#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wz0 s SER 2 N 0.00 0.12 0.32 1.61 0.01 -1.26 -5.18 113.70 109.32 1wz0 s SER 2 Ca 0.00 -0.69 0.04 0.00 1.31 0.00 0.00 55.95 56.60 1wz0 s SER 2 Cb 0.00 0.35 -0.04 0.00 0.21 0.00 0.00 66.02 66.54 1wz0 s SER 2 CO 0.00 -0.75 0.17 -0.94 0.41 0.00 0.00 173.24 172.13 1wz0 s SER 3 N -2.88 1.68 0.00 2.44 1.04 -1.26 -5.15 113.70 109.57 1wz0 s SER 3 Ca 0.07 -1.59 0.00 0.00 0.48 0.00 0.00 55.95 54.91 1wz0 s SER 3 Cb 0.05 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.59 1wz0 s SER 3 CO -0.09 -0.91 0.00 0.61 0.98 0.00 0.00 173.24 173.82 1wz0 n GLY 4 N -0.62 0.77 3.63 7.32 0.00 -1.26 -5.17 105.19 109.86 1wz0 n GLY 4 Ca 0.01 0.57 -0.03 0.00 0.00 0.00 0.00 46.02 46.58 1wz0 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wz0 s SER 5 N 0.00 -1.06 -0.23 1.61 1.04 -1.26 -5.16 113.70 108.63 1wz0 s SER 5 Ca 0.00 1.53 -0.30 0.00 0.48 0.00 0.00 55.95 57.67 1wz0 s SER 5 Cb 0.00 2.06 0.16 0.00 0.10 0.00 0.00 66.02 68.34 1wz0 s SER 5 CO 0.00 -0.22 1.21 -0.55 0.98 0.00 0.00 173.24 174.65 1wz0 s SER 6 N 2.61 -0.18 0.00 7.02 0.15 -1.26 -5.09 113.70 116.95 1wz0 s SER 6 Ca -0.07 0.19 0.00 0.00 0.70 0.00 0.00 55.95 56.77 1wz0 s SER 6 Cb -0.10 0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.35 1wz0 s SER 6 CO -0.19 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 174.70 1wz0 n GLY 7 N 0.60 -0.27 2.75 9.45 0.00 -1.26 -5.13 105.19 111.33 1wz0 n GLY 7 Ca -0.04 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 1wz0 n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1wz0 s MET 8 N 0.00 0.92 0.05 1.61 0.00 -1.26 -5.10 119.30 115.52 1wz0 s MET 8 Ca 0.00 -1.38 -0.27 0.00 0.00 0.00 0.00 55.69 54.04 1wz0 s MET 8 Cb 0.00 -2.17 0.09 0.00 0.00 0.00 0.00 34.83 32.75 1wz0 s MET 8 CO 0.00 -1.03 0.87 0.00 0.00 0.00 0.00 175.02 174.86 1wz0 s ALA 9 N 1.23 -1.76 -0.57 3.16 0.00 -1.26 -5.12 121.76 117.44 1wz0 s ALA 9 Ca 0.12 0.78 -0.26 0.00 0.00 0.00 0.00 51.96 52.60 1wz0 s ALA 9 Cb -0.19 0.51 0.04 0.00 0.00 0.00 0.00 23.12 23.48 1wz0 s ALA 9 CO -0.17 -0.77 1.05 0.34 0.00 0.00 0.00 175.76 176.21 1wz0 s ASP 10 N -2.60 6.37 -0.59 0.00 -1.08 -1.26 -4.89 116.67 112.61 1wz0 s ASP 10 Ca 0.06 -0.20 0.00 0.00 -0.52 0.00 0.00 52.55 51.89 1wz0 s ASP 10 Cb -0.01 -2.48 0.45 0.00 -1.46 0.00 0.00 42.92 39.41 1wz0 s ASP 10 CO -0.07 -1.35 1.85 -0.62 0.52 0.00 0.00 175.17 175.49 1wz0 n GLU 11 N 7.91 2.90 -3.02 4.34 4.71 -1.26 -4.86 120.64 131.36 1wz0 n GLU 11 Ca 0.04 -3.50 -0.12 0.00 -0.01 0.00 0.00 57.16 53.57 1wz0 n GLU 11 Cb 0.48 -2.29 0.06 0.00 -1.01 0.00 0.00 31.44 28.69 1wz0 n GLU 11 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 1wz0 n LYS 12 N -0.86 -4.59 -1.13 3.49 4.81 -1.26 -5.01 118.16 113.61 1wz0 n LYS 12 Ca 0.58 0.61 -0.29 0.00 -0.87 0.00 0.00 58.31 58.35 1wz0 n LYS 12 Cb 0.71 -4.91 0.20 0.00 0.02 0.00 0.00 35.03 31.05 1wz0 n LYS 12 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1wz0 s PRO 13 N -4.92 -0.18 -1.63 1.64 0.04 -1.26 -3.74 135.00 124.94 1wz0 s PRO 13 Ca 0.02 0.31 -0.20 0.00 0.04 0.00 0.00 61.00 61.16 1wz0 s PRO 13 Cb -0.00 -1.68 0.20 0.00 0.04 0.00 0.00 34.50 33.05 1wz0 s PRO 13 CO 0.53 -3.10 0.55 1.17 0.04 0.00 0.00 177.00 176.19 1wz0 n LYS 14 N -4.39 -1.31 -4.44 4.56 4.81 -1.26 -4.90 118.16 111.23 1wz0 n LYS 14 Ca 0.08 0.16 -0.32 0.00 -0.87 0.00 0.00 58.31 57.35 1wz0 n LYS 14 Cb 0.58 -4.75 -0.16 0.00 0.02 0.00 0.00 35.03 30.72 1wz0 n LYS 14 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 