#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qp1 n ARG 2 N 0.00 -0.33 -1.53 3.17 0.63 -1.26 -4.89 116.66 112.45 2qp1 n ARG 2 Ca 0.00 0.08 -0.61 0.00 -0.92 0.00 0.00 57.85 56.40 2qp1 n ARG 2 Cb 0.00 -4.11 -0.10 0.00 0.45 0.00 0.00 32.46 28.70 2qp1 n ARG 2 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 2qp1 n HIS 3 N -2.05 1.59 -0.86 -0.14 8.25 -1.26 0.57 115.22 121.32 2qp1 n HIS 3 Ca 0.00 0.78 0.00 0.00 -0.26 0.00 0.00 57.72 58.24 2qp1 n HIS 3 Cb 0.08 -2.34 0.00 0.00 1.12 0.00 0.00 29.99 28.85 2qp1 n HIS 3 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2qp1 n ARG 4 N 6.06 -0.62 -2.47 -0.41 5.12 -1.26 -4.98 116.66 118.11 2qp1 n ARG 4 Ca 0.40 0.15 -0.39 0.00 -1.93 0.00 0.00 57.85 56.08 2qp1 n ARG 4 Cb 0.02 -3.95 -0.04 0.00 -1.16 0.00 0.00 32.46 27.34 2qp1 n ARG 4 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2qp1 s LYS 5 N -0.90 4.40 0.00 5.56 1.02 0.19 -5.05 119.74 124.96 2qp1 s LYS 5 Ca 0.00 1.72 0.00 0.00 0.02 0.00 0.00 55.97 57.71 2qp1 s LYS 5 Cb 0.00 -2.91 0.00 0.00 -0.52 0.00 0.00 37.83 34.40 2qp1 s LYS 5 CO 0.00 0.02 0.00 0.45 -0.92 0.00 0.00 175.35 174.90 2qp1 n SER 6 N 0.62 0.06 -0.45 2.83 2.88 -1.26 -5.05 113.62 113.26 2qp1 n SER 6 Ca 0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 2qp1 n SER 6 Cb 0.46 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.92 2qp1 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2qp1 n GLY 7 N 5.00 -0.77 2.84 0.46 0.00 -1.26 -4.92 105.19 106.54 2qp1 n GLY 7 Ca 0.00 -1.08 0.03 0.00 0.00 0.00 0.00 46.02 44.98 2qp1 n GLY 7 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2qp1 s ARG 8 N 0.00 0.03 0.00 1.61 3.52 -1.26 -5.01 118.95 117.84 2qp1 s ARG 8 Ca 0.00 0.00 0.06 0.00 -0.13 0.00 0.00 55.73 55.66 2qp1 s ARG 8 Cb 0.00 0.01 0.30 0.00 -1.56 0.00 0.00 34.95 33.69 2qp1 s ARG 8 CO 0.00 -0.05 1.05 0.00 -0.81 0.00 0.00 175.30 175.49 2qp1 n GLN 9 N 4.07 0.08 0.00 5.12 10.64 -1.26 -4.83 117.38 131.20 2qp1 n GLN 9 Ca 0.07 0.24 0.00 0.00 -1.83 0.00 0.00 57.00 55.48 2qp1 n GLN 9 Cb 0.63 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 28.51 2qp1 n GLN 9 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 2qp1 n LEU 10 N -1.30 0.00 -1.68 2.61 7.99 -1.26 -1.80 117.00 121.56 2qp1 n LEU 10 Ca 0.03 0.00 -0.00 0.00 -0.01 0.00 0.00 56.01 56.02 2qp1 n LEU 10 Cb 0.05 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.36 2qp1 n LEU 10 CO 0.05 0.00 0.31 0.59 -1.51 0.00 0.00 177.39 176.83 2qp1 n ASN 11 N 0.50 -0.19 -3.68 -1.43 5.03 -1.26 -5.17 115.26 109.05 2qp1 n ASN 11 Ca 0.00 -1.13 -0.04 0.00 0.87 0.00 0.00 54.58 54.28 2qp1 n ASN 11 Cb 0.00 0.14 -0.01 0.00 -1.02 0.00 0.00 39.78 38.89 2qp1 n ASN 11 CO 0.00 0.00 0.00 -0.60 -1.83 0.00 0.00 177.26 174.83 2qp1 s ARG 12 N 0.01 1.05 0.78 3.52 6.06 -0.74 -5.15 118.95 124.48 2qp1 s ARG 12 Ca 0.01 -0.54 -0.13 0.00 -2.50 0.00 0.00 55.73 52.56 2qp1 s ARG 12 Cb 0.03 0.38 0.07 0.00 0.06 0.00 0.00 34.95 35.49 2qp1 s ARG 12 CO -0.01 -0.48 1.17 0.54 -2.50 0.00 0.00 175.30 174.03 2qp1 s ASN 13 N -2.83 3.96 0.20 -2.12 2.20 -1.26 -4.79 114.94 110.30 2qp1 s ASN 13 Ca 0.11 2.24 0.18 0.00 -0.94 0.00 0.00 52.86 54.45 2qp1 s ASN 13 Cb -0.01 -2.57 0.84 0.00 -2.00 0.00 0.00 41.25 37.51 2qp1 s ASN 13 CO -0.01 -2.41 1.55 -0.24 -2.94 0.00 0.00 177.10 173.05 2qp1 n SER 14 N -3.16 0.43 0.09 3.54 2.88 -1.26 -0.62 113.62 115.52 2qp1 n SER 14 Ca 0.12 0.65 0.13 0.00 -1.33 0.00 0.00 58.87 58.44 2qp1 n SER 14 Cb 0.51 -0.72 0.45 0.00 -0.75 0.00 0.00 64.21 63.70 2qp1 n SER 14 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2qp1 n SER 15 N -2.02 0.61 -0.08 -3.46 3.41 -1.26 -2.97 113.62 107.84 2qp1 n SER 15 Ca 0.01 0.57 -0.09 0.00 -0.26 0.00 0.00 58.87 59.10 2qp1 n SER 15 Cb 0.13 -0.73 -0.03 0.00 -0.26 0.00 0.00 64.21 63.32 2qp1 n SER 15 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2qp1 n HIS 16 N -2.09 0.00 0.29 7.33 -0.00 0.21 -4.44 115.22 116.52 2qp1 n HIS 16 Ca 0.05 0.00 0.12 0.00 -0.00 0.00 0.00 57.72 57.89 2qp1 n HIS 16 Cb 0.37 -0.48 0.65 0.00 -0.00 0.00 0.00 29.99 30.53 2qp1 n HIS 16 