#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 0.91 -4.66 1.61 7.64 -1.26 -4.90 113.62 112.97 1x4l n SER 2 Ca 0.00 0.35 -0.24 0.00 1.01 0.00 0.00 58.87 59.99 1x4l n SER 2 Cb 0.00 -1.02 -0.08 0.00 -1.01 0.00 0.00 64.21 62.10 1x4l n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1x4l s SER 3 N 7.87 4.30 -0.30 6.43 0.15 -1.26 -5.14 113.70 125.76 1x4l s SER 3 Ca 1.23 -0.94 -0.07 0.00 0.70 0.00 0.00 55.95 56.86 1x4l s SER 3 Cb -1.20 -0.58 0.15 0.00 -1.71 0.00 0.00 66.02 62.68 1x4l s SER 3 CO 0.54 -0.26 0.63 -0.83 1.20 0.00 0.00 173.24 174.52 1x4l s GLY 4 N -3.75 -0.80 -0.00 9.45 0.00 -1.26 -5.04 107.32 105.92 1x4l s GLY 4 Ca 0.36 2.19 -0.00 0.00 0.00 0.00 0.00 44.72 47.26 1x4l s GLY 4 CO 0.20 3.15 -0.00 -1.26 0.00 0.00 0.00 173.10 175.18 1x4l n SER 5 N 5.44 1.66 -4.66 1.64 2.88 -1.26 -5.01 113.62 114.32 1x4l n SER 5 Ca -0.09 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.04 1x4l n SER 5 Cb 0.50 -0.01 -0.05 0.00 -0.75 0.00 0.00 64.21 63.90 1x4l n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x4l s SER 6 N -4.63 6.83 0.00 -3.46 0.15 -1.26 -4.97 113.70 106.36 1x4l s SER 6 Ca -0.01 1.02 0.00 0.00 0.70 0.00 0.00 55.95 57.66 1x4l s SER 6 Cb 0.00 -2.42 0.00 0.00 -1.71 0.00 0.00 66.02 61.90 1x4l s SER 6 CO 0.01 -0.41 0.00 0.61 1.20 0.00 0.00 173.24 174.65 1x4l n GLY 7 N 3.68 1.21 3.67 9.45 0.00 -1.26 -4.65 105.19 117.29 1x4l n GLY 7 Ca 0.03 -1.15 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 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 6.96 4.14 -0.09 0.00 0.00 0.67 -3.51 120.51 128.68 1x4l n ALA 9 Ca 0.19 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1x4l n ALA 9 Cb 0.41 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.80 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 1.31 -0.15 1.28 0.00 0.00 -1.26 -4.87 105.19 101.50 1x4l n GLY 10 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 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 0.04 -0.78 -3.95 0.00 -2.24 -1.24 -4.92 114.28 101.20 1x4l n THR 12 Ca 0.16 -0.39 -0.10 0.00 -2.27 0.00 0.00 64.05 61.45 1x4l n THR 12 Cb 0.79 -0.87 -0.11 0.00 -2.10 0.00 0.00 70.33 68.04 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 -4.11 0.17 0.85 3.42 0.01 -1.23 -5.01 114.94 109.03 1x4l s ASN 13 Ca 0.14 -0.39 -0.11 0.00 -0.71 0.00 0.00 52.86 51.79 1x4l s ASN 13 Cb -0.08 0.12 0.10 0.00 0.41 0.00 0.00 41.25 41.80 1x4l s ASN 13 CO 0.96 -0.29 1.09 -2.16 -1.51 0.00 0.00 177.10 175.19 1x4l s PRO 14 N -1.32 1.64 0.22 -0.60 0.04 -1.26 0.13 135.00 133.86 1x4l s PRO 14 Ca -0.14 0.95 0.11 0.00 0.04 0.00 0.00 61.00 61.96 1x4l s PRO 14 Cb -0.09 -1.84 -0.05 0.00 0.04 0.00 0.00 34.50 32.56 1x4l s PRO 14 CO -0.00 -2.01 -0.20 0.42 