#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4l n SER 2 N 0.00 -3.01 -0.01 1.61 7.64 -1.26 -4.93 113.62 113.66 1x4l n SER 2 Ca 0.00 0.56 -0.02 0.00 1.01 0.00 0.00 58.87 60.42 1x4l n SER 2 Cb 0.00 -0.71 -0.01 0.00 -1.01 0.00 0.00 64.21 62.48 1x4l n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1x4l n SER 3 N 2.08 1.87 0.00 6.43 3.41 -1.26 -5.15 113.62 121.00 1x4l n SER 3 Ca 0.07 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 1x4l n SER 3 Cb 0.39 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.28 1x4l n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x4l n GLY 4 N 3.09 4.10 3.02 5.00 0.00 -1.26 -5.14 105.19 113.99 1x4l n GLY 4 Ca -0.05 -1.48 -0.13 0.00 0.00 0.00 0.00 46.02 44.36 1x4l n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x4l s SER 5 N 0.00 -0.16 1.05 1.61 1.04 -1.26 -5.15 113.70 110.83 1x4l s SER 5 Ca 0.00 0.31 -0.14 0.00 0.48 0.00 0.00 55.95 56.60 1x4l s SER 5 Cb 0.00 0.31 0.12 0.00 0.10 0.00 0.00 66.02 66.55 1x4l s SER 5 CO 0.00 -0.06 0.49 -1.54 0.98 0.00 0.00 173.24 173.11 1x4l n SER 6 N 3.11 -1.78 0.00 7.02 3.41 -1.26 -4.23 113.62 119.90 1x4l n SER 6 Ca -0.14 0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 1x4l n SER 6 Cb 0.58 -1.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.36 1x4l n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x4l n GLY 7 N 1.41 -2.09 3.68 5.00 0.00 -1.26 -4.70 105.19 107.23 1x4l n GLY 7 Ca 0.05 0.71 -0.39 0.00 0.00 0.00 0.00 46.02 46.38 1x4l n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x4l n ALA 9 N 4.51 6.53 0.08 0.00 0.00 0.95 -3.77 120.51 128.80 1x4l n ALA 9 Ca -0.05 -2.39 0.00 0.00 0.00 0.00 0.00 53.44 51.00 1x4l n ALA 9 Cb 0.51 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.56 1x4l n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x4l n GLY 10 N 2.16 -1.04 1.41 0.00 0.00 -1.26 -4.91 105.19 101.55 1x4l n GLY 10 Ca 0.49 0.21 -0.06 0.00 0.00 0.00 0.00 46.02 46.66 1x4l n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x4l n THR 12 N -0.05 0.00 -4.24 0.00 -2.24 -1.25 -4.86 114.28 101.63 1x4l n THR 12 Ca 0.22 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.86 1x4l n THR 12 Cb 0.91 -0.24 -0.10 0.00 -2.10 0.00 0.00 70.33 68.79 1x4l n THR 12 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1x4l s ASN 13 N -2.44 1.75 0.77 3.42 0.01 -1.25 -5.02 114.94 112.17 1x4l s ASN 13 Ca 0.41 -1.01 -0.11 0.00 -0.71 0.00 0.00 52.86 51.44 1x4l s ASN 13 Cb -0.24 -0.00 0.05 0.00 0.41 0.00 0.00 41.25 41.47 1x4l s ASN 13 CO 0.50 -0.34 1.09 -2.16 -1.51 0.00 0.00 177.10 174.68 1x4l s PRO 14 N -3.75 2.28 -0.58 -0.60 0.04 -1.26 -0.80 135.00 130.34 1x4l s PRO 14 Ca 0.16 1.19 -0.06 0.00 0.04 0.00 0.00 61.00 62.33 1x4l s PRO 14 Cb 0.03 -1.90 0.15 0.00 0.04 0.00 0.00 34.50 32.82 1x4l s PRO 14 CO 0.00 -1.62 0.43 0.42 0.04 0.00 0.00 177.00 176.26 1x4l s ILE 15 N -2.86 4.03 -0.24 0.56 1.01 -1.26 -4.61 121.20 117.83 1x4l s ILE 15 Ca 0.62 -2.47 -0.29 0.00 0.00 0.00 0.00 60.65 58.50 1x4l s ILE 15 Cb -0.17 -3.63 0.16 0.00 0.01 0.00 0.00 42.46 38.83 1x4l s ILE 15 CO 0.55 -0.85 1.21 -0.55 0.00 0.00 0.00 174.94 175.30 1x4l s SER 16 N 1.55 -0.19 0.00 3.58 0.15 -1.26 -5.01 113.70 112.52 1x4l s SER 16 Ca 0.13 0.22 0.00 0.00 0.70 0.00 0.00 55.95 57.00 1x4l s SER 16 Cb -0.21 0.17 0.00 0.00 -1.71 0.00 0.00 66.02 64.28 1x4l s SER 16 CO -0.04 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 174.85 1x4l n GLY 17 N 0.72 4.09 1.95 9.45 0.00 -1.26 -5.01 105.19 115.13 1x4l n GLY 17 Ca -0.05 -0.66 -0.12 0.00 0.00 0.00 0.00 46.02 45.19 1x4l n GLY 17 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x4l n LEU 18 N 0.00 5.63 0.00 0.99 4.77 -1.26 -4.87 117.00 122.26 1x4l n LEU 18 Ca 0.00 -3.17 0.00 0.00 -0.03 0.00 0.00 56.01 52.81 1x4l n LEU 18 Cb 0.00 -1.27 0.00 0.00 -2.33 0.00 0.00 43.42 39.82 1x4l n LEU 18 CO 0.00 1.48 0.00 0.61 -1.33 0.00 0.00 177.39 178.15 1x4l n GLY 19 N 1.72 0.56 3.92 -0.72 0.00 -1.26 -5.12 105.19 104.29 1x4l n GLY 19 Ca 0.32 -1.51 -0.27 0.00 0.00 0.00 0.00 46.02 44.56 1x4l n GLY 19 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1x4l s GLY 20 N 0.00 1.67 0.04 -0.02 0.00 -1.26 -4.99 107.32 102.76 1x4l s GLY 20 Ca 0.00 -0.92 -0.21 0.00 0.00 0.00 0.00 44.72 43.59 1x4l s GLY 20 CO 0.00 -0.43 0.49 -1.59 0.00 0.00 0.00 173.10 171.57 1x4l s THR 21 N -3.44 0.04 -0.28 0.90 2.01 -1.26 -4.93 115.64 108.68 1x4l s THR 21 Ca 0.63 -0.30 0.03 0.00 0.31 0.00 0.00 61.69 62.36 1x4l s THR 21 Cb -0.10 -0.95 0.35 0.00 0.01 0.00 0.00 72.50 71.81 1x4l s THR 21 CO 0.47 -0.16 1.42 0.29 -0.69 0.00 0.00 174.62 175.94 1x4l n LYS 22 N 0.52 1.82 -1.46 4.92 5.02 -1.26 -4.97 118.16 122.76 1x4l n LYS 22 Ca -0.19 -1.53 -0.36 0.00 -2.02 0.00 0.00 58.31 54.21 1x4l n LYS 22 Cb 0.60 -1.64 0.07 0.00 -0.02 0.00 0.00 35.03 34.04 