#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 -8.74 0.38 1.61 2.88 -1.26 -4.92 113.62 103.57 1wi0 n SER 2 Ca 0.00 1.72 -0.16 0.00 -1.33 0.00 0.00 58.87 59.09 1wi0 n SER 2 Cb 0.00 -4.91 -0.08 0.00 -0.75 0.00 0.00 64.21 58.47 1wi0 n SER 2 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1wi0 h SER 3 N 3.94 -0.84 0.00 -3.46 0.02 -2.14 -3.49 113.55 107.58 1wi0 h SER 3 Ca -0.02 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1wi0 h SER 3 Cb 0.04 0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.80 1wi0 h SER 3 CO 0.00 -0.49 0.00 0.61 -1.14 0.00 0.00 176.83 175.81 1wi0 n GLY 4 N -0.95 3.61 3.39 -3.77 0.00 -1.26 -5.16 105.19 101.04 1wi0 n GLY 4 Ca -0.13 -0.71 0.02 0.00 0.00 0.00 0.00 46.02 45.19 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 -0.72 1.09 1.61 0.01 -1.26 -5.16 113.70 109.27 1wi0 s SER 5 Ca 0.00 0.86 -0.13 0.00 1.31 0.00 0.00 55.95 57.99 1wi0 s SER 5 Cb 0.00 1.76 0.20 0.00 0.21 0.00 0.00 66.02 68.20 1wi0 s SER 5 CO 0.00 -0.14 0.79 -1.20 0.41 0.00 0.00 173.24 173.10 1wi0 n SER 6 N 5.15 -1.47 -3.26 2.44 7.64 -1.26 -5.03 113.62 117.82 1wi0 n SER 6 Ca -0.09 0.01 -0.06 0.00 1.01 0.00 0.00 58.87 59.75 1wi0 n SER 6 Cb 0.52 -1.24 -0.04 0.00 -1.01 0.00 0.00 64.21 62.44 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 -2.30 -0.75 -0.47 0.23 0.00 -1.26 -5.11 107.32 97.65 1wi0 s GLY 7 Ca 0.65 0.19 -0.28 0.00 0.00 0.00 0.00 44.72 45.28 1wi0 s GLY 7 CO 0.64 3.24 1.44 2.56 0.00 0.00 0.00 173.10 180.98 1wi0 s PRO 8 N 2.30 3.43 0.14 2.90 0.04 -1.26 -4.98 135.00 137.57 1wi0 s PRO 8 Ca 0.12 0.76 0.06 0.00 0.04 0.00 0.00 61.00 61.98 1wi0 s PRO 8 Cb -0.11 -4.08 -0.04 0.00 0.04 0.00 0.00 34.50 30.31 1wi0 s PRO 8 CO -0.21 -1.75 -0.13 0.12 0.04 0.00 0.00 177.00 175.07 1wi0 s PHE 9 N 5.84 1.39 -0.48 0.56 5.36 -1.26 -5.08 117.98 124.31 1wi0 s PHE 9 Ca 0.59 -0.62 0.06 0.00 -0.96 0.00 0.00 56.93 56.00 1wi0 s PHE 9 Cb -0.13 -0.71 0.26 0.00 -0.34 0.00 0.00 43.02 42.11 1wi0 s PHE 9 CO 0.30 0.15 0.95 0.00 -1.46 0.00 0.00 175.22 175.16 1wi0 s ALA 11 N 0.55 4.01 0.60 0.00 0.00 -1.26 -5.05 121.76 120.61 1wi0 s ALA 11 Ca 0.29 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 50.97 1wi0 s ALA 11 Cb 0.25 -0.33 0.00 0.00 0.00 0.00 0.00 23.12 23.03 1wi0 s ALA 11 CO -0.19 -0.21 0.00 -1.33 0.00 0.00 0.00 175.76 174.03 1wi0 n MET 12 N -1.40 -4.10 -2.63 0.00 2.81 -1.26 -4.68 117.12 105.86 1wi0 n MET 12 Ca -0.07 3.19 -0.43 0.00 -1.81 0.00 0.00 57.70 58.59 1wi0 n MET 12 Cb 0.65 -4.03 -0.03 0.00 -0.71 0.00 0.00 33.22 29.11 1wi0 n MET 12 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1wi0 s GLU 13 N -5.37 3.57 -0.04 0.03 0.41 -1.26 -4.96 118.70 111.09 1wi0 s GLU 13 Ca 0.00 0.31 -0.36 0.00 -0.41 0.00 0.00 54.97 54.51 1wi0 s GLU 13 Cb 0.00 -3.97 -0.15 0.00 -1.78 0.00 0.00 34.13 28.23 1wi0 s GLU 13 CO 0.00 -1.53 1.63 -1.71 -0.49 0.00 0.00 175.26 173.15 1wi0 n ASN 14 N 8.07 2.58 -4.06 -0.19 5.15 -1.26 -4.82 115.26 120.73 1wi0 n ASN 14 Ca 0.09 1.07 -0.37 0.00 -0.60 0.00 0.00 54.58 54.76 1wi0 n ASN 14 Cb 0.49 -1.27 0.02 0.00 -0.53 0.00 0.00 39.78 38.49 1wi0 n ASN 14 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1wi0 n GLN 15 N 4.44 0.00 -0.92 1.20 10.64 -1.26 -4.81 117.38 126.67 1wi0 n GLN 15 Ca 0.21 0.00 -0.34 0.00 -1.83 0.00 0.00 57.00 55.04 1wi0 n GLN 15 Cb 0.22 -0.97 0.10 0.00 -0.86 0.00 0.00 30.24 28.73 1wi0 n GLN 15 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.06 176.56 1wi0 n VAL 16 N -1.74 0.35 -3.35 -0.39 0.24 -1.26 -4.95 118.33 107.23 1wi0 n VAL 16 Ca 0.05 -0.27 -0.33 0.00 -2.04 0.00 0.00 64.34 61.74 1wi0 n VAL 16 Cb 0.48 -0.56 -0.06 0.00 -1.47 0.00 0.00 33.84 32.24 1wi0 n VAL 16 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1wi0 