#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4v s SER 2 N 0.00 5.27 -0.30 1.61 0.01 -1.26 -5.06 113.70 113.98 1x4v s SER 2 Ca 0.00 -0.64 0.14 0.00 1.31 0.00 0.00 55.95 56.77 1x4v s SER 2 Cb 0.00 -0.55 0.47 0.00 0.21 0.00 0.00 66.02 66.15 1x4v s SER 2 CO 0.00 -0.73 1.12 -1.54 0.41 0.00 0.00 173.24 172.50 1x4v n SER 3 N -1.69 3.19 -3.40 2.44 3.41 -1.26 -5.01 113.62 111.30 1x4v n SER 3 Ca 0.06 -2.96 -0.14 0.00 -0.26 0.00 0.00 58.87 55.56 1x4v n SER 3 Cb 0.61 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 1x4v n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x4v n GLY 4 N -0.55 -1.18 3.59 5.00 0.00 -1.26 -4.76 105.19 106.03 1x4v n GLY 4 Ca 0.25 0.64 -0.42 0.00 0.00 0.00 0.00 46.02 46.48 1x4v n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x4v n SER 5 N -1.93 3.12 -4.59 1.61 7.64 -1.26 -4.93 113.62 113.29 1x4v n SER 5 Ca -0.14 0.12 -0.41 0.00 1.01 0.00 0.00 58.87 59.44 1x4v n SER 5 Cb 0.60 -1.55 -0.06 0.00 -1.01 0.00 0.00 64.21 62.18 1x4v n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1x4v s SER 6 N 8.80 6.48 0.00 6.43 1.04 -1.26 -4.98 113.70 130.21 1x4v s SER 6 Ca 1.01 0.34 0.00 0.00 0.48 0.00 0.00 55.95 57.78 1x4v s SER 6 Cb -0.33 -2.34 0.00 0.00 0.10 0.00 0.00 66.02 63.46 1x4v s SER 6 CO 0.34 -0.54 0.00 0.61 0.98 0.00 0.00 173.24 174.64 1x4v n GLY 7 N 4.51 0.71 2.44 7.32 0.00 -1.26 -4.86 105.19 114.04 1x4v n GLY 7 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 1x4v n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x4v n ARG 8 N -0.77 0.00 -1.87 1.61 1.74 -1.26 -4.76 116.66 111.35 1x4v n ARG 8 Ca 0.00 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.66 1x4v n ARG 8 Cb 0.00 -1.10 -0.03 0.00 -1.02 0.00 0.00 32.46 30.31 1x4v n ARG 8 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1x4v s LYS 9 N 5.05 4.18 -0.26 5.56 3.01 -1.26 -4.86 119.74 131.17 1x4v s LYS 9 Ca 0.91 2.39 -0.05 0.00 -1.01 0.00 0.00 55.97 58.22 1x4v s LYS 9 Cb -1.05 -3.62 -0.18 0.00 -1.01 0.00 0.00 37.83 31.97 1x4v s LYS 9 CO 0.45 -0.77 2.89 -0.89 0.51 0.00 0.00 175.35 177.54 1x4v n ILE 10 N 4.76 2.58 -2.38 2.17 -0.00 -1.26 -4.17 119.36 121.07 1x4v n ILE 10 Ca 0.16 -1.36 -0.15 0.00 -0.00 0.00 0.00 62.75 61.41 1x4v n ILE 10 Cb 0.40 -1.99 0.03 0.00 -0.00 0.00 0.00 39.64 38.08 1x4v n ILE 10 CO 0.00 0.00 0.00 0.49 -0.00 0.00 0.00 176.55 177.04 1x4v n PHE 11 N 2.86 2.21 -4.41 1.39 3.01 -1.26 -5.07 117.46 116.18 1x4v n PHE 11 Ca 0.40 -2.31 -0.30 0.00 1.01 0.00 0.00 