1x4l n LYS 22 CO 0.00 0.00 0.00 2.48 -0.52 0.00 0.00 177.40 179.36 1x4l n TYR 23 N -0.24 0.58 -2.73 2.13 4.11 -1.26 -4.44 117.16 115.31 1x4l n TYR 23 Ca 0.28 0.41 -0.42 0.00 -0.00 0.00 0.00 57.90 58.16 1x4l n TYR 23 Cb 1.04 -2.09 -0.03 0.00 -0.00 0.00 0.00 39.34 38.27 1x4l n TYR 23 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.86 177.28 1x4l s ILE 24 N -1.70 4.84 -0.15 -3.48 -1.09 0.21 -4.89 121.20 114.94 1x4l s ILE 24 Ca 0.74 1.99 0.02 0.00 -2.23 0.00 0.00 60.65 61.17 1x4l s ILE 24 Cb -0.37 -4.29 0.02 0.00 -1.58 0.00 0.00 42.46 36.23 1x4l s ILE 24 CO 0.49 0.09 -0.19 -0.94 -1.23 0.00 0.00 174.94 173.16 1x4l s SER 25 N 1.05 2.95 0.44 3.58 1.04 -1.26 -0.22 113.70 121.28 1x4l s SER 25 Ca 0.49 -0.58 0.07 0.00 0.48 0.00 0.00 55.95 56.41 1x4l s SER 25 Cb -0.19 -1.36 -0.03 0.00 0.10 0.00 0.00 66.02 64.53 1x4l s SER 25 CO 0.22 0.02 0.26 0.12 0.98 0.00 0.00 173.24 174.84 1x4l s PHE 26 N 1.12 2.45 0.18 5.02 5.36 0.98 -4.99 117.98 128.09 1x4l s PHE 26 Ca -0.01 -0.62 -0.07 0.00 -0.96 0.00 0.00 56.93 55.28 1x4l s PHE 26 Cb -0.14 -2.00 0.27 0.00 -0.34 0.00 0.00 43.02 40.81 1x4l s PHE 26 CO -0.07 0.00 1.03 0.39 -1.46 0.00 0.00 175.22 175.10 1x4l n GLU 27 N -1.40 -0.08 0.00 10.12 -0.58 -1.26 -3.83 120.64 123.60 1x4l n GLU 27 Ca -0.01 1.02 0.00 0.00 -0.42 0.00 0.00 57.16 57.76 1x4l n GLU 27 Cb 0.64 -1.53 0.00 0.00 -0.57 0.00 0.00 31.44 29.98 1x4l n GLU 27 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1x4l n GLU 28 N -5.05 0.00 -1.82 3.49 1.02 -1.26 -5.10 120.64 111.92 1x4l n GLU 28 Ca 0.10 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.95 1x4l n GLU 28 Cb 0.32 -0.60 0.09 0.00 -0.02 0.00 0.00 31.44 31.23 1x4l n GLU 28 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1x4l s ARG 29 N -1.46 1.98 0.26 3.49 0.52 -1.25 -5.10 118.95 117.39 1x4l s ARG 29 Ca 0.00 0.22 -0.14 0.00 -0.52 0.00 0.00 55.73 55.29 1x4l s ARG 29 Cb 0.00 -1.94 0.00 0.00 0.52 0.00 0.00 34.95 33.53 1x4l s ARG 29 CO 0.00 -1.61 0.54 -0.65 0.02 0.00 0.00 175.30 173.60 1x4l s GLN 30 N -5.47 1.62 0.18 3.54 -0.21 -1.26 -0.02 119.66 118.05 1x4l s GLN 30 Ca 0.62 -1.21 -0.08 0.00 0.02 0.00 0.00 55.36 54.70 1x4l s GLN 30 Cb -0.12 0.50 0.03 0.00 1.00 0.00 0.00 33.01 34.43 1x4l s GLN 30 CO 0.50 -0.69 0.42 0.91 -2.12 0.00 0.00 175.29 174.32 1x4l n TRP 31 N -0.41 -1.57 -4.21 0.91 8.01 0.69 -0.03 117.44 120.83 1x4l n TRP 31 Ca -0.02 -0.89 -0.27 