#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wi2 s SER 2 N 0.00 -0.00 -0.24 1.61 1.04 -1.26 -5.18 113.70 109.66 1wi2 s SER 2 Ca 0.00 0.00 -0.31 0.00 0.48 0.00 0.00 55.95 56.12 1wi2 s SER 2 Cb 0.00 0.68 0.17 0.00 0.10 0.00 0.00 66.02 66.97 1wi2 s SER 2 CO 0.00 -0.00 1.26 -0.55 0.98 0.00 0.00 173.24 174.93 1wi2 s SER 3 N 0.68 -0.12 0.00 7.02 0.15 -1.26 -5.12 113.70 115.05 1wi2 s SER 3 Ca -0.03 0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.72 1wi2 s SER 3 Cb -0.03 0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.38 1wi2 s SER 3 CO -0.12 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 174.80 1wi2 n GLY 4 N 0.42 -0.98 3.28 9.45 0.00 -1.26 -5.18 105.19 110.93 1wi2 n GLY 4 Ca -0.02 -1.14 -0.15 0.00 0.00 0.00 0.00 46.02 44.71 1wi2 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wi2 s SER 5 N 0.00 1.76 -0.30 1.61 0.15 -1.26 -5.14 113.70 110.52 1wi2 s SER 5 Ca 0.00 -1.11 -0.02 0.00 0.70 0.00 0.00 55.95 55.52 1wi2 s SER 5 Cb 0.00 0.01 0.19 0.00 -1.71 0.00 0.00 66.02 64.51 1wi2 s SER 5 CO 0.00 -0.42 0.63 -0.44 1.20 0.00 0.00 173.24 174.20 1wi2 s SER 6 N -3.22 -1.33 -0.15 5.45 0.01 -1.26 -5.14 113.70 108.06 1wi2 s SER 6 Ca 0.22 0.88 -0.00 0.00 1.31 0.00 0.00 55.95 58.36 1wi2 s SER 6 Cb 0.04 2.14 0.03 0.00 0.21 0.00 0.00 66.02 68.44 1wi2 s SER 6 CO 0.04 -0.25 -0.08 -0.83 0.41 0.00 0.00 173.24 172.54 1wi2 s GLY 7 N 2.87 0.95 0.38 3.44 0.00 -1.26 -5.03 107.32 108.67 1wi2 s GLY 7 Ca 0.19 -0.76 0.00 0.00 0.00 0.00 0.00 44.72 44.14 1wi2 s GLY 7 CO -0.20 0.83 0.00 0.70 0.00 0.00 0.00 173.10 174.42 1wi2 n ASN 8 N 4.87 -8.22 0.00 1.64 3.02 -1.26 -5.09 115.26 110.22 1wi2 n ASN 8 Ca -0.13 1.14 0.00 0.00 -0.03 0.00 0.00 54.58 55.56 1wi2 n ASN 8 Cb 0.49 -4.20 0.00 0.00 -0.61 0.00 0.00 39.78 35.46 1wi2 n ASN 8 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1wi2 n ASN 9 N -0.06 0.00 0.00 6.41 4.13 -1.26 -5.18 115.26 119.29 1wi2 n ASN 9 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1wi2 n ASN 9 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1wi2 n ASN 9 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1wi2 n GLU 10 N -0.09 3.57 -3.63 3.52 1.02 -1.26 -4.94 120.64 118.83 1wi2 n GLU 10 Ca 0.00 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.90 1wi2 n GLU 10 Cb 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 31.44 1wi2 n GLU 10 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1wi2 n LEU 11 N 0.00 -3.09 -4.88 -4.62 4.77 -1.26 -4.96 117.00 102.97 1wi2 n LEU 11 Ca 0.00 -0.83 -0.32 0.00 -0.03 0.00 0.00 56.01 54.84 1wi2 n LEU 11 Cb 0.00 -2.24 -0.05 0.00 -2.33 0.00 0.00 43.42 38.80 1wi2 n LEU 11 CO 0.00 0.14 -0.18 0.42 -1.33 0.00 0.00 177.39 176.44 1wi2 s THR 12 N -3.20 5.18 0.00 -5.08 -4.23 -1.26 -4.86 115.64 102.19 1wi2 s THR 12 Ca 0.21 -0.42 0.00 0.00 -1.18 0.00 0.00 61.69 60.30 1wi2 s THR 12 Cb -0.08 -3.49 0.00 0.00 1.34 0.00 0.00 72.50 70.27 1wi2 s THR 12 CO 0.86 0.19 0.00 0.00 -0.54 0.00 0.00 174.62 175.13 1wi2 n GLN 13 N 0.53 0.00 -2.22 3.99 0.00 -1.26 -4.98 117.38 113.43 1wi2 n GLN 13 Ca -0.07 0.00 -0.03 0.00 0.00 0.00 0.00 57.00 56.89 1wi2 n GLN 13 Cb 0.52 0.00 0.08 0.00 0.00 0.00 0.00 30.24 30.83 1wi2 n GLN 13 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 1wi2 n PHE 14 N -0.19 -1.52 -4.43 2.61 3.01 -1.26 -5.12 117.46 110.56 1wi2 n PHE 14 Ca 0.00 -1.37 -0.32 0.00 1.01 0.00 0.00 57.45 56.76 1wi2 n PHE 14 Cb 0.00 1.28 -0.10 0.00 -0.01 0.00 0.00 39.48 40.65 1wi2 n PHE 14 CO 0.00 