#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 -0.50 -2.88 1.61 -0.04 -1.26 -4.96 135.00 126.96 1pmx n PRO 2 Ca 0.00 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.03 1pmx n PRO 2 Cb 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.41 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 -2.64 3.40 0.39 0.54 8.01 -1.26 -5.01 118.70 122.12 1pmx s GLU 3 Ca 0.00 -0.13 0.04 0.00 0.01 0.00 0.00 54.97 54.89 1pmx s GLU 3 Cb 0.00 -3.99 -0.03 0.00 -4.31 0.00 0.00 34.13 25.80 1pmx s GLU 3 CO 0.00 -1.30 0.12 0.95 0.01 0.00 0.00 175.26 175.04 1pmx s THR 4 N 3.65 0.69 -0.12 3.63 -4.23 -1.26 -4.40 115.64 113.60 1pmx s THR 4 Ca 0.31 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.80 1pmx s THR 4 Cb -0.12 -2.44 0.04 0.00 1.34 0.00 0.00 72.50 71.33 1pmx s THR 4 CO 0.22 0.00 0.03 -0.22 -0.54 0.00 0.00 174.62 174.11 1pmx s LEU 5 N -3.57 0.69 0.05 4.79 2.96 -1.22 -5.02 118.68 117.37 1pmx s LEU 5 Ca 0.27 -0.37 -0.01 0.00 -0.22 0.00 0.00 54.13 53.79 1pmx s LEU 5 Cb 0.04 -0.43 -0.04 0.00 0.50 0.00 0.00 46.19 46.26 1pmx s LEU 5 CO 0.15 -0.26 -0.02 0.00 -1.32 0.00 0.00 176.35 174.90 1pmx n GLY 7 N 0.14 0.84 0.30 0.00 0.00 -1.26 -3.06 105.19 102.14 1pmx n GLY 7 Ca -0.14 -0.77 0.12 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.53 2.14 -0.78 4.61 0.00 -1.99 -1.28 119.26 121.42 1pmx h ALA 8 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1pmx h ALA 8 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1pmx h ALA 8 CO 0.00 -0.19 0.49 0.93 0.00 0.00 0.00 179.25 180.48 1pmx h GLU 9 N 0.03 1.04 -0.01 0.00 5.08 -1.94 0.63 114.58 119.42 1pmx h GLU 9 Ca 0.09 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1pmx h GLU 9 Cb 0.32 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1pmx h GLU 9 CO -0.00 0.71 -0.02 1.25 -1.00 0.00 0.00 179.01 179.95 1pmx h LEU 10 N 1.07 0.03 -1.33 1.33 5.85 -1.30 -2.59 115.31 118.37 1pmx h LEU 10 Ca 0.28 -0.58 -0.06 0.00 0.84 0.00 0.00 57.88 58.36 1pmx h LEU 10 Cb -0.08 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 1pmx h LEU 10 CO -0.06 0.61 -0.18 0.58 -0.34 0.00 0.00 178.44 179.05 1pmx h VAL 11 N -0.55 1.20 -0.37 1.05 2.07 -1.26 -2.73 116.25 115.66 1pmx h VAL 11 Ca 0.00 -0.90 -0.05 0.00 0.82 0.00 0.00 66.70 66.57 1pmx h VAL 11 Cb 0.60 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 1pmx h VAL 11 CO 0.00 0.28 0.04 0.44 0.02 0.00 0.00 177.57 178.36 1pmx h ASP 12 N 0.21 0.61 -0.19 0.57 5.19 0.27 -1.65 116.42 121.43 1pmx h ASP 12 Ca 0.04 -0.27 -0.00 0.00 -0.62 0.00 0.00 57.03 56.18 1pmx h ASP 12 Cb 0.45 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.79 1pmx h ASP 12 CO 0.03 0.73 0.12 0.00 -3.12 0.00 0.00 179.24 176.99 1pmx h ALA 13 N 0.90 0.24 -0.81 3.45 0.00 -1.21 0.51 119.26 122.34 1pmx h ALA 13 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1pmx