#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 0.44 -4.52 1.61 2.88 -1.26 -5.11 113.62 107.66 1x4l n SER 2 Ca 0.00 0.12 -0.25 0.00 -1.33 0.00 0.00 58.87 57.42 1x4l n SER 2 Cb 0.00 -0.09 -0.11 0.00 -0.75 0.00 0.00 64.21 63.27 1x4l n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1x4l s SER 3 N -5.41 3.31 0.37 -3.46 0.01 -1.26 -5.16 113.70 102.09 1x4l s SER 3 Ca 0.00 -1.26 0.01 0.00 1.31 0.00 0.00 55.95 56.01 1x4l s SER 3 Cb 0.00 -0.27 -0.00 0.00 0.21 0.00 0.00 66.02 65.95 1x4l s SER 3 CO 0.00 -0.36 0.04 0.61 0.41 0.00 0.00 173.24 173.94 1x4l n GLY 4 N -0.76 3.62 3.77 3.44 0.00 -1.26 -5.13 105.19 108.87 1x4l n GLY 4 Ca -0.05 -2.25 -0.37 0.00 0.00 0.00 0.00 46.02 43.35 1x4l n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x4l s SER 5 N -3.09 6.18 -0.27 1.61 0.15 -1.26 -5.04 113.70 111.97 1x4l s SER 5 Ca 0.05 2.27 -0.25 0.00 0.70 0.00 0.00 55.95 58.72 1x4l s SER 5 Cb 0.00 -2.60 0.12 0.00 -1.71 0.00 0.00 66.02 61.83 1x4l s SER 5 CO 0.04 -0.91 0.99 -0.55 1.20 0.00 0.00 173.24 174.01 1x4l s SER 6 N -1.41 -0.48 0.00 5.45 0.15 -1.26 -5.06 113.70 111.08 1x4l s SER 6 Ca 0.64 0.92 0.00 0.00 0.70 0.00 0.00 55.95 58.20 1x4l s SER 6 Cb -0.28 0.92 0.00 0.00 -1.71 0.00 0.00 66.02 64.96 1x4l s SER 6 CO 0.33 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.21 1x4l n GLY 7 N 2.19 -0.04 3.53 9.45 0.00 -1.22 -4.05 105.19 115.05 1x4l n GLY 7 Ca -0.13 0.56 -0.41 0.00 0.00 0.00 0.00 46.02 46.04 1x4l n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x4l h ALA 9 N 9.88 2.64 -0.12 0.00 0.00 -0.95 0.52 119.26 131.23 1x4l h ALA 9 Ca -0.21 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1x4l h ALA 9 Cb 1.05 0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1x4l h ALA 9 CO 1.27 -1.29 0.00 0.41 0.00 0.00 0.00 179.25 179.65 1x4l n GLY 10 N -1.48 -2.83 1.70 0.00 0.00 -1.26 -2.58 105.19 98.73 1x4l n GLY 10 Ca 0.37 0.31 0.05 0.00 0.00 0.00 0.00 46.02 46.76 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 0.50 -1.16 -4.37 0.00 -2.24 0.18 -4.90 114.28 102.28 1x4l n THR 12 Ca 0.24 -0.35 -0.25 0.00 -2.27 0.00 0.00 64.05 61.42 1x4l n THR 12 Cb 1.07 -1.03 -0.12 0.00 -2.10 0.00 0.00 70.33 68.15 1x4l n THR 12 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1x4l s ASN 13 N -3.97 3.06 -0.51 3.42 6.03 -1.19 -4.93 114.94 116.83 1x4l s ASN 13 Ca 0.16 -0.81 -0.27 0.00 -1.03 0.00 0.00 52.86 50.90 1x4l s ASN 13 Cb -0.09 -0.20 -0.02 0.00 -3.03 0.00 0.00 41.25 37.91 1x4l s ASN 13 CO 0.64 0.08 1.80 -2.16 -2.03 0.00 0.00 177.10 175.43 1x4l s PRO 14 N -2.47 2.92 -1.07 3.55 0.04 -1.26 -1.26 135.00 135.45 1x4l s PRO 14 Ca 0.16 0.87 -0.24 0.00 0.04 0.00 0.00 61.00 61.83 1x4l s