0.00 0.00 -0.48 1.01 0.00 0.00 176.76 177.29 1wi2 s LEU 15 N -3.01 3.25 0.22 4.37 0.05 -1.26 -5.10 118.68 117.20 1wi2 s LEU 15 Ca 0.07 -0.10 -0.30 0.00 0.05 0.00 0.00 54.13 53.84 1wi2 s LEU 15 Cb 0.33 -1.85 -0.08 0.00 -2.05 0.00 0.00 46.19 42.54 1wi2 s LEU 15 CO -0.09 0.29 1.11 -2.16 -0.55 0.00 0.00 176.35 174.94 1wi2 s PRO 16 N -1.40 4.60 0.35 1.48 0.04 -1.26 -4.78 135.00 134.03 1wi2 s PRO 16 Ca 0.17 1.76 0.07 0.00 0.04 0.00 0.00 61.00 63.05 1wi2 s PRO 16 Cb -0.11 -3.24 -0.01 0.00 0.04 0.00 0.00 34.50 31.17 1wi2 s PRO 16 CO 0.08 0.11 0.41 -0.98 0.04 0.00 0.00 177.00 176.65 1wi2 s ARG 17 N -0.75 2.89 -0.08 4.56 1.70 0.30 -4.92 118.95 122.66 1wi2 s ARG 17 Ca 0.48 -1.19 0.04 0.00 -0.47 0.00 0.00 55.73 54.58 1wi2 s ARG 17 Cb -0.31 -2.64 -0.02 0.00 -0.57 0.00 0.00 34.95 31.41 1wi2 s ARG 17 CO 0.37 0.02 -0.18 0.42 -1.08 0.00 0.00 175.30 174.84 1wi2 s ILE 18 N -2.27 2.64 -0.46 4.99 -1.09 -1.26 -0.02 121.20 123.73 1wi2 s ILE 18 Ca 0.45 -0.85 0.01 0.00 -2.23 0.00 0.00 60.65 58.03 1wi2 s ILE 18 Cb -0.08 -2.03 0.12 0.00 -1.58 0.00 0.00 42.46 38.90 1wi2 s ILE 18 CO 0.29 0.56 0.22 -0.69 -1.23 0.00 0.00 174.94 174.09 1wi2 s VAL 19 N -0.19 2.90 -0.19 2.92 1.01 -0.90 -4.96 120.40 120.99 1wi2 s VAL 19 Ca -0.01 -2.62 -0.12 0.00 0.00 0.00 0.00 61.98 59.23 1wi2 s VAL 19 Cb -0.13 -3.01 -0.05 0.00 0.00 0.00 0.00 36.38 33.19 1wi2 s VAL 19 CO 0.03 -0.73 0.21 0.42 0.00 0.00 0.00 175.10 175.04 1wi2 s THR 20 N 0.50 5.35 0.40 3.92 -4.23 -1.26 -3.75 115.64 116.57 1wi2 s THR 20 Ca 0.13 0.37 0.04 0.00 -1.18 0.00 0.00 61.69 61.04 1wi2 s THR 20 Cb -0.22 -3.55 -0.04 0.00 1.34 0.00 0.00 72.50 70.02 1wi2 s THR 20 CO -0.04 0.40 0.06 -0.76 -0.54 0.00 0.00 174.62 173.74 1wi2 s LEU 21 N 0.51 2.23 -0.06 4.79 1.02 -1.07 -5.00 118.68 121.11 1wi2 s LEU 21 Ca 0.12 -1.52 -0.07 0.00 0.02 0.00 0.00 54.13 52.68 1wi2 s LEU 21 Cb -0.12 -0.43 -0.02 0.00 0.02 0.00 0.00 46.19 45.64 1wi2 s LEU 21 CO 0.01 -0.74 -0.13 1.17 0.02 0.00 0.00 176.35 176.69 1wi2 n LYS 22 N -0.91 0.19 -2.07 1.70 4.81 -1.26 -3.06 118.16 117.56 1wi2 n LYS 22 Ca -0.07 0.08 0.00 0.00 -0.87 0.00 0.00 58.31 57.45 1wi2 n LYS 22 Cb 0.66 -0.82 0.00 0.00 0.02 0.00 0.00 35.03 34.89 1wi2 n LYS 22 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1wi2 n LYS 23 N -3.23 -5.69 -1.55 1.64 3.00 -1.26 -4.55 118.16 106.52 1wi2 n LYS 23 Ca -0.05 4.03 -0.30 0.00 -0.00 0.00 0.00 58.31 61.99 1wi2 n LYS 23 Cb 0.19 -4.36 0.10 0.00 0.00 0.00 0.00 35.03 30.96 1wi2 n LYS 23 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1wi2 s PRO 24 N -0.86 1.93 -0.58 1.64 0.04 -1.26 -4.92 135.00 130.99 1wi2 s PRO 24 Ca 0.00 0.59 -0.27 0.00 0.04 0.00 0.00 61.00 61.35 1wi2 s PRO 24 Cb 0.00 -1.91 0.01 0.00 0.04 0.00 0.00 34.50 32.64 1wi2 s PRO 24 CO 0.00 -1.71 1.51 -1.25 0.04 0.00 0.00 177.00 175.59 1wi2 s PRO 25 N -5.17 3.15 0.00 0.56 0.04 -1.26 -2.43 135.00 129.88 1wi2 s PRO 25 Ca 0.61 0.45 0.00 0.00 0.04 0.00 0.00 61.00 62.10 1wi2 s PRO 25 Cb -0.14 -4.19 0.00 0.00 0.04 0.00 0.00 34.50 30.21 1wi2 s PRO 25 CO 0.54 -2.12 0.00 0.41 0.04 0.00 0.00 177.00 175.87 1wi2 n GLY 26 N 5.37 1.56 3.89 0.56 0.00 -1.26 -5.12 105.19 110.20 1wi2 n GLY 26 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 1wi2 n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wi2 s ALA 27 N -2.00 3.30 -0.36 4.61 0.00 -1.02 -4.97 121.76 121.32 1wi2 s ALA 27 Ca 0.00 -0.36 0.09 0.00 0.00 0.00 0.00 51.96 51.69 1wi2 s ALA 27 Cb 0.00 -2.76 0.67 0.00 0.00 0.00 0.00 23.12 21.03 1wi2 