#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 -0.19 0.00 -2.24 -1.25 -3.17 114.28 107.42 1mpz n THR 2 Ca 0.00 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.73 1mpz n THR 2 Cb 0.00 0.57 -0.05 0.00 -2.10 0.00 0.00 70.33 68.75 1mpz n THR 2 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1mpz h THR 3 N 6.30 0.00 0.00 4.28 2.02 -1.96 -3.46 112.91 120.09 1mpz h THR 3 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1mpz h THR 3 Cb 1.33 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1mpz h THR 3 CO 0.00 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.50 1mpz n GLY 4 N -1.13 4.18 0.18 2.16 0.00 -1.26 -4.95 105.19 104.37 1mpz n GLY 4 Ca 0.01 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 -4.81 135.00 131.24 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 -1.14 0.00 0.00 -0.04 0.00 0.00 33.50 32.32 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 4.78 -0.25 0.00 0.00 3.00 -1.26 -4.49 116.66 118.44 1mpz n ARG 8 Ca 0.24 0.06 0.00 0.00 -0.00 0.00 0.00 57.85 58.15 1mpz n ARG 8 Cb 0.16 -3.77 0.00 0.00 0.00 0.00 0.00 32.46 28.85 1mpz n ARG 8 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1mpz n GLN 9 N -1.71 0.00 0.22 -0.14 6.02 1.00 -4.88 117.38 117.88 1mpz n GLN 9 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.07 1mpz n GLN 9 Cb 0.06 0.00 0.51 0.00 1.02 0.00 0.00 30.24 31.83 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 -3.65 1.09 0.00 0.00 -0.00 0.65 -4.36 118.16 111.88 1mpz n LYS 11 Ca -0.01 -0.19 0.00 0.00 -0.00 0.00 0.00 58.31 58.11 1mpz n LYS 11 Cb 0.37 -1.07 0.00 0.00 -0.00 0.00 0.00 35.03 34.33 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 1.14 0.00 -4.92 -5.58 -0.00 -1.00 -4.49 117.00 102.15 1mpz n LEU 12 Ca 0.04 0.15 -0.27 0.00 -0.00 0.00 0.00 56.01 55.93 1mpz n LEU 12 Cb 0.52 -0.15 -0.02 0.00 -0.00 0.00 0.00 43.42 43.78 1mpz n LEU 12 CO 0.04 -0.15 0.28 -1.59 -0.00 0.00 0.00 177.39 175.98 1mpz s LYS 13 N -2.20 3.56 -0.55 1.47 0.00 -1.26 -4.95 119.74 115.82 1mpz s LYS 13 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 55.97 55.89 1mpz s LYS 13 Cb 0.00 -2.55 -0.14 0.00 0.00 0.00 0.00 37.83 35.14 1mpz s LYS 13 CO 0.00 0.04 2.69 -0.35 0.00 0.00 0.00 175.35 177.73 1mpz n PRO 14 N -1.67 2.08 -1.09 1.78 -0.04 -1.26 -4.85 135.00 129.95 1mpz n PRO 14 Ca -0.02 -1.21 0.15 0.00 -0.04 0.00 0.00 63.50 62.38 1mpz n PRO 14 Cb 0.55 -2.20 -0.04 0.00 -0.04 0.00 0.00 33.50 31.77 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 3.21 -2.83 0.00 0.55 0.00 -1.15 -5.00 120.51 115.28 1mpz n ALA 15 Ca 0.44 0.42 0.00 0.00 0.00 0.00 0.00 53.44 54.31 1mpz n ALA 15 Cb 0.46 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.89 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 -3.62 0.00 0.00 0.00 0.00 -1.06 -4.97 105.19 95.54 1mpz n GLY 16 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 0.00 -4.71 2.61 -1.04 -1.18 -4.38 114.28 105.58 1mpz n THR 17 Ca 0.00 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.71 1mpz n THR 17 Cb 0.00 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.37 1mpz n THR 17 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1mpz s THR 18 N -1.36 2.31 -0.90 12.58 -1.32 -1.26 0.24 115.64 125.94 1mpz s THR 18 Ca 0.00 -1.46 -0.21 0.00 -1.21 0.00 0.00 61.69 58.81 1mpz s THR 18 Cb 0.00 -1.95 0.03 0.00 -1.51 0.00 0.00 72.50 69.07 1mpz s THR 18 CO 0.00 0.28 0.53 0.00 -2.21 0.00 0.00 174.62 173.22 1mpz n TRP 20 N -3.76 -0.94 -1.01 0.00 -0.00 -1.24 -4.97 117.44 105.51 1mpz n TRP 20 Ca -0.14 0.17 0.00 0.00 -0.00 0.00 0.00 57.50 57.53 1mpz n TRP 20 Cb 0.48 0.27 0.00 0.00 -0.00 0.00 0.00 31.31 32.07 1mpz n TRP 20 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 1mpz n LYS 21 N -3.25 -2.16 -2.82 5.87 5.02 0.13 -4.87 118.16 116.08 1mpz n LYS 21 Ca 0.00 1.76 -0.20 0.00 -2.02 0.00 0.00 58.31 57.85 1mpz n LYS 21 Cb 0.00 -1.66 0.05 0.00 -0.02 0.00 0.00 35.03 33.40 1mpz n LYS 21 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1mpz s THR 22 N -0.51 2.53 -1.61 -0.18 -4.23 -1.26 -4.64 115.64 105.73 1mpz s THR 22 Ca 0.00 -0.82 0.17 0.00 -1.18 0.00 0.00 61.69 59.86 1mpz s THR 22 Cb 0.00 -2.71 0.57 0.00 1.34 0.00 0.00 72.50 71.70 1mpz s THR 22 CO 0.00 0.00 1.47 -1.20 -0.54 0.00 0.00 174.62 174.35 1mpz n SER 23 N -2.29 3.65 -0.03 3.99 7.64 -1.26 -4.10 113.62 121.22 1mpz n SER 23 Ca 0.11 -2.18 -0.06 0.00 1.01 0.00 0.00 58.87 57.75 1mpz n SER 23 Cb 0.60 -0.47 -0.02 0.00 -1.01 0.00 0.00 64.21 63.31 1mpz n SER 23 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1mpz n LEU 24 N 1.09 0.74 0.00 -3.43 -0.00 -1.26 -5.03 117.00 109.11 1mpz n LEU 24 Ca 0.21 0.06 0.00 0.00 -0.00 0.00 0.00 56.01 56.28 1mpz n LEU 24 Cb 0.64 -0.18 0.00 0.00 -0.00 0.00 0.00 43.42 43.88 1mpz n LEU 24 CO 0.17 0.18 0.00 0.41 -0.00 0.00 0.00 177.39 178.15 1mpz n THR 25 N -3.19 0.00 0.00 1.47 -1.04 -1.26 -5.14 114.28 105.12 1mpz n THR 25 Ca -0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.90 1mpz n THR 25 Cb 0.59 -0.26 0.00 0.00 -1.82 0.00 0.00 70.33 68.84 1mpz n THR 25 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1mpz n SER 26 N -0.62 0.00 -4.93 8.00 3.41 -1.26 -4.73 113.62 113.48 1mpz n SER 26 Ca 0.00 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.36 1mpz n SER 26 Cb 0.00 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 63.99 1mpz n SER 26 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1mpz s HIS 27 N 0.00 3.10 0.00 7.33 3.76 -1.26 -4.09 115.29 124.13 1mpz s HIS 27 Ca 0.00 0.45 0.00 0.00 -0.15 0.00 0.00 55.06 55.36 1mpz s HIS 27 Cb 0.00 -2.83 0.00 