PRO 14 Cb -0.08 -4.30 -0.10 0.00 0.04 0.00 0.00 34.50 30.06 1x4l s PRO 14 CO 0.07 -2.38 1.99 0.42 0.04 0.00 0.00 177.00 177.15 1x4l s ILE 15 N 8.11 3.41 -0.28 0.56 1.01 -1.26 -4.78 121.20 127.98 1x4l s ILE 15 Ca 0.70 -0.59 0.01 0.00 0.00 0.00 0.00 60.65 60.77 1x4l s ILE 15 Cb -0.15 -4.23 0.17 0.00 0.01 0.00 0.00 42.46 38.25 1x4l s ILE 15 CO 0.25 -0.79 0.48 -0.94 0.00 0.00 0.00 174.94 173.95 1x4l s SER 16 N 7.49 -0.47 0.00 3.58 1.04 -1.26 -5.02 113.70 119.06 1x4l s SER 16 Ca 0.72 0.19 0.00 0.00 0.48 0.00 0.00 55.95 57.34 1x4l s SER 16 Cb -0.04 1.54 0.00 0.00 0.10 0.00 0.00 66.02 67.62 1x4l s SER 16 CO 0.10 -0.31 0.00 0.61 0.98 0.00 0.00 173.24 174.62 1x4l n GLY 17 N 5.39 6.16 0.29 7.32 0.00 -1.26 -5.00 105.19 118.09 1x4l n GLY 17 Ca -0.00 -1.81 -0.02 0.00 0.00 0.00 0.00 46.02 44.19 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 -0.54 0.00 0.99 4.77 -1.26 -4.74 117.00 116.22 1x4l n LEU 18 Ca 0.00 1.31 0.00 0.00 -0.03 0.00 0.00 56.01 57.29 1x4l n LEU 18 Cb 0.00 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 1x4l n LEU 18 CO 0.00 -1.16 0.00 0.61 -1.33 0.00 0.00 177.39 175.51 1x4l n GLY 19 N -1.33 -0.07 0.00 -0.72 0.00 -1.26 -5.08 105.19 96.74 1x4l n GLY 19 Ca 0.07 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 0.00 3.80 -0.02 0.00 -1.26 -5.16 105.19 102.55 1x4l n GLY 20 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 4.42 -0.87 2.61 2.01 -1.26 -4.94 115.64 117.61 1x4l s THR 21 Ca 0.00 1.53 0.01 0.00 0.31 0.00 0.00 61.69 63.54 1x4l s THR 21 Cb 0.00 -3.97 0.06 0.00 0.01 0.00 0.00 72.50 68.60 1x4l s THR 21 CO 0.00 0.26 0.63 0.29 -0.69 0.00 0.00 174.62 175.11 1x4l n LYS 22 N 0.88 1.26 -1.45 4.92 5.02 -1.26 -4.93 118.16 122.60 1x4l n LYS 22 Ca -0.02 -0.22 -0.39 0.00 -2.02 0.00 0.00 58.31 55.66 1x4l n LYS 22 Cb 0.50 -1.52 0.03 0.00 -0.02 0.00 0.00 35.03 34.02 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 0.07 -0.77 -2.49 2.13 4.11 -1.26 -4.63 117.16 114.32 1x4l n TYR 23 Ca 0.02 0.47 -0.43 0.00 -0.00 0.00 0.00 57.90 57.97 1x4l n TYR 23 Cb 0.34 -1.95 -0.02 0.00 -0.00 0.00 0.00 39.34 37.71 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 -1.68 4.36 -0.21 -3.48 -1.09 0.19 -4.93 121.20 114.37 1x4l s ILE 24 Ca 0.67 1.66 0.01 0.00 -2.23 0.00 0.00 60.65 60.77 1x4l s ILE 24 Cb -0.48 -4.07 0.03 0.00 -1.58 0.00 0.00 42.46 36.36 1x4l s ILE 24 CO 0.56 -0.06 -0.17 -0.94 -1.23 0.00 0.00 174.94 173.10 1x4l s SER 25 N 1.57 3.55 0.49 3.58 1.04 -1.26 -0.09 113.70 122.58 1x4l s SER 25 Ca 0.53 -0.87 0.06 0.00 0.48 0.00 0.00 55.95 56.15 1x4l s SER 25 Cb -0.22 -1.51 0.00 0.00 0.10 0.00 0.00 66.02 64.40 1x4l s SER 25 CO 0.18 -0.06 0.32 0.12 0.98 0.00 0.00 173.24 