s LEU 17 N 0.34 4.22 -0.15 1.34 2.96 0.49 -4.93 118.68 122.95 1wi0 s LEU 17 Ca 0.56 1.04 -0.01 0.00 -0.22 0.00 0.00 54.13 55.50 1wi0 s LEU 17 Cb -0.24 -3.58 0.04 0.00 0.50 0.00 0.00 46.19 42.91 1wi0 s LEU 17 CO 0.68 -0.02 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.97 1wi0 s VAL 18 N -1.70 0.82 -0.24 1.68 1.01 -1.26 0.58 120.40 121.29 1wi0 s VAL 18 Ca 0.45 -0.46 -0.13 0.00 0.00 0.00 0.00 61.98 61.84 1wi0 s VAL 18 Cb -0.13 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 1wi0 s VAL 18 CO 0.20 0.08 0.29 -0.63 0.00 0.00 0.00 175.10 175.04 1wi0 s ILE 19 N 1.75 5.26 -0.43 2.22 1.01 -0.74 -0.55 121.20 129.72 1wi0 s ILE 19 Ca 0.01 0.44 -0.14 0.00 0.00 0.00 0.00 60.65 60.95 1wi0 s ILE 19 Cb -0.15 -3.62 0.04 0.00 0.01 0.00 0.00 42.46 38.74 1wi0 s ILE 19 CO -0.07 0.26 0.33 -0.60 0.00 0.00 0.00 174.94 174.85 1wi0 s ARG 20 N 1.47 2.94 -0.53 2.79 3.52 -0.63 0.67 118.95 129.19 1wi0 s ARG 20 Ca 0.13 -1.18 -0.24 0.00 -0.13 0.00 0.00 55.73 54.31 1wi0 s ARG 20 Cb -0.15 -4.00 0.04 0.00 -1.56 0.00 0.00 34.95 29.28 1wi0 s ARG 20 CO 0.08 -0.87 0.90 0.42 -0.81 0.00 0.00 175.30 175.02 1wi0 s ILE 21 N 1.64 4.46 -0.75 4.11 1.09 0.41 -0.91 121.20 131.25 1wi0 s ILE 21 Ca 0.04 0.26 -0.26 0.00 -1.10 0.00 0.00 60.65 59.60 1wi0 s ILE 21 Cb -0.21 -4.49 -0.07 0.00 -1.06 0.00 0.00 42.46 36.63 1wi0 s ILE 21 CO 0.08 -1.03 2.10 -0.54 -0.10 0.00 0.00 174.94 175.46 1wi0 s LYS 22 N 3.75 2.28 0.45 2.79 -0.14 -0.61 -1.98 119.74 126.28 1wi0 s LYS 22 Ca 0.29 0.35 -0.25 0.00 -1.36 0.00 0.00 55.97 55.00 1wi0 s LYS 22 Cb -0.13 -4.77 -0.09 0.00 -1.68 0.00 0.00 37.83 31.17 1wi0 s LYS 22 CO 0.19 -3.47 1.44 -0.89 -0.76 0.00 0.00 175.35 171.86 1wi0 n ILE 23 N 7.95 2.76 -2.33 2.17 2.08 -0.66 -4.61 119.36 126.72 1wi0 n ILE 23 Ca 0.37 -0.50 -0.41 0.00 0.56 0.00 0.00 62.75 62.76 1wi0 n ILE 23 Cb 0.48 -1.85 -0.03 0.00 -0.75 0.00 0.00 39.64 37.50 1wi0 n ILE 23 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 1wi0 s PRO 24 N -2.43 3.25 -0.68 0.38 0.04 -1.26 -3.92 135.00 130.37 1wi0 s PRO 24 Ca 0.61 0.56 -0.06 0.00 0.04 0.00 0.00 61.00 62.15 1wi0 s PRO 24 Cb -0.45 -4.15 0.01 0.00 0.04 0.00 0.00 34.50 29.94 1wi0 s PRO 24 CO 0.58 -2.00 0.66 0.09 0.04 0.00 0.00 177.00 176.37 1wi0 n ASN 25 N 9.91 -7.05 0.10 6.66 3.02 -1.26 -4.85 115.26 121.79 1wi0 n ASN 25 Ca 0.14 -0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.53 1wi0 n ASN 25 Cb 0.49 -4.30 0.00 0.00 -0.61 0.00 0.00 39.78 35.36 1wi0 n ASN 25 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1wi0 n SER 26 N -1.58 -1.74 0.00 6.41 7.64 -1.25 -5.15 113.62 117.95 1wi0 n SER 26 Ca -0.05 0.68 0.00 0.00 1.01 0.00 0.00 58.87 60.50 1wi0 n SER 26 Cb 0.55 1.91 0.00 0.00 -1.01 0.00 0.00 64.21 65.66 1wi0 n SER 26 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wi0 n GLY 27 N -1.20 -0.31 3.65 0.23 0.00 -1.26 -5.05 105.19 101.26 1wi0 n GLY 27 Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.41 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 -2.49 0.16 4.61 0.00 -1.26 -1.65 121.76 120.13 1wi0 s ALA 28 Ca 0.00 2.05 0.01 0.00 0.00 0.00 0.00 51.96 54.02 1wi0 s ALA 28 Cb 0.00 -1.87 -0.04 0.00 0.00 0.00 0.00 23.12 21.22 1wi0 s ALA 28 CO 0.00 -0.32 0.32 0.54 0.00 0.00 0.00 175.76 176.31 1wi0 s VAL 29 N 1.10 5.28 -0.32 0.00 0.11 -0.84 -4.87 120.40 120.86 1wi0 s VAL 29 Ca -0.08 -0.52 -0.03 0.00 -2.93 0.00 0.00 61.98 58.43 1wi0 s VAL 29 Cb -0.03 -3.73 0.05 0.00 -1.53 0.00 0.00 36.38 31.15 1wi0 s VAL 29 CO -0.12 -0.11 0.05 1.51 -3.33 0.00 0.00 175.10 173.10 1wi0 s ASP 30 N -3.14 5.02 -0.55 3.54 -4.77 -1.26 -0.45 116.67 115.07 1wi0 s ASP 30 Ca 0.36 -1.33 -0.25 0.00 -3.30 0.00 0.00 52.55 48.03 1wi0 s ASP 30 Cb -0.11 -1.76 0.04 0.00 -1.09 0.00 0.00 