s ALA 27 CO 0.00 -0.47 1.67 1.04 0.00 0.00 0.00 175.76 178.00 1wi2 n GLN 28 N -2.44 3.58 -1.24 0.00 6.02 -1.26 -5.02 117.38 117.03 1wi2 n GLN 28 Ca 0.02 -2.72 0.00 0.00 -0.01 0.00 0.00 57.00 54.30 1wi2 n GLN 28 Cb 0.55 -2.12 0.00 0.00 1.02 0.00 0.00 30.24 29.68 1wi2 n GLN 28 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1wi2 n LEU 29 N 0.01 -2.11 -0.30 1.08 4.32 -1.26 -4.62 117.00 114.12 1wi2 n LEU 29 Ca 0.35 2.37 0.02 0.00 -0.02 0.00 0.00 56.01 58.72 1wi2 n LEU 29 Cb 1.25 -2.09 0.05 0.00 -1.62 0.00 0.00 43.42 41.02 1wi2 n LEU 29 CO 0.38 0.31 0.51 0.61 -1.22 0.00 0.00 177.39 177.98 1wi2 n GLY 30 N -0.87 -0.07 3.55 -0.72 0.00 -1.26 -4.83 105.19 100.99 1wi2 n GLY 30 Ca 0.00 -0.13 -0.10 0.00 0.00 0.00 0.00 46.02 45.79 1wi2 n GLY 30 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1wi2 s PHE 31 N -1.74 -0.43 0.01 1.61 -0.12 -1.26 0.20 117.98 116.25 1wi2 s PHE 31 Ca 0.08 0.15 0.04 0.00 -0.05 0.00 0.00 56.93 57.15 1wi2 s PHE 31 Cb 0.04 0.60 -0.03 0.00 -0.63 0.00 0.00 43.02 43.00 1wi2 s PHE 31 CO 0.05 -0.95 -0.10 -0.80 -0.05 0.00 0.00 175.22 173.37 1wi2 s ASN 32 N -2.79 4.36 0.04 1.98 -0.87 0.47 -4.92 114.94 113.21 1wi2 s ASN 32 Ca 0.04 -0.23 0.05 0.00 -1.57 0.00 0.00 52.86 51.15 1wi2 s ASN 32 Cb -0.02 -0.93 -0.04 0.00 -0.02 0.00 0.00 41.25 40.24 1wi2 s ASN 32 CO -0.07 0.28 -0.09 0.27 -2.57 0.00 0.00 177.10 174.91 1wi2 s ILE 33 N -0.97 3.45 0.30 0.60 -4.36 -1.26 0.15 121.20 119.11 1wi2 s ILE 33 Ca 0.16 -0.97 -0.10 0.00 -0.26 0.00 0.00 60.65 59.49 1wi2 s ILE 33 Cb -0.11 -2.53 0.00 0.00 1.25 0.00 0.00 42.46 41.08 1wi2 s ILE 33 CO 0.07 0.31 0.51 0.00 0.24 0.00 0.00 174.94 176.06 1wi2 s ARG 34 N -1.64 1.75 0.56 0.37 1.70 -0.98 -4.74 118.95 115.97 1wi2 s ARG 34 Ca 0.18 -1.45 0.00 0.00 -0.47 0.00 0.00 55.73 53.99 1wi2 s ARG 34 Cb -0.11 0.48 0.00 0.00 -0.57 0.00 0.00 34.95 34.75 1wi2 s ARG 34 CO 0.09 -0.74 0.00 0.41 -1.08 0.00 0.00 175.30 173.98 1wi2 n GLY 35 N -0.46 -3.15 0.63 3.88 0.00 -1.26 -2.33 105.19 102.50 1wi2 n GLY 35 Ca -0.02 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1wi2 n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wi2 n GLY 36 N -3.83 -1.11 1.73 -0.02 0.00 0.13 -3.93 105.19 98.15 1wi2 n GLY 36 Ca -0.07 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1wi2 n GLY 36 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1wi2 n LYS 37 N 0.75 0.00 -1.10 1.61 2.85 -1.26 -4.12 118.16 116.89 1wi2 n LYS 37 Ca 0.00 0.00 -0.02 0.00 -1.05 0.00 0.00 58.31 57.24 1wi2 n LYS 37 Cb 0.00 0.00 -0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1wi2 n LYS 37 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1wi2 n ALA 38 N -3.17 0.48 -2.68 0.58 0.00 -1.26 -4.82 120.51 109.63 1wi2 n ALA 38 Ca 0.00 -0.32 -0.22 0.00 0.00 0.00 0.00 53.44 52.90 1wi2 n ALA 38 Cb 0.00 -0.39 -0.00 0.00 0.00 0.00 0.00 19.45 19.06 1wi2 n ALA 38 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1wi2 n SER 39 N -0.20 3.47 -4.26 0.00 2.88 -1.26 -4.93 113.62 109.32 1wi2 n SER 39 Ca -0.10 -3.39 -0.38 0.00 -1.33 0.00 0.00 58.87 53.66 1wi2 n SER 39 Cb 0.50 -0.51 -0.07 0.00 -0.75 0.00 0.00 64.21 63.38 1wi2 n SER 39 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1wi2 n GLN 40 N -0.26 -0.75 -4.13 -1.46 0.00 -1.26 -4.86 117.38 104.66 1wi2 n GLN 40 Ca 0.29 0.12 -0.23 0.00 -0.00 0.00 0.00 57.00 57.18 1wi2 n GLN 40 Cb 0.65 -4.21 -0.06 0.00 0.00 0.00 0.00 30.24 26.61 1wi2 n GLN 40 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.06 176.95 