174.77 1x4l s PHE 26 N 1.24 2.03 0.04 5.02 5.36 0.53 -5.00 117.98 127.20 1x4l s PHE 26 Ca 0.01 -0.74 -0.08 0.00 -0.96 0.00 0.00 56.93 55.15 1x4l s PHE 26 Cb -0.15 -1.94 -0.02 0.00 -0.34 0.00 0.00 43.02 40.57 1x4l s PHE 26 CO -0.10 -0.22 0.68 0.39 -1.46 0.00 0.00 175.22 174.51 1x4l n GLU 27 N -1.57 -0.12 0.00 10.12 -0.58 -1.26 -3.89 120.64 123.33 1x4l n GLU 27 Ca -0.02 0.67 0.00 0.00 -0.42 0.00 0.00 57.16 57.39 1x4l n GLU 27 Cb 0.64 -0.99 0.00 0.00 -0.57 0.00 0.00 31.44 30.52 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 -3.63 0.99 -2.12 3.49 1.02 -1.26 -5.07 120.64 114.05 1x4l n GLU 28 Ca 0.01 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.87 1x4l n GLU 28 Cb 0.07 -0.91 0.07 0.00 -0.02 0.00 0.00 31.44 30.64 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 -1.83 2.33 0.23 3.49 0.52 -1.25 -5.01 118.95 117.42 1x4l s ARG 29 Ca 0.00 -0.05 -0.18 0.00 -0.52 0.00 0.00 55.73 54.98 1x4l s ARG 29 Cb 0.00 -2.12 0.02 0.00 0.52 0.00 0.00 34.95 33.38 1x4l s ARG 29 CO 0.00 -1.22 0.57 -0.65 0.02 0.00 0.00 175.30 174.02 1x4l s GLN 30 N -5.30 1.51 0.22 3.54 -0.21 -1.22 -0.34 119.66 117.85 1x4l s GLN 30 Ca 0.59 -0.95 -0.06 0.00 0.02 0.00 0.00 55.36 54.97 1x4l s GLN 30 Cb -0.11 0.54 0.02 0.00 1.00 0.00 0.00 33.01 34.46 1x4l s GLN 30 CO 0.47 -0.66 0.39 0.91 -2.12 0.00 0.00 175.29 174.28 1x4l n TRP 31 N -0.38 -1.51 -4.04 0.91 8.01 0.87 -0.27 117.44 121.03 1x4l n TRP 31 Ca -0.07 -1.16 -0.22 0.00 -1.31 0.00 0.00 57.50 54.74 1x4l n TRP 31 Cb 0.62 0.45 -0.05 0.00 -2.01 0.00 0.00 31.31 30.32 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 -4.67 2.88 0.60 -5.99 3.76 -1.26 0.55 115.29 111.16 1x4l s HIS 32 Ca 0.12 -0.26 0.29 0.00 -0.15 0.00 0.00 55.06 55.06 1x4l s HIS 32 Cb -0.02 -1.56 1.64 0.00 1.11 0.00 0.00 32.58 33.75 1x4l s HIS 32 CO 0.09 0.38 2.05 -0.91 -0.85 0.00 0.00 174.74 175.49 1x4l h ASN 33 N 1.48 0.00 0.00 1.40 -0.26 -1.92 0.15 115.58 116.43 1x4l h ASN 33 Ca -0.45 0.00 -0.37 0.00 -0.56 0.00 0.00 56.30 54.91 1x4l h ASN 33 Cb 1.25 0.00 -0.06 0.00 -1.06 0.00 0.00 38.32 38.45 1x4l h ASN 33 CO 0.60 0.00 -2.24 0.47 -1.06 0.00 0.00 177.43 175.21 1x4l n ASP 34 N -3.69 1.56 -0.19 5.81 9.92 -1.26 -4.60 116.55 124.10 1x4l n ASP 34 Ca 0.03 0.27 -0.01 0.00 -0.53 0.00 0.00 54.79 54.55 1x4l n ASP 34 Cb 0.40 -0.65 0.09 0.00 -0.64 0.00 0.00 41.12 40.32 1x4l n ASP 34 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1x4l n PHE 36 N -4.99 0.83 -3.84 0.00 7.35 0.51 -4.83 117.46 112.49 1x4l n PHE 36 Ca 0.08 0.09 -0.12 0.00 -0.76 0.00 0.00 57.45 56.73 1x4l n PHE 36 Cb 0.25 -2.05 -0.09 0.00 0.35 0.00 0.00 39.48 37.93 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 8.16 -0.03 1.03 -2.13 0.01 -1.26 -2.34 114.94 118.38 1x4l s ASN 37 Ca 1.11 -0.13 -0.22 0.00 -0.71 0.00 0.00 52.86 52.92 1x4l s ASN 37 Cb -0.51 0.23 -0.07 0.00 0.41 0.00 0.00 41.25 41.31 1x4l s ASN 37 CO 0.32 -0.39 -0.77 0.00 -1.51 0.00 0.00 177.10 174.74 1x4l n LYS 39 N 0.68 0.70 -0.08 0.00 0.00 -0.93 -3.43 118.16 115.09 1x4l n LYS 39 Ca -0.00 -0.12 -0.07 0.00 0.00 0.00 0.00 58.31 58.11 1x4l n LYS 39 Cb 0.66 -1.36 -0.02 0.00 0.00 0.00 0.00 35.03 34.31 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 -1.95 0.49 0.03 1.64 4.81 -1.26 -4.63 118.16 117.28 1x4l n LYS 40 Ca -0.02 0.34 0.11 0.00 -0.87 0.00 0.00 58.31 57.87 1x4l n LYS 40 Cb 0.39 -1.53 -0.01 0.00 0.02 0.00 0.00 35.03 33.91 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 -2.02 -4.25 -4.83 0.00 2.88 -1.22 -4.94 113.62 99.25 1x4l n SER 42 Ca 0.01 -0.68 -0.29 0.00 -1.33 0.00 0.00 58.87 56.58 1x4l n SER 42 Cb 0.45 -5.10 -0.05 0.00 -0.75 0.00 0.00 64.21 58.76 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 -5.92 3.97 -0.13 2.46 2.96 -1.26 -4.60 118.68 116.17 1x4l s LEU 43 Ca 0.23 0.05 -0.33 0.00 -0.22 0.00 0.00 54.13 53.85 1x4l s LEU 43 Cb -0.03 -2.61 -0.10 0.00 0.50 0.00 0.00 46.19 43.94 1x4l s LEU 43 CO 0.74 0.14 1.98 -0.24 -1.32 0.00 0.00 176.35 177.66 1x4l n SER 44 N 0.20 3.35 -0.10 3.68 2.88 -1.26 -1.10 113.62 121.27 1x4l n SER 44 Ca -0.08 0.79 -0.10 0.00 -1.33 0.00 0.00 58.87 58.15 1x4l n SER 44 Cb 0.52 -1.40 -0.15 0.00 -0.75 0.00 0.00 64.21 62.43 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 7.87 0.22 -4.32 2.46 4.77 -0.99 -4.91 117.00 122.11 1x4l n LEU 45 Ca 0.26 -0.01 -0.56 0.00 -0.03 0.00 0.00 56.01 55.67 1x4l n LEU 45 Cb 0.32 0.38 -0.11 0.00 -2.33 0.00 0.00 43.42 41.68 1x4l n LEU 45 CO 0.72 0.51 1.78 0.55 -1.33 0.00 0.00 177.39 179.62 1x4l n VAL 46 N -2.75 0.05 -0.90 4.08 3.14 -1.24 0.00 118.33 120.72 1x4l n VAL 46 Ca -0.32 -0.08 0.00 0.00 -2.96 0.00 0.00 64.34 60.98 1x4l n VAL 46 Cb 1.12 -0.84 0.00 0.00 -1.06 0.00 0.00 33.84 33.05 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 7.16 1.25 3.34 7.55 0.00 -1.26 -5.09 105.19 118.13 1x4l n GLY 47 Ca 0.52 -0.37 -0.17 0.00 0.00 0.00 0.00 46.02 46.00 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 1.74 -1.25 1.61 0.52 0.10 -5.06 118.95 114.35 1x4l s ARG 48 Ca 0.00 -1.90 -0.05 0.00 -0.52 0.00 0.00 55.73 53.26 1x4l s ARG 48 Cb 0.00 0.35 0.13 0.00 0.52 0.00 0.00 34.95 35.96 1x4l s ARG 48 CO 0.00 -0.66 2.37 0.41 0.02 0.00 0.00 175.30 177.44 1x4l n GLY 49 N -0.57 5.24 3.73 -3.53 0.00 -1.26 -4.99 105.19 103.81 1x4l n GLY 49 Ca 0.05 -2.08 -0.36 0.00 0.00 0.00 0.00 46.02 43.63 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 -1.43 