42.92 40.00 1wi0 s ASP 30 CO 0.29 -0.31 0.99 0.86 0.70 0.00 0.00 175.17 177.70 1wi0 s TRP 31 N 1.27 2.77 -0.37 2.11 -0.00 0.21 -4.88 118.94 120.05 1wi0 s TRP 31 Ca -0.03 0.10 -0.28 0.00 -0.00 0.00 0.00 56.10 55.89 1wi0 s TRP 31 Cb -0.20 -4.15 -0.02 0.00 -0.00 0.00 0.00 33.47 29.10 1wi0 s TRP 31 CO -0.01 -1.38 1.81 -0.08 -0.00 0.00 0.00 176.95 177.29 1wi0 s THR 32 N 4.13 3.46 -0.20 5.86 -1.32 -1.26 -1.79 115.64 124.53 1wi0 s THR 32 Ca 0.33 0.45 -0.03 0.00 -1.21 0.00 0.00 61.69 61.23 1wi0 s THR 32 Cb -0.11 -3.68 -0.01 0.00 -1.51 0.00 0.00 72.50 67.18 1wi0 s THR 32 CO 0.21 -0.47 -0.06 -0.69 -2.21 0.00 0.00 174.62 171.40 1wi0 s VAL 33 N 7.21 3.38 -0.18 5.08 1.01 0.20 -4.98 120.40 132.13 1wi0 s VAL 33 Ca 0.78 -0.50 -0.07 0.00 0.00 0.00 0.00 61.98 62.19 1wi0 s VAL 33 Cb -0.21 -2.51 -0.22 0.00 0.00 0.00 0.00 36.38 33.44 1wi0 s VAL 33 CO 0.32 0.45 0.14 1.41 0.00 0.00 0.00 175.10 177.42 1wi0 n HIS 34 N 4.44 0.82 -1.50 5.22 8.25 -1.26 0.19 115.22 131.38 1wi0 n HIS 34 Ca -0.18 0.20 -0.38 0.00 -0.26 0.00 0.00 57.72 57.10 1wi0 n HIS 34 Cb 0.51 -1.10 -0.03 0.00 1.12 0.00 0.00 29.99 30.49 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 -3.58 8.34 -0.34 0.41 7.64 -1.26 -4.56 113.62 120.27 1wi0 n SER 35 Ca -0.37 -2.75 -0.09 0.00 1.01 0.00 0.00 58.87 56.67 1wi0 n SER 35 Cb 0.98 -1.49 -0.08 0.00 -1.01 0.00 0.00 64.21 62.61 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 2.92 -2.21 0.16 0.23 0.00 -1.26 -0.18 105.19 104.85 1wi0 n GLY 36 Ca 0.72 0.98 -0.12 0.00 0.00 0.00 0.00 46.02 47.60 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 0.41 -2.13 1.61 0.13 -1.98 -3.29 132.00 126.76 1wi0 h PRO 37 Ca 0.13 -0.40 -0.28 0.00 -0.87 0.00 0.00 66.00 64.58 1wi0 h PRO 37 Cb 0.33 0.10 -0.07 0.00 0.13 0.00 0.00 31.00 31.49 1wi0 h PRO 37 CO -0.76 1.06 0.23 1.04 -0.23 0.00 0.00 178.00 179.34 1wi0 n GLN 38 N -3.78 2.28 -4.92 0.86 3.00 0.74 -4.82 117.38 110.74 1wi0 n GLN 38 Ca -0.06 -1.30 -0.26 0.00 -0.01 0.00 0.00 57.00 55.37 1wi0 n GLN 38 Cb 0.79 -2.12 -0.16 0.00 0.00 0.00 0.00 30.24 28.75 1wi0 n GLN 38 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 1wi0 s LEU 39 N -0.20 1.99 0.29 1.08 2.96 -0.88 -4.72 118.68 119.20 1wi0 s LEU 39 Ca 0.66 -0.36 0.09 0.00 -0.22 0.00 0.00 54.13 54.31 1wi0 s LEU 39 Cb 0.31 -1.01 -0.05 0.00 0.50 0.00 0.00 46.19 45.94 1wi0 s LEU 39 CO -0.03 0.21 0.00 -0.76 -1.32 0.00 0.00 176.35 174.45 1wi0 s LEU 40 N -0.25 3.11 0.12 -0.68 1.43 -1.26 -4.90 118.68 116.25 1wi0 s LEU 40 Ca 0.02 -0.76 -0.20 0.00 -1.03 0.00 0.00 54.13 52.17 1wi0 s LEU 40 Cb -0.09 -1.60 -0.07 0.00 0.03 0.00 0.00 46.19 44.46 1wi0 s LEU 40 CO 0.01 -0.08 1.77 0.15 0.23 0.00 0.00 176.35 178.42 1wi0 h PHE 41 N 1.86 0.25 -0.27 0.29 3.57 -1.91 -2.81 116.94 117.92 1wi0 h PHE 41 Ca -0.43 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.13 1wi0 h PHE 41 Cb 1.25 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 39.85 1wi0 h PHE 41 CO 0.69 0.17 -0.09 0.00 -2.23 0.00 0.00 178.31 176.85 1wi0 h ARG 42 N 0.26 -0.04 -0.85 1.11 2.47 -1.96 -1.50 114.38 113.87 1wi0 h ARG 42 Ca 0.07 0.00 0.16 0.00 -1.26 0.00 0.00 59.98 58.96 1wi0 h ARG 42 Cb -0.02 0.01 -0.16 0.00 -1.65 0.00 0.00 29.97 28.15 1wi0 h ARG 42 CO -0.01 -0.02 -0.24 -0.44 0.56 0.00 0.00 179.97 179.81 1wi0 h ASP 43 N -0.04 -0.89 -0.47 7.04 5.19 -1.91 1.78 116.42 127.12 1wi0 h ASP 43 Ca 0.13 0.26 0.07 0.00 -0.62 0.00 0.00 57.03 56.88 1wi0 h ASP 43 Cb 0.24 0.56 -0.06 0.00 0.18 0.00 0.00 39.33 40.25 1wi0 h ASP 43 CO -0.30 -0.29 0.12 0.58 -3.12 0.00 0.00 179.24 176.23 1wi0 h VAL 44 N -0.01 0.77 -0.16 -1.35 2.07 -1.14 0.44 116.25 116.87 1wi0 h VAL 44 Ca 0.39 -0.09 -0.08 0.00 0.82 0.00 0.00 66.70 67.74 1wi0 h VAL 44 Cb 0.62 