#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 -4.35 -4.47 1.61 7.64 -1.26 -4.82 113.62 107.97 1x4l n SER 2 Ca 0.00 -0.61 -0.51 0.00 1.01 0.00 0.00 58.87 58.76 1x4l n SER 2 Cb 0.00 -4.90 -0.07 0.00 -1.01 0.00 0.00 64.21 58.24 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 -3.04 2.25 -0.68 6.43 3.41 -1.26 -4.22 113.62 116.51 1x4l n SER 3 Ca -0.11 0.46 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 1x4l n SER 3 Cb 0.60 -1.27 0.00 0.00 -0.26 0.00 0.00 64.21 63.28 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 6.31 -3.27 3.71 5.00 0.00 -1.26 -4.86 105.19 110.82 1x4l n GLY 4 Ca 0.39 -0.71 -0.60 0.00 0.00 0.00 0.00 46.02 45.10 1x4l n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x4l n SER 5 N 0.00 2.13 -4.56 1.61 3.41 -1.26 -4.79 113.62 110.16 1x4l n SER 5 Ca 0.00 1.08 -0.39 0.00 -0.26 0.00 0.00 58.87 59.31 1x4l n SER 5 Cb 0.00 -1.08 -0.03 0.00 -0.26 0.00 0.00 64.21 62.84 1x4l n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1x4l s SER 6 N 3.56 5.14 0.25 4.04 0.01 -1.26 -4.70 113.70 120.74 1x4l s SER 6 Ca 1.00 0.75 0.00 0.00 1.31 0.00 0.00 55.95 59.02 1x4l s SER 6 Cb -1.16 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 62.55 1x4l s SER 6 CO 0.69 -2.40 0.00 0.61 0.41 0.00 0.00 173.24 172.55 1x4l n GLY 7 N 5.74 -0.22 3.54 3.44 0.00 -1.26 -3.70 105.19 112.73 1x4l n GLY 7 Ca 0.26 -1.03 -0.33 0.00 0.00 0.00 0.00 46.02 44.92 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 16.98 2.47 -2.35 0.00 0.00 -1.49 1.32 119.26 136.19 1x4l h ALA 9 Ca -0.16 0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1x4l h ALA 9 Cb 1.23 0.28 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1x4l h ALA 9 CO 1.19 -1.20 0.00 0.41 0.00 0.00 0.00 179.25 179.65 1x4l n GLY 10 N -1.39 -3.07 1.18 0.00 0.00 -1.26 -3.14 105.19 97.51 1x4l n GLY 10 Ca 0.38 0.23 0.04 0.00 0.00 0.00 0.00 46.02 46.67 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 0.33 -0.65 -4.34 0.00 -2.24 0.45 -4.90 114.28 102.93 1x4l n THR 12 Ca 0.14 -0.33 -0.27 0.00 -2.27 0.00 0.00 64.05 61.32 1x4l n THR 12 Cb 0.71 -0.69 -0.11 0.00 -2.10 0.00 0.00 70.33 68.14 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 -3.87 3.89 -0.47 3.42 4.22 -1.17 -4.85 114.94 116.11 1x4l s ASN 13 Ca 0.06 -0.67 -0.28 0.00 -2.14 0.00 0.00 52.86 49.84 1x4l s ASN 13 Cb -0.04 -0.52 -0.02 0.00 1.28 0.00 0.00 41.25 41.95 1x4l s ASN 13 CO 0.73 0.13 1.77 -2.16 -2.04 0.00 0.00 177.10 175.53 1x4l s PRO 14 N -2.63 3.05 -0.92 3.55 0.04 -1.26 0.08 135.00 136.91 1x4l s PRO 14 Ca 0.22 0.99 -0.24 0.00 0.04 0.00 0.00 61.00 62.00 1x4l s PRO 14 Cb -0.09 -4.26 -0.05 0.00 0.04 0.00 0.00 34.50 30.15 1x4l s