#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wi0 s SER 2 N 0.00 4.32 -0.27 1.61 0.15 -1.26 -4.81 113.70 113.45 1wi0 s SER 2 Ca 0.00 -0.10 -0.05 0.00 0.70 0.00 0.00 55.95 56.50 1wi0 s SER 2 Cb 0.00 -2.55 0.14 0.00 -1.71 0.00 0.00 66.02 61.90 1wi0 s SER 2 CO 0.00 -3.45 0.53 -0.44 1.20 0.00 0.00 173.24 171.08 1wi0 s SER 3 N 10.03 -0.75 0.00 5.45 0.01 -1.26 -5.10 113.70 122.09 1wi0 s SER 3 Ca 0.85 0.97 0.00 0.00 1.31 0.00 0.00 55.95 59.08 1wi0 s SER 3 Cb -0.11 1.82 0.00 0.00 0.21 0.00 0.00 66.02 67.94 1wi0 s SER 3 CO 0.07 -0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.08 1wi0 n GLY 4 N 5.41 -2.89 2.72 3.44 0.00 -1.26 -5.10 105.19 107.52 1wi0 n GLY 4 Ca -0.06 -0.90 -0.00 0.00 0.00 0.00 0.00 46.02 45.06 1wi0 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wi0 s SER 5 N -0.28 -0.30 -0.30 1.61 1.04 -1.26 -5.14 113.70 109.06 1wi0 s SER 5 Ca 0.00 -0.24 -0.15 0.00 0.48 0.00 0.00 55.95 56.05 1wi0 s SER 5 Cb 0.00 0.39 0.17 0.00 0.10 0.00 0.00 66.02 66.68 1wi0 s SER 5 CO 0.00 -0.02 0.98 -0.55 0.98 0.00 0.00 173.24 174.62 1wi0 s SER 6 N 1.55 -0.60 0.37 7.02 0.15 -1.26 -5.18 113.70 115.76 1wi0 s SER 6 Ca 0.18 0.79 -0.10 0.00 0.70 0.00 0.00 55.95 57.53 1wi0 s SER 6 Cb 0.07 1.67 0.04 0.00 -1.71 0.00 0.00 66.02 66.09 1wi0 s SER 6 CO -0.13 -0.11 0.66 0.61 1.20 0.00 0.00 173.24 175.47 1wi0 n GLY 7 N 5.02 1.43 3.56 9.45 0.00 -1.26 -5.08 105.19 118.30 1wi0 n GLY 7 Ca -0.09 -1.39 -0.34 0.00 0.00 0.00 0.00 46.02 44.20 1wi0 n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wi0 s PRO 8 N -2.37 3.09 -0.32 1.61 0.04 -1.26 -4.94 135.00 130.85 1wi0 s PRO 8 Ca 0.21 -0.74 -0.29 0.00 0.04 0.00 0.00 61.00 60.22 1wi0 s PRO 8 Cb -0.03 -5.22 -0.01 0.00 0.04 0.00 0.00 34.50 29.28 1wi0 s PRO 8 CO 0.15 -2.79 1.58 0.12 0.04 0.00 0.00 177.00 176.10 1wi0 s PHE 9 N 7.48 2.16 0.00 0.56 5.36 -1.26 -4.44 117.98 127.85 1wi0 s PHE 9 Ca 0.58 0.64 0.00 0.00 -0.96 0.00 0.00 56.93 57.19 1wi0 s PHE 9 Cb -0.03 -4.12 0.00 0.00 -0.34 0.00 0.00 43.02 38.53 1wi0 s PHE 9 CO -0.05 -2.53 0.00 0.00 -1.46 0.00 0.00 175.22 171.18 1wi0 s ALA 11 N -1.80 -0.93 0.00 0.00 0.00 -1.26 -5.03 121.76 112.74 1wi0 s ALA 11 Ca 0.00 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.35 1wi0 s ALA 11 Cb 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 23.12 22.21 1wi0 s ALA 11 CO 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 175.76 175.44 1wi0 n MET 12 N 4.43 0.00 -3.79 0.00 3.85 -1.26 -5.11 117.12 115.24 1wi0 n MET 12 Ca -0.21 0.00 -0.13 0.00 -1.00 0.00 0.00 57.70 56.36 1wi0 n MET 12 Cb 0.54 -0.10 -0.11 0.00 -1.05 0.00 0.00 33.22 32.50 1wi0 n MET 12 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 175.97 173.97 1wi0 s GLU 13 N -1.77 0.36 -0.22 3.17 2.12 -1.26 -5.06 118.70 116.04 1wi0 s GLU 13 Ca 0.00 0.24 -0.18 0.00 0.36 0.00 0.00 54.97 55.39 1wi0 s GLU 13 Cb 0.00 0.17 -0.15 0.00 0.26 0.00 0.00 34.13 34.41 1wi0 s GLU 13 CO 0.00 -0.06 -0.01 -1.71 -0.54 0.00 0.00 175.26 172.94 1wi0 n ASN 14 N 2.64 1.89 -4.92 -1.70 5.15 -1.26 -4.95 115.26 112.11 1wi0 n ASN 14 Ca -0.14 0.42 -0.29 0.00 -0.60 0.00 0.00 54.58 53.96 1wi0 n ASN 14 Cb 0.58 -0.91 -0.04 0.00 -0.53 0.00 0.00 39.78 38.89 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 -2.42 3.56 0.58 1.20 -1.52 -1.26 -5.09 119.66 114.71 1wi0 s GLN 15 Ca -0.30 -0.23 -0.08 0.00 -1.95 0.00 0.00 55.36 52.79 1wi0 s GLN 15 Cb 0.08 -2.83 -0.02 0.00 -0.22 0.00 0.00 33.01 30.02 1wi0 s GLN 15 CO 0.52 0.41 0.93 0.14 -0.25 0.00 0.00 175.29 177.04 1wi0 s VAL 16 N -1.81 4.41 0.06 1.09 -7.23 -1.26 -5.02 120.40 110.64 1wi0 s VAL 16 Ca 0.40 0.44 -0.21 0.00 -1.81 0.00 0.00 61.98 60.79 1wi0 s VAL 16 Cb -0.11 -3.74 -0.06 0.00 0.56 0.00 0.00 36.38 33.03 1wi0 