#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4l h SER 2 N 0.00 -0.79 -3.69 1.61 0.02 -2.13 -3.33 113.55 105.25 1x4l h SER 2 Ca 0.00 0.12 -0.74 0.00 -0.84 0.00 0.00 61.79 60.33 1x4l h SER 2 Cb 0.00 0.34 -0.30 0.00 0.14 0.00 0.00 62.40 62.58 1x4l h SER 2 CO 0.00 -0.32 -0.24 -0.55 -1.14 0.00 0.00 176.83 174.58 1x4l s SER 3 N -4.93 5.88 -0.16 3.07 0.15 -1.26 -5.02 113.70 111.44 1x4l s SER 3 Ca -0.15 -2.41 -0.33 0.00 0.70 0.00 0.00 55.95 53.76 1x4l s SER 3 Cb 0.10 -2.03 0.13 0.00 -1.71 0.00 0.00 66.02 62.52 1x4l s SER 3 CO 0.66 -0.57 1.15 -0.83 1.20 0.00 0.00 173.24 174.85 1x4l s GLY 4 N 1.98 -0.30 -0.30 9.45 0.00 -1.25 -5.15 107.32 111.74 1x4l s GLY 4 Ca 0.12 1.59 -0.09 0.00 0.00 0.00 0.00 44.72 46.34 1x4l s GLY 4 CO -0.04 0.56 0.89 -1.35 0.00 0.00 0.00 173.10 173.17 1x4l s SER 5 N -2.11 -0.78 -0.48 1.64 1.04 -1.26 -5.10 113.70 106.65 1x4l s SER 5 Ca 0.08 0.51 -0.34 0.00 0.48 0.00 0.00 55.95 56.68 1x4l s SER 5 Cb -0.01 1.66 -0.16 0.00 0.10 0.00 0.00 66.02 67.61 1x4l s SER 5 CO -0.05 -0.15 1.82 -1.54 0.98 0.00 0.00 173.24 174.30 1x4l n SER 6 N 5.44 0.54 0.00 7.02 3.41 -1.26 -4.65 113.62 124.13 1x4l n SER 6 Ca -0.05 0.48 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 1x4l n SER 6 Cb 0.53 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 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 5.94 -0.72 3.55 5.00 0.00 -1.26 -4.72 105.19 112.98 1x4l n GLY 7 Ca 0.46 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 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 10.39 2.55 -2.83 0.00 0.00 -1.50 -0.08 119.26 127.78 1x4l h ALA 9 Ca -0.22 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1x4l h ALA 9 Cb 1.05 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1x4l h ALA 9 CO 1.29 -1.04 0.00 0.41 0.00 0.00 0.00 179.25 179.91 1x4l n GLY 10 N -1.61 -3.04 1.49 0.00 0.00 -1.26 -3.37 105.19 97.39 1x4l n GLY 10 Ca 0.15 0.12 -0.08 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.14 -0.87 -4.15 0.00 -2.24 -0.06 -4.90 114.28 101.92 1x4l n THR 12 Ca 0.25 -0.34 -0.14 0.00 -2.27 0.00 0.00 64.05 61.55 1x4l n THR 12 Cb 0.98 -0.82 -0.11 0.00 -2.10 0.00 0.00 70.33 68.28 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 -3.94 1.28 0.46 3.42 0.01 -1.11 -4.95 114.94 110.11 1x4l s ASN 13 Ca 0.07 -0.78 -0.23 0.00 -0.71 0.00 0.00 52.86 51.21 1x4l s ASN 13 Cb -0.04 0.03 -0.07 0.00 0.41 0.00 0.00 41.25 41.57 1x4l s ASN 13 CO 0.66 -0.27 1.16 -2.16 -1.51 0.00 0.00 177.10 174.98 1x4l s PRO 14 N -2.63 3.76 -0.16 -0.60 0.04 -1.26 0.00 135.00 134.15 1x4l s PRO 14 Ca 0.03 1.77 -0.00 0.00 0.04 0.00 0.00 61.00 62.84 1x4l s PRO 14 Cb -0.03 -2.41 -0.10 0.00 0.04 0.00 0.00 34.50 32.00 1x4l s