PRO 14 CO 0.12 -2.22 1.93 0.42 0.04 0.00 0.00 177.00 177.29 1x4l s ILE 15 N 7.68 3.47 -0.30 0.56 1.01 -1.26 -4.82 121.20 127.55 1x4l s ILE 15 Ca 0.71 -0.41 -0.16 0.00 0.00 0.00 0.00 60.65 60.80 1x4l s ILE 15 Cb -0.17 -4.07 0.16 0.00 0.01 0.00 0.00 42.46 38.40 1x4l s ILE 15 CO 0.28 -0.99 1.02 -0.55 0.00 0.00 0.00 174.94 174.70 1x4l s SER 16 N 7.86 -0.49 0.00 3.58 0.15 -1.26 -5.03 113.70 118.51 1x4l s SER 16 Ca 0.69 0.71 0.00 0.00 0.70 0.00 0.00 55.95 58.05 1x4l s SER 16 Cb -0.06 1.44 0.00 0.00 -1.71 0.00 0.00 66.02 65.69 1x4l s SER 16 CO -0.01 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 174.94 1x4l n GLY 17 N 4.43 -0.62 3.12 9.45 0.00 -1.26 -5.07 105.19 115.24 1x4l n GLY 17 Ca -0.12 0.33 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.31 5.40 0.00 0.99 1.43 -1.26 -5.05 118.68 119.88 1x4l s LEU 18 Ca 0.00 -2.77 0.00 0.00 -1.03 0.00 0.00 54.13 50.33 1x4l s LEU 18 Cb 0.00 -1.89 0.00 0.00 0.03 0.00 0.00 46.19 44.33 1x4l s LEU 18 CO 0.00 -0.41 0.00 0.61 0.23 0.00 0.00 176.35 176.78 1x4l n GLY 19 N 3.63 2.28 3.68 -3.19 0.00 -1.26 -4.49 105.19 105.83 1x4l n GLY 19 Ca 0.07 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 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 0.39 2.94 -0.02 0.00 -1.26 -5.01 105.19 102.23 1x4l n GLY 20 Ca 0.00 0.29 -0.12 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.12 0.14 0.00 2.61 2.01 -1.26 -5.03 115.64 112.99 1x4l s THR 21 Ca 0.57 -0.43 -0.04 0.00 0.31 0.00 0.00 61.69 62.10 1x4l s THR 21 Cb -0.58 -0.19 -0.18 0.00 0.01 0.00 0.00 72.50 71.56 1x4l s THR 21 CO 0.61 -0.19 2.77 0.29 -0.69 0.00 0.00 174.62 177.41 1x4l n LYS 22 N 2.43 1.47 -3.72 4.92 5.02 -1.26 -4.86 118.16 122.15 1x4l n LYS 22 Ca -0.17 -0.65 -0.24 0.00 -2.02 0.00 0.00 58.31 55.23 1x4l n LYS 22 Cb 0.58 -1.75 -0.02 0.00 -0.02 0.00 0.00 35.03 33.82 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 1.17 3.48 -0.17 2.13 1.13 -1.26 -3.43 117.35 120.40 1x4l s TYR 23 Ca 0.44 0.19 -0.22 0.00 -1.41 0.00 0.00 57.07 56.07 1x4l s TYR 23 Cb 0.21 -1.74 -0.03 0.00 -1.10 0.00 0.00 41.96 39.30 1x4l s TYR 23 CO 0.00 0.33 0.66 0.42 -2.51 0.00 0.00 175.55 174.45 1x4l s ILE 24 N -2.04 5.01 -0.15 -3.49 -1.09 0.19 -4.87 121.20 114.76 1x4l s ILE 24 Ca 0.37 1.28 0.02 0.00 -2.23 0.00 0.00 60.65 60.09 1x4l s ILE 24 Cb -0.10 -3.98 0.01 0.00 -1.58 0.00 0.00 42.46 36.81 1x4l s ILE 24 CO 0.31 0.13 -0.21 -0.94 -1.23 0.00 0.00 174.94 173.01 1x4l s SER 25 N 1.09 3.14 0.46 3.58 1.04 -1.26 -0.47 113.70 121.28 1x4l s SER 25 Ca 0.31 -0.61 0.06 0.00 0.48 0.00 0.00 55.95 56.19 1x4l s SER 25 Cb -0.16 -1.46 -0.03 0.00 0.10 0.00 0.00 66.02 64.47 1x4l s SER 25 CO 0.12 0.06 