h ALA 13 Cb 0.39 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 1pmx h ALA 13 CO 0.01 -0.25 0.52 -0.07 0.00 0.00 0.00 179.25 179.46 1pmx h LEU 14 N 0.23 0.95 -0.60 0.00 3.38 -1.44 0.47 115.31 118.31 1pmx h LEU 14 Ca 0.07 -0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.84 1pmx h LEU 14 Cb 0.02 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1pmx h LEU 14 CO -0.01 0.71 -0.67 1.56 0.09 0.00 0.00 178.44 180.12 1pmx h GLN 15 N 1.11 0.16 0.01 1.13 1.08 -1.01 0.49 115.11 118.08 1pmx h GLN 15 Ca 0.30 -0.13 -0.19 0.00 -1.45 0.00 0.00 58.65 57.18 1pmx h GLN 15 Cb -0.09 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.34 1pmx h GLN 15 CO -0.06 0.77 -0.87 0.35 -0.95 0.00 0.00 178.83 178.07 1pmx h PHE 16 N 0.11 0.09 0.00 2.96 3.57 0.67 -0.89 116.94 123.47 1pmx h PHE 16 Ca -0.01 -0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.36 1pmx h PHE 16 Cb 1.19 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.91 1pmx h PHE 16 CO 0.02 0.90 -0.76 0.28 -2.23 0.00 0.00 178.31 176.51 1pmx n VAL 17 N -3.56 1.45 -0.04 1.41 0.31 0.16 -4.64 118.33 113.42 1pmx n VAL 17 Ca -0.02 0.14 -0.12 0.00 -0.01 0.00 0.00 64.34 64.33 1pmx n VAL 17 Cb 0.82 -2.28 -0.11 0.00 -0.91 0.00 0.00 33.84 31.36 1pmx n VAL 17 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1pmx n GLY 19 N 1.23 2.01 0.38 0.00 0.00 -0.34 -1.97 105.19 106.50 1pmx n GLY 19 Ca -0.09 0.16 0.06 0.00 0.00 0.00 0.00 46.02 46.16 1pmx n GLY 19 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1pmx n ASP 20 N 10.84 1.10 0.07 1.61 2.03 -1.26 -3.88 116.55 127.07 1pmx n ASP 20 Ca 0.00 -1.84 -0.13 0.00 0.52 0.00 0.00 54.79 53.34 1pmx n ASP 20 Cb 0.00 -0.11 -0.13 0.00 -0.72 0.00 0.00 41.12 40.15 1pmx n ASP 20 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 1pmx h ARG 21 N 1.30 0.17 -0.63 -0.67 3.08 -1.72 -3.43 114.38 112.48 1pmx h ARG 21 Ca 0.00 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 59.76 1pmx h ARG 21 Cb 0.29 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1pmx h ARG 21 CO 0.00 1.08 0.00 0.41 -1.07 0.00 0.00 179.97 180.39 1pmx n GLY 22 N 1.51 -0.76 3.79 0.04 0.00 -1.25 -3.85 105.19 104.68 1pmx n GLY 22 Ca -0.09 -0.93 -0.25 0.00 0.00 0.00 0.00 46.02 44.76 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 0.00 3.11 -0.10 1.61 -0.12 -1.26 -1.52 117.98 119.71 1pmx s PHE 23 Ca 0.00 -0.05 0.02 0.00 -0.05 0.00 0.00 56.93 56.85 1pmx s PHE 23 Cb 0.00 -1.47 0.01 0.00 -0.63 0.00 0.00 43.02 40.93 1pmx s PHE 23 CO 0.00 0.52 -0.17 1.52 -0.05 0.00 0.00 175.22 177.04 1pmx s TYR 24 N -1.86 2.02 0.38 3.49 -0.85 -1.25 -5.02 117.35 114.26 1pmx s TYR 24 Ca 0.31 -0.88 0.20 0.00 -0.52 0.00 0.00 57.07 56.18 1pmx s TYR 24 Cb -0.09 -1.42 1.06 0.00 0.38 0.00 0.00 41.96 41.89 1pmx s TYR 24 CO 0.23 -0.42 1.95 0.74 -1.52 0.00 0.00 175.55 