#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2enk n SER 2 N 0.00 -8.16 -4.59 1.61 7.64 -1.26 -4.95 113.62 103.91 2enk n SER 2 Ca 0.00 0.60 -0.27 0.00 1.01 0.00 0.00 58.87 60.21 2enk n SER 2 Cb 0.00 -4.23 -0.11 0.00 -1.01 0.00 0.00 64.21 58.86 2enk n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2enk s SER 3 N -6.85 3.83 0.00 6.43 1.04 -1.26 -5.08 113.70 111.81 2enk s SER 3 Ca 0.00 -1.31 0.00 0.00 0.48 0.00 0.00 55.95 55.12 2enk s SER 3 Cb 0.00 -0.38 0.00 0.00 0.10 0.00 0.00 66.02 65.74 2enk s SER 3 CO 0.00 -0.37 0.00 0.61 0.98 0.00 0.00 173.24 174.46 2enk n GLY 4 N -0.91 3.47 2.37 7.32 0.00 -1.26 -4.95 105.19 111.23 2enk n GLY 4 Ca -0.05 -0.47 -0.16 0.00 0.00 0.00 0.00 46.02 45.34 2enk n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2enk n SER 5 N 0.00 -4.69 -3.70 1.61 3.41 -1.26 -4.94 113.62 104.05 2enk n SER 5 Ca 0.00 0.18 -0.19 0.00 -0.26 0.00 0.00 58.87 58.60 2enk n SER 5 Cb 0.00 -4.02 -0.03 0.00 -0.26 0.00 0.00 64.21 59.90 2enk n SER 5 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2enk n SER 6 N -1.60 2.64 -4.59 4.04 3.41 -1.26 -5.11 113.62 111.15 2enk n SER 6 Ca -0.18 -2.33 -0.39 0.00 -0.26 0.00 0.00 58.87 55.71 2enk n SER 6 Cb 0.62 0.15 -0.10 0.00 -0.26 0.00 0.00 64.21 64.62 2enk n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2enk s GLY 7 N -2.89 1.90 0.08 5.00 0.00 -1.26 -4.91 107.32 105.24 2enk s GLY 7 Ca 0.06 -0.99 -0.01 0.00 0.00 0.00 0.00 44.72 43.79 2enk s GLY 7 CO 0.04 0.90 -0.01 1.17 0.00 0.00 0.00 173.10 175.19 2enk n LYS 8 N 5.28 0.02 -3.60 2.90 0.00 -1.26 -4.92 118.16 116.57 2enk n LYS 8 Ca -0.10 0.01 -0.36 0.00 0.00 0.00 0.00 58.31 57.86 2enk n LYS 8 Cb 0.51 -0.52 -0.06 0.00 0.00 0.00 0.00 35.03 34.96 2enk n LYS 8 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2enk n TYR 9 N -3.50 4.18 -3.75 5.64 4.02 -1.26 -4.99 117.16 117.50 2enk n TYR 9 Ca -0.01 -4.08 -0.29 0.00 -0.01 0.00 0.00 57.90 53.52 2enk n TYR 9 Cb 0.02 -1.14 -0.16 0.00 -0.02 0.00 0.00 39.34 38.04 2enk n TYR 9 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2enk s THR 10 N -1.47 0.73 -1.11 -0.72 -4.23 -1.26 -4.87 115.64 102.71 2enk s THR 10 Ca 0.28 -0.89 -0.07 0.00 -1.18 0.00 0.00 61.69 59.83 2enk s THR 10 Cb -0.06 -1.31 -0.04 0.00 1.34 0.00 0.00 72.50 72.43 2enk s THR 10 CO -0.12 -0.35 0.89 0.00 -0.54 0.00 0.00 174.62 174.51 2enk n GLN 11 N 4.95 -2.90 -2.91 3.99 3.00 -1.26 -4.95 117.38 117.30 2enk n GLN 11 Ca -0.07 0.78 -0.41 0.00 -0.01 0.00 0.00 57.00 57.28 2enk n GLN 11 Cb 0.45 -5.50 -0.04 0.00 0.00 0.00 0.00 30.24 25.15 2enk n GLN 11 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.06 178.27 2enk s ASN 12 N -3.62 7.00 -1.63 1.08 3.84 -1.26 -3.68 114.94 116.67 2enk s ASN 12 Ca 0.36 1.22 -0.01 0.00 0.21 0.00 0.00 52.86 54.64 2enk s ASN 12 Cb -0.07 -2.45 0.00 0.00 -0.55 0.00 0.00 41.25 38.18 2enk s ASN 12 CO 0.77 -0.31 0.15 -3.20 -2.79 0.00 0.00 177.10 171.72 2enk n ASN 13 N 4.71 -5.70 -4.16 -4.21 5.15 -1.26 -4.99 115.26 104.80 2enk n ASN 13 Ca 0.03 -0.09 -0.23 0.00 -0.60 0.00 0.00 54.58 53.69 2enk n ASN 13 Cb 0.50 -4.68 -0.15 0.00 -0.53 0.00 0.00 39.78 34.92 2enk n ASN 13 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 2enk s PHE 14 N -3.03 1.46 -0.01 1.20 0.40 -1.24 -4.28 117.98 112.48 2enk s PHE 14 Ca 0.08 -0.30 0.07 0.00 -0.60 0.00 0.00 56.93 56.18 2enk s PHE 14 Cb -0.03 -0.91 -0.02 0.00 0.51 0.00 0.00 43.02 42.56 2enk s PHE 14 CO 0.09 0.01 -0.23 -1.50 0.70 0.00 0.00 175.22 174.29 2enk s ILE 15 N -0.53 2.32 0.97 0.64 2.07 -0.74 -4.96 121.20 120.98 2enk s ILE 15 Ca 0.06 -1.09 -0.12 0.00 -1.41 0.00 0.00 60.65 58.09 2enk s ILE 15 Cb -0.07 -1.86 0.18 0.00 0.13 0.00 0.00 42.46 40.84 2enk s ILE 15 CO 0.00 0.53 1.08 -0.89 -1.91 0.00 0.00 174.94 173.75 2enk s THR 16 N -0.69 2.36 0.01 4.00 2.01 -1.26 -1.07 115.64 120.99 2enk s THR 16 Ca 0.11 0.12 -0.12 0.00 0.31 0.00 0.00 61.69 62.10 2enk s THR 16 Cb -0.10 -2.44 -0.07 0.00 0.01 0.00 0.00 72.50 69.90 2enk s THR 16 CO 0.00 -0.15 0.94 1.23 -0.69 0.00 0.00 174.62 175.95 2enk h GLY 17 N -1.89 -0.46 1.05 4.40 0.00 -1.79 -2.79 103.07 101.59 2enk h GLY 17 Ca -0.52 0.17 0.10 0.00 0.00 0.00 0.00 47.33 47.08 2enk h GLY 17 CO 0.52 -0.17 0.39 -0.24 0.00 0.00 0.00 176.54 177.04 2enk h VAL 18 N -0.55 0.88 -0.17 4.60 3.04 -1.90 0.43 116.25 122.58 2enk h VAL 18 Ca -0.05 -0.12 -0.00 0.00 -1.01 0.00 0.00 66.70 65.53 2enk h VAL 18 Cb 0.34 0.50 -0.01 0.00 -2.01 0.00 0.00 31.29 30.11 2enk h VAL 18 CO 0.07 0.06 0.11 0.03 -1.01 0.00 0.00 177.57 176.83 2enk h ARG 19 N 0.34 0.23 0.05 4.17 2.47 -1.93 0.17 114.38 119.88 2enk h ARG 19 Ca 0.27 -0.01 -0.32 0.00 -1.26 0.00 0.00 59.98 58.65 2enk h ARG 19 Cb 0.59 -0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 28.83 2enk h ARG 19 CO -0.07 0.16 -1.81 0.00 0.56 0.00 0.00 179.97 178.81 2enk h ALA 20 N 1.88 0.62 0.00 0.04 0.00 -0.70 -2.92 119.26 118.19 2enk h ALA 20 Ca 0.06 -1.42 -0.07 0.00 0.00 0.00 0.00 54.91 53.49 2enk h ALA 20 Cb -0.01 0.56 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2enk h ALA 20 CO -0.01 1.46 -0.32 0.82 0.00 0.00 0.00 179.25 181.20 2enk h ILE 21 N 0.03 0.78 0.00 0.00 2.04 -0.71 0.20 117.51 119.85 2enk h ILE 21 Ca -0.33 -1.35 -0.19 0.00 1.00 0.00 0.00 64.86 63.98 2enk h ILE 21 Cb 2.02 1.85 -0.03 0.00 -0.74 0.00 0.00 36.82 39.92 2enk h ILE 21 CO 0.09 0.31 -1.59 0.59 0.00 0.00 0.00 178.15 177.55 2enk n ASN 22 N -3.51 0.72 -0.07 1.72 3.02 0.55 -2.75 115.26 114.94 2enk n ASN 22 Ca -0.00 0.32 -0.04 0.00 -0.03 0.00 0.00 54.58 54.83 2enk n ASN 22 Cb 0.47 0.34 -0.01 0.00 -0.61 0.00 0.00 39.78 39.96 2enk n ASN 22 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2enk h GLU 23 N 0.00 0.00 0.00 3.52 4.39 -1.39 -3.37 114.58 117.72 2enk h GLU 23 Ca -0.21 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.49 2enk h GLU 23 Cb 1.67 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.32 2enk h GLU 23 CO 0.04 0.00 0.00 0.74 -1.16 0.00 0.00 179.01 178.63 2enk h PHE 24 N -1.00 0.00 -5.56 4.33 -1.00 -0.84 -3.46 116.94 109.42 2enk h PHE 24 Ca 0.00 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.64 2enk h PHE 24 Cb 0.41 0.00 0.06 0.00 3.61 0.00 0.00 35.95 40.04 2enk h PHE 24 CO -0.18 0.00 -0.40 0.00 -1.61 0.00 0.00 178.31 176.12 2enk n LEU 26 N -2.44 0.00 -4.91 0.00 4.77 -1.19 -5.04 117.00 108.19 2enk n LEU 26 Ca -0.05 -0.90 -0.27 0.00 -0.03 0.00 0.00 56.01 54.75 2enk n LEU 26 Cb 0.56 0.03 0.04 0.00 -2.33 0.00 0.00 43.42 41.72 2enk n LEU 26 CO 0.57 -0.28 0.60 -0.54 -1.33 0.00 0.00 177.39 176.40 2enk s LYS 27 N -2.64 2.77 0.19 3.23 -0.14 -1.26 -4.92 119.74 116.96 2enk s LYS 27 Ca 0.06 0.06 0.07 0.00 -1.36 0.00 0.00 55.97 54.80 2enk s LYS 27 Cb -0.00 -2.19 0.04 0.00 -1.68 0.00 0.00 37.83 34.00 2enk s LYS 27 CO 0.04 -0.88 1.42 1.03 -0.76 0.00 0.00 175.35 176.20 2enk h SER 28 N -0.37 0.06 0.99 2.83 0.87 -2.00 -3.22 113.55 112.71 2enk h SER 28 