2.15 0.31 1.61 -0.71 -1.26 -4.27 117.98 114.37 1x4l s PHE 50 Ca 0.53 1.51 0.04 0.00 -1.04 0.00 0.00 56.93 57.98 1x4l s PHE 50 Cb 0.20 -3.60 0.05 0.00 -1.21 0.00 0.00 43.02 38.46 1x4l s PHE 50 CO -0.11 -2.69 0.43 1.28 -1.34 0.00 0.00 175.22 172.79 1x4l n LEU 51 N -1.97 0.00 -3.71 -1.99 4.32 0.77 -4.97 117.00 109.44 1x4l n LEU 51 Ca 0.15 -1.27 -0.30 0.00 -0.02 0.00 0.00 56.01 54.57 1x4l n LEU 51 Cb 0.49 -0.23 -0.15 0.00 -1.62 0.00 0.00 43.42 41.91 1x4l n LEU 51 CO 0.46 -0.63 -0.33 0.42 -1.22 0.00 0.00 177.39 176.10 1x4l s THR 52 N -0.94 0.77 0.84 -5.08 -4.23 -1.26 -3.63 115.64 102.12 1x4l s THR 52 Ca 0.32 -1.35 -0.12 0.00 -1.18 0.00 0.00 61.69 59.36 1x4l s THR 52 Cb -0.02 -1.59 0.10 0.00 1.34 0.00 0.00 72.50 72.32 1x4l s THR 52 CO 0.20 -0.69 1.16 -0.70 -0.54 0.00 0.00 174.62 174.06 1x4l s GLU 53 N 1.65 1.71 0.00 3.99 2.56 0.55 -4.96 118.70 124.21 1x4l s GLU 53 Ca 0.10 0.20 0.00 0.00 0.00 0.00 0.00 54.97 55.26 1x4l s GLU 53 Cb -0.17 -1.91 0.00 0.00 2.00 0.00 0.00 34.13 34.04 1x4l s GLU 53 CO -0.26 -1.79 0.60 0.54 -0.56 0.00 0.00 175.26 173.79 1x4l n ARG 54 N -3.46 0.00 -0.82 4.30 1.74 -1.26 -2.92 116.66 114.24 1x4l n ARG 54 Ca 0.07 0.60 0.06 0.00 -0.77 0.00 0.00 57.85 57.81 1x4l n ARG 54 Cb 0.60 -0.94 0.15 0.00 -1.02 0.00 0.00 32.46 31.26 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 -2.28 1.52 -3.83 0.55 9.92 -1.26 -5.06 116.55 116.12 1x4l n ASP 55 Ca 0.00 -3.35 -0.08 0.00 -0.53 0.00 0.00 54.79 50.83 1x4l n ASP 55 Cb 0.00 -0.46 -0.03 0.00 -0.64 0.00 0.00 41.12 39.99 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 -2.87 -0.26 0.21 -2.24 1.01 -1.15 -5.18 116.67 106.19 1x4l s ASP 56 Ca 0.36 -0.59 0.08 0.00 0.71 0.00 0.00 52.55 53.11 1x4l s ASP 56 Cb 0.37 0.68 -0.04 0.00 1.01 0.00 0.00 42.92 44.94 1x4l s ASP 56 CO -0.09 -1.25 0.00 0.27 0.21 0.00 0.00 175.17 174.31 1x4l s ILE 57 N -3.91 3.63 0.23 0.77 -4.36 -1.26 0.20 121.20 116.50 1x4l s ILE 57 Ca 0.12 -1.60 -0.09 0.00 -0.26 0.00 0.00 60.65 58.81 1x4l s ILE 57 Cb -0.04 -2.87 -0.01 0.00 1.25 0.00 0.00 42.46 40.79 1x4l s ILE 57 CO 0.04 -0.21 0.37 -0.76 0.24 0.00 0.00 174.94 174.62 1x4l s LEU 58 N -3.23 0.59 0.22 0.37 1.43 -1.24 -2.20 118.68 114.62 1x4l s LEU 58 Ca 0.29 -1.04 0.04 0.00 -1.03 0.00 0.00 54.13 52.39 1x4l s LEU 58 Cb -0.08 1.36 -0.03 0.00 0.03 0.00 0.00 46.19 47.47 1x4l s LEU 58 CO 0.19 -1.04 0.35 0.00 0.23 0.00 0.00 176.35 176.08 1x4l h PRO 60 N 1.42 0.53 -0.90 0.00 0.11 -1.94 0.64 132.00 131.86 1x4l h PRO 60 Ca -0.51 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.58 1x4l h PRO 60 Cb 1.22 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.17 1x4l h PRO 60 CO 0.63 0.35 0.59 0.22 -0.21 