176.53 1pmx h PHE 25 N 7.12 0.00 -3.27 -3.49 -1.00 -2.00 -3.43 116.94 110.88 1pmx h PHE 25 Ca -0.28 0.00 -0.57 0.00 2.81 0.00 0.00 57.97 59.93 1pmx h PHE 25 Cb 1.19 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.71 1pmx h PHE 25 CO 0.48 0.23 -0.02 1.21 -1.61 0.00 0.00 178.31 178.60 1pmx s ASN 26 N -6.57 7.06 -0.03 2.17 3.84 -1.26 -3.03 114.94 117.13 1pmx s ASN 26 Ca -0.03 1.26 0.01 0.00 0.21 0.00 0.00 52.86 54.32 1pmx s ASN 26 Cb 0.14 -2.37 0.01 0.00 -0.55 0.00 0.00 41.25 38.48 1pmx s ASN 26 CO 0.66 0.23 -0.05 -0.75 -2.79 0.00 0.00 177.10 174.40 1pmx s LYS 27 N -0.90 0.66 0.69 0.43 2.47 -1.26 -5.00 119.74 116.82 1pmx s LYS 27 Ca 0.30 -0.12 -0.11 0.00 -1.56 0.00 0.00 55.97 54.48 1pmx s LYS 27 Cb -0.19 -0.67 0.00 0.00 -1.46 0.00 0.00 37.83 35.50 1pmx s LYS 27 CO 0.19 -0.01 1.06 -1.25 0.16 0.00 0.00 175.35 175.50 1pmx s PRO 28 N 0.56 3.03 0.00 4.03 0.04 -1.26 -4.91 135.00 136.48 1pmx s PRO 28 Ca -0.07 0.83 0.00 0.00 0.04 0.00 0.00 61.00 61.80 1pmx s PRO 28 Cb -0.10 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.43 1pmx s PRO 28 CO -0.00 -1.00 0.00 -2.37 0.04 0.00 0.00 177.00 173.67 1pmx n THR 29 N -3.05 0.00 0.00 1.26 5.66 -1.26 -5.06 114.28 111.84 1pmx n THR 29 Ca 0.07 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.07 1pmx n THR 29 Cb 0.54 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.32 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 -1.08 0.00 0.11 1.09 0.00 -1.26 -4.93 105.19 99.12 1pmx n GLY 30 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1pmx n GLY 30 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1pmx h TYR 31 N 0.00 0.37 -0.08 1.61 0.05 -2.00 -3.50 116.97 113.41 1pmx h TYR 31 Ca 0.00 -0.27 0.00 0.00 0.05 0.00 0.00 58.73 58.51 1pmx h TYR 31 Cb 0.00 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 37.73 1pmx h TYR 31 CO 0.00 1.34 0.00 0.41 -1.05 0.00 0.00 178.16 178.86 1pmx n GLY 32 N 1.66 0.77 3.50 3.88 0.00 -1.26 -5.00 105.19 108.73 1pmx n GLY 32 Ca -0.17 -1.05 -0.43 0.00 0.00 0.00 0.00 46.02 44.37 1pmx n GLY 32 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1pmx s SER 33 N 0.00 6.31 0.31 1.61 0.15 -1.26 -4.62 113.70 116.20 1pmx s SER 33 Ca 0.00 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.17 1pmx s SER 33 Cb 0.00 -2.36 0.00 0.00 -1.71 0.00 0.00 66.02 61.95 1pmx s SER 33 CO 0.00 -1.00 0.00 -1.54 1.20 0.00 0.00 173.24 171.90 1pmx n SER 34 N 6.75 -2.57 -0.10 5.45 3.41 -1.26 -5.00 113.62 120.31 1pmx n SER 34 Ca -0.01 0.58 -0.19 0.00 -0.26 0.00 0.00 58.87 58.99 1pmx n SER 34 Cb 0.47 2.54 -0.09 0.00 -0.26 0.00 0.00 64.21 66.87 1pmx n SER 34 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1pmx n SER 35 N -3.14 1.85 -4.91 4.04 3.41 -1.26 -4.96 113.62 108.66 1pmx n SER 35 Ca 0.00 0.46 -0.27 0.00 -0.26 0.00 0.00 58.87 58.80 1pmx n