#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 -4.08 114.28 114.60 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 0.14 0.00 0.00 -1.55 0.00 0.00 70.33 68.92 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 -5.02 114.28 108.06 1mpz n THR 3 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 1mpz n THR 3 Cb 0.37 -0.09 0.00 0.00 -1.82 0.00 0.00 70.33 68.79 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 3.57 2.65 0.10 3.41 0.00 0.25 -4.92 105.19 110.25 1mpz n GLY 4 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.19 -4.81 135.00 131.33 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 -1.08 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 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 6.97 0.00 -2.98 0.00 3.00 -1.26 -4.17 116.66 118.22 1mpz n ARG 8 Ca 0.43 0.00 -0.12 0.00 -0.00 0.00 0.00 57.85 58.16 1mpz n ARG 8 Cb 0.37 -0.77 -0.03 0.00 0.00 0.00 0.00 32.46 32.04 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 -2.00 0.45 0.00 -0.14 6.02 0.64 -4.93 117.38 117.41 1mpz n GLN 9 Ca 0.00 -2.43 0.00 0.00 -0.01 0.00 0.00 57.00 54.56 1mpz n GLN 9 Cb 0.00 -1.53 0.00 0.00 1.02 0.00 0.00 30.24 29.73 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 0.00 0.55 0.30 0.00 -0.00 0.26 -4.13 118.16 115.14 1mpz n LYS 11 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 58.31 58.41 1mpz n LYS 11 Cb 0.00 -1.23 0.53 0.00 -0.00 0.00 0.00 35.03 34.33 1mpz n LYS 11 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.40 178.77 1mpz h LEU 12 N 1.72 0.00-10.66 -5.58 8.10 -1.91 -3.38 115.31 103.60 1mpz h LEU 12 Ca 0.00 0.00 -0.43 0.00 0.11 0.00 0.00 57.88 57.56 1mpz h LEU 12 Cb 0.55 0.00 0.19 0.00 -0.44 0.00 0.00 40.66 40.95 1mpz h LEU 12 CO 0.00 0.00 0.29 -1.59 -4.11 0.00 0.00 178.44 173.03 1mpz s LYS 13 N -3.91 -0.45 0.00 0.17 0.00 -1.26 -4.86 119.74 109.43 1mpz s LYS 13 Ca -0.02 -0.36 0.00 0.00 0.00 0.00 0.00 55.97 55.59 1mpz s LYS 13 Cb 0.06 -1.71 0.00 0.00 0.00 0.00 0.00 37.83 36.17 1mpz s LYS 13 CO 0.18 -3.15 1.07 -0.35 0.00 0.00 0.00 175.35 173.10 1mpz n PRO 14 N -4.30 0.75 0.00 1.78 -0.04 -1.26 -4.94 135.00 126.99 1mpz n PRO 14 Ca 0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 1mpz n PRO 14 Cb 0.59 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.93 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 1.06 0.00 0.00 0.55 0.00 -1.26 -4.96 120.51 115.90 1mpz n ALA 15 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1mpz n ALA 15 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.82 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 0.00 -0.99 0.00 0.00 0.00 0.54 -4.68 105.19 100.06 1mpz n GLY 16 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.45 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 -0.55 2.61 -1.04 0.35 -4.84 114.28 110.82 1mpz n THR 17 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1mpz n THR 17 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1mpz n THR 17 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 1mpz n THR 18 N 0.00 0.09 0.00 12.58 5.66 -1.22 -1.41 114.28 129.97 1mpz n THR 18 Ca 0.00 -0.27 0.00 0.00 -3.05 0.00 0.00 64.05 60.73 1mpz n THR 18 Cb 0.00 1.40 0.00 0.00 -1.55 0.00 0.00 70.33 70.18 1mpz n THR 18 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1mpz s TRP 20 N 0.00 3.19 -0.06 0.00 -0.00 -1.09 -4.79 118.94 116.18 1mpz s TRP 20 Ca 0.00 -2.66 -0.27 0.00 -0.00 0.00 0.00 56.10 53.17 1mpz s TRP 20 Cb 0.00 -2.59 -0.03 0.00 -0.00 0.00 0.00 33.47 30.85 1mpz s TRP 20 CO 0.00 -0.93 0.88 -1.59 -0.00 0.00 0.00 176.95 175.31 1mpz s LYS 21 N 1.08 4.46 0.00 5.86 -2.85 -1.26 -0.14 119.74 126.89 1mpz s LYS 21 Ca 0.11 1.19 0.00 0.00 -1.00 0.00 0.00 55.97 56.27 1mpz s LYS 21 Cb -0.19 -3.49 0.00 0.00 -2.06 0.00 0.00 37.83 32.10 1mpz s LYS 21 CO -0.13 -0.10 0.00 -2.37 0.10 0.00 0.00 175.35 172.85 1mpz n THR 22 N 4.10 0.00 -1.42 3.79 5.66 -0.96 -4.73 114.28 120.72 1mpz n THR 22 Ca 0.04 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.89 1mpz n THR 22 Cb 0.50 