#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wi0 n SER 2 N 0.00 -2.03 -1.37 1.61 7.64 -1.26 -5.17 113.62 113.04 1wi0 n SER 2 Ca 0.00 0.59 0.07 0.00 1.01 0.00 0.00 58.87 60.54 1wi0 n SER 2 Cb 0.00 2.02 -0.04 0.00 -1.01 0.00 0.00 64.21 65.19 1wi0 n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1wi0 n SER 3 N -3.27 -7.38 0.00 6.43 7.64 -1.26 -5.09 113.62 110.69 1wi0 n SER 3 Ca 0.00 1.54 0.00 0.00 1.01 0.00 0.00 58.87 61.42 1wi0 n SER 3 Cb 0.00 -4.48 0.00 0.00 -1.01 0.00 0.00 64.21 58.72 1wi0 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wi0 n GLY 4 N -3.19 3.99 3.84 0.23 0.00 -1.26 -5.14 105.19 103.65 1wi0 n GLY 4 Ca -0.04 -1.60 -0.22 0.00 0.00 0.00 0.00 46.02 44.17 1wi0 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wi0 s SER 5 N 0.00 5.02 0.14 1.61 0.01 -1.26 -5.06 113.70 114.17 1wi0 s SER 5 Ca 0.00 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 56.57 1wi0 s SER 5 Cb 0.00 -0.72 0.00 0.00 0.21 0.00 0.00 66.02 65.51 1wi0 s SER 5 CO 0.00 -0.49 0.00 -1.20 0.41 0.00 0.00 173.24 171.96 1wi0 n SER 6 N -1.41 0.34 -4.06 2.44 7.64 -1.26 -5.00 113.62 112.31 1wi0 n SER 6 Ca 0.00 0.23 -0.34 0.00 1.01 0.00 0.00 58.87 59.78 1wi0 n SER 6 Cb 0.61 0.03 -0.12 0.00 -1.01 0.00 0.00 64.21 63.72 1wi0 n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wi0 s GLY 7 N -4.63 2.15 -0.03 0.23 0.00 -1.26 -4.94 107.32 98.84 1wi0 s GLY 7 Ca 0.00 -2.80 -0.23 0.00 0.00 0.00 0.00 44.72 41.69 1wi0 s GLY 7 CO 0.00 1.02 1.08 -0.56 0.00 0.00 0.00 173.10 174.64 1wi0 h PRO 8 N 7.50 0.25 -3.31 2.90 0.13 -2.01 -3.45 132.00 134.00 1wi0 h PRO 8 Ca -0.08 -0.24 -0.35 0.00 -0.87 0.00 0.00 66.00 64.47 1wi0 h PRO 8 Cb 1.00 0.06 -0.38 0.00 0.13 0.00 0.00 31.00 31.81 1wi0 h PRO 8 CO 0.66 0.94 -0.72 0.12 -0.23 0.00 0.00 178.00 178.76 1wi0 s PHE 9 N -3.30 0.02 -0.30 1.56 5.36 -1.26 -5.12 117.98 114.94 1wi0 s PHE 9 Ca -0.15 0.29 -0.26 0.00 -0.96 0.00 0.00 56.93 55.85 1wi0 s PHE 9 Cb 0.02 -0.41 0.20 0.00 -0.34 0.00 0.00 43.02 42.49 1wi0 s PHE 9 CO 0.76 -0.18 1.47 0.00 -1.46 0.00 0.00 175.22 175.81 1wi0 n ALA 11 N 1.28 -3.33 0.03 0.00 0.00 -1.26 -4.93 120.51 112.31 1wi0 n ALA 11 Ca -0.08 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1wi0 n ALA 11 Cb 0.57 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.86 1wi0 n ALA 11 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1wi0 n MET 12 N -3.52 0.00 -4.26 0.00 0.00 -1.26 -5.08 117.12 102.99 1wi0 n MET 12 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 57.70 57.39 1wi0 n MET 12 Cb 0.63 -0.40 -0.10 0.00 0.00 0.00 0.00 33.22 33.35 1wi0 n MET 12 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 175.97 174.14 1wi0 s GLU 13 N -2.00 2.19 0.00 0.03 -1.05 -1.26 -5.01 118.70 111.60 1wi0 s GLU 13 Ca 0.00 -0.99 0.00 0.00 -0.15 0.00 0.00 54.97 53.83 1wi0 s GLU 13 Cb 0.00 -2.33 0.00 0.00 -0.44 0.00 0.00 34.13 31.36 1wi0 s GLU 13 CO 0.00 0.52 0.00 -1.71 0.95 0.00 0.00 175.26 175.02 1wi0 n ASN 14 N 0.81 0.43 -4.38 0.83 5.15 -1.26 -5.11 115.26 111.73 1wi0 n ASN 14 Ca -0.14 0.00 -0.21 0.00 -0.60 0.00 0.00 54.58 53.63 1wi0 n ASN 14 Cb 0.52 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.67 1wi0 n ASN 14 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1wi0 s GLN 15 N -1.77 1.42 0.81 1.20 -0.21 -1.26 -5.14 119.66 114.71 1wi0 s GLN 15 Ca 0.00 -1.58 -0.11 0.00 0.02 0.00 0.00 55.36 53.69 1wi0 s GLN 15 Cb 0.00 -1.40 0.08 0.00 1.00 0.00 0.00 33.01 32.68 1wi0 s GLN 15 CO 0.00 0.26 1.09 0.14 -2.12 0.00 0.00 175.29 174.66 1wi0 s VAL 16 N -2.48 3.15 0.07 1.09 -7.23 -1.26 -5.01 120.40 108.74 1wi0 s VAL 16 Ca 0.22 0.37 -0.22 0.00 -1.81 0.00 0.00 61.98 60.55 1wi0 s VAL 16 Cb -0.04 -2.94 -0.06 0.00 0.56 0.00 0.00 36.38 33.90 1wi0 s VAL 16 CO 0.09 -0.49 0.65 -0.22 -0.31 0.00 0.00 175.10 