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2qp1 h ARG 17 N -0.94 0.00 -0.94 1.57 3.08 -1.63 1.84 114.38 117.36 2qp1 h ARG 17 Ca -0.01 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 2qp1 h ARG 17 Cb 0.95 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.95 2qp1 h ARG 17 CO -0.01 0.00 0.10 0.94 -1.07 0.00 0.00 179.97 179.93 2qp1 n GLN 18 N -2.66 1.75 0.00 0.04 0.00 -1.16 -3.32 117.38 112.03 2qp1 n GLN 18 Ca -0.02 -0.90 0.00 0.00 -0.00 0.00 0.00 57.00 56.08 2qp1 n GLN 18 Cb 0.41 -1.53 0.00 0.00 0.00 0.00 0.00 30.24 29.12 2qp1 n GLN 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2qp1 n ALA 19 N 0.10 0.04 0.00 1.69 0.00 0.52 -4.67 120.51 118.19 2qp1 n ALA 19 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 2qp1 n ALA 19 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.14 2qp1 n ALA 19 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 2qp1 n MET 20 N -1.86 0.00 -0.01 0.00 0.00 0.43 -0.93 117.12 114.75 2qp1 n MET 20 Ca 0.00 0.26 -0.01 0.00 -0.00 0.00 0.00 57.70 57.95 2qp1 n MET 20 Cb 0.00 -1.53 -0.01 0.00 0.00 0.00 0.00 33.22 31.68 2qp1 n MET 20 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 2qp1 n PHE 21 N -1.23 0.00 0.05 1.12 0.99 -1.21 -4.48 117.46 112.69 2qp1 n PHE 21 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.45 57.34 2qp1 n PHE 21 Cb 0.03 -0.04 -0.04 0.00 -1.00 0.00 0.00 39.48 38.42 2qp1 n PHE 21 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.76 176.67 2qp1 h ARG 22 N -0.00 -0.28 0.00 -1.08 2.43 -1.40 0.58 114.38 114.63 2qp1 h ARG 22 Ca -0.03 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2qp1 h ARG 22 Cb 1.04 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.65 2qp1 h ARG 22 CO -0.00 -0.19 -0.00 -0.91 -1.51 0.00 0.00 179.97 177.36 2qp1 h ASN 23 N -0.29 0.00 0.00 -3.80 2.35 -1.33 -2.46 115.58 110.06 2qp1 h ASN 23 Ca 0.06 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.74 2qp1 h ASN 23 Cb 0.36 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 2qp1 h ASN 23 CO -0.18 0.00 -0.43 -0.03 -1.65 0.00 0.00 177.43 175.15 2qp1 h MET 24 N 0.00 0.00 -0.56 0.81 4.05 -0.95 -3.32 114.93 114.96 2qp1 h MET 24 Ca -0.00 0.00 0.11 0.00 -0.28 0.00 0.00 59.70 59.53 2qp1 h MET 24 Cb 0.08 0.00 -0.09 0.00 -0.80 0.00 0.00 31.60 30.79 2qp1 h MET 24 CO 0.00 0.69 -0.01 0.00 0.23 0.00 0.00 176.91 177.82 2qp1 h ALA 25 N -0.45 0.52 -0.97 0.39 0.00 0.24 0.13 119.26 119.12 2qp1 h ALA 25 Ca -0.10 0.17 0.23 0.00 0.00 0.00 0.00 54.91 55.21 2qp1 h ALA 25 Cb 0.84 0.30 -0.12 0.00 0.00 0.00 0.00 17.79 18.81 2qp1 h ALA 25 CO -0.06 -0.39 0.53 0.78 0.00 0.00 0.00 179.25 180.11 2qp1 h GLY 26 N 0.11 1.78 0.82 0.00 0.00 -1.61 0.48 103.07 104.65 2qp1 h GLY 26 Ca 0.28 -0.27 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 2qp1 h GLY 26 CO -0.48 -0.24 -0.04 1.76 0.00 0.00 0.00 176.54 177.55 2qp1 h SER 27 N 0.54 0.41 -0.49 0.19 0.02 -0.88 -2.48 113.55 110.85 2qp1 h SER 27 Ca 0.61 -0.35 0.05 0.00 -0.84 0.00 0.00 61.79 61.27 2qp1 h SER 27 Cb 1.15 -0.11 -0.05 0.00 0.14 0.00 0.00 62.40 63.53 2qp1 h SER 27 CO -0.48 0.66 0.21 0.25 -1.14 0.00 0.00 176.83 176.33 2qp1 h LEU 28 N 0.15 0.26 -2.83 5.07 7.12 0.49 0.29 115.31 125.86 2qp1 h LEU 28 Ca 0.06 0.04 0.00 0.00 0.13 0.00 0.00 57.88 58.11 2qp1 h LEU 28 Cb 0.47 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.61 2qp1 h LEU 28 CO 0.02 0.19 0.02 0.58 -0.13 0.00 0.00 178.44 179.12 2qp1 h VAL 29 N 0.41 0.11 0.00 1.05 2.07 -0.06 0.12 116.25 119.95 2qp1 h VAL 29 Ca 0.22 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.74 2qp1 h VAL 29 Cb 0.18 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 2qp1 h VAL 29 CO -0.19 0.00 0.00 0.54 0.02 0.00 0.00 177.57 177.94 2qp1 n ARG 30 N -3.23 0.00 0.26 1.57 1.74 0.92 -4.56 116.66 113.35 2qp1 n ARG 30 Ca -0.03 0.00 0.16 0.00 -0.77 0.00 0.00 57.85 57.21 2qp1 n ARG 30 Cb 0.09 -0.02 0.87 0.00 -1.02 0.00 0.00 32.46 32.39 2qp1 n ARG 30 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2qp1 h HIS 31 N 0.00 0.00 0.00 -1.55 3.86 -1.43 -3.45 115.15 112.58 2qp1 h HIS 31 