0.00 0.00 178.00 179.59 1x4l h ASP 61 N 0.55 1.04 0.00 -2.05 3.58 -1.95 -0.93 116.42 116.66 1x4l h ASP 61 Ca 0.66 -0.03 -0.01 0.00 0.42 0.00 0.00 57.03 58.06 1x4l h ASP 61 Cb 1.29 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 42.08 1x4l h ASP 61 CO -0.49 0.76 -0.23 0.00 -2.88 0.00 0.00 179.24 176.40 1x4l h GLY 63 N -1.00 1.03 1.95 0.00 0.00 0.07 0.89 103.07 106.01 1x4l h GLY 63 Ca -0.02 -0.14 -0.16 0.00 0.00 0.00 0.00 47.33 47.01 1x4l h GLY 63 CO -0.01 -0.20 -0.75 0.07 0.00 0.00 0.00 176.54 175.65 1x4l h LYS 64 N 0.22 0.05 -1.66 4.80 2.10 -1.31 -3.26 116.57 117.51 1x4l h LYS 64 Ca 0.68 -0.05 -0.66 0.00 -2.00 0.00 0.00 60.65 58.62 1x4l h LYS 64 Cb 2.05 0.01 -0.35 0.00 -0.90 0.00 0.00 32.23 33.03 1x4l h LYS 64 CO -0.29 0.77 0.06 -0.25 -2.00 0.00 0.00 179.45 177.74 1x4l n ASP 65 N -3.68 5.98 -4.60 7.07 8.00 0.30 -4.75 116.55 124.88 1x4l n ASP 65 Ca -0.01 -3.77 -0.42 0.00 0.71 0.00 0.00 54.79 51.29 1x4l n ASP 65 Cb 0.72 -0.72 -0.05 0.00 -0.02 0.00 0.00 41.12 41.05 1x4l n ASP 65 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1x4l s ILE 66 N -5.28 4.78 -1.48 0.53 -1.09 -0.73 -4.09 121.20 113.84 1x4l s ILE 66 Ca 0.50 0.98 -0.09 0.00 -2.23 0.00 0.00 60.65 59.81 1x4l s ILE 66 Cb 0.42 -4.16 0.06 0.00 -1.58 0.00 0.00 42.46 37.20 1x4l s ILE 66 CO -0.27 -0.33 0.84 -0.24 -1.23 0.00 0.00 174.94 173.71 1x4l n SER 67 N 6.27 -3.29 0.00 3.58 2.88 -1.26 -4.88 113.62 116.91 1x4l n SER 67 Ca 0.03 -0.83 0.00 0.00 -1.33 0.00 0.00 58.87 56.74 1x4l n SER 67 Cb 0.48 -3.76 0.00 0.00 -0.75 0.00 0.00 64.21 60.18 1x4l n SER 67 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4l n GLY 68 N -1.67 4.19 1.59 0.46 0.00 -1.26 -5.17 105.19 103.34 1x4l n GLY 68 Ca -0.08 -0.48 -0.14 0.00 0.00 0.00 0.00 46.02 45.33 1x4l n GLY 68 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x4l n PRO 69 N -1.28 -2.00 -4.19 1.61 -0.04 -1.26 -4.35 135.00 123.50 1x4l n PRO 69 Ca 0.00 -0.79 -0.18 0.00 -0.04 0.00 0.00 63.50 62.48 1x4l n PRO 69 Cb 0.00 -0.74 -0.12 0.00 -0.04 0.00 0.00 33.50 32.60 1x4l n PRO 69 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x4l s SER 70 N -2.84 1.77 -0.06 3.54 0.15 -1.26 -4.87 113.70 110.13 1x4l s SER 70 Ca 0.32 -0.66 -0.19 0.00 0.70 0.00 0.00 55.95 56.13 1x4l s SER 70 Cb -0.03 -0.06 -0.14 0.00 -1.71 0.00 0.00 66.02 64.09 1x4l s SER 70 CO 0.25 -0.09 0.75 0.28 1.20 0.00 0.00 173.24 175.63 1x4l h SER 71 N 4.13 -0.20 0.00 5.45 0.02 -1.98 -3.53 113.55 117.44 1x4l h SER 71 Ca -0.41 -0.30 0.00 0.00 -0.84 0.00 0.00 61.79 60.24 1x4l h SER 71 Cb 1.19 0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.78 1x4l h SER 71 CO 0.42 0.36 0.00 0.61 -1.14 0.00 0.00 176.83 177.08