#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pmx n PRO 2 N 0.00 2.05 -3.30 1.61 -0.04 -1.26 -4.78 135.00 129.29 1pmx n PRO 2 Ca 0.00 -1.90 -0.47 0.00 -0.04 0.00 0.00 63.50 61.10 1pmx n PRO 2 Cb 0.00 -1.83 -0.03 0.00 -0.04 0.00 0.00 33.50 31.60 1pmx n PRO 2 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1pmx s GLU 3 N -1.84 3.44 0.49 0.54 8.01 -1.26 -5.03 118.70 123.06 1pmx s GLU 3 Ca 0.42 -2.21 0.03 0.00 0.01 0.00 0.00 54.97 53.22 1pmx s GLU 3 Cb 0.30 -4.42 -0.02 0.00 -4.31 0.00 0.00 34.13 25.68 1pmx s GLU 3 CO -0.08 -1.33 0.07 0.95 0.01 0.00 0.00 175.26 174.88 1pmx s THR 4 N 0.71 1.47 -0.16 3.63 -4.23 -1.26 -4.25 115.64 111.55 1pmx s THR 4 Ca 0.15 -1.91 -0.01 0.00 -1.18 0.00 0.00 61.69 58.74 1pmx s THR 4 Cb -0.15 -2.38 0.04 0.00 1.34 0.00 0.00 72.50 71.35 1pmx s THR 4 CO -0.06 0.00 -0.03 -0.22 -0.54 0.00 0.00 174.62 173.78 1pmx s LEU 5 N -3.90 1.43 0.05 4.79 2.96 -1.21 -5.01 118.68 117.79 1pmx s LEU 5 Ca 0.18 -0.65 -0.01 0.00 -0.22 0.00 0.00 54.13 53.42 1pmx s LEU 5 Cb 0.03 -0.79 -0.03 0.00 0.50 0.00 0.00 46.19 45.89 1pmx s LEU 5 CO 0.10 -0.22 -0.02 0.00 -1.32 0.00 0.00 176.35 174.90 1pmx n GLY 7 N 0.29 0.95 0.31 0.00 0.00 -1.26 -3.10 105.19 102.39 1pmx n GLY 7 Ca -0.15 -0.76 0.13 0.00 0.00 0.00 0.00 46.02 45.24 1pmx n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pmx h ALA 8 N -0.51 2.19 -0.76 4.61 0.00 -1.99 -1.24 119.26 121.56 1pmx h ALA 8 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pmx h ALA 8 Cb 0.00 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1pmx h ALA 8 CO 0.00 -0.25 0.49 0.93 0.00 0.00 0.00 179.25 180.42 1pmx h GLU 9 N 0.04 1.01 -0.04 0.00 5.08 -1.94 0.82 114.58 119.55 1pmx h GLU 9 Ca 0.12 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 1pmx h GLU 9 Cb 0.42 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1pmx h GLU 9 CO -0.01 0.68 -0.16 1.25 -1.00 0.00 0.00 179.01 179.78 1pmx h LEU 10 N 1.04 0.20 -1.11 1.33 5.85 -1.32 -2.66 115.31 118.64 1pmx h LEU 10 Ca 0.28 -0.65 -0.09 0.00 0.84 0.00 0.00 57.88 58.26 1pmx h LEU 10 Cb -0.10 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 1pmx h LEU 10 CO -0.06 0.82 -0.39 0.58 -0.34 0.00 0.00 178.44 179.05 1pmx h VAL 11 N -0.41 1.29 -0.26 1.05 2.07 -1.24 -2.77 116.25 115.99 1pmx h VAL 11 Ca -0.01 -1.41 -0.05 0.00 0.82 0.00 0.00 66.70 66.06 1pmx h VAL 11 Cb 0.81 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 1pmx h VAL 11 CO 0.03 0.41 -0.02 0.44 0.02 0.00 0.00 177.57 178.45 1pmx h ASP 12 N 0.09 0.46 -0.11 0.57 5.19 0.64 -1.73 116.42 121.53 1pmx h ASP 12 Ca 0.01 -0.33 -0.00 0.00 -0.62 0.00 0.00 57.03 56.08 1pmx h ASP 12 Cb 0.73 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 40.11 1pmx h ASP 12 CO 0.05 0.68 0.06 0.00 -3.12 0.00 0.00 179.24 176.92 1pmx h ALA 13 N 0.80 0.14 -0.55 3.45 0.00 -1.37 -0.33 119.26 121.39 1pmx h ALA 