PRO 14 CO -0.01 -0.55 -0.15 -0.89 0.04 0.00 0.00 177.00 175.45 1x4l n ILE 15 N -0.48 0.89 -1.46 0.56 5.41 -1.26 -4.80 119.36 118.22 1x4l n ILE 15 Ca 0.07 -0.32 -0.62 0.00 1.00 0.00 0.00 62.75 62.87 1x4l n ILE 15 Cb 0.48 -1.14 -0.11 0.00 -0.71 0.00 0.00 39.64 38.16 1x4l n ILE 15 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1x4l n SER 16 N -3.06 0.95 0.00 4.38 2.88 -1.26 -4.88 113.62 112.64 1x4l n SER 16 Ca -0.28 0.91 0.00 0.00 -1.33 0.00 0.00 58.87 58.17 1x4l n SER 16 Cb 0.78 -0.87 0.00 0.00 -0.75 0.00 0.00 64.21 63.37 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 5.61 1.64 0.78 0.46 0.00 -1.26 -5.10 105.19 107.32 1x4l n GLY 17 Ca 0.42 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.37 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 0.63 0.00 0.99 4.77 -1.26 -5.08 117.00 117.04 1x4l n LEU 18 Ca 0.00 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1x4l n LEU 18 Cb 0.00 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 1x4l n LEU 18 CO 0.00 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.72 1x4l n GLY 19 N 2.60 0.88 2.45 -0.72 0.00 -1.26 -5.14 105.19 104.00 1x4l n GLY 19 Ca -0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 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 5.00 1.51 3.65 -0.02 0.00 -1.26 -5.14 105.19 108.93 1x4l n GLY 20 Ca 0.00 -2.13 -0.03 0.00 0.00 0.00 0.00 46.02 43.86 1x4l n GLY 20 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x4l s THR 21 N -1.47 0.00 -1.85 2.61 -4.23 -1.26 -4.98 115.64 104.46 1x4l s THR 21 Ca 0.39 0.00 0.02 0.00 -1.18 0.00 0.00 61.69 60.92 1x4l s THR 21 Cb -0.03 -1.00 0.06 0.00 1.34 0.00 0.00 72.50 72.87 1x4l s THR 21 CO 0.25 0.00 0.98 0.29 -0.54 0.00 0.00 174.62 175.61 1x4l n LYS 22 N 2.24 1.17 -0.68 3.99 5.02 -1.26 -4.91 118.16 123.73 1x4l n LYS 22 Ca -0.13 -0.23 -0.32 0.00 -2.02 0.00 0.00 58.31 55.61 1x4l n LYS 22 Cb 0.57 -1.12 0.17 0.00 -0.02 0.00 0.00 35.03 34.63 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 -0.27 -1.38 -3.69 2.13 4.11 -1.26 -4.61 117.16 112.20 1x4l n TYR 23 Ca 0.02 0.13 -0.37 0.00 -0.00 0.00 0.00 57.90 57.68 1x4l n TYR 23 Cb 0.09 -1.63 -0.07 0.00 -0.00 0.00 0.00 39.34 37.74 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 -2.29 5.34 -0.04 -3.48 1.09 0.48 -4.90 121.20 117.40 1x4l s ILE 24 Ca 0.58 0.43 0.02 0.00 -1.10 0.00 0.00 60.65 60.57 1x4l s ILE 24 Cb -0.15 -3.54 0.01 0.00 -1.06 0.00 0.00 42.46 37.73 1x4l s ILE 24 CO 0.66 0.52 -0.08 -0.55 -0.10 0.00 0.00 174.94 175.40 1x4l s SER 25 N -0.43 1.18 0.46 3.58 0.15 -1.26 -0.30 113.70 117.07 1x4l s SER 25 Ca 0.16 -0.18 0.04 0.00 0.70 0.00 0.00 55.95 56.67 1x4l s SER 25 Cb -0.13 -0.48 -0.04 0.00 -1.71 0.00 0.00 