#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 -3.04 -3.31 1.61 -0.04 -1.26 -4.99 135.00 123.97 1pmx n PRO 2 Ca 0.00 -1.74 -0.46 0.00 -0.04 0.00 0.00 63.50 61.26 1pmx n PRO 2 Cb 0.00 -1.60 -0.05 0.00 -0.04 0.00 0.00 33.50 31.81 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 -5.46 2.99 0.43 0.54 8.01 -1.26 -5.03 118.70 118.91 1pmx s GLU 3 Ca 0.70 -1.71 0.03 0.00 0.01 0.00 0.00 54.97 54.01 1pmx s GLU 3 Cb -0.07 -4.30 -0.02 0.00 -4.31 0.00 0.00 34.13 25.43 1pmx s GLU 3 CO 0.54 -1.33 0.10 0.95 0.01 0.00 0.00 175.26 175.53 1pmx s THR 4 N 1.61 0.72 -0.20 3.63 -4.23 -1.26 -4.54 115.64 111.36 1pmx s THR 4 Ca 0.03 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.51 1pmx s THR 4 Cb -0.30 -2.31 0.06 0.00 1.34 0.00 0.00 72.50 71.29 1pmx s THR 4 CO 0.03 0.00 0.05 -0.22 -0.54 0.00 0.00 174.62 173.94 1pmx s LEU 5 N -3.66 1.09 0.17 4.79 2.96 -1.24 -5.01 118.68 117.77 1pmx s LEU 5 Ca 0.20 -0.86 -0.01 0.00 -0.22 0.00 0.00 54.13 53.24 1pmx s LEU 5 Cb 0.02 -0.55 -0.04 0.00 0.50 0.00 0.00 46.19 46.13 1pmx s LEU 5 CO 0.12 -0.33 0.10 0.00 -1.32 0.00 0.00 176.35 174.93 1pmx n GLY 7 N -0.19 3.08 0.26 0.00 0.00 -1.26 -1.89 105.19 105.18 1pmx n GLY 7 Ca -0.01 -0.28 0.08 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.93 1.95 -0.57 4.61 0.00 -1.98 -2.15 119.26 120.18 1pmx h ALA 8 Ca 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1pmx h ALA 8 Cb 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1pmx h ALA 8 CO 0.00 0.03 0.19 0.93 0.00 0.00 0.00 179.25 180.41 1pmx h GLU 9 N 0.00 0.88 -0.33 0.00 5.08 -1.77 0.81 114.58 119.25 1pmx h GLU 9 Ca -0.00 -0.18 -0.10 0.00 -1.00 0.00 0.00 59.36 58.07 1pmx h GLU 9 Cb 0.05 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1pmx h GLU 9 CO 0.00 0.79 -0.20 1.25 -1.00 0.00 0.00 179.01 179.85 1pmx h LEU 10 N 0.80 0.75 -0.41 1.33 5.85 -1.26 -2.39 115.31 119.99 1pmx h LEU 10 Ca 0.19 -0.42 -0.18 0.00 0.84 0.00 0.00 57.88 58.30 1pmx h LEU 10 Cb 0.27 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1pmx h LEU 10 CO -0.01 1.01 -0.74 0.58 -0.34 0.00 0.00 178.44 178.95 1pmx h VAL 11 N 0.50 1.39 -0.37 1.05 2.07 -1.31 -2.79 116.25 116.78 1pmx h VAL 11 Ca 0.07 -2.18 -0.05 0.00 0.82 0.00 0.00 66.70 65.35 1pmx h VAL 11 Cb 0.75 2.15 -0.02 0.00 -1.52 0.00 0.00 31.29 32.65 1pmx h VAL 11 CO 0.06 0.65 0.00 0.44 0.02 0.00 0.00 177.57 178.74 1pmx h ASP 12 N 0.25 0.55 -0.01 0.57 3.32 0.69 -2.14 116.42 119.65 1pmx h ASP 12 Ca -0.03 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 1pmx h ASP 12 Cb 1.31 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.72 1pmx h ASP 12 CO 0.12 0.62 -0.05 0.00 -1.72 0.00 0.00 179.24 178.22 1pmx h ALA 13 N 1.45 0.02 -0.24 3.45 0.00 -1.39 -1.99 119.26 120.56 1pmx h ALA 13 Ca 0.12 -0.34 0.06 0.00 0.00 0.00 0.00 54.91 