#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wwx n SER 2 N 0.00 1.90 -4.03 1.61 2.88 -1.26 -5.05 113.62 109.68 1wwx n SER 2 Ca 0.00 0.16 -0.08 0.00 -1.33 0.00 0.00 58.87 57.62 1wwx n SER 2 Cb 0.00 -0.60 -0.10 0.00 -0.75 0.00 0.00 64.21 62.76 1wwx n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wwx s SER 3 N -6.89 0.36 0.00 -3.46 0.01 -1.26 -5.12 113.70 97.34 1wwx s SER 3 Ca -0.33 -0.77 0.00 0.00 1.31 0.00 0.00 55.95 56.15 1wwx s SER 3 Cb 0.11 0.18 0.00 0.00 0.21 0.00 0.00 66.02 66.52 1wwx s SER 3 CO 0.47 -0.50 0.00 0.61 0.41 0.00 0.00 173.24 174.22 1wwx n GLY 4 N 0.63 0.64 2.68 3.44 0.00 -1.26 -5.09 105.19 106.24 1wwx n GLY 4 Ca -0.18 -1.75 -0.09 0.00 0.00 0.00 0.00 46.02 44.00 1wwx n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wwx n SER 5 N 0.00 -4.79 -4.22 1.61 7.64 -1.26 -4.90 113.62 107.70 1wwx n SER 5 Ca 0.00 0.17 -0.37 0.00 1.01 0.00 0.00 58.87 59.68 1wwx n SER 5 Cb 0.00 -1.21 -0.12 0.00 -1.01 0.00 0.00 64.21 61.87 1wwx n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1wwx s SER 6 N -0.88 5.28 0.00 6.43 0.01 -1.26 -4.96 113.70 118.32 1wwx s SER 6 Ca 0.09 -1.44 0.00 0.00 1.31 0.00 0.00 55.95 55.91 1wwx s SER 6 Cb -0.01 -1.85 0.00 0.00 0.21 0.00 0.00 66.02 64.37 1wwx s SER 6 CO 0.21 -0.40 0.00 0.61 0.41 0.00 0.00 173.24 174.06 1wwx n GLY 7 N 4.75 3.17 3.58 3.44 0.00 -1.26 -5.10 105.19 113.76 1wwx n GLY 7 Ca -0.10 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 1wwx n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wwx s SER 8 N 0.00 6.56 0.05 1.61 0.15 -1.26 -4.86 113.70 115.95 1wwx s SER 8 Ca 0.00 0.33 -0.02 0.00 0.70 0.00 0.00 55.95 56.96 1wwx s SER 8 Cb 0.00 -2.42 -0.01 0.00 -1.71 0.00 0.00 66.02 61.88 1wwx s SER 8 CO 0.00 -0.83 -0.04 -0.24 1.20 0.00 0.00 173.24 173.33 1wwx n SER 9 N 6.65 0.98 -4.75 5.45 2.88 -1.26 -4.86 113.62 118.71 1wwx n SER 9 Ca 0.04 0.13 -0.40 0.00 -1.33 0.00 0.00 58.87 57.32 1wwx n SER 9 Cb 0.48 -0.32 -0.05 0.00 -0.75 0.00 0.00 64.21 63.57 1wwx n SER 9 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1wwx s HIS 10 N -2.09 3.84 0.03 0.66 3.76 -1.26 -4.99 115.29 115.24 1wwx s HIS 10 Ca -0.03 1.64 -0.27 0.00 -0.15 0.00 0.00 55.06 56.24 1wwx s HIS 10 Cb 0.01 -2.86 -0.17 0.00 1.11 0.00 0.00 32.58 30.67 1wwx s HIS 10 CO 0.05 0.37 1.34 1.25 -0.85 0.00 0.00 174.74 176.89 1wwx h LEU 11 N 4.99 -0.54 -1.03 0.89 5.85 -1.99 -2.67 115.31 120.81 1wwx h LEU 11 Ca -0.45 -0.07 0.41 0.00 0.84 0.00 0.00 57.88 58.61 1wwx h LEU 11 Cb 1.21 0.14 -0.17 0.00 0.37 0.00 0.00 40.66 42.20 1wwx h LEU 11 CO 0.69 -0.23 0.57 4.11 -0.34 0.00 0.00 178.44 183.24 1wwx h TRP 12 N -0.86 0.82 -0.33 1.25 