66.02 63.66 1x4l s SER 25 CO 0.05 0.01 0.01 0.12 1.20 0.00 0.00 173.24 174.63 1x4l s PHE 26 N 0.60 2.15 0.17 3.44 5.36 0.16 -4.98 117.98 124.89 1x4l s PHE 26 Ca -0.09 -0.84 -0.05 0.00 -0.96 0.00 0.00 56.93 54.99 1x4l s PHE 26 Cb -0.13 -1.66 0.28 0.00 -0.34 0.00 0.00 43.02 41.17 1x4l s PHE 26 CO 0.01 0.31 0.96 0.39 -1.46 0.00 0.00 175.22 175.42 1x4l n GLU 27 N -1.11 -0.06 0.00 10.12 -0.58 -1.26 -3.85 120.64 123.91 1x4l n GLU 27 Ca -0.12 0.95 0.00 0.00 -0.42 0.00 0.00 57.16 57.57 1x4l n GLU 27 Cb 0.67 -1.43 0.00 0.00 -0.57 0.00 0.00 31.44 30.11 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 -5.00 0.00 -1.76 3.49 1.02 -1.26 -5.10 120.64 112.03 1x4l n GLU 28 Ca 0.10 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.94 1x4l n GLU 28 Cb 0.31 -0.49 0.07 0.00 -0.02 0.00 0.00 31.44 31.31 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 -1.45 2.38 0.28 3.49 0.52 -1.25 -4.87 118.95 118.05 1x4l s ARG 29 Ca 0.00 0.46 -0.07 0.00 -0.52 0.00 0.00 55.73 55.60 1x4l s ARG 29 Cb 0.00 -1.97 -0.01 0.00 0.52 0.00 0.00 34.95 33.50 1x4l s ARG 29 CO 0.00 -1.37 0.42 -0.65 0.02 0.00 0.00 175.30 173.72 1x4l s GLN 30 N -5.32 1.63 0.17 3.54 -0.21 -1.21 0.39 119.66 118.64 1x4l s GLN 30 Ca 0.60 -1.50 -0.09 0.00 0.02 0.00 0.00 55.36 54.40 1x4l s GLN 30 Cb -0.12 0.43 0.03 0.00 1.00 0.00 0.00 33.01 34.35 1x4l s GLN 30 CO 0.52 -0.66 0.45 0.91 -2.12 0.00 0.00 175.29 174.39 1x4l n TRP 31 N -0.43 -1.50 -4.40 0.91 8.01 0.59 -1.35 117.44 119.27 1x4l n TRP 31 Ca -0.00 -0.88 -0.25 0.00 -1.31 0.00 0.00 57.50 55.06 1x4l n TRP 31 Cb 0.62 0.44 -0.09 0.00 -2.01 0.00 0.00 31.31 30.27 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 -5.04 2.51 0.55 -5.99 3.76 -1.26 -0.38 115.29 109.44 1x4l s HIS 32 Ca 0.09 -0.49 0.26 0.00 -0.15 0.00 0.00 55.06 54.77 1x4l s HIS 32 Cb -0.02 -1.53 1.46 0.00 1.11 0.00 0.00 32.58 33.59 1x4l s HIS 32 CO 0.05 0.48 2.02 -0.91 -0.85 0.00 0.00 174.74 175.53 1x4l h ASN 33 N 1.83 0.00 0.00 1.40 2.35 -1.91 0.27 115.58 119.52 1x4l h ASN 33 Ca -0.43 0.00 -0.43 0.00 -0.55 0.00 0.00 56.30 54.89 1x4l h ASN 33 Cb 1.25 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.56 1x4l h ASN 33 CO 0.69 0.00 -2.42 -0.67 -1.65 0.00 0.00 177.43 173.39 1x4l n ASP 34 N -4.18 1.95 -0.16 5.81 2.03 -1.26 -4.54 116.55 116.19 1x4l n ASP 34 Ca 0.06 0.34 -0.03 0.00 0.52 0.00 0.00 54.79 55.69 1x4l n ASP 34 Cb 0.50 -0.82 0.07 0.00 -0.72 0.00 0.00 41.12 40.15 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 -5.02 1.03 -3.83 0.00 7.35 0.95 -4.83 117.46 113.10 1x4l n PHE 36 Ca 0.06 0.10 -0.12 0.00 -0.76 0.00 0.00 57.45 56.73 1x4l n PHE 36 Cb 0.21 -2.32 -0.10 0.00 0.35 0.00 0.00 39.48 37.62 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 