54.75 1pmx h ALA 13 Cb 0.35 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1pmx h ALA 13 CO 0.01 -0.12 0.17 -0.07 0.00 0.00 0.00 179.25 179.24 1pmx h LEU 14 N -0.57 0.04 0.04 0.00 3.38 -1.42 0.23 115.31 117.01 1pmx h LEU 14 Ca -0.00 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.73 1pmx h LEU 14 Cb 0.69 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1pmx h LEU 14 CO 0.01 0.03 -1.12 1.56 0.09 0.00 0.00 178.44 179.00 1pmx h GLN 15 N 0.05 0.08 0.02 1.13 4.20 -1.39 0.12 115.11 119.31 1pmx h GLN 15 Ca 0.11 -0.13 -0.22 0.00 0.06 0.00 0.00 58.65 58.47 1pmx h GLN 15 Cb 0.39 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 1pmx h GLN 15 CO -0.01 1.03 -0.94 0.35 -0.67 0.00 0.00 178.83 178.59 1pmx h PHE 16 N 0.02 0.41 0.13 2.96 3.57 -0.33 0.13 116.94 123.83 1pmx h PHE 16 Ca -0.07 -0.23 -0.36 0.00 3.53 0.00 0.00 57.97 60.84 1pmx h PHE 16 Cb 1.84 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 40.53 1pmx h PHE 16 CO 0.02 1.07 -1.93 0.28 -2.23 0.00 0.00 178.31 175.51 1pmx h VAL 17 N 0.14 0.68 0.00 1.41 2.07 -0.70 -3.42 116.25 116.43 1pmx h VAL 17 Ca -0.06 -2.36 -0.37 0.00 0.82 0.00 0.00 66.70 64.72 1pmx h VAL 17 Cb 1.59 2.54 -0.06 0.00 -1.52 0.00 0.00 31.29 33.85 1pmx h VAL 17 CO 0.15 0.88 -2.24 0.00 0.02 0.00 0.00 177.57 176.38 1pmx n GLY 19 N 1.31 1.59 0.65 0.00 0.00 0.44 -2.68 105.19 106.51 1pmx n GLY 19 Ca -0.46 -0.02 0.08 0.00 0.00 0.00 0.00 46.02 45.62 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 10.71 1.92 -0.14 1.61 2.03 -1.26 -4.18 116.55 127.24 1pmx n ASP 20 Ca 0.00 -1.88 -0.08 0.00 0.52 0.00 0.00 54.79 53.35 1pmx n ASP 20 Cb 0.00 -0.19 0.08 0.00 -0.72 0.00 0.00 41.12 40.28 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 2.27 0.90 -0.17 -0.67 2.47 -1.73 -3.45 114.38 114.00 1pmx h ARG 21 Ca 0.00 -0.31 0.00 0.00 -1.26 0.00 0.00 59.98 58.41 1pmx h ARG 21 Cb 0.51 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.76 1pmx h ARG 21 CO 0.00 0.96 0.00 0.41 0.56 0.00 0.00 179.97 181.90 1pmx n GLY 22 N -0.38 0.90 3.74 0.04 0.00 -1.26 -4.21 105.19 104.03 1pmx n GLY 22 Ca 0.02 -0.80 -0.41 0.00 0.00 0.00 0.00 46.02 44.83 1pmx n GLY 22 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1pmx n PHE 23 N -0.08 2.63 -4.72 1.61 1.16 -1.26 -4.44 117.46 112.35 1pmx n PHE 23 Ca 0.00 0.49 -0.29 0.00 -1.87 0.00 0.00 57.45 55.78 1pmx n PHE 23 Cb 0.03 -2.47 -0.17 0.00 -1.61 0.00 0.00 39.48 35.26 1pmx n PHE 23 CO 0.00 0.00 0.00 1.52 -1.87 0.00 0.00 176.76 176.41 1pmx s TYR 24 N -1.13 2.10 0.02 2.97 -0.85 -1.22 -5.03 117.35 114.21 1pmx s TYR 24 Ca 0.56 -0.92 -0.10 0.00 -0.52 0.00 0.00 57.07 56.09 1pmx s TYR 24 Cb -0.51 -1.47 -0.05 0.00 0.38 0.00 0.00 41.96 40.31 1pmx s TYR 24 CO 0.62 -0.43 1.15 0.74 -1.52 0.00 0.00 175.55 176.11 1pmx h PHE 25 N 7.11 -0.34 -2.94 -3.49 -1.00 -1.93 -3.39 116.94 110.95 1pmx h PHE 25 Ca -0.28 -0.00 -0.55 0.00 2.81 0.00 0.00 57.97 59.95 1pmx h PHE 25 Cb 1.20 0.12 -0.08 0.00 3.61 0.00 0.00 35.95 40.80 1pmx h PHE 25 CO 0.48 -0.19 0.99 1.21 -1.61 0.00 0.00 178.31 179.18 1pmx s ASN 26 N -2.63 6.36 -0.19 2.17 3.84 -1.25 -4.12 114.94 119.11 1pmx s ASN 26 Ca -0.05 -0.08 -0.17 0.00 0.21 0.00 0.00 52.86 52.77 1pmx s ASN 26 Cb 0.01 -2.55 -0.21 0.00 -0.55 0.00 0.00 41.25 37.95 1pmx s ASN 26 CO 0.16 -1.58 0.21 0.29 -2.79 0.00 0.00 177.10 173.39 1pmx n LYS 27 N 8.69 0.62 -0.38 0.43 5.02 -1.26 -4.99 118.16 126.29 1pmx n LYS 27 Ca 0.07 0.47 -0.00 0.00 -2.02 0.00 0.00 58.31 56.83 1pmx n LYS 27 Cb 0.49 -1.72 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 1pmx n LYS 27 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1pmx n PRO 28 N -4.16 0.37 -1.23 1.97 -0.04 -1.26 -5.06 135.00 125.59 1pmx n PRO 28 Ca -0.34 -0.01 -0.05 0.00 -0.04 0.00 0.00 63.50 63.07 1pmx n PRO 28 Cb 0.79 -0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 34.23 1pmx n PRO 28 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1pmx n THR 29 N -1.64 0.00 0.00 0.52 -2.24 -1.26 -4.98 114.28 104.68 1pmx n THR 29 Ca 0.00 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1pmx n THR 29 Cb 0.00 0.50 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1pmx n THR 29 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pmx n GLY 30 N -0.27 -1.59 2.03 3.38 0.00 -1.23 -4.65 105.19 102.86 1pmx n GLY 30 Ca -0.20 -1.13 -0.11 0.00 0.00 0.00 0.00 46.02 44.58 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 -2.09 0.00 1.61 4.02 -1.25 -3.97 117.16 115.48 1pmx n TYR 31 Ca 0.00 -1.15 0.00 0.00 -0.01 0.00 0.00 57.90 56.74 1pmx n TYR 31 Cb 0.00 -0.27 0.00 0.00 -0.02 0.00 0.00 39.34 39.05 1pmx n TYR 31 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1pmx n GLY 32 N 1.36 1.25 0.13 2.72 0.00 -1.26 -4.14 105.19 105.25 1pmx n GLY 32 Ca 0.05 -0.78 -0.22 0.00 0.00 0.00 0.00 46.02 45.08 1pmx n GLY 32 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1pmx n SER 33 N 3.42 2.03 -4.49 1.61 3.41 -1.26 -4.78 113.62 113.56 1pmx n SER 33 Ca 0.00 0.28 -0.43 0.00 -0.26 0.00 0.00 58.87 58.46 1pmx n SER 33 Cb 0.00 -0.90 -0.06 0.00 -0.26 0.00 0.00 64.21 62.99 1pmx n SER 33 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1pmx s SER 34 N -6.98 6.29 0.17 4.04 0.01 -1.26 -4.72 113.70 111.24 1pmx s SER 34 Ca -0.25 -0.56 0.00 0.00 1.31 0.00 0.00 55.95 56.45 1pmx s SER 34 Cb 0.07 -2.33 0.00 0.00 0.21 0.00 0.00 66.02 63.97 1pmx s SER 34 CO 0.70 -0.89 0.00 -1.54 0.41 0.00 0.00 173.24 171.92 1pmx n SER 35 N 6.41 -0.93 -4.90 2.44 3.41 -1.25 -3.47 113.62 115.33 1pmx n SER 35 Ca -0.03 0.32 -0.28 0.00 -0.26 0.00 0.00 58.87 58.61 1pmx n SER 35 Cb 0.47 1.04 0.01 0.00 -0.26 