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1wi0 h VAL 44 CO -0.88 0.05 -0.25 -0.07 0.02 0.00 0.00 177.57 176.44 1wi0 h LEU 45 N 0.26 0.29 -1.25 2.57 -0.00 0.12 0.67 115.31 117.96 1wi0 h LEU 45 Ca 0.23 -0.09 -0.07 0.00 -0.00 0.00 0.00 57.88 57.95 1wi0 h LEU 45 Cb 0.28 -0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 40.86 1wi0 h LEU 45 CO -0.28 0.54 -0.33 0.44 -0.00 0.00 0.00 178.44 178.81 1wi0 h ASP 46 N 0.26 0.00 0.00 -0.43 5.19 0.48 -1.35 116.42 120.57 1wi0 h ASP 46 Ca 0.04 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.44 1wi0 h ASP 46 Cb 0.58 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.09 1wi0 h ASP 46 CO 0.04 0.33 -0.42 0.58 -3.12 0.00 0.00 179.24 176.65 1wi0 h VAL 47 N 0.00 0.07 -0.95 -1.35 2.07 0.75 -3.37 116.25 113.47 1wi0 h VAL 47 Ca -0.00 -1.08 0.30 0.00 0.82 0.00 0.00 66.70 66.74 1wi0 h VAL 47 Cb 0.70 0.16 -0.16 0.00 -1.52 0.00 0.00 31.29 30.47 1wi0 h VAL 47 CO 0.04 0.02 0.37 0.40 0.02 0.00 0.00 177.57 178.42 1wi0 h ILE 48 N -1.00 0.22 -1.05 4.57 2.04 0.25 1.48 117.51 124.02 1wi0 h ILE 48 Ca -0.02 -0.07 0.28 0.00 1.00 0.00 0.00 64.86 66.06 1wi0 h ILE 48 Cb 0.43 0.02 -0.08 0.00 -0.74 0.00 0.00 36.82 36.45 1wi0 h ILE 48 CO -0.01 0.03 0.70 1.23 0.00 0.00 0.00 178.15 180.11 1wi0 h GLY 49 N 0.19 0.83 1.88 5.37 0.00 -1.40 1.20 103.07 111.15 1wi0 h GLY 49 Ca 0.66 -0.14 -0.20 0.00 0.00 0.00 0.00 47.33 47.65 1wi0 h GLY 49 CO -0.69 -0.09 -0.91 1.46 0.00 0.00 0.00 176.54 176.31 1wi0 h GLN 50 N 0.27 0.10 0.03 4.80 4.20 0.19 -2.51 115.11 122.19 1wi0 h GLN 50 Ca 0.57 -0.12 -0.22 0.00 0.06 0.00 0.00 58.65 58.94 1wi0 h GLN 50 Cb 1.68 0.04 0.02 0.00 0.30 0.00 0.00 27.48 29.52 1wi0 h GLN 50 CO -0.20 0.94 -0.86 0.28 -0.67 0.00 0.00 178.83 178.31 1wi0 h VAL 51 N 0.05 1.36 -2.87 -0.54 2.07 0.10 -3.38 116.25 113.05 1wi0 h VAL 51 Ca -0.03 -2.22 -0.61 0.00 0.82 0.00 0.00 66.70 64.65 1wi0 h VAL 51 Cb 1.58 2.58 -0.42 0.00 -1.52 0.00 0.00 31.29 33.51 1wi0 h VAL 51 CO 0.13 0.66 -0.61 0.18 0.02 0.00 0.00 177.57 177.96 1wi0 n LEU 52 N -4.03 2.93 0.24 2.57 4.32 0.34 -4.88 117.00 118.49 1wi0 n LEU 52 Ca -0.11 -5.20 0.14 0.00 -0.02 0.00 0.00 56.01 50.81 1wi0 n LEU 52 Cb 0.80 -0.65 0.41 0.00 -1.62 0.00 0.00 43.42 42.37 1wi0 n LEU 52 CO 0.52 1.82 0.87 1.55 -1.22 0.00 0.00 177.39 180.93 1wi0 h PRO 53 N 5.16 0.00 -0.19 3.23 0.13 -1.63 -2.78 132.00 135.92 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 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1wi0 h PRO 53 CO 0.72 0.05 0.00 0.39 -0.23 0.00 0.00 178.00 178.93 1wi0 n GLU 54 N -3.13 2.05 -3.11 0.86 1.02 -1.26 -4.58 120.64 112.49 1wi0 n GLU 54 Ca 0.02 -1.91 -0.21 0.00 -0.02 0.00 0.00 57.16 55.04 1wi0 n GLU 54 Cb 0.44 -1.41 -0.05 0.00 -0.02 0.00 0.00 31.44 30.40 1wi0 n GLU 54 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wi0 n ALA 55 N 1.18 1.71 -1.33 0.62 0.00 -1.05 -5.13 120.51 116.51 1wi0 n ALA 55 Ca 0.14 -3.03 -0.38 0.00 0.00 0.00 0.00 53.44 50.17 1wi0 n ALA 55 Cb 0.52 -0.91 0.02 0.00 0.00 0.00 0.00 19.45 19.08 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 1.45 0.98 -3.82 0.00 -1.04 -1.20 -4.70 114.28 105.94 1wi0 n THR 56 Ca 0.19 -0.50 -0.12 0.00 -2.04 0.00 0.00 64.05 61.58 1wi0 n THR 56 Cb 0.55 -0.30 -0.13 0.00 -1.82 0.00 0.00 70.33 68.63 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 -1.88 -0.01 -0.09 12.58 2.01 -1.26 -3.30 115.64 123.68 1wi0 s THR 57 Ca 0.62 0.02 0.04 0.00 0.31 0.00 0.00 61.69 62.68 1wi0 s THR 57 Cb -0.47 -0.17 -0.08 0.00 0.01 0.00 0.00 72.50 71.78 1wi0 s THR 57 CO 0.61 0.01 -0.04 0.35 -0.69 0.00 0.00 174.62 174.87 1wi0 n THR 58 N 3.16 0.59 -4.47 -0.82 -2.24 -1.26 -4.80 114.28 104.44 1wi0 n THR 58 Ca -0.14 -0.29 -0.23 0.00 -2.27 0.00 0.00 64.05 61.12 1wi0 n