174.82 1wi0 s LEU 17 N -5.95 4.51 -0.24 1.32 2.96 0.27 -4.93 118.68 116.62 1wi0 s LEU 17 Ca 0.61 1.36 0.01 0.00 -0.22 0.00 0.00 54.13 55.89 1wi0 s LEU 17 Cb -0.16 -3.04 0.06 0.00 0.50 0.00 0.00 46.19 43.54 1wi0 s LEU 17 CO 0.56 0.18 -0.07 -0.69 -1.32 0.00 0.00 176.35 175.01 1wi0 s VAL 18 N -0.74 1.72 -0.33 1.68 1.01 -1.26 0.47 120.40 122.94 1wi0 s VAL 18 Ca 0.32 -1.34 -0.15 0.00 0.00 0.00 0.00 61.98 60.82 1wi0 s VAL 18 Cb -0.20 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 1wi0 s VAL 18 CO 0.21 -0.07 0.34 -0.63 0.00 0.00 0.00 175.10 174.95 1wi0 s ILE 19 N 1.31 5.19 -0.52 2.22 1.01 -1.07 -0.20 121.20 129.13 1wi0 s ILE 19 Ca -0.07 0.06 -0.18 0.00 0.00 0.00 0.00 60.65 60.46 1wi0 s ILE 19 Cb -0.19 -3.79 0.07 0.00 0.01 0.00 0.00 42.46 38.56 1wi0 s ILE 19 CO -0.06 -0.05 0.60 -0.60 0.00 0.00 0.00 174.94 174.83 1wi0 s ARG 20 N 1.98 3.08 -0.21 2.79 3.52 -0.91 0.14 118.95 129.34 1wi0 s ARG 20 Ca 0.11 -1.09 -0.29 0.00 -0.13 0.00 0.00 55.73 54.32 1wi0 s ARG 20 Cb -0.17 -4.15 -0.01 0.00 -1.56 0.00 0.00 34.95 29.07 1wi0 s ARG 20 CO 0.11 -1.27 1.25 0.42 -0.81 0.00 0.00 175.30 175.00 1wi0 s ILE 21 N 2.44 4.29 -0.21 4.11 1.09 0.64 -1.72 121.20 131.84 1wi0 s ILE 21 Ca 0.12 1.54 -0.29 0.00 -1.10 0.00 0.00 60.65 60.92 1wi0 s ILE 21 Cb -0.22 -4.08 -0.04 0.00 -1.06 0.00 0.00 42.46 37.07 1wi0 s ILE 21 CO 0.09 -0.23 1.83 -0.54 -0.10 0.00 0.00 174.94 175.99 1wi0 s LYS 22 N 3.64 3.60 0.12 2.79 -0.14 0.49 -2.32 119.74 127.92 1wi0 s LYS 22 Ca 0.54 1.81 -0.20 0.00 -1.36 0.00 0.00 55.97 56.76 1wi0 s LYS 22 Cb -0.20 -4.16 -0.07 0.00 -1.68 0.00 0.00 37.83 31.73 1wi0 s LYS 22 CO 0.16 -1.54 0.63 0.42 -0.76 0.00 0.00 175.35 174.25 1wi0 s ILE 23 N 6.12 4.65 -0.28 2.17 -1.09 -0.98 -4.44 121.20 127.36 1wi0 s ILE 23 Ca 0.82 1.29 -0.29 0.00 -2.23 0.00 0.00 60.65 60.24 1wi0 s ILE 23 Cb -0.28 -3.93 -0.00 0.00 -1.58 0.00 0.00 42.46 36.67 1wi0 s ILE 23 CO 0.33 0.47 1.34 -2.16 -1.23 0.00 0.00 174.94 173.69 1wi0 s PRO 24 N -1.31 3.92 -0.80 2.79 0.04 -1.26 -3.93 135.00 134.45 1wi0 s PRO 24 Ca 0.33 1.33 -0.03 0.00 0.04 0.00 0.00 61.00 62.67 1wi0 s PRO 24 Cb -0.19 -3.89 0.00 0.00 0.04 0.00 0.00 34.50 30.46 1wi0 s PRO 24 CO 0.21 -1.11 0.61 0.09 0.04 0.00 0.00 177.00 176.83 1wi0 n ASN 25 N 7.66 -4.87 0.00 6.66 4.13 -1.26 -4.74 115.26 122.84 1wi0 n ASN 25 Ca 0.15 -0.91 0.00 0.00 1.68 0.00 0.00 54.58 55.50 1wi0 n ASN 25 Cb 0.46 -1.64 0.00 0.00 -1.54 0.00 0.00 39.78 37.07 1wi0 n ASN 25 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 1wi0 n SER 26 N -2.44 0.00 0.00 6.41 2.88 -1.26 -5.14 113.62 114.07 1wi0 n SER 26 Ca -0.31 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.23 1wi0 n SER 26 Cb 0.70 0.07 0.00 0.00 -0.75 0.00 0.00 64.21 64.23 1wi0 n SER 26 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wi0 n GLY 27 N -1.14 0.32 3.63 0.46 0.00 -1.25 -5.06 105.19 102.15 1wi0 n GLY 27 Ca 0.00 -0.34 -0.05 0.00 0.00 0.00 0.00 46.02 45.63 1wi0 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wi0 s ALA 28 N -1.00 -2.11 -0.04 4.61 0.00 -1.26 -2.31 121.76 119.65 1wi0 s ALA 28 Ca 0.00 1.76 0.05 0.00 0.00 0.00 0.00 51.96 53.77 1wi0 s ALA 28 Cb 0.00 -1.50 -0.02 0.00 0.00 0.00 0.00 23.12 21.60 1wi0 s ALA 28 CO 0.00 -0.19 -0.18 0.08 0.00 0.00 0.00 175.76 175.47 1wi0 s VAL 29 N -0.39 2.75 -0.21 0.00 1.01 -0.98 -4.94 120.40 117.64 1wi0 s VAL 29 Ca 0.06 -0.86 -0.12 0.00 0.00 0.00 0.00 61.98 61.06 1wi0 s VAL 29 Cb -0.03 -2.05 -0.05 0.00 0.00 0.00 0.00 36.38 34.25 1wi0 s VAL 29 CO -0.09 0.58 0.22 1.51 0.00 0.00 0.00 175.10 177.31 1wi0 s ASP 30 N -0.73 6.25 -0.48 3.32 -4.77 -1.26 -0.26 116.67 118.74 1wi0 s ASP 30 Ca 0.11 0.28 -0.14 0.00 -3.30 0.00 0.00 52.55 49.51 1wi0 s ASP 30 Cb -0.10 -2.14 0.09 0.00 -1.09 0.00 0.00 42.92 39.68 1wi0 s ASP 30 CO 0.00 0.08 0.39 