s VAL 16 CO 0.28 -0.85 0.63 -0.22 -0.31 0.00 0.00 175.10 174.63 1wi0 s LEU 17 N -5.02 4.50 -0.21 1.32 2.96 0.30 -4.93 118.68 117.60 1wi0 s LEU 17 Ca 0.53 1.32 0.01 0.00 -0.22 0.00 0.00 54.13 55.76 1wi0 s LEU 17 Cb -0.11 -3.01 0.04 0.00 0.50 0.00 0.00 46.19 43.62 1wi0 s LEU 17 CO 0.49 0.19 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.91 1wi0 s VAL 18 N -0.73 1.73 -0.30 1.68 1.01 -1.26 0.76 120.40 123.28 1wi0 s VAL 18 Ca 0.32 -1.08 -0.15 0.00 0.00 0.00 0.00 61.98 61.07 1wi0 s VAL 18 Cb -0.20 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 1wi0 s VAL 18 CO 0.20 0.16 0.36 -0.63 0.00 0.00 0.00 175.10 175.20 1wi0 s ILE 19 N 1.35 5.17 -0.56 2.22 1.01 -0.86 -0.10 121.20 129.43 1wi0 s ILE 19 Ca -0.02 0.32 -0.18 0.00 0.00 0.00 0.00 60.65 60.77 1wi0 s ILE 19 Cb -0.16 -3.75 0.11 0.00 0.01 0.00 0.00 42.46 38.67 1wi0 s ILE 19 CO -0.08 0.05 0.61 -0.60 0.00 0.00 0.00 174.94 174.92 1wi0 s ARG 20 N 2.04 3.03 0.32 2.79 3.52 -0.53 0.20 118.95 130.32 1wi0 s ARG 20 Ca 0.13 -1.41 -0.27 0.00 -0.13 0.00 0.00 55.73 54.05 1wi0 s ARG 20 Cb -0.16 -4.25 -0.09 0.00 -1.56 0.00 0.00 34.95 28.88 1wi0 s ARG 20 CO 0.11 -1.41 1.04 0.42 -0.81 0.00 0.00 175.30 174.64 1wi0 s ILE 21 N 2.28 3.75 -0.32 4.11 1.09 0.74 -1.37 121.20 131.47 1wi0 s ILE 21 Ca 0.09 1.58 -0.23 0.00 -1.10 0.00 0.00 60.65 60.98 1wi0 s ILE 21 Cb -0.26 -3.93 0.00 0.00 -1.06 0.00 0.00 42.46 37.21 1wi0 s ILE 21 CO 0.06 0.24 0.77 -0.75 -0.10 0.00 0.00 174.94 175.16 1wi0 s LYS 22 N -1.82 3.90 0.03 2.79 2.47 -0.98 -2.18 119.74 123.96 1wi0 s LYS 22 Ca 0.49 0.48 -0.15 0.00 -1.56 0.00 0.00 55.97 55.24 1wi0 s LYS 22 Cb -0.26 -3.75 -0.06 0.00 -1.46 0.00 0.00 37.83 32.30 1wi0 s LYS 22 CO 0.33 -0.72 0.44 0.42 0.16 0.00 0.00 175.35 175.99 1wi0 s ILE 23 N 2.96 4.98 -0.32 5.43 -1.09 -0.91 -4.46 121.20 127.79 1wi0 s ILE 23 Ca 0.31 0.84 -0.29 0.00 -2.23 0.00 0.00 60.65 59.29 1wi0 s ILE 23 Cb -0.14 -3.73 0.00 0.00 -1.58 0.00 0.00 42.46 37.01 1wi0 s ILE 23 CO 0.14 0.51 1.36 -2.16 -1.23 0.00 0.00 174.94 173.55 1wi0 s PRO 24 N -1.28 3.81 -0.73 2.79 0.04 -1.26 -3.91 135.00 134.46 1wi0 s PRO 24 Ca 0.27 1.20 -0.08 0.00 0.04 0.00 0.00 61.00 62.43 1wi0 s PRO 24 Cb -0.17 -3.93 0.01 0.00 0.04 0.00 0.00 34.50 30.45 1wi0 s PRO 24 CO 0.15 -1.26 0.63 0.09 0.04 0.00 0.00 177.00 176.65 1wi0 n ASN 25 N 8.03 -5.51 0.00 6.66 3.02 -1.26 -4.77 115.26 121.43 1wi0 n ASN 25 Ca 0.16 -0.63 0.00 0.00 -0.03 0.00 0.00 54.58 54.08 1wi0 n ASN 25 Cb 0.47 -2.33 0.00 0.00 -0.61 0.00 0.00 39.78 37.30 1wi0 n ASN 25 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1wi0 n SER 26 N -1.96 0.00 0.00 6.41 2.88 -1.26 -5.14 113.62 114.56 1wi0 n SER 26 Ca -0.22 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.32 1wi0 n SER 26 Cb 0.66 0.11 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 -1.09 0.30 3.63 0.46 0.00 -1.25 -5.05 105.19 102.18 1wi0 n GLY 27 Ca 0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.09 0.07 4.61 0.00 -1.26 -2.14 121.76 119.95 1wi0 s ALA 28 Ca 0.00 1.79 0.07 0.00 0.00 0.00 0.00 51.96 53.82 1wi0 s ALA 28 Cb 0.00 -1.38 -0.04 0.00 0.00 0.00 0.00 23.12 21.70 1wi0 s ALA 28 CO 0.00 -0.23 -0.15 0.08 0.00 0.00 0.00 175.76 175.46 1wi0 s VAL 29 N -0.82 3.04 -0.23 0.00 1.01 -0.93 -4.93 120.40 117.55 1wi0 s VAL 29 Ca 0.06 -1.24 -0.07 0.00 0.00 0.00 0.00 61.98 60.73 1wi0 s VAL 29 Cb -0.02 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.99 1wi0 s VAL 29 CO -0.07 0.23 0.05 1.51 0.00 0.00 0.00 175.10 176.82 1wi0 s ASP 30 N -1.80 5.11 -0.39 3.32 -4.77 -1.26 -0.18 116.67 116.70 1wi0 s ASP 30 Ca 0.17 -0.17 -0.17 0.00 -3.30 0.00 0.00 52.55 49.08 1wi0 s ASP 30 Cb -0.11 -1.90 0.01 0.00 -1.09 0.00 0.00 42.92 39.83 1wi0 s ASP 30 CO 0.09 0.02 