5.08 -1.96 1.23 115.95 121.17 1wwx h TRP 12 Ca -0.07 0.04 -0.16 0.00 1.08 0.00 0.00 58.89 59.78 1wwx h TRP 12 Cb 0.58 -0.19 -0.00 0.00 -3.00 0.00 0.00 29.16 26.55 1wwx h TRP 12 CO 0.00 -0.43 -0.42 0.93 -1.28 0.00 0.00 178.44 177.24 1wwx h GLU 13 N 0.04 0.86 0.40 0.12 5.08 -1.94 -0.68 114.58 118.46 1wwx h GLU 13 Ca 0.84 -0.49 -0.02 0.00 -1.00 0.00 0.00 59.36 58.69 1wwx h GLU 13 Cb 2.22 0.03 0.00 0.00 0.50 0.00 0.00 28.75 31.51 1wwx h GLU 13 CO -0.72 1.13 -0.19 0.35 -1.00 0.00 0.00 179.01 178.58 1wwx h PHE 14 N 0.65 -0.49 -0.61 4.33 3.57 0.18 -0.74 116.94 123.83 1wwx h PHE 14 Ca 0.04 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 1wwx h PHE 14 Cb 1.02 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.89 1wwx h PHE 14 CO 0.07 -0.21 0.25 -0.24 -2.23 0.00 0.00 178.31 175.95 1wwx h VAL 15 N -0.72 1.21 -0.63 1.41 3.04 -1.04 -2.61 116.25 116.90 1wwx h VAL 15 Ca -0.05 -0.66 -0.06 0.00 -1.01 0.00 0.00 66.70 64.92 1wwx h VAL 15 Cb 0.51 0.48 -0.03 0.00 -2.01 0.00 0.00 31.29 30.24 1wwx h VAL 15 CO 0.09 0.26 0.18 -0.09 -1.01 0.00 0.00 177.57 177.00 1wwx h ARG 16 N 0.87 1.00 -0.17 4.17 2.43 -1.03 -3.05 114.38 118.60 1wwx h ARG 16 Ca 0.21 -0.23 0.04 0.00 -0.81 0.00 0.00 59.98 59.20 1wwx h ARG 16 Cb 0.16 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 29.52 1wwx h ARG 16 CO -0.02 0.89 -0.11 0.22 -1.51 0.00 0.00 179.97 179.43 1wwx h ASP 17 N 0.92 -0.37 -0.88 -3.80 1.82 -0.74 -1.97 116.42 111.40 1wwx h ASP 17 Ca 0.20 0.08 0.23 0.00 -0.39 0.00 0.00 57.03 57.16 1wwx h ASP 17 Cb 0.32 0.19 -0.14 0.00 0.68 0.00 0.00 39.33 40.38 1wwx h ASP 17 CO -0.00 -0.15 0.24 -0.07 -1.61 0.00 0.00 179.24 177.65 1wwx h LEU 18 N -0.12 0.01 -1.16 2.28 4.07 -1.42 1.78 115.31 120.76 1wwx h LEU 18 Ca 0.10 0.20 0.04 0.00 0.08 0.00 0.00 57.88 58.30 1wwx h LEU 18 Cb 0.26 0.26 -0.05 0.00 1.08 0.00 0.00 40.66 42.22 1wwx h LEU 18 CO -0.24 -0.15 0.58 -0.07 -1.08 0.00 0.00 178.44 177.47 1wwx h LEU 19 N 0.21 0.93 -0.03 1.67 3.38 -1.37 -1.41 115.31 118.69 1wwx h LEU 19 Ca 0.55 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.51 1wwx h LEU 19 Cb 1.11 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1wwx h LEU 19 CO -0.65 0.63 -0.65 0.18 0.09 0.00 0.00 178.44 178.04 1wwx n LEU 20 N -4.45 0.69 -4.03 1.67 4.77 0.19 -4.58 117.00 111.27 1wwx n LEU 20 Ca 0.12 -0.17 -0.33 0.00 -0.03 0.00 0.00 56.01 55.59 1wwx n LEU 20 Cb 0.12 -0.17 -0.09 0.00 -2.33 0.00 0.00 43.42 40.96 1wwx n LEU 20 CO 0.34 0.17 0.19 -0.44 -1.33 0.00 0.00 177.39 176.32 1wwx s SER 21 N -2.98 5.52 0.00 -1.43 0.01 0.55 -4.89 113.70 110.48 1wwx s SER 21 Ca 0.11 -3.69 0.15 0.00 1.31 0.00 0.00 55.95 53.82 1wwx