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.22 1mpz n THR 22 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1mpz n SER 23 N 0.00 -4.99 0.00 1.09 7.64 -1.26 0.27 113.62 116.37 1mpz n SER 23 Ca 0.00 0.37 0.00 0.00 1.01 0.00 0.00 58.87 60.25 1mpz n SER 23 Cb 0.00 -4.16 0.00 0.00 -1.01 0.00 0.00 64.21 59.04 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 -1.81 0.00 0.00 -3.43 7.94 -1.26 -5.06 117.00 113.38 1mpz n LEU 24 Ca -0.15 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.75 1mpz n LEU 24 Cb 0.58 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.53 1mpz n LEU 24 CO 0.23 0.00 0.00 0.41 -1.11 0.00 0.00 177.39 176.92 1mpz n THR 25 N 0.00 0.00 -1.40 1.96 -1.04 0.14 -5.07 114.28 108.87 1mpz n THR 25 Ca 0.00 0.00 -0.48 0.00 -2.04 0.00 0.00 64.05 61.53 1mpz n THR 25 Cb 0.00 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.37 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 0.00 0.50 -2.17 8.00 7.64 -1.26 -2.26 113.62 124.08 1mpz n SER 26 Ca 0.00 0.37 -0.29 0.00 1.01 0.00 0.00 58.87 59.95 1mpz n SER 26 Cb 0.00 -0.92 0.08 0.00 -1.01 0.00 0.00 64.21 62.36 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 9.39 2.96 0.53 1.43 8.25 0.81 -4.71 115.22 133.88 1mpz n HIS 27 Ca 0.61 -2.65 0.00 0.00 -0.26 0.00 0.00 57.72 55.42 1mpz n HIS 27 Cb 0.01 -1.07 0.00 0.00 1.12 0.00 0.00 29.99 30.05 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 -0.89 0.00 -3.83 4.41 4.02 -1.12 -0.49 117.16 119.26 1mpz n TYR 28 Ca 0.56 -0.59 -0.02 0.00 -0.01 0.00 0.00 57.90 57.84 1mpz n TYR 28 Cb 0.84 -0.31 0.01 0.00 -0.02 0.00 0.00 39.34 39.86 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 -0.65 0.00 0.00 0.00 -2.24 -0.50 -0.34 114.28 110.55 1mpz n THR 30 Ca -0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1mpz n THR 30 Cb 0.60 -0.50 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 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 2.47 2.11 3.85 3.38 0.00 -1.26 -4.52 105.19 111.22 1mpz n GLY 31 Ca 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.10 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 0.64 0.00 -3.62 1.61 4.76 -1.26 -4.75 118.16 115.54 1mpz n LYS 32 Ca 0.00 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.06 1mpz n LYS 32 Cb 0.00 0.00 -0.07 0.00 -1.84 0.00 0.00 35.03 33.12 1mpz n LYS 32 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1mpz s SER 33 N 0.00 5.91 0.00 4.39 0.01 -1.26 -4.84 113.70 117.92 1mpz s SER 33 Ca 0.00 -3.39 0.00 0.00 1.31 0.00 0.00 55.95 53.87 1mpz s SER 33 Cb 0.00 -1.93 0.00 0.00 0.21 0.00 0.00 66.02 64.30 1mpz s SER 33 CO 0.00 -0.27 0.00 0.00 0.41 0.00 0.00 173.24 173.38 1mpz n ASP 35 N 0.00 0.00 -3.55 0.00 10.43 -1.25 -4.88 116.55 117.29 1mpz n ASP 35 Ca 0.00 0.00 -0.16 0.00 2.57 0.00 0.00 54.79 57.20 1mpz n ASP 35 Cb 0.00 0.00 -0.06 0.00 1.84 0.00 0.00 41.12 42.90 1mpz n ASP 35 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1mpz s PRO 37 N -0.93 4.64 -0.70 0.00 0.04 -1.26 -4.48 135.00 132.32 1mpz s PRO 37 Ca -0.07 1.76 0.04 0.00 0.04 0.00 0.00 61.00 62.77 1mpz s PRO 37 Cb -0.01 -3.22 0.28 0.00 0.04 0.00 0.00 34.50 31.59 1mpz s PRO 37 CO 0.06 0.18 0.92 1.28 0.04 0.00 0.00 177.00 179.49 1mpz n LEU 38 N 1.61 4.39 -3.65 -3.56 4.32 -1.26 -4.33 117.00 114.52 1mpz n LEU 38 Ca 0.00 -5.47 -0.09 0.00 -0.02 0.00 0.00 56.01 50.43 1mpz n LEU 38 Cb 0.45 -0.74 -0.08 0.00 -1.62 0.00 0.00 43.42 41.44 1mpz n LEU 38 CO 0.54 2.08 0.29 -0.47 -1.22 0.00 0.00 177.39 178.61 1mpz s TYR 39 N -2.81 -0.93 -0.65 -1.77 5.04 -1.26 0.25 117.35 115.23 1mpz s TYR 39 Ca 0.41 1.92 -0.27 0.00 -2.44 0.00 0.00 57.07 56.69 1mpz s TYR 39 Cb 0.17 0.51 0.01 0.00 0.35 0.00 0.00 41.96 42.99 1mpz s TYR 39 CO -0.03 -0.47 1.55 -1.25 -1.34 0.00 0.00 175.55 174.01 1mpz s PRO 40 N 1.41 2.99 0.00 4.97 0.04 -1.26 -4.88 135.00 138.26 1mpz s PRO 40 Ca -0.08 0.26 0.12 0.00 0.04 0.00 0.00 61.00 61.33 1mpz s PRO 40 Cb -0.06 -4.25 0.69 0.00 0.04 0.00 0.00 34.50 30.92 1mpz s PRO 40 CO -0.16 -2.34 1.13 0.41 0.04 0.00 0.00 177.00 176.08