#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c01 s ALA 2 N 0.00 -1.37 -0.77 -1.46 0.00 -0.98 -4.60 121.76 112.58 1c01 s ALA 2 Ca 0.00 1.81 -0.17 0.00 0.00 0.00 0.00 51.96 53.60 1c01 s ALA 2 Cb 0.00 -1.08 0.16 0.00 0.00 0.00 0.00 23.12 22.20 1c01 s ALA 2 CO 0.00 -0.30 0.83 0.12 0.00 0.00 0.00 175.76 176.41 1c01 s PHE 3 N 1.23 3.34 0.56 0.00 5.36 -0.48 -1.47 117.98 126.52 1c01 s PHE 3 Ca -0.08 -1.49 -0.18 0.00 -0.96 0.00 0.00 56.93 54.22 1c01 s PHE 3 Cb -0.06 -4.00 -0.05 0.00 -0.34 0.00 0.00 43.02 38.57 1c01 s PHE 3 CO -0.12 -1.21 1.08 0.99 -1.46 0.00 0.00 175.22 174.50 1c01 s THR 4 N 1.64 3.54 0.05 0.12 2.01 -0.21 -1.92 115.64 120.88 1c01 s THR 4 Ca 0.19 0.84 -0.14 0.00 0.31 0.00 0.00 61.69 62.90 1c01 s THR 4 Cb -0.14 -3.33 0.02 0.00 0.01 0.00 0.00 72.50 69.06 1c01 s THR 4 CO -0.04 -0.32 0.30 0.68 -0.69 0.00 0.00 174.62 174.56 1c01 s VAL 5 N -2.13 0.08 0.10 3.82 -7.23 -0.11 -0.90 120.40 114.03 1c01 s VAL 5 Ca 0.67 -0.68 0.03 0.00 -1.81 0.00 0.00 61.98 60.19 1c01 s VAL 5 Cb -0.19 -0.95 -0.04 0.00 0.56 0.00 0.00 36.38 35.76 1c01 s VAL 5 CO 0.31 -0.38 -0.09 0.26 -0.31 0.00 0.00 175.10 174.89 1c01 s TRP 6 N -2.61 1.01 0.24 2.82 0.51 0.38 -2.10 118.94 119.19 1c01 s TRP 6 Ca -0.05 -0.75 -0.07 0.00 -2.12 0.00 0.00 56.10 53.12 1c01 s TRP 6 Cb -0.01 -0.56 0.22 0.00 -0.81 0.00 0.00 33.47 32.32 1c01 s TRP 6 CO -0.04 -0.04 1.90 0.66 -0.51 0.00 0.00 176.95 178.92 1c01 h SER 7 N 3.31 1.09 -4.29 2.95 4.64 -1.82 -0.91 113.55 118.51 1c01 h SER 7 Ca -0.36 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1c01 h SER 7 Cb 1.18 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1c01 h SER 7 CO 0.58 0.81 0.00 0.61 -0.87 0.00 0.00 176.83 177.96 1c01 n GLY 8 N -1.29 4.14 0.11 -0.77 0.00 -1.26 -2.65 105.19 103.47 1c01 n GLY 8 Ca 0.10 -1.56 -0.20 0.00 0.00 0.00 0.00 46.02 44.36 1c01 n GLY 8 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1c01 h PRO 9 N 0.00 0.25 0.00 1.61 0.14 -1.89 -3.45 132.00 128.66 1c01 h PRO 9 Ca 0.00 -0.42 0.00 0.00 0.14 0.00 0.00 66.00 65.72 1c01 h PRO 9 Cb 0.00 0.16 0.00 0.00 0.14 0.00 0.00 31.00 31.30 1c01 h PRO 9 CO 0.00 1.20 0.00 0.41 0.14 0.00 0.00 178.00 179.75 1c01 n GLY 10 N 1.67 2.51 2.25 1.56 0.00 -1.26 -4.26 105.19 107.65 1c01 n GLY 10 Ca -0.16 -1.32 -0.32 0.00 0.00 0.00 0.00 