0.86 0.70 0.00 0.00 175.17 177.20 1wi0 s TRP 31 N 0.82 3.28 -0.29 2.11 -0.00 0.12 -4.93 118.94 120.05 1wi0 s TRP 31 Ca 0.11 -1.24 -0.27 0.00 -0.00 0.00 0.00 56.10 54.70 1wi0 s TRP 31 Cb -0.13 -3.33 -0.06 0.00 -0.00 0.00 0.00 33.47 29.95 1wi0 s TRP 31 CO 0.03 -0.89 2.28 -0.08 -0.00 0.00 0.00 176.95 178.30 1wi0 s THR 32 N 1.56 3.00 -0.22 5.86 -1.32 -1.26 -2.61 115.64 120.64 1wi0 s THR 32 Ca 0.04 0.00 -0.04 0.00 -1.21 0.00 0.00 61.69 60.48 1wi0 s THR 32 Cb -0.26 -3.00 -0.01 0.00 -1.51 0.00 0.00 72.50 67.73 1wi0 s THR 32 CO 0.04 -0.00 -0.05 -0.69 -2.21 0.00 0.00 174.62 171.71 1wi0 s VAL 33 N 9.44 3.33 -0.13 5.08 1.01 0.18 -4.95 120.40 134.35 1wi0 s VAL 33 Ca 1.00 -0.53 0.19 0.00 0.00 0.00 0.00 61.98 62.65 1wi0 s VAL 33 Cb -0.29 -2.52 -0.26 0.00 0.00 0.00 0.00 36.38 33.31 1wi0 s VAL 33 CO 0.33 0.41 0.34 1.41 0.00 0.00 0.00 175.10 177.59 1wi0 n HIS 34 N 4.79 0.18 -1.67 5.22 8.25 -1.26 0.97 115.22 131.70 1wi0 n HIS 34 Ca -0.18 0.06 -0.36 0.00 -0.26 0.00 0.00 57.72 56.98 1wi0 n HIS 34 Cb 0.51 -0.85 0.04 0.00 1.12 0.00 0.00 29.99 30.80 1wi0 n HIS 34 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1wi0 n SER 35 N -2.62 7.44 -0.35 0.41 7.64 -1.26 -4.75 113.62 120.14 1wi0 n SER 35 Ca -0.19 -3.73 0.01 0.00 1.01 0.00 0.00 58.87 55.97 1wi0 n SER 35 Cb 0.91 -1.06 0.06 0.00 -1.01 0.00 0.00 64.21 63.11 1wi0 n SER 35 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wi0 n GLY 36 N -0.46 -1.78 0.19 0.23 0.00 -1.26 -0.00 105.19 102.10 1wi0 n GLY 36 Ca 0.55 1.01 -0.19 0.00 0.00 0.00 0.00 46.02 47.39 1wi0 n GLY 36 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wi0 h PRO 37 N 0.00 0.67 -1.91 1.61 0.13 -1.97 -3.26 132.00 127.28 1wi0 h PRO 37 Ca 0.35 -0.65 -0.29 0.00 -0.87 0.00 0.00 66.00 64.54 1wi0 h PRO 37 Cb 0.58 0.17 -0.11 0.00 0.13 0.00 0.00 31.00 31.77 1wi0 h PRO 37 CO -0.92 1.25 0.08 0.94 -0.23 0.00 0.00 178.00 179.13 1wi0 n GLN 38 N -3.97 1.96 -4.74 0.86 7.27 0.99 -4.86 117.38 114.90 1wi0 n GLN 38 Ca -0.10 -1.42 -0.31 0.00 0.07 0.00 0.00 57.00 55.24 1wi0 n GLN 38 Cb 0.79 -1.83 -0.13 0.00 2.41 0.00 0.00 30.24 31.47 1wi0 n GLN 38 CO 0.00 0.00 0.00 -1.17 0.07 0.00 0.00 177.06 175.96 1wi0 s LEU 39 N -1.08 2.59 0.33 1.69 2.96 -0.19 -4.80 118.68 120.18 1wi0 s LEU 39 Ca 0.48 -0.39 0.09 0.00 -0.22 0.00 0.00 54.13 54.09 1wi0 s LEU 39 Cb 0.28 -1.51 -0.05 0.00 0.50 0.00 0.00 46.19 45.41 1wi0 s LEU 39 CO -0.08 0.27 0.03 -0.76 -1.32 0.00 0.00 176.35 174.49 1wi0 s LEU 40 N -1.28 3.04 0.17 -0.68 1.43 -1.26 -4.91 118.68 115.18 1wi0 s LEU 40 Ca 0.14 -0.91 -0.11 0.00 -1.03 0.00 0.00 54.13 52.21 1wi0 s LEU 40 Cb -0.10 -1.46 0.05 0.00 0.03 0.00 0.00 46.19 44.71 1wi0 s LEU 40 CO 0.04 -0.21 1.65 0.15 0.23 0.00 0.00 176.35 178.21 1wi0 h PHE 41 N 1.78 1.01 -0.30 0.29 3.57 -1.92 -2.99 116.94 118.39 1wi0 h PHE 41 Ca -0.43 -0.15 -0.00 0.00 3.53 0.00 0.00 57.97 60.92 1wi0 h PHE 41 Cb 1.25 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.70 1wi0 h PHE 41 CO 0.69 0.89 0.18 0.00 -2.23 0.00 0.00 178.31 177.84 1wi0 h ARG 42 N 0.84 0.40 -0.80 1.11 2.47 -1.96 -2.47 114.38 113.97 1wi0 h ARG 42 Ca 0.17 -0.04 0.18 0.00 -1.26 0.00 0.00 59.98 59.03 1wi0 h ARG 42 Cb 0.44 -0.08 -0.15 0.00 -1.65 0.00 0.00 29.97 28.53 1wi0 h ARG 42 CO 0.01 0.32 -0.10 -0.44 0.56 0.00 0.00 179.97 180.32 1wi0 h ASP 43 N 0.38 -0.56 0.45 7.04 3.32 -1.94 1.54 116.42 126.65 1wi0 h ASP 43 Ca 0.11 0.23 -0.01 0.00 0.02 0.00 0.00 57.03 57.37 1wi0 h ASP 43 Cb 0.02 0.44 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 1wi0 h ASP 43 CO -0.02 -0.24 -0.36 0.58 -1.72 0.00 0.00 179.24 177.48 1wi0 h VAL 44 N 0.04 0.26 -0.50 -1.35 2.07 -1.39 0.35 116.25 115.73 1wi0 h VAL 44 Ca 0.42 0.00 0.10 0.00 0.82 0.00 0.00 66.70 68.03 1wi0 h VAL 44 Cb 0.71 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1wi0 