1wz0 s GLU 15 N -6.92 2.85 0.00 1.64 -6.30 -1.25 -5.04 118.70 103.68 1wz0 s GLU 15 Ca 0.72 -0.79 0.00 0.00 -2.50 0.00 0.00 54.97 52.40 1wz0 s GLU 15 Cb -0.42 -2.38 0.00 0.00 0.00 0.00 0.00 34.13 31.34 1wz0 s GLU 15 CO 0.88 -0.09 0.00 0.41 0.02 0.00 0.00 175.26 176.48 1wz0 n GLY 16 N 4.30 3.59 3.85 -1.50 0.00 -1.26 -5.14 105.19 109.02 1wz0 n GLY 16 Ca -0.20 -0.53 -0.32 0.00 0.00 0.00 0.00 46.02 44.97 1wz0 n GLY 16 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1wz0 s VAL 17 N 0.00 4.60 -0.71 1.61 -7.23 -1.26 -5.03 120.40 112.37 1wz0 s VAL 17 Ca 0.00 1.08 -0.06 0.00 -1.81 0.00 0.00 61.98 61.19 1wz0 s VAL 17 Cb 0.00 -3.65 0.18 0.00 0.56 0.00 0.00 36.38 33.47 1wz0 s VAL 17 CO 0.00 -0.38 0.56 -0.54 -0.31 0.00 0.00 175.10 174.43 1wz0 s LYS 18 N -3.41 2.93 -0.08 4.82 -0.14 -1.26 -5.02 119.74 117.59 1wz0 s LYS 18 Ca 0.57 -2.57 -0.03 0.00 -1.36 0.00 0.00 55.97 52.58 1wz0 s LYS 18 Cb -0.10 -3.96 0.04 0.00 -1.68 0.00 0.00 37.83 32.13 1wz0 s LYS 18 CO 0.22 -1.21 0.07 0.95 -0.76 0.00 0.00 175.35 174.62 1wz0 s THR 19 N -0.09 -0.12 -0.46 2.17 -4.23 -1.26 -5.10 115.64 106.56 1wz0 s THR 19 Ca 0.18 0.27 0.03 0.00 -1.18 0.00 0.00 61.69 60.99 1wz0 s THR 19 Cb -0.16 -0.27 0.13 0.00 1.34 0.00 0.00 72.50 73.54 1wz0 s THR 19 CO -0.05 0.06 0.23 -0.70 -0.54 0.00 0.00 174.62 173.62 1wz0 s GLU 20 N 2.17 1.54 -0.18 3.99 2.12 -1.26 -4.95 118.70 122.14 1wz0 s GLU 20 Ca 0.04 -2.20 -0.15 0.00 0.36 0.00 0.00 54.97 53.02 1wz0 s GLU 20 Cb -0.13 -2.75 -0.11 0.00 0.26 0.00 0.00 34.13 31.40 1wz0 s GLU 20 CO -0.05 -1.12 0.00 0.09 -0.54 0.00 0.00 175.26 173.64 1wz0 n ASN 21 N 3.47 1.84 -4.92 -1.70 3.02 -1.26 -4.99 115.26 110.72 1wz0 n ASN 21 Ca 0.06 0.52 -0.20 0.00 -0.03 0.00 0.00 54.58 54.94 1wz0 n ASN 21 Cb 0.34 -0.91 -0.02 0.00 -0.61 0.00 0.00 39.78 38.58 1wz0 n ASN 21 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1wz0 s ASN 22 N -6.32 5.40 -0.04 6.41 3.84 -1.26 -5.09 114.94 117.87 1wz0 s ASN 22 Ca -0.22 -0.52 -0.28 0.00 0.21 0.00 0.00 52.86 52.05 1wz0 s ASN 22 Cb 0.04 -0.80 -0.03 0.00 -0.55 0.00 0.00 41.25 39.91 1wz0 s ASN 22 CO 0.41 -0.56 0.88 -1.81 -2.79 0.00 0.00 177.10 173.23 1wz0 s ASP 23 N -4.15 7.21 0.42 -4.21 1.01 -1.26 -5.06 116.67 110.63 1wz0 s ASP 23 Ca 0.47 1.46 0.07 0.00 0.71 0.00 0.00 52.55 55.27 1wz0 s ASP 23 Cb -0.06 -2.51 -0.03 0.00 1.01 0.00 0.00 42.92 41.33 1wz0 s ASP 23 CO 0.29 -0.24 0.32 -1.00 0.21 0.00 0.00 175.17 174.75 1wz0 s HIS 24 N 1.11 2.63 0.05 4.23 3.76 -1.26 -4.64 115.29 121.17 1wz0 s HIS 24 Ca 0.46 -0.54 0.08 0.00 -0.15 0.00 0.00 55.06 54.91 1wz0 s HIS 24 Cb -0.19 -2.10 -0.03 0.00 1.11 0.00 0.00 32.58 31.37 1wz0 s HIS 24 CO 0.23 -0.04 -0.21 0.96 -0.85 0.00 0.00 174.74 174.83 1wz0 s ILE 25 N -2.53 1.73 -0.14 0.60 -4.36 -1.05 -4.99 121.20 110.47 1wz0 s ILE 25 Ca 0.45 -1.25 -0.02 0.00 -0.26 0.00 0.00 60.65 59.57 1wz0 s ILE 25 Cb -0.01 -1.51 -0.02 0.00 1.25 0.00 0.00 42.46 42.17 1wz0 s ILE 25 CO 0.26 0.20 -0.08 0.20 0.24 0.00 0.00 174.94 175.76 1wz0 s ASN 26 N -1.25 4.44 -0.12 4.36 0.01 -1.26 -2.91 114.94 118.22 1wz0 s ASN 26 Ca 0.08 -0.21 0.02 0.00 -0.71 0.00 0.00 52.86 52.04 1wz0 s ASN 26 Cb -0.09 -1.67 -0.01 0.00 0.41 0.00 0.00 41.25 39.89 1wz0 s ASN 26 CO 0.02 0.18 -0.18 -0.76 -1.51 0.00 0.00 177.10 174.85 1wz0 s LEU 27 N 0.29 2.42 -0.42 0.60 1.43 -0.98 -2.67 118.68 119.35 1wz0 s LEU 27 Ca -0.06 -0.44 -0.21 0.00 -1.03 0.00 0.00 54.13 52.39 1wz0 s LEU 27 Cb -0.15 -1.52 0.02 0.00 0.03 0.00 0.00 46.19 44.57 