46.02 44.22 1c01 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c01 n ASN 12 N -0.86 0.19 0.00 0.00 3.02 -1.26 -4.99 115.26 111.36 1c01 n ASN 12 Ca 0.58 -2.77 0.00 0.00 -0.03 0.00 0.00 54.58 52.36 1c01 n ASN 12 Cb 0.74 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 1c01 n ASN 12 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1c01 n ASN 13 N 1.21 0.00 -4.44 6.41 6.94 -1.26 -4.86 115.26 119.26 1c01 n ASN 13 Ca 0.21 0.00 -0.44 0.00 -0.02 0.00 0.00 54.58 54.33 1c01 n ASN 13 Cb 0.56 0.00 -0.03 0.00 -2.36 0.00 0.00 39.78 37.95 1c01 n ASN 13 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 1c01 s ARG 14 N 0.00 3.51 -0.16 -3.83 6.06 -1.26 -4.95 118.95 118.32 1c01 s ARG 14 Ca 0.00 -1.68 -0.29 0.00 -2.50 0.00 0.00 55.73 51.25 1c01 s ARG 14 Cb 0.00 -4.76 -0.05 0.00 0.06 0.00 0.00 34.95 30.20 1c01 s ARG 14 CO 0.00 -1.73 1.83 0.00 -2.50 0.00 0.00 175.30 172.91 1c01 s ALA 15 N 2.65 3.22 0.04 6.12 0.00 -1.26 -3.58 121.76 128.94 1c01 s ALA 15 Ca 0.29 0.74 -0.08 0.00 0.00 0.00 0.00 51.96 52.91 1c01 s ALA 15 Cb -0.08 -3.90 0.00 0.00 0.00 0.00 0.00 23.12 19.14 1c01 s ALA 15 CO -0.06 -2.05 0.17 -2.00 0.00 0.00 0.00 175.76 171.82 1c01 s GLU 16 N 5.00 0.66 0.00 0.00 -6.30 -0.89 -5.05 118.70 112.12 1c01 s GLU 16 Ca 0.82 -0.65 -0.16 0.00 -2.50 0.00 0.00 54.97 52.48 1c01 s GLU 16 Cb -0.31 0.27 0.03 0.00 0.00 0.00 0.00 34.13 34.12 1c01 s GLU 16 CO 0.33 -0.18 0.36 0.50 0.02 0.00 0.00 175.26 176.28 1c01 s ARG 17 N -2.52 0.77 -0.45 4.30 3.52 -1.26 -0.94 118.95 122.37 1c01 s ARG 17 Ca -0.05 -0.24 0.04 0.00 -0.13 0.00 0.00 55.73 55.34 1c01 s ARG 17 Cb -0.01 0.34 0.12 0.00 -1.56 0.00 0.00 34.95 33.84 1c01 s ARG 17 CO -0.04 -0.23 0.18 0.71 -0.81 0.00 0.00 175.30 175.11 1c01 s TYR 18 N -1.71 3.26 -0.10 5.12 2.02 -0.81 -4.92 117.35 120.20 1c01 s TYR 18 Ca -0.11 -3.03 0.14 0.00 -0.37 0.00 0.00 57.07 53.71 1c01 s TYR 18 Cb -0.03 -2.76 -0.20 0.00 -0.40 0.00 0.00 41.96 38.56 1c01 s TYR 18 CO 0.02 -0.82 0.14 -1.13 -1.57 0.00 0.00 175.55 172.20 1c01 n SER 19 N 3.58 1.41 -4.58 2.29 3.41 -1.26 -1.38 113.62 117.09 1c01 n SER 19 Ca 0.05 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.25 1c01 n SER 19 Cb 0.36 1.13 0.02 0.00 -0.26 0.00 0.00 64.21 65.46 1c01 n SER 19 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1c01 