h VAL 44 CO -0.77 0.00 0.34 -0.07 0.02 0.00 0.00 177.57 177.09 1wi0 h LEU 45 N -0.81 0.23 -0.98 2.57 -0.00 -0.36 0.74 115.31 116.71 1wi0 h LEU 45 Ca -0.04 0.00 -0.10 0.00 -0.00 0.00 0.00 57.88 57.74 1wi0 h LEU 45 Cb 0.70 -0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 41.30 1wi0 h LEU 45 CO -0.01 0.14 -0.48 0.44 -0.00 0.00 0.00 178.44 178.53 1wi0 h ASP 46 N 0.26 0.00 0.00 -0.43 5.19 0.33 -2.02 116.42 119.75 1wi0 h ASP 46 Ca 0.23 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.63 1wi0 h ASP 46 Cb 0.57 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.08 1wi0 h ASP 46 CO -0.05 0.48 -0.15 0.58 -3.12 0.00 0.00 179.24 176.98 1wi0 h VAL 47 N 0.00 0.25 -0.89 -1.35 2.07 0.39 -3.35 116.25 113.37 1wi0 h VAL 47 Ca -0.00 -1.21 0.23 0.00 0.82 0.00 0.00 66.70 66.54 1wi0 h VAL 47 Cb 0.90 0.50 -0.16 0.00 -1.52 0.00 0.00 31.29 31.01 1wi0 h VAL 47 CO 0.06 0.09 0.07 0.40 0.02 0.00 0.00 177.57 178.21 1wi0 h ILE 48 N -1.00 0.18 -1.30 4.57 2.04 0.15 1.53 117.51 123.69 1wi0 h ILE 48 Ca -0.01 -0.03 0.38 0.00 1.00 0.00 0.00 64.86 66.19 1wi0 h ILE 48 Cb 0.28 0.09 -0.05 0.00 -0.74 0.00 0.00 36.82 36.40 1wi0 h ILE 48 CO -0.01 0.02 1.05 1.23 0.00 0.00 0.00 178.15 180.44 1wi0 h GLY 49 N 0.08 0.00 1.09 5.37 0.00 -1.50 1.56 103.07 109.68 1wi0 h GLY 49 Ca 0.53 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.53 1wi0 h GLY 49 CO -0.78 0.00 -1.64 1.46 0.00 0.00 0.00 176.54 175.58 1wi0 h GLN 50 N 0.00 0.33 -0.23 4.80 4.20 0.20 -2.99 115.11 121.43 1wi0 h GLN 50 Ca 0.62 -0.56 -0.17 0.00 0.06 0.00 0.00 58.65 58.59 1wi0 h GLN 50 Cb 2.72 0.21 0.00 0.00 0.30 0.00 0.00 27.48 30.71 1wi0 h GLN 50 CO -0.01 1.22 -0.52 0.28 -0.67 0.00 0.00 178.83 179.14 1wi0 h VAL 51 N 0.09 1.30 -2.87 -0.54 2.07 0.19 -3.35 116.25 113.14 1wi0 h VAL 51 Ca -0.29 -1.73 -0.61 0.00 0.82 0.00 0.00 66.70 64.89 1wi0 h VAL 51 Cb 2.06 1.80 -0.42 0.00 -1.52 0.00 0.00 31.29 33.21 1wi0 h VAL 51 CO 0.17 0.55 -0.59 0.18 0.02 0.00 0.00 177.57 177.90 1wi0 n LEU 52 N -4.11 3.02 0.24 2.57 4.32 0.41 -4.87 117.00 118.58 1wi0 n LEU 52 Ca -0.06 -5.23 0.13 0.00 -0.02 0.00 0.00 56.01 50.84 1wi0 n LEU 52 Cb 0.61 -0.68 0.41 0.00 -1.62 0.00 0.00 43.42 42.14 1wi0 n LEU 52 CO 0.49 1.82 0.87 1.55 -1.22 0.00 0.00 177.39 180.90 1wi0 h PRO 53 N 5.14 0.00 -0.18 3.23 0.13 -1.67 -2.78 132.00 135.86 1wi0 h PRO 53 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1wi0 h PRO 53 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 1wi0 h PRO 53 CO 0.73 0.05 0.00 0.39 -0.23 0.00 0.00 178.00 178.94 1wi0 n GLU 54 N -3.14 2.07 -3.16 0.86 1.02 -1.26 -4.66 120.64 112.37 1wi0 n GLU 54 Ca 0.02 -1.92 -0.18 0.00 -0.02 0.00 0.00 57.16 55.07 1wi0 n GLU 54 Cb 0.44 -1.42 -0.06 0.00 -0.02 0.00 0.00 31.44 30.38 1wi0 n GLU 54 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wi0 s ALA 55 N -1.51 -0.04 1.10 0.62 0.00 -1.05 -5.14 121.76 115.73 1wi0 s ALA 55 Ca 0.29 -1.58 -0.18 0.00 0.00 0.00 0.00 51.96 50.49 1wi0 s ALA 55 Cb 0.18 -2.04 0.14 0.00 0.00 0.00 0.00 23.12 21.40 1wi0 s ALA 55 CO 0.26 -2.09 0.11 -2.37 0.00 0.00 0.00 175.76 171.68 1wi0 n THR 56 N 3.02 0.00 -3.63 0.00 5.66 -1.22 -4.65 114.28 113.45 1wi0 n THR 56 Ca 0.24 -0.19 -0.11 0.00 -3.05 0.00 0.00 64.05 60.94 1wi0 n THR 56 Cb 0.51 -0.57 -0.07 0.00 -1.55 0.00 0.00 70.33 68.64 1wi0 n THR 56 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1wi0 s THR 57 N -2.16 0.00 -0.11 1.09 2.01 -1.26 -4.23 115.64 110.97 1wi0 s THR 57 Ca 0.49 0.00 0.02 0.00 0.31 0.00 0.00 61.69 62.51 1wi0 s THR 57 Cb -0.09 -1.00 -0.08 0.00 0.01 0.00 0.00 72.50 71.34 1wi0 s THR 57 CO 0.55 0.00 -0.08 0.41 -0.69 0.00 0.00 174.62 174.81 1wi0 n THR 58 N 2.30 0.65 -4.55 -0.82 -1.04 -1.23 -4.80 114.28 104.79 1wi0 n THR 58 Ca -0.13 -0.27 -0.25 0.00 -2.04 0.00 0.00 