57.45 56.25 1x4v n PHE 11 Cb 0.62 -0.28 -0.06 0.00 -0.01 0.00 0.00 39.48 39.75 1x4v n PHE 11 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1x4v s THR 12 N -4.33 1.53 -0.02 4.37 -4.23 -1.26 -4.42 115.64 107.29 1x4v s THR 12 Ca 0.41 -1.81 0.00 0.00 -1.18 0.00 0.00 61.69 59.11 1x4v s THR 12 Cb 0.38 -2.34 0.02 0.00 1.34 0.00 0.00 72.50 71.90 1x4v s THR 12 CO -0.01 0.00 0.01 0.20 -0.54 0.00 0.00 174.62 174.28 1x4v s ASN 13 N -3.98 0.16 -0.14 3.99 0.01 -0.93 -4.98 114.94 109.08 1x4v s ASN 13 Ca 0.21 0.01 -0.26 0.00 -0.71 0.00 0.00 52.86 52.11 1x4v s ASN 13 Cb 0.02 -0.09 -0.02 0.00 0.41 0.00 0.00 41.25 41.57 1x4v s ASN 13 CO 0.12 -0.08 0.84 -0.75 -1.51 0.00 0.00 177.10 175.71 1x4v s LYS 14 N 0.75 4.34 0.34 -0.60 2.20 -1.26 -3.14 119.74 122.37 1x4v s LYS 14 Ca -0.07 1.05 -0.29 0.00 -0.36 0.00 0.00 55.97 56.31 1x4v s LYS 14 Cb -0.10 -3.55 -0.11 0.00 -1.51 0.00 0.00 37.83 32.56 1x4v s LYS 14 CO -0.02 -0.25 1.50 0.00 -0.36 0.00 0.00 175.35 176.22 1x4v n GLU 16 N 1.09 2.33 -3.58 0.00 1.02 -0.75 -4.85 120.64 115.90 1x4v n GLU 16 Ca 0.04 -2.08 -0.35 0.00 -0.02 0.00 0.00 57.16 54.75 1x4v n GLU 16 Cb 0.38 -1.86 -0.05 0.00 -0.02 0.00 0.00 31.44 29.88 1x4v n GLU 16 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1x4v s ARG 17 N -2.24 3.75 0.18 3.49 6.06 -1.26 -5.02 118.95 123.90 1x4v s ARG 17 Ca 0.39 0.16 -0.31 0.00 -2.50 0.00 0.00 55.73 53.46 1x4v s ARG 17 Cb 0.32 -2.99 -0.10 0.00 0.06 0.00 0.00 34.95 32.24 1x4v s ARG 17 CO 0.08 0.56 1.49 0.00 -2.50 0.00 0.00 175.30 174.93 1x4v s ALA 18 N -1.40 3.69 -1.38 6.12 0.00 -1.26 -2.64 121.76 124.88 1x4v s ALA 18 Ca 0.33 1.30 -0.06 0.00 0.00 0.00 0.00 51.96 53.52 1x4v s ALA 18 Cb -0.14 -3.58 0.01 0.00 0.00 0.00 0.00 23.12 19.41 1x4v s ALA 18 CO 0.18 -0.72 0.86 0.41 0.00 0.00 0.00 175.76 176.48 1x4v n GLY 19 N 3.22 -0.46 2.92 0.00 0.00 -1.26 -5.00 105.19 104.61 1x4v n GLY 19 Ca 0.11 0.14 -0.16 0.00 0.00 0.00 0.00 46.02 46.11 1x4v n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x4v n ARG 21 N 3.21 1.52 -2.08 0.00 1.85 -1.26 -4.72 116.66 115.19 1x4v n ARG 21 Ca -0.16 -3.11 -0.37 0.00 -1.00 0.00 0.00 57.85 53.21 1x4v n ARG 21 Cb 0.57 -1.24 0.01 0.00 -1.05 0.00 0.00 32.46 30.75 1x4v n ARG 21 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1x4v s GLN 22 N -2.42 3.43 -0.22 2.89 -1.52 -1.26 -4.89 119.66 115.66 1x4v s GLN 22 Ca 0.37 1.91 -0.00 0.00 -1.95 0.00 0.00 55.36 55.69 1x4v s GLN 22 Cb 0.37 -2.26 0.06 0.00 -0.22 0.00 0.00 33.01 30.96 