0.18 0.12 0.98 0.00 0.00 173.24 174.70 1x4l s PHE 26 N 0.95 2.28 0.14 5.02 5.36 0.15 -5.01 117.98 126.88 1x4l s PHE 26 Ca -0.04 -0.71 -0.12 0.00 -0.96 0.00 0.00 56.93 55.11 1x4l s PHE 26 Cb -0.15 -1.88 0.14 0.00 -0.34 0.00 0.00 43.02 40.79 1x4l s PHE 26 CO -0.05 0.08 0.99 0.39 -1.46 0.00 0.00 175.22 175.18 1x4l n GLU 27 N -1.33 -0.16 0.00 10.12 -0.58 -1.26 -3.97 120.64 123.46 1x4l n GLU 27 Ca -0.05 0.98 0.00 0.00 -0.42 0.00 0.00 57.16 57.68 1x4l n GLU 27 Cb 0.65 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 30.06 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 -4.93 0.00 -1.60 3.49 1.02 -1.26 -5.09 120.64 112.27 1x4l n GLU 28 Ca 0.06 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.90 1x4l n GLU 28 Cb 0.25 -0.50 0.10 0.00 -0.02 0.00 0.00 31.44 31.26 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 -1.72 1.89 0.24 3.49 0.52 -1.25 -4.95 118.95 117.15 1x4l s ARG 29 Ca 0.00 0.49 -0.11 0.00 -0.52 0.00 0.00 55.73 55.59 1x4l s ARG 29 Cb 0.00 -1.91 -0.01 0.00 0.52 0.00 0.00 34.95 33.55 1x4l s ARG 29 CO 0.00 -1.73 0.43 -0.65 0.02 0.00 0.00 175.30 173.37 1x4l s GLN 30 N -5.24 1.48 0.23 3.54 -0.21 -1.26 -0.67 119.66 117.54 1x4l s GLN 30 Ca 0.61 -1.29 -0.10 0.00 0.02 0.00 0.00 55.36 54.60 1x4l s GLN 30 Cb -0.14 0.44 0.04 0.00 1.00 0.00 0.00 33.01 34.35 1x4l s GLN 30 CO 0.53 -0.60 0.53 0.91 -2.12 0.00 0.00 175.29 174.54 1x4l n TRP 31 N -0.36 -1.76 -4.19 0.91 8.01 0.38 -1.38 117.44 119.05 1x4l n TRP 31 Ca -0.01 -1.13 -0.27 0.00 -1.31 0.00 0.00 57.50 54.77 1x4l n TRP 31 Cb 0.62 0.57 -0.08 0.00 -2.01 0.00 0.00 31.31 30.41 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 -4.45 2.87 0.61 -5.99 3.76 -1.26 -0.64 115.29 110.19 1x4l s HIS 32 Ca 0.11 -0.12 0.27 0.00 -0.15 0.00 0.00 55.06 55.17 1x4l s HIS 32 Cb -0.03 -1.40 1.24 0.00 1.11 0.00 0.00 32.58 33.50 1x4l s HIS 32 CO 0.07 0.51 1.66 -0.97 -0.85 0.00 0.00 174.74 175.16 1x4l h ASN 33 N 2.77 0.00 0.00 1.40 -0.73 -1.89 0.33 115.58 117.47 1x4l h ASN 33 Ca -0.47 0.00 -0.27 0.00 1.87 0.00 0.00 56.30 57.42 1x4l h ASN 33 Cb 1.20 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 39.75 1x4l h ASN 33 CO 0.58 0.00 -1.86 0.47 -0.37 0.00 0.00 177.43 176.26 1x4l n ASP 34 N -3.39 1.63 -0.25 1.15 9.92 -1.26 -4.60 116.55 119.75 1x4l n ASP 34 Ca 0.11 0.28 0.04 0.00 -0.53 0.00 0.00 54.79 54.69 1x4l n ASP 34 Cb 0.93 -0.66 0.17 0.00 -0.64 0.00 0.00 41.12 40.92 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 -5.00 0.96 -3.82 0.00 7.35 0.11 -4.83 117.46 112.23 1x4l n PHE 36 Ca 0.13 0.14 -0.11 0.00 -0.76 0.00 0.00 57.45 56.85 1x4l n PHE 36 Cb 0.39 -2.29 -0.08 0.00 0.35 0.00 0.00 39.48 37.85 