0.00 0.00 64.21 65.47 1pmx n SER 35 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pmx s ARG 36 N -1.45 3.39 -0.69 4.33 1.70 -1.26 -4.94 118.95 120.03 1pmx s ARG 36 Ca 0.00 0.31 -0.20 0.00 -0.47 0.00 0.00 55.73 55.36 1pmx s ARG 36 Cb 0.00 -2.26 0.10 0.00 -0.57 0.00 0.00 34.95 32.22 1pmx s ARG 36 CO 0.00 -0.45 0.89 0.50 -1.08 0.00 0.00 175.30 175.17 1pmx s ARG 37 N -4.94 3.19 0.16 3.89 3.52 -1.26 -4.51 118.95 119.00 1pmx s ARG 37 Ca 0.51 -1.22 0.00 0.00 -0.13 0.00 0.00 55.73 54.89 1pmx s ARG 37 Cb -0.11 -4.37 0.00 0.00 -1.56 0.00 0.00 34.95 28.91 1pmx s ARG 37 CO 0.48 -1.70 0.00 0.00 -0.81 0.00 0.00 175.30 173.27 1pmx n ALA 38 N 6.90 0.00 -1.02 6.12 0.00 -1.26 -5.16 120.51 126.09 1pmx n ALA 38 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.41 1pmx n ALA 38 Cb 0.45 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.93 1pmx n ALA 38 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1pmx n PRO 39 N -2.77 -1.14 -3.87 0.00 -0.04 -1.26 -5.08 135.00 120.84 1pmx n PRO 39 Ca 0.00 -0.22 -0.20 0.00 -0.04 0.00 0.00 63.50 63.04 1pmx n PRO 39 Cb 0.00 -0.20 -0.17 0.00 -0.04 0.00 0.00 33.50 33.09 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 -3.31 0.43 -0.03 0.54 1.03 -1.26 -5.11 119.66 111.94 1pmx s GLN 40 Ca 0.09 0.10 -0.27 0.00 0.04 0.00 0.00 55.36 55.32 1pmx s GLN 40 Cb -0.01 -0.71 0.06 0.00 0.03 0.00 0.00 33.01 32.38 1pmx s GLN 40 CO 0.07 -0.21 0.60 0.95 -2.54 0.00 0.00 175.29 174.15 1pmx s THR 41 N 1.50 0.01 0.00 3.63 -4.23 -1.26 -4.96 115.64 110.34 1pmx s THR 41 Ca -0.03 -0.11 0.00 0.00 -1.18 0.00 0.00 61.69 60.38 1pmx s THR 41 Cb -0.13 -0.92 0.00 0.00 1.34 0.00 0.00 72.50 72.79 1pmx s THR 41 CO -0.03 -0.06 0.00 0.61 -0.54 0.00 0.00 174.62 174.60 1pmx n GLY 42 N 0.92 -0.20 0.19 3.99 0.00 -1.26 -3.95 105.19 104.88 1pmx n GLY 42 Ca -0.19 0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.79 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 1.35 0.72 -0.61 6.09 -1.94 -2.24 117.51 120.88 1pmx h ILE 43 Ca 0.00 -1.98 -0.03 0.00 -1.37 0.00 0.00 64.86 61.48 1pmx h ILE 43 Cb 0.00 1.96 -0.00 0.00 0.47 0.00 0.00 36.82 39.24 1pmx h ILE 43 CO 0.00 0.61 -0.45 0.58 -3.07 0.00 0.00 178.15 175.81 1pmx h VAL 44 N 0.36 0.09 0.00 2.19 2.07 -1.93 0.62 116.25 119.64 1pmx h VAL 44 Ca -0.02 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 1pmx h VAL 44 Cb 1.22 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1pmx h VAL 44 CO 0.12 0.00 -0.12 0.44 0.02 0.00 0.00 177.57 178.03 1pmx h ASP 45 N -1.11 0.00 0.97 0.57 5.19 -1.93 0.84 116.42 120.95 1pmx h ASP 45 Ca -0.09 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 1pmx h ASP 45 Cb 0.89 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.40 1pmx h ASP 45 CO 0.09 0.12 -1.01 1.21 -3.12 0.00 0.00 179.24 176.54 1pmx n GLU 