1x4v s GLN 22 CO -0.07 -0.86 -0.02 1.03 -0.25 0.00 0.00 175.29 175.11 1x4v s ARG 23 N -2.89 1.30 -0.19 2.91 0.52 -1.26 -2.73 118.95 116.61 1x4v s ARG 23 Ca 0.69 -0.81 -0.08 0.00 -0.52 0.00 0.00 55.73 55.00 1x4v s ARG 23 Cb -0.32 -2.44 -0.04 0.00 0.52 0.00 0.00 34.95 32.67 1x4v s ARG 23 CO 0.38 -0.62 0.08 -1.21 0.02 0.00 0.00 175.30 173.96 1x4v s GLU 24 N 1.54 4.00 0.33 3.54 8.01 -1.19 -4.91 118.70 130.04 1x4v s GLU 24 Ca -0.04 -0.32 0.07 0.00 0.01 0.00 0.00 54.97 54.69 1x4v s GLU 24 Cb -0.18 -3.29 0.76 0.00 -4.31 0.00 0.00 34.13 27.11 1x4v s GLU 24 CO -0.07 0.23 1.84 0.52 0.01 0.00 0.00 175.26 177.79 1x4v h MET 25 N 6.86 0.73 -6.70 1.61 2.86 -1.92 -2.46 114.93 115.92 1x4v h MET 25 Ca -0.38 -0.04 -0.48 0.00 -2.06 0.00 0.00 59.70 56.74 1x4v h MET 25 Cb 1.17 -0.17 0.04 0.00 0.06 0.00 0.00 31.60 32.70 1x4v h MET 25 CO 0.70 0.48 -0.08 0.00 1.06 0.00 0.00 176.91 179.08 1x4v s MET 26 N -5.75 2.25 -0.32 1.72 0.23 -1.26 -4.23 119.30 111.93 1x4v s MET 26 Ca -0.10 -1.54 -0.12 0.00 -1.03 0.00 0.00 55.69 52.90 1x4v s MET 26 Cb 0.23 -2.61 -0.02 0.00 -1.53 0.00 0.00 34.83 30.90 1x4v s MET 26 CO 0.80 -0.91 0.21 0.21 -2.03 0.00 0.00 175.02 173.29 1x4v s LYS 27 N -4.72 3.55 -0.58 3.16 2.20 -1.26 -4.49 119.74 117.60 1x4v s LYS 27 Ca 0.62 -0.60 -0.01 0.00 -0.36 0.00 0.00 55.97 55.62 1x4v s LYS 27 Cb -0.06 -3.71 0.15 0.00 -1.51 0.00 0.00 37.83 32.70 1x4v s LYS 27 CO 0.39 -0.38 0.38 -0.51 -0.36 0.00 0.00 175.35 174.87 1x4v s LEU 28 N 1.70 5.02 -0.15 5.43 1.43 -1.26 -5.07 118.68 125.77 1x4v s LEU 28 Ca 0.06 -2.83 -0.08 0.00 -1.03 0.00 0.00 54.13 50.25 1x4v s LEU 28 Cb -0.17 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 1x4v s LEU 28 CO 0.09 -0.35 0.12 -0.89 0.23 0.00 0.00 176.35 175.56 1x4v s THR 29 N -0.02 5.34 1.21 5.49 2.01 -1.26 -0.65 115.64 127.77 1x4v s THR 29 Ca 0.16 0.15 -0.15 0.00 0.31 0.00 0.00 61.69 62.16 1x4v s THR 29 Cb -0.22 -3.37 0.27 0.00 0.01 0.00 0.00 72.50 69.20 1x4v s THR 29 CO -0.03 0.55 0.78 0.00 -0.69 0.00 0.00 174.62 175.23 1x4v n GLU 31 N -4.49 0.89 -0.10 0.00 0.28 -1.26 -3.64 120.64 112.31 1x4v n GLU 31 Ca 0.03 -0.09 -0.16 0.00 -0.16 0.00 0.00 57.16 56.78 1x4v n GLU 31 Cb 0.56 -1.24 -0.06 0.00 1.43 0.00 0.00 31.44 32.12 1x4v n GLU 31 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1x4v n ARG 32 N -1.80 0.53 0.08 3.44 1.74 -1.26 -4.58 116.66 114.82 1x4v n ARG 32 Ca -0.01 0.38 0.04 0.00 -0.77 0.00 0.00 57.85 57.48 1x4v n ARG 32 Cb 0.29 -1.58 -0.03 0.00 -1.02 