0.00 -1.31 0.00 0.00 57.50 55.01 1x4l n TRP 31 Cb 0.61 0.44 -0.08 0.00 -2.01 0.00 0.00 31.31 30.28 1x4l n TRP 31 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.69 175.67 1x4l s HIS 32 N -5.26 2.82 0.56 -5.99 3.76 -1.26 -0.62 115.29 109.31 1x4l s HIS 32 Ca 0.09 -0.14 0.19 0.00 -0.15 0.00 0.00 55.06 55.04 1x4l s HIS 32 Cb -0.02 -1.38 1.02 0.00 1.11 0.00 0.00 32.58 33.31 1x4l s HIS 32 CO 0.05 0.51 1.55 -0.91 -0.85 0.00 0.00 174.74 175.09 1x4l h ASN 33 N 2.79 0.00 0.00 1.40 4.21 -1.91 0.17 115.58 122.25 1x4l h ASN 33 Ca -0.47 0.00 -0.18 0.00 1.21 0.00 0.00 56.30 56.86 1x4l h ASN 33 Cb 1.20 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 38.37 1x4l h ASN 33 CO 0.57 0.00 -1.45 -0.67 -1.29 0.00 0.00 177.43 174.59 1x4l n ASP 34 N -2.62 1.19 -0.35 5.81 2.03 -1.26 -4.64 116.55 116.71 1x4l n ASP 34 Ca -0.01 0.20 0.12 0.00 0.52 0.00 0.00 54.79 55.61 1x4l n ASP 34 Cb 0.55 -0.47 0.30 0.00 -0.72 0.00 0.00 41.12 40.78 1x4l n ASP 34 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1x4l n PHE 36 N -4.78 1.27 -3.70 0.00 7.35 0.57 -4.83 117.46 113.34 1x4l n PHE 36 Ca 0.22 0.17 -0.14 0.00 -0.76 0.00 0.00 57.45 56.94 1x4l n PHE 36 Cb 0.54 -2.58 -0.08 0.00 0.35 0.00 0.00 39.48 37.70 1x4l n PHE 36 CO 0.00 0.00 0.00 -0.80 -0.76 0.00 0.00 176.76 175.20 1x4l s ASN 37 N 11.24 -0.35 1.02 -2.13 0.01 -1.26 -3.22 114.94 120.25 1x4l s ASN 37 Ca 1.07 0.37 -0.22 0.00 -0.71 0.00 0.00 52.86 53.36 1x4l s ASN 37 Cb -0.44 0.47 -0.12 0.00 0.41 0.00 0.00 41.25 41.57 1x4l s ASN 37 CO 0.32 -0.44 -0.95 0.00 -1.51 0.00 0.00 177.10 174.52 1x4l n LYS 39 N 1.44 1.57 -0.04 0.00 3.00 -0.91 -3.10 118.16 120.11 1x4l n LYS 39 Ca -0.01 -0.97 -0.07 0.00 -0.00 0.00 0.00 58.31 57.27 1x4l n LYS 39 Cb 0.67 -1.24 -0.04 0.00 0.00 0.00 0.00 35.03 34.41 1x4l n LYS 39 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1x4l n LYS 40 N 0.18 0.20 0.00 1.64 4.81 -1.26 -4.75 118.16 118.97 1x4l n LYS 40 Ca 0.07 0.06 0.02 0.00 -0.87 0.00 0.00 58.31 57.58 1x4l n LYS 40 Cb 0.33 -1.09 0.01 0.00 0.02 0.00 0.00 35.03 34.30 1x4l n LYS 40 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1x4l n SER 42 N 0.09 -3.03 -4.87 0.00 7.64 -1.18 -4.88 113.62 107.38 1x4l n SER 42 Ca 0.02 -0.98 -0.32 0.00 1.01 0.00 0.00 58.87 58.60 1x4l n SER 42 Cb 0.07 -2.94 -0.05 0.00 -1.01 0.00 0.00 64.21 60.28 1x4l n SER 42 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1x4l