s SER 21 Cb 0.17 -1.81 0.76 0.00 0.21 0.00 0.00 66.02 65.35 1wwx s SER 21 CO 0.75 -0.16 1.40 -0.81 0.41 0.00 0.00 173.24 174.83 1wwx n PRO 22 N 2.30 0.22 0.08 12.44 -0.04 -1.25 -1.38 135.00 147.38 1wwx n PRO 22 Ca 0.20 0.14 0.03 0.00 -0.04 0.00 0.00 63.50 63.82 1wwx n PRO 22 Cb 0.36 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.29 1wwx n PRO 22 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1wwx h GLU 23 N 0.00 0.00 0.00 0.54 5.08 -1.90 -3.39 114.58 114.91 1wwx h GLU 23 Ca 0.00 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.04 1wwx h GLU 23 Cb 0.13 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.33 1wwx h GLU 23 CO 0.00 0.30 -2.12 0.39 -1.00 0.00 0.00 179.01 176.58 1wwx n GLU 24 N -2.96 0.45 -1.78 2.33 -0.58 -0.95 -4.95 120.64 112.21 1wwx n GLU 24 Ca -0.05 0.16 -0.42 0.00 -0.42 0.00 0.00 57.16 56.43 1wwx n GLU 24 Cb 0.76 -1.29 -0.03 0.00 -0.57 0.00 0.00 31.44 30.32 1wwx n GLU 24 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1wwx s ASN 25 N -6.43 6.51 -0.65 1.62 2.47 -0.48 -4.95 114.94 113.04 1wwx s ASN 25 Ca -0.27 2.56 0.00 0.00 0.42 0.00 0.00 52.86 55.57 1wwx s ASN 25 Cb 0.09 -2.54 0.16 0.00 -1.45 0.00 0.00 41.25 37.52 1wwx s ASN 25 CO 0.39 -1.01 0.45 0.00 -3.72 0.00 0.00 177.10 173.22 1wwx n GLY 27 N 2.99 -0.48 0.07 0.00 0.00 -1.26 -4.82 105.19 101.70 1wwx n GLY 27 Ca 0.11 0.10 -0.03 0.00 0.00 0.00 0.00 46.02 46.20 1wwx n GLY 27 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1wwx n ILE 28 N -3.99 0.98 -4.14 -0.61 5.41 -1.26 -4.19 119.36 111.55 1wwx n ILE 28 Ca 0.01 -0.74 -0.11 0.00 1.00 0.00 0.00 62.75 62.91 1wwx n ILE 28 Cb 0.53 -0.38 -0.09 0.00 -0.71 0.00 0.00 39.64 38.98 1wwx n ILE 28 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1wwx s LEU 29 N -5.27 1.20 0.03 1.39 1.43 -1.26 -2.63 118.68 113.57 1wwx s LEU 29 Ca -0.08 -1.24 -0.10 0.00 -1.03 0.00 0.00 54.13 51.68 1wwx s LEU 29 Cb 0.09 0.59 0.01 0.00 0.03 0.00 0.00 46.19 46.90 1wwx s LEU 29 CO 0.85 -0.85 0.20 -1.83 0.23 0.00 0.00 176.35 174.95 1wwx s GLU 30 N -4.10 0.67 -0.35 1.70 -1.05 -0.76 -4.83 118.70 109.98 1wwx s GLU 30 Ca 0.31 -0.57 -0.17 0.00 -0.15 0.00 0.00 54.97 54.39 1wwx s GLU 30 Cb 0.06 0.28 -0.01 0.00 -0.44 0.00 0.00 34.13 34.02 1wwx s GLU 30 CO 0.08 -0.19 0.43 -1.58 0.95 0.00 0.00 175.26 174.95 1wwx s TRP 31 N -2.36 3.19 -0.38 4.83 0.23 -1.26 -1.77 118.94 121.42 1wwx s TRP 31 Ca -0.07 0.04 0.22 0.00 -2.03 0.00 0.00 56.10 54.27 1wwx s TRP 31 Cb -0.02 -2.80 -0.08 0.00 0.03 0.00 0.00 33.47 30.61 1wwx s TRP 31 CO -0.03 -0.50 0.88 0.39 0.96 0.00 0.00 176.95 178.66 1wwx n GLU 32 N 5.56 0.45 -3.15 4.98 -0.58 0.33 -4.87 120.64 