9.75 -0.07 1.03 -2.13 0.01 -1.26 -2.90 114.94 119.37 1x4l s ASN 37 Ca 1.07 -0.02 -0.21 0.00 -0.71 0.00 0.00 52.86 52.99 1x4l s ASN 37 Cb -0.41 0.27 -0.07 0.00 0.41 0.00 0.00 41.25 41.45 1x4l s ASN 37 CO 0.28 -0.33 -0.66 0.00 -1.51 0.00 0.00 177.10 174.88 1x4l n LYS 39 N 0.55 1.60 -0.04 0.00 3.00 -0.69 -3.01 118.16 119.58 1x4l n LYS 39 Ca 0.00 -0.97 -0.06 0.00 -0.00 0.00 0.00 58.31 57.28 1x4l n LYS 39 Cb 0.65 -1.27 -0.03 0.00 0.00 0.00 0.00 35.03 34.37 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 0.14 0.19 0.00 1.64 4.81 -1.26 -4.76 118.16 118.92 1x4l n LYS 40 Ca 0.07 0.05 0.01 0.00 -0.87 0.00 0.00 58.31 57.57 1x4l n LYS 40 Cb 0.35 -1.10 0.01 0.00 0.02 0.00 0.00 35.03 34.31 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 0.03 -1.44 -4.87 0.00 7.64 -1.16 -4.87 113.62 108.95 1x4l n SER 42 Ca 0.01 -1.06 -0.33 0.00 1.01 0.00 0.00 58.87 58.50 1x4l n SER 42 Cb 0.03 -2.64 -0.05 0.00 -1.01 0.00 0.00 64.21 60.54 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 -7.17 4.20 -0.26 -3.43 2.96 -1.26 -4.49 118.68 109.23 1x4l s LEU 43 Ca 0.35 0.97 -0.33 0.00 -0.22 0.00 0.00 54.13 54.91 1x4l s LEU 43 Cb -0.19 -3.61 -0.09 0.00 0.50 0.00 0.00 46.19 42.79 1x4l s LEU 43 CO 0.93 -0.04 2.15 -0.24 -1.32 0.00 0.00 176.35 177.83 1x4l n SER 44 N 0.07 2.72 -0.05 3.68 2.88 -1.26 -1.68 113.62 119.97 1x4l n SER 44 Ca -0.01 0.43 -0.03 0.00 -1.33 0.00 0.00 58.87 57.94 1x4l n SER 44 Cb 0.52 -1.38 -0.15 0.00 -0.75 0.00 0.00 64.21 62.46 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 9.96 0.18 -4.61 2.46 4.77 -1.14 -4.90 117.00 123.71 1x4l n LEU 45 Ca 0.34 0.08 -0.59 0.00 -0.03 0.00 0.00 56.01 55.81 1x4l n LEU 45 Cb 0.31 0.28 -0.08 0.00 -2.33 0.00 0.00 43.42 41.60 1x4l n LEU 45 CO 0.72 0.30 1.42 0.55 -1.33 0.00 0.00 177.39 179.06 1x4l n VAL 46 N -2.65 0.19 -2.01 4.08 3.14 -1.25 -0.22 118.33 119.60 1x4l n VAL 46 Ca -0.21 -0.07 0.00 0.00 -2.96 0.00 0.00 64.34 61.11 1x4l n VAL 46 Cb 0.94 -1.05 0.00 0.00 -1.06 0.00 0.00 33.84 32.67 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 4.99 0.58 3.31 7.55 0.00 -1.26 -5.06 105.19 115.30 1x4l n GLY 47 Ca 0.34 -0.80 -0.19 0.00 0.00 0.00 0.00 46.02 45.37 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 -4.07 1.69 -0.63 1.61 0.52 0.69 -5.05 118.95 113.70 1x4l s ARG 48 Ca 0.00 -1.98 -0.04 0.00 -0.52 0.00 0.00 55.73 53.19 1x4l s ARG 48 Cb 0.00 0.15 0.09 0.00 0.52 0.00 0.00 34.95 35.70 1x4l s ARG 48 CO 0.00 -0.57 2.66 0.41 0.02 0.00 0.00 175.30 177.82 1x4l n GLY 49 N -0.61 4.58 3.53 -3.53 0.00 -1.26 -4.99 105.19 102.91 1x4l n GLY 49 Ca 0.04 -1.95 -0.33 0.00 0.00 0.00 0.00 46.02 43.78 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 