0.45 0.86 0.70 0.00 0.00 175.17 177.29 1wi0 s TRP 31 N 1.30 3.17 -0.60 2.11 -0.00 0.13 -4.90 118.94 120.15 1wi0 s TRP 31 Ca 0.05 -0.15 -0.26 0.00 -0.00 0.00 0.00 56.10 55.73 1wi0 s TRP 31 Cb -0.15 -2.89 -0.02 0.00 -0.00 0.00 0.00 33.47 30.41 1wi0 s TRP 31 CO 0.03 -0.62 1.90 -0.08 -0.00 0.00 0.00 176.95 178.18 1wi0 s THR 32 N 2.22 3.33 -0.27 5.86 -1.32 -1.26 -2.04 115.64 122.16 1wi0 s THR 32 Ca 0.14 0.19 -0.09 0.00 -1.21 0.00 0.00 61.69 60.72 1wi0 s THR 32 Cb -0.16 -3.87 -0.03 0.00 -1.51 0.00 0.00 72.50 66.92 1wi0 s THR 32 CO 0.14 -0.84 0.12 -0.69 -2.21 0.00 0.00 174.62 171.13 1wi0 s VAL 33 N 9.29 4.67 -0.13 5.08 1.01 0.23 -4.94 120.40 135.61 1wi0 s VAL 33 Ca 0.69 -0.10 0.14 0.00 0.00 0.00 0.00 61.98 62.71 1wi0 s VAL 33 Cb -0.13 -3.23 -0.24 0.00 0.00 0.00 0.00 36.38 32.79 1wi0 s VAL 33 CO 0.21 0.27 0.34 1.41 0.00 0.00 0.00 175.10 177.34 1wi0 n HIS 34 N 4.98 0.51 -1.72 5.22 8.25 -1.26 0.11 115.22 131.31 1wi0 n HIS 34 Ca -0.15 0.18 -0.32 0.00 -0.26 0.00 0.00 57.72 57.16 1wi0 n HIS 34 Cb 0.51 -1.09 -0.02 0.00 1.12 0.00 0.00 29.99 30.51 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 -2.94 6.96 -0.37 0.41 7.64 -1.26 -4.71 113.62 119.35 1wi0 n SER 35 Ca -0.26 -3.38 0.00 0.00 1.01 0.00 0.00 58.87 56.24 1wi0 n SER 35 Cb 1.10 -1.20 0.06 0.00 -1.01 0.00 0.00 64.21 63.15 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 0.58 -1.95 0.15 0.23 0.00 -1.26 -0.72 105.19 102.22 1wi0 n GLY 36 Ca 0.52 1.09 -0.17 0.00 0.00 0.00 0.00 46.02 47.46 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 0.44 -2.27 1.61 0.13 -1.97 -3.30 132.00 126.64 1wi0 h PRO 37 Ca 0.36 -0.43 -0.37 0.00 -0.87 0.00 0.00 66.00 64.69 1wi0 h PRO 37 Cb 0.61 0.11 -0.06 0.00 0.13 0.00 0.00 31.00 31.79 1wi0 h PRO 37 CO -0.98 1.08 0.87 0.94 -0.23 0.00 0.00 178.00 179.68 1wi0 n GLN 38 N -4.23 2.59 -5.11 0.86 7.27 0.11 -4.83 117.38 114.03 1wi0 n GLN 38 Ca -0.10 -1.57 -0.28 0.00 0.07 0.00 0.00 57.00 55.12 1wi0 n GLN 38 Cb 0.65 -2.24 -0.16 0.00 2.41 0.00 0.00 30.24 30.90 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 -0.32 2.04 0.31 1.69 2.96 -0.72 -4.77 118.68 119.88 1wi0 s LEU 39 Ca 0.66 -0.41 0.09 0.00 -0.22 0.00 0.00 54.13 54.25 1wi0 s LEU 39 Cb 0.29 -1.16 -0.04 0.00 0.50 0.00 0.00 46.19 45.77 1wi0 s LEU 39 CO -0.05 0.27 0.07 -0.76 -1.32 0.00 0.00 176.35 174.56 1wi0 s LEU 40 N -0.47 3.20 0.14 -0.68 1.43 -1.26 -4.90 118.68 116.13 1wi0 s LEU 40 Ca 0.07 -0.75 -0.17 0.00 -1.03 0.00 0.00 54.13 52.25 1wi0 s LEU 40 Cb -0.09 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.44 1wi0 s LEU 40 CO -0.00 -0.17 1.76 0.15 0.23 0.00 0.00 176.35 178.31 1wi0 h PHE 41 N 1.72 0.47 -0.23 0.29 3.57 -1.91 -2.84 116.94 118.00 1wi0 h PHE 41 Ca -0.44 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.10 1wi0 h PHE 41 Cb 1.25 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 39.80 1wi0 h PHE 41 CO 0.66 0.35 -0.02 0.00 -2.23 0.00 0.00 178.31 177.06 1wi0 h ARG 42 N 0.45 0.04 -0.89 1.11 2.47 -1.96 -1.88 114.38 113.72 1wi0 h ARG 42 Ca 0.12 -0.00 0.18 0.00 -1.26 0.00 0.00 59.98 59.02 1wi0 h ARG 42 Cb 0.03 -0.01 -0.17 0.00 -1.65 0.00 0.00 29.97 28.17 1wi0 h ARG 42 CO -0.02 0.03 -0.23 -0.44 0.56 0.00 0.00 179.97 179.86 1wi0 h ASP 43 N 0.04 -0.85 -0.05 7.04 5.19 -1.92 1.70 116.42 127.58 1wi0 h ASP 43 Ca 0.11 0.27 0.03 0.00 -0.62 0.00 0.00 57.03 56.82 1wi0 h ASP 43 Cb 0.15 0.56 -0.04 0.00 0.18 0.00 0.00 39.33 40.18 1wi0 h ASP 43 CO -0.21 -0.29 -0.16 0.58 -3.12 0.00 0.00 179.24 176.05 1wi0 h VAL 44 N -0.00 0.61 -0.09 -1.35 2.07 -1.24 0.34 116.25 116.58 1wi0 h VAL 44 Ca 0.42 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.92 1wi0 h VAL 44 Cb 0.64 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1wi0 