#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 3.58 0.00 0.54 0.04 -1.26 -4.92 135.00 132.98 1q2i s PRO 2 Ca 0.00 1.21 0.00 0.00 0.04 0.00 0.00 61.00 62.25 1q2i s PRO 2 Cb 0.00 -4.06 0.00 0.00 0.04 0.00 0.00 34.50 30.48 1q2i s PRO 2 CO 0.00 -1.56 0.00 -0.11 0.04 0.00 0.00 177.00 175.37 1q2i n LEU 3 N 9.03 0.00 -3.37 -3.56 -0.00 -1.26 -5.16 117.00 112.68 1q2i n LEU 3 Ca 0.18 0.00 0.01 0.00 -0.00 0.00 0.00 56.01 56.20 1q2i n LEU 3 Cb 0.47 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.86 1q2i n LEU 3 CO 0.68 0.00 0.18 -0.55 -0.00 0.00 0.00 177.39 177.70 1q2i s SER 4 N 0.00 -1.14 0.00 1.96 0.15 -1.26 -4.49 113.70 108.92 1q2i s SER 4 Ca 0.00 1.10 0.00 0.00 0.70 0.00 0.00 55.95 57.75 1q2i s SER 4 Cb 0.00 2.12 0.00 0.00 -1.71 0.00 0.00 66.02 66.43 1q2i s SER 4 CO 0.00 -0.25 0.00 0.00 1.20 0.00 0.00 173.24 174.19 1q2i n GLN 5 N 5.43 0.00 -1.93 5.44 6.02 -1.26 -4.82 117.38 126.27 1q2i n GLN 5 Ca -0.06 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.65 1q2i n GLN 5 Cb 0.50 0.00 0.03 0.00 1.02 0.00 0.00 30.24 31.79 1q2i n GLN 5 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 1q2i n GLU 6 N 0.00 3.32 0.00 -1.09 0.28 -1.26 -4.48 120.64 117.41 1q2i n GLU 6 Ca 0.00 -3.98 0.00 0.00 -0.16 0.00 0.00 57.16 53.02 1q2i n GLU 6 Cb 0.00 -2.28 0.00 0.00 1.43 0.00 0.00 31.44 30.59 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 -0.71 0.00 0.25 3.84 -1.04 -1.26 -4.92 114.28 110.44 1q2i n THR 7 Ca 0.48 0.00 0.11 0.00 -2.04 0.00 0.00 64.05 62.60 1q2i n THR 7 Cb 0.80 0.00 0.58 0.00 -1.82 0.00 0.00 70.33 69.89 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 -1.89 0.93 116.94 109.41 1q2i h PHE 8 Ca 0.00 0.00 -0.15 0.00 -0.20 0.00 0.00 57.97 57.62 1q2i h PHE 8 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.15 1q2i h PHE 8 CO 0.00 0.00 -0.72 0.66 -2.00 0.00 0.00 178.31 176.25 1q2i h SER 9 N 0.00 0.00 0.08 -0.68 4.64 -1.79 -3.03 113.55 112.77 1q2i h SER 9 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1q2i h SER 9 Cb 0.64 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.73 1q2i h SER 9 CO 0.00 0.72 -0.03 -0.78 -0.87 0.00 0.00 176.83 175.87 1q2i h ASP 10 N 0.00 0.00 0.00 4.97 3.58 0.65 -3.35 116.42 122.26 1q2i h ASP 10 Ca -0.01 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.44 1q2i h ASP 10 Cb 1.37 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.42 1q2i h ASP 10 CO 0.09 0.03 0.00 0.00 -2.88 0.00 0.00 179.24 176.49 1q2i n LEU 11 N -3.91 0.00 0.00 2.28 -0.00 -1.15 -4.25 117.00 109.97 1q2i n LEU 11 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.98 1q2i n LEU 11 Cb 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.54 1q2i n LEU 11 CO 0.29 0.00 0.00 0.79 -0.00 0.00 0.00 