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 9.53 -0.02 1.08 -2.13 0.01 -1.26 -3.14 114.94 119.02 1x4l s ASN 37 Ca 1.11 -0.28 -0.20 0.00 -0.71 0.00 0.00 52.86 52.78 1x4l s ASN 37 Cb -0.53 0.30 0.03 0.00 0.41 0.00 0.00 41.25 41.46 1x4l s ASN 37 CO 0.32 -0.54 -0.33 0.00 -1.51 0.00 0.00 177.10 175.04 1x4l n LYS 39 N -0.97 2.99 -0.10 0.00 0.00 -1.05 -3.14 118.16 115.89 1x4l n LYS 39 Ca 0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 58.31 58.16 1x4l n LYS 39 Cb 0.65 -1.06 -0.09 0.00 0.00 0.00 0.00 35.03 34.53 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 -1.31 0.47 -0.00 1.64 4.81 -1.26 -4.69 118.16 117.82 1x4l n LYS 40 Ca 0.02 0.13 0.01 0.00 -0.87 0.00 0.00 58.31 57.59 1x4l n LYS 40 Cb 0.19 -1.35 0.00 0.00 0.02 0.00 0.00 35.03 33.89 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 0.06 -3.42 -4.85 0.00 7.64 -1.19 -4.88 113.62 106.99 1x4l n SER 42 Ca 0.01 -0.71 -0.32 0.00 1.01 0.00 0.00 58.87 58.86 1x4l n SER 42 Cb 0.03 -2.81 -0.03 0.00 -1.01 0.00 0.00 64.21 60.39 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 -6.88 3.61 -0.16 -3.43 2.96 -1.26 -4.42 118.68 109.10 1x4l s LEU 43 Ca 0.59 1.50 -0.29 0.00 -0.22 0.00 0.00 54.13 55.71 1x4l s LEU 43 Cb -0.32 -4.44 -0.06 0.00 0.50 0.00 0.00 46.19 41.87 1x4l s LEU 43 CO 0.72 -0.60 2.05 -0.55 -1.32 0.00 0.00 176.35 176.65 1x4l s SER 44 N -3.21 5.87 -0.19 3.68 0.15 -1.26 -1.25 113.70 117.49 1x4l s SER 44 Ca 0.57 2.04 0.14 0.00 0.70 0.00 0.00 55.95 59.40 1x4l s SER 44 Cb -0.10 -2.52 -0.23 0.00 -1.71 0.00 0.00 66.02 61.46 1x4l s SER 44 CO 0.34 -1.61 0.09 0.18 1.20 0.00 0.00 173.24 173.44 1x4l n LEU 45 N 10.04 0.70 -4.68 3.45 4.77 -1.19 -4.90 117.00 125.19 1x4l n LEU 45 Ca 0.25 0.02 -0.65 0.00 -0.03 0.00 0.00 56.01 55.61 1x4l n LEU 45 Cb 0.44 0.17 -0.10 0.00 -2.33 0.00 0.00 43.42 41.60 1x4l n LEU 45 CO 0.67 0.58 1.26 0.55 -1.33 0.00 0.00 177.39 179.11 1x4l n VAL 46 N -2.89 0.07 -2.13 4.08 3.14 -1.25 0.11 118.33 119.45 1x4l n VAL 46 Ca -0.34 -0.02 -0.01 0.00 -2.96 0.00 0.00 64.34 61.01 1x4l n VAL 46 Cb 1.12 -0.67 0.00 0.00 -1.06 0.00 0.00 33.84 33.23 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 4.47 0.42 3.25 7.55 0.00 -1.26 -5.05 105.19 114.57 1x4l n GLY 47 Ca 0.33 -0.79 -0.15 0.00 0.00 0.00 0.00 46.02 45.41 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 -4.27 1.38 -0.30 1.61 0.52 0.12 -5.05 118.95 112.96 1x4l s ARG 48 Ca 0.01 -1.76 -0.05 0.00 -0.52 0.00 0.00 55.73 53.41 1x4l s ARG 48 Cb -0.00 0.15 -0.09 0.00 0.52 0.00 0.00 34.95 35.52 1x4l s ARG 48 CO 0.01 -0.43 3.17 0.41 0.02 0.00 0.00 175.30 178.48 1x4l n GLY 49 N -0.40 3.74 3.47 -3.53 0.00 -1.26 -4.97 105.19 102.24 1x4l n GLY 49 