#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q2i s PRO 2 N 0.00 3.47 0.00 0.54 0.04 -1.26 -4.92 135.00 132.87 1q2i s PRO 2 Ca 0.00 1.10 0.00 0.00 0.04 0.00 0.00 61.00 62.14 1q2i s PRO 2 Cb 0.00 -4.10 0.00 0.00 0.04 0.00 0.00 34.50 30.44 1q2i s PRO 2 CO 0.00 -1.70 0.00 -0.11 0.04 0.00 0.00 177.00 175.23 1q2i n LEU 3 N 9.42 0.00 -3.50 -3.56 -0.00 -1.26 -5.16 117.00 112.93 1q2i n LEU 3 Ca 0.19 0.00 -0.01 0.00 -0.00 0.00 0.00 56.01 56.19 1q2i n LEU 3 Cb 0.48 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.85 1q2i n LEU 3 CO 0.70 0.00 0.18 -0.55 -0.00 0.00 0.00 177.39 177.72 1q2i s SER 4 N 0.00 -1.01 0.00 1.96 0.15 -1.26 -4.40 113.70 109.14 1q2i s SER 4 Ca 0.00 1.24 0.00 0.00 0.70 0.00 0.00 55.95 57.89 1q2i s SER 4 Cb 0.00 2.07 0.00 0.00 -1.71 0.00 0.00 66.02 66.38 1q2i s SER 4 CO 0.00 -0.24 0.00 0.00 1.20 0.00 0.00 173.24 174.20 1q2i n GLN 5 N 5.43 0.00 -2.32 5.44 3.00 -1.26 -4.81 117.38 122.86 1q2i n GLN 5 Ca -0.08 0.00 -0.21 0.00 -0.01 0.00 0.00 57.00 56.69 1q2i n GLN 5 Cb 0.50 0.00 0.02 0.00 0.00 0.00 0.00 30.24 30.75 1q2i n GLN 5 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.06 176.21 1q2i n GLU 6 N -0.25 3.16 0.00 -1.09 0.28 -1.26 -4.66 120.64 116.81 1q2i n GLU 6 Ca 0.00 -4.15 0.00 0.00 -0.16 0.00 0.00 57.16 52.85 1q2i n GLU 6 Cb 0.00 -2.12 0.00 0.00 1.43 0.00 0.00 31.44 30.75 1q2i n GLU 6 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1q2i n THR 7 N -0.57 0.00 0.30 3.84 -1.04 -1.26 -4.92 114.28 110.63 1q2i n THR 7 Ca 0.36 0.00 0.11 0.00 -2.04 0.00 0.00 64.05 62.47 1q2i n THR 7 Cb 0.83 0.00 0.57 0.00 -1.82 0.00 0.00 70.33 69.91 1q2i n THR 7 CO 0.00 0.00 0.00 2.19 -0.64 0.00 0.00 175.07 176.62 1q2i h PHE 8 N 0.00 0.00 0.00 -1.42 -5.15 -1.92 1.73 116.94 110.18 1q2i h PHE 8 Ca 0.00 0.00 -0.08 0.00 -0.20 0.00 0.00 57.97 57.69 1q2i h PHE 8 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.16 1q2i h PHE 8 CO 0.00 0.00 -0.36 1.03 -2.00 0.00 0.00 178.31 176.98 1q2i h SER 9 N 0.00 0.00 0.46 -0.68 0.87 -1.83 -3.06 113.55 109.31 1q2i h SER 9 Ca 0.00 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.53 1q2i h SER 9 Cb 0.92 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.87 1q2i h SER 9 CO 0.00 0.36 -0.13 -0.78 -0.53 0.00 0.00 176.83 175.75 1q2i h ASP 10 N 0.00 0.00 0.00 6.23 1.82 0.23 -3.37 116.42 121.34 1q2i h ASP 10 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1q2i h ASP 10 Cb 1.18 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.19 1q2i h ASP 10 CO 0.05 0.13 0.00 0.00 -1.61 0.00 0.00 179.24 177.81 1q2i n LEU 11 N -3.57 0.00 0.00 2.28 -0.00 -1.16 -4.25 117.00 110.30 1q2i n LEU 11 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.00 1q2i n LEU 11 Cb 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.69 1q2i n LEU 11 CO 0.30 0.00 0.00 0.79 -0.00 