13 Ca 0.07 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1pmx h ALA 13 Cb 0.46 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1pmx h ALA 13 CO 0.02 -0.32 0.35 -0.07 0.00 0.00 0.00 179.25 179.23 1pmx h LEU 14 N 0.09 0.60 -1.28 0.00 3.38 -1.50 0.20 115.31 116.79 1pmx h LEU 14 Ca 0.04 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1pmx h LEU 14 Cb 0.07 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1pmx h LEU 14 CO -0.01 0.43 -0.19 1.56 0.09 0.00 0.00 178.44 180.32 1pmx h GLN 15 N 0.71 0.25 0.02 1.13 1.08 -1.15 0.71 115.11 117.86 1pmx h GLN 15 Ca 0.21 -0.07 -0.22 0.00 -1.45 0.00 0.00 58.65 57.12 1pmx h GLN 15 Cb -0.04 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 27.36 1pmx h GLN 15 CO -0.06 0.44 -0.96 0.35 -0.95 0.00 0.00 178.83 177.65 1pmx h PHE 16 N 0.24 0.47 0.00 2.96 3.57 -0.28 -2.44 116.94 121.46 1pmx h PHE 16 Ca 0.04 -0.27 0.00 0.00 3.53 0.00 0.00 57.97 61.28 1pmx h PHE 16 Cb 0.47 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.17 1pmx h PHE 16 CO 0.01 1.10 -0.16 0.28 -2.23 0.00 0.00 178.31 177.31 1pmx h VAL 17 N 0.16 0.00 0.02 1.41 2.07 -0.29 -3.43 116.25 116.19 1pmx h VAL 17 Ca -0.07 -0.38 -0.00 0.00 0.82 0.00 0.00 66.70 67.07 1pmx h VAL 17 Cb 1.60 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.37 1pmx h VAL 17 CO 0.16 0.00 -0.01 0.00 0.02 0.00 0.00 177.57 177.74 1pmx n GLY 19 N 1.27 3.98 0.30 0.00 0.00 -0.14 -1.34 105.19 109.27 1pmx n GLY 19 Ca -0.09 0.15 0.17 0.00 0.00 0.00 0.00 46.02 46.26 1pmx n GLY 19 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1pmx h ASP 20 N 0.00 0.00 -0.29 1.61 5.19 -1.92 -2.65 116.42 118.36 1pmx h ASP 20 Ca 0.00 0.00 0.08 0.00 -0.62 0.00 0.00 57.03 56.49 1pmx h ASP 20 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 1pmx h ASP 20 CO 0.00 0.03 0.32 0.03 -3.12 0.00 0.00 179.24 176.50 1pmx h ARG 21 N 0.00 0.00 -2.23 3.56 3.08 -1.52 -3.45 114.38 113.82 1pmx h ARG 21 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1pmx h ARG 21 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1pmx h ARG 21 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 1pmx n GLY 22 N -1.44 -1.34 3.74 0.04 0.00 -1.00 -3.79 105.19 101.40 1pmx n GLY 22 Ca 0.04 -0.32 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 1pmx n GLY 22 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1pmx s PHE 23 N -0.33 3.82 0.11 1.61 -0.12 -1.26 -3.84 117.98 117.96 1pmx s PHE 23 Ca 0.00 1.72 0.04 0.00 -0.05 0.00 0.00 56.93 58.64 1pmx s PHE 23 Cb 0.00 -2.97 -0.04 0.00 -0.63 0.00 0.00 43.02 39.38 1pmx s PHE 23 CO 0.00 0.27 0.09 1.52 -0.05 0.00 0.00 175.22 177.05 1pmx s TYR 24 N -0.20 3.16 -0.15 3.49 -0.85 -1.14 -5.02 117.35 116.63 1pmx s TYR 24 Ca 0.44 0.04 -0.03 0.00 -0.52 0.00 0.00 57.07 57.00 1pmx s TYR 24 Cb -0.23 -1.58 -0.24 0.00 0.38 0.00 0.00 41.96 40.30 1pmx s TYR 24 CO 0.28 