0.04 0.00 0.00 177.00 175.24 1x4l s ILE 15 N -2.92 2.21 0.91 0.56 1.01 -1.26 -4.49 121.20 117.22 1x4l s ILE 15 Ca 0.63 -2.17 -0.17 0.00 0.00 0.00 0.00 60.65 58.94 1x4l s ILE 15 Cb -0.18 -2.12 -0.12 0.00 0.01 0.00 0.00 42.46 40.05 1x4l s ILE 15 CO 0.57 -0.32 -0.50 -0.24 0.00 0.00 0.00 174.94 174.45 1x4l n SER 16 N -0.13 -5.00 0.00 3.58 2.88 -1.26 -4.88 113.62 108.81 1x4l n SER 16 Ca -0.09 0.28 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 1x4l n SER 16 Cb 0.58 -0.85 0.00 0.00 -0.75 0.00 0.00 64.21 63.19 1x4l n SER 16 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4l n GLY 17 N 3.03 0.00 2.88 0.46 0.00 -1.26 -4.76 105.19 105.54 1x4l n GLY 17 Ca 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.87 1x4l n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x4l s LEU 18 N 0.00 1.61 0.00 0.99 2.01 -1.26 -5.11 118.68 116.92 1x4l s LEU 18 Ca 0.00 -0.06 0.00 0.00 0.01 0.00 0.00 54.13 54.08 1x4l s LEU 18 Cb 0.00 -0.23 0.00 0.00 0.01 0.00 0.00 46.19 45.97 1x4l s LEU 18 CO 0.00 -0.02 0.00 0.61 1.01 0.00 0.00 176.35 177.95 1x4l n GLY 19 N 3.54 0.50 4.76 -3.19 0.00 -1.26 -4.66 105.19 104.87 1x4l n GLY 19 Ca -0.20 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.00 1x4l n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x4l n GLY 20 N 0.00 1.08 3.89 -0.02 0.00 -1.26 -4.90 105.19 103.98 1x4l n GLY 20 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1x4l n GLY 20 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x4l s THR 21 N 0.00 4.88 -1.42 2.61 2.01 -1.26 -4.98 115.64 117.48 1x4l s THR 21 Ca 0.00 0.35 -0.13 0.00 0.31 0.00 0.00 61.69 62.23 1x4l s THR 21 Cb 0.00 -3.77 0.07 0.00 0.01 0.00 0.00 72.50 68.81 1x4l s THR 21 CO 0.00 -0.55 2.18 0.29 -0.69 0.00 0.00 174.62 175.85 1x4l n LYS 22 N -1.45 3.11 -4.54 4.92 5.02 -1.26 -4.89 118.16 119.06 1x4l n LYS 22 Ca 0.01 -2.82 -0.26 0.00 -2.02 0.00 0.00 58.31 53.22 1x4l n LYS 22 Cb 0.54 -3.17 -0.08 0.00 -0.02 0.00 0.00 35.03 32.30 1x4l n LYS 22 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 1x4l s TYR 23 N 2.39 1.82 -0.13 2.13 1.13 -1.26 -3.76 117.35 119.66 1x4l s TYR 23 Ca 0.46 -1.21 -0.05 0.00 -1.41 0.00 0.00 57.07 54.87 1x4l s TYR 23 Cb 0.13 -1.23 -0.04 0.00 -1.10 0.00 0.00 41.96 39.73 1x4l s TYR 23 CO -0.07 -0.20 0.05 0.42 -2.51 0.00 0.00 175.55 173.24 1x4l s ILE 24 N -3.17 4.70 -0.03 -3.49 -1.09 0.13 -4.76 121.20 113.48 1x4l s ILE 24 Ca 0.23 -0.09 0.02 0.00 -2.23 0.00 0.00 60.65 58.59 1x4l s ILE 24 Cb 0.03 -3.05 0.00 0.00 -1.58 0.00 0.00 42.46 37.87 1x4l s ILE 24 CO 0.13 0.55 -0.09 -0.55 -1.23 0.00 0.00 174.94 173.75 1x4l s SER 25 N -0.36 1.21 0.41 3.58 0.15 -1.26 -0.28 113.70 117.16 1x4l s SER 25 Ca 0.09 -0.19 0.03 0.00 0.70 0.00 0.00 55.95 56.58 