1wz0 s LEU 27 CO 0.04 0.16 0.66 -0.54 0.23 0.00 0.00 176.35 176.91 1wz0 s LYS 28 N 0.36 3.42 -0.21 1.70 1.02 -0.23 -2.55 119.74 123.26 1wz0 s LYS 28 Ca -0.14 -0.20 -0.20 0.00 0.02 0.00 0.00 55.97 55.45 1wz0 s LYS 28 Cb -0.17 -3.91 -0.03 0.00 -0.52 0.00 0.00 37.83 33.21 1wz0 s LYS 28 CO 0.07 -0.94 0.58 0.08 -0.92 0.00 0.00 175.35 174.22 1wz0 s VAL 29 N 2.87 5.05 -0.12 3.17 1.01 0.43 0.29 120.40 133.10 1wz0 s VAL 29 Ca 0.24 1.08 -0.03 0.00 0.00 0.00 0.00 61.98 63.27 1wz0 s VAL 29 Cb -0.14 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.31 1wz0 s VAL 29 CO 0.18 0.13 0.01 0.00 0.00 0.00 0.00 175.10 175.43 1wz0 s ALA 30 N 1.87 3.30 0.29 5.51 0.00 -0.73 -2.24 121.76 129.76 1wz0 s ALA 30 Ca 0.26 -0.79 -0.08 0.00 0.00 0.00 0.00 51.96 51.36 1wz0 s ALA 30 Cb -0.16 -1.60 -0.00 0.00 0.00 0.00 0.00 23.12 21.36 1wz0 s ALA 30 CO 0.10 0.46 0.46 0.20 0.00 0.00 0.00 175.76 176.98 1wz0 s GLY 31 N -0.46 1.00 -0.18 0.00 0.00 -1.26 -2.91 107.32 103.52 1wz0 s GLY 31 Ca 0.09 -1.21 -0.04 0.00 0.00 0.00 0.00 44.72 43.55 1wz0 s GLY 31 CO 0.02 -0.83 3.06 0.61 0.00 0.00 0.00 173.10 175.96 1wz0 n GLN 32 N -0.46 2.02 -0.05 2.90 10.64 -1.26 -3.92 117.38 127.26 1wz0 n GLN 32 Ca -0.01 -1.40 -0.06 0.00 -1.83 0.00 0.00 57.00 53.71 1wz0 n GLN 32 Cb 0.62 -1.92 -0.04 0.00 -0.86 0.00 0.00 30.24 28.04 1wz0 n GLN 32 CO 0.00 0.00 0.00 -0.40 -1.83 0.00 0.00 177.06 174.83 1wz0 n ASP 33 N 1.69 3.26 0.00 2.61 5.75 -1.26 -4.88 116.55 123.72 1wz0 n ASP 33 Ca 0.40 -0.04 0.00 0.00 -0.01 0.00 0.00 54.79 55.13 1wz0 n ASP 33 Cb 0.73 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.76 1wz0 n ASP 33 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1wz0 n GLY 34 N 3.00 1.72 3.49 6.12 0.00 -1.25 -5.11 105.19 113.15 1wz0 n GLY 34 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1wz0 n GLY 34 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wz0 s SER 35 N -2.00 -0.51 -0.08 1.61 0.15 -1.26 -5.14 113.70 106.46 1wz0 s SER 35 Ca 0.00 0.75 -0.30 0.00 0.70 0.00 0.00 55.95 57.10 1wz0 s SER 35 Cb 0.00 1.45 -0.02 0.00 -1.71 0.00 0.00 66.02 65.74 1wz0 s SER 35 CO 0.00 -0.11 1.12 -0.69 1.20 0.00 0.00 173.24 174.76 1wz0 s VAL 36 N 1.98 4.47 -0.23 4.45 1.01 -1.26 -4.70 120.40 126.12 1wz0 s VAL 36 Ca -0.05 1.77 -0.07 0.00 0.00 0.00 0.00 61.98 63.63 1wz0 s VAL 36 Cb -0.05 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 1wz0 s VAL 36 CO -0.16 -0.01 0.06 -0.69 0.00 0.00 0.00 175.10 174.30 1wz0 s VAL 37 N 2.20 4.35 0.27 2.92 1.01 -0.95 -4.93 120.40 125.28 1wz0 s VAL 37 Ca 0.53 -0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.38 1wz0 s VAL 37 Cb -0.22 -3.01 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 1wz0 s VAL 37 CO 0.20 0.38 0.40 -1.10 0.00 0.00 0.00 175.10 174.98 1wz0 s GLN 38 N 1.23 3.39 -0.12 2.72 -0.21 -1.26 -0.43 119.66 124.99 1wz0 s GLN 38 Ca 0.04 -0.75 -0.08 0.00 0.02 0.00 0.00 55.36 54.60 1wz0 s GLN 38 Cb -0.14 -2.85 0.04 0.00 1.00 0.00 0.00 33.01 31.06 1wz0 s GLN 38 CO 0.03 0.34 0.30 -0.06 -2.12 0.00 0.00 175.29 173.78 1wz0 s PHE 39 N -2.05 -0.40 -0.31 0.91 0.40 -1.06 -4.96 117.98 110.51 1wz0 s PHE 39 Ca 0.36 0.92 -0.05 0.00 -0.60 0.00 0.00 56.93 57.56 1wz0 s PHE 39 Cb -0.09 0.12 0.03 0.00 0.51 0.00 0.00 43.02 43.59 1wz0 s PHE 39 CO 0.30 -0.24 0.05 0.21 0.70 0.00 0.00 175.22 176.25 1wz0 s LYS 40 N 0.96 2.73 0.37 0.44 2.20 -1.26 -2.32 119.74 122.86 1wz0 s LYS 40 Ca -0.07 -1.09 0.04 0.00 -0.36 0.00 0.00 55.97 54.50 1wz0 s LYS 40 Cb -0.07 -3.31 -0.03 