64.05 61.36 1wi0 n THR 58 Cb 0.56 -0.88 -0.11 0.00 -1.82 0.00 0.00 70.33 68.08 1wi0 n THR 58 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1wi0 s ALA 59 N -2.23 2.84 -0.10 2.41 0.00 -1.26 -4.84 121.76 118.59 1wi0 s ALA 59 Ca -0.14 -2.06 -0.21 0.00 0.00 0.00 0.00 51.96 49.55 1wi0 s ALA 59 Cb 0.04 0.41 0.05 0.00 0.00 0.00 0.00 23.12 23.61 1wi0 s ALA 59 CO 0.28 -0.21 0.50 -0.59 0.00 0.00 0.00 175.76 175.74 1wi0 s PHE 60 N -3.00 -0.48 0.20 0.00 -0.12 -1.20 -1.41 117.98 111.98 1wi0 s PHE 60 Ca 0.34 0.98 0.04 0.00 -0.05 0.00 0.00 56.93 58.24 1wi0 s PHE 60 Cb 0.09 0.22 -0.03 0.00 -0.63 0.00 0.00 43.02 42.67 1wi0 s PHE 60 CO 0.16 -0.40 0.31 -1.21 -0.05 0.00 0.00 175.22 174.03 1wi0 s GLU 61 N -0.61 3.38 -0.15 1.99 2.02 -0.76 -1.08 118.70 123.49 1wi0 s GLU 61 Ca -0.07 -0.72 -0.10 0.00 0.02 0.00 0.00 54.97 54.10 1wi0 s GLU 61 Cb -0.03 -2.88 0.05 0.00 0.10 0.00 0.00 34.13 31.36 1wi0 s GLU 61 CO 0.04 0.47 0.37 1.52 0.02 0.00 0.00 175.26 177.68 1wi0 s TYR 62 N -1.89 -0.50 0.02 1.61 -0.85 -0.88 -0.45 117.35 114.42 1wi0 s TYR 62 Ca 0.34 1.11 -0.30 0.00 -0.52 0.00 0.00 57.07 57.70 1wi0 s TYR 62 Cb -0.10 0.19 -0.07 0.00 0.38 0.00 0.00 41.96 42.36 1wi0 s TYR 62 CO 0.28 -0.28 1.66 -1.21 -1.52 0.00 0.00 175.55 174.49 1wi0 s GLU 63 N 1.00 4.19 0.00 -3.49 2.02 -1.23 0.08 118.70 121.27 1wi0 s GLU 63 Ca -0.06 2.29 0.00 0.00 0.02 0.00 0.00 54.97 57.21 1wi0 s GLU 63 Cb -0.07 -3.77 0.00 0.00 0.10 0.00 0.00 34.13 30.40 1wi0 s GLU 63 CO -0.08 -0.78 0.00 -3.47 0.02 0.00 0.00 175.26 170.95 1wi0 n ASP 64 N 6.23 0.00 0.03 -0.19 2.03 -1.26 -4.82 116.55 118.57 1wi0 n ASP 64 Ca 0.16 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.40 1wi0 n ASP 64 Cb 0.41 0.00 0.08 0.00 -0.72 0.00 0.00 41.12 40.89 1wi0 n ASP 64 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 1wi0 h GLU 65 N 0.00 0.45 -0.64 -0.67 -0.00 -1.98 -2.67 114.58 109.06 1wi0 h GLU 65 Ca 0.00 -0.29 0.00 0.00 -0.00 0.00 0.00 59.36 59.07 1wi0 h GLU 65 Cb 0.00 0.04 0.00 0.00 -0.00 0.00 0.00 28.75 28.79 1wi0 h GLU 65 CO 0.00 0.89 0.00 -0.25 -0.00 0.00 0.00 179.01 179.65 1wi0 n ASP 66 N -3.93 4.97 -4.04 3.06 9.92 -1.26 -4.94 116.55 120.33 1wi0 n ASP 66 Ca -0.03 -2.72 -0.36 0.00 -0.53 0.00 0.00 54.79 51.15 1wi0 n ASP 66 Cb 0.61 -0.64 -0.01 0.00 -0.64 0.00 0.00 41.12 40.44 1wi0 n ASP 66 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1wi0 n GLY 67 N 0.67 -0.52 0.90 0.44 0.00 -1.01 -4.80 105.19 100.87 1wi0 n GLY 67 Ca 0.24 0.24 0.09 0.00 0.00 0.00 0.00 46.02 46.60 1wi0 n GLY 67 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1wi0 n ASP 68 N -1.87 3.01 -2.75 1.61 2.03 -1.26 -4.84 116.55 112.47 1wi0 n ASP 68 Ca -0.15 -1.88 -0.04 0.00 0.52 0.00 0.00 54.79 53.25 1wi0 n ASP 68 Cb 0.51 -0.17 -0.03 0.00 -0.72 0.00 0.00 41.12 40.71 1wi0 n ASP 68 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1wi0 n ARG 69 N 1.13 -3.57 -2.03 -0.67 5.12 -1.26 -4.94 116.66 110.45 1wi0 n ARG 69 Ca 0.15 2.78 -0.29 0.00 -1.93 0.00 0.00 57.85 58.57 1wi0 n ARG 69 Cb 0.51 -4.01 0.16 0.00 -1.16 0.00 0.00 32.46 27.95 1wi0 n ARG 69 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1wi0 s ILE 70 N -0.67 2.03 -0.14 0.55 -1.09 0.11 -4.76 121.20 117.24 1wi0 s ILE 70 Ca -0.18 -0.09 -0.03 0.00 -2.23 0.00 0.00 60.65 58.12 1wi0 s ILE 70 Cb 0.01 -2.94 0.05 0.00 -1.58 0.00 0.00 42.46 38.00 1wi0 s ILE 70 CO 0.59 0.00 0.03 -0.89 -1.23 0.00 0.00 174.94 173.44 1wi0 s THR 71 N -3.71 0.36 -0.61 2.92 2.01 -1.26 -2.07 115.64 113.28 1wi0 s THR 71 Ca 0.70 -0.21 -0.19 0.00 0.31 0.00 0.00 61.69 62.30 1wi0 s THR 71 Cb -0.05 -0.75 0.10 0.00 0.01 0.00 0.00 72.50 71.81 1wi0 s THR 71 CO 0.51 -0.03 0.74 -0.69 -0.69 0.00 0.00 174.62 174.46 1wi0 s VAL 72 N 1.95 4.77 -0.42 3.82 1.01 -0.24 -4.82 120.40 126.47 1wi0 s VAL 72 Ca 0.02 -0.96 0.14 0.00 0.00 0.00 0.00 61.98 61.18 1wi0 s VAL 72 Cb -0.15 -4.52 0.43 0.00 0.00 0.00 0.00 36.38 32.14 1wi0 s VAL 72 CO -0.07 -1.17 1.34 0.54 0.00 0.00 0.00 175.10 175.74 1wi0 n ARG 73 N 6.46 2.84 -3.60 2.72 1.74 -1.26 -3.21 116.66 122.35 1wi0 n ARG 73 Ca -0.08 -2.53 -0.05 0.00 -0.77 0.00 0.00 57.85 54.43 1wi0 n ARG 73 Cb 0.43 -1.61 -0.02 0.00 -1.02 0.00 0.00 32.46 30.23 1wi0 n ARG 73 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1wi0 s SER 74 N -1.64 -0.15 0.31 0.55 0.15 -1.26 -5.01 113.70 106.65 1wi0 s SER 74 Ca 0.34 0.03 0.08 0.00 0.70 0.00 0.00 55.95 57.10 1wi0 s SER 74 Cb 0.25 0.15 0.83 0.00 -1.71 0.00 0.00 66.02 65.54 1wi0 s SER 74 CO 0.11 -0.23 1.75 -2.24 1.20 0.00 0.00 173.24 173.82 1wi0 h ASP 75 N 2.04 0.72 -0.50 5.45 2.03 -1.97 -0.41 116.42 123.78 1wi0 h ASP 75 Ca -0.10 0.12 0.07 0.00 -0.73 0.00 0.00 57.03 56.40 1wi0 h ASP 75 Cb 1.17 0.00 -0.10 0.00 -0.83 0.00 0.00 39.33 39.58 1wi0 h ASP 75 CO 0.24 0.17 -0.46 -0.33 -1.03 0.00 0.00 179.24 177.83 1wi0 h GLU 76 N 0.65 -0.28 -0.53 4.15 5.08 -2.00 0.68 114.58 122.33 1wi0 h GLU 76 Ca 0.62 0.02 0.02 0.00 -1.00 0.00 0.00 59.36 59.02 1wi0 h GLU 76 Cb 1.09 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.37 1wi0 h GLU 76 CO -0.44 -0.19 0.33 0.93 -1.00 0.00 0.00 179.01 178.64 1wi0 h GLU 77 N -0.29 0.63 -0.02 2.33 5.08 -1.45 -2.64 114.58 118.22 1wi0 h GLU 77 Ca 0.15 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1wi0 h GLU 77 Cb 0.57 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 1wi0 h GLU 77 CO -0.64 0.42 -0.03 0.52 -1.00 0.00 0.00 179.01 178.28 1wi0 h MET 78 N 0.65 -0.03 -0.95 2.33 2.86 -0.27 0.79 114.93 120.31 1wi0 h MET 78 Ca 0.21 0.00 0.30 0.00 -2.06 0.00 0.00 59.70 58.15 1wi0 h MET 78 Cb 0.01 0.01 -0.16 0.00 0.06 0.00 0.00 31.60 31.51 1wi0 h MET 78 CO -0.09 -0.02 0.33 0.87 1.06 0.00 0.00 176.91 179.06 1wi0 h LYS 79 N -0.03 0.15 0.66 1.72 6.56 -1.12 0.44 116.57 124.96 1wi0 h LYS 79 Ca 0.00 -0.01 -0.03 0.00 -1.06 0.00 0.00 60.65 59.55 1wi0 h LYS 79 Cb 0.04 -0.03 0.00 0.00 -0.57 0.00 0.00 32.23 31.67 1wi0 h LYS 79 CO -0.04 0.10 -0.34 0.00 -2.06 0.00 0.00 179.45 177.12 1wi0 h ALA 80 N 1.88 -0.92 -0.95 3.86 0.00 -0.58 1.09 119.26 123.63 1wi0 h ALA 80 Ca 0.66 -0.20 0.19 0.00 0.00 0.00 0.00 54.91 55.57 1wi0 h ALA 80 Cb 1.47 0.38 -0.11 0.00 0.00 0.00 0.00 17.79 19.54 1wi0 h ALA 80 CO -0.72 -1.02 0.54 1.98 0.00 0.00 0.00 179.25 180.03 1wi0 h MET 81 N -0.92 0.63 -0.12 0.00 1.85 0.48 0.32 114.93 117.17 1wi0 h MET 81 Ca -0.09 -0.04 -0.20 0.00 -0.61 0.00 0.00 59.70 58.76 1wi0 h MET 81 Cb 0.71 -0.14 0.00 0.00 0.43 0.00 0.00 31.60 32.61 1wi0 h MET 81 CO 0.13 0.41 -0.74 -0.07 -0.40 0.00 0.00 176.91 176.24 1wi0 h LEU 82 N 0.65 0.70 -1.08 3.39 3.38 -0.26 -1.58 115.31 120.51 1wi0 h LEU 82 Ca 0.56 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1wi0 h LEU 82 Cb 0.93 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.42 1wi0 h LEU 82 CO -0.42 1.22 0.57 0.28 0.09 0.00 0.00 178.44 180.19 1wi0 h SER 83 N 0.41 1.05 0.22 -0.43 0.02 0.46 -2.31 113.55 112.97 1wi0 h SER 83 Ca -0.04 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 1wi0 h SER 83 Cb 1.34 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.62 1wi0 h SER 83 CO 0.14 0.78 -0.11 0.22 -1.14 0.00 0.00 176.83 176.72 1wi0 h TYR 84 N 1.23 -0.28 -0.78 3.45 3.20 -0.46 -1.21 116.97 122.11 1wi0 h TYR 84 Ca 0.33 -0.01 0.23 0.00 3.14 0.00 0.00 58.73 62.42 1wi0 h TYR 84 Cb -0.10 0.09 -0.15 0.00 1.54 0.00 0.00 36.73 38.11 1wi0 h TYR 84 CO 0.00 -0.17 0.05 0.98 -1.64 0.00 0.00 178.16 177.38 1wi0 n TYR 85 N -3.83 0.54 -0.04 -3.82 9.36 -0.60 0.14 117.16 118.90 1wi0 n TYR 85 Ca -0.04 0.94 -0.14 0.00 3.32 0.00 0.00 57.90 61.98 1wi0 n TYR 85 Cb 0.12 -1.11 -0.09 0.00 -0.63 0.00 0.00 39.34 37.63 1wi0 