1x4l s SER 25 Cb -0.12 -0.35 -0.04 0.00 -1.71 0.00 0.00 66.02 63.81 1x4l s SER 25 CO 0.02 0.06 0.07 0.12 1.20 0.00 0.00 173.24 174.71 1x4l s PHE 26 N 0.25 1.91 0.11 3.44 5.36 0.91 -4.97 117.98 124.99 1x4l s PHE 26 Ca -0.04 -1.07 -0.12 0.00 -0.96 0.00 0.00 56.93 54.74 1x4l s PHE 26 Cb -0.09 -1.35 0.07 0.00 -0.34 0.00 0.00 43.02 41.31 1x4l s PHE 26 CO 0.01 -0.03 0.84 0.39 -1.46 0.00 0.00 175.22 174.96 1x4l n GLU 27 N -0.95 -0.17 0.00 10.12 1.02 -1.26 -3.86 120.64 125.55 1x4l n GLU 27 Ca -0.08 0.83 0.00 0.00 -0.02 0.00 0.00 57.16 57.89 1x4l n GLU 27 Cb 0.66 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.86 1x4l n GLU 27 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1x4l n GLU 28 N -4.75 0.00 -1.88 3.49 1.02 -1.26 -5.10 120.64 112.15 1x4l n GLU 28 Ca 0.04 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.89 1x4l n GLU 28 Cb 0.19 -0.71 0.11 0.00 -0.02 0.00 0.00 31.44 31.01 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 -1.48 1.68 0.30 3.49 0.52 -1.25 -4.91 118.95 117.29 1x4l s ARG 29 Ca 0.00 0.03 -0.13 0.00 -0.52 0.00 0.00 55.73 55.10 1x4l s ARG 29 Cb 0.00 -1.92 0.01 0.00 0.52 0.00 0.00 34.95 33.56 1x4l s ARG 29 CO 0.00 -1.78 0.59 -0.65 0.02 0.00 0.00 175.30 173.48 1x4l s GLN 30 N -5.62 1.81 0.18 3.54 -0.21 -1.26 -0.06 119.66 118.04 1x4l s GLN 30 Ca 0.64 -1.33 -0.08 0.00 0.02 0.00 0.00 55.36 54.61 1x4l s GLN 30 Cb -0.10 0.53 0.03 0.00 1.00 0.00 0.00 33.01 34.47 1x4l s GLN 30 CO 0.50 -0.79 0.42 0.91 -2.12 0.00 0.00 175.29 174.21 1x4l n TRP 31 N -0.46 -1.57 -4.71 0.91 8.01 0.62 -0.24 117.44 119.99 1x4l n TRP 31 Ca -0.03 -0.89 -0.31 0.00 -1.31 0.00 0.00 57.50 54.96 1x4l n TRP 31 Cb 0.61 0.44 -0.13 0.00 -2.01 0.00 0.00 31.31 30.22 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 -5.30 2.58 0.61 -5.99 3.76 -1.26 0.19 115.29 109.88 1x4l s HIS 32 Ca 0.09 -0.24 0.25 0.00 -0.15 0.00 0.00 55.06 55.00 1x4l s HIS 32 Cb -0.02 -1.49 0.87 0.00 1.11 0.00 0.00 32.58 33.04 1x4l s HIS 32 CO 0.05 0.23 1.30 -0.91 -0.85 0.00 0.00 174.74 174.57 1x4l h ASN 33 N 4.69 0.00 0.00 1.40 -0.26 -1.86 0.51 115.58 120.07 1x4l h ASN 33 Ca -0.47 0.00 -0.31 0.00 -0.56 0.00 0.00 56.30 54.95 1x4l h ASN 33 Cb 1.15 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 38.37 1x4l h ASN 33 CO 0.48 0.00 -2.04 -0.67 -1.06 0.00 0.00 177.43 174.14 1x4l n ASP 34 N -3.20 1.94 -0.10 5.81 2.03 -1.26 -4.59 116.55 117.18 1x4l n ASP 34 Ca 0.21 0.34 -0.05 0.00 0.52 0.00 0.00 54.79 55.80 1x4l n ASP 34 Cb 1.47 -0.79 0.02 0.00 -0.72 0.00 0.00 41.12 41.09 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 -5.17 0.72 -3.73 0.00 7.35 0.16 -4.84 117.46 111.94 1x4l n PHE 36 Ca 0.02 0.24 -0.14 0.00 -0.76 0.00 0.00 57.45 56.81 1x4l n PHE 36 Cb 