Ca -0.45 -0.05 -0.18 0.00 -1.23 0.00 0.00 61.79 59.87 2enk h SER 28 Cb 1.27 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 63.18 2enk h SER 28 CO 0.61 0.87 -1.08 0.28 -0.53 0.00 0.00 176.83 176.98 2enk h SER 29 N 0.03 0.00 0.28 6.23 0.02 -2.00 -3.34 113.55 114.76 2enk h SER 29 Ca -0.02 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2enk h SER 29 Cb 1.46 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.97 2enk h SER 29 CO 0.11 0.74 -0.42 0.44 -1.14 0.00 0.00 176.83 176.56 2enk h ASP 30 N 0.00 -1.20 -0.58 3.07 5.19 -1.95 -1.82 116.42 119.13 2enk h ASP 30 Ca -0.09 0.12 0.11 0.00 -0.62 0.00 0.00 57.03 56.54 2enk h ASP 30 Cb 1.65 0.42 -0.08 0.00 0.18 0.00 0.00 39.33 41.50 2enk h ASP 30 CO 0.08 -0.53 0.13 -0.07 -3.12 0.00 0.00 179.24 175.72 2enk h LEU 31 N -0.76 0.01 -1.76 1.55 -0.00 -1.71 0.11 115.31 112.74 2enk h LEU 31 Ca -0.01 0.11 0.14 0.00 -0.00 0.00 0.00 57.88 58.12 2enk h LEU 31 Cb 0.72 0.14 -0.04 0.00 -0.00 0.00 0.00 40.66 41.49 2enk h LEU 31 CO -0.15 0.02 0.43 -0.33 -0.00 0.00 0.00 178.44 178.41 2enk h GLU 32 N 0.26 0.24 -0.05 1.13 5.08 -1.57 0.13 114.58 119.79 2enk h GLU 32 Ca 0.30 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.61 2enk h GLU 32 Cb 0.44 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2enk h GLU 32 CO -0.39 0.16 -0.17 0.37 -1.00 0.00 0.00 179.01 177.98 2enk h GLN 33 N 0.24 0.09 -7.47 2.33 5.75 0.06 -3.44 115.11 112.67 2enk h GLN 33 Ca 0.30 -0.02 -0.46 0.00 -0.15 0.00 0.00 58.65 58.33 2enk h GLN 33 Cb 0.86 -0.01 0.13 0.00 1.07 0.00 0.00 27.48 29.53 2enk h GLN 33 CO -0.06 0.26 0.29 -0.51 -2.65 0.00 0.00 178.83 176.15 2enk s LEU 34 N -8.68 1.99 0.04 -2.39 1.43 0.45 -4.93 118.68 106.60 2enk s LEU 34 Ca -0.04 1.00 -0.31 0.00 -1.03 0.00 0.00 54.13 53.75 2enk s LEU 34 Cb 0.16 -3.32 -0.10 0.00 0.03 0.00 0.00 46.19 42.96 2enk s LEU 34 CO 0.71 -2.59 1.94 -1.14 0.23 0.00 0.00 176.35 175.50 2enk n ARG 35 N -3.80 2.77 -3.28 1.70 0.63 -1.26 -4.94 116.66 108.48 2enk n ARG 35 Ca 0.06 1.01 -0.44 0.00 -0.92 0.00 0.00 57.85 57.57 2enk n ARG 35 Cb 0.59 -2.95 -0.07 0.00 0.45 0.00 0.00 32.46 30.48 2enk n ARG 35 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 2enk s LYS 36 N 4.10 3.05 -0.27 -0.14 1.02 -1.26 -4.73 119.74 121.51 2enk s LYS 36 Ca 0.88 -1.12 -0.18 0.00 0.02 0.00 0.00 55.97 55.57 2enk s LYS 36 Cb -0.48 -4.11 -0.02 0.00 -0.52 0.00 0.00 37.83 32.70 2enk s LYS 36 CO 0.43 -1.12 0.53 0.42 -0.92 0.00 0.00 175.35 174.68 2enk s ILE 37 N 2.12 5.05 -0.28 2.17 1.09 -1.22 -5.03 121.20 125.10 2enk s ILE 37 Ca 0.09 0.84 -0.29 0.00 -1.10 0.00 0.00 60.65 60.19 2enk s ILE 37 Cb -0.22 -3.86 0.01 0.00 -1.06 0.00 0.00 42.46 37.34 2enk s ILE 37 CO 0.09 0.04 1.11 -0.60 -0.10 0.00 0.00 174.94 175.48 2enk s ARG 38 N 2.35 4.12 -0.18 2.79 3.52 -1.26 -3.58 118.95 126.70 2enk s ARG 38 Ca 0.21 1.22 -0.17 0.00 -0.13 0.00 0.00 55.73 56.87 2enk s ARG 38 Cb -0.16 -3.73 -0.06 0.00 -1.56 0.00 0.00 34.95 29.44 2enk s ARG 38 CO 0.10 -0.84 -0.32 0.54 -0.81 0.00 0.00 175.30 173.97 2enk n ARG 39 N 6.75 0.52 -4.24 5.12 5.12 -1.26 -5.08 116.66 123.60 2enk n ARG 39 Ca 0.12 0.26 -0.18 0.00 -1.93 0.00 0.00 57.85 56.13 2enk n ARG 39 Cb 0.47 -1.48 -0.08 0.00 -1.16 0.00 0.00 32.46 30.21 2enk n ARG 39 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2enk s ARG 40 N -2.78 1.73 -0.46 5.56 0.52 -1.26 -5.12 118.95 117.15 2enk s ARG 40 Ca -0.28 -1.93 0.07 0.00 -0.52 0.00 0.00 55.73 53.07 