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2qp1 h HIS 31 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2qp1 h HIS 31 CO 0.00 0.00 0.00 0.39 0.86 0.00 0.00 177.93 179.18 2qp1 n GLU 32 N -2.66 0.00 -3.73 2.45 1.02 0.41 -4.88 120.64 113.26 2qp1 n GLU 32 Ca -0.02 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 56.93 2qp1 n GLU 32 Cb 0.10 -3.21 -0.17 0.00 -0.02 0.00 0.00 31.44 28.13 2qp1 n GLU 32 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 2qp1 s ILE 33 N -1.69 -0.04 0.07 -3.67 1.10 -1.26 -0.35 121.20 115.36 2qp1 s ILE 33 Ca 0.00 0.32 0.01 0.00 -0.51 0.00 0.00 60.65 60.47 2qp1 s ILE 33 Cb 0.00 -0.17 -0.03 0.00 0.15 0.00 0.00 42.46 42.41 2qp1 s ILE 33 CO 0.00 0.16 -0.06 -0.63 -2.11 0.00 0.00 174.94 172.29 2qp1 s ILE 34 N 1.73 0.54 -0.45 2.00 1.01 -0.13 -4.97 121.20 120.93 2qp1 s ILE 34 Ca -0.00 -1.54 0.03 0.00 0.00 0.00 0.00 60.65 59.13 2qp1 s ILE 34 Cb -0.12 -1.18 0.13 0.00 0.01 0.00 0.00 42.46 41.30 2qp1 s ILE 34 CO -0.03 -0.69 0.23 -1.59 0.00 0.00 0.00 174.94 172.86 2qp1 s LYS 35 N -2.87 1.48 0.00 2.79 0.00 -1.26 -1.91 119.74 117.97 2qp1 s LYS 35 Ca 0.01 -2.14 0.00 0.00 0.00 0.00 0.00 55.97 53.85 2qp1 s LYS 35 Cb -0.01 -2.66 0.00 0.00 0.00 0.00 0.00 37.83 35.16 2qp1 s LYS 35 CO -0.03 -1.13 0.00 -2.37 0.00 0.00 0.00 175.35 171.82 2qp1 n THR 36 N 3.51 0.00 -2.58 3.79 5.66 -1.26 -4.78 114.28 118.62 2qp1 n THR 36 Ca 0.07 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.68 2qp1 n THR 36 Cb 0.34 -0.29 -0.05 0.00 -1.55 0.00 0.00 70.33 68.79 2qp1 n THR 36 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2qp1 s THR 37 N 1.14 3.74 0.17 1.09 2.01 -1.26 0.50 115.64 123.02 2qp1 s THR 37 Ca 0.00 1.59 -0.25 0.00 0.31 0.00 0.00 61.69 63.34 2qp1 s THR 37 Cb 0.00 -3.95 0.04 0.00 0.01 0.00 0.00 72.50 68.60 2qp1 s THR 37 CO 0.00 0.26 1.57 0.25 -0.69 0.00 0.00 174.62 176.01 2qp1 h LEU 38 N 3.44 -1.50 -0.38 4.42 5.85 -1.62 -0.14 115.31 125.38 2qp1 h LEU 38 Ca -0.47 0.25 0.04 0.00 0.84 0.00 0.00 57.88 58.54 2qp1 h LEU 38 Cb 1.21 0.68 -0.04 0.00 0.37 0.00 0.00 40.66 42.88 2qp1 h LEU 38 CO 0.66 -0.33 0.16 -0.65 -0.34 0.00 0.00 178.44 177.94 2qp1 h PRO 39 N -0.22 0.33 -0.58 5.25 0.11 -1.93 -1.95 132.00 133.02 2qp1 h PRO 39 Ca 0.18 -0.02 0.10 0.00 0.11 0.00 0.00 66.00 66.37 2qp1 h PRO 39 Cb 0.56 -0.07 -0.07 0.00 0.11 0.00 0.00 31.00 31.52 2qp1 h PRO 39 CO -0.70 0.22 0.18 0.87 -0.21 0.00 0.00 178.00 178.36 2qp1 h LYS 40 N 0.34 0.33 0.53 1.05 1.57 -1.65 -1.05 116.57 117.69 2qp1 h LYS 40 Ca 0.17 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.91 2qp1 h LYS 40 Cb 0.11 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 2qp1 h LYS 40 CO -0.15 0.22 -0.38 0.00 -0.57 0.00 0.00 179.45 178.58 2qp1 h ALA 41 N 1.42 -1.14 -1.11 3.86 0.00 -0.53 0.96 119.26 122.72 2qp1 h ALA 41 Ca 0.30 -0.18 0.33 0.00 0.00 0.00 0.00 54.91 55.36 2qp1 h ALA 41 Cb 0.39 0.53 -0.12 0.00 0.00 0.00 0.00 17.79 18.58 2qp1 h ALA 41 CO -0.33 -1.13 0.68 0.87 0.00 0.00 0.00 179.25 179.35 2qp1 h LYS 42 N -0.87 0.28 0.37 0.00 1.57 -1.06 0.91 116.57 117.76 2qp1 h LYS 42 Ca -0.07 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 2qp1 h LYS 42 Cb 0.71 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.96 2qp1 h LYS 42 CO 0.04 0.19 -0.18 0.93 -0.57 0.00 0.00 179.45 179.86 2qp1 h GLU 43 N 0.29 -0.47 -1.32 3.15 4.39 -0.57 -3.14 114.58 116.90 2qp1 h GLU 43 Ca 0.71 0.03 0.39 0.00 0.34 0.00 0.00 59.36 60.83 2qp1 h GLU 43 Cb 1.86 0.11 -0.08 0.00 -0.10 0.00 0.00 28.75 30.54 2qp1 h GLU 43 CO -0.45 -0.32 0.92 1.25 -1.16 0.00 0.00 179.01 179.25 2qp1 h LEU 44 N -1.13 0.13 0.02 1.33 5.85 0.28 0.36 115.31 122.15 2qp1 h LEU 44 Ca -0.05 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.73 2qp1 h LEU 44 Cb 0.38 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 2qp1 h LEU 44 CO 0.08 -0.02 -0.49 -0.09 -0.34 0.00 0.00 178.44 177.59 2qp1 h ARG 45 N 0.09 -0.60 -1.92 1.25 2.43 0.80 -0.43 114.38 115.99 2qp1 h ARG 45 Ca 0.68 0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 59.77 2qp1 h ARG 45 Cb 2.44 0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 