46 N -3.32 0.59 0.00 3.56 4.07 -0.84 -3.76 120.64 120.94 1pmx n GLU 46 Ca -0.00 0.12 0.00 0.00 -0.06 0.00 0.00 57.16 57.22 1pmx n GLU 46 Cb 0.34 -1.82 0.00 0.00 -0.06 0.00 0.00 31.44 29.91 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 -0.86 0.48 -3.94 0.00 -1.00 -1.51 -3.44 116.94 106.67 1pmx h PHE 49 Ca -0.02 -0.08 -0.21 0.00 2.81 0.00 0.00 57.97 60.48 1pmx h PHE 49 Cb 0.55 -0.13 -0.22 0.00 3.61 0.00 0.00 35.95 39.76 1pmx h PHE 49 CO 0.10 0.58 -0.71 -0.98 -1.61 0.00 0.00 178.31 175.69 1pmx s ARG 50 N -4.69 0.32 0.19 1.51 1.70 -1.24 -5.05 118.95 111.68 1pmx s ARG 50 Ca -0.07 -0.55 -0.31 0.00 -0.47 0.00 0.00 55.73 54.34 1pmx s ARG 50 Cb 0.15 -0.01 -0.10 0.00 -0.57 0.00 0.00 34.95 34.42 1pmx s ARG 50 CO 0.77 -0.02 1.48 -1.54 -1.08 0.00 0.00 175.30 174.92 1pmx s SER 51 N -1.24 6.66 0.10 -2.89 1.04 -1.25 -3.00 113.70 113.11 1pmx s SER 51 Ca -0.12 2.57 0.00 0.00 0.48 0.00 0.00 55.95 58.88 1pmx s SER 51 Cb -0.08 -2.60 -0.00 0.00 0.10 0.00 0.00 66.02 63.43 1pmx s SER 51 CO -0.01 -0.74 0.01 0.00 0.98 0.00 0.00 173.24 173.48 1pmx s ASP 53 N -1.55 4.43 0.61 0.00 -4.77 -1.26 -5.00 116.67 109.13 1pmx s ASP 53 Ca 0.01 -0.18 0.29 0.00 -3.30 0.00 0.00 52.55 49.37 1pmx s ASP 53 Cb 0.00 -1.52 1.55 0.00 -1.09 0.00 0.00 42.92 41.86 1pmx s ASP 53 CO 0.01 0.22 1.94 -0.07 0.70 0.00 0.00 175.17 177.97 1pmx h LEU 54 N 6.30 0.00 -2.23 2.11 -0.00 -2.03 -0.24 115.31 119.23 1pmx h LEU 54 Ca -0.34 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.54 1pmx h LEU 54 Cb 1.19 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.85 1pmx h LEU 54 CO 0.57 0.00 -0.02 0.03 -0.00 0.00 0.00 178.44 179.02 1pmx h ARG 55 N 0.00 0.00 0.00 1.13 -0.00 -2.04 -1.39 114.38 112.08 1pmx h ARG 55 Ca 0.13 0.00 -0.08 0.00 -0.50 0.00 0.00 59.98 59.53 1pmx h ARG 55 Cb 0.91 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.87 1pmx h ARG 55 CO -0.00 0.02 -0.38 0.00 0.00 0.00 0.00 179.97 179.61 1pmx h ARG 56 N 0.00 0.00 -0.35 0.04 2.47 -1.46 -2.92 114.38 112.17 1pmx h ARG 56 Ca -0.00 0.00 0.10 0.00 -1.26 0.00 0.00 59.98 58.82 1pmx h ARG 56 Cb 0.05 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.36 1pmx h ARG 56 CO 0.00 0.38 0.27 -0.07 0.56 0.00 0.00 179.97 181.11 1pmx h LEU 57 N 0.00 0.00 -0.98 3.04 3.38 -1.41 -0.32 115.31 119.02 1pmx h LEU 57 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 1pmx h LEU 57 Cb 0.72 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1pmx h LEU 57 CO 0.05 0.00 -0.40 -0.33 0.09 0.00 0.00 178.44 177.85 1pmx h GLU 58 N 0.00 0.22 -0.02 1.13 5.08 -1.66 -3.15 114.58 116.18 1pmx h GLU 58 Ca 0.16 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1pmx h GLU 58 Cb 0.71 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 1pmx h GLU 58 CO -0.00 0.59 0.01 0.52 -1.00 0.00 0.00 179.01 