0.95 -0.31 -3.43 1.61 -1.74 -1.26 -4.35 117.46 108.93 1x4l n PHE 50 Ca 0.51 0.32 -0.15 0.00 -0.56 0.00 0.00 57.45 57.58 1x4l n PHE 50 Cb 0.48 -1.92 0.02 0.00 1.52 0.00 0.00 39.48 39.58 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 -2.13 0.00 -3.83 5.98 4.32 0.82 -4.94 117.00 117.23 1x4l n LEU 51 Ca 0.10 -1.70 -0.30 0.00 -0.02 0.00 0.00 56.01 54.09 1x4l n LEU 51 Cb 0.52 -0.13 -0.15 0.00 -1.62 0.00 0.00 43.42 42.03 1x4l n LEU 51 CO 0.50 -0.54 -0.36 0.42 -1.22 0.00 0.00 177.39 176.19 1x4l s THR 52 N -1.52 1.19 0.65 -5.08 -4.23 -1.26 -3.62 115.64 101.77 1x4l s THR 52 Ca 0.28 -1.38 -0.10 0.00 -1.18 0.00 0.00 61.69 59.31 1x4l s THR 52 Cb -0.02 -1.76 -0.00 0.00 1.34 0.00 0.00 72.50 72.05 1x4l s THR 52 CO 0.18 -0.46 1.03 -0.70 -0.54 0.00 0.00 174.62 174.12 1x4l s GLU 53 N 1.49 3.08 0.01 3.99 2.12 0.64 -4.97 118.70 125.07 1x4l s GLU 53 Ca 0.05 0.42 -0.02 0.00 0.36 0.00 0.00 54.97 55.78 1x4l s GLU 53 Cb -0.18 -2.10 -0.00 0.00 0.26 0.00 0.00 34.13 32.10 1x4l s GLU 53 CO -0.16 -0.81 0.69 0.54 -0.54 0.00 0.00 175.26 174.98 1x4l n ARG 54 N -2.82 -0.03 -0.52 4.30 5.12 -1.26 -2.64 116.66 118.81 1x4l n ARG 54 Ca 0.06 0.69 0.06 0.00 -1.93 0.00 0.00 57.85 56.73 1x4l n ARG 54 Cb 0.56 -1.03 0.13 0.00 -1.16 0.00 0.00 32.46 30.97 1x4l n ARG 54 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 1x4l n ASP 55 N -2.88 1.63 -3.57 0.55 5.75 -1.26 -5.06 116.55 111.71 1x4l n ASP 55 Ca 0.00 -3.12 -0.09 0.00 -0.01 0.00 0.00 54.79 51.57 1x4l n ASP 55 Cb 0.02 -0.42 -0.02 0.00 -1.03 0.00 0.00 41.12 39.66 1x4l n ASP 55 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1x4l s ASP 56 N -2.66 0.04 0.21 -1.12 1.01 -1.08 -5.18 116.67 107.88 1x4l s ASP 56 Ca 0.30 -0.98 0.10 0.00 0.71 0.00 0.00 52.55 52.69 1x4l s ASP 56 Cb 0.29 0.71 -0.04 0.00 1.01 0.00 0.00 42.92 44.89 1x4l s ASP 56 CO -0.04 -1.37 -0.13 0.27 0.21 0.00 0.00 175.17 174.11 1x4l s ILE 57 N -3.40 2.91 0.22 0.77 -4.36 -1.26 0.23 121.20 116.32 1x4l s ILE 57 Ca 0.19 -1.89 -0.07 0.00 -0.26 0.00 0.00 60.65 58.62 1x4l s ILE 57 Cb -0.03 -2.46 -0.02 0.00 1.25 0.00 0.00 42.46 41.19 1x4l s ILE 57 CO 0.11 -0.19 0.31 -0.76 0.24 0.00 0.00 174.94 174.65 1x4l s LEU 58 N -2.99 0.73 0.20 0.37 1.43 -1.24 -1.71 118.68 115.48 1x4l s LEU 58 Ca 0.25 -1.16 0.05 0.00 -1.03 0.00 0.00 54.13 52.24 1x4l s LEU 58 Cb -0.08 1.08 -0.03 0.00 0.03 0.00 0.00 46.19 47.18 1x4l s LEU 58 CO 0.14 -0.99 0.24 0.00 0.23 0.00 0.00 176.35 175.97 1x4l h PRO 60 N 1.85 0.33 -0.78 0.00 0.11 -1.92 0.60 132.00 132.19 1x4l h PRO 60 Ca -0.49 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 1x4l h PRO 60 Cb 1.21 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 1x4l h PRO 60 CO 0.64 