0.00 -1.51 0.00 0.00 37.83 32.90 1wz0 s LYS 40 CO -0.07 -0.56 0.16 0.96 -0.36 0.00 0.00 175.35 175.48 1wz0 s ILE 41 N 1.39 0.43 0.33 5.43 -4.36 -1.14 -4.98 121.20 118.30 1wz0 s ILE 41 Ca -0.01 -2.00 -0.06 0.00 -0.26 0.00 0.00 60.65 58.32 1wz0 s ILE 41 Cb -0.19 -2.43 -0.05 0.00 1.25 0.00 0.00 42.46 41.04 1wz0 s ILE 41 CO 0.01 0.00 0.62 -0.54 0.24 0.00 0.00 174.94 175.27 1wz0 s LYS 42 N -3.69 3.65 0.45 0.37 1.02 -1.26 -2.53 119.74 117.75 1wz0 s LYS 42 Ca 0.30 0.10 0.17 0.00 0.02 0.00 0.00 55.97 56.57 1wz0 s LYS 42 Cb 0.03 -2.57 1.05 0.00 -0.52 0.00 0.00 37.83 35.82 1wz0 s LYS 42 CO 0.18 0.12 1.97 0.07 -0.92 0.00 0.00 175.35 176.77 1wz0 h ARG 43 N 1.41 0.00 -0.01 1.68 0.11 -1.96 -1.70 114.38 113.91 1wz0 h ARG 43 Ca -0.48 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.60 1wz0 h ARG 43 Cb 1.19 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.27 1wz0 h ARG 43 CO 0.65 0.21 -0.41 -2.39 0.10 0.00 0.00 179.97 178.13 1wz0 n HIS 44 N -4.10 0.00 -2.90 4.08 1.44 -1.26 -2.57 115.22 109.91 1wz0 n HIS 44 Ca -0.02 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.28 1wz0 n HIS 44 Cb 0.28 -0.08 -0.04 0.00 0.12 0.00 0.00 29.99 30.27 1wz0 n HIS 44 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 1wz0 s THR 45 N -2.57 4.97 0.19 0.61 2.01 -0.64 -4.96 115.64 115.25 1wz0 s THR 45 Ca 0.20 1.71 -0.30 0.00 0.31 0.00 0.00 61.69 63.61 1wz0 s THR 45 Cb 0.18 -4.16 -0.09 0.00 0.01 0.00 0.00 72.50 68.45 1wz0 s THR 45 CO 0.58 0.20 1.31 -2.16 -0.69 0.00 0.00 174.62 173.85 1wz0 s PRO 46 N 0.96 4.39 0.60 4.92 0.04 -1.26 -3.99 135.00 140.66 1wz0 s PRO 46 Ca 0.44 2.04 0.29 0.00 0.04 0.00 0.00 61.00 63.80 1wz0 s PRO 46 Cb -0.19 -3.20 1.27 0.00 0.04 0.00 0.00 34.50 32.42 1wz0 s PRO 46 CO 0.22 -0.25 1.66 -0.07 0.04 0.00 0.00 177.00 178.59 1wz0 h LEU 47 N 5.45 0.00 -0.72 -3.56 3.38 -1.39 -2.42 115.31 116.04 1wz0 h LEU 47 Ca -0.45 0.00 0.11 0.00 0.09 0.00 0.00 57.88 57.63 1wz0 h LEU 47 Cb 1.21 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.85 1wz0 h LEU 47 CO 0.78 0.00 -0.30 -1.54 0.09 0.00 0.00 178.44 177.47 1wz0 n SER 48 N -3.51 -0.50 -0.35 -0.43 3.41 -0.93 0.23 113.62 111.54 1wz0 n SER 48 Ca 0.15 1.27 -0.03 0.00 -0.26 0.00 0.00 58.87 59.99 1wz0 n SER 48 Cb 1.03 -0.28 0.10 0.00 -0.26 0.00 0.00 64.21 64.80 1wz0 n SER 48 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1wz0 h LYS 49 N 0.00 1.28 0.61 4.33 1.57 -1.76 -1.17 116.57 121.43 1wz0 h LYS 49 Ca 0.24 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.88 1wz0 h LYS 49 Cb 0.42 -0.27 0.01 0.00 0.08 0.00 0.00 32.23 32.47 1wz0 h LYS 49 CO -0.72 0.89 -0.30 1.25 -0.57 0.00 0.00 179.45 180.01 1wz0 h LEU 50 N 1.30 -0.70 -0.35 2.94 5.85 0.28 -1.66 115.31 122.97 1wz0 h LEU 50 Ca 0.34 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 59.11 1wz0 h LEU 50 Cb -0.06 0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.08 1wz0 h LEU 50 CO -0.06 -0.43 -0.05 0.24 -0.34 0.00 0.00 178.44 177.80 1wz0 h MET 51 N -0.94 0.04 -0.43 1.25 2.86 -0.52 -0.90 114.93 116.29 1wz0 h MET 51 Ca -0.08 -0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.63 1wz0 h MET 51 Cb 0.67 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.25 1wz0 h MET 51 CO 0.14 0.03 -0.00 0.87 1.06 0.00 0.00 176.91 179.00 1wz0 h LYS 52 N 0.04 0.10 0.00 1.72 1.57 -1.17 0.91 116.57 119.74 1wz0 h LYS 52 Ca 0.17 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.92 1wz0 h LYS 52 Cb 0.25 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.53 