Ca 0.02 -1.57 -0.34 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 1.73 -0.83 -3.57 1.61 -1.74 -1.26 -4.41 117.46 108.99 1x4l n PHE 50 Ca 0.47 0.30 -0.23 0.00 -0.56 0.00 0.00 57.45 57.43 1x4l n PHE 50 Cb 0.70 -1.87 0.03 0.00 1.52 0.00 0.00 39.48 39.86 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 -1.36 0.00 -3.88 5.98 4.32 0.84 -4.94 117.00 117.96 1x4l n LEU 51 Ca 0.09 -2.70 -0.30 0.00 -0.02 0.00 0.00 56.01 53.07 1x4l n LEU 51 Cb 0.52 -0.18 -0.15 0.00 -1.62 0.00 0.00 43.42 41.98 1x4l n LEU 51 CO 0.50 -0.63 -0.35 0.42 -1.22 0.00 0.00 177.39 176.11 1x4l s THR 52 N -2.65 1.55 0.68 -5.08 -4.23 -1.26 -3.50 115.64 101.15 1x4l s THR 52 Ca 0.42 -1.75 -0.11 0.00 -1.18 0.00 0.00 61.69 59.07 1x4l s THR 52 Cb -0.03 -2.10 -0.00 0.00 1.34 0.00 0.00 72.50 71.71 1x4l s THR 52 CO 0.27 -0.55 1.07 -0.70 -0.54 0.00 0.00 174.62 174.17 1x4l s GLU 53 N 1.29 3.06 0.00 3.99 2.12 0.64 -4.96 118.70 124.85 1x4l s GLU 53 Ca 0.08 0.67 0.00 0.00 0.36 0.00 0.00 54.97 56.07 1x4l s GLU 53 Cb -0.18 -2.03 0.00 0.00 0.26 0.00 0.00 34.13 32.18 1x4l s GLU 53 CO -0.15 -0.94 0.59 0.54 -0.54 0.00 0.00 175.26 174.76 1x4l n ARG 54 N -2.98 0.00 -0.60 4.30 1.74 -1.26 -2.47 116.66 115.39 1x4l n ARG 54 Ca 0.07 0.59 0.06 0.00 -0.77 0.00 0.00 57.85 57.80 1x4l n ARG 54 Cb 0.55 -0.90 0.17 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 -2.48 1.70 -2.97 0.55 8.00 -1.26 -5.05 116.55 115.04 1x4l n ASP 55 Ca 0.00 -3.48 -0.09 0.00 0.71 0.00 0.00 54.79 51.93 1x4l n ASP 55 Cb 0.00 -0.47 0.02 0.00 -0.02 0.00 0.00 41.12 40.64 1x4l n ASP 55 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1x4l s ASP 56 N -2.96 0.04 0.23 -2.24 1.01 -1.03 -5.18 116.67 106.53 1x4l s ASP 56 Ca 0.35 -1.15 0.11 0.00 0.71 0.00 0.00 52.55 52.58 1x4l s ASP 56 Cb 0.34 0.84 -0.05 0.00 1.01 0.00 0.00 42.92 45.07 1x4l s ASP 56 CO -0.06 -1.66 -0.20 0.27 0.21 0.00 0.00 175.17 173.73 1x4l s ILE 57 N -2.39 2.53 0.16 0.77 -4.36 -1.26 0.23 121.20 116.88 1x4l s ILE 57 Ca 0.16 -2.16 -0.08 0.00 -0.26 0.00 0.00 60.65 58.31 1x4l s ILE 57 Cb -0.05 -2.27 -0.01 0.00 1.25 0.00 0.00 42.46 41.38 1x4l s ILE 57 CO 0.12 -0.25 0.27 -0.76 0.24 0.00 0.00 174.94 174.56 1x4l s LEU 58 N -3.09 1.01 0.20 0.37 1.43 -1.23 -2.52 118.68 114.85 1x4l s LEU 58 Ca 0.26 -0.90 0.01 0.00 -1.03 0.00 0.00 54.13 52.46 1x4l s LEU 58 Cb -0.07 1.13 -0.04 0.00 0.03 0.00 0.00 46.19 47.24 1x4l s LEU 58 CO 0.13 -0.88 0.37 0.00 0.23 0.00 0.00 176.35 176.20 1x4l h PRO 60 N 1.88 0.09 -0.39 0.00 0.11 -1.93 0.66 132.00 132.43 1x4l h PRO 60 Ca -0.49 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.48 1x4l h PRO 60 Cb 1.20 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1x4l