0.52 0.22 1.19 -1.52 0.00 0.00 175.55 176.24 1pmx n PHE 25 N 0.20 0.89 -3.52 -3.49 3.01 -1.26 -4.82 117.46 108.47 1pmx n PHE 25 Ca -0.09 0.20 -0.38 0.00 1.01 0.00 0.00 57.45 58.19 1pmx n PHE 25 Cb 0.53 -1.12 -0.09 0.00 -0.01 0.00 0.00 39.48 38.79 1pmx n PHE 25 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 1pmx s ASN 26 N -6.82 6.23 0.13 4.37 3.84 -1.26 -2.96 114.94 118.47 1pmx s ASN 26 Ca -0.25 0.25 -0.03 0.00 0.21 0.00 0.00 52.86 53.05 1pmx s ASN 26 Cb 0.07 -2.16 -0.05 0.00 -0.55 0.00 0.00 41.25 38.56 1pmx s ASN 26 CO 0.73 -0.04 0.34 -0.54 -2.79 0.00 0.00 177.10 174.80 1pmx s LYS 27 N 1.39 3.56 0.01 0.43 -0.14 -1.26 -5.05 119.74 118.68 1pmx s LYS 27 Ca 0.12 -0.20 -0.22 0.00 -1.36 0.00 0.00 55.97 54.32 1pmx s LYS 27 Cb -0.15 -2.89 -0.12 0.00 -1.68 0.00 0.00 37.83 32.99 1pmx s LYS 27 CO 0.07 0.49 1.01 -1.00 -0.76 0.00 0.00 175.35 175.16 1pmx h PRO 28 N 2.80 -0.76 0.00 -1.68 0.13 -1.98 -3.49 132.00 127.03 1pmx h PRO 28 Ca -0.46 0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1pmx h PRO 28 Cb 1.17 0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.47 1pmx h PRO 28 CO 0.73 -0.50 0.00 -2.37 -0.23 0.00 0.00 178.00 175.63 1pmx n THR 29 N -4.85 0.00 0.00 1.56 5.66 -1.26 -5.12 114.28 110.27 1pmx n THR 29 Ca -0.10 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.90 1pmx n THR 29 Cb 0.31 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.09 1pmx n THR 29 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1pmx n GLY 30 N -1.02 -1.35 2.03 1.09 0.00 -1.26 -5.01 105.19 99.66 1pmx n GLY 30 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.53 1pmx n GLY 30 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1pmx n TYR 31 N 0.00 -1.74 -4.11 1.61 4.01 -1.26 -5.13 117.16 110.55 1pmx n TYR 31 Ca 0.00 0.27 -0.17 0.00 -0.16 0.00 0.00 57.90 57.84 1pmx n TYR 31 Cb 0.00 0.94 -0.15 0.00 -0.31 0.00 0.00 39.34 39.82 1pmx n TYR 31 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1pmx s GLY 32 N -3.71 0.28 0.43 2.72 0.00 -1.26 -5.16 107.32 100.62 1pmx s GLY 32 Ca 0.00 -0.10 0.08 0.00 0.00 0.00 0.00 44.72 44.70 1pmx s GLY 32 CO 0.00 0.09 0.51 -0.56 0.00 0.00 0.00 173.10 173.14 1pmx s SER 33 N 0.30 5.36 0.00 1.64 0.01 -1.26 -5.05 113.70 114.70 1pmx s SER 33 Ca -0.03 -0.60 0.00 0.00 1.31 0.00 0.00 55.95 56.63 1pmx s SER 33 Cb -0.07 -0.53 0.00 0.00 0.21 0.00 0.00 66.02 65.63 1pmx s SER 33 CO -0.00 -0.77 0.00 -1.54 0.41 0.00 0.00 173.24 171.34 1pmx n SER 34 N -1.76 0.00 -1.37 2.44 3.41 -1.26 -5.04 113.62 110.04 1pmx n SER 34 Ca 0.07 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.65 1pmx n SER 34 Cb 0.60 0.35 0.01 0.00 -0.26 0.00 0.00 64.21 64.92 1pmx n SER 34 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1pmx n SER 35 N -2.40 -0.60 -4.96 4.04 2.88 -1.26 -5.16 113.62 106.16 1pmx n SER 35 Ca 0.00 -1.27 -0.19 0.00 -1.33 