177.39 178.47 1q2i n TRP 12 N 0.00 0.00 0.00 1.47 5.03 -1.24 -1.09 117.44 121.61 1q2i n TRP 12 Ca 0.00 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.53 1q2i n TRP 12 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 31.31 30.28 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 0.00 0.00 -0.99 4.81 -1.26 0.13 118.16 120.86 1q2i n LYS 13 Ca 0.00 0.18 -0.15 0.00 -0.87 0.00 0.00 58.31 57.46 1q2i n LYS 13 Cb 0.00 -1.65 -0.14 0.00 0.02 0.00 0.00 35.03 33.26 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 0.23 0.00 3.14 -0.00 -1.41 -3.36 115.31 113.91 1q2i h LEU 14 Ca 0.00 -0.49 0.00 0.00 -0.00 0.00 0.00 57.88 57.39 1q2i h LEU 14 Cb 0.29 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 40.88 1q2i h LEU 14 CO 0.00 1.44 -1.15 0.18 -0.00 0.00 0.00 178.44 178.91 1q2i n LEU 15 N -3.29 0.58 0.15 0.17 4.77 0.35 -4.26 117.00 115.48 1q2i n LEU 15 Ca -0.23 0.07 0.04 0.00 -0.03 0.00 0.00 56.01 55.86 1q2i n LEU 15 Cb 1.05 -0.08 0.07 0.00 -2.33 0.00 0.00 43.42 42.13 1q2i n LEU 15 CO 0.45 -0.02 0.77 1.17 -1.33 0.00 0.00 177.39 178.42 1q2i n LYS 16 N -2.18 0.02 0.02 3.23 0.00 0.31 0.83 118.16 120.38 1q2i n LYS 16 Ca 0.01 0.70 0.12 0.00 0.00 0.00 0.00 58.31 59.14 1q2i n LYS 16 Cb 0.48 -1.86 0.18 0.00 0.00 0.00 0.00 35.03 33.83 1q2i n LYS 16 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 1q2i n LYS 17 N -2.12 0.10 -0.06 1.64 2.85 -1.26 -4.04 118.16 115.28 1q2i n LYS 17 Ca 0.04 0.02 -0.13 0.00 -1.05 0.00 0.00 58.31 57.19 1q2i n LYS 17 Cb 0.81 -1.55 -0.06 0.00 -0.65 0.00 0.00 35.03 33.58 1q2i n LYS 17 CO 0.00 0.00 0.00 0.11 -0.05 0.00 0.00 177.40 177.46 1q2i h TRP 18 N 0.00 0.48 0.00 5.58 -0.00 3.36 -2.55 115.95 122.81 1q2i h TRP 18 Ca 0.00 -0.14 0.00 0.00 -0.00 0.00 0.00 58.89 58.75 1q2i h TRP 18 Cb 0.59 -0.10 0.00 0.00 -0.00 0.00 0.00 29.16 29.64 1q2i h TRP 18 CO 0.00 0.76 0.00 1.17 -0.00 0.00 0.00 178.44 180.37 1q2i n LYS 19 N -4.53 0.45 -3.47 0.12 3.00 -1.23 -4.67 118.16 107.83 1q2i n LYS 19 Ca -0.06 0.05 -0.23 0.00 -0.00 0.00 0.00 58.31 58.08 1q2i n LYS 19 Cb 0.36 -1.50 -0.01 0.00 0.00 0.00 0.00 35.03 33.88 1q2i n LYS 19 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.40 175.76 1q2i s MET 20 N -2.34 3.47 0.00 1.64 -1.94 -0.96 -4.09 119.30 115.07 1q2i s MET 20 Ca 0.25 -0.41 0.00 0.00 -1.71 0.00 0.00 55.69 53.82 1q2i s MET 20 Cb 0.14 -2.70 0.00 0.00 2.01 0.00 0.00 34.83 34.28 1q2i s MET 20 CO 0.29 0.19 0.00 -2.13 -0.01 0.00 0.00 175.02 173.36 1q2i n ARG 21 N -1.73 -1.50 -2.45 2.03 0.63 -1.26 -4.87 116.66 107.51 1q2i n ARG 21 Ca -0.05 0.38 -0.42 0.00 -0.92 0.00 0.00 57.85 56.83 1q2i n ARG 21 Cb 0.56 -4.55 0.01 0.00 0.45 0.00 0.00 32.46 28.93 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 0.05 