1wi2 n LEU 41 N -3.76 0.00 0.00 1.69 7.94 -1.26 -5.08 117.00 116.53 1wi2 n LEU 41 Ca 0.08 -2.76 0.00 0.00 -1.11 0.00 0.00 56.01 52.22 1wi2 n LEU 41 Cb 0.42 0.87 0.00 0.00 0.53 0.00 0.00 43.42 45.25 1wi2 n LEU 41 CO 0.87 -0.42 0.00 0.61 -1.11 0.00 0.00 177.39 177.34 1wi2 n GLY 42 N -0.43 5.51 3.87 -3.96 0.00 -1.26 -4.46 105.19 104.46 1wi2 n GLY 42 Ca -0.06 -1.43 -0.37 0.00 0.00 0.00 0.00 46.02 44.16 1wi2 n GLY 42 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wi2 s ILE 43 N -0.15 5.40 0.01 -0.61 -1.09 -1.25 0.17 121.20 123.68 1wi2 s ILE 43 Ca 0.00 0.35 -0.06 0.00 -2.23 0.00 0.00 60.65 58.71 1wi2 s ILE 43 Cb 0.00 -3.47 -0.00 0.00 -1.58 0.00 0.00 42.46 37.40 1wi2 s ILE 43 CO 0.00 0.60 0.10 -0.36 -1.23 0.00 0.00 174.94 174.05 1wi2 s PHE 44 N -1.05 0.11 -1.11 3.97 0.40 -0.98 -0.31 117.98 119.01 1wi2 s PHE 44 Ca 0.17 -0.27 -0.24 0.00 -0.60 0.00 0.00 56.93 55.99 1wi2 s PHE 44 Cb -0.13 -0.09 -0.13 0.00 0.51 0.00 0.00 43.02 43.17 1wi2 s PHE 44 CO 0.06 -0.28 2.02 0.42 0.70 0.00 0.00 175.22 178.15 1wi2 s ILE 45 N -1.56 3.34 0.17 0.64 -1.09 -0.98 -2.31 121.20 119.41 1wi2 s ILE 45 Ca -0.14 -0.53 -0.26 0.00 -2.23 0.00 0.00 60.65 57.49 1wi2 s ILE 45 Cb -0.07 -4.25 0.02 0.00 -1.58 0.00 0.00 42.46 36.58 1wi2 s ILE 45 CO 0.00 -0.62 1.57 0.77 -1.23 0.00 0.00 174.94 175.42 1wi2 h SER 46 N 10.65 -1.54 -5.20 3.58 4.64 0.12 -3.32 113.55 122.47 1wi2 h SER 46 Ca 0.13 0.25 -0.10 0.00 -0.47 0.00 0.00 61.79 61.60 1wi2 h SER 46 Cb 0.97 0.69 -0.14 0.00 -0.31 0.00 0.00 62.40 63.61 1wi2 h SER 46 CO 1.14 -0.34 -0.40 -0.75 -0.87 0.00 0.00 176.83 175.61 1wi2 s LYS 47 N -5.81 0.90 -0.02 4.77 2.36 -0.84 -4.88 119.74 116.22 1wi2 s LYS 47 Ca -0.14 -1.06 0.02 0.00 -2.55 0.00 0.00 55.97 52.24 1wi2 s LYS 47 Cb 0.13 0.33 0.00 0.00 -1.05 0.00 0.00 37.83 37.24 1wi2 s LYS 47 CO 0.66 -0.29 -0.07 0.08 1.55 0.00 0.00 175.35 177.27 1wi2 s VAL 48 N -3.90 0.65 0.04 4.02 1.01 -1.26 0.18 120.40 121.13 1wi2 s VAL 48 Ca 0.09 -0.29 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 1wi2 s VAL 48 Cb 0.05 -0.58 -0.07 0.00 0.00 0.00 0.00 36.38 35.77 1wi2 s VAL 48 CO -0.08 0.21 1.61 -0.63 0.00 0.00 0.00 175.10 176.21 1wi2 s ILE 49 N 0.18 3.25 -0.76 2.22 -1.09 0.13 -4.85 121.20 120.26 1wi2 s ILE 49 Ca -0.02 0.62 -0.06 0.00 -2.23 0.00 0.00 60.65 58.96 1wi2 s ILE 49 Cb -0.07 -3.40 -0.12 0.00 -1.58 0.00 0.00 42.46 37.29 1wi2 s ILE 49 CO 0.00 -0.01 2.62 -0.81 -1.23 0.00 0.00 174.94 175.51 1wi2 n PRO 50 N 5.84 2.30 0.00 2.79 -0.04 -1.26 -2.70 135.00 141.93 1wi2 n PRO 50 Ca 0.16 -1.39 0.00 0.00 -0.04 0.00 0.00 63.50 62.23 1wi2 n PRO 50 Cb 0.41 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 31.55 1wi2 n PRO 50 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1wi2 n ASP 51 N 3.44 0.00 -2.53 3.54 8.00 -1.26 -5.13 116.55 122.61 1wi2 n ASP 51 Ca 0.49 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.89 1wi2 n ASP 51 Cb 0.37 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.44 1wi2 n ASP 51 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1wi2 n SER 52 N 0.00 1.44 0.08 -2.24 3.41 -1.10 -5.03 113.62 110.17 1wi2 n SER 52 Ca 0.00 -1.81 -0.12 0.00 -0.26 0.00 0.00 58.87 56.68 1wi2 n SER 52 Cb 0.00 0.32 -0.03 0.00 -0.26 0.00 0.00 64.21 64.23 1wi2 n SER 52 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1wi2 h ASP 53 N 0.56 0.42 -0.56 4.04 3.32 -1.90 -3.12 116.42 119.19 1wi2 h ASP 53 Ca -0.13 -0.34 -0.08 0.00 0.02 0.00 0.00 57.03 56.50 1wi2 h ASP 53 Cb 0.46 