0.00 1.11 0.00 0.00 32.58 30.86 1mpz s HIS 27 CO 0.00 -0.96 0.00 0.66 -0.85 0.00 0.00 174.74 173.59 1mpz n TYR 28 N -2.60 0.00 -3.25 1.40 4.02 -1.11 0.18 117.16 115.79 1mpz n TYR 28 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.95 1mpz n TYR 28 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.91 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 2.25 0.00 0.00 0.00 -1.04 -1.26 -2.55 114.28 111.68 1mpz n THR 30 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1mpz n THR 30 Cb 0.00 -0.44 0.00 0.00 -1.82 0.00 0.00 70.33 68.07 1mpz n THR 30 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1mpz n GLY 31 N 2.74 2.90 0.00 3.41 0.00 -1.26 -2.93 105.19 110.05 1mpz n GLY 31 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1mpz n GLY 31 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1mpz n LYS 32 N 0.00 0.00 -3.38 1.61 5.02 -1.26 -4.83 118.16 115.32 1mpz n LYS 32 Ca 0.00 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.03 1mpz n LYS 32 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 34.93 1mpz n LYS 32 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1mpz n SER 33 N 0.00 2.65 -3.02 4.39 3.41 -1.26 -4.45 113.62 115.35 1mpz n SER 33 Ca 0.00 -3.21 -0.08 0.00 -0.26 0.00 0.00 58.87 55.32 1mpz n SER 33 Cb 0.00 -0.66 0.04 0.00 -0.26 0.00 0.00 64.21 63.33 1mpz n SER 33 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mpz n ASP 35 N -2.89 0.13 -3.63 0.00 -0.08 -1.26 -4.83 116.55 103.98 1mpz n ASP 35 Ca 0.06 -2.05 -0.25 0.00 -1.51 0.00 0.00 54.79 51.04 1mpz n ASP 35 Cb 0.23 0.01 -0.17 0.00 2.34 0.00 0.00 41.12 43.53 1mpz n ASP 35 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1mpz s PRO 37 N 2.13 4.40 -0.43 0.00 0.04 -1.26 -4.15 135.00 135.72 1mpz s PRO 37 Ca 0.03 1.71 -0.20 0.00 0.04 0.00 0.00 61.00 62.57 1mpz s PRO 37 Cb -0.15 -3.46 0.02 0.00 0.04 0.00 0.00 34.50 30.95 1mpz s PRO 37 CO -0.08 -0.35 0.62 -0.51 0.04 0.00 0.00 177.00 176.73 1mpz s LEU 38 N 1.65 4.53 0.00 -3.56 1.02 -1.19 -4.75 118.68 116.38 1mpz s LEU 38 Ca 0.57 -0.36 0.00 0.00 0.02 0.00 0.00 54.13 54.36 1mpz s LEU 38 Cb -0.27 -2.70 0.00 0.00 0.02 0.00 0.00 46.19 43.25 1mpz s LEU 38 CO 0.26 -0.75 0.00 0.00 0.02 0.00 0.00 176.35 175.87 1mpz n TYR 39 N 6.19 0.00 -1.55 0.29 9.36 -1.26 0.25 117.16 130.44 1mpz n TYR 39 Ca -0.02 0.00 -0.30 0.00 3.32 0.00 0.00 57.90 60.90 1mpz n TYR 39 Cb 0.48 -0.95 0.10 0.00 -0.63 0.00 0.00 39.34 38.34 1mpz n TYR 39 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 1mpz s PRO 40 N -5.81 1.79 0.00 2.98 0.04 -1.26 -2.50 135.00 130.23 1mpz s PRO 40 Ca 0.00 0.52 0.00 0.00 0.04 0.00 0.00 61.00 61.56 1mpz s PRO 40 Cb 0.00 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.65 1mpz s PRO 40 CO 0.00 -1.80 0.00 0.41 0.04 0.00 0.00 177.00 175.65