32.08 2qp1 h ARG 45 CO -0.14 -0.40 -0.00 2.89 -1.51 0.00 0.00 179.97 180.81 2qp1 n ARG 46 N -5.18 1.44 0.00 0.20 1.85 0.11 -2.87 116.66 112.21 2qp1 n ARG 46 Ca -0.07 -0.61 0.00 0.00 -1.00 0.00 0.00 57.85 56.17 2qp1 n ARG 46 Cb 0.36 -1.39 0.00 0.00 -1.05 0.00 0.00 32.46 30.38 2qp1 n ARG 46 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 2qp1 n VAL 47 N 1.51 0.00 -0.10 8.89 0.31 -0.24 -4.84 118.33 123.86 2qp1 n VAL 47 Ca 0.17 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.34 2qp1 n VAL 47 Cb 0.61 -0.15 -0.08 0.00 -0.91 0.00 0.00 33.84 33.31 2qp1 n VAL 47 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2qp1 n VAL 48 N -1.46 1.50 -0.32 2.52 0.31 -0.76 -4.02 118.33 116.09 2qp1 n VAL 48 Ca 0.00 0.02 0.21 0.00 -0.01 0.00 0.00 64.34 64.56 2qp1 n VAL 48 Cb 0.12 -2.15 0.42 0.00 -0.91 0.00 0.00 33.84 31.32 2qp1 n VAL 48 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2qp1 h GLU 49 N -1.00 0.10 -0.34 5.55 5.08 -1.78 0.94 114.58 123.12 2qp1 h GLU 49 Ca -0.27 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2qp1 h GLU 49 Cb 1.08 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 2qp1 h GLU 49 CO -0.16 0.07 0.21 -1.35 -1.00 0.00 0.00 179.01 176.78 2qp1 h PRO 50 N 0.10 0.46 -0.40 2.33 0.11 -1.82 0.43 132.00 133.21 2qp1 h PRO 50 Ca 0.69 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.76 2qp1 h PRO 50 Cb 1.61 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.60 2qp1 h PRO 50 CO -0.76 0.33 0.21 -0.07 -0.21 0.00 0.00 178.00 177.51 2qp1 h LEU 51 N 0.45 0.48 -0.53 2.35 4.07 0.59 0.33 115.31 123.05 2qp1 h LEU 51 Ca 0.12 -0.03 -0.16 0.00 0.08 0.00 0.00 57.88 57.89 2qp1 h LEU 51 Cb -0.01 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.60 2qp1 h LEU 51 CO -0.02 0.40 -0.70 0.40 -1.08 0.00 0.00 178.44 177.44 2qp1 h ILE 52 N 0.55 1.43 -0.24 1.22 2.04 0.26 0.30 117.51 123.08 2qp1 h ILE 52 Ca 0.14 -2.21 -0.12 0.00 1.00 0.00 0.00 64.86 63.68 2qp1 h ILE 52 Cb 0.03 2.17 -0.01 0.00 -0.74 0.00 0.00 36.82 38.26 2qp1 h ILE 52 CO -0.02 0.65 -0.35 0.74 0.00 0.00 0.00 178.15 179.17 2qp1 h THR 53 N 0.15 1.29 0.00 -0.27 2.02 0.16 -1.65 112.91 114.60 2qp1 h THR 53 Ca -0.02 -1.46 -0.05 0.00 0.77 0.00 0.00 66.41 65.65 2qp1 h THR 53 Cb 1.24 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 69.13 2qp1 h THR 53 CO 0.11 0.46 -0.23 0.25 0.37 0.00 0.00 175.52 176.48 2qp1 h LEU 54 N 0.44 0.00 -0.64 2.58 5.85 -0.07 -2.95 115.31 120.51 2qp1 h LEU 54 Ca 0.05 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2qp1 h LEU 54 Cb 0.81 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.84 2qp1 h LEU 54 CO 0.07 0.23 0.00 0.00 -0.34 0.00 0.00 178.44 178.39 2qp1 n ALA 55 N -2.17 1.67 -0.83 1.25 0.00 0.10 -3.92 120.51 116.62 2qp1 n ALA 55 Ca 0.02 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2qp1 n ALA 55 Cb 0.56 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.63 2qp1 n ALA 55 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qp1 n LYS 56 N -2.18 0.00 -1.85 0.00 4.76 -1.12 -3.49 118.16 114.28 2qp1 n LYS 56 Ca 0.02 0.19 -0.32 0.00 -2.87 0.00 0.00 58.31 55.34 2qp1 n LYS 56 Cb 0.23 -1.09 0.02 0.00 -1.84 0.00 0.00 35.03 32.35 2qp1 n LYS 56 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 2qp1 s THR 57 N -1.35 4.09 0.00 -0.18 2.01 -1.25 -4.84 115.64 114.12 2qp1 s THR 57 Ca 0.00 0.81 0.00 0.00 0.31 0.00 0.00 61.69 62.81 2qp1 s THR 57 Cb 0.00 -3.48 0.00 0.00 0.01 0.00 0.00 72.50 69.03 2qp1 s THR 57 CO 0.00 -0.76 0.00 -0.67 -0.69 0.00 0.00 174.62 172.50 2qp1 n ASP 58 N -2.55 0.00 0.00 3.53 -0.08 -1.26 -4.90 116.55 111.29 2qp1 n ASP 58 Ca 0.08 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.36 2qp1 n ASP 58 Cb 0.53 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.99 2qp1 n ASP 58 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 2qp1 n SER 59 N 0.00 -0.27 0.00 1.67 2.88 -1.26 -4.11 113.62 112.53 2qp1 n SER 59 Ca 0.00 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.55 2qp1 n SER 59 Cb 0.00 0.64 0.04 0.00 -0.75 0.00 0.00 64.21 64.14 2qp1 n SER 59 