n TYR 85 CO 0.00 0.00 0.00 1.88 0.22 0.00 0.00 176.86 178.96 1wi0 h TYR 86 N 0.00 0.38 -0.63 2.98 0.05 -1.49 1.52 116.97 119.78 1wi0 h TYR 86 Ca 0.49 -0.15 0.18 0.00 0.05 0.00 0.00 58.73 59.30 1wi0 h TYR 86 Cb 1.05 -0.07 -0.03 0.00 1.01 0.00 0.00 36.73 38.70 1wi0 h TYR 86 CO -0.36 0.84 0.45 0.77 -1.05 0.00 0.00 178.16 178.80 1wi0 h SER 87 N -0.18 0.03 0.01 3.88 0.02 0.25 0.18 113.55 117.74 1wi0 h SER 87 Ca -0.00 0.00 -0.37 0.00 -0.84 0.00 0.00 61.79 60.58 1wi0 h SER 87 Cb 0.83 -0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.32 1wi0 h SER 87 CO 0.05 0.01 -2.01 1.07 -1.14 0.00 0.00 176.83 174.81 1wi0 n THR 88 N -4.36 1.54 -0.25 -2.27 5.66 0.11 -4.00 114.28 110.71 1wi0 n THR 88 Ca 0.12 -0.27 0.04 0.00 -3.05 0.00 0.00 64.05 60.89 1wi0 n THR 88 Cb 0.68 -1.91 0.14 0.00 -1.55 0.00 0.00 70.33 67.69 1wi0 n THR 88 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 175.07 172.60 1wi0 h VAL 89 N -0.88 0.35 -0.27 1.08 2.07 0.26 1.12 116.25 119.98 1wi0 h VAL 89 Ca -0.55 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 66.99 1wi0 h VAL 89 Cb 1.54 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 1wi0 h VAL 89 CO -0.30 0.02 0.19 0.00 0.02 0.00 0.00 177.57 177.50 1wi0 h MET 90 N 0.09 0.17 0.00 1.57 -0.00 -0.85 0.11 114.93 116.03 1wi0 h MET 90 Ca 0.39 -0.01 -0.10 0.00 -0.00 0.00 0.00 59.70 59.98 1wi0 h MET 90 Cb 0.68 -0.04 -0.01 0.00 -0.00 0.00 0.00 31.60 32.23 1wi0 h MET 90 CO -0.65 0.11 -0.48 0.93 -0.00 0.00 0.00 176.91 176.82 1wi0 h GLU 91 N 0.18 0.00 0.00 -0.10 4.39 0.11 -2.49 114.58 116.66 1wi0 h GLU 91 Ca 0.12 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 1wi0 h GLU 91 Cb 0.25 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.90 1wi0 h GLU 91 CO -0.02 0.48 -0.04 1.96 -1.16 0.00 0.00 179.01 180.23 1wi0 h GLN 92 N 0.00 0.00 0.13 2.33 4.20 0.11 -2.47 115.11 119.41 1wi0 h GLN 92 Ca -0.00 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.43 1wi0 h GLN 92 Cb 1.11 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.89 1wi0 h GLN 92 CO 0.06 0.04 -1.35 1.96 -0.67 0.00 0.00 178.83 178.87 1wi0 h GLN 93 N 0.00 0.28 -0.11 1.46 4.20 -1.16 -2.12 115.11 117.65 1wi0 h GLN 93 Ca -0.00 -0.47 -0.04 0.00 0.06 0.00 0.00 58.65 58.20 1wi0 h GLN 93 Cb 0.82 0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.77 1wi0 h GLN 93 CO 0.00 1.23 -0.11 -0.39 -0.67 0.00 0.00 178.83 178.89 1wi0 h VAL 94 N -0.26 1.15 0.19 -0.54 -1.51 -1.46 -3.08 116.25 110.74 1wi0 h VAL 94 Ca -0.28 -0.66 -0.01 0.00 -1.23 0.00 0.00 66.70 64.52 1wi0 h VAL 94 Cb 1.79 1.19 0.00 0.00 -2.13 0.00 0.00 31.29 32.14 1wi0 h VAL 94 CO 0.09 0.20 -0.09 0.78 -1.23 0.00 0.00 177.57 177.32 1wi0 h ASN 95 N 0.17 -0.22 0.00 4.19 2.35 -1.54 -3.47 115.58 117.06 1wi0 h ASN 95 Ca 0.04 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1wi0 h ASN 95 Cb 0.31 0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.74 1wi0 h ASN 95 CO 0.02 0.27 0.00 0.61 -1.65 0.00 0.00 177.43 176.67 1wi0 n GLY 96 N 1.10 3.10 3.08 2.83 0.00 -0.81 -5.10 105.19 109.38 1wi0 n GLY 96 Ca -0.04 -0.43 -0.37 0.00 0.00 0.00 0.00 46.02 45.18 1wi0 n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wi0 n GLN 97 N 0.00 0.00 -2.10 1.61 10.64 -1.14 -4.82 117.38 121.57 1wi0 n GLN 97 Ca 0.00 0.00 -0.33 0.00 -1.83 0.00 0.00 57.00 54.84 1wi0 n GLN 97 Cb 0.00 -0.96 0.01 0.00 -0.86 0.00 0.00 30.24 28.42 1wi0 n GLN 97 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1wi0 s LEU 98 N 5.42 3.56 0.33 2.61 1.43 -1.26 -4.35 118.68 126.42 1wi0 s LEU 98 Ca 0.52 1.91 -0.26 0.00 -1.03 0.00 0.00 54.13 55.27 1wi0 s LEU 98 Cb -0.42 -4.55 -0.09 0.00 0.03 0.00 0.00 46.19 41.16 1wi0 s LEU 98 CO 0.67 -1.20 1.00 -0.63 0.23 0.00 0.00 176.35 176.42 1wi0 s ILE 99 N -2.27 3.95 0.09 -0.59 -1.09 -1.26 -4.98 121.20 115.04 