h VAL 44 CO -0.91 0.00 -0.03 -0.07 0.02 0.00 0.00 177.57 176.58 1wi0 h LEU 45 N -0.23 0.11 -1.06 2.57 -0.00 0.61 0.52 115.31 117.83 1wi0 h LEU 45 Ca 0.07 -0.01 -0.07 0.00 -0.00 0.00 0.00 57.88 57.86 1wi0 h LEU 45 Cb 0.33 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 40.95 1wi0 h LEU 45 CO -0.19 0.17 -0.35 0.44 -0.00 0.00 0.00 178.44 178.50 1wi0 h ASP 46 N 0.13 0.00 0.00 -0.43 3.32 0.43 -2.00 116.42 117.86 1wi0 h ASP 46 Ca 0.03 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 1wi0 h ASP 46 Cb 0.14 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 1wi0 h ASP 46 CO 0.00 0.35 -0.34 0.58 -1.72 0.00 0.00 179.24 178.12 1wi0 h VAL 47 N 0.00 0.17 -0.93 -1.35 2.07 0.21 -3.36 116.25 113.05 1wi0 h VAL 47 Ca -0.00 -1.16 0.27 0.00 0.82 0.00 0.00 66.70 66.63 1wi0 h VAL 47 Cb 0.82 0.35 -0.15 0.00 -1.52 0.00 0.00 31.29 30.79 1wi0 h VAL 47 CO 0.05 0.06 0.28 0.40 0.02 0.00 0.00 177.57 178.38 1wi0 h ILE 48 N -1.00 0.23 -1.29 4.57 2.04 -0.16 1.48 117.51 123.38 1wi0 h ILE 48 Ca -0.03 -0.06 0.37 0.00 1.00 0.00 0.00 64.86 66.15 1wi0 h ILE 48 Cb 0.40 0.04 -0.06 0.00 -0.74 0.00 0.00 36.82 36.46 1wi0 h ILE 48 CO -0.02 0.03 0.92 1.23 0.00 0.00 0.00 178.15 180.31 1wi0 h GLY 49 N 0.17 0.16 1.63 5.37 0.00 -1.51 1.45 103.07 110.34 1wi0 h GLY 49 Ca 0.62 -0.02 -0.27 0.00 0.00 0.00 0.00 47.33 47.66 1wi0 h GLY 49 CO -0.71 -0.03 -1.25 1.46 0.00 0.00 0.00 176.54 176.01 1wi0 h GLN 50 N 0.04 0.19 -0.01 4.80 4.20 0.19 -2.76 115.11 121.76 1wi0 h GLN 50 Ca 0.63 -0.33 -0.19 0.00 0.06 0.00 0.00 58.65 58.82 1wi0 h GLN 50 Cb 2.42 0.12 0.01 0.00 0.30 0.00 0.00 27.48 30.34 1wi0 h GLN 50 CO -0.05 1.12 -0.72 0.28 -0.67 0.00 0.00 178.83 178.79 1wi0 h VAL 51 N 0.05 1.38 -2.89 -0.54 2.07 0.17 -3.37 116.25 113.11 1wi0 h VAL 51 Ca -0.13 -2.11 -0.61 0.00 0.82 0.00 0.00 66.70 64.67 1wi0 h VAL 51 Cb 1.93 2.50 -0.42 0.00 -1.52 0.00 0.00 31.29 33.78 1wi0 h VAL 51 CO 0.17 0.63 -0.59 0.18 0.02 0.00 0.00 177.57 177.98 1wi0 n LEU 52 N -4.11 3.02 0.25 2.57 4.32 0.40 -4.88 117.00 118.57 1wi0 n LEU 52 Ca -0.10 -5.22 0.14 0.00 -0.02 0.00 0.00 56.01 50.81 1wi0 n LEU 52 Cb 0.73 -0.68 0.43 0.00 -1.62 0.00 0.00 43.42 42.27 1wi0 n LEU 52 CO 0.49 1.82 0.89 1.55 -1.22 0.00 0.00 177.39 180.92 1wi0 h PRO 53 N 5.16 0.00 -0.23 3.23 0.13 -1.67 -2.76 132.00 135.87 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 0.02 0.00 0.39 -0.23 0.00 0.00 178.00 178.91 1wi0 n GLU 54 N -3.11 2.04 -3.00 0.86 -0.58 -1.26 -4.59 120.64 111.00 1wi0 n GLU 54 Ca 0.02 -1.92 -0.17 0.00 -0.42 0.00 0.00 57.16 54.68 1wi0 n GLU 54 Cb 0.42 -1.39 -0.01 0.00 -0.57 0.00 0.00 31.44 29.88 1wi0 n GLU 54 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wi0 n ALA 55 N 1.11 0.75 -0.87 0.62 0.00 -1.05 -5.14 120.51 115.93 1wi0 n ALA 55 Ca 0.14 -2.53 -0.35 0.00 0.00 0.00 0.00 53.44 50.70 1wi0 n ALA 55 Cb 0.50 -1.04 0.09 0.00 0.00 0.00 0.00 19.45 19.00 1wi0 n ALA 55 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1wi0 n THR 56 N 1.41 0.00 -3.70 0.00 -1.04 -1.15 -4.71 114.28 105.08 1wi0 n THR 56 Ca 0.16 -0.23 -0.13 0.00 -2.04 0.00 0.00 64.05 61.80 1wi0 n THR 56 Cb 0.58 -0.28 -0.09 0.00 -1.82 0.00 0.00 70.33 68.73 1wi0 n THR 56 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1wi0 s THR 57 N -2.14 -0.00 -0.17 12.58 2.01 -1.26 -3.76 115.64 122.90 1wi0 s THR 57 Ca 0.46 0.00 0.05 0.00 0.31 0.00 0.00 61.69 62.51 1wi0 s THR 57 Cb -0.08 -0.72 -0.14 0.00 0.01 0.00 0.00 72.50 71.57 1wi0 s THR 57 CO 0.70 0.00 -0.10 0.41 -0.69 0.00 0.00 174.62 174.94 1wi0 n THR 58 N 2.88 1.03 -4.55 -0.82 -1.04 -1.26 -4.76 114.28 105.76 1wi0 n THR 58 Ca -0.14 -0.46 -0.26 0.00 -2.04 0.00 0.00 64.05 61.15 1wi0 n THR 58 Cb 0.56 -1.00 -0.09 0.00 -1.82 0.00 0.00 70.33 