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2qp1 n VAL 60 N -0.11 0.00 0.00 2.46 0.31 -1.26 -1.75 118.33 117.98 2qp1 n VAL 60 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2qp1 n VAL 60 Cb 0.00 -0.52 0.00 0.00 -0.91 0.00 0.00 33.84 32.41 2qp1 n VAL 60 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qp1 n ALA 61 N -0.61 0.00 0.32 3.52 0.00 -1.26 -3.20 120.51 119.29 2qp1 n ALA 61 Ca 0.01 -0.01 0.14 0.00 0.00 0.00 0.00 53.44 53.57 2qp1 n ALA 61 Cb 0.00 0.00 0.73 0.00 0.00 0.00 0.00 19.45 20.18 2qp1 n ALA 61 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2qp1 h ASN 62 N 0.00 0.00 0.00 0.00 -0.26 -1.70 0.18 115.58 113.81 2qp1 h ASN 62 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2qp1 h ASN 62 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.26 2qp1 h ASN 62 CO 0.00 0.00 0.00 -1.14 -1.06 0.00 0.00 177.43 175.23 2qp1 n ARG 63 N -2.80 0.00 -0.32 0.81 3.00 -0.72 -0.15 116.66 116.48 2qp1 n ARG 63 Ca -0.02 0.15 0.14 0.00 -0.00 0.00 0.00 57.85 58.12 2qp1 n ARG 63 Cb 0.42 -1.03 0.37 0.00 0.00 0.00 0.00 32.46 32.21 2qp1 n ARG 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2qp1 h ARG 64 N 0.00 0.67 -0.60 -0.14 3.08 -1.35 0.89 114.38 116.92 2qp1 h ARG 64 Ca 0.00 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 2qp1 h ARG 64 Cb 0.00 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 29.87 2qp1 h ARG 64 CO 0.00 0.44 0.29 1.25 -1.07 0.00 0.00 179.97 180.89 2qp1 h LEU 65 N 0.69 0.76 -1.31 3.04 5.85 -1.04 0.83 115.31 124.13 2qp1 h LEU 65 Ca 0.54 -0.07 -0.06 0.00 0.84 0.00 0.00 57.88 59.13 2qp1 h LEU 65 Cb 0.93 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.76 2qp1 h LEU 65 CO -0.31 0.65 -0.28 0.00 -0.34 0.00 0.00 178.44 178.16 2qp1 h ALA 66 N 1.47 1.16 0.00 1.25 0.00 0.41 -2.19 119.26 121.37 2qp1 h ALA 66 Ca 0.21 -0.25 -0.22 0.00 0.00 0.00 0.00 54.91 54.65 2qp1 h ALA 66 Cb 0.08 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2qp1 h ALA 66 CO -0.03 0.35 -1.17 0.35 0.00 0.00 0.00 179.25 178.75 2qp1 h PHE 67 N 0.00 0.00 -0.05 0.00 3.57 0.14 -3.34 116.94 117.26 2qp1 h PHE 67 Ca -0.00 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.51 2qp1 h PHE 67 Cb 0.66 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 2qp1 h PHE 67 CO 0.00 0.93 -0.16 0.00 -2.23 0.00 0.00 178.31 176.84 2qp1 h ALA 68 N 1.07 -0.55 -2.07 2.41 0.00 0.12 -3.37 119.26 116.88 2qp1 h ALA 68 Ca -0.09 -0.02 -0.46 0.00 0.00 0.00 0.00 54.91 54.34 2qp1 h ALA 68 Cb 1.79 0.72 0.09 0.00 0.00 0.00 0.00 17.79 20.39 2qp1 h ALA 68 CO 0.10 -0.62 0.23 -0.98 0.00 0.00 0.00 179.25 177.99 2qp1 s ARG 69 N -3.81 1.85 -0.62 0.00 3.03 -1.19 -4.49 118.95 113.71 2qp1 s ARG 69 Ca -0.05 -0.45 -0.18 0.00 2.03 0.00 0.00 55.73 57.08 2qp1 s ARG 69 Cb 0.02 -2.15 0.03 0.00 -1.03 0.00 0.00 34.95 31.81 2qp1 s ARG 69 CO 0.18 -1.46 0.64 0.25 -1.13 0.00 0.00 175.30 173.78 2qp1 n THR 70 N -3.03 -5.21 0.51 4.99 -2.24 -1.26 -4.69 114.28 103.34 2qp1 n THR 70 Ca 0.10 0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.99 2qp1 n THR 70 Cb 0.60 -4.12 0.00 0.00 -2.10 0.00 0.00 70.33 64.71 2qp1 n THR 70 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2qp1 n ARG 71 N -1.28 0.29 -2.85 -0.78 3.00 -1.26 -4.50 116.66 109.28 2qp1 n ARG 71 Ca -0.14 0.00 -0.43 0.00 -0.00 0.00 0.00 57.85 57.28 2qp1 n ARG 71 Cb 0.64 -1.04 -0.03 0.00 0.00 0.00 0.00 32.46 32.04 2qp1 n ARG 71 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2qp1 s ASP 72 N -1.44 6.45 0.00 6.15 3.68 -1.26 -4.84 116.67 125.41 2qp1 s ASP 72 Ca 0.00 -1.58 0.01 0.00 2.13 0.00 0.00 52.55 53.11 2qp1 s ASP 72 Cb 0.00 -2.43 0.06 0.00 -1.45 0.00 0.00 42.92 39.10 2qp1 s ASP 72 CO 0.00 -1.27 0.28 -3.20 0.13 0.00 0.00 175.17 171.11 2qp1 n ASN 73 N 7.31 0.00 -0.09 -0.34 5.15 -1.26 -1.98 115.26 124.05 2qp1 n ASN 73 Ca 0.16 -0.17 -0.17 0.00 -0.60 0.00 0.00 54.58 53.79 2qp1 n ASN 73 Cb 0.48 0.00 -0.07 0.00 -0.53 0.00 0.00 39.78 39.67 2qp1 n ASN 73 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 2qp1 n GLU 74 N -0.65 0.38 0.29 1.20 2.13 -1.26 -4.43 120.64 118.30 2qp1 