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 1wi2 h ASP 53 CO 0.21 1.15 0.05 0.00 -1.72 0.00 0.00 179.24 178.92 1wi2 h ALA 54 N 0.82 0.97 0.00 3.45 0.00 -1.90 1.49 119.26 124.09 1wi2 h ALA 54 Ca -0.07 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1wi2 h ALA 54 Cb 1.56 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 1wi2 h ALA 54 CO 0.15 0.64 -0.04 1.25 0.00 0.00 0.00 179.25 181.24 1wi2 h HIS 55 N 0.92 0.00 0.07 0.00 -0.00 -1.74 0.18 115.15 114.58 1wi2 h HIS 55 Ca 0.18 0.00 -0.37 0.00 -0.00 0.00 0.00 60.37 60.18 1wi2 h HIS 55 Cb 0.47 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 27.84 1wi2 h HIS 55 CO 0.03 0.04 -2.14 0.54 -0.00 0.00 0.00 177.93 176.41 1wi2 n ARG 56 N -4.28 0.71 -0.17 5.26 1.74 -0.67 -4.06 116.66 115.19 1wi2 n ARG 56 Ca -0.03 0.22 0.29 0.00 -0.77 0.00 0.00 57.85 57.56 1wi2 n ARG 56 Cb 0.13 -1.65 0.72 0.00 -1.02 0.00 0.00 32.46 30.64 1wi2 n ARG 56 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1wi2 h ALA 57 N 0.16 2.80 0.00 7.54 0.00 0.25 -3.44 119.26 126.57 1wi2 h ALA 57 Ca -0.47 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1wi2 h ALA 57 Cb 2.00 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.86 1wi2 h ALA 57 CO 0.03 -1.12 0.00 0.41 0.00 0.00 0.00 179.25 178.57 1wi2 n GLY 58 N -1.69 1.70 3.75 0.00 0.00 -0.87 -5.05 105.19 103.03 1wi2 n GLY 58 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1wi2 n GLY 58 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wi2 s LEU 59 N 0.00 4.59 0.01 0.99 1.43 -0.00 -5.05 118.68 120.65 1wi2 s LEU 59 Ca 0.00 2.02 -0.03 0.00 -1.03 0.00 0.00 54.13 55.09 1wi2 s LEU 59 Cb 0.00 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.60 1wi2 s LEU 59 CO 0.00 0.02 0.04 0.00 0.23 0.00 0.00 176.35 176.64 1wi2 s GLN 60 N -0.99 0.36 -0.18 1.70 -2.07 -1.26 -4.67 119.66 112.55 1wi2 s GLN 60 Ca 0.44 -0.48 -0.30 0.00 -1.82 0.00 0.00 55.36 53.19 1wi2 s GLN 60 Cb -0.27 0.14 -0.08 0.00 -1.09 0.00 0.00 33.01 31.71 1wi2 s GLN 60 CO 0.34 -0.07 2.14 0.39 -1.32 0.00 0.00 175.29 176.77 1wi2 n GLU 61 N 1.65 1.98 0.00 9.60 1.02 -1.26 -1.57 120.64 132.06 1wi2 n GLU 61 Ca -0.23 0.61 0.00 0.00 -0.02 0.00 0.00 57.16 57.52 1wi2 n GLU 61 Cb 0.56 -3.00 0.00 0.00 -0.02 0.00 0.00 31.44 28.98 1wi2 n GLU 61 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wi2 n GLY 62 N 5.54 0.61 3.58 0.62 0.00 -1.25 -4.77 105.19 109.52 1wi2 n GLY 62 Ca 0.29 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.90 1wi2 n GLY 62 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wi2 s ASP 63 N -0.31 6.18 0.15 1.61 1.01 -0.61 -4.28 116.67 120.42 1wi2 s ASP 63 Ca 0.00 0.23 -0.30 0.00 0.71 0.00 0.00 52.55 53.18 1wi2 s ASP 63 Cb 0.00 -2.55 -0.08 0.00 1.01 0.00 0.00 42.92 41.30 1wi2 s ASP 63 CO 0.00 -1.68 1.30 -1.58 0.21 0.00 0.00 175.17 173.42 1wi2 s GLN 64 N 5.44 4.39 -0.55 8.23 0.74 -1.26 -2.31 119.66 134.35 1wi2 s GLN 64 Ca 0.50 1.99 -0.19 0.00 0.05 0.00 0.00 55.36 57.71 1wi2 s GLN 64 Cb -0.10 -3.24 0.09 0.00 1.10 0.00 0.00 33.01 30.85 1wi2 s GLN 64 CO 0.25 -0.28 0.64 0.08 -0.55 0.00 0.00 175.29 175.42 1wi2 s VAL 65 N 0.54 4.90 0.02 1.34 1.01 0.57 -3.30 120.40 125.47 1wi2 s VAL 65 Ca 0.59 -0.84 -0.18 0.00 0.00 0.00 0.00 61.98 61.55 1wi2 s VAL 65 Cb -0.35 -4.38 -0.10 0.00 0.00 0.00 0.00 36.38 31.55 1wi2 s VAL 65 CO 0.34 -0.95 1.09 -0.07 0.00 0.00 0.00 175.10 175.51 1wi2 h LEU 66 N 9.71 -0.55 -8.61 3.92 3.38 0.01 -3.39 115.31 119.79 1wi2 h LEU 66 Ca -0.29 0.02 -0.28 0.00 0.09 0.00 0.00 57.88 