1wi0 s ILE 99 Ca 0.66 1.65 0.03 0.00 -2.23 0.00 0.00 60.65 60.76 1wi0 s ILE 99 Cb -0.18 -3.93 -0.04 0.00 -1.58 0.00 0.00 42.46 36.73 1wi0 s ILE 99 CO 0.34 0.17 0.13 -1.61 -1.23 0.00 0.00 174.94 172.73 1wi0 s GLU 100 N -2.02 3.05 0.32 2.79 0.41 -1.26 -5.09 118.70 116.90 1wi0 s GLU 100 Ca 0.51 -0.65 -0.27 0.00 -0.41 0.00 0.00 54.97 54.14 1wi0 s GLU 100 Cb -0.22 -2.80 -0.09 0.00 -1.78 0.00 0.00 34.13 29.23 1wi0 s GLU 100 CO 0.28 0.56 1.07 -1.25 -0.49 0.00 0.00 175.26 175.43 1wi0 s PRO 101 N -2.57 4.48 -0.93 0.39 0.04 -1.26 -4.88 135.00 130.27 1wi0 s PRO 101 Ca 0.31 1.68 -0.26 0.00 0.04 0.00 0.00 61.00 62.77 1wi0 s PRO 101 Cb -0.12 -2.96 -0.19 0.00 0.04 0.00 0.00 34.50 31.27 1wi0 s PRO 101 CO 0.24 0.10 2.24 -0.11 0.04 0.00 0.00 177.00 179.51 1wi0 n LEU 102 N 0.75 1.46 -4.59 -3.56 7.94 0.71 -4.67 117.00 115.05 1wi0 n LEU 102 Ca 0.01 -1.98 -0.42 0.00 -1.11 0.00 0.00 56.01 52.51 1wi0 n LEU 102 Cb 0.47 -1.67 -0.03 0.00 0.53 0.00 0.00 43.42 42.71 1wi0 n LEU 102 CO 0.50 -3.15 1.81 -1.58 -1.11 0.00 0.00 177.39 173.86 1wi0 s GLN 103 N 8.67 3.00 0.27 1.96 0.74 -1.26 -2.13 119.66 130.90 1wi0 s GLN 103 Ca 0.87 1.78 0.10 0.00 0.05 0.00 0.00 55.36 58.16 1wi0 s GLN 103 Cb -0.10 -4.37 -0.05 0.00 1.10 0.00 0.00 33.01 29.59 1wi0 s GLN 103 CO 0.14 -2.26 -0.16 0.96 -0.55 0.00 0.00 175.29 173.43 1wi0 s ILE 104 N 8.65 2.17 -0.08 -2.34 -4.36 -0.70 -3.50 121.20 121.04 1wi0 s ILE 104 Ca 0.95 -2.31 0.02 0.00 -0.26 0.00 0.00 60.65 59.06 1wi0 s ILE 104 Cb -0.28 -2.28 0.01 0.00 1.25 0.00 0.00 42.46 41.17 1wi0 s ILE 104 CO 0.33 -0.43 -0.12 -0.36 0.24 0.00 0.00 174.94 174.60 1wi0 s PHE 105 N -2.70 1.55 -0.42 1.37 0.40 0.40 -0.38 117.98 118.21 1wi0 s PHE 105 Ca 0.28 -0.63 -0.29 0.00 -0.60 0.00 0.00 56.93 55.70 1wi0 s PHE 105 Cb -0.02 -1.15 0.01 0.00 0.51 0.00 0.00 43.02 42.37 1wi0 s PHE 105 CO 0.13 -0.34 1.41 -1.25 0.70 0.00 0.00 175.22 175.87 1wi0 s PRO 106 N 0.84 3.56 -0.51 0.24 0.04 -1.26 -1.82 135.00 136.09 1wi0 s PRO 106 Ca -0.11 0.92 -0.26 0.00 0.04 0.00 0.00 61.00 61.58 1wi0 s PRO 106 Cb -0.15 -4.03 0.03 0.00 0.04 0.00 0.00 34.50 30.39 1wi0 s PRO 106 CO 0.02 -1.58 1.02 1.03 0.04 0.00 0.00 177.00 177.53 1wi0 s ARG 107 N 4.96 3.52 -0.60 4.56 0.52 -0.50 -4.98 118.95 126.43 1wi0 s ARG 107 Ca 0.61 0.16 -0.26 0.00 -0.52 0.00 0.00 55.73 55.72 1wi0 s ARG 107 Cb -0.13 -3.97 0.04 0.00 0.52 0.00 0.00 34.95 31.40 1wi0 s ARG 107 CO 0.33 -1.40 1.11 -1.54 0.02 0.00 0.00 175.30 173.81 1wi0 s SER 108 N 2.56 6.35 -0.21 0.23 1.04 -1.26 -3.48 113.70 118.94 1wi0 s SER 108 Ca 0.39 -0.20 -0.36 0.00 0.48 0.00 0.00 55.95 56.26 1wi0 s SER 108 Cb -0.10 -2.51 0.14 0.00 0.10 0.00 0.00 66.02 63.66 1wi0 s SER 108 CO 0.26 -1.45 1.25 -0.83 0.98 0.00 0.00 173.24 173.45 1wi0 s GLY 109 N 3.08 -0.27 0.82 7.32 0.00 -1.26 -5.06 107.32 111.95 1wi0 s GLY 109 Ca 0.36 1.67 -0.14 0.00 0.00 0.00 0.00 44.72 46.61 1wi0 s GLY 109 CO 0.21 0.55 0.90 -1.55 0.00 0.00 0.00 173.10 173.21 1wi0 n PRO 110 N -0.07 -1.76 -3.16 2.90 -0.04 -1.26 -4.31 135.00 127.30 1wi0 n PRO 110 Ca 0.02 -1.41 0.05 0.00 -0.04 0.00 0.00 63.50 62.12 1wi0 n PRO 110 Cb 0.58 -1.11 -0.02 0.00 -0.04 0.00 0.00 33.50 32.90 1wi0 n PRO 110 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1wi0 s SER 111 N -4.16 -0.09 0.06 3.54 1.04 -1.26 -4.97 113.70 107.86 1wi0 s SER 111 Ca 0.54 0.07 0.00 0.00 0.48 0.00 0.00 55.95 57.04 1wi0 s SER 111 Cb -0.03 1.08 0.00 0.00 0.10 0.00 0.00 66.02 67.17 1wi0 s SER 111 CO 0.40 -0.02 0.00 -0.24 0.98 0.00 0.00 173.24 174.36 1wi0 n SER 112 N 5.30 -9.41 0.00 7.02 2.88 -1.26 -5.17 113.62 112.98 1wi0 n SER 112 Ca -0.09 1.75 0.00 0.00 -1.33 0.00 0.00 58.87 59.20 1wi0 n SER 112 Cb 0.55 -5.16 0.00 0.00 -0.75 0.00 0.00 64.21 58.85 1wi0 n SER 112 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42