67.99 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 -2.36 3.00 -0.00 2.41 0.00 -1.26 -4.83 121.76 118.71 1wi0 s ALA 59 Ca -0.20 -1.36 -0.21 0.00 0.00 0.00 0.00 51.96 50.19 1wi0 s ALA 59 Cb 0.06 0.56 0.04 0.00 0.00 0.00 0.00 23.12 23.78 1wi0 s ALA 59 CO 0.47 -0.26 0.46 -0.59 0.00 0.00 0.00 175.76 175.84 1wi0 s PHE 60 N -3.15 -0.36 0.12 0.00 -0.71 -1.21 -1.95 117.98 110.73 1wi0 s PHE 60 Ca 0.25 0.52 0.04 0.00 -1.04 0.00 0.00 56.93 56.69 1wi0 s PHE 60 Cb 0.04 0.24 -0.04 0.00 -1.21 0.00 0.00 43.02 42.05 1wi0 s PHE 60 CO 0.13 -0.52 0.14 -1.21 -1.34 0.00 0.00 175.22 172.42 1wi0 s GLU 61 N -1.66 2.99 -0.20 1.99 2.02 -0.15 -1.76 118.70 121.92 1wi0 s GLU 61 Ca -0.10 -0.74 -0.12 0.00 0.02 0.00 0.00 54.97 54.03 1wi0 s GLU 61 Cb -0.02 -2.74 0.06 0.00 0.10 0.00 0.00 34.13 31.53 1wi0 s GLU 61 CO 0.04 0.53 0.50 1.52 0.02 0.00 0.00 175.26 177.86 1wi0 s TYR 62 N -1.60 -0.74 -0.05 1.61 -0.85 -0.84 -0.02 117.35 114.86 1wi0 s TYR 62 Ca 0.31 1.54 -0.30 0.00 -0.52 0.00 0.00 57.07 58.10 1wi0 s TYR 62 Cb -0.11 0.37 -0.05 0.00 0.38 0.00 0.00 41.96 42.54 1wi0 s TYR 62 CO 0.24 -0.39 1.59 -1.21 -1.52 0.00 0.00 175.55 174.25 1wi0 s GLU 63 N 1.39 4.20 0.00 -3.49 2.02 -1.25 0.63 118.70 122.20 1wi0 s GLU 63 Ca -0.09 2.12 0.00 0.00 0.02 0.00 0.00 54.97 57.02 1wi0 s GLU 63 Cb -0.07 -3.89 0.00 0.00 0.10 0.00 0.00 34.13 30.27 1wi0 s GLU 63 CO -0.14 -0.79 0.00 -3.47 0.02 0.00 0.00 175.26 170.88 1wi0 n ASP 64 N 6.77 0.00 0.10 -0.19 2.03 -0.54 -4.76 116.55 119.95 1wi0 n ASP 64 Ca 0.16 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.44 1wi0 n ASP 64 Cb 0.43 0.00 0.15 0.00 -0.72 0.00 0.00 41.12 40.98 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 0.18 -0.89 -0.67 4.11 -1.94 -2.61 114.58 112.76 1wi0 h GLU 65 Ca 0.00 -0.12 -0.19 0.00 0.07 0.00 0.00 59.36 59.12 1wi0 h GLU 65 Cb 0.00 0.02 -0.11 0.00 0.50 0.00 0.00 28.75 29.15 1wi0 h GLU 65 CO 0.00 0.71 0.24 -0.25 0.07 0.00 0.00 179.01 179.78 1wi0 n ASP 66 N -3.88 3.72 -2.24 3.06 9.92 -1.26 -4.85 116.55 121.02 1wi0 n ASP 66 Ca -0.02 -2.84 -0.10 0.00 -0.53 0.00 0.00 54.79 51.30 1wi0 n ASP 66 Cb 0.60 -0.68 -0.01 0.00 -0.64 0.00 0.00 41.12 40.39 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 -0.14 -0.24 3.58 0.44 0.00 -0.98 -4.89 105.19 102.95 1wi0 n GLY 67 Ca 0.29 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.91 1wi0 n GLY 67 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wi0 s ASP 68 N -1.99 6.33 -0.80 1.61 1.01 -1.26 -4.69 116.67 116.88 1wi0 s ASP 68 Ca 0.00 0.16 -0.26 0.00 0.71 0.00 0.00 52.55 53.17 1wi0 s ASP 68 Cb 0.00 -2.26 -0.15 0.00 1.01 0.00 0.00 42.92 41.52 1wi0 s ASP 68 CO 0.00 -0.38 2.40 0.54 0.21 0.00 0.00 175.17 177.94 1wi0 n ARG 69 N 5.62 0.53 -0.88 8.23 5.12 -1.26 -1.47 116.66 132.56 1wi0 n ARG 69 Ca -0.05 -0.86 -0.29 0.00 -1.93 0.00 0.00 57.85 54.72 1wi0 n ARG 69 Cb 0.49 -3.63 0.23 0.00 -1.16 0.00 0.00 32.46 28.39 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 14.55 1.73 -0.05 0.55 -1.09 0.20 -4.62 121.20 132.48 1wi0 s ILE 70 Ca 0.94 0.00 0.01 0.00 -2.23 0.00 0.00 60.65 59.37 1wi0 s ILE 70 Cb -0.15 -2.33 0.02 0.00 -1.58 0.00 0.00 42.46 38.42 1wi0 s ILE 70 CO 0.10 0.00 -0.06 -0.89 -1.23 0.00 0.00 174.94 172.85 1wi0 s THR 71 N -2.76 0.67 -0.31 2.92 2.01 -1.26 -1.98 115.64 114.93 1wi0 s THR 71 Ca 0.68 -0.21 -0.03 0.00 0.31 0.00 0.00 61.69 62.45 1wi0 s THR 71 Cb -0.16 -0.66 0.05 0.00 0.01 0.00 0.00 72.50 71.74 1wi0 s THR 71 CO 0.59 0.25 0.02 -0.69 -0.69 0.00 0.00 174.62 174.10 1wi0 s VAL 72 N 0.80 3.13 -0.07 3.82 1.01 -0.73 -4.87 120.40 123.49 1wi0 s VAL 72 Ca -0.12 -1.36 0.08 0.00 0.00 0.00 0.00 61.98 60.58 1wi0 s VAL 72 Cb -0.14 -2.80 -0.11 0.00 0.00 0.00 0.00 36.38 33.32 1wi0 s VAL 