n LYS 20 N -2.38 1.15 -0.89 4.33 4.76 -1.26 -4.69 118.16 119.18 1c01 n LYS 20 Ca -0.17 0.42 -0.29 0.00 -2.87 0.00 0.00 58.31 55.40 1c01 n LYS 20 Cb 0.79 -1.98 0.20 0.00 -1.84 0.00 0.00 35.03 32.21 1c01 n LYS 20 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1c01 n GLY 22 N -0.23 -2.05 3.87 0.00 0.00 0.48 -4.79 105.19 102.47 1c01 n GLY 22 Ca 0.05 -1.38 -0.36 0.00 0.00 0.00 0.00 46.02 44.33 1c01 n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c01 s SER 24 N -1.43 1.95 -0.16 0.00 1.04 -0.99 -4.87 113.70 109.25 1c01 s SER 24 Ca 0.25 -0.31 -0.29 0.00 0.48 0.00 0.00 55.95 56.08 1c01 s SER 24 Cb -0.14 -0.21 -0.01 0.00 0.10 0.00 0.00 66.02 65.76 1c01 s SER 24 CO 0.13 0.20 1.10 0.00 0.98 0.00 0.00 173.24 175.66 1c01 s ALA 25 N -0.41 3.59 0.35 5.32 0.00 -1.26 -1.08 121.76 128.27 1c01 s ALA 25 Ca 0.06 0.35 -0.16 0.00 0.00 0.00 0.00 51.96 52.21 1c01 s ALA 25 Cb -0.06 -3.53 -0.09 0.00 0.00 0.00 0.00 23.12 19.43 1c01 s ALA 25 CO -0.01 -0.93 0.78 0.42 0.00 0.00 0.00 175.76 176.03 1c01 s ILE 26 N 2.83 4.62 0.00 0.00 1.01 -0.47 -4.94 121.20 124.25 1c01 s ILE 26 Ca 0.49 1.06 0.00 0.00 0.00 0.00 0.00 60.65 62.20 1c01 s ILE 26 Cb -0.19 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.68 1c01 s ILE 26 CO 0.13 -0.22 0.00 1.41 0.00 0.00 0.00 174.94 176.26 1c01 n HIS 27 N -0.44 0.00 -2.81 3.97 8.25 -1.26 -4.81 115.22 118.12 1c01 n HIS 27 Ca 0.04 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.07 1c01 n HIS 27 Cb 0.53 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.63 1c01 n HIS 27 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1c01 s GLN 28 N -0.38 3.84 -1.30 -0.41 -1.52 -1.26 -4.88 119.66 113.75 1c01 s GLN 28 Ca 0.00 -1.99 -0.07 0.00 -1.95 0.00 0.00 55.36 51.35 1c01 s GLN 28 Cb 0.00 -5.16 0.14 0.00 -0.22 0.00 0.00 33.01 27.77 1c01 s GLN 28 CO 0.00 -1.94 2.15 1.63 -0.25 0.00 0.00 175.29 176.88 1c01 n LYS 29 N 6.97 4.16 0.11 2.91 5.02 -1.25 -4.22 118.16 131.87 1c01 n LYS 29 Ca 0.35 -3.50 0.00 0.00 -2.02 0.00 0.00 58.31 53.13 1c01 n LYS 29 Cb 0.47 -2.76 0.00 0.00 -0.02 0.00 0.00 35.03 32.72 1c01 n LYS 29 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1c01 n GLY 30 N 2.20 -0.23 3.80 0.72 0.00 -0.39 -4.59 105.19 106.71 1c01 n GLY 30 Ca 0.52 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.46 