s LEU 43 N -7.23 4.10 -0.08 -3.43 2.96 -1.26 -4.50 118.68 109.23 1x4l s LEU 43 Ca 0.62 1.06 -0.34 0.00 -0.22 0.00 0.00 54.13 55.25 1x4l s LEU 43 Cb -0.33 -3.85 -0.12 0.00 0.50 0.00 0.00 46.19 42.38 1x4l s LEU 43 CO 0.91 -0.15 1.87 -0.24 -1.32 0.00 0.00 176.35 177.41 1x4l n SER 44 N -0.35 3.41 -0.05 3.68 2.88 -1.26 -1.23 113.62 120.70 1x4l n SER 44 Ca 0.02 0.98 -0.02 0.00 -1.33 0.00 0.00 58.87 58.52 1x4l n SER 44 Cb 0.53 -1.37 -0.11 0.00 -0.75 0.00 0.00 64.21 62.51 1x4l n SER 44 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1x4l n LEU 45 N 6.48 0.00 -4.48 2.46 4.77 -1.20 -4.90 117.00 120.13 1x4l n LEU 45 Ca 0.22 0.00 -0.51 0.00 -0.03 0.00 0.00 56.01 55.69 1x4l n LEU 45 Cb 0.29 0.23 -0.07 0.00 -2.33 0.00 0.00 43.42 41.54 1x4l n LEU 45 CO 0.73 0.23 1.74 0.55 -1.33 0.00 0.00 177.39 179.31 1x4l n VAL 46 N -2.36 0.22 -0.93 4.08 3.14 -1.26 -0.50 118.33 120.73 1x4l n VAL 46 Ca -0.16 -0.23 0.00 0.00 -2.96 0.00 0.00 64.34 60.99 1x4l n VAL 46 Cb 0.77 -1.61 0.00 0.00 -1.06 0.00 0.00 33.84 31.94 1x4l n VAL 46 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1x4l n GLY 47 N 6.21 1.14 3.27 7.55 0.00 -1.26 -5.08 105.19 117.02 1x4l n GLY 47 Ca 0.39 -0.45 -0.16 0.00 0.00 0.00 0.00 46.02 45.79 1x4l n GLY 47 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x4l s ARG 48 N -2.32 1.55 -1.38 1.61 0.52 0.35 -5.06 118.95 114.23 1x4l s ARG 48 Ca 0.00 -1.85 -0.07 0.00 -0.52 0.00 0.00 55.73 53.29 1x4l s ARG 48 Cb 0.00 0.31 0.08 0.00 0.52 0.00 0.00 34.95 35.87 1x4l s ARG 48 CO 0.00 -0.56 2.45 0.41 0.02 0.00 0.00 175.30 177.62 1x4l n GLY 49 N -0.48 5.00 3.74 -3.53 0.00 -1.26 -4.98 105.19 103.67 1x4l n GLY 49 Ca 0.05 -1.95 -0.35 0.00 0.00 0.00 0.00 46.02 43.77 1x4l n GLY 49 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1x4l s PHE 50 N -0.37 2.25 0.34 1.61 -0.71 -1.26 -4.20 117.98 115.64 1x4l s PHE 50 Ca 0.56 1.55 0.06 0.00 -1.04 0.00 0.00 56.93 58.06 1x4l s PHE 50 Cb 0.18 -3.46 0.06 0.00 -1.21 0.00 0.00 43.02 38.59 1x4l s PHE 50 CO -0.08 -2.37 0.46 1.28 -1.34 0.00 0.00 175.22 173.17 1x4l n LEU 51 N -2.20 0.00 -3.71 -1.99 4.32 0.82 -4.96 117.00 109.28 1x4l n LEU 51 Ca 0.13 -1.48 -0.30 0.00 -0.02 0.00 0.00 56.01 54.35 1x4l n LEU 51 Cb 0.50 -0.24 -0.15 0.00 -1.62 0.00 0.00 43.42 41.91 1x4l n LEU 51 CO 0.46 -0.62 -0.33 0.42 -1.22 0.00 0.00 177.39 176.11 1x4l s THR 52 N -1.13 0.78 0.78 -5.08 -4.23 -1.26 -3.59 