72 CO 0.01 -0.13 0.07 0.54 0.00 0.00 0.00 175.10 175.59 1wi0 n ARG 73 N 4.65 2.01 -4.28 2.72 1.74 -1.26 -3.32 116.66 118.92 1wi0 n ARG 73 Ca -0.13 -0.02 -0.15 0.00 -0.77 0.00 0.00 57.85 56.78 1wi0 n ARG 73 Cb 0.43 -1.22 -0.10 0.00 -1.02 0.00 0.00 32.46 30.56 1wi0 n ARG 73 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1wi0 s SER 74 N -3.78 1.47 0.30 0.55 1.04 -1.26 -4.98 113.70 107.04 1wi0 s SER 74 Ca -0.04 -1.20 0.06 0.00 0.48 0.00 0.00 55.95 55.25 1wi0 s SER 74 Cb 0.03 0.08 0.79 0.00 0.10 0.00 0.00 66.02 67.02 1wi0 s SER 74 CO 0.36 -0.55 1.73 -0.78 0.98 0.00 0.00 173.24 174.98 1wi0 h ASP 75 N 2.59 0.58 -0.35 7.02 1.82 -1.98 -1.54 116.42 124.56 1wi0 h ASP 75 Ca -0.37 0.13 0.04 0.00 -0.39 0.00 0.00 57.03 56.43 1wi0 h ASP 75 Cb 1.21 0.05 -0.05 0.00 0.68 0.00 0.00 39.33 41.22 1wi0 h ASP 75 CO 0.63 0.11 -0.32 -0.08 -1.61 0.00 0.00 179.24 177.97 1wi0 h GLU 76 N 0.56 -0.13 -0.81 0.28 4.81 -2.00 0.22 114.58 117.52 1wi0 h GLU 76 Ca 0.60 0.01 0.15 0.00 -0.13 0.00 0.00 59.36 59.99 1wi0 h GLU 76 Cb 1.08 0.03 -0.10 0.00 0.63 0.00 0.00 28.75 30.40 1wi0 h GLU 76 CO -0.47 -0.09 0.36 0.93 -0.73 0.00 0.00 179.01 179.02 1wi0 h GLU 77 N -0.14 0.49 0.01 1.92 3.07 -1.63 -1.77 114.58 116.53 1wi0 h GLU 77 Ca 0.06 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.89 1wi0 h GLU 77 Cb 0.29 -0.11 -0.00 0.00 -0.84 0.00 0.00 28.75 28.09 1wi0 h GLU 77 CO -0.41 0.33 -0.03 0.52 -1.40 0.00 0.00 179.01 178.02 1wi0 h MET 78 N 0.51 -0.04 -0.98 2.33 2.86 -0.25 0.80 114.93 120.15 1wi0 h MET 78 Ca 0.45 0.00 0.34 0.00 -2.06 0.00 0.00 59.70 58.43 1wi0 h MET 78 Cb 0.69 0.01 -0.16 0.00 0.06 0.00 0.00 31.60 32.19 1wi0 h MET 78 CO -0.40 -0.03 0.43 0.87 1.06 0.00 0.00 176.91 178.84 1wi0 h LYS 79 N -0.05 0.14 0.28 1.72 1.57 -0.53 0.79 116.57 120.49 1wi0 h LYS 79 Ca -0.00 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1wi0 h LYS 79 Cb 0.04 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1wi0 h LYS 79 CO -0.01 0.09 -0.14 0.00 -0.57 0.00 0.00 179.45 178.82 1wi0 h ALA 80 N 1.92 -0.38 -0.99 3.86 0.00 -0.42 0.96 119.26 124.20 1wi0 h ALA 80 Ca 0.73 -0.13 0.17 0.00 0.00 0.00 0.00 54.91 55.68 1wi0 h ALA 80 Cb 1.74 0.15 -0.10 0.00 0.00 0.00 0.00 17.79 19.58 1wi0 h ALA 80 CO -0.72 -0.64 0.62 1.98 0.00 0.00 0.00 179.25 180.48 1wi0 h MET 81 N -0.53 0.78 -0.00 0.00 1.85 0.70 0.51 114.93 118.23 1wi0 h MET 81 Ca -0.04 -0.05 -0.24 0.00 -0.61 0.00 0.00 59.70 58.76 1wi0 h MET 81 Cb 0.39 -0.18 0.02 0.00 0.43 0.00 0.00 31.60 32.27 1wi0 h MET 81 CO 0.06 0.52 -0.93 -0.07 -0.40 0.00 0.00 176.91 176.09 1wi0 h LEU 82 N 0.80 0.83 -2.29 3.39 3.38 -0.33 -2.12 115.31 118.97 1wi0 h LEU 82 Ca 0.54 -0.74 0.04 0.00 0.09 0.00 0.00 57.88 57.81 1wi0 h LEU 82 Cb 0.80 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1wi0 h LEU 82 CO -0.33 1.46 0.19 -1.28 0.09 0.00 0.00 178.44 178.57 1wi0 h SER 83 N 0.28 0.00 0.00 -0.43 0.87 0.28 -2.04 113.55 112.52 1wi0 h SER 83 Ca -0.12 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 1wi0 h SER 83 Cb 1.60 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.56 1wi0 h SER 83 CO 0.18 0.00 -0.19 0.22 -0.53 0.00 0.00 176.83 176.51 1wi0 h TYR 84 N 0.00 0.00 -0.88 2.24 3.20 -0.87 -2.89 116.97 117.76 1wi0 h TYR 84 Ca 0.07 0.00 0.28 0.00 3.14 0.00 0.00 58.73 62.22 1wi0 h TYR 84 Cb 0.44 0.00 -0.16 0.00 1.54 0.00 0.00 36.73 38.55 1wi0 h TYR 84 CO 0.00 0.00 0.16 0.98 -1.64 0.00 0.00 178.16 177.66 1wi0 n TYR 85 N -3.84 0.71 -0.05 -3.82 9.36 -0.81 0.18 117.16 118.89 1wi0 n TYR 85 Ca -0.03 1.06 -0.16 0.00 3.32 0.00 0.00 57.90 62.09 1wi0 n TYR 85 Cb 0.10 -1.25 -0.07 0.00 -0.63 0.00 0.00 39.34 37.49 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 0.91 -0.33 2.98 0.05 -1.54 