THR 58 Cb 0.58 -0.83 -0.10 0.00 -2.10 0.00 0.00 70.33 67.88 1wi0 n THR 58 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wi0 s ALA 59 N -2.21 2.53 -0.06 6.98 0.00 -1.26 -4.85 121.76 122.89 1wi0 s ALA 59 Ca -0.09 -1.86 -0.23 0.00 0.00 0.00 0.00 51.96 49.78 1wi0 s ALA 59 Cb 0.03 0.65 0.05 0.00 0.00 0.00 0.00 23.12 23.85 1wi0 s ALA 59 CO 0.29 -0.30 0.51 -0.59 0.00 0.00 0.00 175.76 175.67 1wi0 s PHE 60 N -3.26 -0.46 0.10 0.00 -0.71 -1.13 -1.84 117.98 110.68 1wi0 s PHE 60 Ca 0.33 0.85 0.02 0.00 -1.04 0.00 0.00 56.93 57.09 1wi0 s PHE 60 Cb 0.07 0.25 -0.04 0.00 -1.21 0.00 0.00 43.02 42.10 1wi0 s PHE 60 CO 0.15 -0.47 0.20 -1.21 -1.34 0.00 0.00 175.22 172.55 1wi0 s GLU 61 N -0.99 3.28 -0.10 1.99 2.02 -0.80 -0.75 118.70 123.35 1wi0 s GLU 61 Ca -0.10 -0.57 -0.05 0.00 0.02 0.00 0.00 54.97 54.27 1wi0 s GLU 61 Cb -0.03 -2.92 0.05 0.00 0.10 0.00 0.00 34.13 31.33 1wi0 s GLU 61 CO 0.06 0.57 0.22 1.52 0.02 0.00 0.00 175.26 177.65 1wi0 s TYR 62 N -1.57 -0.30 0.10 1.61 -0.85 -0.90 -0.47 117.35 114.97 1wi0 s TYR 62 Ca 0.33 0.74 -0.32 0.00 -0.52 0.00 0.00 57.07 57.30 1wi0 s TYR 62 Cb -0.12 0.00 -0.12 0.00 0.38 0.00 0.00 41.96 42.10 1wi0 s TYR 62 CO 0.27 -0.23 1.77 0.39 -1.52 0.00 0.00 175.55 176.22 1wi0 n GLU 63 N 4.37 2.52 -1.65 -3.49 1.02 -1.21 -0.19 120.64 122.02 1wi0 n GLU 63 Ca -0.23 0.92 -0.15 0.00 -0.02 0.00 0.00 57.16 57.67 1wi0 n GLU 63 Cb 0.52 -2.77 0.09 0.00 -0.02 0.00 0.00 31.44 29.26 1wi0 n GLU 63 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1wi0 n ASP 64 N 5.10 0.63 0.25 1.62 5.75 -1.26 -4.83 116.55 123.82 1wi0 n ASP 64 Ca 0.18 -1.59 0.14 0.00 -0.01 0.00 0.00 54.79 53.50 1wi0 n ASP 64 Cb 0.34 -0.45 0.80 0.00 -1.03 0.00 0.00 41.12 40.77 1wi0 n ASP 64 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 1wi0 h GLU 65 N 0.00 0.00 -0.62 0.11 4.11 -1.98 0.46 114.58 116.65 1wi0 h GLU 65 Ca -0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.21 1wi0 h GLU 65 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 1wi0 h GLU 65 CO 0.21 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 179.04 1wi0 n ASP 66 N -4.09 5.26 -4.05 3.06 9.92 -1.26 -4.95 116.55 120.44 1wi0 n ASP 66 Ca -0.01 -2.67 -0.41 0.00 -0.53 0.00 0.00 54.79 51.16 1wi0 n ASP 66 Cb 0.16 -0.63 0.01 0.00 -0.64 0.00 0.00 41.12 40.02 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 0.92 -0.69 0.30 0.44 0.00 0.16 -4.81 105.19 101.51 1wi0 n GLY 67 Ca 0.27 0.28 0.03 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 -1.76 1.88 -2.48 1.61 2.03 -1.26 -4.84 116.55 111.73 1wi0 n ASP 68 Ca -0.10 -1.52 -0.02 0.00 0.52 0.00 0.00 54.79 53.67 1wi0 n ASP 68 Cb 0.49 -0.05 -0.02 0.00 -0.72 0.00 0.00 41.12 40.83 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 0.28 -4.21 -2.44 -0.67 5.12 -1.26 -4.91 116.66 108.58 1wi0 n ARG 69 Ca 0.05 3.12 -0.25 0.00 -1.93 0.00 0.00 57.85 58.83 1wi0 n ARG 69 Cb 0.23 -4.16 0.14 0.00 -1.16 0.00 0.00 32.46 27.51 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 -0.52 2.04 -0.15 0.55 -1.09 0.73 -4.80 121.20 117.97 1wi0 s ILE 70 Ca -0.11 -0.45 -0.03 0.00 -2.23 0.00 0.00 60.65 57.82 1wi0 s ILE 70 Cb 0.01 -2.59 0.05 0.00 -1.58 0.00 0.00 42.46 38.35 1wi0 s ILE 70 CO 0.30 0.00 0.05 -0.89 -1.23 0.00 0.00 174.94 173.17 1wi0 s THR 71 N -3.37 0.26 -0.45 2.92 2.01 -1.26 -2.13 115.64 113.62 1wi0 s THR 71 Ca 0.70 -0.20 -0.20 0.00 0.31 0.00 0.00 61.69 62.30 1wi0 s THR 71 Cb -0.04 -0.71 0.03 0.00 0.01 0.00 0.00 72.50 71.79 1wi0 s THR 71 CO 0.47 -0.09 0.59 -0.69 -0.69 0.00 0.00 174.62 174.21 1wi0 s VAL 72 N 1.99 4.90 -0.06 3.82 1.01 0.07 -4.84 120.40 127.29 1wi0 s VAL 72 Ca 0.02 -0.15 0.11 0.00 0.00 0.00 0.00 61.98 61.95 1wi0 s VAL 72 Cb -0.15 -4.19 -0.16 0.00 0.00 0.00 0.00 36.38 