SER 35 Cb 0.00 -0.94 -0.00 0.00 -0.26 0.00 0.00 64.21 63.01 1pmx n SER 35 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1pmx s ARG 36 N -2.35 3.54 0.24 4.33 3.52 -1.26 -5.05 118.95 121.92 1pmx s ARG 36 Ca -0.26 0.19 -0.30 0.00 -0.13 0.00 0.00 55.73 55.23 1pmx s ARG 36 Cb 0.06 -2.38 -0.09 0.00 -1.56 0.00 0.00 34.95 30.98 1pmx s ARG 36 CO 0.51 -0.20 1.01 -0.98 -0.81 0.00 0.00 175.30 174.83 1pmx s ARG 37 N -4.72 4.75 0.21 5.12 3.03 -1.26 -4.84 118.95 121.23 1pmx s ARG 37 Ca 0.47 1.61 -0.18 0.00 2.03 0.00 0.00 55.73 59.67 1pmx s ARG 37 Cb -0.10 -3.25 0.03 0.00 -1.03 0.00 0.00 34.95 30.59 1pmx s ARG 37 CO 0.45 0.36 0.55 0.00 -1.13 0.00 0.00 175.30 175.53 1pmx s ALA 38 N -1.03 -0.98 0.98 7.88 0.00 -1.26 -5.07 121.76 122.29 1pmx s ALA 38 Ca 0.43 -0.22 -0.12 0.00 0.00 0.00 0.00 51.96 52.05 1pmx s ALA 38 Cb -0.28 0.87 0.18 0.00 0.00 0.00 0.00 23.12 23.88 1pmx s ALA 38 CO 0.35 -0.83 1.08 -1.25 0.00 0.00 0.00 175.76 175.11 1pmx s PRO 39 N -3.88 0.56 -0.21 0.00 0.04 -1.26 -5.02 135.00 125.23 1pmx s PRO 39 Ca 0.10 0.76 -0.09 0.00 0.04 0.00 0.00 61.00 61.80 1pmx s PRO 39 Cb -0.02 -1.73 -0.05 0.00 0.04 0.00 0.00 34.50 32.74 1pmx s PRO 39 CO -0.02 -2.70 0.12 -1.14 0.04 0.00 0.00 177.00 173.30 1pmx s GLN 40 N -4.84 4.09 -0.30 4.56 2.00 -1.26 -5.04 119.66 118.87 1pmx s GLN 40 Ca 0.65 -0.27 -0.17 0.00 -2.00 0.00 0.00 55.36 53.57 1pmx s GLN 40 Cb -0.20 -3.39 0.20 0.00 0.80 0.00 0.00 33.01 30.42 1pmx s GLN 40 CO 0.59 0.22 1.23 -0.08 -0.50 0.00 0.00 175.29 176.75 1pmx s THR 41 N 0.56 -0.03 0.00 -0.34 -1.32 -1.26 -5.02 115.64 108.23 1pmx s THR 41 Ca 0.07 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.55 1pmx s THR 41 Cb -0.12 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.87 1pmx s THR 41 CO 0.00 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.02 1pmx n GLY 42 N 3.48 0.82 0.23 6.08 0.00 -1.26 -4.44 105.19 110.10 1pmx n GLY 42 Ca -0.15 0.35 -0.14 0.00 0.00 0.00 0.00 46.02 46.08 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 0.76 -0.61 6.09 -1.88 -1.98 117.51 121.18 1pmx h ILE 43 Ca 0.00 -1.84 -0.03 0.00 -1.37 0.00 0.00 64.86 61.62 1pmx h ILE 43 Cb 0.00 1.79 -0.00 0.00 0.47 0.00 0.00 36.82 39.07 1pmx h ILE 43 CO 0.00 0.59 -0.47 0.58 -3.07 0.00 0.00 178.15 175.78 1pmx h VAL 44 N 0.57 0.06 0.00 2.19 2.07 -1.94 0.81 116.25 120.01 1pmx h VAL 44 Ca -0.01 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 1pmx h VAL 44 Cb 1.23 0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1pmx h VAL 44 CO 0.13 0.00 -0.11 0.44 0.02 0.00 0.00 177.57 178.05 1pmx h ASP 45 N -1.15 0.00 0.80 0.57 5.19 -1.94 0.84 116.42 120.72 1pmx h ASP 45 Ca -0.10 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.20 1pmx h ASP 45 Cb 0.93 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.42 1pmx h ASP 45 CO 0.10 0.11 -1.28 1.21 -3.12 0.00 0.00 179.24 176.27 1pmx n GLU 46 N -3.33 0.62 -0.04 3.56 4.07 -0.74 -3.09 120.64 121.68 1pmx n GLU 46 Ca -0.00 0.18 -0.06 0.00 -0.06 0.00 0.00 57.16 57.22 1pmx n GLU 46 Cb 0.31 -1.81 -0.03 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 -0.88 0.29 -3.92 0.00 0.04 -1.51 -3.45 116.94 107.52 1pmx h PHE 49 Ca -0.02 -0.11 -0.35 0.00 2.80 0.00 0.00 57.97 60.30 1pmx h PHE 49 Cb 0.55 -0.05 -0.21 0.00 2.20 0.00 0.00 35.95 38.44 1pmx h PHE 49 CO 0.11 0.77 -0.76 1.03 -0.60 0.00 0.00 178.31 178.86 1pmx s ARG 50 N -3.75 0.72 0.02 1.51 0.52 -1.18 -5.02 118.95 111.77 1pmx s ARG 50 Ca -0.04 -0.92 -0.30 0.00 -0.52 0.00 0.00 55.73 53.95 1pmx s ARG 50 Cb 0.12 -0.58 -0.05 0.00 0.52 0.00 0.00 34.95 34.95 1pmx s ARG 50 CO 0.80 0.12 1.27 -1.54 0.02 0.00 0.00 175.30 175.96 1pmx s SER 51 N -1.79 6.99 0.17 0.23 1.04 -1.26 -2.47 113.70 116.61 1pmx s SER 51 Ca -0.04 2.02 0.00 0.00 0.48 0.00 0.00 55.95 58.42 1pmx s SER 51 Cb -0.09 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.46 1pmx s SER 51 CO 0.01 -0.58 0.02 0.00 0.98 0.00 0.00 173.24 173.67 1pmx s ASP 53 N -1.96 4.73 0.60 0.00 -4.77 -1.26 -4.99 116.67 109.01 1pmx s ASP 53 Ca 0.01 -0.12 0.28 0.00 -3.30 0.00 0.00 52.55 49.43 1pmx s ASP 53 Cb -0.00 -1.67 1.42 0.00 -1.09 0.00 0.00 42.92 41.58 1pmx s ASP 53 CO 0.01 0.21 1.82 -0.07 0.70 0.00 0.00 175.17 177.84 1pmx h LEU 54 N 6.41 0.00 -1.62 2.11 -0.00 -2.01 0.18 115.31 120.38 1pmx h LEU 54 Ca -0.34 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.50 1pmx h LEU 54 Cb 1.19 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.84 1pmx h LEU 54 CO 0.60 0.00 -0.14 0.03 -0.00 0.00 0.00 178.44 178.93 1pmx h ARG 55 N 0.00 0.06 -0.35 1.13 3.08 -2.04 -2.38 114.38 113.89 1pmx h ARG 55 Ca 0.21 -0.01 0.10 0.00 0.07 0.00 0.00 59.98 60.35 1pmx h ARG 55 Cb 1.30 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.33 1pmx h ARG 55 CO -0.00 0.21 0.25 0.00 -1.07 0.00 0.00 179.97 179.36 1pmx h ARG 56 N 0.06 0.00 -0.67 0.04 2.47 -1.06 -1.60 114.38 113.62 1pmx h ARG 56 Ca 0.01 -0.00 0.09 0.00 -1.26 0.00 0.00 59.98 58.83 1pmx h ARG 56 Cb 0.29 -0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.57 1pmx h ARG 56 CO 0.02 0.00 0.45 -0.07 0.56 0.00 0.00 179.97 180.93 1pmx h LEU 57 N 0.00 0.48 -1.25 3.04 3.38 -1.59 -0.53 115.31 118.85 1pmx h LEU 57 Ca 0.17 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 1pmx h LEU 57 Cb 0.66 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1pmx h LEU 57 CO -0.00 0.29 -0.23 -0.33 0.09 0.00 0.00 178.44 178.26 1pmx h GLU 58 N 0.54 0.00 -0.21 1.13 4.39 -1.47 -2.96 114.58 116.00 1pmx h GLU 58 Ca 0.31 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.90 1pmx h GLU 58 Cb 0.49 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 1pmx h GLU 58 CO -0.10 0.23 -0.32 0.52 -1.16 0.00 