1c01 n GLY 30 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c01 s GLY 31 N -4.85 -0.16 -0.28 -0.02 0.00 -0.97 -0.95 107.32 100.09 1c01 s GLY 31 Ca 0.00 -0.20 -0.18 0.00 0.00 0.00 0.00 44.72 44.34 1c01 s GLY 31 CO 0.00 -0.06 0.73 -2.52 0.00 0.00 0.00 173.10 171.25 1c01 s TYR 32 N -3.89 -0.96 -0.36 1.90 1.13 -0.72 -0.47 117.35 114.00 1c01 s TYR 32 Ca 0.10 1.98 -0.02 0.00 -1.41 0.00 0.00 57.07 57.72 1c01 s TYR 32 Cb -0.05 0.54 0.08 0.00 -1.10 0.00 0.00 41.96 41.43 1c01 s TYR 32 CO 0.04 -0.47 0.10 0.34 -2.51 0.00 0.00 175.55 173.06 1c01 s ASP 33 N 1.35 5.07 0.44 -0.18 -1.08 -0.08 -0.37 116.67 121.83 1c01 s ASP 33 Ca -0.08 -1.69 -0.15 0.00 -0.52 0.00 0.00 52.55 50.11 1c01 s ASP 33 Cb -0.05 -1.77 -0.08 0.00 -1.46 0.00 0.00 42.92 39.56 1c01 s ASP 33 CO -0.15 -0.41 0.88 0.12 0.52 0.00 0.00 175.17 176.13 1c01 s PHE 34 N 1.18 3.43 -0.28 -5.34 5.36 -0.14 -1.04 117.98 121.14 1c01 s PHE 34 Ca 0.03 1.32 -0.01 0.00 -0.96 0.00 0.00 56.93 57.30 1c01 s PHE 34 Cb -0.21 -2.66 0.13 0.00 -0.34 0.00 0.00 43.02 39.94 1c01 s PHE 34 CO -0.03 -0.19 0.27 0.45 -1.46 0.00 0.00 175.22 174.25 1c01 s SER 35 N -2.88 1.92 0.18 6.13 0.15 -0.54 -1.18 113.70 117.46 1c01 s SER 35 Ca 0.56 -0.79 -0.30 0.00 0.70 0.00 0.00 55.95 56.12 1c01 s SER 35 Cb -0.10 0.38 -0.08 0.00 -1.71 0.00 0.00 66.02 64.51 1c01 s SER 35 CO 0.27 -0.39 1.23 -0.47 1.20 0.00 0.00 173.24 175.08 1c01 s TYR 36 N 2.32 3.38 -0.37 3.44 5.04 -1.26 -2.32 117.35 127.58 1c01 s TYR 36 Ca 0.09 1.36 0.12 0.00 -2.44 0.00 0.00 57.07 56.21 1c01 s TYR 36 Cb -0.14 -3.47 0.39 0.00 0.35 0.00 0.00 41.96 39.08 1c01 s TYR 36 CO -0.32 -1.39 0.97 0.25 -1.34 0.00 0.00 175.55 173.72 1c01 n THR 37 N 2.66 0.27 0.00 4.34 -2.24 -1.26 -4.62 114.28 113.43 1c01 n THR 37 Ca 0.05 -3.07 0.00 0.00 -2.27 0.00 0.00 64.05 58.76 1c01 n THR 37 Cb 0.44 0.54 0.00 0.00 -2.10 0.00 0.00 70.33 69.22 1c01 n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1c01 n GLY 38 N 0.04 3.02 3.67 3.38 0.00 -1.26 -4.44 105.19 109.60 1c01 n GLY 38 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1c01 n GLY 38 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1c01 s GLN 39 N -0.26 4.10 0.60 1.61 1.11 -1.26 -5.04 119.66 120.53 1c01 s GLN 39 Ca 0.00 -0.19 -0.06 0.00 0.01 0.00 0.00 55.36 55.12 1c01 s GLN 39 Cb 0.00 -3.52 