123.36 1wwx n GLU 32 Ca -0.07 -0.02 0.05 0.00 -0.42 0.00 0.00 57.16 56.70 1wwx n GLU 32 Cb 0.49 -1.63 -0.01 0.00 -0.57 0.00 0.00 31.44 29.72 1wwx n GLU 32 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1wwx s ASP 33 N -4.40 -0.54 0.24 1.62 -1.08 -0.71 -4.89 116.67 106.91 1wwx s ASP 33 Ca -0.00 0.22 0.02 0.00 -0.52 0.00 0.00 52.55 52.27 1wwx s ASP 33 Cb 0.13 1.41 0.27 0.00 -1.46 0.00 0.00 42.92 43.27 1wwx s ASP 33 CO 0.83 -0.10 1.60 0.03 0.52 0.00 0.00 175.17 178.05 1wwx h ARG 34 N 7.74 0.37 0.62 4.34 2.47 -1.89 0.84 114.38 128.86 1wwx h ARG 34 Ca -0.12 -0.21 -0.03 0.00 -1.26 0.00 0.00 59.98 58.36 1wwx h ARG 34 Cb 1.17 0.02 0.01 0.00 -1.65 0.00 0.00 29.97 29.52 1wwx h ARG 34 CO -0.07 0.78 -0.30 0.93 0.56 0.00 0.00 179.97 181.88 1wwx h GLU 35 N 0.29 -0.80 0.02 0.04 5.08 -1.97 -3.23 114.58 114.01 1wwx h GLU 35 Ca 0.01 0.05 -0.21 0.00 -1.00 0.00 0.00 59.36 58.22 1wwx h GLU 35 Cb 0.98 0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.39 1wwx h GLU 35 CO 0.08 -0.49 -0.96 1.96 -1.00 0.00 0.00 179.01 178.60 1wwx h GLN 36 N -0.99 0.07 0.00 2.33 4.20 -1.98 -3.48 115.11 115.26 1wwx h GLN 36 Ca -0.09 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.53 1wwx h GLN 36 Cb 0.68 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.49 1wwx h GLN 36 CO 0.14 0.97 0.00 0.41 -0.67 0.00 0.00 178.83 179.68 1wwx n GLY 37 N 1.16 1.25 3.73 3.46 0.00 0.27 -4.71 105.19 110.35 1wwx n GLY 37 Ca -0.02 -0.25 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 1wwx n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wwx s ILE 38 N -2.00 4.52 0.07 -0.61 1.01 -0.10 -3.22 121.20 120.86 1wwx s ILE 38 Ca 0.00 2.03 0.01 0.00 0.00 0.00 0.00 60.65 62.69 1wwx s ILE 38 Cb 0.00 -4.30 -0.03 0.00 0.01 0.00 0.00 42.46 38.13 1wwx s ILE 38 CO 0.00 0.32 -0.06 0.72 0.00 0.00 0.00 174.94 175.92 1wwx s PHE 39 N -0.02 0.74 0.05 3.97 -0.71 0.67 -0.51 117.98 122.16 1wwx s PHE 39 Ca 0.46 -0.76 0.09 0.00 -1.04 0.00 0.00 56.93 55.68 1wwx s PHE 39 Cb -0.23 -0.44 -0.03 0.00 -1.21 0.00 0.00 43.02 41.11 1wwx s PHE 39 CO 0.29 -0.15 -0.25 0.50 -1.34 0.00 0.00 175.22 174.27 1wwx s ARG 40 N -2.90 1.63 -0.90 1.99 3.52 -0.73 -0.15 118.95 121.41 1wwx s ARG 40 Ca 0.02 -1.09 -0.18 0.00 -0.13 0.00 0.00 55.73 54.36 1wwx s ARG 40 Cb -0.01 -1.82 0.15 0.00 -1.56 0.00 0.00 34.95 31.72 1wwx s ARG 40 CO -0.03 0.46 1.03 0.08 -0.81 0.00 0.00 175.30 176.03 1wwx s VAL 41 N -0.84 4.96 0.11 7.11 1.01 0.48 -1.83 120.40 131.40 1wwx s VAL 41 Ca 0.11 -1.80 -0.21 0.00 0.00 0.00 0.00 61.98 60.08 1wwx s VAL 41 Cb -0.10 -4.69 -0.09 0.00 0.00 0.00 0.00 36.38 31.50 1wwx s VAL 41 CO 0.02 -1.38 1.76 0.58 0.00 