0.00 179.01 178.17 1pmx h MET 59 N 0.00 0.43 0.00 2.33 2.86 -1.19 -2.96 114.93 116.39 1pmx h MET 59 Ca -0.00 -0.18 -0.17 0.00 -2.06 0.00 0.00 59.70 57.28 1pmx h MET 59 Cb 0.69 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.31 1pmx h MET 59 CO 0.03 0.70 -0.82 1.88 1.06 0.00 0.00 176.91 179.77 1pmx h TYR 60 N 0.37 0.00 -2.57 -0.22 -1.99 -1.53 -3.45 116.97 107.58 1pmx h TYR 60 Ca 0.05 0.00 -0.52 0.00 2.00 0.00 0.00 58.73 60.25 1pmx h TYR 60 Cb 0.75 0.00 0.04 0.00 2.00 0.00 0.00 36.73 39.52 1pmx h TYR 60 CO 0.02 0.82 1.09 0.00 -0.00 0.00 0.00 178.16 180.09 1pmx n ALA 62 N 5.25 -0.01 0.19 0.00 0.00 -0.57 -4.92 120.51 120.44 1pmx n ALA 62 Ca 0.17 -0.22 0.07 0.00 0.00 0.00 0.00 53.44 53.46 1pmx n ALA 62 Cb 0.37 -2.19 0.27 0.00 0.00 0.00 0.00 19.45 17.91 1pmx n ALA 62 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1pmx h PRO 63 N -0.39 0.00 0.00 0.00 0.13 -1.92 -3.46 132.00 126.36 1pmx h PRO 63 Ca -0.47 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.33 1pmx h PRO 63 Cb 1.32 0.00 0.19 0.00 0.13 0.00 0.00 31.00 32.65 1pmx h PRO 63 CO 0.47 0.34 -0.16 1.47 -0.23 0.00 0.00 178.00 179.89 1pmx n LEU 64 N -3.35 0.00 -3.93 1.56 -0.00 -1.26 -5.08 117.00 104.94 1pmx n LEU 64 Ca 0.01 -0.79 -0.09 0.00 -0.00 0.00 0.00 56.01 55.14 1pmx n LEU 64 Cb 0.55 -0.94 -0.08 0.00 -0.00 0.00 0.00 43.42 42.96 1pmx n LEU 64 CO 0.36 -2.76 -0.12 -0.54 -0.00 0.00 0.00 177.39 174.34 1pmx s LYS 65 N -4.77 0.92 -0.21 1.47 1.02 -1.26 -4.85 119.74 112.06 1pmx s LYS 65 Ca 0.60 -1.09 -0.29 0.00 0.02 0.00 0.00 55.97 55.22 1pmx s LYS 65 Cb -0.11 0.33 -0.04 0.00 -0.52 0.00 0.00 37.83 37.50 1pmx s LYS 65 CO 0.50 -0.30 1.87 -1.25 -0.92 0.00 0.00 175.35 175.26 1pmx s PRO 66 N -3.91 3.56 0.09 -1.68 0.04 -1.26 -4.59 135.00 127.24 1pmx s PRO 66 Ca 0.10 1.84 0.00 0.00 0.04 0.00 0.00 61.00 62.98 1pmx s PRO 66 Cb 0.05 -4.18 0.00 0.00 0.04 0.00 0.00 34.50 30.41 1pmx s PRO 66 CO -0.07 -1.60 0.00 0.00 0.04 0.00 0.00 177.00 175.38 1pmx n ALA 67 N 9.62 0.53 -3.57 8.56 0.00 -1.26 -5.16 120.51 129.24 1pmx n ALA 67 Ca 0.23 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.51 1pmx n ALA 67 Cb 0.45 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.84 1pmx n ALA 67 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1pmx s LYS 68 N -1.20 0.94 0.40 0.00 -2.85 -1.26 -5.17 119.74 110.60 1pmx s LYS 68 Ca 0.00 0.56 -0.16 0.00 -1.00 0.00 0.00 55.97 55.37 1pmx s LYS 68 Cb 0.00 0.45 -0.09 0.00 -2.06 0.00 0.00 37.83 36.13 1pmx s LYS 68 CO 0.00 -0.22 0.85 -1.54 0.10 0.00 0.00 175.35 174.53 1pmx s SER 69 N -0.51 6.75 0.00 0.03 1.04 -1.26 -5.09 113.70 114.66 1pmx s SER 69 Ca -0.06 1.42 0.00 0.00 0.48 0.00 0.00 55.95 57.79 1pmx s SER 69 Cb -0.02 -2.44 0.00 0.00 0.10 0.00 0.00 66.02 63.66 1pmx s SER 69 CO 0.06 -0.35 0.00 0.00 0.98 0.00 0.00 173.24 173.92