0.18 -2.17 -0.09 0.00 0.35 0.00 0.00 39.48 37.75 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 8.54 -0.30 1.02 -2.13 0.01 -1.26 -2.93 114.94 117.88 1x4l s ASN 37 Ca 1.24 0.35 -0.22 0.00 -0.71 0.00 0.00 52.86 53.52 1x4l s ASN 37 Cb -0.87 0.47 -0.11 0.00 0.41 0.00 0.00 41.25 41.15 1x4l s ASN 37 CO 0.42 -0.38 -0.92 0.00 -1.51 0.00 0.00 177.10 174.71 1x4l n LYS 39 N 1.25 3.47 -0.12 0.00 3.00 -1.02 -3.51 118.16 121.25 1x4l n LYS 39 Ca -0.01 -0.00 -0.22 0.00 -0.00 0.00 0.00 58.31 58.08 1x4l n LYS 39 Cb 0.67 -1.00 -0.07 0.00 0.00 0.00 0.00 35.03 34.62 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 -1.26 0.54 -0.01 1.64 4.81 -1.26 -4.70 118.16 117.92 1x4l n LYS 40 Ca 0.02 0.23 0.09 0.00 -0.87 0.00 0.00 58.31 57.78 1x4l n LYS 40 Cb 0.17 -1.41 -0.13 0.00 0.02 0.00 0.00 35.03 33.68 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 -1.92 -2.56 -4.85 0.00 2.88 -1.23 -4.97 113.62 100.98 1x4l n SER 42 Ca -0.01 -0.47 -0.28 0.00 -1.33 0.00 0.00 58.87 56.77 1x4l n SER 42 Cb 0.41 -3.97 -0.05 0.00 -0.75 0.00 0.00 64.21 59.85 1x4l n SER 42 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 1x4l s LEU 43 N -5.19 4.02 -0.01 2.46 2.96 -1.26 -4.65 118.68 117.01 1x4l s LEU 43 Ca 0.05 0.04 -0.31 0.00 -0.22 0.00 0.00 54.13 53.69 1x4l s LEU 43 Cb -0.01 -2.64 -0.10 0.00 0.50 0.00 0.00 46.19 43.95 1x4l s LEU 43 CO 0.55 0.11 1.95 -0.24 -1.32 0.00 0.00 176.35 177.40 1x4l n SER 44 N -0.08 3.93 -0.09 3.68 2.88 -1.26 -1.12 113.62 121.56 1x4l n SER 44 Ca -0.08 0.91 -0.10 0.00 -1.33 0.00 0.00 58.87 58.28 1x4l n SER 44 Cb 0.53 -1.48 -0.13 0.00 -0.75 0.00 0.00 64.21 62.39 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 7.32 0.67 -4.28 2.46 4.77 -1.15 -4.91 117.00 121.88 1x4l n LEU 45 Ca 0.21 -0.03 -0.58 0.00 -0.03 0.00 0.00 56.01 55.58 1x4l n LEU 45 Cb 0.37 0.15 -0.12 0.00 -2.33 0.00 0.00 43.42 41.50 1x4l n LEU 45 CO 0.70 0.52 1.76 0.55 -1.33 0.00 0.00 177.39 179.59 1x4l n VAL 46 N -2.74 0.01 -0.86 4.08 3.14 -1.25 0.23 118.33 120.93 1x4l n VAL 46 Ca -0.30 -0.02 0.00 0.00 -2.96 0.00 0.00 64.34 61.06 1x4l n VAL 46 Cb 1.02 -0.59 0.00 0.00 -1.06 0.00 0.00 33.84 33.21 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 7.38 1.29 3.23 7.55 0.00 -1.26 -5.09 105.19 118.29 1x4l n GLY 47 Ca 0.54 -0.38 -0.14 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.27 1.36 -0.32 1.61 0.52 0.13 -5.05 118.95 114.94 1x4l s ARG 48 Ca 0.00 -1.74 -0.05 0.00 -0.52 0.00 0.00 55.73 53.42 1x4l s ARG 48 Cb 0.00 0.29 -0.10 0.00 0.52 0.00 0.00 34.95 35.66 1x4l s ARG 48 CO 0.00 -0.47 3.18 0.41 0.02 0.00 0.00 175.30 178.44 1x4l n GLY 49 N -0.37 3.73 3.51 -3.53 0.00 -1.26 -4.97 105.19 102.29 1x4l n GLY 49 Ca 0.04 -1.55 -0.36 0.00 0.00 0.00 0.00 46.02 