0.22 0.29 -0.44 -0.21 0.00 0.00 178.00 178.50 1x4l h ASP 61 N 0.34 1.09 0.00 -2.05 3.32 -1.96 -0.77 116.42 116.40 1x4l h ASP 61 Ca 0.62 -0.18 -0.07 0.00 0.02 0.00 0.00 57.03 57.43 1x4l h ASP 61 Cb 1.66 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.92 1x4l h ASP 61 CO -0.31 0.98 -0.45 0.00 -1.72 0.00 0.00 179.24 177.74 1x4l h GLY 63 N -1.00 -0.23 -0.82 0.00 0.00 -0.05 -1.71 103.07 99.26 1x4l h GLY 63 Ca -0.10 0.32 0.27 0.00 0.00 0.00 0.00 47.33 47.82 1x4l h GLY 63 CO -0.06 -0.20 0.18 0.58 0.00 0.00 0.00 176.54 177.04 1x4l n LYS 64 N -5.38 -0.06 -0.22 4.80 2.85 -0.29 0.22 118.16 120.07 1x4l n LYS 64 Ca -0.02 1.20 -0.05 0.00 -1.05 0.00 0.00 58.31 58.39 1x4l n LYS 64 Cb 0.30 -1.99 0.05 0.00 -0.65 0.00 0.00 35.03 32.74 1x4l n LYS 64 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 177.40 177.57 1x4l h ASP 65 N 0.00 0.69 -2.31 -5.58 1.82 -1.48 -3.41 116.42 106.16 1x4l h ASP 65 Ca 0.58 -0.01 -0.56 0.00 -0.39 0.00 0.00 57.03 56.64 1x4l h ASP 65 Cb 1.35 -0.16 -0.00 0.00 0.68 0.00 0.00 39.33 41.19 1x4l h ASP 65 CO -0.72 0.49 1.32 -0.63 -1.61 0.00 0.00 179.24 178.10 1x4l s ILE 66 N -6.14 3.18 0.13 2.25 1.01 0.61 -4.88 121.20 117.37 1x4l s ILE 66 Ca -0.13 0.20 -0.23 0.00 0.00 0.00 0.00 60.65 60.49 1x4l s ILE 66 Cb 0.14 -3.19 -0.01 0.00 0.01 0.00 0.00 42.46 39.41 1x4l s ILE 66 CO 0.76 -0.09 1.65 0.28 0.00 0.00 0.00 174.94 177.54 1x4l h SER 67 N 12.61 -0.62 -4.06 3.58 0.02 -1.81 -3.47 113.55 119.80 1x4l h SER 67 Ca -0.42 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 1x4l h SER 67 Cb 1.22 0.28 0.00 0.00 0.14 0.00 0.00 62.40 64.04 1x4l h SER 67 CO 0.97 -0.25 -0.65 0.61 -1.14 0.00 0.00 176.83 176.36 1x4l n GLY 68 N -1.34 -4.71 0.25 -3.77 0.00 -1.26 -4.63 105.19 89.73 1x4l n GLY 68 Ca -0.03 -0.48 0.16 0.00 0.00 0.00 0.00 46.02 45.68 1x4l n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x4l h PRO 69 N 2.60 0.00 0.00 1.61 0.13 -1.96 -3.39 132.00 131.00 1x4l h PRO 69 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1x4l h PRO 69 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1x4l h PRO 69 CO 0.00 0.00 -0.10 0.43 -0.23 0.00 0.00 178.00 178.10 1x4l n SER 70 N -2.92 0.65 -4.74 1.44 7.64 -1.26 -5.08 113.62 109.34 1x4l n SER 70 Ca 0.01 0.21 -0.35 0.00 1.01 0.00 0.00 58.87 59.75 1x4l n SER 70 Cb 0.28 -0.11 0.06 0.00 -1.01 0.00 0.00 64.21 63.43 1x4l n SER 70 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1x4l s SER 71 N -5.62 4.80 0.00 6.43 0.15 -1.26 -5.23 113.70 112.97 1x4l s SER 71 Ca 0.00 2.30 0.00 0.00 0.70 0.00 0.00 55.95 58.95 1x4l s SER 71 Cb 0.00 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 1x4l s SER 71 CO 0.00 -1.85 0.00 0.61 1.20 0.00 0.00 173.24 173.20