2enk s ARG 40 Cb 0.05 0.34 0.24 0.00 0.52 0.00 0.00 34.95 36.10 2enk s ARG 40 CO 0.41 -0.65 0.75 0.45 0.02 0.00 0.00 175.30 176.28 2enk n SER 41 N -1.39 -1.89 -4.67 0.23 2.88 -1.26 -4.93 113.62 102.59 2enk n SER 41 Ca 0.06 -3.07 -0.42 0.00 -1.33 0.00 0.00 58.87 54.10 2enk n SER 41 Cb 0.62 0.99 -0.03 0.00 -0.75 0.00 0.00 64.21 65.04 2enk n SER 41 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2enk s PRO 42 N 0.09 4.22 1.20 -1.46 0.04 -1.26 -4.82 135.00 133.02 2enk s PRO 42 Ca 0.33 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.38 2enk s PRO 42 Cb 0.20 -3.80 0.00 0.00 0.04 0.00 0.00 34.50 30.93 2enk s PRO 42 CO -0.19 -0.74 0.00 1.58 0.04 0.00 0.00 177.00 177.69 2enk n HIS 43 N 6.46 -2.28 -0.01 0.56 -0.00 -1.26 -4.40 115.22 114.28 2enk n HIS 43 Ca 0.15 0.45 -0.01 0.00 0.46 0.00 0.00 57.72 58.77 2enk n HIS 43 Cb 0.43 -0.67 -0.02 0.00 -0.12 0.00 0.00 29.99 29.62 2enk n HIS 43 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 2enk n GLU 44 N -2.21 3.42 0.11 1.57 1.02 -1.26 -4.66 120.64 118.64 2enk n GLU 44 Ca 0.00 -0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.11 2enk n GLU 44 Cb 0.17 -1.06 0.09 0.00 -0.02 0.00 0.00 31.44 30.61 2enk n GLU 44 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 2enk h ASP 45 N 0.00 0.00 -2.49 1.62 3.58 -2.01 -3.41 116.42 113.71 2enk h ASP 45 Ca -0.07 -0.00 -0.56 0.00 0.42 0.00 0.00 57.03 56.82 2enk h ASP 45 Cb 1.15 -0.00 -0.09 0.00 1.72 0.00 0.00 39.33 42.11 2enk h ASP 45 CO 0.00 0.73 0.95 -0.89 -2.88 0.00 0.00 179.24 177.15 2enk s THR 46 N -3.35 3.87 0.04 2.25 2.01 -1.26 -4.98 115.64 114.22 2enk s THR 46 Ca -0.01 0.30 -0.34 0.00 0.31 0.00 0.00 61.69 61.95 2enk s THR 46 Cb 0.12 -4.85 -0.13 0.00 0.01 0.00 0.00 72.50 67.65 2enk s THR 46 CO 0.78 -1.73 1.73 -0.62 -0.69 0.00 0.00 174.62 174.08 2enk n GLU 47 N 8.96 2.16 -0.49 4.92 4.71 -1.26 -4.81 120.64 134.83 2enk n GLU 47 Ca 0.02 0.79 -0.28 0.00 -0.01 0.00 0.00 57.16 57.68 2enk n GLU 47 Cb 0.48 -2.59 0.22 0.00 -1.01 0.00 0.00 31.44 28.54 2enk n GLU 47 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 2enk n SER 48 N 5.01 -2.82 -0.00 1.62 7.64 -1.26 -5.00 113.62 118.81 2enk n SER 48 Ca 0.20 -0.37 -0.01 0.00 1.01 0.00 0.00 58.87 59.70 2enk n SER 48 Cb 0.29 -0.99 -0.00 0.00 -1.01 0.00 0.00 64.21 62.50 2enk n SER 48 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 2enk n PHE 49 N -4.89 0.00 -1.18 1.43 1.16 -1.26 -5.14 117.46 107.57 2enk n PHE 49 Ca 0.05 0.00 0.13 0.00 -1.87 0.00 0.00 57.45 55.76 2enk n PHE 49 Cb 0.54 -0.04 -0.07 0.00 -1.61 0.00 0.00 39.48 38.30 2enk n PHE 49 CO 0.00 0.00 0.00 2.41 -1.87 0.00 0.00 176.76 177.30 2enk n THR 50 N -2.38 -0.87 -4.35 1.97 -1.04 -1.26 -4.52 114.28 101.84 2enk n THR 50 Ca -0.02 0.81 -0.18 0.00 -2.04 0.00 0.00 64.05 62.62 2enk n THR 50 Cb 0.52 -1.22 -0.10 0.00 -1.82 0.00 0.00 70.33 67.71 2enk n THR 50 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 2enk s VAL 51 N -4.13 1.66 0.38 12.58 -7.23 -1.24 -3.49 120.40 118.93 2enk s VAL 51 Ca 0.00 -2.18 0.05 0.00 -1.81 0.00 0.00 61.98 58.03 2enk s VAL 51 Cb 0.00 -2.09 -0.03 0.00 0.56 0.00 0.00 36.38 34.82 2enk s VAL 51 CO 0.00 -0.56 0.17 -0.31 -0.31 0.00 0.00 175.10 174.09 2enk s TYR 52 N -3.02 1.76 -0.16 2.82 2.02 -0.23 -3.43 117.35 117.10 2enk s TYR 52 Ca 0.23 -1.39 -0.10 0.00 -0.37 0.00 0.00 57.07 55.44 2enk s TYR 52 Cb 0.00 -1.02 -0.05 0.00 -0.40 0.00 0.00 41.96 40.49 2enk s TYR 52 CO 