115.64 101.91 1x4l s THR 52 Ca 0.35 -1.39 -0.12 0.00 -1.18 0.00 0.00 61.69 59.35 1x4l s THR 52 Cb -0.03 -1.60 0.06 0.00 1.34 0.00 0.00 72.50 72.27 1x4l s THR 52 CO 0.22 -0.70 1.10 -0.70 -0.54 0.00 0.00 174.62 174.00 1x4l s GLU 53 N 1.60 2.25 0.00 3.99 2.12 0.65 -4.95 118.70 124.35 1x4l s GLU 53 Ca 0.10 0.55 0.00 0.00 0.36 0.00 0.00 54.97 55.99 1x4l s GLU 53 Cb -0.18 -1.94 0.00 0.00 0.26 0.00 0.00 34.13 32.27 1x4l s GLU 53 CO -0.25 -1.49 0.54 0.54 -0.54 0.00 0.00 175.26 174.07 1x4l n ARG 54 N -3.33 0.00 -0.63 4.30 1.74 -1.26 -2.64 116.66 114.84 1x4l n ARG 54 Ca 0.07 0.54 0.06 0.00 -0.77 0.00 0.00 57.85 57.76 1x4l n ARG 54 Cb 0.57 -0.85 0.17 0.00 -1.02 0.00 0.00 32.46 31.33 1x4l n ARG 54 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1x4l n ASP 55 N -2.19 1.67 -3.88 0.55 2.03 -1.26 -5.05 116.55 108.42 1x4l n ASP 55 Ca 0.00 -3.50 -0.08 0.00 0.52 0.00 0.00 54.79 51.74 1x4l n ASP 55 Cb 0.00 -0.48 -0.03 0.00 -0.72 0.00 0.00 41.12 39.90 1x4l n ASP 55 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1x4l s ASP 56 N -2.97 -0.22 0.26 1.67 1.01 -1.08 -5.18 116.67 110.16 1x4l s ASP 56 Ca 0.36 -0.69 0.09 0.00 0.71 0.00 0.00 52.55 53.01 1x4l s ASP 56 Cb 0.35 0.70 -0.04 0.00 1.01 0.00 0.00 42.92 44.93 1x4l s ASP 56 CO -0.07 -1.30 0.03 0.27 0.21 0.00 0.00 175.17 174.31 1x4l s ILE 57 N -3.93 3.65 0.22 0.77 -4.36 -1.26 0.24 121.20 116.53 1x4l s ILE 57 Ca 0.14 -1.79 -0.11 0.00 -0.26 0.00 0.00 60.65 58.62 1x4l s ILE 57 Cb -0.05 -2.95 -0.01 0.00 1.25 0.00 0.00 42.46 40.71 1x4l s ILE 57 CO 0.08 -0.36 0.41 -0.76 0.24 0.00 0.00 174.94 174.55 1x4l s LEU 58 N -3.66 0.49 0.20 0.37 1.43 -1.24 -2.14 118.68 114.13 1x4l s LEU 58 Ca 0.31 -0.92 0.05 0.00 -1.03 0.00 0.00 54.13 52.54 1x4l s LEU 58 Cb -0.07 1.57 -0.04 0.00 0.03 0.00 0.00 46.19 47.68 1x4l s LEU 58 CO 0.21 -1.06 0.21 0.00 0.23 0.00 0.00 176.35 175.93 1x4l h PRO 60 N 1.93 0.51 -0.61 0.00 0.11 -1.94 0.69 132.00 132.69 1x4l h PRO 60 Ca -0.49 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 1x4l h PRO 60 Cb 1.21 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 1x4l h PRO 60 CO 0.63 0.33 0.35 -0.44 -0.21 0.00 0.00 178.00 178.66 1x4l h ASP 61 N 0.52 0.73 0.00 -2.05 3.32 -1.95 -1.24 116.42 115.75 1x4l h ASP 61 Ca 0.66 -0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.63 1x4l h ASP 61 Cb 1.34 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 1x4l