0.00 0.00 58.87 56.08 1pmx n SER 35 Cb 0.00 0.24 -0.00 0.00 -0.75 0.00 0.00 64.21 63.70 1pmx n SER 35 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1pmx s ARG 36 N 0.03 2.69 0.43 -1.46 0.52 -1.26 -5.10 118.95 114.80 1pmx s ARG 36 Ca 0.02 -1.37 -0.22 0.00 -0.52 0.00 0.00 55.73 53.64 1pmx s ARG 36 Cb 0.10 -2.61 -0.10 0.00 0.52 0.00 0.00 34.95 32.86 1pmx s ARG 36 CO -0.03 -0.28 0.98 0.50 0.02 0.00 0.00 175.30 176.49 1pmx s ARG 37 N -4.29 4.16 -0.46 3.54 3.52 -1.26 -5.04 118.95 119.12 1pmx s ARG 37 Ca 0.53 1.24 0.05 0.00 -0.13 0.00 0.00 55.73 57.42 1pmx s ARG 37 Cb -0.07 -2.26 0.19 0.00 -1.56 0.00 0.00 34.95 31.24 1pmx s ARG 37 CO 0.31 -0.11 0.76 0.00 -0.81 0.00 0.00 175.30 175.46 1pmx s ALA 38 N -2.01 -2.60 1.00 6.12 0.00 -1.26 -5.17 121.76 117.84 1pmx s ALA 38 Ca 0.62 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 52.56 1pmx s ALA 38 Cb -0.13 -2.77 0.00 0.00 0.00 0.00 0.00 23.12 20.21 1pmx s ALA 38 CO 0.17 -2.28 0.00 -0.35 0.00 0.00 0.00 175.76 173.30 1pmx n PRO 39 N 3.38 0.09 -3.33 0.00 -0.04 -1.26 -5.01 135.00 128.82 1pmx n PRO 39 Ca 0.14 0.00 -0.46 0.00 -0.04 0.00 0.00 63.50 63.15 1pmx n PRO 39 Cb 0.58 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.99 1pmx n PRO 39 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1pmx s GLN 40 N -2.54 3.01 -0.13 0.54 -2.07 -1.26 -5.02 119.66 112.20 1pmx s GLN 40 Ca 0.00 -1.80 -0.10 0.00 -1.82 0.00 0.00 55.36 51.65 1pmx s GLN 40 Cb 0.00 -4.28 0.04 0.00 -1.09 0.00 0.00 33.01 27.68 1pmx s GLN 40 CO 0.00 -1.31 0.32 0.95 -1.32 0.00 0.00 175.29 173.93 1pmx s THR 41 N 1.42 -0.01 0.00 3.63 -4.23 -1.26 -5.08 115.64 110.11 1pmx s THR 41 Ca 0.05 0.05 0.00 0.00 -1.18 0.00 0.00 61.69 60.60 1pmx s THR 41 Cb -0.28 -0.47 0.00 0.00 1.34 0.00 0.00 72.50 73.10 1pmx s THR 41 CO 0.01 0.02 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 1pmx n GLY 42 N 3.42 4.17 0.16 3.99 0.00 -1.26 -4.67 105.19 111.00 1pmx n GLY 42 Ca -0.17 -1.65 -0.23 0.00 0.00 0.00 0.00 46.02 43.97 1pmx n GLY 42 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1pmx h ILE 43 N 0.00 1.29 0.70 -0.61 6.09 -1.88 -2.81 117.51 120.29 1pmx h ILE 43 Ca 0.00 -2.55 -0.03 0.00 -1.37 0.00 0.00 64.86 60.91 1pmx h ILE 43 Cb 0.00 2.87 -0.01 0.00 0.47 0.00 0.00 36.82 40.15 1pmx h ILE 43 CO 0.00 0.77 -0.46 0.58 -3.07 0.00 0.00 178.15 175.97 1pmx h VAL 44 N 0.19 0.08 0.00 2.19 2.07 -1.94 0.68 116.25 119.51 1pmx h VAL 44 Ca -0.21 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 1pmx h VAL 44 Cb 2.00 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 31.84 1pmx h VAL 44 CO 0.25 0.00 -0.14 0.44 0.02 0.00 0.00 177.57 178.14 1pmx h ASP 45 N -1.10 0.00 0.90 0.57 5.19 -1.95 0.87 116.42 120.90 1pmx h ASP 45 Ca -0.09 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.27 1pmx h ASP 45 Cb 0.90 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.40 