0.00 0.00 32.46 30.12 1x4v n ARG 32 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1x4v n SER 34 N -2.90 -2.94 -4.31 0.00 7.64 -1.24 -4.77 113.62 105.10 1x4v n SER 34 Ca -0.05 -0.40 -0.24 0.00 1.01 0.00 0.00 58.87 59.20 1x4v n SER 34 Cb 0.74 -3.58 -0.12 0.00 -1.01 0.00 0.00 64.21 60.23 1x4v n SER 34 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1x4v s ARG 35 N -5.22 1.20 0.42 1.43 0.52 -1.26 -4.76 118.95 111.29 1x4v s ARG 35 Ca 0.12 -1.26 -0.24 0.00 -0.52 0.00 0.00 55.73 53.83 1x4v s ARG 35 Cb -0.05 -1.42 -0.08 0.00 0.52 0.00 0.00 34.95 33.91 1x4v s ARG 35 CO 0.49 0.32 1.13 1.21 0.02 0.00 0.00 175.30 178.47 1x4v s ASN 36 N -2.17 6.47 0.26 0.23 2.47 -1.26 -0.21 114.94 120.73 1x4v s ASN 36 Ca 0.10 2.23 -0.21 0.00 0.42 0.00 0.00 52.86 55.39 1x4v s ASN 36 Cb -0.09 -2.60 0.03 0.00 -1.45 0.00 0.00 41.25 37.14 1x4v s ASN 36 CO 0.05 -0.71 0.73 -0.36 -3.72 0.00 0.00 177.10 173.09 1x4v s PHE 37 N -1.55 -0.22 0.17 0.43 0.08 0.18 -1.82 117.98 115.26 1x4v s PHE 37 Ca 0.60 -0.21 -0.04 0.00 0.12 0.00 0.00 56.93 57.39 1x4v s PHE 37 Cb -0.27 0.69 -0.05 0.00 -0.57 0.00 0.00 43.02 42.82 1x4v s PHE 37 CO 0.33 -1.18 0.41 0.00 -0.10 0.00 0.00 175.22 174.68 1x4v n ILE 39 N -0.13 -0.34 -0.19 0.00 5.41 -1.26 0.24 119.36 123.09 1x4v n ILE 39 Ca -0.02 1.72 -0.09 0.00 1.00 0.00 0.00 62.75 65.36 1x4v n ILE 39 Cb 0.52 -2.80 0.02 0.00 -0.71 0.00 0.00 39.64 36.67 1x4v n ILE 39 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 1x4v h LYS 40 N 0.00 0.90 -0.34 0.38 6.56 -1.98 -2.98 116.57 119.11 1x4v h LYS 40 Ca 0.74 -0.23 0.00 0.00 -1.06 0.00 0.00 60.65 60.10 1x4v h LYS 40 Cb 2.04 -0.11 0.00 0.00 -0.57 0.00 0.00 32.23 33.59 1x4v h LYS 40 CO -0.62 0.86 0.00 0.72 -2.06 0.00 0.00 179.45 178.35 1x4v n HIS 41 N -4.37 1.20 0.07 -1.35 8.25 0.65 -4.52 115.22 115.15 1x4v n HIS 41 Ca 0.02 -0.82 -0.07 0.00 -0.26 0.00 0.00 57.72 56.59 1x4v n HIS 41 Cb 0.26 -0.35 0.08 0.00 1.12 0.00 0.00 29.99 31.10 1x4v n HIS 41 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1x4v h ARG 42 N 2.37 0.30 -6.78 -0.41 9.65 0.32 -3.41 114.38 116.41 1x4v h ARG 42 Ca 0.00 -0.22 -0.49 0.00 -1.10 0.00 0.00 59.98 58.17 1x4v h ARG 42 Cb 1.55 0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 30.15 1x4v h ARG 42 CO 0.28 0.85 0.37 -1.58 2.80 0.00 0.00 179.97 182.69 1x4v s HIS 43 N -3.69 3.86 -2.00 2.20 2.46 -1.26 -4.77 115.29 112.08 1x4v s HIS 43 Ca -0.05 1.85 0.07 0.00 0.47 0.00 0.00 55.06 57.41 1x4v s HIS 43 Cb 0.11 -3.03 