#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 -3.98 114.28 114.70 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 0.50 0.00 0.00 -1.55 0.00 0.00 70.33 69.28 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 -4.95 114.28 108.12 1mpz n THR 3 Ca 0.00 1.06 0.00 0.00 -2.04 0.00 0.00 64.05 63.07 1mpz n THR 3 Cb 0.56 -1.81 0.00 0.00 -1.82 0.00 0.00 70.33 67.26 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 -0.77 4.12 1.25 3.41 0.00 -1.26 -4.95 105.19 106.99 1mpz n GLY 4 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.31 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 -4.79 135.00 131.27 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 -1.12 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 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 8.51 0.00 0.00 0.00 5.12 -1.26 -4.44 116.66 124.59 1mpz n ARG 8 Ca 0.50 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.42 1mpz n ARG 8 Cb 0.35 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.65 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 -0.91 0.00 0.29 5.56 3.00 0.94 -4.91 117.38 121.35 1mpz n GLN 9 Ca 0.00 0.00 0.17 0.00 -0.01 0.00 0.00 57.00 57.16 1mpz n GLN 9 Cb 0.00 0.00 0.96 0.00 0.00 0.00 0.00 30.24 31.20 1mpz n GLN 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1mpz n LYS 11 N -3.61 0.96 -0.59 0.00 -0.00 0.16 -4.03 118.16 111.05 1mpz n LYS 11 Ca -0.02 0.00 0.46 0.00 -0.00 0.00 0.00 58.31 58.75 1mpz n LYS 11 Cb 0.15 -1.16 0.73 0.00 -0.00 0.00 0.00 35.03 34.75 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 -0.66 0.07 -4.56 -5.58 -0.00 0.29 -4.24 117.00 102.33 1mpz n LEU 12 Ca 0.07 1.07 -0.29 0.00 -0.00 0.00 0.00 56.01 56.86 1mpz n LEU 12 Cb 0.03 -0.53 0.22 0.00 -0.00 0.00 0.00 43.42 43.14 1mpz n LEU 12 CO 0.05 -1.11 0.57 -1.59 -0.00 0.00 0.00 177.39 175.32 1mpz s LYS 13 N -4.89 -0.31 0.00 1.47 0.00 -1.26 -4.81 119.74 109.95 1mpz s LYS 13 Ca -0.05 0.89 -0.01 0.00 0.00 0.00 0.00 55.97 56.80 1mpz s LYS 13 Cb 0.27 -1.62 -0.05 0.00 0.00 0.00 0.00 37.83 36.43 1mpz s LYS 13 CO 0.82 -3.33 1.80 -0.35 0.00 0.00 0.00 175.35 174.29 1mpz n PRO 14 N -4.65 0.92 -1.56 1.78 -0.04 -1.26 -4.88 135.00 125.31 1mpz n PRO 14 Ca 0.05 -0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 1mpz n PRO 14 Cb 0.54 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.71 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 1.85 -1.87 -2.00 0.55 0.00 -1.26 -5.07 120.51 112.71 1mpz n ALA 15 Ca 0.07 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1mpz n ALA 15 Cb 0.45 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.52 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 -2.32 2.75 3.25 0.00 0.00 -1.26 -5.04 105.19 102.57 1mpz n GLY 16 Ca 0.00 -0.39 -0.14 0.00 0.00 0.00 0.00 46.02 45.49 1mpz n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mpz s THR 17 N 1.66 1.03 -0.09 2.61 2.01 -1.24 -4.87 115.64 116.76 1mpz s THR 17 Ca 0.00 -2.03 -0.29 0.00 0.31 0.00 0.00 61.69 59.67 1mpz s THR 17 Cb 0.00 -1.91 -0.05 0.00 0.01 0.00 0.00 72.50 70.56 1mpz s THR 17 CO 0.00 -0.69 1.62 -0.89 -0.69 0.00 0.00 174.62 173.96 1mpz s THR 18 N -3.41 3.66 -0.28 -0.82 2.01 0.09 0.22 115.64 117.12 1mpz s THR 18 Ca 0.18 0.79 -0.04 0.00 0.31 0.00 0.00 61.69 62.94 1mpz s THR 18 Cb 0.04 -3.54 0.00 0.00 0.01 0.00 0.00 72.50 69.01 1mpz s THR 18 CO 0.01 -0.11 0.18 0.00 -0.69 0.00 0.00 174.62 174.01 1mpz s TRP 20 N -3.07 -0.15 0.00 0.00 -0.11 -1.25 -4.89 118.94 109.47 1mpz s TRP 20 Ca 0.05 0.03 0.00 0.00 1.22 0.00 0.00 56.10 57.40 1mpz s TRP 20 Cb -0.03 0.03 0.00 0.00 -1.50 0.00 0.00 33.47 31.97 1mpz s TRP 20 CO 0.27 -0.10 0.00 1.63 -4.62 0.00 0.00 176.95 174.13 1mpz n LYS 21 N 3.84 0.00 -0.51 5.86 4.76 -1.26 -4.20 118.16 126.64 1mpz n LYS 21 Ca 0.06 0.00 0.07 0.00 -2.87 0.00 0.00 58.31 55.57 1mpz n LYS 21 Cb 0.63 0.00 -0.02 0.00 -1.84 0.00 0.00 35.03 33.81 1mpz n LYS 21 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1mpz n THR 22 N 0.00 0.00 -0.87 -0.18 -2.24 -1.26 -4.78 114.28 104.95 1mpz n THR 22 