0.00 0.00 177.39 178.48 1q2i n TRP 12 N 0.00 0.00 0.02 1.47 5.03 -1.24 -0.58 117.44 122.15 1q2i n TRP 12 Ca 0.00 0.00 0.01 0.00 3.03 0.00 0.00 57.50 60.54 1q2i n TRP 12 Cb 0.00 0.00 0.05 0.00 -1.03 0.00 0.00 31.31 30.33 1q2i n TRP 12 CO 0.00 0.00 0.00 1.17 -0.03 0.00 0.00 177.69 178.83 1q2i n LYS 13 N 0.00 0.01 0.05 -0.99 4.81 -1.26 0.13 118.16 120.92 1q2i n LYS 13 Ca 0.00 0.33 -0.10 0.00 -0.87 0.00 0.00 58.31 57.67 1q2i n LYS 13 Cb 0.00 -1.76 -0.13 0.00 0.02 0.00 0.00 35.03 33.16 1q2i n LYS 13 CO 0.00 0.00 0.00 1.37 1.17 0.00 0.00 177.40 179.94 1q2i h LEU 14 N 0.00 0.11 -0.59 3.14 -0.00 -1.14 -1.70 115.31 115.13 1q2i h LEU 14 Ca 0.00 -0.14 0.00 0.00 -0.00 0.00 0.00 57.88 57.74 1q2i h LEU 14 Cb 0.44 -0.04 0.00 0.00 -0.00 0.00 0.00 40.66 41.07 1q2i h LEU 14 CO 0.00 1.11 -0.06 0.18 -0.00 0.00 0.00 178.44 179.67 1q2i n LEU 15 N -3.33 0.98 -0.04 0.17 7.99 0.35 -1.96 117.00 121.17 1q2i n LEU 15 Ca -0.07 -0.28 -0.06 0.00 -0.01 0.00 0.00 56.01 55.59 1q2i n LEU 15 Cb 0.99 -0.05 -0.02 0.00 -0.11 0.00 0.00 43.42 44.22 1q2i n LEU 15 CO 0.48 0.17 -0.44 0.29 -1.51 0.00 0.00 177.39 176.38 1q2i n LYS 16 N -0.37 0.34 0.00 3.23 4.76 -1.08 -4.57 118.16 120.47 1q2i n LYS 16 Ca 0.18 0.14 0.13 0.00 -2.87 0.00 0.00 58.31 55.89 1q2i n LYS 16 Cb 0.30 -1.09 0.65 0.00 -1.84 0.00 0.00 35.03 33.04 1q2i n LYS 16 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1q2i n LYS 17 N -4.08 0.27 0.00 1.97 2.85 -0.64 -4.62 118.16 113.91 1q2i n LYS 17 Ca -0.09 0.04 0.00 0.00 -1.05 0.00 0.00 58.31 57.20 1q2i n LYS 17 Cb 0.34 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.22 1q2i n LYS 17 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 177.40 178.26 1q2i n TRP 18 N -1.35 0.00 1.11 5.58 8.01 -0.83 0.30 117.44 130.26 1q2i n TRP 18 Ca 0.11 0.00 0.04 0.00 -1.31 0.00 0.00 57.50 56.34 1q2i n TRP 18 Cb 0.24 0.00 0.24 0.00 -2.01 0.00 0.00 31.31 29.78 1q2i n TRP 18 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 1q2i n LYS 19 N 0.00 0.56 -0.31 -0.99 5.02 -1.26 -4.90 118.16 116.28 1q2i n LYS 19 Ca 0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.18 1q2i n LYS 19 Cb 0.00 -1.22 -0.01 0.00 -0.02 0.00 0.00 35.03 33.78 1q2i n LYS 19 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1q2i n MET 20 N -0.72 0.00 -1.00 1.97 0.00 0.86 0.05 117.12 118.28 1q2i n MET 20 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.76 1q2i n MET 20 Cb 0.03 -0.23 0.00 0.00 0.00 0.00 0.00 33.22 33.02 1q2i n MET 20 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 1q2i n ARG 21 N 0.23 -0.01 -2.30 3.17 0.63 -1.26 -4.93 116.66 112.19 1q2i n ARG 21 Ca 0.04 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.56 1q2i n ARG 21 Cb 0.05 -2.73 0.00 0.00 0.45 0.00 0.00 32.46 30.24 1q2i n ARG 21 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1q2i