0.42 0.00 -0.13 0.00 0.00 32.58 29.95 1x4v s HIS 43 CO 0.81 0.21 0.87 -0.35 -2.47 0.00 0.00 174.74 173.82 1x4v n PRO 44 N 1.27 0.49 -0.04 2.88 -0.04 -1.26 -2.14 135.00 136.15 1x4v n PRO 44 Ca -0.01 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.43 1x4v n PRO 44 Cb 0.47 -1.23 -0.11 0.00 -0.04 0.00 0.00 33.50 32.59 1x4v n PRO 44 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1x4v n LEU 45 N -0.73 0.00 -1.74 1.53 4.77 -1.26 -4.45 117.00 115.13 1x4v n LEU 45 Ca 0.05 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 56.00 1x4v n LEU 45 Cb 0.02 0.21 0.29 0.00 -2.33 0.00 0.00 43.42 41.62 1x4v n LEU 45 CO 0.04 0.21 0.95 0.47 -1.33 0.00 0.00 177.39 177.73 1x4v n ASP 46 N -2.32 4.50 -3.64 -1.43 8.00 -0.91 -4.91 116.55 115.85 1x4v n ASP 46 Ca -0.15 -3.24 -0.10 0.00 0.71 0.00 0.00 54.79 52.02 1x4v n ASP 46 Cb 0.74 -0.70 -0.07 0.00 -0.02 0.00 0.00 41.12 41.07 1x4v n ASP 46 CO 0.00 0.00 0.00 -1.38 -0.39 0.00 0.00 177.20 175.43 1x4v s HIS 47 N -2.99 -0.90 -0.94 1.24 -3.43 -1.21 -4.57 115.29 102.49 1x4v s HIS 47 Ca 0.52 1.95 -0.24 0.00 -0.80 0.00 0.00 55.06 56.49 1x4v s HIS 47 Cb 0.42 0.46 -0.20 0.00 -1.43 0.00 0.00 32.58 31.83 1x4v s HIS 47 CO 0.12 -0.44 2.05 -3.47 -2.00 0.00 0.00 174.74 170.99 1x4v n ASP 48 N 3.52 1.00 -4.70 7.38 2.03 -1.26 -4.77 116.55 119.75 1x4v n ASP 48 Ca -0.17 -2.22 -0.42 0.00 0.52 0.00 0.00 54.79 52.50 1x4v n ASP 48 Cb 0.57 -1.59 -0.03 0.00 -0.72 0.00 0.00 41.12 39.35 1x4v n ASP 48 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1x4v h SER 50 N 7.75 0.00 0.00 0.00 0.87 -1.95 -3.49 113.55 116.72 1x4v h SER 50 Ca -0.42 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.14 1x4v h SER 50 Cb 1.20 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1x4v h SER 50 CO 0.92 0.27 0.00 0.61 -0.53 0.00 0.00 176.83 178.09 1x4v n GLY 51 N 1.86 2.50 3.29 5.77 0.00 -1.26 -4.84 105.19 112.51 1x4v n GLY 51 Ca -0.01 -0.86 -0.24 0.00 0.00 0.00 0.00 46.02 44.91 1x4v n GLY 51 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x4v n GLU 52 N 0.00 -1.10 -0.03 1.61 1.02 -1.26 -4.30 120.64 116.58 1x4v n GLU 52 Ca 0.00 0.08 -0.04 0.00 -0.02 0.00 0.00 57.16 57.18 1x4v n GLU 52 Cb 0.00 -3.24 -0.02 0.00 -0.02 0.00 0.00 31.44 28.15 1x4v n GLU 52 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1x4v n GLY 53 N -0.79 -0.08 3.64 0.62 0.00 -1.26 -5.03 105.19 102.29 1x4v n GLY 53 Ca 0.07 -0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 1x4v n GLY 53 