1.29 116.97 120.33 1wi0 h TYR 86 Ca 0.60 -0.37 0.08 0.00 0.05 0.00 0.00 58.73 59.10 1wi0 h TYR 86 Cb 1.37 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 38.95 1wi0 h TYR 86 CO -0.31 1.17 0.23 1.03 -1.05 0.00 0.00 178.16 179.22 1wi0 h SER 87 N 0.39 0.05 0.01 3.88 0.87 0.21 0.75 113.55 119.72 1wi0 h SER 87 Ca -0.02 0.00 -0.38 0.00 -1.23 0.00 0.00 61.79 60.17 1wi0 h SER 87 Cb 1.18 -0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 63.08 1wi0 h SER 87 CO 0.12 0.03 -2.09 1.07 -0.53 0.00 0.00 176.83 175.43 1wi0 n THR 88 N -4.45 1.55 -0.30 2.23 5.66 0.56 -4.03 114.28 115.50 1wi0 n THR 88 Ca 0.05 -0.32 0.12 0.00 -3.05 0.00 0.00 64.05 60.85 1wi0 n THR 88 Cb 0.36 -1.86 0.29 0.00 -1.55 0.00 0.00 70.33 67.57 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 -0.78 0.43 0.00 1.08 2.07 0.19 1.53 116.25 120.77 1wi0 h VAL 89 Ca -0.55 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 66.83 1wi0 h VAL 89 Cb 1.59 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1wi0 h VAL 89 CO -0.27 0.06 -0.10 0.00 0.02 0.00 0.00 177.57 177.27 1wi0 h MET 90 N 0.33 0.00 0.00 1.57 -0.00 -1.04 -0.56 114.93 115.22 1wi0 h MET 90 Ca 0.54 0.00 -0.04 0.00 -0.00 0.00 0.00 59.70 60.20 1wi0 h MET 90 Cb 1.03 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.63 1wi0 h MET 90 CO -0.56 0.10 -0.29 0.93 -0.00 0.00 0.00 176.91 177.10 1wi0 h GLU 91 N 0.00 0.00 0.00 -0.10 4.39 0.19 -2.58 114.58 116.48 1wi0 h GLU 91 Ca -0.00 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.60 1wi0 h GLU 91 Cb 0.24 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1wi0 h GLU 91 CO 0.01 0.17 -0.48 1.96 -1.16 0.00 0.00 179.01 179.50 1wi0 h GLN 92 N 0.00 0.00 0.13 2.33 4.20 0.60 -1.31 115.11 121.07 1wi0 h GLN 92 Ca -0.01 0.00 -0.30 0.00 0.06 0.00 0.00 58.65 58.40 1wi0 h GLN 92 Cb 1.14 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.92 1wi0 h GLN 92 CO 0.02 0.48 -1.55 1.96 -0.67 0.00 0.00 178.83 179.08 1wi0 h GLN 93 N 0.00 0.28 -0.11 1.46 4.20 -1.47 0.29 115.11 119.77 1wi0 h GLN 93 Ca -0.00 -0.48 -0.07 0.00 0.06 0.00 0.00 58.65 58.16 1wi0 h GLN 93 Cb 1.14 0.18 -0.01 0.00 0.30 0.00 0.00 27.48 29.09 1wi0 h GLN 93 CO 0.06 1.23 -0.24 -0.39 -0.67 0.00 0.00 178.83 178.82 1wi0 h VAL 94 N -0.18 1.22 0.12 -0.54 -1.51 -1.50 -2.96 116.25 110.91 1wi0 h VAL 94 Ca -0.33 -1.03 -0.01 0.00 -1.23 0.00 0.00 66.70 64.10 1wi0 h VAL 94 Cb 1.86 1.41 0.00 0.00 -2.13 0.00 0.00 31.29 32.44 1wi0 h VAL 94 CO 0.09 0.31 -0.06 0.78 -1.23 0.00 0.00 177.57 177.46 1wi0 h ASN 95 N 0.17 -0.14 0.00 4.19 -0.26 -1.35 -3.48 115.58 114.71 1wi0 h ASN 95 Ca 0.03 -0.40 0.00 0.00 -0.56 0.00 0.00 56.30 55.37 1wi0 h ASN 95 Cb 0.53 0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.82 1wi0 h ASN 95 CO 0.04 0.37 0.00 0.61 -1.06 0.00 0.00 177.43 177.39 1wi0 n GLY 96 N 0.32 0.82 3.18 2.83 0.00 -1.08 -5.09 105.19 106.17 1wi0 n GLY 96 Ca -0.08 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.82 1wi0 n GLY 96 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wi0 s GLN 97 N 0.00 0.85 0.93 1.61 -0.21 0.99 -5.03 119.66 118.79 1wi0 s GLN 97 Ca 0.00 -1.29 -0.11 0.00 0.02 0.00 0.00 55.36 53.98 1wi0 s GLN 97 Cb 0.00 -0.33 0.15 0.00 1.00 0.00 0.00 33.01 33.82 1wi0 s GLN 97 CO 0.00 0.02 1.09 -0.48 -2.12 0.00 0.00 175.29 173.80 1wi0 s LEU 98 N -2.87 2.22 0.08 2.90 0.05 -1.26 -3.99 118.68 115.81 1wi0 s LEU 98 Ca 0.10 1.64 -0.06 0.00 0.05 0.00 0.00 54.13 55.86 1wi0 s LEU 98 Cb 0.02 -4.01 -0.05 0.00 -2.05 0.00 0.00 46.19 40.11 1wi0 s LEU 98 CO -0.03 -2.90 0.34 -0.63 -0.55 0.00 0.00 176.35 172.59 1wi0 s ILE 99 N -2.81 5.20 0.11 1.48 -1.09 -1.26 -4.87 121.20 117.95 1wi0 s ILE 99 Ca 0.64 0.15 0.03 0.00 -2.23 0.00 0.00 60.65 59.25 1wi0 s ILE 