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1mpz n THR 22 Cb 0.00 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.06 1mpz n THR 22 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1mpz n SER 23 N -3.98 -1.63 0.00 3.42 2.88 -1.26 -4.38 113.62 108.67 1mpz n SER 23 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1mpz n SER 23 Cb 0.23 -1.32 0.00 0.00 -0.75 0.00 0.00 64.21 62.38 1mpz n SER 23 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1mpz n LEU 24 N 0.00 0.00 0.00 2.46 7.94 -1.26 -5.03 117.00 121.11 1mpz n LEU 24 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1mpz n LEU 24 Cb 0.08 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.03 1mpz n LEU 24 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.39 176.69 1mpz n THR 25 N -1.26 0.00 -0.06 1.96 -1.04 -1.26 -5.12 114.28 107.50 1mpz n THR 25 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1mpz n THR 25 Cb 0.00 -0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 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 -2.06 -0.08 -0.11 8.00 7.64 -1.26 -4.37 113.62 121.37 1mpz n SER 26 Ca 0.00 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.66 1mpz n SER 26 Cb 0.00 -0.04 -0.09 0.00 -1.01 0.00 0.00 64.21 63.07 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 0.54 -3.40 1.43 8.25 -1.26 -3.21 115.22 117.57 1mpz n HIS 27 Ca 0.00 0.23 -0.01 0.00 -0.26 0.00 0.00 57.72 57.68 1mpz n HIS 27 Cb 0.00 -0.99 0.00 0.00 1.12 0.00 0.00 29.99 30.13 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 -4.38 -0.04 0.00 4.41 4.02 -1.09 -3.93 117.16 116.14 1mpz n TYR 28 Ca -0.37 0.01 0.00 0.00 -0.01 0.00 0.00 57.90 57.52 1mpz n TYR 28 Cb 0.71 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.95 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 0.06 0.00 -1.97 0.00 -1.04 -1.26 -0.73 114.28 109.33 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 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 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 0.00 -4.23 5.00 3.41 0.00 -1.26 -4.26 105.19 103.84 1mpz n GLY 31 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 1.65 0.00 -3.50 1.61 4.01 -1.26 -4.59 118.16 116.08 1mpz n LYS 32 Ca 0.00 0.00 -0.42 0.00 -0.51 0.00 0.00 58.31 57.38 1mpz n LYS 32 Cb 0.00 0.00 -0.05 0.00 -0.51 0.00 0.00 35.03 34.47 1mpz n LYS 32 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1mpz s SER 33 N 0.00 6.28 0.00 4.39 0.15 -1.26 -4.71 113.70 118.55 1mpz s SER 33 Ca 0.00 -3.08 0.00 0.00 0.70 0.00 0.00 55.95 53.57 1mpz s SER 33 Cb 0.00 -2.05 0.00 0.00 -1.71 0.00 0.00 66.02 62.26 1mpz s SER 33 CO 0.00 -0.39 0.00 0.00 1.20 0.00 0.00 173.24 174.05 1mpz n ASP 35 N -0.57 0.00 -3.56 0.00 5.75 -1.26 -4.85 116.55 112.06 1mpz n ASP 35 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 54.79 54.70 1mpz n ASP 35 Cb 0.00 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.05 1mpz n ASP 35 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1mpz s PRO 37 N -1.85 4.59 -0.60 0.00 0.04 -1.22 -4.38 135.00 131.59 1mpz s PRO 37 Ca 0.02 1.75 0.02 0.00 0.04 0.00 0.00 61.00 62.84 1mpz s PRO 37 Cb -0.01 -3.25 0.40 0.00 0.04 0.00 0.00 34.50 31.68 1mpz s PRO 37 CO -0.03 0.09 1.51 1.28 0.04 0.00 0.00 177.00 179.89 1mpz n LEU 38 N 2.11 5.93 0.00 -3.56 4.77 -1.25 -4.04 117.00 120.96 1mpz n LEU 38 Ca 0.02 -5.00 0.00 0.00 -0.03 0.00 0.00 56.01 51.00 1mpz n LEU 38 Cb 0.46 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 1mpz n LEU 38 CO 0.54 2.01 0.00 0.00 -1.33 0.00 0.00 177.39 178.61 1mpz n TYR 39 N -0.54 0.00 -1.54 -1.77 9.36 -1.20 -3.33 117.16 118.14 1mpz n TYR 39 Ca 0.46 0.00 -0.29 0.00 3.32 0.00 0.00 57.90 61.39 1mpz n TYR 39 Cb 0.52 0.00 0.12 0.00 -0.63 0.00 0.00 39.34 39.35 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 -2.00 1.37 0.00 2.98 0.04 -1.26 -4.53 135.00 131.60 1mpz s PRO 40 Ca 0.00 0.37 0.00 0.00 0.04 0.00 0.00 61.00 61.41 1mpz s PRO 40 Cb 0.00 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.68 1mpz s PRO 40 CO 0.00 -2.05 0.00 0.41 0.04 0.00 0.00 177.00 175.40