31.88 1wi0 s VAL 72 CO -0.07 -0.61 0.15 0.54 0.00 0.00 0.00 175.10 175.11 1wi0 n ARG 73 N 6.09 1.23 -4.24 2.72 1.74 -1.26 -2.85 116.66 120.09 1wi0 n ARG 73 Ca -0.04 -0.06 -0.14 0.00 -0.77 0.00 0.00 57.85 56.84 1wi0 n ARG 73 Cb 0.47 -1.27 -0.10 0.00 -1.02 0.00 0.00 32.46 30.54 1wi0 n ARG 73 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1wi0 s SER 74 N -3.77 0.64 0.35 0.55 0.01 -1.26 -4.95 113.70 105.27 1wi0 s SER 74 Ca -0.05 -1.35 0.08 0.00 1.31 0.00 0.00 55.95 55.94 1wi0 s SER 74 Cb 0.05 0.27 0.78 0.00 0.21 0.00 0.00 66.02 67.33 1wi0 s SER 74 CO 0.46 -0.77 1.88 0.44 0.41 0.00 0.00 173.24 175.66 1wi0 h ASP 75 N 2.56 0.68 -0.37 2.44 3.32 -1.97 -1.45 116.42 121.64 1wi0 h ASP 75 Ca -0.37 0.03 0.08 0.00 0.02 0.00 0.00 57.03 56.79 1wi0 h ASP 75 Cb 1.24 -0.10 -0.09 0.00 0.22 0.00 0.00 39.33 40.60 1wi0 h ASP 75 CO 0.57 0.37 -0.32 -0.08 -1.72 0.00 0.00 179.24 178.06 1wi0 h GLU 76 N 0.74 -0.26 -0.76 3.56 4.81 -2.00 0.11 114.58 120.78 1wi0 h GLU 76 Ca 0.43 0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.65 1wi0 h GLU 76 Cb 0.62 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.02 1wi0 h GLU 76 CO -0.19 -0.17 0.36 0.93 -0.73 0.00 0.00 179.01 179.21 1wi0 h GLU 77 N -0.27 1.08 0.06 1.92 5.08 -1.65 -2.79 114.58 118.02 1wi0 h GLU 77 Ca 0.16 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1wi0 h GLU 77 Cb 0.54 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1wi0 h GLU 77 CO -0.52 0.84 -0.07 0.52 -1.00 0.00 0.00 179.01 178.78 1wi0 h MET 78 N 1.08 -0.13 -0.99 2.33 2.86 -0.22 0.20 114.93 120.06 1wi0 h MET 78 Ca 0.26 0.01 0.34 0.00 -2.06 0.00 0.00 59.70 58.25 1wi0 h MET 78 Cb 0.11 0.03 -0.18 0.00 0.06 0.00 0.00 31.60 31.62 1wi0 h MET 78 CO -0.03 -0.09 0.33 0.87 1.06 0.00 0.00 176.91 179.05 1wi0 h LYS 79 N -0.14 0.05 0.64 1.72 6.56 -0.94 0.72 116.57 125.19 1wi0 h LYS 79 Ca -0.01 -0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.55 1wi0 h LYS 79 Cb 0.12 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 31.77 1wi0 h LYS 79 CO -0.01 0.03 -0.33 0.00 -2.06 0.00 0.00 179.45 177.08 1wi0 h ALA 80 N 1.96 -0.90 -0.95 3.86 0.00 -1.12 1.24 119.26 123.36 1wi0 h ALA 80 Ca 0.73 -0.19 0.21 0.00 0.00 0.00 0.00 54.91 55.66 1wi0 h ALA 80 Cb 1.74 0.37 -0.12 0.00 0.00 0.00 0.00 17.79 19.79 1wi0 h ALA 80 CO -0.80 -1.01 0.51 1.98 0.00 0.00 0.00 179.25 179.93 1wi0 h MET 81 N -0.90 0.54 -0.06 0.00 1.85 0.36 0.19 114.93 116.92 1wi0 h MET 81 Ca -0.09 -0.03 -0.08 0.00 -0.61 0.00 0.00 59.70 58.89 1wi0 h MET 81 Cb 0.70 -0.12 0.00 0.00 0.43 0.00 0.00 31.60 32.61 1wi0 h MET 81 CO 0.13 0.36 -0.29 -0.07 -0.40 0.00 0.00 176.91 176.64 1wi0 h LEU 82 N 0.56 0.36 -1.81 3.39 3.38 -0.46 -1.16 115.31 119.57 1wi0 h LEU 82 Ca 0.58 -0.65 0.22 0.00 0.09 0.00 0.00 57.88 58.12 1wi0 h LEU 82 Cb 1.03 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.63 1wi0 h LEU 82 CO -0.46 0.95 0.58 -1.28 0.09 0.00 0.00 178.44 178.33 1wi0 h SER 83 N -0.21 0.16 0.00 -0.43 0.87 0.36 -1.21 113.55 113.08 1wi0 h SER 83 Ca -0.02 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1wi0 h SER 83 Cb 0.95 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.89 1wi0 h SER 83 CO 0.06 0.06 -0.02 0.22 -0.53 0.00 0.00 176.83 176.62 1wi0 h TYR 84 N 0.16 0.00 -0.81 2.24 3.20 -0.61 -2.47 116.97 118.68 1wi0 h TYR 84 Ca 0.41 0.00 0.25 0.00 3.14 0.00 0.00 58.73 62.54 1wi0 h TYR 84 Cb 1.39 0.00 -0.15 0.00 1.54 0.00 0.00 36.73 39.51 1wi0 h TYR 84 CO -0.00 0.00 0.13 0.98 -1.64 0.00 0.00 178.16 177.63 1wi0 n TYR 85 N -3.44 0.63 -0.04 -3.82 9.36 -0.45 0.19 117.16 119.59 1wi0 n TYR 85 Ca -0.00 0.97 -0.15 0.00 3.32 0.00 0.00 57.90 62.03 1wi0 n TYR 85 Cb 0.01 -1.18 -0.08 0.00 -0.63 0.00 0.00 39.34 37.47 