1pmx h ASP 45 CO 0.07 0.14 -1.13 1.21 -3.12 0.00 0.00 179.24 176.41 1pmx n GLU 46 N -3.50 0.61 0.00 3.56 4.07 -1.04 -3.75 120.64 120.59 1pmx n GLU 46 Ca -0.01 0.15 0.00 0.00 -0.06 0.00 0.00 57.16 57.24 1pmx n GLU 46 Cb 0.29 -1.82 0.00 0.00 -0.06 0.00 0.00 31.44 29.85 1pmx n GLU 46 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1pmx h PHE 49 N 0.23 0.89 -4.05 0.00 -1.00 -1.15 -3.44 116.94 108.43 1pmx h PHE 49 Ca 0.03 -0.39 -0.17 0.00 2.81 0.00 0.00 57.97 60.26 1pmx h PHE 49 Cb 0.80 -0.14 -0.19 0.00 3.61 0.00 0.00 35.95 40.03 1pmx h PHE 49 CO 0.08 1.19 -0.70 -0.98 -1.61 0.00 0.00 178.31 176.29 1pmx s ARG 50 N -3.75 0.46 0.74 1.51 1.70 -1.22 -5.05 118.95 113.35 1pmx s ARG 50 Ca -0.09 -0.87 -0.15 0.00 -0.47 0.00 0.00 55.73 54.15 1pmx s ARG 50 Cb 0.09 0.08 0.03 0.00 -0.57 0.00 0.00 34.95 34.59 1pmx s ARG 50 CO 0.88 -0.06 1.16 -1.13 -1.08 0.00 0.00 175.30 175.07 1pmx n SER 51 N 0.99 1.17 -1.53 -2.89 3.41 -1.26 -2.96 113.62 110.55 1pmx n SER 51 Ca -0.20 0.68 -0.04 0.00 -0.26 0.00 0.00 58.87 59.06 1pmx n SER 51 Cb 0.57 -1.49 -0.00 0.00 -0.26 0.00 0.00 64.21 63.03 1pmx n SER 51 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pmx s ASP 53 N -1.58 4.54 0.59 0.00 -4.77 -1.26 -4.99 116.67 109.20 1pmx s ASP 53 Ca 0.07 -0.19 0.29 0.00 -3.30 0.00 0.00 52.55 49.42 1pmx s ASP 53 Cb -0.00 -1.72 1.63 0.00 -1.09 0.00 0.00 42.92 41.73 1pmx s ASP 53 CO 0.05 0.17 2.05 -0.07 0.70 0.00 0.00 175.17 178.07 1pmx h LEU 54 N 6.68 0.00 -2.21 2.11 3.38 -2.01 -0.84 115.31 122.41 1pmx h LEU 54 Ca -0.29 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.71 1pmx h LEU 54 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1pmx h LEU 54 CO 0.60 0.00 0.12 -0.09 0.09 0.00 0.00 178.44 179.16 1pmx h ARG 55 N 0.00 0.00 0.00 1.13 2.43 -2.04 -0.72 114.38 115.18 1pmx h ARG 55 Ca 0.11 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.25 1pmx h ARG 55 Cb 0.65 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1pmx h ARG 55 CO -0.00 0.00 -0.13 0.00 -1.51 0.00 0.00 179.97 178.33 1pmx h ARG 56 N 0.00 0.00 -0.35 0.20 2.47 -1.57 -2.44 114.38 112.69 1pmx h ARG 56 Ca 0.06 0.00 0.10 0.00 -1.26 0.00 0.00 59.98 58.88 1pmx h ARG 56 Cb 0.29 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.60 1pmx h ARG 56 CO -0.00 0.13 0.29 -0.07 0.56 0.00 0.00 179.97 180.88 1pmx h LEU 57 N 0.00 0.00 -1.02 3.04 3.38 -1.31 0.00 115.31 119.40 1pmx h LEU 57 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1pmx h LEU 57 Cb 0.