0.07 -0.46 0.16 -0.51 -1.57 0.00 0.00 175.55 173.24 2enk s LEU 53 N -3.54 4.28 0.50 -1.29 1.02 -1.26 -1.79 118.68 116.61 2enk s LEU 53 Ca 0.28 0.36 0.16 0.00 0.02 0.00 0.00 54.13 54.96 2enk s LEU 53 Cb 0.02 -2.13 1.22 0.00 0.02 0.00 0.00 46.19 45.33 2enk s LEU 53 CO 0.18 0.25 2.11 0.03 0.02 0.00 0.00 176.35 178.94 2enk h ARG 54 N 6.07 0.09 -0.19 1.70 3.08 -1.91 -1.11 114.38 122.10 2enk h ARG 54 Ca -0.46 -0.01 -0.14 0.00 0.07 0.00 0.00 59.98 59.44 2enk h ARG 54 Cb 1.18 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.20 2enk h ARG 54 CO 0.70 0.06 -0.48 0.77 -1.07 0.00 0.00 179.97 179.94 2enk h SER 55 N 0.09 0.54 0.16 7.04 0.02 -1.93 -2.22 113.55 117.25 2enk h SER 55 Ca 0.07 -0.27 -0.01 0.00 -0.84 0.00 0.00 61.79 60.74 2enk h SER 55 Cb 0.15 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2enk h SER 55 CO -0.01 0.94 -0.08 0.44 -1.14 0.00 0.00 176.83 176.98 2enk h ASP 56 N 0.40 -0.19 -0.71 3.07 3.32 -1.65 -3.22 116.42 117.44 2enk h ASP 56 Ca 0.02 -0.35 0.10 0.00 0.02 0.00 0.00 57.03 56.82 2enk h ASP 56 Cb 0.99 0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.54 2enk h ASP 56 CO 0.09 0.33 0.47 0.58 -1.72 0.00 0.00 179.24 178.99 2enk h VAL 57 N -0.79 0.91 0.23 -1.35 2.07 -1.41 -1.89 116.25 114.03 2enk h VAL 57 Ca -0.02 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.30 2enk h VAL 57 Cb 0.53 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 2enk h VAL 57 CO 0.04 0.10 -0.48 -0.08 0.02 0.00 0.00 177.57 177.17 2enk h GLU 58 N 0.57 -0.75 -0.63 1.57 4.81 -1.41 -1.65 114.58 117.08 2enk h GLU 58 Ca 0.33 0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.59 2enk h GLU 58 Cb 0.52 0.17 -0.03 0.00 0.63 0.00 0.00 28.75 30.04 2enk h GLU 58 CO -0.11 -0.50 0.31 0.00 -0.73 0.00 0.00 179.01 177.98 2enk h ALA 59 N -0.74 1.36 -0.24 2.92 0.00 -1.51 -1.71 119.26 119.34 2enk h ALA 59 Ca -0.02 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.83 2enk h ALA 59 Cb 0.74 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2enk h ALA 59 CO -0.20 0.50 0.23 -0.22 0.00 0.00 0.00 179.25 179.57 2enk h LYS 60 N 0.89 0.00 0.00 0.00 1.63 -0.74 0.17 116.57 118.52 2enk h LYS 60 Ca 0.22 0.00 -0.15 0.00 -0.85 0.00 0.00 60.65 59.87 2enk h LYS 60 Cb 0.08 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.68 2enk h LYS 60 CO -0.03 0.00 -0.89 1.03 -3.45 0.00 0.00 179.45 176.11 2enk h SER 61 N 0.00 0.00 0.67 4.20 0.87 -0.39 -3.08 113.55 115.82 2enk h SER 61 Ca 0.11 0.00 -0.27 0.00 -1.23 0.00 0.00 61.79 60.40 2enk h SER 61 Cb 0.57 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.52 2enk h SER 61 CO -0.00 0.64 -1.26 -0.07 -0.53 0.00 0.00 176.83 175.60 2enk h LEU 62 N 0.00 0.31 -0.72 2.23 3.38 -0.64 -2.12 115.31 117.76 2enk h LEU 62 Ca -0.06 -0.36 -0.08 0.00 0.09 0.00 0.00 57.88 57.48 2enk h LEU 62 Cb 1.54 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.18 2enk h LEU 62 CO 0.07 1.28 -0.37 1.05 0.09 0.00 0.00 178.44 180.57 2enk h GLU 63 N 0.05 0.00 0.00 1.13 -0.00 -1.10 -0.87 114.58 113.79 2enk h GLU 63 Ca -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.23 2enk h GLU 63 Cb 1.94 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.69 2enk h GLU 63 CO 0.18 0.37 0.00 0.28 -0.00 0.00 0.00 179.01 179.83 2enk n VAL 64 N -3.41 0.00 0.29 -1.06 0.31 -1.16 -4.44 118.33 108.86 2enk n VAL 64 Ca 0.00 0.35 0.14 0.00 -0.01 0.00 0.00 64.34 64.82 2enk n VAL 64 Cb 0.55 -1.20 0.86 0.00 -0.91 0.00 0.00 