1wz0 h LYS 52 CO -0.33 0.07 -0.11 0.00 -0.57 0.00 0.00 179.45 178.51 1wz0 h ALA 53 N 1.38 1.56 -0.06 3.86 0.00 -0.58 -1.50 119.26 123.93 1wz0 h ALA 53 Ca 0.21 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 54.85 1wz0 h ALA 53 Cb 0.31 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1wz0 h ALA 53 CO -0.36 0.14 -0.70 -0.92 0.00 0.00 0.00 179.25 177.41 1wz0 h TYR 54 N 0.00 0.38 0.04 0.00 3.20 0.50 -1.59 116.97 119.49 1wz0 h TYR 54 Ca -0.00 -0.16 -0.20 0.00 3.14 0.00 0.00 58.73 61.51 1wz0 h TYR 54 Cb 0.24 -0.06 0.02 0.00 1.54 0.00 0.00 36.73 38.47 1wz0 h TYR 54 CO 0.00 0.89 -0.79 0.00 -1.64 0.00 0.00 178.16 176.62 1wz0 h GLU 56 N -0.03 0.86 -0.50 0.00 4.11 -1.35 0.62 114.58 118.30 1wz0 h GLU 56 Ca -0.11 -0.29 0.08 0.00 0.07 0.00 0.00 59.36 59.11 1wz0 h GLU 56 Cb 1.51 -0.07 -0.10 0.00 0.50 0.00 0.00 28.75 30.59 1wz0 h GLU 56 CO 0.15 0.92 -0.39 -0.09 0.07 0.00 0.00 179.01 179.67 1wz0 h ARG 57 N 0.71 -0.24 0.00 1.06 2.43 -1.38 -3.15 114.38 113.81 1wz0 h ARG 57 Ca 0.13 0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.25 1wz0 h ARG 57 Cb 0.55 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 1wz0 h ARG 57 CO 0.03 -0.16 -0.41 1.96 -1.51 0.00 0.00 179.97 179.88 1wz0 h GLN 58 N -0.25 0.00 0.00 0.20 1.08 -1.62 -3.49 115.11 111.03 1wz0 h GLN 58 Ca 0.18 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.38 1wz0 h GLN 58 Cb 0.56 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.99 1wz0 h GLN 58 CO -0.63 0.64 0.00 0.41 -0.95 0.00 0.00 178.83 178.30 1wz0 n GLY 59 N 1.60 1.24 3.91 3.46 0.00 0.20 -5.12 105.19 110.48 1wz0 n GLY 59 Ca -0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.63 1wz0 n GLY 59 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wz0 s LEU 60 N 0.00 2.80 0.04 0.99 1.43 -0.32 -5.00 118.68 118.61 1wz0 s LEU 60 Ca 0.00 -1.17 0.00 0.00 -1.03 0.00 0.00 54.13 51.93 1wz0 s LEU 60 Cb 0.00 -1.30 -0.04 0.00 0.03 0.00 0.00 46.19 44.88 1wz0 s LEU 60 CO 0.00 -1.08 0.13 -0.55 0.23 0.00 0.00 176.35 175.09 1wz0 s SER 61 N -4.29 5.94 0.13 2.29 0.15 -1.26 -4.53 113.70 112.14 1wz0 s SER 61 Ca 0.38 0.17 -0.25 0.00 0.70 0.00 0.00 55.95 56.95 1wz0 s SER 61 Cb -0.02 -1.74 -0.02 0.00 -1.71 0.00 0.00 66.02 62.52 1wz0 s SER 61 CO 0.23 0.22 1.63 0.24 1.20 0.00 0.00 173.24 176.76 1wz0 h MET 62 N 3.55 -0.34 -0.72 5.44 2.86 -1.95 -1.75 114.93 122.03 1wz0 h MET 62 Ca -0.47 0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.20 1wz0 h MET 62 Cb 1.17 0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.87 1wz0 h MET 62 CO 0.68 -0.22 0.47 0.07 1.06 0.00 0.00 176.91 178.97 1wz0 h ARG 63 N -0.35 0.94 -0.84 1.72 0.11 -2.03 -2.43 114.38 111.50 1wz0 h ARG 63 Ca 0.09 -0.06 0.15 0.00 0.10 0.00 0.00 59.98 60.26 1wz0 h ARG 63 Cb 0.49 -0.21 -0.10 0.00 1.11 0.00 0.00 29.97 31.26 1wz0 h ARG 63 CO -0.30 0.62 0.42 1.96 0.10 0.00 0.00 179.97 182.77 1wz0 h GLN 64 N 0.97 0.57 -6.36 0.08 4.20 -1.78 -3.42 115.11 109.37 1wz0 h GLN 64 Ca 0.26 -0.03 -0.47 0.00 0.06 0.00 0.00 58.65 58.47 1wz0 h GLN 64 Cb -0.10 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.55 1wz0 h GLN 64 CO -0.06 0.38 -0.26 0.96 -0.67 0.00 0.00 178.83 179.18 1wz0 s ILE 65 N -5.97 2.58 0.01 2.54 -4.36 -0.73 -4.75 121.20 110.51 1wz0 s ILE 65 Ca -0.12 -1.15 -0.04 0.00 -0.26 0.00 0.00 60.65 59.09 1wz0 s ILE 65 Cb 0.22 -2.73 -0.01 0.00 1.25 0.00 0.00 42.46 41.19 1wz0 s ILE 65 CO 0.78 0.00 0.06 -0.13 0.24 0.00 0.00 174.94 175.88 1wz0 s ARG 66 N -4.35 0.36 0.11 0.37 