n GLU 74 Ca 0.01 0.15 0.17 0.00 0.66 0.00 0.00 57.16 58.15 2qp1 n GLU 74 Cb 0.00 -1.16 0.86 0.00 0.27 0.00 0.00 31.44 31.41 2qp1 n GLU 74 CO 0.00 0.00 0.00 -0.84 -0.41 0.00 0.00 177.13 175.88 2qp1 h ILE 75 N -0.51 0.23 0.00 6.31 3.07 -1.75 0.16 117.51 125.02 2qp1 h ILE 75 Ca -0.43 -0.37 -0.00 0.00 1.55 0.00 0.00 64.86 65.61 2qp1 h ILE 75 Cb 1.42 1.29 -0.00 0.00 -0.27 0.00 0.00 36.82 39.27 2qp1 h ILE 75 CO -0.23 0.05 -0.01 -0.37 -1.05 0.00 0.00 178.15 176.53 2qp1 h VAL 76 N 0.00 0.04 0.07 0.16 -1.51 -1.69 -1.90 116.25 111.42 2qp1 h VAL 76 Ca -0.00 -0.46 -0.18 0.00 -1.23 0.00 0.00 66.70 64.82 2qp1 h VAL 76 Cb 0.29 1.44 0.02 0.00 -2.13 0.00 0.00 31.29 30.91 2qp1 h VAL 76 CO 0.01 0.01 -0.76 0.00 -1.23 0.00 0.00 177.57 175.60 2qp1 h ALA 77 N 1.99 0.00 -0.63 5.19 0.00 -0.90 -3.14 119.26 121.77 2qp1 h ALA 77 Ca -0.00 -0.64 0.13 0.00 0.00 0.00 0.00 54.91 54.40 2qp1 h ALA 77 Cb 0.44 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.20 2qp1 h ALA 77 CO 0.00 0.40 0.10 -0.22 0.00 0.00 0.00 179.25 179.54 2qp1 h LYS 78 N -0.15 0.21 -7.31 0.00 1.63 -1.25 -3.10 116.57 106.60 2qp1 h LYS 78 Ca -0.11 -0.01 -0.51 0.00 -0.85 0.00 0.00 60.65 59.16 2qp1 h LYS 78 Cb 1.51 -0.05 0.11 0.00 -0.60 0.00 0.00 32.23 33.20 2qp1 h LYS 78 CO 0.15 0.14 0.35 -0.51 -3.45 0.00 0.00 179.45 176.13 2qp1 s LEU 79 N -10.58 3.13 0.00 5.20 1.43 -0.80 0.15 118.68 117.21 2qp1 s LEU 79 Ca -0.13 1.72 0.00 0.00 -1.03 0.00 0.00 54.13 54.69 2qp1 s LEU 79 Cb 0.19 -4.51 0.00 0.00 0.03 0.00 0.00 46.19 41.90 2qp1 s LEU 79 CO 0.74 -1.65 0.00 0.49 0.23 0.00 0.00 176.35 176.16 2qp1 n PHE 80 N -3.17 0.00 -0.02 0.29 3.72 -1.23 -4.19 117.46 112.86 2qp1 n PHE 80 Ca 0.08 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.46 2qp1 n PHE 80 Cb 0.53 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.05 2qp1 n PHE 80 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 2qp1 h ASN 81 N 0.00 -0.06 0.00 4.37 4.21 -1.63 -3.37 115.58 119.10 2qp1 h ASN 81 Ca 0.00 -0.08 0.00 0.00 1.21 0.00 0.00 56.30 57.43 2qp1 h ASN 81 Cb 0.00 0.02 0.00 0.00 -1.12 0.00 0.00 38.32 37.22 2qp1 h ASN 81 CO 0.00 0.47 0.00 -0.62 -1.29 0.00 0.00 177.43 175.99 2qp1 n GLU 82 N -4.82 0.00 -0.28 0.81 1.02 0.17 -4.27 120.64 113.28 2qp1 n GLU 82 Ca -0.02 0.00 0.33 0.00 -0.02 0.00 0.00 57.16 57.45 2qp1 n GLU 82 Cb 0.07 -0.35 0.74 0.00 -0.02 0.00 0.00 31.44 31.89 2qp1 n GLU 82 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2qp1 h LEU 83 N 0.00 0.00 0.19 -4.62 3.38 0.12 0.39 115.31 114.77 2qp1 h LEU 83 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2qp1 h LEU 83 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 2qp1 h LEU 83 CO 0.00 0.00 -0.11 1.23 0.09 0.00 0.00 178.44 179.65 2qp1 h GLY 84 N 0.00 -0.48 0.93 0.83 0.00 -1.73 -3.04 103.07 99.58 2qp1 h GLY 84 Ca 0.52 0.20 -0.04 0.00 0.00 0.00 0.00 47.33 48.01 2qp1 h GLY 84 CO -0.01 -0.17 0.09 -2.55 0.00 0.00 0.00 176.54 173.90 2qp1 h PRO 85 N -0.27 0.62 -1.00 4.80 0.11 -1.44 0.38 132.00 135.20 2qp1 h PRO 85 Ca -0.03 -0.15 0.40 0.00 0.11 0.00 0.00 66.00 66.33 2qp1 h PRO 85 Cb 0.22 -0.08 -0.16 0.00 0.11 0.00 0.00 31.00 31.09 2qp1 h PRO 85 CO 0.03 0.65 0.57 0.54 -0.21 0.00 0.00 178.00 179.58 2qp1 n ARG 86 N -4.57 -0.05 -0.07 1.05 5.12 0.13 0.12 116.66 118.38 2qp1 n ARG 86 Ca -0.01 1.24 0.05 0.00 -1.93 0.00 0.00 57.85 57.20 2qp1 n ARG 86 Cb 0.21 -2.27 0.07 0.00 -1.16 0.00 0.00 32.46 29.30 2qp1 n ARG 86 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 2qp1 n PHE 87 N -4.95 0.00 0.23 -1.55 3.72 -1.15 -4.74 117.46 109.02 2qp1 n PHE 87 Ca 0.35 -0.69 0.17 0.00 -0.05 0.00 0.00 57.45 57.23 2qp1 n PHE 87 Cb 1.24 -0.10 0.74 0.00 -0.94 0.00 0.00 39.48 40.43 2qp1 n PHE 87 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2qp1 h ALA 88 N 0.00 1.71 0.00 4.37 0.00 0.31 0.50 119.26 126.16 2qp1 h ALA 88 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qp1 h ALA 88 Cb 0.85 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2qp1 h ALA 88 CO 0.00 -0.53 -0.01 -1.13 0.00 0.00 0.00 179.25 177.59 2qp1 n SER 89 N -3.20 2.20 -4.82 0.00 