4.27 0.00 -0.14 5.12 -1.26 -3.18 116.66 121.52 1q2i n ARG 22 Ca 0.00 -3.89 0.00 0.00 -1.93 0.00 0.00 57.85 52.03 1q2i n ARG 22 Cb 0.38 -2.70 0.00 0.00 -1.16 0.00 0.00 32.46 28.97 1q2i n ARG 22 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1q2i n ASN 23 N 2.30 0.00 0.00 0.55 2.85 -1.26 -4.96 115.26 114.73 1q2i n ASN 23 Ca 0.42 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.89 1q2i n ASN 23 Cb 0.32 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.34 1q2i n ASN 23 CO 0.00 0.00 0.00 1.67 -2.11 0.00 0.00 177.26 176.82 1q2i n GLN 24 N 0.00 0.00 -0.11 1.20 0.00 -1.26 -4.88 117.38 112.33 1q2i n GLN 24 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.00 56.86 1q2i n GLN 24 Cb 0.00 -0.10 -0.12 0.00 0.00 0.00 0.00 30.24 30.02 1q2i n GLN 24 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1q2i n PHE 25 N -1.73 0.00 -1.21 3.69 -0.00 -1.26 -4.39 117.46 112.57 1q2i n PHE 25 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 57.45 57.17 1q2i n PHE 25 Cb 0.00 -0.93 0.13 0.00 -0.00 0.00 0.00 39.48 38.68 1q2i n PHE 25 CO 0.00 0.00 0.00 -2.67 -0.00 0.00 0.00 176.76 174.09 1q2i n TRP 26 N -3.05 3.02 -1.70 -5.13 2.14 -1.26 -4.71 117.44 106.75 1q2i n TRP 26 Ca -0.39 -2.31 -0.33 0.00 2.07 0.00 0.00 57.50 56.54 1q2i n TRP 26 Cb 1.01 -1.14 -0.04 0.00 -0.81 0.00 0.00 31.31 30.33 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 -0.96 4.33 0.00 -1.67 0.24 -1.19 -3.81 118.33 115.26 1q2i n VAL 27 Ca 0.59 -3.53 0.00 0.00 -2.04 0.00 0.00 64.34 59.36 1q2i n VAL 27 Cb 1.20 -1.93 0.00 0.00 -1.47 0.00 0.00 33.84 31.64 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 1.58 0.00 -1.06 7.34 5.02 -1.26 -4.97 118.16 124.82 1q2i n LYS 28 Ca 0.57 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.71 1q2i n LYS 28 Cb 0.40 0.00 0.20 0.00 -0.02 0.00 0.00 35.03 35.61 1q2i n LYS 28 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1q2i n VAL 29 N 0.00 2.95 -2.68 -0.18 0.31 -1.25 -4.63 118.33 112.85 1q2i n VAL 29 Ca 0.00 -2.16 -0.04 0.00 -0.01 0.00 0.00 64.34 62.13 1q2i n VAL 29 Cb 0.00 -0.41 0.05 0.00 -0.91 0.00 0.00 33.84 32.58 1q2i n VAL 29 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1q2i n GLN 30 N -1.02 0.19 -1.73 5.55 7.27 -1.26 -5.15 117.38 121.23 1q2i n GLN 30 Ca 0.49 -0.90 -0.40 0.00 0.07 0.00 0.00 57.00 56.26 1q2i n GLN 30 Cb 1.43 -0.26 0.02 0.00 2.41 0.00 0.00 30.24 33.84 1q2i n GLN 30 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 1q2i n ARG 31 N 2.05 1.99 0.00 3.69 0.63 -1.26 -5.11 116.66 118.64 1q2i n ARG 31 Ca 0.07 0.71 0.00 0.00 -0.92 0.00 0.00 57.85 57.71 1q2i n ARG 31 Cb 0.67 -2.51 0.00 0.00 0.45 0.00 0.00 32.46 31.06 1q2i n ARG 31 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53