0.01 0.00 -1.01 0.00 0.00 33.01 28.49 1c01 s GLN 39 CO 0.00 0.08 0.91 0.99 0.01 0.00 0.00 175.29 177.28 1c01 s THR 40 N 0.99 3.63 0.32 -0.19 2.01 -1.26 -4.59 115.64 116.55 1c01 s THR 40 Ca 0.09 0.02 0.03 0.00 0.31 0.00 0.00 61.69 62.15 1c01 s THR 40 Cb -0.13 -3.45 -0.06 0.00 0.01 0.00 0.00 72.50 68.87 1c01 s THR 40 CO 0.04 -0.47 0.08 0.00 -0.69 0.00 0.00 174.62 173.58 1c01 s ALA 41 N -3.01 2.31 -0.27 7.40 0.00 -0.74 -1.72 121.76 125.73 1c01 s ALA 41 Ca 0.54 -1.91 -0.17 0.00 0.00 0.00 0.00 51.96 50.42 1c01 s ALA 41 Cb -0.11 0.75 0.08 0.00 0.00 0.00 0.00 23.12 23.84 1c01 s ALA 41 CO 0.45 -0.34 0.67 0.00 0.00 0.00 0.00 175.76 176.54 1c01 s ALA 42 N -3.38 -1.80 -0.32 0.00 0.00 -0.40 -2.35 121.76 113.51 1c01 s ALA 42 Ca 0.35 2.30 -0.15 0.00 0.00 0.00 0.00 51.96 54.46 1c01 s ALA 42 Cb 0.08 -1.35 -0.02 0.00 0.00 0.00 0.00 23.12 21.82 1c01 s ALA 42 CO 0.15 -0.36 0.37 -0.51 0.00 0.00 0.00 175.76 175.41 1c01 s LEU 43 N 1.44 4.30 -0.26 0.00 2.01 -0.49 -0.32 118.68 125.36 1c01 s LEU 43 Ca -0.09 -0.06 -0.11 0.00 0.01 0.00 0.00 54.13 53.88 1c01 s LEU 43 Cb -0.05 -2.38 -0.05 0.00 0.01 0.00 0.00 46.19 43.72 1c01 s LEU 43 CO -0.17 -0.30 0.20 -0.31 1.01 0.00 0.00 176.35 176.78 1c01 s TYR 44 N 2.06 3.27 -1.86 0.29 1.51 -0.63 0.62 117.35 122.61 1c01 s TYR 44 Ca 0.13 0.21 0.23 0.00 -1.01 0.00 0.00 57.07 56.64 1c01 s TYR 44 Cb -0.16 -2.35 1.32 0.00 -0.11 0.00 0.00 41.96 40.66 1c01 s TYR 44 CO 0.11 -0.05 1.75 -1.71 -1.11 0.00 0.00 175.55 174.54 1c01 n ASN 45 N 4.69 0.00 -4.54 2.29 2.85 -1.25 -1.71 115.26 117.59 1c01 n ASN 45 Ca -0.14 -0.56 -0.33 0.00 -0.11 0.00 0.00 54.58 53.44 1c01 n ASN 45 Cb 0.52 -0.07 -0.12 0.00 1.24 0.00 0.00 39.78 41.35 1c01 n ASN 45 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1c01 s GLN 46 N -2.14 2.72 0.34 1.20 1.11 -1.26 -4.28 119.66 117.35 1c01 s GLN 46 Ca 0.31 -0.60 -0.29 0.00 0.01 0.00 0.00 55.36 54.80 1c01 s GLN 46 Cb 0.16 -2.54 -0.12 0.00 -1.01 0.00 0.00 33.01 29.50 1c01 s GLN 46 CO 0.29 0.63 1.45 0.00 0.01 0.00 0.00 175.29 177.66 1c01 n ALA 47 N 2.32 2.02 -3.86 6.09 0.00 -1.26 -2.49 120.51 123.34 1c01 n ALA 47 Ca -0.18 0.36 -0.27 0.00 0.00 0.00 0.00 53.44 53.35 1c01 n ALA 47 Cb 0.53 -2.37 0.02 0.00 0.00 0.00 0.00 19.45 17.63 1c01 n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c01 