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1pmx h LEU 57 CO 0.02 0.00 -0.45 -0.33 0.09 0.00 0.00 178.44 177.76 1pmx h GLU 58 N 0.00 0.00 0.14 1.13 5.08 -1.61 -3.23 114.58 116.09 1pmx h GLU 58 Ca 0.17 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 1pmx h GLU 58 Cb 0.75 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1pmx h GLU 58 CO -0.00 0.45 -0.07 0.52 -1.00 0.00 0.00 179.01 178.92 1pmx h MET 59 N 0.00 -0.18 -0.16 2.33 2.86 -1.14 -2.95 114.93 115.69 1pmx h MET 59 Ca -0.00 0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.69 1pmx h MET 59 Cb 0.87 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.56 1pmx h MET 59 CO 0.06 0.13 0.32 1.88 1.06 0.00 0.00 176.91 180.36 1pmx h TYR 60 N -0.49 0.00 -3.99 -0.22 0.05 -1.57 -3.42 116.97 107.32 1pmx h TYR 60 Ca -0.02 0.00 -0.52 0.00 0.05 0.00 0.00 58.73 58.24 1pmx h TYR 60 Cb 0.39 0.00 0.08 0.00 1.01 0.00 0.00 36.73 38.21 1pmx h TYR 60 CO 0.02 0.00 0.52 0.00 -1.05 0.00 0.00 178.16 177.66 1pmx s ALA 62 N -1.45 2.40 0.15 0.00 0.00 -1.25 -5.00 121.76 116.61 1pmx s ALA 62 Ca 0.63 -1.02 0.06 0.00 0.00 0.00 0.00 51.96 51.63 1pmx s ALA 62 Cb -0.32 -2.83 -0.07 0.00 0.00 0.00 0.00 23.12 19.90 1pmx s ALA 62 CO 0.39 -2.16 1.35 -1.00 0.00 0.00 0.00 175.76 174.34 1pmx h PRO 63 N -1.43 0.05 -6.97 0.00 0.13 -1.95 -3.46 132.00 118.37 1pmx h PRO 63 Ca -0.45 -0.07 -0.38 0.00 -0.87 0.00 0.00 66.00 64.23 1pmx h PRO 63 Cb 1.27 0.02 0.22 0.00 0.13 0.00 0.00 31.00 32.64 1pmx h PRO 63 CO 0.48 0.93 -0.16 1.47 -0.23 0.00 0.00 178.00 180.49 1pmx n LEU 64 N -3.51 -0.45 -4.31 1.56 -0.00 -1.26 -5.07 117.00 103.96 1pmx n LEU 64 Ca -0.01 -0.81 -0.16 0.00 -0.00 0.00 0.00 56.01 55.02 1pmx n LEU 64 Cb 0.86 -1.04 -0.10 0.00 -0.00 0.00 0.00 43.42 43.14 1pmx n LEU 64 CO 0.47 -4.53 -0.36 -0.54 -0.00 0.00 0.00 177.39 172.43 1pmx s LYS 65 N -5.02 1.26 0.31 1.47 1.02 -1.26 -4.79 119.74 112.72 1pmx s LYS 65 Ca 0.68 -1.61 -0.29 0.00 0.02 0.00 0.00 55.97 54.77 1pmx s LYS 65 Cb -0.14 -0.64 -0.10 0.00 -0.52 0.00 0.00 37.83 36.43 1pmx s LYS 65 CO 0.58 -0.03 1.41 -1.25 -0.92 0.00 0.00 175.35 175.13 1pmx s PRO 66 N -3.82 4.26 -0.30 -1.68 0.04 -1.26 -4.79 135.00 127.46 1pmx s PRO 66 Ca 0.25 2.33 -0.15 0.00 0.04 0.00 0.00 61.00 63.47 1pmx s PRO 66 Cb 0.04 -3.06 0.17 0.00 0.04 0.00 0.00 34.50 31.69 1pmx s PRO 66 CO 0.06 -0.36 1.01 0.00 0.04 0.00 0.00 177.00 177.75 1pmx s ALA 67 N -0.64 -2.82 -0.24 8.56 0.00 -1.26 -5.10 121.76 120.26 1pmx s ALA 67 Ca 0.54 1.97 -0.29 0.00 0.00 0.00 0.00 51.96 54.18 1pmx s ALA 67 Cb -0.42 -2.12 0.00 0.00 0.00 0.00 0.00 23.12 20.58 1pmx s ALA 67 CO 0.51 -1.01 1.19 0.21 0.00 0.00 0.00 175.76 176.66 1pmx s LYS 68 N 2.47 4.13 -0.25 0.00 2.20 -1.26 -4.90 119.74 122.12 1pmx s LYS 68 Ca -0.02 1.38 -0.17 0.00 -0.36 0.00 0.00 55.97 56.81 1pmx s LYS 68 Cb -0.06 -3.76 -0.14 0.00 -1.51 0.00 0.00 37.83 32.35 1pmx s LYS 68 CO -0.17 -0.83 -0.15 0.43 -0.36 0.00 0.00 175.35 174.27 1pmx n SER 69 N 6.86 1.92 -0.31 1.43 7.64 -1.26 -5.33 113.62 124.56 1pmx n SER 69 Ca 0.13 0.37 0.15 0.00 1.01 0.00 0.00 58.87 60.54 1pmx n SER 69 Cb 0.46 -0.87 0.67 0.00 -1.01 0.00 0.00 64.21 63.46 1pmx n SER 69 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03