3.41 -1.26 -5.03 113.62 104.92 2qp1 n SER 89 Ca 0.02 -2.72 -0.33 0.00 -0.26 0.00 0.00 58.87 55.59 2qp1 n SER 89 Cb 0.53 -0.29 -0.07 0.00 -0.26 0.00 0.00 64.21 64.13 2qp1 n SER 89 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2qp1 s ARG 90 N -2.23 4.20 0.10 4.33 6.06 0.18 -4.99 118.95 126.61 2qp1 s ARG 90 Ca 0.21 1.10 0.12 0.00 -2.50 0.00 0.00 55.73 54.66 2qp1 s ARG 90 Cb 0.19 -2.18 -0.14 0.00 0.06 0.00 0.00 34.95 32.88 2qp1 s ARG 90 CO 0.02 -0.05 1.09 0.00 -2.50 0.00 0.00 175.30 173.85 2qp1 h ALA 91 N 1.81 0.58 0.00 6.12 0.00 -1.96 -3.49 119.26 122.31 2qp1 h ALA 91 Ca -0.49 -0.93 0.00 0.00 0.00 0.00 0.00 54.91 53.49 2qp1 h ALA 91 Cb 1.18 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2qp1 h ALA 91 CO 0.61 1.14 0.00 0.41 0.00 0.00 0.00 179.25 181.41 2qp1 n GLY 92 N 1.38 -1.99 3.52 0.00 0.00 -1.26 -5.08 105.19 101.76 2qp1 n GLY 92 Ca -0.05 0.64 -0.27 0.00 0.00 0.00 0.00 46.02 46.34 2qp1 n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qp1 n GLY 93 N 0.00 -0.30 0.33 -0.02 0.00 -1.26 -4.70 105.19 99.24 2qp1 n GLY 93 Ca 0.00 0.47 0.14 0.00 0.00 0.00 0.00 46.02 46.62 2qp1 n GLY 93 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2qp1 n TYR 94 N 11.60 0.00 -3.78 1.61 4.01 -1.26 -4.85 117.16 124.48 2qp1 n TYR 94 Ca 0.57 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 58.19 2qp1 n TYR 94 Cb 0.25 -0.07 -0.08 0.00 -0.31 0.00 0.00 39.34 39.13 2qp1 n TYR 94 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2qp1 s THR 95 N -2.24 0.07 0.35 -0.72 -1.32 -1.26 -0.68 115.64 109.84 2qp1 s THR 95 Ca 0.32 -0.61 0.08 0.00 -1.21 0.00 0.00 61.69 60.26 2qp1 s THR 95 Cb 0.20 -0.73 -0.03 0.00 -1.51 0.00 0.00 72.50 70.44 2qp1 s THR 95 CO 0.42 -0.34 0.29 -0.13 -2.21 0.00 0.00 174.62 172.66 2qp1 s ARG 96 N -1.84 2.66 -0.17 7.08 3.00 -0.27 -4.86 118.95 124.54 2qp1 s ARG 96 Ca -0.10 -1.35 0.03 0.00 0.00 0.00 0.00 55.73 54.30 2qp1 s ARG 96 Cb -0.04 -2.43 -0.13 0.00 0.00 0.00 0.00 34.95 32.35 2qp1 s ARG 96 CO 0.01 0.05 -0.13 0.44 0.00 0.00 0.00 175.30 175.67 2qp1 n ILE 97 N -1.38 1.03 -3.01 1.52 -6.64 -1.26 -1.37 119.36 108.25 2qp1 n ILE 97 Ca -0.01 -0.43 -0.06 0.00 -1.77 0.00 0.00 62.75 60.48 2qp1 n ILE 97 Cb 0.60 -1.06 0.01 0.00 -1.44 0.00 0.00 39.64 37.75 2qp1 n ILE 97 CO 0.00 0.00 0.00 0.18 -1.77 0.00 0.00 176.55 174.96 2qp1 n LEU 98 N -2.95 -5.71 -4.77 7.28 7.99 -1.26 0.11 117.00 117.69 2qp1 n LEU 98 Ca -0.31 0.76 -0.29 0.00 -0.01 0.00 0.00 56.01 56.16 2qp1 n LEU 98 Cb 0.86 -2.49 0.13 0.00 -0.11 0.00 0.00 43.42 41.81 2qp1 n LEU 98 CO 0.20 -2.07 0.70 -0.54 -1.51 0.00 0.00 177.39 174.17 2qp1 s LYS 99 N -1.61 1.19 0.00 3.23 1.02 -1.26 -1.51 119.74 120.79 2qp1 s LYS 99 Ca 0.08 0.38 0.00 0.00 0.02 0.00 0.00 55.97 56.44 2qp1 s LYS 99 Cb -0.01 -1.84 0.00 0.00 -0.52 0.00 0.00 37.83 35.46 2qp1 s LYS 99 CO 0.50 -2.18 0.00 0.00 -0.92 0.00 0.00 175.35 172.75 2qp1 n GLY 101 N -0.14 -0.21 2.05 0.00 0.00 0.40 -4.78 105.19 102.50 2qp1 n GLY 101 Ca 0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 46.02 45.85 2qp1 n GLY 101 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qp1 n PHE 102 N -0.76 -2.93 -1.21 1.61 3.01 -1.17 -4.20 117.46 111.82 2qp1 n PHE 102 Ca 0.00 1.72 0.00 0.00 1.01 0.00 0.00 57.45 60.18 2qp1 n PHE 102 Cb 0.06 -3.09 0.00 0.00 -0.01 0.00 0.00 39.48 36.44 2qp1 n PHE 102 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 2qp1 n ARG 103 N 1.11 3.50 -0.00 -1.08 0.63 0.63 -4.68 116.66 116.77 2qp1 n ARG 103 Ca -0.16 0.00 -0.01 0.00 -0.92 0.00 0.00 57.85 56.75 2qp1 n ARG 103 Cb 0.25 0.00 -0.00 0.00 0.45 0.00 0.00 32.46 33.16 2qp1 n ARG 103 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2qp1 n ALA 104 N -3.00 2.01 0.24 5.13 0.00 -1.26 -4.72 120.51 118.91 2qp1 n ALA 104 Ca 0.00 -0.18 0.12 0.00 0.00 0.00 0.00 53.44 53.38 2qp1 n ALA 104 Cb 0.00 0.07 0.74 0.00 0.00 0.00 0.00 19.45 20.26 2qp1 n ALA 104 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2qp1 h GLY 105 N -0.15 0.00 -4.13 0.00 0.00 -1.99 -3.43 103.07 93.37 2qp1 h GLY 105 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.13 