n GLY 48 N 0.97 -0.41 4.45 0.00 0.00 -1.26 -2.23 105.19 106.70 1c01 n GLY 48 Ca 0.04 0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1c01 n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c01 n SER 50 N -2.35 6.42 0.00 0.00 7.64 -0.95 -4.74 113.62 119.64 1c01 n SER 50 Ca 0.11 -3.06 0.00 0.00 1.01 0.00 0.00 58.87 56.93 1c01 n SER 50 Cb 0.44 -1.10 0.00 0.00 -1.01 0.00 0.00 64.21 62.54 1c01 n SER 50 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c01 n GLY 51 N 0.52 2.33 3.12 0.23 0.00 -1.26 -4.91 105.19 105.23 1c01 n GLY 51 Ca 0.33 0.22 -0.14 0.00 0.00 0.00 0.00 46.02 46.43 1c01 n GLY 51 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c01 s VAL 52 N 1.82 0.73 0.65 1.61 1.01 -1.26 -5.07 120.40 119.89 1c01 s VAL 52 Ca 0.00 -1.40 -0.11 0.00 0.00 0.00 0.00 61.98 60.48 1c01 s VAL 52 Cb 0.00 -1.04 0.17 0.00 0.00 0.00 0.00 36.38 35.51 1c01 s VAL 52 CO 0.00 -0.49 0.51 0.00 0.00 0.00 0.00 175.10 175.12 1c01 n ALA 53 N 0.95 -2.01 0.00 5.51 0.00 -1.26 -3.86 120.51 119.84 1c01 n ALA 53 Ca -0.19 -0.80 0.00 0.00 0.00 0.00 0.00 53.44 52.45 1c01 n ALA 53 Cb 0.56 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1c01 n ALA 53 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1c01 n HIS 54 N -3.92 -0.60 -3.67 0.00 -0.00 0.20 -4.77 115.22 102.46 1c01 n HIS 54 Ca 0.07 0.00 -0.23 0.00 -0.00 0.00 0.00 57.72 57.56 1c01 n HIS 54 Cb 0.30 0.28 -0.17 0.00 -0.00 0.00 0.00 29.99 30.39 1c01 n HIS 54 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 1c01 s THR 55 N -1.56 0.02 0.17 3.57 2.01 -1.25 -4.94 115.64 113.66 1c01 s THR 55 Ca 0.00 0.12 -0.03 0.00 0.31 0.00 0.00 61.69 62.09 1c01 s THR 55 Cb 0.00 -0.41 -0.05 0.00 0.01 0.00 0.00 72.50 72.05 1c01 s THR 55 CO 0.00 0.01 0.38 -0.13 -0.69 0.00 0.00 174.62 174.19 1c01 s ARG 56 N 2.11 3.56 -0.16 4.92 3.00 -1.26 -1.40 118.95 129.72 1c01 s ARG 56 Ca 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 55.73 55.53 1c01 s ARG 56 Cb -0.14 -2.85 0.04 0.00 0.00 0.00 0.00 34.95 32.01 1c01 s ARG 56 CO -0.06 0.43 -0.03 -0.06 0.00 0.00 0.00 175.30 175.59 1c01 s PHE 57 N -1.76 1.41 -0.76 -0.53 0.40 -0.99 -4.94 117.98 110.80 1c01 s PHE 57 Ca 0.40 -0.90 0.11 0.00 -0.60 0.00 0.00 56.93 55.93 1c01 s PHE 57 Cb -0.12 -1.18 0.32 0.00 0.51 0.00 0.00 43.02 42.55 1c01 s PHE 57 CO 