0.00 0.00 175.10 176.08 1wwx h VAL 42 N 5.56 1.01 -3.58 2.92 2.07 -1.79 -3.35 116.25 119.09 1wwx h VAL 42 Ca 0.13 -0.05 -0.71 0.00 0.82 0.00 0.00 66.70 66.90 1wwx h VAL 42 Cb 1.03 0.85 -0.34 0.00 -1.52 0.00 0.00 31.29 31.31 1wwx h VAL 42 CO 1.01 0.03 -0.31 -0.54 0.02 0.00 0.00 177.57 177.78 1wwx s LYS 43 N -6.18 2.69 0.36 1.57 1.02 -1.09 -4.91 119.74 113.20 1wwx s LYS 43 Ca -0.13 -2.53 0.07 0.00 0.02 0.00 0.00 55.97 53.40 1wwx s LYS 43 Cb 0.08 -3.81 0.68 0.00 -0.52 0.00 0.00 37.83 34.25 1wwx s LYS 43 CO 0.68 -1.19 1.88 0.66 -0.92 0.00 0.00 175.35 176.46 1wwx h SER 44 N 7.10 0.34 0.20 2.83 4.64 -1.86 0.18 113.55 126.98 1wwx h SER 44 Ca -0.00 -0.07 -0.26 0.00 -0.47 0.00 0.00 61.79 60.98 1wwx h SER 44 Cb 0.96 -0.09 0.02 0.00 -0.31 0.00 0.00 62.40 62.98 1wwx h SER 44 CO 0.72 0.48 -1.09 1.05 -0.87 0.00 0.00 176.83 177.12 1wwx h GLU 45 N 0.34 0.55 -0.12 4.77 4.11 -1.95 -3.16 114.58 119.12 1wwx h GLU 45 Ca 0.07 -0.65 -0.20 0.00 0.07 0.00 0.00 59.36 58.64 1wwx h GLU 45 Cb 0.40 0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1wwx h GLU 45 CO 0.02 1.26 -0.74 0.00 0.07 0.00 0.00 179.01 179.62 1wwx h ALA 46 N 0.50 0.47 -0.12 1.06 0.00 -1.90 -2.42 119.26 116.85 1wwx h ALA 46 Ca -0.13 -0.60 0.03 0.00 0.00 0.00 0.00 54.91 54.21 1wwx h ALA 46 Cb 1.75 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.47 1wwx h ALA 46 CO 0.20 0.73 -0.06 1.25 0.00 0.00 0.00 179.25 181.37 1wwx h LEU 47 N 0.40 -0.20 0.16 0.00 5.85 -0.72 -1.37 115.31 119.42 1wwx h LEU 47 Ca -0.04 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1wwx h LEU 47 Cb 1.34 0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.49 1wwx h LEU 47 CO 0.14 -0.08 -0.07 0.00 -0.34 0.00 0.00 178.44 178.08 1wwx h ALA 48 N 1.06 -0.21 -0.77 1.25 0.00 -1.60 -1.57 119.26 117.41 1wwx h ALA 48 Ca 0.07 -0.17 0.17 0.00 0.00 0.00 0.00 54.91 54.99 1wwx h ALA 48 Cb 0.16 0.08 -0.14 0.00 0.00 0.00 0.00 17.79 17.89 1wwx h ALA 48 CO -0.16 -0.46 -0.05 0.87 0.00 0.00 0.00 179.25 179.46 1wwx h LYS 49 N -0.52 0.06 -0.30 0.00 1.57 -1.31 0.18 116.57 116.25 1wwx h LYS 49 Ca -0.02 -0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 1wwx h LYS 49 Cb 0.41 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1wwx h LYS 49 CO 0.04 0.04 -0.06 0.52 -0.57 0.00 0.00 179.45 179.42 1wwx h MET 50 N 0.07 0.57 0.08 3.15 2.86 -1.22 -3.06 114.93 117.37 1wwx h MET 50 Ca 0.41 -0.21 0.02 0.00 -2.06 0.00 0.00 59.70 57.86 1wwx h MET 50 Cb 0.72 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.30 1wwx h MET 50 CO -0.72 0.76 -0.27 2.35 1.06 0.00 0.00 176.91 180.09 1wwx h TRP 51 N 0.34 -0.72 -0.90 -0.22 -0.00 0.17 -2.21 115.95 