#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mpz n THR 2 N 0.00 0.00 0.00 0.00 5.66 -1.26 -4.09 114.28 114.59 1mpz n THR 2 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1mpz n THR 2 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1mpz n THR 2 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1mpz n THR 3 N 0.00 0.00 0.00 1.09 -1.04 -1.26 -5.04 114.28 108.02 1mpz n THR 3 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1mpz n THR 3 Cb 0.00 -0.73 0.00 0.00 -1.82 0.00 0.00 70.33 67.78 1mpz n THR 3 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1mpz n GLY 4 N 0.00 2.27 0.19 3.41 0.00 -1.26 -4.91 105.19 104.90 1mpz n GLY 4 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1mpz n GLY 4 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1mpz n PRO 5 N 0.00 0.75 0.00 1.61 -0.04 -1.26 -3.89 135.00 132.17 1mpz n PRO 5 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1mpz n PRO 5 Cb 0.00 -1.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 1mpz n PRO 5 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mpz n ARG 8 N 5.94 0.00 0.00 0.00 5.12 -1.26 -4.61 116.66 121.84 1mpz n ARG 8 Ca 0.30 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.22 1mpz n ARG 8 Cb 0.14 -0.72 0.00 0.00 -1.16 0.00 0.00 32.46 30.72 1mpz n ARG 8 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1mpz n GLN 9 N -1.12 0.00 -3.76 5.56 6.02 0.63 -4.92 117.38 119.79 1mpz n GLN 9 Ca 0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.70 1mpz n GLN 9 Cb 0.00 -0.06 -0.12 0.00 1.02 0.00 0.00 30.24 31.08 1mpz n GLN 9 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1mpz n LYS 11 N 2.88 0.00 0.05 0.00 0.00 -1.09 -3.16 118.16 116.85 1mpz n LYS 11 Ca 0.15 -0.36 0.03 0.00 -0.00 0.00 0.00 58.31 58.13 1mpz n LYS 11 Cb 0.36 0.48 0.15 0.00 -0.00 0.00 0.00 35.03 36.03 1mpz n LYS 11 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.40 178.87 1mpz n LEU 12 N 0.00 0.15 -4.35 -5.58 -0.00 -1.26 -4.01 117.00 101.95 1mpz n LEU 12 Ca -0.10 0.49 -0.45 0.00 -0.00 0.00 0.00 56.01 55.95 1mpz n LEU 12 Cb 0.41 -0.49 -0.02 0.00 -0.00 0.00 0.00 43.42 43.32 1mpz n LEU 12 CO -0.05 -0.54 -0.23 2.29 -0.00 0.00 0.00 177.39 178.86 1mpz n LYS 13 N -1.65 0.02 -0.57 1.47 2.85 -1.26 -4.68 118.16 114.34 1mpz n LYS 13 Ca -0.00 0.01 -0.05 0.00 -1.05 0.00 0.00 58.31 57.22 1mpz n LYS 13 Cb 0.12 -1.01 -0.07 0.00 -0.65 0.00 0.00 35.03 33.42 1mpz n LYS 13 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 1mpz n PRO 14 N 1.17 1.14 -1.04 -1.58 -0.04 -1.26 -4.58 135.00 128.81 1mpz n PRO 14 Ca 0.14 -0.39 0.00 0.00 -0.04 0.00 0.00 63.50 63.21 1mpz n PRO 14 Cb 0.33 -1.51 0.00 0.00 -0.04 0.00 0.00 33.50 32.28 1mpz n PRO 14 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mpz n ALA 15 N 2.14 -2.56 -0.50 0.55 0.00 -1.26 -5.08 120.51 113.80 1mpz n ALA 15 Ca 0.17 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.82 1mpz n ALA 15 Cb 0.54 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 19.05 1mpz n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mpz n GLY 16 N 0.44 0.01 0.00 0.00 0.00 -1.10 -4.99 105.19 99.55 1mpz n GLY 16 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1mpz n GLY 16 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1mpz n THR 17 N -1.75 0.00 -4.28 2.61 -1.04 -0.96 -5.00 114.28 103.86 1mpz n THR 17 Ca 0.00 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 61.76 1mpz n THR 17 Cb 0.00 0.00 -0.17 0.00 -1.82 0.00 0.00 70.33 68.34 1mpz n THR 17 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1mpz s THR 18 N -2.85 1.01 -0.89 12.58 2.01 -1.26 0.28 115.64 126.51 1mpz s THR 18 Ca 0.00 -0.36 -0.10 0.00 0.31 0.00 0.00 61.69 61.54 1mpz s THR 18 Cb 0.00 -0.97 0.01 0.00 0.01 0.00 0.00 72.50 71.55 1mpz s THR 18 CO 0.00 0.34 0.58 0.00 -0.69 0.00 0.00 174.62 174.85 1mpz n TRP 20 N -3.23 0.00 0.00 0.00 -0.00 -1.26 -4.91 117.44 108.04 1mpz n TRP 20 Ca -0.24 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.26 1mpz n TRP 20 Cb 0.61 0.31 0.00 0.00 -0.00 0.00 0.00 31.31 32.23 1mpz n TRP 20 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 177.69 178.05 1mpz n LYS 21 N -1.95 0.00 -0.00 5.87 2.85 -1.26 -4.82 118.16 118.85 1mpz n LYS 21 Ca 0.00 0.00 -0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1mpz n LYS 21 Cb 0.00 0.00 -0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1mpz n LYS 21 