0.27 -0.57 1.26 0.41 0.70 0.00 0.00 175.22 177.29 1c01 n GLY 58 N 4.95 2.97 3.64 4.36 0.00 -1.26 -1.79 105.19 118.06 1c01 n GLY 58 Ca -0.10 -0.45 -0.10 0.00 0.00 0.00 0.00 46.02 45.37 1c01 n GLY 58 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1c01 s SER 59 N -1.14 -0.79 -0.49 1.61 1.04 -1.26 -4.88 113.70 107.78 1c01 s SER 59 Ca 0.24 1.40 -0.45 0.00 0.48 0.00 0.00 55.95 57.63 1c01 s SER 59 Cb 0.14 1.38 -0.19 0.00 0.10 0.00 0.00 66.02 67.45 1c01 s SER 59 CO 0.14 -0.23 1.80 -1.20 0.98 0.00 0.00 173.24 174.72 1c01 n SER 60 N 3.34 1.00 -3.99 7.02 7.64 -1.26 -4.59 113.62 122.78 1c01 n SER 60 Ca -0.16 0.96 -0.31 0.00 1.01 0.00 0.00 58.87 60.36 1c01 n SER 60 Cb 0.57 -0.87 -0.14 0.00 -1.01 0.00 0.00 64.21 62.76 1c01 n SER 60 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1c01 s ALA 61 N 4.18 3.19 -1.16 -0.43 0.00 -0.33 -4.90 121.76 122.33 1c01 s ALA 61 Ca 1.09 -3.01 -0.20 0.00 0.00 0.00 0.00 51.96 49.85 1c01 s ALA 61 Cb -1.48 -2.15 -0.04 0.00 0.00 0.00 0.00 23.12 19.45 1c01 s ALA 61 CO 0.74 -1.91 1.94 0.54 0.00 0.00 0.00 175.76 177.07 1c01 n ARG 62 N 3.57 2.21 -2.87 0.00 1.74 -1.26 -0.97 116.66 119.09 1c01 n ARG 62 Ca 0.05 -2.53 -0.25 0.00 -0.77 0.00 0.00 57.85 54.34 1c01 n ARG 62 Cb 0.36 -3.37 0.00 0.00 -1.02 0.00 0.00 32.46 28.44 1c01 n ARG 62 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1c01 s ALA 63 N 6.22 3.55 -0.40 7.54 0.00 0.50 -4.90 121.76 134.27 1c01 s ALA 63 Ca 0.58 -0.77 0.10 0.00 0.00 0.00 0.00 51.96 51.87 1c01 s ALA 63 Cb 0.07 -2.36 0.35 0.00 0.00 0.00 0.00 23.12 21.19 1c01 s ALA 63 CO 0.07 -0.35 0.92 0.00 0.00 0.00 0.00 175.76 176.41 1c01 s ASN 65 N -2.02 -0.03 1.31 0.00 -0.87 -1.09 -4.27 114.94 107.96 1c01 s ASN 65 Ca 0.32 -0.24 -0.21 0.00 -1.57 0.00 0.00 52.86 51.15 1c01 s ASN 65 Cb 0.34 0.29 0.33 0.00 -0.02 0.00 0.00 41.25 42.19 1c01 s ASN 65 CO -0.06 -0.53 1.03 -2.16 -2.57 0.00 0.00 177.10 172.81 1c01 s PRO 66 N -2.21 -2.05 0.00 -0.60 0.04 -0.13 -3.58 135.00 126.47 1c01 s PRO 66 Ca -0.08 0.01 0.00 0.00 0.04 0.00 0.00 61.00 60.98 1c01 s PRO 66 Cb -0.03 -1.49 0.00 0.00 0.04 0.00 0.00 34.50 33.02 1c01 s PRO 66 CO -0.02 -4.27 0.00 1.97 0.04 0.00 0.00 177.00 174.72 1c01 n PHE 67 N -5.18 0.00 -1.72 0.56 1.16 -1.26 -4.94 117.46 106.08 1c01 n PHE 67 Ca 0.13 0.00 0.02 0.00 -1.87 0.00 