h PRO 60 CO 0.67 0.06 -0.30 -0.44 -0.21 0.00 0.00 178.00 177.78 1x4l h ASP 61 N 0.10 0.90 0.12 -2.05 5.19 -1.96 -1.45 116.42 117.27 1x4l h ASP 61 Ca 0.58 -0.37 -0.26 0.00 -0.62 0.00 0.00 57.03 56.36 1x4l h ASP 61 Cb 2.11 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 41.36 1x4l h ASP 61 CO -0.09 1.13 -1.30 0.00 -3.12 0.00 0.00 179.24 175.86 1x4l h GLY 63 N -0.03 1.22 -1.63 0.00 0.00 0.02 -2.51 103.07 100.14 1x4l h GLY 63 Ca -0.28 -0.47 0.52 0.00 0.00 0.00 0.00 47.33 47.10 1x4l h GLY 63 CO 0.07 0.46 1.11 0.58 0.00 0.00 0.00 176.54 178.76 1x4l n LYS 64 N -4.39 -0.02 -0.27 4.80 2.85 -0.54 0.26 118.16 120.85 1x4l n LYS 64 Ca 0.10 1.18 -0.04 0.00 -1.05 0.00 0.00 58.31 58.49 1x4l n LYS 64 Cb 0.04 -2.48 0.05 0.00 -0.65 0.00 0.00 35.03 31.99 1x4l n LYS 64 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1x4l n ASP 65 N -4.38 2.98 -3.83 -5.58 5.75 -0.94 -4.53 116.55 106.02 1x4l n ASP 65 Ca 0.42 -2.34 -0.28 0.00 -0.01 0.00 0.00 54.79 52.58 1x4l n ASP 65 Cb 1.76 -0.57 -0.12 0.00 -1.03 0.00 0.00 41.12 41.16 1x4l n ASP 65 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1x4l s ILE 66 N -0.88 2.51 -0.33 2.12 1.01 0.74 -4.95 121.20 121.42 1x4l s ILE 66 Ca 0.13 -3.96 -0.02 0.00 0.00 0.00 0.00 60.65 56.80 1x4l s ILE 66 Cb 0.11 -2.66 0.17 0.00 0.01 0.00 0.00 42.46 40.08 1x4l s ILE 66 CO 0.03 -1.02 2.21 -1.54 0.00 0.00 0.00 174.94 174.62 1x4l n SER 67 N 2.20 6.42 -3.41 3.58 3.41 -1.26 -4.95 113.62 119.62 1x4l n SER 67 Ca 0.20 -3.07 0.00 0.00 -0.26 0.00 0.00 58.87 55.74 1x4l n SER 67 Cb 0.36 -1.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.21 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 0.53 -3.43 0.06 5.00 0.00 -1.26 -4.94 105.19 101.15 1x4l n GLY 68 Ca 0.33 -1.15 -0.13 0.00 0.00 0.00 0.00 46.02 45.08 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 0.00 0.02 -5.21 1.61 0.13 -2.07 -3.45 132.00 123.03 1x4l h PRO 69 Ca 0.00 -0.01 -0.63 0.00 -0.87 0.00 0.00 66.00 64.49 1x4l h PRO 69 Cb 0.00 0.00 0.07 0.00 0.13 0.00 0.00 31.00 31.20 1x4l h PRO 69 CO 0.00 0.50 -0.25 -1.13 -0.23 0.00 0.00 178.00 176.89 1x4l n SER 70 N -4.84 -0.64 -3.64 1.44 3.41 -1.26 -4.96 113.62 103.12 1x4l n SER 70 Ca -0.08 0.99 -0.03 0.00 -0.26 0.00 0.00 58.87 59.49 1x4l n SER 70 Cb 0.25 -0.81 -0.07 0.00 -0.26 0.00 0.00 64.21 63.32 1x4l n SER 70 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1x4l s SER 71 N -0.51 -0.34 0.00 4.04 0.01 -1.26 -5.06 113.70 110.57 1x4l s SER 71 Ca 0.65 0.59 0.00 0.00 1.31 0.00 0.00 55.95 58.50 1x4l s SER 71 Cb -0.93 0.93 0.00 0.00 0.21 0.00 0.00 66.02 66.23 1x4l s SER 71 CO 0.49 -0.10 0.10 0.61 0.41 0.00 0.00 173.24 174.75