1.81 -1.26 -4.84 118.95 111.14 1wz0 s ARG 66 Ca 0.52 -0.43 0.08 0.00 -1.72 0.00 0.00 55.73 54.19 1wz0 s ARG 66 Cb -0.06 0.14 -0.04 0.00 -0.45 0.00 0.00 34.95 34.54 1wz0 s ARG 66 CO 0.32 -0.07 -0.16 -0.06 -0.68 0.00 0.00 175.30 174.64 1wz0 s PHE 67 N -1.24 2.59 -0.03 -0.53 0.40 -1.26 -3.27 117.98 114.65 1wz0 s PHE 67 Ca -0.13 -0.23 -0.19 0.00 -0.60 0.00 0.00 56.93 55.77 1wz0 s PHE 67 Cb -0.08 -1.38 0.04 0.00 0.51 0.00 0.00 43.02 42.11 1wz0 s PHE 67 CO 0.00 0.39 0.42 1.03 0.70 0.00 0.00 175.22 177.75 1wz0 s ARG 68 N -2.09 0.78 -0.17 0.44 0.52 0.16 -3.50 118.95 115.09 1wz0 s ARG 68 Ca 0.19 -0.06 -0.01 0.00 -0.52 0.00 0.00 55.73 55.33 1wz0 s ARG 68 Cb -0.11 0.35 0.04 0.00 0.52 0.00 0.00 34.95 35.76 1wz0 s ARG 68 CO 0.11 -0.22 -0.04 0.12 0.02 0.00 0.00 175.30 175.28 1wz0 s PHE 69 N -1.28 1.63 -1.73 -0.53 5.36 0.25 -0.12 117.98 121.56 1wz0 s PHE 69 Ca -0.13 -1.07 0.00 0.00 -0.96 0.00 0.00 56.93 54.77 1wz0 s PHE 69 Cb -0.04 -1.28 0.00 0.00 -0.34 0.00 0.00 43.02 41.36 1wz0 s PHE 69 CO 0.06 -0.62 0.00 -0.25 -1.46 0.00 0.00 175.22 172.95 1wz0 n ASP 70 N 4.89 -5.43 -0.13 6.13 8.00 -1.26 -2.07 116.55 126.68 1wz0 n ASP 70 Ca -0.11 0.11 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1wz0 n ASP 70 Cb 0.47 -4.51 0.00 0.00 -0.02 0.00 0.00 41.12 37.06 1wz0 n ASP 70 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wz0 n GLY 71 N -0.92 0.73 2.95 0.44 0.00 -1.26 -5.07 105.19 102.06 1wz0 n GLY 71 Ca -0.22 -0.70 -0.13 0.00 0.00 0.00 0.00 46.02 44.97 1wz0 n GLY 71 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1wz0 s GLN 72 N -3.77 0.30 -0.09 1.61 -2.07 -0.88 -5.12 119.66 109.64 1wz0 s GLN 72 Ca 0.00 -0.30 -0.30 0.00 -1.82 0.00 0.00 55.36 52.94 1wz0 s GLN 72 Cb 0.00 -0.18 -0.04 0.00 -1.09 0.00 0.00 33.01 31.70 1wz0 s GLN 72 CO 0.00 0.04 1.52 -1.25 -1.32 0.00 0.00 175.29 174.28 1wz0 s PRO 73 N -0.57 4.20 0.03 9.60 0.04 -1.26 -0.58 135.00 146.46 1wz0 s PRO 73 Ca -0.04 2.01 0.02 0.00 0.04 0.00 0.00 61.00 63.03 1wz0 s PRO 73 Cb -0.04 -3.89 -0.04 0.00 0.04 0.00 0.00 34.50 30.57 1wz0 s PRO 73 CO -0.00 -0.79 0.02 0.96 0.04 0.00 0.00 177.00 177.23 1wz0 s ILE 74 N 3.78 4.26 -0.08 0.56 -4.36 -1.23 -4.93 121.20 119.21 1wz0 s ILE 74 Ca 0.67 -0.67 0.03 0.00 -0.26 0.00 0.00 60.65 60.41 1wz0 s ILE 74 Cb -0.29 -2.95 -0.02 0.00 1.25 0.00 0.00 42.46 40.44 1wz0 s ILE 74 CO 0.25 0.29 -0.15 0.20 0.24 0.00 0.00 174.94 175.76 1wz0 s ASN 75 N -1.84 3.90 0.31 4.36 0.01 -1.26 -4.79 114.94 115.64 1wz0 s ASN 75 Ca 0.22 -0.28 0.06 0.00 -0.71 0.00 0.00 52.86 52.16 1wz0 s ASN 75 Cb -0.12 -1.10 0.86 0.00 0.41 0.00 0.00 41.25 41.31 1wz0 s ASN 75 CO 0.14 0.27 1.61 1.05 -1.51 0.00 0.00 177.10 178.66 1wz0 h GLU 76 N 5.89 0.09 -0.51 -0.60 4.11 -1.96 0.40 114.58 122.00 1wz0 h GLU 76 Ca -0.38 -0.01 0.09 0.00 0.07 0.00 0.00 59.36 59.14 1wz0 h GLU 76 Cb 1.18 -0.02 -0.08 0.00 0.50 0.00 0.00 28.75 30.33 1wz0 h GLU 76 CO 0.52 0.06 0.07 1.79 0.07 0.00 0.00 179.01 181.52 1wz0 h THR 77 N 0.10 0.67 -3.46 -1.06 1.35 -1.95 -2.43 112.91 106.13 1wz0 h THR 77 Ca 0.63 -0.07 -0.53 0.00 -0.55 0.00 0.00 66.41 65.89 1wz0 h THR 77 Cb 1.40 0.46 0.21 0.00 -1.73 0.00 0.00 68.15 68.49 1wz0 h THR 77 CO -0.78 0.04 -0.48 0.47 -0.25 0.00 0.00 175.52 174.51 1wz0 n ASP 78 N -5.15 -1.77 -4.60 5.36 8.00 0.14 -4.74 116.55 113.79 1wz0 n ASP 78 Ca 0.06 0.37 -0.24 0.00 0.71 0.00 0.00 54.79 55.69 1wz0 n ASP 78 Cb 0.26 -1.23 -0.08 0.00 -0.02 0.00 0.00 41.12 40.05 1wz0 n ASP 78 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1wz0 