33.84 33.13 2enk n VAL 64 CO 0.00 0.00 0.00 -0.50 -1.32 0.00 0.00 176.83 175.01 2enk h TRP 65 N 0.00 0.00 0.00 3.52 4.06 -1.56 -3.46 115.95 118.51 2enk h TRP 65 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2enk h TRP 65 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 2enk h TRP 65 CO 0.00 0.02 0.00 0.41 -3.56 0.00 0.00 178.44 175.31 2enk n GLY 66 N -1.28 3.09 3.37 1.49 0.00 -0.33 -4.93 105.19 106.60 2enk n GLY 66 Ca -0.03 -1.00 -0.11 0.00 0.00 0.00 0.00 46.02 44.89 2enk n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2enk s SER 67 N 0.00 -0.32 0.46 1.61 1.04 -1.22 -4.69 113.70 110.58 2enk s SER 67 Ca 0.00 -0.26 0.31 0.00 0.48 0.00 0.00 55.95 56.48 2enk s SER 67 Cb 0.00 0.52 1.27 0.00 0.10 0.00 0.00 66.02 67.91 2enk s SER 67 CO 0.00 -0.91 1.90 1.55 0.98 0.00 0.00 173.24 176.77 2enk h PRO 68 N 2.25 0.00 -0.03 4.02 0.13 -1.90 -2.87 132.00 133.60 2enk h PRO 68 Ca -0.33 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.61 2enk h PRO 68 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 2enk h PRO 68 CO 0.44 0.00 -0.80 0.93 -0.23 0.00 0.00 178.00 178.34 2enk h GLU 69 N 0.00 0.30 -0.51 0.86 4.39 -1.98 -2.22 114.58 115.41 2enk h GLU 69 Ca 0.00 -0.28 -0.08 0.00 0.34 0.00 0.00 59.36 59.35 2enk h GLU 69 Cb 0.44 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.14 2enk h GLU 69 CO 0.00 0.95 0.03 0.00 -1.16 0.00 0.00 179.01 178.83 2enk h ALA 70 N 0.96 0.69 -0.23 3.43 0.00 -1.86 -2.94 119.26 119.31 2enk h ALA 70 Ca -0.04 -0.27 -0.20 0.00 0.00 0.00 0.00 54.91 54.40 2enk h ALA 70 Cb 1.39 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2enk h ALA 70 CO 0.13 0.48 -0.64 1.25 0.00 0.00 0.00 179.25 180.47 2enk h LEU 71 N 0.76 0.95 -1.75 0.00 5.85 -1.61 -3.09 115.31 116.42 2enk h LEU 71 Ca 0.15 -0.56 0.16 0.00 0.84 0.00 0.00 57.88 58.47 2enk h LEU 71 Cb 0.48 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 2enk h LEU 71 CO 0.02 1.36 0.48 0.00 -0.34 0.00 0.00 178.44 179.95 2enk h ALA 72 N 0.65 2.30 -0.47 1.25 0.00 -1.32 0.93 119.26 122.60 2enk h ALA 72 Ca -0.01 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.95 2enk h ALA 72 Cb 1.26 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 2enk h ALA 72 CO 0.14 -0.49 0.32 0.00 0.00 0.00 0.00 179.25 179.21 2enk h ARG 73 N 0.25 0.39 0.00 0.00 2.47 -1.43 -1.11 114.38 114.95 2enk h ARG 73 Ca 0.34 -0.02 -0.25 0.00 -1.26 0.00 0.00 59.98 58.79 2enk h ARG 73 Cb 0.98 -0.09 -0.04 0.00 -1.65 0.00 0.00 29.97 29.17 2enk h ARG 73 CO -0.07 0.26 -1.62 0.39 0.56 0.00 0.00 179.97 179.49 2enk n GLU 74 N -4.47 0.63 -0.21 0.04 -0.58 0.22 -4.10 120.64 112.16 2enk n GLU 74 Ca 0.06 0.27 -0.07 0.00 -0.42 0.00 0.00 57.16 57.01 2enk n GLU 74 Cb 0.25 -1.80 0.08 0.00 -0.57 0.00 0.00 31.44 29.40 2enk n GLU 74 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2enk h LYS 75 N 0.00 1.04 0.08 3.49 1.57 -0.43 -2.07 116.57 120.25 2enk h LYS 75 Ca -0.25 -0.27 0.02 0.00 -1.87 0.00 0.00 60.65 58.29 2enk h LYS 75 Cb 1.87 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 34.02 2enk h LYS 75 CO 0.07 0.95 -0.19 -0.22 -0.57 0.00 0.00 179.45 179.49 2enk h LYS 76 N 0.98 -0.34 0.24 3.15 3.64 -1.39 0.21 116.57 123.06 2enk h LYS 76 Ca 0.20 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 2enk h LYS 76 Cb 0.42 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 2enk h LYS 76 CO 0.01 -0.23 -0.12 -0.07 -2.27 0.00 0.00 179.45 176.78 2enk h LEU 77 N -0.35 -0.27 -1.13 5.20 -0.00 -1.70 -2.45 115.31 114.61 2enk h LEU 77 Ca 0.03 -0.00 0.12 0.00 -0.00 0.00 0.00 57.88 58.03 2enk h LEU 77 Cb 0.39 0.07 -0.07 0.00 -0.00 0.00 0.00 40.66 41.04 2enk h LEU 77 CO -0.12 -0.18 0.60 0.03 -0.00 0.00 0.00 178.44 178.77 2enk h ARG 78 N -0.34 0.88 0.70 1.13 2.47 -1.21 -2.05 114.38 115.96 2enk h ARG 78 Ca -0.03 -0.05 -0.03 0.00 -1.26 0.00 0.00 59.98 58.61 2enk h ARG 78 Cb 0.26 -0.20 -0.00 0.00 -1.65 0.00 0.00 29.97 28.38 2enk h ARG 78 CO 0.05 0.58 -0.44 -0.22 0.56 0.00 0.00 179.97 180.51 2enk h LYS 79 N 0.90 -1.03 -0.74 0.04 3.64 -0.22 -1.73 116.57 117.43 2enk h LYS 79 Ca 0.46 0.07 0.18 0.00 -1.27 0.00 0.00 60.65 60.09 2enk h LYS 79 Cb 0.50 0.24 -0.04 0.00 -0.41 0.00 0.00 32.23 32.51 2enk h LYS 79 CO -0.22 -0.69 0.51 0.93 -2.27 0.00 0.00 179.45 177.71 2enk h GLU 80 N -1.07 0.22 -0.07 1.90 4.39 -1.05 -1.15 114.58 117.74 2enk h GLU 80 Ca -0.09 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 2enk h GLU 80 Cb 0.87 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.46 2enk h GLU 80 CO 0.09 0.15 0.02 0.00 -1.16 0.00 0.00 179.01 178.11 2enk h ALA 81 N 1.65 0.10 -0.96 3.43 0.00 -0.79 -2.29 119.26 120.41 2enk h ALA 81 Ca 0.36 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.20 2enk h ALA 81 Cb 1.09 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.79 2enk h ALA 81 CO -0.08 -0.27 0.61 0.93 0.00 0.00 0.00 179.25 180.44 2enk h GLU 82 N -0.10 1.10 -0.81 0.00 5.08 -0.35 -1.81 114.58 117.70 2enk h GLU 82 Ca 0.02 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 2enk h GLU 82 Cb 0.25 -0.25 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 2enk h GLU 82 CO 0.00 0.73 0.36 0.82 -1.00 0.00 0.00 179.01 179.92 2enk h ILE 83 N 1.13 1.26 0.00 3.13 2.04 -1.31 0.10 117.51 123.86 2enk h ILE 83 Ca 0.41 -0.76 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 2enk h ILE 83 Cb 0.13 0.25 -0.00 0.00 -0.74 0.00 0.00 36.82 36.46 2enk h ILE 83 CO -0.16 0.32 -0.12 -0.33 0.00 0.00 0.00 178.15 177.85 2enk h GLU 84 N 1.16 0.00 0.00 2.37 4.39 -0.75 0.37 114.58 122.12 2enk h GLU 84 Ca 0.27 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.95 2enk h GLU 84 Cb 0.16 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.81 2enk h GLU 84 CO -0.03 0.12 -0.40 -0.92 -1.16 0.00 0.00 179.01 176.62 2enk h TYR 85 N 0.00 0.00 -0.05 4.33 3.20 -0.93 -3.36 116.97 120.16 2enk h TYR 85 Ca -0.00 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.88 2enk h TYR 85 Cb 0.29 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.56 2enk h TYR 85 CO 0.00 0.17 0.10 0.07 -1.64 0.00 0.00 178.16 176.86 2enk h ARG 86 N -1.00 0.00 -0.90 1.82 0.11 -0.84 -1.74 114.38 111.83 2enk h ARG 86 Ca -0.03 0.00 0.21 0.00 0.10 0.00 0.00 59.98 60.26 2enk h ARG 86 Cb 0.45 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.46 2enk h ARG 86 CO -0.02 0.00 0.60 0.93 0.10 0.00 0.00 179.97 181.58 2enk h GLU 87 N 0.00 0.33 0.00 0.08 4.39 -1.06 0.25 114.58 118.56 2enk h GLU 87 Ca 0.03 -0.02 -0.11 0.00 0.34 0.00 0.00 59.36 59.59 2enk h GLU 87 Cb 0.23 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 2enk h GLU 87 CO -0.00 0.22 -1.04 0.07 -1.16 0.00 0.00 179.01 177.09 2enk h ARG 88 N 0.34 0.00 0.00 2.33 -0.00 -1.53 -3.32 114.38 112.21 2enk h ARG 88 Ca 0.46 0.00 -0.05 0.00 -0.00 0.00 0.00 59.98 60.40 2enk h ARG 88 Cb 1.25 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.22 2enk h ARG 88 CO -0.15 0.28 -0.21 -0.07 -0.00 0.00 0.00 179.97 179.81 2enk h LEU 89 N 0.00 0.00 -2.02 0.08 -0.00 -0.56 -2.44 115.31 110.37 2enk h LEU 89 Ca -0.09 0.00 0.14 0.00 -0.00 0.00 0.00 57.88 57.93 2enk h LEU 89 Cb 1.40 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 42.04 2enk h LEU 89 CO 0.04 0.21 0.39 -0.26 -0.00 0.00 0.00 178.44 178.83 2enk h PHE 90 N 0.00 0.00 -0.13 1.13 -1.00 -1.52 0.30 116.94 115.72 2enk h PHE 90 Ca -0.00 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 2enk h PHE 90 Cb 0.43 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.98 2enk h PHE 90 CO 0.00 0.00 0.01 -0.09 -1.61 0.00 0.00 178.31 176.62 2enk h ARG 91 N 0.00 0.18 0.00 1.51 2.43 -1.68 -3.30 114.38 113.53 2enk h ARG 91 Ca 0.23 -0.02 -0.24 0.00 -0.81 0.00 0.00 59.98 59.13 2enk h ARG 91 Cb 1.01 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.48 2enk h ARG 91 CO -0.00 0.19 -1.76 -1.71 -1.51 0.00 0.00 179.97 175.18 2enk n ASN 92 N -4.44 1.78 -2.65 -3.80 2.85 0.52 -5.10 115.26 104.42 2enk n ASN 92 Ca -0.01 0.30 -0.03 0.00 -0.11 0.00 0.00 54.58 54.74 2enk n ASN 92 Cb 0.14 -0.71 -0.02 0.00 1.24 0.00 0.00 39.78 40.43 2enk n ASN 92 CO 0.00 0.00 0.00 1.67 -2.11 0.00 0.00 177.26 176.82 2enk n GLN 93 N -4.20 -4.00 -2.35 1.20 7.27 0.76 -4.80 117.38 111.26 2enk n GLN 93 Ca -0.34 3.10 -0.03 0.00 0.07 0.00 0.00 57.00 59.80 2enk n GLN 93 Cb 0.69 -5.24 -0.03 0.00 2.41 0.00 0.00 30.24 28.07 2enk n GLN 93 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 2enk n LYS 94 N 1.15 -4.21 -0.04 3.69 4.76 -1.26 -4.79 118.16 117.45 2enk n LYS 94 Ca -0.19 3.19 0.20 0.00 -2.87 0.00 0.00 58.31 58.64 2enk n LYS 94 Cb 0.30 -4.42 0.67 0.00 -1.84 0.00 0.00 35.03 29.73 2enk n LYS 94 CO 0.00 0.00 0.00 0.97 -1.37 0.00 0.00 177.40 177.00 2enk h ILE 95 N 3.62 0.73 -5.21 -0.18 2.10 -1.98 -3.46 117.51 113.14 2enk h ILE 95 Ca -0.33 -0.02 -0.23 0.00 1.08 0.00 0.00 64.86 65.37 2enk h ILE 95 Cb 0.73 0.67 0.18 0.00 -1.09 0.00 0.00 36.82 37.31 2enk h ILE 95 CO 0.01 0.01 -0.77 -0.11 -1.08 0.00 0.00 178.15 176.21 2enk n LEU 96 N -4.38 -5.19 -4.98 2.19 7.94 -1.26 -5.03 117.00 106.28 2enk n LEU 96 Ca 0.11 -0.63 -0.19 0.00 -1.11 0.00 0.00 56.01 54.19 2enk n LEU 96 Cb 0.62 -2.94 -0.00 0.00 0.53 0.00 0.00 43.42 41.63 2enk n LEU 96 CO 0.36 0.11 0.07 -0.13 -1.11 0.00 0.00 177.39 176.70 2enk s ARG 97 N -4.31 2.98 0.97 1.96 1.81 -1.26 -5.11 118.95 115.99 2enk s ARG 97 Ca 0.39 -1.12 -0.16 0.00 -1.72 0.00 0.00 55.73 53.11 2enk s ARG 97 Cb -0.05 -2.76 0.24 0.00 -0.45 0.00 0.00 34.95 31.93 2enk s ARG 97 CO 0.66 -0.04 0.83 -0.85 -0.68 0.00 0.00 175.30 175.22 2enk n GLU 98 N -1.68 -2.84 -4.91 3.54 0.00 -1.26 -5.05 120.64 108.44 2enk n GLU 98 Ca 0.02 -1.33 -0.32 0.00 0.00 0.00 0.00 57.16 55.53 2enk n GLU 98 Cb 0.59 -1.29 -0.13 0.00 0.00 0.00 0.00 31.44 30.60 2enk n GLU 98 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.13 178.65 2enk s TYR 99 N -2.46 2.64 -0.18 -1.84 1.13 -1.26 -5.02 117.35 110.36 2enk s TYR 99 Ca 0.55 -0.20 0.17 0.00 -1.41 0.00 0.00 57.07 56.17 2enk s TYR 99 Cb -0.06 -1.59 -0.25 0.00 -1.10 0.00 0.00 41.96 38.96 2enk s TYR 99 CO 0.42 0.17 0.13 0.54 -2.51 0.00 0.00 175.55 174.30 2enk n ARG 100 N 2.22 0.68 0.00 -3.49 5.12 -1.26 -5.36 116.66 114.58 2enk n ARG 100 Ca -0.17 0.03 0.12 0.00 -1.93 0.00 0.00 57.85 55.91 2enk n ARG 100 Cb 0.52 -1.55 0.18 0.00 -1.16 0.00 0.00 32.46 30.44 2enk n ARG 100 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45