44.14 1x4l n GLY 49 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1x4l n PHE 50 N 1.81 -0.37 -3.27 1.61 -1.74 -1.26 -4.40 117.46 109.83 1x4l n PHE 50 Ca 0.48 0.37 -0.21 0.00 -0.56 0.00 0.00 57.45 57.53 1x4l n PHE 50 Cb 0.70 -1.97 0.05 0.00 1.52 0.00 0.00 39.48 39.78 1x4l n PHE 50 CO 0.00 0.00 0.00 1.28 -0.56 0.00 0.00 176.76 177.48 1x4l n LEU 51 N -0.60 0.00 -3.81 5.98 4.32 0.69 -4.96 117.00 118.63 1x4l n LEU 51 Ca 0.11 -2.57 -0.30 0.00 -0.02 0.00 0.00 56.01 53.23 1x4l n LEU 51 Cb 0.49 -0.31 -0.15 0.00 -1.62 0.00 0.00 43.42 41.83 1x4l n LEU 51 CO 0.50 -0.67 -0.33 0.42 -1.22 0.00 0.00 177.39 176.09 1x4l s THR 52 N -2.58 1.25 0.81 -5.08 -4.23 -1.26 -3.49 115.64 101.05 1x4l s THR 52 Ca 0.52 -1.67 -0.12 0.00 -1.18 0.00 0.00 61.69 59.24 1x4l s THR 52 Cb -0.04 -1.94 0.08 0.00 1.34 0.00 0.00 72.50 71.94 1x4l s THR 52 CO 0.33 -0.66 1.11 -0.70 -0.54 0.00 0.00 174.62 174.15 1x4l s GLU 53 N 1.40 1.99 0.02 3.99 2.12 0.61 -4.95 118.70 123.88 1x4l s GLU 53 Ca 0.10 0.51 -0.04 0.00 0.36 0.00 0.00 54.97 55.91 1x4l s GLU 53 Cb -0.18 -1.92 -0.01 0.00 0.26 0.00 0.00 34.13 32.29 1x4l s GLU 53 CO -0.20 -1.66 0.77 0.54 -0.54 0.00 0.00 175.26 174.16 1x4l n ARG 54 N -3.44 -0.05 -0.63 4.30 1.74 -1.26 -2.74 116.66 114.58 1x4l n ARG 54 Ca 0.07 0.76 0.06 0.00 -0.77 0.00 0.00 57.85 57.97 1x4l n ARG 54 Cb 0.57 -1.14 0.13 0.00 -1.02 0.00 0.00 32.46 31.01 1x4l n ARG 54 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1x4l n ASP 55 N -3.07 1.53 -3.25 0.55 9.92 -1.26 -5.06 116.55 115.90 1x4l n ASP 55 Ca 0.00 -3.11 -0.10 0.00 -0.53 0.00 0.00 54.79 51.05 1x4l n ASP 55 Cb 0.03 -0.42 -0.01 0.00 -0.64 0.00 0.00 41.12 40.08 1x4l n ASP 55 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1x4l s ASP 56 N -2.65 0.24 0.24 -2.24 1.01 -1.11 -5.18 116.67 106.98 1x4l s ASP 56 Ca 0.31 -1.16 0.12 0.00 0.71 0.00 0.00 52.55 52.52 1x4l s ASP 56 Cb 0.31 0.75 -0.05 0.00 1.01 0.00 0.00 42.92 44.94 1x4l s ASP 56 CO -0.06 -1.47 -0.21 0.27 0.21 0.00 0.00 175.17 173.92 1x4l s ILE 57 N -2.92 2.48 0.21 0.77 -4.36 -1.26 0.23 121.20 116.34 1x4l s ILE 57 Ca 0.20 -2.21 -0.09 0.00 -0.26 0.00 0.00 60.65 58.29 1x4l s ILE 57 Cb -0.03 -2.25 -0.01 0.00 1.25 0.00 0.00 42.46 41.41 1x4l s ILE 57 CO 0.13 -0.27 0.34 -0.76 0.24 0.00 0.00 174.94 174.62 1x4l s LEU 58 N -3.13 0.71 0.19 0.37 1.43 -1.23 -2.42 118.68 114.59 1x4l s LEU 58 Ca 0.26 -1.01 0.04 0.00 -1.03 0.00 0.00 54.13 52.39 1x4l s LEU 58 Cb -0.06 1.28 -0.03 0.00 0.03 0.00 0.00 46.19 47.40 1x4l s LEU 58 CO 0.13 -0.99 0.29 0.00 0.23 0.00 0.00 176.35 176.00 1x4l h PRO 60 N 1.81 0.30 -0.38 0.00 0.11 -1.93 0.52 132.00 132.43 1x4l h PRO 60 Ca -0.50 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.53 1x4l h PRO 60 Cb 