s THR 79 N -2.35 3.21 -0.44 -3.53 -4.23 -1.26 -2.79 115.64 104.24 1wz0 s THR 79 Ca 0.59 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 59.33 1wz0 s THR 79 Cb -0.23 -2.70 0.26 0.00 1.34 0.00 0.00 72.50 71.17 1wz0 s THR 79 CO 0.65 -0.36 1.73 -0.81 -0.54 0.00 0.00 174.62 175.29 1wz0 n PRO 80 N -0.75 0.21 0.03 3.99 -0.04 -1.25 -2.50 135.00 134.68 1wz0 n PRO 80 Ca -0.06 0.44 -0.07 0.00 -0.04 0.00 0.00 63.50 63.76 1wz0 n PRO 80 Cb 0.59 -1.90 -0.12 0.00 -0.04 0.00 0.00 33.50 32.03 1wz0 n PRO 80 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wz0 h ALA 81 N 2.25 0.55 -0.16 0.55 0.00 -1.83 0.34 119.26 120.96 1wz0 h ALA 81 Ca 0.00 -1.14 -0.10 0.00 0.00 0.00 0.00 54.91 53.67 1wz0 h ALA 81 Cb 0.36 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1wz0 h ALA 81 CO 0.00 1.37 -0.33 0.37 0.00 0.00 0.00 179.25 180.66 1wz0 h GLN 82 N 0.00 0.31 -0.68 0.00 5.75 -1.78 -2.55 115.11 116.17 1wz0 h GLN 82 Ca -0.13 -0.13 -0.05 0.00 -0.15 0.00 0.00 58.65 58.19 1wz0 h GLN 82 Cb 1.86 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 30.37 1wz0 h GLN 82 CO 0.10 0.61 0.06 1.28 -2.65 0.00 0.00 178.83 178.24 1wz0 n LEU 83 N -4.08 5.21 -4.25 -2.39 4.77 -1.23 -4.92 117.00 110.10 1wz0 n LEU 83 Ca -0.01 -2.66 -0.32 0.00 -0.03 0.00 0.00 56.01 52.98 1wz0 n LEU 83 Cb 0.43 -0.68 -0.07 0.00 -2.33 0.00 0.00 43.42 40.78 1wz0 n LEU 83 CO 0.41 0.62 -0.30 -1.84 -1.33 0.00 0.00 177.39 174.95 1wz0 n GLU 84 N 0.38 -1.80 -1.97 3.23 0.28 -0.96 -4.78 120.64 115.02 1wz0 n GLU 84 Ca 0.27 0.22 -0.39 0.00 -0.16 0.00 0.00 57.16 57.09 1wz0 n GLU 84 Cb 1.12 -4.23 -0.03 0.00 1.43 0.00 0.00 31.44 29.73 1wz0 n GLU 84 CO 0.00 0.00 0.00 -1.64 -0.16 0.00 0.00 177.13 175.33 1wz0 s MET 85 N -7.09 2.74 0.57 3.44 -1.94 0.11 -4.97 119.30 112.16 1wz0 s MET 85 Ca 0.25 0.91 -0.08 0.00 -1.71 0.00 0.00 55.69 55.06 1wz0 s MET 85 Cb -0.14 -4.36 -0.02 0.00 2.01 0.00 0.00 34.83 32.31 1wz0 s MET 85 CO 0.97 -2.58 0.92 -1.83 -0.01 0.00 0.00 175.02 172.49 1wz0 s GLU 86 N 6.84 3.36 0.79 2.03 -1.05 -1.26 -4.89 118.70 124.52 1wz0 s GLU 86 Ca 0.74 0.35 -0.14 0.00 -0.15 0.00 0.00 54.97 55.77 1wz0 s GLU 86 Cb -0.16 -2.23 0.06 0.00 -0.44 0.00 0.00 34.13 31.37 1wz0 s GLU 86 CO 0.25 -0.51 1.09 -3.47 0.95 0.00 0.00 175.26 173.57 1wz0 n ASP 87 N -2.56 0.71 -2.35 0.83 2.03 -1.26 -2.90 116.55 111.06 1wz0 n ASP 87 Ca 0.04 0.59 -0.19 0.00 0.52 0.00 0.00 54.79 55.75 1wz0 n ASP 87 Cb 0.55 -1.46 0.01 0.00 -0.72 0.00 0.00 41.12 39.50 1wz0 n ASP 87 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1wz0 n GLU 88 N -2.80 -2.78 -1.27 -0.67 1.02 -1.09 -4.98 120.64 108.07 1wz0 n GLU 88 Ca 0.13 0.84 -0.20 0.00 -0.02 0.00 0.00 57.16 57.91 1wz0 n GLU 88 Cb 0.50 -5.41 0.14 0.00 -0.02 0.00 0.00 31.44 26.66 1wz0 n GLU 88 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1wz0 n ASP 89 N -1.71 0.01 -3.74 1.62 9.92 -1.11 -4.88 116.55 116.65 1wz0 n ASP 89 Ca -0.16 -1.31 -0.14 0.00 -0.53 0.00 0.00 54.79 52.65 1wz0 n ASP 89 Cb 0.64 -0.69 -0.15 0.00 -0.64 0.00 0.00 41.12 40.28 1wz0 n ASP 89 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1wz0 s THR 90 N -2.96 -0.06 0.03 -3.53 2.01 -1.26 -1.07 115.64 108.80 1wz0 s THR 90 Ca 0.51 0.19 -0.01 0.00 0.31 0.00 0.00 61.69 62.69 1wz0 s THR 90 Cb -0.01 -0.24 -0.04 0.00 0.01 0.00 0.00 72.50 72.22 1wz0 s THR 90 CO 0.36 0.08 0.18 -0.63 -0.69 0.00 0.00 174.62 173.91 1wz0 s ILE 91 N 1.22 5.27 -0.24 1.82 1.01 0.15 -4.58 121.20 125.86 1wz0 s ILE 91 Ca -0.09 -0.33 -0.07 0.00 0.00 0.00 0.00 60.65 60.17 1wz0 s ILE 91 Cb -0.12 -3.51 -0.03 0.00 0.01 0.00 0.00 42.46 38.82 1wz0 s ILE 91 CO -0.06 0.23 0.05 -1.81 0.00 0.00 0.00 174.94 173.35 1wz0 s ASP 92 N -2.19 5.01 0.02 3.58 1.11 0.83 -1.78 116.67 123.25 1wz0 s ASP 92 Ca 0.30 -0.22 -0.05 0.00 0.18 0.00 0.00 52.55 52.77 1wz0 s ASP 92 Cb -0.13 -1.89 -0.01 0.00 1.07 0.00 0.00 42.92 41.96 1wz0 s ASP 92 CO 0.22 -0.01 0.08 -0.69 1.18 0.00 0.00 175.17 175.94 1wz0 s VAL 93 N 1.48 0.12 -0.25 -1.27 1.01 -1.15 0.38 120.40 120.72 1wz0 s VAL 93 Ca 0.06 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 61.10 1wz0 s VAL 93 Cb -0.15 -0.64 0.06 0.00 0.00 0.00 0.00 36.38 35.65 1wz0 s VAL 93 CO 0.02 -0.53 -0.11 -0.36 0.00 0.00 0.00 175.10 174.13 1wz0 s PHE 94 N -2.03 3.18 -0.61 5.22 0.40 -1.20 -4.24 117.98 118.69 1wz0 s PHE 94 Ca -0.10 -2.25 -0.22 0.00 -0.60 0.00 0.00 56.93 53.77 1wz0 s PHE 94 Cb -0.05 -1.90 0.07 0.00 0.51 0.00 0.00 43.02 41.65 1wz0 s PHE 94 CO -0.02 -0.87 0.86 -0.65 0.70 0.00 0.00 175.22 175.24 1wz0 s GLN 95 N 1.13 3.13 0.29 0.44 -0.21 -1.26 -4.23 119.66 118.95 1wz0 s GLN 95 Ca -0.08 -0.86 0.03 0.00 0.02 0.00 0.00 55.36 54.47 1wz0 s GLN 95 Cb -0.19 -4.19 -0.03 0.00 1.00 0.00 0.00 33.01 29.59 1wz0 s GLN 95 CO -0.06 -1.63 0.45 -0.65 -2.12 0.00 0.00 175.29 171.29 1wz0 s GLN 96 N 3.57 3.46 0.25 2.91 -0.21 -1.26 -4.72 119.66 123.67 1wz0 s GLN 96 Ca 0.20 -0.54 -0.31 0.00 0.02 0.00 0.00 55.36 54.73 1wz0 s GLN 96 Cb -0.18 -2.78 -0.12 0.00 1.00 0.00 0.00 33.01 30.93 1wz0 s GLN 96 CO 0.11 0.29 1.56 1.04 -2.12 0.00 0.00 175.29 176.17 1wz0 n GLN 97 N -1.58 2.46 -2.82 2.91 3.00 -1.26 -4.94 117.38 115.15 1wz0 n GLN 97 Ca -0.07 0.88 -0.42 0.00 -0.01 0.00 0.00 57.00 57.38 1wz0 n GLN 97 Cb 0.57 -2.63 -0.03 0.00 0.00 0.00 0.00 30.24 28.14 1wz0 n GLN 97 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.06 176.98 1wz0 s THR 98 N 0.23 4.88 -0.24 5.09 -1.32 -1.26 -5.03 115.64 117.98 1wz0 s THR 98 Ca 0.68 1.81 0.02 0.00 -1.21 0.00 0.00 61.69 62.99 1wz0 s THR 98 Cb -0.56 -4.21 0.06 0.00 -1.51 0.00 0.00 72.50 66.28 1wz0 s THR 98 CO 0.46 0.09 -0.11 -0.44 -2.21 0.00 0.00 174.62 172.41 1wz0 s SER 99 N 1.04 4.13 0.00 8.08 0.01 -1.26 -5.07 113.70 120.63 1wz0 s SER 99 Ca 0.44 -1.25 0.00 0.00 1.31 0.00 0.00 55.95 56.45 1wz0 s SER 99 Cb -0.18 -1.44 0.00 0.00 0.21 0.00 0.00 66.02 64.61 1wz0 s SER 99 CO 0.18 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.26 1wz0 n GLY 100 N 4.52 3.04 3.77 3.44 0.00 -1.26 -5.15 105.19 113.55 1wz0 n GLY 100 Ca -0.14 -0.36 -0.37 0.00 0.00 0.00 0.00 46.02 45.15 1wz0 n GLY 100 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wz0 s PRO 101 N -1.63 3.73 -0.37 1.61 0.04 -1.26 -4.99 135.00 132.14 1wz0 s PRO 101 Ca 0.00 1.76 -0.25 0.00 0.04 0.00 0.00 61.00 62.55 1wz0 s PRO 101 Cb 0.00 -2.38 0.01 0.00 0.04 0.00 0.00 34.50 32.18 1wz0 s PRO 101 CO 0.00 -0.57 0.89 0.45 0.04 0.00 0.00 177.00 177.81 1wz0 s SER 102 N -1.39 6.66 -1.17 6.66 0.15 -1.26 -4.03 113.70 119.31 1wz0 s SER 102 Ca 0.64 0.54 -0.03 0.00 0.70 0.00 0.00 55.95 57.80 1wz0 s SER 102 Cb -0.28 -2.45 -0.02 0.00 -1.71 0.00 0.00 66.02 61.56 1wz0 s SER 102 CO 0.34 -0.83 0.90 -0.24 1.20 0.00 0.00 173.24 174.62 1wz0 n SER 103 N 6.69 -3.48 -0.86 5.45 2.88 -1.26 -5.36 113.62 117.68 1wz0 n SER 103 Ca 0.06 -0.71 0.11 0.00 -1.33 0.00 0.00 58.87 57.00 1wz0 n SER 103 Cb 0.48 -4.83 0.09 0.00 -0.75 0.00 0.00 64.21 59.20 1wz0 n SER 103 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42