57.43 1wi2 h LEU 66 Cb 1.09 0.14 -0.15 0.00 0.09 0.00 0.00 40.66 41.84 1wi2 h LEU 66 CO 1.03 -0.34 -0.67 0.00 0.09 0.00 0.00 178.44 178.54 1wi2 s ALA 67 N -4.37 1.27 -0.23 1.53 0.00 -1.24 -1.46 121.76 117.27 1wi2 s ALA 67 Ca -0.09 -1.53 -0.04 0.00 0.00 0.00 0.00 51.96 50.30 1wi2 s ALA 67 Cb 0.01 0.42 0.08 0.00 0.00 0.00 0.00 23.12 23.62 1wi2 s ALA 67 CO 0.28 -0.28 0.09 0.08 0.00 0.00 0.00 175.76 175.93 1wi2 s VAL 68 N -3.62 0.20 -1.20 0.00 1.01 0.48 -0.33 120.40 116.94 1wi2 s VAL 68 Ca 0.21 -0.62 -0.03 0.00 0.00 0.00 0.00 61.98 61.53 1wi2 s VAL 68 Cb 0.06 -0.96 -0.02 0.00 0.00 0.00 0.00 36.38 35.45 1wi2 s VAL 68 CO 0.02 -0.46 0.85 0.59 0.00 0.00 0.00 175.10 176.10 1wi2 n ASN 69 N 5.15 -3.03 0.00 3.32 3.02 -0.98 -2.06 115.26 120.68 1wi2 n ASN 69 Ca -0.06 -0.75 0.00 0.00 -0.03 0.00 0.00 54.58 53.73 1wi2 n ASN 69 Cb 0.45 -4.59 0.00 0.00 -0.61 0.00 0.00 39.78 35.04 1wi2 n ASN 69 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1wi2 n ASP 70 N -3.08 0.00 -4.67 6.41 -0.08 -1.26 -4.93 116.55 108.94 1wi2 n ASP 70 Ca -0.23 0.00 -0.49 0.00 -1.51 0.00 0.00 54.79 52.57 1wi2 n ASP 70 Cb 0.65 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 44.07 1wi2 n ASP 70 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1wi2 n VAL 71 N 0.00 0.24 -2.66 5.18 0.31 -0.88 -4.91 118.33 115.62 1wi2 n VAL 71 Ca 0.00 -0.04 -0.41 0.00 -0.01 0.00 0.00 64.34 63.88 1wi2 n VAL 71 Cb 0.00 -1.55 -0.05 0.00 -0.91 0.00 0.00 33.84 31.33 1wi2 n VAL 71 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1wi2 s ASP 72 N 2.25 7.45 0.00 4.52 1.01 -1.26 0.18 116.67 130.82 1wi2 s ASP 72 Ca 0.86 1.93 0.19 0.00 0.71 0.00 0.00 52.55 56.24 1wi2 s ASP 72 Cb -0.75 -2.60 -0.10 0.00 1.01 0.00 0.00 42.92 40.48 1wi2 s ASP 72 CO 0.46 -0.07 0.86 0.49 0.21 0.00 0.00 175.17 177.13 1wi2 n PHE 73 N 2.34 0.00 -0.11 4.23 3.01 -0.53 -4.39 117.46 122.00 1wi2 n PHE 73 Ca 0.01 0.00 0.27 0.00 1.01 0.00 0.00 57.45 58.74 1wi2 n PHE 73 Cb 0.48 0.00 0.66 0.00 -0.01 0.00 0.00 39.48 40.61 1wi2 n PHE 73 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 1wi2 h GLN 74 N 1.03 0.00 -1.09 -1.08 4.20 -1.71 -2.84 115.11 113.63 1wi2 h GLN 74 Ca 0.00 0.00 -0.38 0.00 0.06 0.00 0.00 58.65 58.33 1wi2 h GLN 74 Cb 0.54 0.00 -0.26 0.00 0.30 0.00 0.00 27.48 28.05 1wi2 h GLN 74 CO 0.00 0.00 -0.78 -3.47 -0.67 0.00 0.00 178.83 173.91 1wi2 n ASP 75 N -3.69 -1.55 -4.22 1.46 -0.08 -1.26 -4.41 116.55 102.80 1wi2 n ASP 75 Ca 0.17 -2.95 -0.15 0.00 -1.51 0.00 0.00 54.79 50.35 1wi2 n ASP 75 Cb 1.06 0.65 -0.11 0.00 2.34 0.00 0.00 41.12 45.07 1wi2 n ASP 75 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 1wi2 s ILE 76 N -0.07 1.12 0.35 5.18 2.07 -1.07 -5.02 121.20 123.76 1wi2 s ILE 76 Ca 0.33 -1.79 -0.24 0.00 -1.41 0.00 0.00 60.65 57.54 1wi2 s ILE 76 Cb 0.17 -1.56 -0.10 0.00 0.13 0.00 0.00 42.46 41.10 1wi2 s ILE 76 CO -0.17 -0.58 0.93 -1.61 -1.91 0.00 0.00 174.94 171.60 1wi2 s GLU 77 N -3.05 4.44 0.11 3.50 0.41 -1.26 -4.04 118.70 118.81 1wi2 s GLU 77 Ca 0.10 1.22 -0.28 0.00 -0.41 0.00 0.00 54.97 55.59 1wi2 s GLU 77 Cb -0.02 -2.60 -0.08 0.00 -1.78 0.00 0.00 34.13 29.65 1wi2 s GLU 77 CO 0.01 0.19 1.62 1.25 -0.49 0.00 0.00 175.26 177.83 1wi2 h HIS 78 N 2.77 -0.87 -0.74 1.61 -0.00 -1.90 0.69 115.15 116.71 1wi2 h HIS 78 Ca -0.48 0.02 0.15 0.00 -0.00 0.00 0.00 60.37 60.06 1wi2 h HIS 78 Cb 1.19 0.37 -0.05 0.00 -0.00 0.00 0.00 27.41 28.92 1wi2 h HIS 78 CO 0.62 -0.43 0.49 1.03 -0.00 0.00 0.00 177.93 179.65 1wi2 h SER 79 N -0.54 0.38 -0.09 3.26 0.87 -1.96 0.24 113.55 115.70 1wi2 h SER 79 Ca 0.03 0.02 -0.05 0.00 -1.23 0.00 0.00 61.79 60.56 1wi2 h SER 79 Cb 0.57 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.48 1wi2 h SER 79 CO -0.19 0.20 -0.13 0.50 -0.53 0.00 0.00 176.83 176.68 1wi2 h LYS 80 N 0.40 0.26 -0.23 2.24 1.63 -1.42 -0.96 116.57 118.49 1wi2 h LYS 80 Ca 0.36 -0.15 0.03 0.00 -0.85 0.00 0.00 60.65 60.04 1wi2 h LYS 80 Cb 0.83 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.44 1wi2 h LYS 80 CO -0.11 0.71 0.03 0.00 -3.45 0.00 0.00 179.45 176.63 1wi2 h ALA 81 N 0.54 0.23 0.62 5.00 0.00 0.21 0.59 119.26 126.45 1wi2 h ALA 81 Ca 0.01 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1wi2 h ALA 81 Cb 0.69 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1wi2 h ALA 81 CO 0.03 -0.39 -0.48 0.28 0.00 0.00 0.00 179.25 178.69 1wi2 h VAL 82 N 0.12 0.05 0.14 0.00 2.07 -0.61 -0.83 116.25 117.18 1wi2 h VAL 82 Ca 0.11 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.64 1wi2 h VAL 82 Cb 0.11 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 29.89 1wi2 h VAL 82 CO -0.15 0.00 -0.51 -0.33 0.02 0.00 0.00 177.57 176.60 1wi2 h GLU 83 N -1.07 -0.72 -0.18 1.57 3.07 -0.91 -0.60 114.58 115.75 1wi2 h GLU 83 Ca -0.08 0.05 0.02 0.00 -0.50 0.00 0.00 59.36 58.85 1wi2 h GLU 83 Cb 0.89 0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 28.94 1wi2 h GLU 83 CO 0.02 -0.48 -0.10 -0.89 -1.40 0.00 0.00 179.01 176.15 1wi2 n ILE 84 N -5.37 -0.12 -0.39 3.13 5.41 0.21 0.91 119.36 123.13 1wi2 n ILE 84 Ca -0.08 1.64 -0.10 0.00 1.00 0.00 0.00 62.75 65.21 1wi2 n ILE 84 Cb 0.40 -2.15 -0.08 0.00 -0.71 0.00 0.00 39.64 37.10 1wi2 n ILE 84 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1wi2 h LEU 85 N 0.00 -2.02 0.00 1.39 3.38 -0.92 1.25 115.31 118.38 1wi2 h LEU 85 Ca 0.03 0.32 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1wi2 h LEU 85 Cb 0.07 0.91 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1wi2 h LEU 85 CO -0.17 -0.25 0.00 0.29 0.09 0.00 0.00 178.44 178.40 1wi2 n LYS 86 N -5.30 0.00 -0.50 1.13 5.02 0.28 -1.35 118.16 117.44 1wi2 n LYS 86 Ca 0.03 0.38 0.41 0.00 -2.02 0.00 0.00 58.31 57.10 1wi2 n LYS 86 Cb 0.29 -1.16 0.66 0.00 -0.02 0.00 0.00 35.03 34.80 1wi2 n LYS 86 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1wi2 n THR 87 N -1.27 -0.16 -2.22 -0.18 -2.24 0.26 -3.67 114.28 104.81 1wi2 n THR 87 Ca 0.00 1.55 -0.39 0.00 -2.27 0.00 0.00 64.05 62.94 1wi2 n THR 87 Cb 0.00 -2.56 -0.03 0.00 -2.10 0.00 0.00 70.33 65.64 1wi2 n THR 87 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wi2 s ALA 88 N -4.97 2.37 0.28 6.98 0.00 0.42 -4.84 121.76 122.01 1wi2 s ALA 88 Ca -0.06 -0.91 0.01 0.00 0.00 0.00 0.00 51.96 51.00 1wi2 s ALA 88 Cb 0.27 -4.29 0.68 0.00 0.00 0.00 0.00 23.12 19.78 1wi2 s ALA 88 CO 0.77 -3.69 1.64 0.07 0.00 0.00 0.00 175.76 174.54 1wi2 h ARG 89 N 13.24 0.16 -5.18 0.00 0.11 -1.77 -3.37 114.38 117.58 1wi2 h ARG 89 Ca -0.27 -0.01 -0.65 0.00 0.10 0.00 0.00 59.98 59.15 1wi2 h ARG 89 Cb 1.12 -0.04 -0.33 0.00 1.11 0.00 0.00 29.97 31.83 1wi2 h ARG 89 CO 1.24 0.11 -0.87 -1.83 0.10 0.00 0.00 179.97 178.72 1wi2 s GLU 90 N -5.97 2.84 0.09 0.08 -1.05 -1.26 -4.69 118.70 108.74 1wi2 s GLU 90 Ca -0.12 -0.80 -0.22 0.00 -0.15 0.00 0.00 54.97 53.67 1wi2 s GLU 90 Cb 0.26 -2.21 -0.07 0.00 -0.44 0.00 0.00 34.13 31.67 1wi2 s GLU 90 CO 0.77 0.10 0.67 0.42 0.95 0.00 0.00 175.26 178.17 1wi2 s ILE 91 N 0.54 4.63 -0.45 1.83 1.01 -1.17 -4.95 121.20 122.64 1wi2 