2qp1 h GLY 105 CO 0.00 0.00 -0.70 0.51 0.00 0.00 0.00 176.54 176.35 2qp1 s ASP 106 N -6.61 0.66 0.00 0.19 1.47 -1.26 -5.00 116.67 106.11 2qp1 s ASP 106 Ca -0.05 -0.73 0.02 0.00 1.18 0.00 0.00 52.55 52.97 2qp1 s ASP 106 Cb 0.17 0.10 0.10 0.00 -0.34 0.00 0.00 42.92 42.95 2qp1 s ASP 106 CO 0.63 -0.37 0.60 -3.20 0.68 0.00 0.00 175.17 173.50 2qp1 n ASN 107 N 0.89 0.00 -4.68 2.11 4.05 -1.26 -3.28 115.26 113.09 2qp1 n ASN 107 Ca -0.19 -0.96 -0.46 0.00 0.45 0.00 0.00 54.58 53.42 2qp1 n ASN 107 Cb 0.57 0.00 -0.04 0.00 1.23 0.00 0.00 39.78 41.54 2qp1 n ASN 107 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2qp1 n ALA 108 N -0.55 1.44 -2.57 5.20 0.00 -1.26 -4.40 120.51 118.36 2qp1 n ALA 108 Ca 0.01 0.37 -0.41 0.00 0.00 0.00 0.00 53.44 53.42 2qp1 n ALA 108 Cb 0.01 -2.45 -0.04 0.00 0.00 0.00 0.00 19.45 16.97 2qp1 n ALA 108 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2qp1 s PRO 109 N 2.16 4.55 0.52 0.00 0.04 -1.26 -0.27 135.00 140.74 2qp1 s PRO 109 Ca 0.83 1.25 0.08 0.00 0.04 0.00 0.00 61.00 63.20 2qp1 s PRO 109 Cb -0.64 -3.42 0.08 0.00 0.04 0.00 0.00 34.50 30.56 2qp1 s PRO 109 CO 0.41 0.09 0.70 -1.33 0.04 0.00 0.00 177.00 176.91 2qp1 n MET 110 N 3.46 0.65 0.00 4.56 2.81 -1.26 -2.12 117.12 125.22 2qp1 n MET 110 Ca 0.02 -2.82 0.00 0.00 -1.81 0.00 0.00 57.70 53.09 2qp1 n MET 110 Cb 0.51 -0.18 0.00 0.00 -0.71 0.00 0.00 33.22 32.84 2qp1 n MET 110 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2qp1 n ALA 111 N -2.37 0.00 -2.54 3.04 0.00 0.18 -0.45 120.51 118.37 2qp1 n ALA 111 Ca -0.12 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.31 2qp1 n ALA 111 Cb 0.54 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.00 2qp1 n ALA 111 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2qp1 n TYR 112 N 0.00 -0.30 -1.43 0.00 4.01 0.12 -4.45 117.16 115.10 2qp1 n TYR 112 Ca 0.00 -0.29 -0.43 0.00 -0.16 0.00 0.00 57.90 57.01 2qp1 n TYR 112 Cb 0.00 0.74 -0.00 0.00 -0.31 0.00 0.00 39.34 39.77 2qp1 n TYR 112 CO 0.00 0.00 0.00 1.51 -0.46 0.00 0.00 176.86 177.91 2qp1 n ILE 113 N -0.25 1.64 -3.61 -0.72 0.13 -0.60 -4.45 119.36 111.50 2qp1 n ILE 113 Ca -0.05 -0.50 -0.05 0.00 -1.10 0.00 0.00 62.75 61.05 2qp1 n ILE 113 Cb 0.56 -0.40 -0.03 0.00 -0.84 0.00 0.00 39.64 38.93 2qp1 n ILE 113 CO 0.00 0.00 0.00 -1.83 2.80 0.00 0.00 176.55 177.52 2qp1 s GLU 114 N -1.36 0.27 0.42 9.51 1.03 -0.47 -0.96 118.70 127.14 2qp1 s GLU 114 Ca 0.62 -0.02 -0.25 0.00 0.03 0.00 0.00 54.97 55.34 2qp1 s GLU 114 Cb -0.69 0.13 -0.10 0.00 -0.80 0.00 0.00 34.13 32.67 2qp1 s GLU 114 CO 0.59 -0.10 1.22 1.28 -1.33 0.00 0.00 175.26 176.92 2qp1 n LEU 115 N 0.25 3.75 0.21 1.83 4.77 0.52 -1.11 117.00 127.23 2qp1 n LEU 115 Ca -0.01 1.10 0.15 0.00 -0.03 0.00 0.00 56.01 57.21 2qp1 n LEU 115 Cb 0.58 -1.47 0.58 0.00 -2.33 0.00 0.00 43.42 40.78 2qp1 n LEU 115 CO 0.10 -0.80 0.93 1.62 -1.33 0.00 0.00 177.39 177.90 2qp1 h VAL 116 N 1.99 0.00 -0.04 4.08 3.04 -1.23 -2.97 116.25 121.12 2qp1 h VAL 116 Ca -0.47 -0.40 -0.01 0.00 -1.01 0.00 0.00 66.70 64.81 2qp1 h VAL 116 Cb 1.30 1.28 -0.01 0.00 -2.01 0.00 0.00 31.29 31.85 2qp1 h VAL 116 CO 0.59 0.00 -0.20 -0.90 -1.01 0.00 0.00 177.57 176.05 2qp1 n ASP 117 N -2.68 2.21 -0.13 3.17 3.85 -1.26 -4.73 116.55 116.98 2qp1 n ASP 117 Ca 0.01 -3.46 0.24 0.00 -0.71 0.00 0.00 54.79 50.88 2qp1 n ASP 117 Cb 0.28 -0.49 0.68 0.00 -1.35 0.00 0.00 41.12 40.24 2qp1 n ASP 117 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.20 176.10 2qp1 h ARG 118 N 0.59 0.06 -5.57 0.11 2.43 -1.87 -3.35 114.38 106.77 2qp1 h ARG 118 Ca 0.02 -0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 59.00 2qp1 h ARG 118 Cb 1.08 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.59 2qp1 h ARG 118 CO 0.05 0.04 0.45 -1.12 -1.51 0.00 0.00 179.97 177.87 2qp1 s SER 119 N -5.83 4.63 0.00 -3.80 0.01 -1.26 -5.11 113.70 102.34 2qp1 s SER 119 Ca -0.05 -0.37 0.00 0.00 1.31 0.00 0.00 55.95 56.83 2qp1 s SER 119 Cb 0.21 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.88 2qp1 s SER 119 CO 0.76 -3.21 0.00 1.21 0.41 0.00 0.00 173.24 172.41