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1mpz h THR 22 N 0.00 0.00 0.00 0.58 1.35 -1.92 -3.44 112.91 109.48 1mpz h THR 22 Ca 0.00 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.85 1mpz h THR 22 Cb 0.00 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.42 1mpz h THR 22 CO 0.00 0.00 0.00 -1.20 -0.25 0.00 0.00 175.52 174.07 1mpz n SER 23 N -2.04 0.00 0.03 5.36 7.64 -1.26 -5.00 113.62 118.35 1mpz n SER 23 Ca -0.00 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.87 1mpz n SER 23 Cb 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1mpz n SER 23 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1mpz n LEU 24 N 0.00 1.03 0.00 -3.43 7.94 -1.26 -4.96 117.00 116.32 1mpz n LEU 24 Ca 0.00 0.14 0.00 0.00 -1.11 0.00 0.00 56.01 55.04 1mpz n LEU 24 Cb 0.00 -0.33 0.00 0.00 0.53 0.00 0.00 43.42 43.62 1mpz n LEU 24 CO 0.00 -0.68 0.00 0.41 -1.11 0.00 0.00 177.39 176.01 1mpz n THR 25 N -3.44 0.00 0.00 1.96 -1.04 -1.26 -5.04 114.28 105.45 1mpz n THR 25 Ca -0.01 0.43 0.00 0.00 -2.04 0.00 0.00 64.05 62.43 1mpz n THR 25 Cb 0.04 -1.32 0.00 0.00 -1.82 0.00 0.00 70.33 67.23 1mpz n THR 25 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1mpz n SER 26 N -1.92 0.00 0.00 8.00 7.64 -1.26 -4.81 113.62 121.27 1mpz n SER 26 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1mpz n SER 26 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1mpz n SER 26 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1mpz n HIS 27 N 0.00 0.00 -0.86 1.43 8.25 -1.26 -4.66 115.22 118.11 1mpz n HIS 27 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1mpz n HIS 27 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1mpz n HIS 27 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1mpz n TYR 28 N 0.00 0.00 -2.82 4.41 4.02 -1.25 -3.85 117.16 117.67 1mpz n TYR 28 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1mpz n TYR 28 Cb 0.00 -1.41 0.00 0.00 -0.02 0.00 0.00 39.34 37.91 1mpz n TYR 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1mpz n THR 30 N 1.72 0.05 0.00 0.00 -2.24 -1.25 -2.26 114.28 110.30 1mpz n THR 30 Ca 0.00 0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1mpz n THR 30 Cb 0.00 -0.40 0.00 0.00 -2.10 0.00 0.00 70.33 67.83 1mpz n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mpz n GLY 31 N 1.62 1.01 1.52 3.38 0.00 -1.26 -3.98 105.19 107.48 1mpz n GLY 31 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.58 1mpz n GLY 31 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1mpz n LYS 32 N 0.00 -3.46 0.00 1.61 -0.00 -1.26 -4.55 118.16 110.50 1mpz n LYS 32 Ca 0.00 2.59 0.00 0.00 -0.00 0.00 0.00 58.31 60.90 1mpz n LYS 32 Cb 0.00 -3.09 0.00 0.00 -0.00 0.00 0.00 35.03 31.94 1mpz n LYS 32 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1mpz n SER 33 N -1.04 0.00 -3.72 -5.58 2.88 -1.26 -4.97 113.62 99.93 1mpz n SER 33 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1mpz n SER 33 Cb 0.03 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 1mpz n SER 33 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1mpz n ASP 35 N 0.00 0.00 -3.55 0.00 4.64 -1.26 -4.99 116.55 111.39 1mpz n ASP 35 Ca 0.00 0.00 0.02 0.00 -1.38 0.00 0.00 54.79 53.43 1mpz n ASP 35 Cb 0.00 0.00 -0.06 0.00 -1.04 0.00 0.00 41.12 40.02 1mpz n ASP 35 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1mpz s PRO 37 N 1.29 3.39 -1.07 0.00 0.04 -1.25 -4.18 135.00 133.22 1mpz s PRO 37 Ca -0.06 1.16 -0.03 0.00 0.04 0.00 0.00 61.00 62.11 1mpz s PRO 37 Cb -0.02 -2.04 0.30 0.00 0.04 0.00 0.00 34.50 32.78 1mpz s PRO 37 CO -0.11 -0.75 1.72 1.47 0.04 0.00 0.00 177.00 179.36 1mpz n LEU 38 N -2.01 7.01 -4.40 -3.56 -0.00 -1.25 -4.55 117.00 108.24 1mpz n LEU 38 Ca 0.08 -5.27 -0.36 0.00 -0.00 0.00 0.00 56.01 50.46 1mpz n LEU 38 Cb 0.53 -1.23 -0.13 0.00 -0.00 0.00 0.00 43.42 42.59 1mpz n LEU 38 CO 0.47 1.89 -0.32 -0.47 -0.00 0.00 0.00 177.39 178.96 1mpz s TYR 39 N -3.42 3.04 -1.13 1.47 5.04 -1.26 -1.10 117.35 119.98 1mpz s TYR 39 Ca 0.36 -0.62 -0.14 0.00 -2.44 0.00 0.00 57.07 54.23 1mpz s TYR 39 Cb 0.13 -2.19 -0.07 0.00 0.35 0.00 0.00 41.96 40.18 1mpz s TYR 39 CO -0.03 -0.43 2.21 -0.35 -1.34 0.00 0.00 175.55 175.61 1mpz n PRO 40 N 4.88 2.36 0.00 4.97 -0.04 -1.26 -5.00 135.00 140.90 1mpz n PRO 40 Ca -0.17 -2.04 0.00 0.00 -0.04 0.00 0.00 63.50 61.25 1mpz n PRO 40 Cb 0.51 -2.91 0.00 0.00 -0.04 0.00 0.00 33.50 31.06 1mpz n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87