s ILE 91 Ca -0.15 1.45 0.07 0.00 0.00 0.00 0.00 60.65 62.02 1wi2 s ILE 91 Cb -0.17 -4.02 0.28 0.00 0.01 0.00 0.00 42.46 38.57 1wi2 s ILE 91 CO 0.05 0.50 0.89 -0.24 0.00 0.00 0.00 174.94 176.14 1wi2 n SER 92 N 1.95 -1.82 -4.92 3.58 2.88 -1.26 -2.59 113.62 111.44 1wi2 n SER 92 Ca -0.07 -3.32 -0.27 0.00 -1.33 0.00 0.00 58.87 53.88 1wi2 n SER 92 Cb 0.50 1.21 -0.03 0.00 -0.75 0.00 0.00 64.21 65.15 1wi2 n SER 92 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wi2 s MET 93 N -0.10 3.56 -0.30 -1.46 0.23 -1.25 -2.31 119.30 117.68 1wi2 s MET 93 Ca 0.30 -0.20 -0.11 0.00 -1.03 0.00 0.00 55.69 54.65 1wi2 s MET 93 Cb 0.26 -2.71 -0.03 0.00 -1.53 0.00 0.00 34.83 30.81 1wi2 s MET 93 CO -0.14 0.26 0.19 0.50 -2.03 0.00 0.00 175.02 173.79 1wi2 s ARG 94 N -3.69 3.71 0.26 3.16 3.52 0.56 -2.12 118.95 124.35 1wi2 s ARG 94 Ca 0.41 -0.48 0.11 0.00 -0.13 0.00 0.00 55.73 55.64 1wi2 s ARG 94 Cb -0.10 -3.66 -0.05 0.00 -1.56 0.00 0.00 34.95 29.57 1wi2 s ARG 94 CO 0.31 -0.29 -0.14 0.14 -0.81 0.00 0.00 175.30 174.51 1wi2 s VAL 95 N 1.72 2.78 -0.16 7.11 -7.23 0.97 0.73 120.40 126.32 1wi2 s VAL 95 Ca 0.06 -2.17 -0.15 0.00 -1.81 0.00 0.00 61.98 57.91 1wi2 s VAL 95 Cb -0.16 -2.45 0.04 0.00 0.56 0.00 0.00 36.38 34.37 1wi2 s VAL 95 CO 0.10 -0.34 0.43 -0.60 -0.31 0.00 0.00 175.10 174.38 1wi2 s ARG 96 N -3.41 0.50 -0.29 4.82 3.52 -1.21 0.11 118.95 123.00 1wi2 s ARG 96 Ca 0.29 0.61 -0.37 0.00 -0.13 0.00 0.00 55.73 56.13 1wi2 s ARG 96 Cb -0.06 0.24 -0.13 0.00 -1.56 0.00 0.00 34.95 33.44 1wi2 s ARG 96 CO 0.16 -0.06 1.98 0.34 -0.81 0.00 0.00 175.30 176.90 1wi2 n PHE 97 N 2.89 1.87 -1.89 5.12 -0.00 -1.26 -4.02 117.46 120.17 1wi2 n PHE 97 Ca -0.14 0.34 -0.22 0.00 -0.00 0.00 0.00 57.45 57.43 1wi2 n PHE 97 Cb 0.57 -2.52 0.05 0.00 -0.00 0.00 0.00 39.48 37.58 1wi2 n PHE 97 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1wi2 n PHE 98 N 7.64 2.54 -1.25 -5.13 -0.00 -1.26 -5.04 117.46 114.97 1wi2 n PHE 98 Ca 0.33 -2.24 0.00 0.00 -0.00 0.00 0.00 57.45 55.55 1wi2 n PHE 98 Cb 0.19 -0.47 0.00 0.00 -0.00 0.00 0.00 39.48 39.20 1wi2 n PHE 98 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 1wi2 n SER 99 N -0.78 -6.09 -4.49 -2.13 7.64 -1.26 -5.01 113.62 101.49 1wi2 n SER 99 Ca 0.44 0.78 -0.24 0.00 1.01 0.00 0.00 58.87 60.86 1wi2 n SER 99 Cb 0.92 -2.93 -0.10 0.00 -1.01 0.00 0.00 64.21 61.09 1wi2 n SER 99 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wi2 s GLY 100 N -0.86 1.86 0.24 0.23 0.00 -1.26 -4.92 107.32 102.60 1wi2 s GLY 100 Ca 0.00 -1.85 0.10 0.00 0.00 0.00 0.00 44.72 42.97 1wi2 s GLY 100 CO 0.00 -1.94 1.52 -0.56 0.00 0.00 0.00 173.10 172.12 1wi2 h PRO 101 N 2.22 0.00 -6.95 2.90 0.13 -1.97 -3.45 132.00 124.88 1wi2 h PRO 101 Ca -0.41 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.25 1wi2 h PRO 101 Cb 1.26 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 1wi2 h PRO 101 CO 0.60 0.70 0.23 -1.54 -0.23 0.00 0.00 178.00 177.76 1wi2 s SER 102 N -6.75 6.70 -0.96 1.44 1.04 -1.26 -4.99 113.70 108.92 1wi2 s SER 102 Ca -0.00 1.40 -0.21 0.00 0.48 0.00 0.00 55.95 57.62 1wi2 s SER 102 Cb 0.11 -2.43 0.09 0.00 0.10 0.00 0.00 66.02 63.89 1wi2 s SER 102 CO 0.77 -0.39 1.28 -0.94 0.98 0.00 0.00 173.24 174.94 1wi2 s SER 103 N -2.71 6.54 0.00 7.02 1.04 -1.26 -5.16 113.70 119.17 1wi2 s SER 103 Ca 0.56 -1.69 0.00 0.00 0.48 0.00 0.00 55.95 55.30 1wi2 s SER 103 Cb -0.10 -2.49 0.00 0.00 0.10 0.00 0.00 66.02 63.54 1wi2 s SER 103 CO 0.24 -1.31 0.00 0.61 0.98 0.00 0.00 173.24 173.76