1.21 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 1x4l h PRO 60 CO 0.65 0.20 -0.05 -0.44 -0.21 0.00 0.00 178.00 178.15 1x4l h ASP 61 N 0.31 0.60 0.00 -2.05 3.32 -1.96 -0.55 116.42 116.08 1x4l h ASP 61 Ca 0.62 -0.14 -0.09 0.00 0.02 0.00 0.00 57.03 57.44 1x4l h ASP 61 Cb 1.74 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 41.11 1x4l h ASP 61 CO -0.28 0.71 -0.67 0.00 -1.72 0.00 0.00 179.24 177.28 1x4l h GLY 63 N -1.00 1.33 -0.21 0.00 0.00 -0.29 -0.30 103.07 102.61 1x4l h GLY 63 Ca -0.14 -0.30 0.31 0.00 0.00 0.00 0.00 47.33 47.21 1x4l h GLY 63 CO -0.08 0.07 0.78 0.07 0.00 0.00 0.00 176.54 177.37 1x4l h LYS 64 N 0.74 0.06 -1.06 4.80 5.09 -1.27 0.54 116.57 125.47 1x4l h LYS 64 Ca 0.43 -0.00 -0.19 0.00 0.09 0.00 0.00 60.65 60.97 1x4l h LYS 64 Cb 0.48 -0.01 -0.11 0.00 0.10 0.00 0.00 32.23 32.68 1x4l h LYS 64 CO -0.29 0.04 0.24 -3.47 -2.09 0.00 0.00 179.45 173.88 1x4l n ASP 65 N -4.27 3.53 -4.34 7.07 2.03 -0.12 -4.85 116.55 115.60 1x4l n ASP 65 Ca 0.24 -2.60 -0.30 0.00 0.52 0.00 0.00 54.79 52.66 1x4l n ASP 65 Cb 1.13 -0.66 -0.15 0.00 -0.72 0.00 0.00 41.12 40.72 1x4l n ASP 65 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1x4l s ILE 66 N -1.21 2.13 -1.16 5.18 1.01 0.19 -4.70 121.20 122.63 1x4l s ILE 66 Ca 0.20 -1.41 -0.07 0.00 0.00 0.00 0.00 60.65 59.37 1x4l s ILE 66 Cb 0.17 -1.83 0.01 0.00 0.01 0.00 0.00 42.46 40.82 1x4l s ILE 66 CO 0.03 0.34 1.01 -1.20 0.00 0.00 0.00 174.94 175.12 1x4l n SER 67 N 1.71 -5.25 0.00 3.58 7.64 -1.26 -5.01 113.62 115.03 1x4l n SER 67 Ca -0.17 -0.48 0.00 0.00 1.01 0.00 0.00 58.87 59.23 1x4l n SER 67 Cb 0.52 -4.47 0.00 0.00 -1.01 0.00 0.00 64.21 59.25 1x4l n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x4l n GLY 68 N -1.71 2.40 3.57 0.23 0.00 -1.26 -4.95 105.19 103.47 1x4l n GLY 68 Ca -0.03 -1.74 -0.28 0.00 0.00 0.00 0.00 46.02 43.97 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 4.91 2.51 0.34 1.61 0.04 -1.26 -4.87 135.00 138.29 1x4l s PRO 69 Ca 0.00 -0.88 0.08 0.00 0.04 0.00 0.00 61.00 60.24 1x4l s PRO 69 Cb 0.00 -5.18 -0.03 0.00 0.04 0.00 0.00 34.50 29.33 1x4l s PRO 69 CO 0.00 -3.80 0.28 0.43 0.04 0.00 0.00 177.00 173.95 1x4l n SER 70 N 14.29 -0.62 -4.61 6.66 7.64 -1.26 -5.11 113.62 130.61 1x4l n SER 70 Ca 0.43 -3.24 -0.43 0.00 1.01 0.00 0.00 58.87 56.64 1x4l n SER 70 Cb 0.47 1.68 -0.02 0.00 -1.01 0.00 0.00 64.21 65.32 1x4l n SER 70 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x4l s SER 71 N -3.39 6.46 0.00 6.43 0.01 -1.26 -5.19 113.70 116.76 1x4l s SER 71 Ca 0.40 0.93 0.00 0.00 1.31 0.00 0.00 55.95 58.59 1x4l s SER 71 Cb 0.02 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.71 1x4l s SER 71 CO 0.28 -1.31 0.00 0.61 0.41 0.00 0.00 173.24 173.24