179.12 1pmx h MET 59 N 0.19 0.03 -0.27 2.33 2.86 -1.21 -2.67 114.93 116.18 1pmx h MET 59 Ca 0.02 -0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.73 1pmx h MET 59 Cb 0.79 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.43 1pmx h MET 59 CO 0.06 0.15 0.22 1.88 1.06 0.00 0.00 176.91 180.28 1pmx h TYR 60 N -0.10 0.00 -3.87 -0.22 -1.99 -1.55 -3.43 116.97 105.81 1pmx h TYR 60 Ca 0.01 0.00 -0.55 0.00 2.00 0.00 0.00 58.73 60.19 1pmx h TYR 60 Cb 0.13 0.00 0.12 0.00 2.00 0.00 0.00 36.73 38.98 1pmx h TYR 60 CO -0.03 0.00 0.69 0.00 -0.00 0.00 0.00 178.16 178.82 1pmx s ALA 62 N -1.17 2.05 0.03 0.00 0.00 -1.26 -4.96 121.76 116.45 1pmx s ALA 62 Ca 0.58 -1.07 -0.02 0.00 0.00 0.00 0.00 51.96 51.46 1pmx s ALA 62 Cb -0.47 -2.83 -0.27 0.00 0.00 0.00 0.00 23.12 19.55 1pmx s ALA 62 CO 0.60 -2.49 0.95 -1.00 0.00 0.00 0.00 175.76 173.82 1pmx h PRO 63 N -1.69 0.22 -7.06 0.00 0.13 -1.95 -3.47 132.00 118.19 1pmx h PRO 63 Ca -0.45 -0.38 -0.56 0.00 -0.87 0.00 0.00 66.00 63.74 1pmx h PRO 63 Cb 1.26 0.14 0.15 0.00 0.13 0.00 0.00 31.00 32.68 1pmx h PRO 63 CO 0.42 1.10 0.52 1.47 -0.23 0.00 0.00 178.00 181.28 1pmx n LEU 64 N -3.44 5.67 -4.66 1.56 -0.00 -1.26 -5.03 117.00 109.83 1pmx n LEU 64 Ca -0.13 0.89 -0.23 0.00 -0.00 0.00 0.00 56.01 56.54 1pmx n LEU 64 Cb 1.03 -1.55 -0.07 0.00 -0.00 0.00 0.00 43.42 42.83 1pmx n LEU 64 CO 0.51 -0.88 -0.31 -0.54 -0.00 0.00 0.00 177.39 176.17 1pmx s LYS 65 N -3.12 2.37 0.99 1.47 3.01 -1.26 -4.45 119.74 118.74 1pmx s LYS 65 Ca 0.78 -1.37 -0.17 0.00 -1.01 0.00 0.00 55.97 54.20 1pmx s LYS 65 Cb -0.40 -2.21 0.24 0.00 -1.01 0.00 0.00 37.83 34.45 1pmx s LYS 65 CO 0.44 0.37 1.15 -0.35 0.51 0.00 0.00 175.35 177.47 1pmx n PRO 66 N -0.92 -1.86 -3.75 -1.68 -0.04 -1.26 -4.96 135.00 120.53 1pmx n PRO 66 Ca -0.07 -1.79 -0.22 0.00 -0.04 0.00 0.00 63.50 61.38 1pmx n PRO 66 Cb 0.59 -1.36 -0.04 0.00 -0.04 0.00 0.00 33.50 32.65 1pmx n PRO 66 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1pmx s ALA 67 N -3.62 3.96 -0.27 0.55 0.00 -1.26 -5.07 121.76 116.05 1pmx s ALA 67 Ca 0.68 -1.90 -0.12 0.00 0.00 0.00 0.00 51.96 50.62 1pmx s ALA 67 Cb -0.04 -0.81 -0.12 0.00 0.00 0.00 0.00 23.12 22.15 1pmx s ALA 67 CO 0.49 -0.23 -0.33 1.63 0.00 0.00 0.00 175.76 177.32 1pmx n LYS 68 N -1.48 0.57 -1.24 0.00 4.01 -1.26 -5.00 118.16 113.76 1pmx n LYS 68 Ca 0.02 0.24 -0.31 0.00 -0.51 0.00 0.00 58.31 57.74 1pmx n LYS 68 Cb 0.63 -1.46 0.10 0.00 -0.51 0.00 0.00 35.03 33.79 1pmx n LYS 68 CO 0.00 0.00 0.00 -1.12 -1.11 0.00 0.00 177.40 175.17 1pmx s SER 69 N -7.29 4.29 0.00 4.39 0.01 -1.26 -5.36 113.70 108.47 1pmx s SER 69 Ca -0.37 1.94 0.28 0.00 1.31 0.00 0.00 55.95 59.12 1pmx s SER 69 Cb 0.14 -2.54 1.10 0.00 0.21 0.00 0.00 66.02 64.93 1pmx s SER 69 CO 0.48 -2.18 1.77 0.00 0.41 0.00 0.00 173.24 173.72