112.41 1wwx h TRP 51 Ca 0.08 0.02 0.20 0.00 -0.00 0.00 0.00 58.89 59.19 1wwx h TRP 51 Cb 0.54 0.31 -0.12 0.00 -0.00 0.00 0.00 29.16 29.89 1wwx h TRP 51 CO 0.05 -0.37 0.44 0.78 -0.00 0.00 0.00 178.44 179.34 1wwx h GLY 52 N -0.46 1.55 0.32 2.65 0.00 -0.78 0.21 103.07 106.56 1wwx h GLY 52 Ca 0.04 -0.22 0.20 0.00 0.00 0.00 0.00 47.33 47.36 1wwx h GLY 52 CO -0.18 -0.19 0.59 1.46 0.00 0.00 0.00 176.54 178.23 1wwx h GLN 53 N 0.50 0.37 -0.05 4.80 1.08 -1.29 0.65 115.11 121.16 1wwx h GLN 53 Ca 0.54 -0.02 -0.18 0.00 -1.45 0.00 0.00 58.65 57.54 1wwx h GLN 53 Cb 0.96 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 28.30 1wwx h GLN 53 CO -0.47 0.24 -0.75 0.00 -0.95 0.00 0.00 178.83 176.90 1wwx h ARG 54 N 0.38 0.30 -0.65 1.46 2.47 -0.54 -3.04 114.38 114.76 1wwx h ARG 54 Ca 0.46 -0.26 0.00 0.00 -1.26 0.00 0.00 59.98 58.92 1wwx h ARG 54 Cb 1.19 0.06 0.00 0.00 -1.65 0.00 0.00 29.97 29.57 1wwx h ARG 54 CO -0.16 0.92 0.00 1.63 0.56 0.00 0.00 179.97 182.92 1wwx n LYS 55 N -3.79 2.58 -2.41 0.04 4.76 0.67 -4.92 118.16 115.10 1wwx n LYS 55 Ca -0.04 -2.34 -0.04 0.00 -2.87 0.00 0.00 58.31 53.02 1wwx n LYS 55 Cb 0.72 -1.53 -0.00 0.00 -1.84 0.00 0.00 35.03 32.38 1wwx n LYS 55 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1wwx n LYS 56 N 1.35 -2.67 -0.02 1.97 5.02 0.19 -4.79 118.16 119.22 1wwx n LYS 56 Ca 0.22 0.19 -0.13 0.00 -2.02 0.00 0.00 58.31 56.57 1wwx n LYS 56 Cb 0.57 -4.70 -0.10 0.00 -0.02 0.00 0.00 35.03 30.78 1wwx n LYS 56 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 1wwx h ASN 57 N 0.00 0.02 0.00 4.39 -1.24 -1.74 -3.47 115.58 113.54 1wwx h ASN 57 Ca -0.09 -0.49 0.00 0.00 0.71 0.00 0.00 56.30 56.42 1wwx h ASN 57 Cb 1.03 -0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.07 1wwx h ASN 57 CO 0.11 0.51 0.00 -0.67 -1.29 0.00 0.00 177.43 176.09 1wwx n ASP 58 N -4.84 0.00 -1.63 1.15 -0.08 -1.26 -4.68 116.55 105.21 1wwx n ASP 58 Ca -0.08 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 53.08 1wwx n ASP 58 Cb 0.26 0.00 0.21 0.00 2.34 0.00 0.00 41.12 43.92 1wwx n ASP 58 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 1wwx n ARG 59 N 0.00 2.23 -2.64 -0.67 1.85 -1.26 -5.00 116.66 111.17 1wwx n ARG 59 Ca 0.00 -3.10 -0.41 0.00 -1.00 0.00 0.00 57.85 53.35 1wwx n ARG 59 Cb 0.00 -1.99 -0.05 0.00 -1.05 0.00 0.00 32.46 29.37 1wwx n ARG 59 CO 0.00 0.00 0.00 1.41 -0.01 0.00 0.00 177.63 179.03 1wwx s MET 60 N -3.22 4.72 -0.18 2.89 1.75 -1.26 -5.01 119.30 118.98 1wwx s MET 60 Ca 0.50 1.59 -0.18 0.00 -1.25 0.00 0.00 55.69 56.35 1wwx s MET 60 Cb 0.43 -3.29 0.05 0.00 2.84 0.00 0.00 34.83 34.87 1wwx s MET 60 CO 0.06 0.28 0.51 -0.08 -0.65 0.00 