n ARG 22 N -2.38 4.38 0.00 -0.14 3.00 0.11 -3.63 116.66 118.00 1q2i n ARG 22 Ca 0.00 -3.76 0.00 0.00 -0.01 0.00 0.00 57.85 54.08 1q2i n ARG 22 Cb 0.00 -2.69 0.00 0.00 0.00 0.00 0.00 32.46 29.77 1q2i n ARG 22 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1q2i n ASN 23 N 2.14 0.00 0.00 0.55 2.85 -1.25 -5.02 115.26 114.53 1q2i n ASN 23 Ca 0.49 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.96 1q2i n ASN 23 Cb 0.29 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.31 1q2i n ASN 23 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1q2i n GLN 24 N 0.00 0.00 -0.67 1.20 1.13 -1.26 -4.75 117.38 113.03 1q2i n GLN 24 Ca 0.00 0.00 0.50 0.00 -1.94 0.00 0.00 57.00 55.56 1q2i n GLN 24 Cb 0.00 0.00 0.78 0.00 0.11 0.00 0.00 30.24 31.13 1q2i n GLN 24 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1q2i n PHE 25 N 0.00 0.06 -2.64 1.08 3.01 -1.26 0.90 117.46 118.62 1q2i n PHE 25 Ca 0.00 0.07 -0.34 0.00 1.01 0.00 0.00 57.45 58.19 1q2i n PHE 25 Cb 0.00 -0.54 -0.00 0.00 -0.01 0.00 0.00 39.48 38.93 1q2i n PHE 25 CO 0.00 0.00 0.00 -2.67 1.01 0.00 0.00 176.76 175.10 1q2i n TRP 26 N -3.92 3.38 0.00 1.38 2.14 -1.26 -4.82 117.44 114.33 1q2i n TRP 26 Ca 0.43 -3.15 0.00 0.00 2.07 0.00 0.00 57.50 56.85 1q2i n TRP 26 Cb 1.91 -0.78 0.00 0.00 -0.81 0.00 0.00 31.31 31.64 1q2i n TRP 26 CO 0.00 0.00 0.00 1.33 2.07 0.00 0.00 177.69 181.09 1q2i n VAL 27 N -0.25 0.00 -0.74 -1.67 0.24 0.26 -3.89 118.33 112.27 1q2i n VAL 27 Ca 0.41 0.00 -0.08 0.00 -2.04 0.00 0.00 64.34 62.62 1q2i n VAL 27 Cb 0.36 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.73 1q2i n VAL 27 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1q2i n LYS 28 N 0.00 1.45 -1.21 7.34 5.02 -1.26 -4.77 118.16 124.74 1q2i n LYS 28 Ca 0.00 -0.77 -0.41 0.00 -2.02 0.00 0.00 58.31 55.11 1q2i n LYS 28 Cb 0.00 -1.37 -0.04 0.00 -0.02 0.00 0.00 35.03 33.60 1q2i n LYS 28 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1q2i n VAL 29 N 1.16 2.23 -2.34 -0.18 0.24 -1.26 -4.43 118.33 113.74 1q2i n VAL 29 Ca 0.17 -1.85 -0.02 0.00 -2.04 0.00 0.00 64.34 60.61 1q2i n VAL 29 Cb 0.57 -2.36 -0.02 0.00 -1.47 0.00 0.00 33.84 30.56 1q2i n VAL 29 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1q2i n GLN 30 N 6.46 -2.93 0.25 7.34 0.00 -1.26 -4.86 117.38 122.38 1q2i n GLN 30 Ca 0.50 2.40 0.09 0.00 -0.00 0.00 0.00 57.00 59.99 1q2i n GLN 30 Cb 0.37 -4.08 0.63 0.00 0.00 0.00 0.00 30.24 27.16 1q2i n GLN 30 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.06 177.13 1q2i h ARG 31 N 2.57 0.00 0.00 3.69 0.11 -1.92 -3.53 114.38 115.30 1q2i h ARG 31 Ca -0.20 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.88 1q2i h ARG 31 Cb 0.44 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.52 1q2i h ARG 31 CO 0.04 0.13 0.00 0.41 0.10 0.00 0.00 179.97 180.65