h ASP 61 CO -0.47 0.58 -0.55 0.00 -1.72 0.00 0.00 179.24 177.07 1x4l h GLY 63 N -1.00 1.25 -0.69 0.00 0.00 0.11 -0.62 103.07 102.12 1x4l h GLY 63 Ca -0.05 -0.00 0.20 0.00 0.00 0.00 0.00 47.33 47.48 1x4l h GLY 63 CO -0.03 -0.35 0.06 0.58 0.00 0.00 0.00 176.54 176.80 1x4l n LYS 64 N -5.25 -0.05 -0.34 4.80 2.85 -0.47 0.94 118.16 120.63 1x4l n LYS 64 Ca 0.20 1.03 0.07 0.00 -1.05 0.00 0.00 58.31 58.56 1x4l n LYS 64 Cb 0.64 -1.66 0.15 0.00 -0.65 0.00 0.00 35.03 33.51 1x4l n LYS 64 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1x4l n ASP 65 N -4.89 -0.30 -4.75 -5.58 2.03 -0.24 -4.47 116.55 98.35 1x4l n ASP 65 Ca 0.18 1.62 -0.67 0.00 0.52 0.00 0.00 54.79 56.43 1x4l n ASP 65 Cb 0.58 -0.50 -0.10 0.00 -0.72 0.00 0.00 41.12 40.38 1x4l n ASP 65 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 1x4l n ILE 66 N -5.51 0.02 -0.65 5.18 5.41 0.27 -4.75 119.36 119.33 1x4l n ILE 66 Ca 0.16 -0.00 -0.04 0.00 1.00 0.00 0.00 62.75 63.87 1x4l n ILE 66 Cb 0.51 -0.55 -0.04 0.00 -0.71 0.00 0.00 39.64 38.85 1x4l n ILE 66 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1x4l n SER 67 N 4.10 5.37 0.00 4.38 3.41 -1.26 -4.74 113.62 124.88 1x4l n SER 67 Ca 0.31 -2.46 0.00 0.00 -0.26 0.00 0.00 58.87 56.46 1x4l n SER 67 Cb -0.05 -1.20 0.00 0.00 -0.26 0.00 0.00 64.21 62.70 1x4l n SER 67 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x4l n GLY 68 N 1.70 0.65 3.76 5.00 0.00 -1.26 -5.03 105.19 110.01 1x4l n GLY 68 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1x4l n GLY 68 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4l s PRO 69 N 2.47 4.46 -0.42 1.61 0.04 -1.26 -4.88 135.00 137.02 1x4l s PRO 69 Ca 0.00 2.06 -0.44 0.00 0.04 0.00 0.00 61.00 62.66 1x4l s PRO 69 Cb 0.00 -3.12 -0.18 0.00 0.04 0.00 0.00 34.50 31.24 1x4l s PRO 69 CO 0.00 -0.05 1.73 -1.13 0.04 0.00 0.00 177.00 177.59 1x4l n SER 70 N 1.10 1.62 -2.39 6.66 3.41 -1.26 -4.83 113.62 117.93 1x4l n SER 70 Ca 0.00 1.06 -0.33 0.00 -0.26 0.00 0.00 58.87 59.35 1x4l n SER 70 Cb 0.43 -0.99 0.05 0.00 -0.26 0.00 0.00 64.21 63.44 1x4l n SER 70 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1x4l n SER 71 N 5.11 6.76 0.00 4.04 3.41 -1.26 -5.24 113.62 126.44 1x4l n SER 71 Ca 0.32 -3.78 0.00 0.00 -0.26 0.00 0.00 58.87 55.15 1x4l n SER 71 Cb 0.02 -0.80 0.00 0.00 -0.26 0.00 0.00 64.21 63.17 1x4l n SER 71 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49