0.00 175.02 175.14 1wwx s THR 61 N -0.64 0.00 0.30 10.11 -1.32 -1.26 -4.42 115.64 118.41 1wwx s THR 61 Ca 0.45 -0.02 0.13 0.00 -1.21 0.00 0.00 61.69 61.04 1wwx s THR 61 Cb -0.27 -0.73 0.32 0.00 -1.51 0.00 0.00 72.50 70.31 1wwx s THR 61 CO 0.34 -0.01 1.35 0.00 -2.21 0.00 0.00 174.62 174.09 1wwx n TYR 62 N 2.65 0.87 -0.22 9.09 9.36 -1.26 0.15 117.16 137.79 1wwx n TYR 62 Ca -0.14 1.02 0.03 0.00 3.32 0.00 0.00 57.90 62.13 1wwx n TYR 62 Cb 0.56 -1.34 0.14 0.00 -0.63 0.00 0.00 39.34 38.07 1wwx n TYR 62 CO 0.00 0.00 0.00 1.49 0.22 0.00 0.00 176.86 178.57 1wwx h GLU 63 N 0.00 0.27 0.15 2.98 4.81 -1.96 0.19 114.58 121.03 1wwx h GLU 63 Ca 0.67 -0.02 -0.27 0.00 -0.13 0.00 0.00 59.36 59.61 1wwx h GLU 63 Cb 1.68 -0.06 0.01 0.00 0.63 0.00 0.00 28.75 31.00 1wwx h GLU 63 CO -0.71 0.18 -1.29 0.87 -0.73 0.00 0.00 179.01 177.33 1wwx h LYS 64 N 0.28 0.31 -0.50 1.92 1.57 0.10 -3.36 116.57 116.89 1wwx h LYS 64 Ca 0.36 -0.53 0.10 0.00 -1.87 0.00 0.00 60.65 58.71 1wwx h LYS 64 Cb 0.56 0.20 -0.08 0.00 0.08 0.00 0.00 32.23 32.99 1wwx h LYS 64 CO -0.44 1.25 -0.02 1.25 -0.57 0.00 0.00 179.45 180.93 1wwx h LEU 65 N -0.23 -0.25 -1.34 2.94 6.46 -0.31 0.18 115.31 122.76 1wwx h LEU 65 Ca -0.26 0.12 0.35 0.00 -0.12 0.00 0.00 57.88 57.98 1wwx h LEU 65 Cb 1.81 0.23 -0.12 0.00 -0.73 0.00 0.00 40.66 41.85 1wwx h LEU 65 CO 0.12 -0.09 0.74 0.28 -0.62 0.00 0.00 178.44 178.88 1wwx h SER 66 N 0.10 0.36 -0.96 1.25 0.02 -0.77 0.98 113.55 114.54 1wwx h SER 66 Ca 0.25 0.12 0.29 0.00 -0.84 0.00 0.00 61.79 61.61 1wwx h SER 66 Cb 0.39 0.08 -0.17 0.00 0.14 0.00 0.00 62.40 62.84 1wwx h SER 66 CO -0.43 -0.07 0.18 0.08 -1.14 0.00 0.00 176.83 175.45 1wwx h ARG 67 N 0.24 0.07 -0.07 3.45 0.11 -1.12 0.98 114.38 118.04 1wwx h ARG 67 Ca 0.71 -0.00 -0.18 0.00 0.10 0.00 0.00 59.98 60.61 1wwx h ARG 67 Cb 2.02 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 33.08 1wwx h ARG 67 CO -0.39 0.04 -0.73 0.00 0.10 0.00 0.00 179.97 179.00 1wwx h ALA 68 N 1.92 0.62 -0.69 0.08 0.00 -0.95 -2.19 119.26 118.05 1wwx h ALA 68 Ca 0.63 -0.61 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1wwx h ALA 68 Cb 1.37 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 1wwx h ALA 68 CO -0.81 0.77 0.26 -0.07 0.00 0.00 0.00 179.25 179.39 1wwx h LEU 69 N 0.25 0.95 0.00 0.00 3.38 0.88 0.01 115.31 120.79 1wwx h LEU 69 Ca -0.03 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1wwx h LEU 69 Cb 1.30 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1wwx h LEU 69 CO 0.12 0.86 -0.28 0.54 0.09 0.00 0.00 178.44 179.77 1wwx n ARG 70 N -4.29 0.22 0.05 1.13 5.12 0.26 -3.42 116.66 115.74 1wwx n ARG 70 Ca 0.06 0.12 0.11 