99 Cb -0.20 -3.61 -0.04 0.00 -1.58 0.00 0.00 42.46 37.03 1wi0 s ILE 99 CO 0.58 0.20 0.11 -1.61 -1.23 0.00 0.00 174.94 172.99 1wi0 s GLU 100 N -2.21 2.94 0.27 2.79 0.41 -1.26 -5.09 118.70 116.55 1wi0 s GLU 100 Ca 0.35 -0.72 -0.30 0.00 -0.41 0.00 0.00 54.97 53.89 1wi0 s GLU 100 Cb -0.13 -2.73 -0.09 0.00 -1.78 0.00 0.00 34.13 29.39 1wi0 s GLU 100 CO 0.21 0.54 1.08 -1.25 -0.49 0.00 0.00 175.26 175.35 1wi0 s PRO 101 N -2.63 4.66 -0.84 0.39 0.04 -1.26 -4.87 135.00 130.48 1wi0 s PRO 101 Ca 0.30 1.77 -0.23 0.00 0.04 0.00 0.00 61.00 62.88 1wi0 s PRO 101 Cb -0.12 -3.20 -0.18 0.00 0.04 0.00 0.00 34.50 31.04 1wi0 s PRO 101 CO 0.23 0.25 2.27 -0.11 0.04 0.00 0.00 177.00 179.68 1wi0 n LEU 102 N 1.25 1.12 -4.58 -3.56 7.94 0.86 -4.64 117.00 115.38 1wi0 n LEU 102 Ca -0.01 -1.54 -0.41 0.00 -1.11 0.00 0.00 56.01 52.94 1wi0 n LEU 102 Cb 0.45 -1.48 -0.03 0.00 0.53 0.00 0.00 43.42 42.89 1wi0 n LEU 102 CO 0.54 -2.63 1.76 -1.58 -1.11 0.00 0.00 177.39 174.37 1wi0 s GLN 103 N 8.45 2.85 0.48 1.96 0.74 -1.26 -1.45 119.66 131.43 1wi0 s GLN 103 Ca 0.93 1.47 0.02 0.00 0.05 0.00 0.00 55.36 57.83 1wi0 s GLN 103 Cb -0.21 -4.38 -0.02 0.00 1.10 0.00 0.00 33.01 29.50 1wi0 s GLN 103 CO 0.17 -2.43 0.02 0.96 -0.55 0.00 0.00 175.29 173.46 1wi0 s ILE 104 N 8.99 1.21 -0.09 -2.34 -4.36 -0.47 -3.74 121.20 120.39 1wi0 s ILE 104 Ca 0.88 -2.00 -0.05 0.00 -0.26 0.00 0.00 60.65 59.22 1wi0 s ILE 104 Cb -0.23 -2.31 0.04 0.00 1.25 0.00 0.00 42.46 41.22 1wi0 s ILE 104 CO 0.30 0.00 0.22 -0.36 0.24 0.00 0.00 174.94 175.34 1wi0 s PHE 105 N -2.90 -0.29 -0.86 1.37 0.40 0.96 -2.31 117.98 114.36 1wi0 s PHE 105 Ca 0.12 0.70 -0.25 0.00 -0.60 0.00 0.00 56.93 56.91 1wi0 s PHE 105 Cb 0.03 0.03 0.00 0.00 0.51 0.00 0.00 43.02 43.59 1wi0 s PHE 105 CO 0.06 -0.20 1.65 -1.25 0.70 0.00 0.00 175.22 176.18 1wi0 s PRO 106 N 1.06 3.02 0.21 0.24 0.04 -1.26 -0.98 135.00 137.34 1wi0 s PRO 106 Ca -0.08 -0.39 -0.17 0.00 0.04 0.00 0.00 61.00 60.40 1wi0 s PRO 106 Cb -0.09 -4.87 0.21 0.00 0.04 0.00 0.00 34.50 29.78 1wi0 s PRO 106 CO -0.07 -2.65 1.44 0.54 0.04 0.00 0.00 177.00 176.29 1wi0 n ARG 107 N 9.02 -0.23 -1.30 4.56 1.74 -0.82 -4.91 116.66 124.73 1wi0 n ARG 107 Ca 0.27 1.42 0.01 0.00 -0.77 0.00 0.00 57.85 58.79 1wi0 n ARG 107 Cb 0.50 -2.11 -0.01 0.00 -1.02 0.00 0.00 32.46 29.82 1wi0 n ARG 107 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1wi0 n SER 108 N -5.35 -6.99 -3.65 0.55 2.88 -1.26 -5.04 113.62 94.77 1wi0 n SER 108 Ca 0.09 1.53 -0.03 0.00 -1.33 0.00 0.00 58.87 59.13 1wi0 n SER 108 Cb 0.36 -4.06 -0.01 0.00 -0.75 0.00 0.00 64.21 59.75 1wi0 n SER 108 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wi0 s GLY 109 N -5.14 -0.34 -0.95 0.46 0.00 -1.25 -4.93 107.32 95.18 1wi0 s GLY 109 Ca 0.00 0.64 -0.07 0.00 0.00 0.00 0.00 44.72 45.30 1wi0 s GLY 109 CO 0.00 0.17 2.56 -1.55 0.00 0.00 0.00 173.10 174.28 1wi0 n PRO 110 N -0.39 2.50 -3.67 2.90 -0.04 -1.26 -4.64 135.00 130.41 1wi0 n PRO 110 Ca -0.06 -1.55 -0.27 0.00 -0.04 0.00 0.00 63.50 61.58 1wi0 n PRO 110 Cb 0.61 -2.44 0.01 0.00 -0.04 0.00 0.00 33.50 31.64 1wi0 n PRO 110 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wi0 n SER 111 N 3.64 -4.68 -4.91 3.54 2.88 -1.26 -4.93 113.62 107.90 1wi0 n SER 111 Ca 0.53 -0.78 -0.30 0.00 -1.33 0.00 0.00 58.87 57.00 1wi0 n SER 111 Cb 0.29 -1.51 -0.04 0.00 -0.75 0.00 0.00 64.21 62.20 1wi0 n SER 111 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1wi0 s SER 112 N -2.61 6.24 0.00 -3.46 1.04 -1.26 -5.24 113.70 108.40 1wi0 s SER 112 Ca 0.08 0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.71 1wi0 s SER 112 Cb -0.01 -1.88 0.00 0.00 0.10 0.00 0.00 66.02 64.23 1wi0 s SER 112 CO 0.85 0.14 0.00 0.61 0.98 0.00 0.00 173.24 175.82