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 0.72 -0.25 2.98 0.05 -1.37 1.54 116.97 120.63 1wi0 h TYR 86 Ca 0.54 -0.29 0.07 0.00 0.05 0.00 0.00 58.73 59.10 1wi0 h TYR 86 Cb 1.22 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 38.83 1wi0 h TYR 86 CO -0.31 1.06 0.19 1.03 -1.05 0.00 0.00 178.16 179.08 1wi0 h SER 87 N 0.17 0.00 0.02 3.88 0.87 0.26 0.51 113.55 119.26 1wi0 h SER 87 Ca -0.02 0.00 -0.38 0.00 -1.23 0.00 0.00 61.79 60.16 1wi0 h SER 87 Cb 1.08 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.99 1wi0 h SER 87 CO 0.10 0.00 -2.14 1.07 -0.53 0.00 0.00 176.83 175.32 1wi0 n THR 88 N -4.40 1.56 -0.20 2.23 5.66 0.11 -4.01 114.28 115.22 1wi0 n THR 88 Ca 0.03 -0.37 -0.00 0.00 -3.05 0.00 0.00 64.05 60.66 1wi0 n THR 88 Cb 0.34 -1.81 0.07 0.00 -1.55 0.00 0.00 70.33 67.38 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 -0.65 0.41 -0.38 1.08 2.07 0.25 0.77 116.25 119.80 1wi0 h VAL 89 Ca -0.56 -0.01 0.07 0.00 0.82 0.00 0.00 66.70 67.02 1wi0 h VAL 89 Cb 1.65 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 1wi0 h VAL 89 CO -0.24 0.00 0.26 0.00 0.02 0.00 0.00 177.57 177.62 1wi0 h MET 90 N 0.03 0.21 0.00 1.57 -0.00 -1.10 0.17 114.93 115.81 1wi0 h MET 90 Ca 0.30 -0.01 -0.09 0.00 -0.00 0.00 0.00 59.70 59.90 1wi0 h MET 90 Cb 0.47 -0.05 -0.01 0.00 -0.00 0.00 0.00 31.60 32.01 1wi0 h MET 90 CO -0.61 0.14 -0.43 0.93 -0.00 0.00 0.00 176.91 176.95 1wi0 h GLU 91 N 0.22 0.00 0.00 -0.10 4.39 0.33 -2.42 114.58 117.00 1wi0 h GLU 91 Ca 0.17 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.80 1wi0 h GLU 91 Cb 0.40 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 1wi0 h GLU 91 CO -0.03 0.43 -0.34 1.96 -1.16 0.00 0.00 179.01 179.87 1wi0 h GLN 92 N 0.00 0.00 0.08 2.33 4.20 0.13 -2.26 115.11 119.59 1wi0 h GLN 92 Ca -0.00 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.56 1wi0 h GLN 92 Cb 1.03 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.82 1wi0 h GLN 92 CO 0.06 0.34 -0.69 1.96 -0.67 0.00 0.00 178.83 179.82 1wi0 h GLN 93 N 0.00 0.17 -0.12 1.46 4.20 -1.19 -2.38 115.11 117.26 1wi0 h GLN 93 Ca -0.00 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.41 1wi0 h GLN 93 Cb 0.94 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.83 1wi0 h GLN 93 CO 0.04 1.14 0.08 -0.39 -0.67 0.00 0.00 178.83 179.04 1wi0 h VAL 94 N -0.61 1.03 0.13 -0.54 -1.51 -1.45 -3.03 116.25 110.27 1wi0 h VAL 94 Ca -0.14 -0.05 -0.01 0.00 -1.23 0.00 0.00 66.70 65.27 1wi0 h VAL 94 Cb 1.43 0.86 0.00 0.00 -2.13 0.00 0.00 31.29 31.45 1wi0 h VAL 94 CO 0.06 0.03 -0.06 0.78 -1.23 0.00 0.00 177.57 177.15 1wi0 h ASN 95 N 0.16 -0.15 0.00 4.19 2.35 -1.48 -3.50 115.58 117.16 1wi0 h ASN 95 Ca 0.04 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1wi0 h ASN 95 Cb -0.02 0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.39 1wi0 h ASN 95 CO -0.01 0.01 0.00 0.61 -1.65 0.00 0.00 177.43 176.39 1wi0 n GLY 96 N 0.82 0.98 3.01 2.83 0.00 -0.90 -5.10 105.19 106.82 1wi0 n GLY 96 Ca -0.02 0.03 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.01 -1.58 1.61 10.64 -1.22 -4.83 117.38 122.00 1wi0 n GLN 97 Ca 0.00 -0.00 -0.29 0.00 -1.83 0.00 0.00 57.00 54.88 1wi0 n GLN 97 Cb 0.00 -1.02 0.11 0.00 -0.86 0.00 0.00 30.24 28.47 1wi0 n GLN 97 CO 0.00 0.00 0.00 -0.48 -1.83 0.00 0.00 177.06 174.75 1wi0 s LEU 98 N 7.78 2.30 0.27 2.61 0.05 -1.26 -4.39 118.68 126.04 1wi0 s LEU 98 Ca 0.40 1.09 -0.12 0.00 0.05 0.00 0.00 54.13 55.54 1wi0 s LEU 98 Cb -0.17 -3.55 -0.08 0.00 -2.05 0.00 0.00 46.19 40.34 1wi0 s LEU 98 CO 0.82 -2.25 0.64 -0.63 -0.55 0.00 0.00 176.35 174.39 1wi0 s ILE 99 N -3.26 4.80 0.09 1.48 -1.09 -1.26 -4.91 121.20 117.05 1wi0 s ILE 99 Ca 0.62 0.73 0.04 0.00 -2.23 0.00 0.00 60.65 59.81 1wi0 s ILE 99 Cb -0.14 -3.62 -0.04 0.00 -1.58 0.00 0.00 42.46 37.08 1wi0 s ILE 99 CO 0.53 -0.11 0.03 -1.83 -1.23 0.00 0.00 174.94 172.33 1wi0 s GLU 100 N -2.86 2.67 0.30 2.79 -1.05 -1.26 -5.10 118.70 114.19 1wi0 s GLU 100 Ca 0.50 -0.79 -0.28 0.00 -0.15 0.00 0.00 54.97 54.25 1wi0 s GLU 100 Cb -0.11 -2.61 -0.09 0.00 -0.44 0.00 0.00 34.13 30.88 1wi0 s GLU 100 CO 0.19 0.55 1.07 -1.25 0.95 0.00 0.00 175.26 176.77 1wi0 s PRO 101 N -2.36 4.55 -0.84 -4.83 0.04 -1.26 -4.87 135.00 125.43 1wi0 s PRO 101 Ca 0.27 1.71 -0.23 0.00 0.04 0.00 0.00 61.00 62.80 1wi0 s PRO 101 Cb -0.12 -3.05 -0.18 0.00 0.04 0.00 0.00 34.50 31.19 1wi0 s PRO 101 CO 0.20 0.16 2.28 -0.11 0.04 0.00 0.00 177.00 179.57 1wi0 n LEU 102 N 0.93 1.10 -4.59 -3.56 7.94 0.28 -4.65 117.00 114.46 1wi0 n LEU 102 Ca 0.00 -1.50 -0.41 0.00 -1.11 0.00 0.00 56.01 52.99 1wi0 n LEU 102 Cb 0.46 -1.47 -0.03 0.00 0.53 0.00 0.00 43.42 42.91 1wi0 n LEU 102 CO 0.52 -2.58 1.83 -1.58 -1.11 0.00 0.00 177.39 174.46 1wi0 s GLN 103 N 8.45 2.91 0.36 1.96 0.74 -1.26 -1.60 119.66 131.22 1wi0 s GLN 103 Ca 0.94 1.73 0.05 0.00 0.05 0.00 0.00 55.36 58.13 1wi0 s GLN 103 Cb -0.23 -4.39 -0.07 0.00 1.10 0.00 0.00 33.01 29.42 1wi0 s GLN 103 CO 0.17 -2.36 0.03 0.96 -0.55 0.00 0.00 175.29 173.54 1wi0 s ILE 104 N 8.99 1.56 -0.03 -2.34 -4.36 -0.09 -3.29 121.20 121.64 1wi0 s ILE 104 Ca 0.95 -2.01 -0.00 0.00 -0.26 0.00 0.00 60.65 59.33 1wi0 s ILE 104 Cb -0.27 -2.87 0.03 0.00 1.25 0.00 0.00 42.46 40.60 1wi0 s ILE 104 CO 0.32 -0.01 0.02 -0.36 0.24 0.00 0.00 174.94 175.15 1wi0 s PHE 105 N -3.03 0.14 -0.40 1.37 0.40 0.38 -1.57 117.98 115.27 1wi0 s PHE 105 Ca 0.36 0.09 -0.29 0.00 -0.60 0.00 0.00 56.93 56.49 1wi0 s PHE 105 Cb 0.09 -0.33 0.01 0.00 0.51 0.00 0.00 43.02 43.30 1wi0 s PHE 105 CO 0.16 -0.12 1.41 -1.25 0.70 0.00 0.00 175.22 176.12 1wi0 s PRO 106 N 1.20 3.60 -1.08 0.24 0.04 -1.26 -1.90 135.00 135.84 1wi0 s PRO 106 Ca -0.07 0.97 -0.21 0.00 0.04 0.00 0.00 61.00 61.73 1wi0 s PRO 106 Cb -0.13 -4.01 0.08 0.00 0.04 0.00 0.00 34.50 30.47 1wi0 s PRO 106 CO -0.03 -1.53 1.45 1.03 0.04 0.00 0.00 177.00 177.97 1wi0 s ARG 107 N 4.87 3.71 0.32 4.56 0.52 -0.76 -4.98 118.95 127.19 1wi0 s ARG 107 Ca 0.61 -1.51 -0.28 0.00 -0.52 0.00 0.00 55.73 54.03 1wi0 s ARG 107 Cb -0.14 -5.30 -0.10 0.00 0.52 0.00 0.00 34.95 29.93 1wi0 s ARG 107 CO 0.32 -2.12 1.18 -1.54 0.02 0.00 0.00 175.30 173.16 1wi0 s SER 108 N 4.45 6.96 0.00 0.23 1.04 -1.26 -4.01 113.70 121.11 1wi0 s SER 108 Ca 0.45 2.43 0.00 0.00 0.48 0.00 0.00 55.95 59.31 1wi0 s SER 108 Cb -0.00 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.49 1wi0 s SER 108 CO -0.05 -0.38 0.00 0.61 0.98 0.00 0.00 173.24 174.40 1wi0 n GLY 109 N 0.94 3.27 0.08 7.32 0.00 -1.21 -5.04 105.19 110.56 1wi0 n GLY 109 Ca 0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 46.02 45.60 1wi0 n GLY 109 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wi0 h PRO 110 N 0.00 -0.16 -4.29 1.61 0.13 -1.94 -3.45 132.00 123.90 1wi0 h PRO 110 Ca 0.00 0.01 -0.31 0.00 -0.87 0.00 0.00 66.00 64.83 1wi0 h PRO 110 Cb 0.00 0.04 -0.27 0.00 0.13 0.00 0.00 31.00 30.89 1wi0 h PRO 110 CO 0.00 -0.11 -0.75 0.45 -0.23 0.00 0.00 178.00 177.37 1wi0 s SER 111 N -3.92 0.59 0.07 1.44 0.15 -1.26 -5.08 113.70 105.70 1wi0 s SER 111 Ca -0.02 -0.15 0.04 0.00 0.70 0.00 0.00 55.95 56.51 1wi0 s SER 111 Cb 0.00 -0.05 -0.03 0.00 -1.71 0.00 0.00 66.02 64.24 1wi0 s SER 111 CO 0.07 0.02 -0.10 -0.44 1.20 0.00 0.00 173.24 173.99 1wi0 s SER 112 N -0.33 1.32 0.00 5.45 0.01 -1.26 -5.26 113.70 113.63 1wi0 s SER 112 Ca -0.00 -0.68 0.00 0.00 1.31 0.00 0.00 55.95 56.58 1wi0 s SER 112 Cb -0.03 0.00 0.00 0.00 0.21 0.00 0.00 66.02 66.20 1wi0 s SER 112 CO -0.00 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.06