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1x4v s HIS 54 N -2.10 2.96 0.49 1.61 -3.43 -1.26 -5.11 115.29 108.44 1x4v s HIS 54 Ca -0.07 -0.00 -0.22 0.00 -0.80 0.00 0.00 55.06 53.97 1x4v s HIS 54 Cb 0.02 -1.61 -0.07 0.00 -1.43 0.00 0.00 32.58 29.49 1x4v s HIS 54 CO 0.12 0.42 1.15 -1.25 -2.00 0.00 0.00 174.74 173.19 1x4v s PRO 55 N -1.65 3.62 -0.09 -0.38 0.04 -1.26 -5.05 135.00 130.22 1x4v s PRO 55 Ca 0.19 1.72 0.03 0.00 0.04 0.00 0.00 61.00 62.99 1x4v s PRO 55 Cb -0.11 -2.27 0.00 0.00 0.04 0.00 0.00 34.50 32.17 1x4v s PRO 55 CO 0.10 -0.66 -0.20 0.99 0.04 0.00 0.00 177.00 177.28 1x4v s THR 56 N -1.62 1.78 -1.18 1.26 2.01 -1.26 -4.71 115.64 111.92 1x4v s THR 56 Ca 0.67 -0.85 -0.08 0.00 0.31 0.00 0.00 61.69 61.74 1x4v s THR 56 Cb -0.27 -1.56 0.01 0.00 0.01 0.00 0.00 72.50 70.69 1x4v s THR 56 CO 0.32 0.50 1.02 -1.20 -0.69 0.00 0.00 174.62 174.57 1x4v n SER 57 N 3.65 -5.81 -4.55 3.53 7.64 -1.26 -4.91 113.62 111.91 1x4v n SER 57 Ca -0.20 -0.46 -0.40 0.00 1.01 0.00 0.00 58.87 58.82 1x4v n SER 57 Cb 0.53 -4.43 -0.03 0.00 -1.01 0.00 0.00 64.21 59.27 1x4v n SER 57 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1x4v s SER 58 N -3.26 5.97 -0.03 6.43 0.15 -1.26 -4.95 113.70 116.74 1x4v s SER 58 Ca 0.50 -0.41 -0.16 0.00 0.70 0.00 0.00 55.95 56.59 1x4v s SER 58 Cb -0.22 -2.55 0.03 0.00 -1.71 0.00 0.00 66.02 61.56 1x4v s SER 58 CO 0.62 -1.95 0.35 -0.83 1.20 0.00 0.00 173.24 172.63 1x4v s GLY 59 N 4.97 -0.21 0.00 9.45 0.00 -1.26 -5.01 107.32 115.26 1x4v s GLY 59 Ca 0.44 0.51 0.03 0.00 0.00 0.00 0.00 44.72 45.70 1x4v s GLY 59 CO 0.13 0.30 0.63 -1.55 0.00 0.00 0.00 173.10 172.61 1x4v n PRO 60 N 1.46 0.49 -0.83 2.90 -0.04 -1.26 -4.23 135.00 133.49 1x4v n PRO 60 Ca -0.20 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.13 1x4v n PRO 60 Cb 0.56 -1.08 -0.12 0.00 -0.04 0.00 0.00 33.50 32.82 1x4v n PRO 60 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x4v n SER 61 N -0.58 4.54 -3.64 3.54 2.88 -1.26 -4.68 113.62 114.43 1x4v n SER 61 Ca 0.02 -2.30 -0.04 0.00 -1.33 0.00 0.00 58.87 55.21 1x4v n SER 61 Cb 0.01 -1.16 -0.07 0.00 -0.75 0.00 0.00 64.21 62.24 1x4v n SER 61 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x4v s SER 62 N 2.27 -0.74 0.00 -3.46 0.15 -1.26 -5.22 113.70 105.43 1x4v s SER 62 Ca 0.54 1.17 0.00 0.00 0.70 0.00 0.00 55.95 58.36 1x4v s SER 62 Cb 0.24 1.35 0.00 0.00 -1.71 0.00 0.00 66.02 65.90 1x4v s SER 62 CO -0.01 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 174.86