0.00 57.45 55.73 1c01 n PHE 67 Cb 0.60 0.00 0.03 0.00 -1.61 0.00 0.00 39.48 38.49 1c01 n PHE 67 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1c01 n GLY 68 N 0.00 1.13 3.93 4.97 0.00 -1.26 -5.08 105.19 108.88 1c01 n GLY 68 Ca 0.00 -0.21 -0.25 0.00 0.00 0.00 0.00 46.02 45.56 1c01 n GLY 68 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1c01 s TRP 69 N -0.56 3.46 -0.24 1.61 0.51 -1.26 -4.84 118.94 117.61 1c01 s TRP 69 Ca 0.06 0.47 -0.01 0.00 -2.12 0.00 0.00 56.10 54.49 1c01 s TRP 69 Cb 0.05 -2.12 -0.18 0.00 -0.81 0.00 0.00 33.47 30.42 1c01 s TRP 69 CO 0.01 -0.11 -0.16 1.63 -0.51 0.00 0.00 176.95 177.80 1c01 n LYS 70 N -2.00 0.65 -4.12 4.98 4.01 -0.69 -4.87 118.16 116.12 1c01 n LYS 70 Ca -0.02 0.18 -0.16 0.00 -0.51 0.00 0.00 58.31 57.80 1c01 n LYS 70 Cb 0.56 -1.54 -0.05 0.00 -0.51 0.00 0.00 35.03 33.49 1c01 n LYS 70 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1c01 n SER 71 N -3.43 -1.23 -3.60 4.39 3.41 -0.73 -1.36 113.62 111.07 1c01 n SER 71 Ca -0.45 -3.04 -0.15 0.00 -0.26 0.00 0.00 58.87 54.98 1c01 n SER 71 Cb 0.98 2.39 -0.13 0.00 -0.26 0.00 0.00 64.21 67.18 1c01 n SER 71 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 1c01 s ILE 72 N -2.98 -0.40 -0.38 -1.33 2.07 -0.24 -1.61 121.20 116.35 1c01 s ILE 72 Ca 0.33 0.17 -0.29 0.00 -1.41 0.00 0.00 60.65 59.46 1c01 s ILE 72 Cb -0.00 -0.51 0.02 0.00 0.13 0.00 0.00 42.46 42.10 1c01 s ILE 72 CO 0.24 0.03 1.07 0.12 -1.91 0.00 0.00 174.94 174.49 1c01 s PHE 73 N 2.40 3.04 -0.08 3.50 5.36 0.56 -2.34 117.98 130.41 1c01 s PHE 73 Ca 0.03 0.99 -0.01 0.00 -0.96 0.00 0.00 56.93 56.98 1c01 s PHE 73 Cb -0.13 -3.92 -0.03 0.00 -0.34 0.00 0.00 43.02 38.60 1c01 s PHE 73 CO -0.10 -0.93 -0.01 0.42 -1.46 0.00 0.00 175.22 173.14 1c01 s ILE 74 N 3.88 4.19 0.43 3.12 -1.09 -0.59 -1.28 121.20 129.86 1c01 s ILE 74 Ca 0.45 -0.30 -0.20 0.00 -2.23 0.00 0.00 60.65 58.38 1c01 s ILE 74 Cb -0.11 -2.75 -0.10 0.00 -1.58 0.00 0.00 42.46 37.92 1c01 s ILE 74 CO 0.21 0.60 0.94 -1.10 -1.23 0.00 0.00 174.94 174.36 1c01 s GLN 75 N -0.87 4.16 0.00 2.79 -1.52 -0.70 -0.39 119.66 123.13 1c01 s GLN 75 Ca 0.13 1.05 0.19 0.00 -1.95 0.00 0.00 55.36 54.78 1c01 s GLN 75 Cb -0.11 -2.20 1.11 0.00 -0.22 0.00 0.00 33.01 31.59 1c01 s GLN 75 CO 0.02 -0.05 1.51 0.00 -0.25 0.00 0.00 175.29 176.51