LYS 113 Ca -0.07 -2.84 0.03 0.00 -0.51 0.00 0.00 58.31 54.92 2qbd n LYS 113 Cb 0.51 -1.03 0.18 0.00 -0.51 0.00 0.00 35.03 34.18 2qbd n LYS 113 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94