0.00 -1.93 0.00 0.00 57.85 56.22 1wwx n ARG 70 Cb 0.19 -1.70 0.03 0.00 -1.16 0.00 0.00 32.46 29.82 1wwx n ARG 70 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 1wwx n TYR 71 N -2.05 0.52 0.47 -1.55 4.19 -0.79 -3.87 117.16 114.08 1wwx n TYR 71 Ca 0.05 0.15 0.13 0.00 3.31 0.00 0.00 57.90 61.54 1wwx n TYR 71 Cb 0.42 -0.65 0.43 0.00 0.49 0.00 0.00 39.34 40.03 1wwx n TYR 71 CO 0.00 0.00 0.00 1.88 0.91 0.00 0.00 176.86 179.65 1wwx h TYR 72 N 0.00 0.00 0.00 2.98 0.05 -1.04 -2.97 116.97 115.99 1wwx h TYR 72 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1wwx h TYR 72 Cb 0.84 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.58 1wwx h TYR 72 CO 0.00 0.00 0.00 1.88 -1.05 0.00 0.00 178.16 178.99 1wwx h TYR 73 N 0.00 0.00 0.00 4.88 0.05 -1.72 0.03 116.97 120.21 1wwx h TYR 73 Ca 0.00 0.00 -0.26 0.00 0.05 0.00 0.00 58.73 58.52 1wwx h TYR 73 Cb 0.63 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.32 1wwx h TYR 73 CO 0.00 0.00 -1.45 0.87 -1.05 0.00 0.00 178.16 176.53 1wwx h LYS 74 N 0.00 0.00 -0.00 4.88 1.57 -1.77 -3.33 116.57 117.92 1wwx h LYS 74 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1wwx h LYS 74 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1wwx h LYS 74 CO 0.00 0.63 -0.67 0.25 -0.57 0.00 0.00 179.45 179.09 1wwx n THR 75 N -3.13 0.00 0.00 -0.16 -2.24 -1.04 -4.95 114.28 102.76 1wwx n THR 75 Ca -0.11 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1wwx n THR 75 Cb 1.00 0.80 0.00 0.00 -2.10 0.00 0.00 70.33 70.03 1wwx n THR 75 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wwx n GLY 76 N 1.46 2.80 0.31 3.38 0.00 -0.06 -4.77 105.19 108.31 1wwx n GLY 76 Ca 0.07 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.19 1wwx n GLY 76 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1wwx h ILE 77 N 0.00 0.19 -1.63 -0.61 1.08 -1.75 -3.23 117.51 111.56 1wwx h ILE 77 Ca 0.00 -0.03 -0.56 0.00 -0.39 0.00 0.00 64.86 63.88 1wwx h ILE 77 Cb 0.00 0.11 -0.08 0.00 -3.07 0.00 0.00 36.82 33.77 1wwx h ILE 77 CO 0.00 0.01 -0.51 -0.76 -0.69 0.00 0.00 178.15 176.21 1wwx s LEU 78 N -10.88 3.12 -0.13 1.44 1.43 -1.08 -0.91 118.68 111.67 1wwx s LEU 78 Ca -0.13 -1.05 0.02 0.00 -1.03 0.00 0.00 54.13 51.94 1wwx s LEU 78 Cb 0.26 -1.46 0.01 0.00 0.03 0.00 0.00 46.19 45.03 1wwx s LEU 78 CO 0.77 -0.51 -0.18 -1.61 0.23 0.00 0.00 176.35 175.05 1wwx s GLU 79 N -3.89 2.53 0.16 1.70 0.41 0.37 -4.29 118.70 115.69 1wwx s GLU 79 Ca 0.41 -0.67 -0.31 0.00 -0.41 0.00 0.00 54.97 53.98 1wwx s GLU 79 Cb 0.03 -2.12 -0.10 0.00 -1.78 0.00 0.00 34.13 30.16 1wwx s GLU 79 CO 0.22 -0.06 1.68 0.50 -0.49 0.00 0.00 175.26 177.11 1wwx s ARG 80 N 0.98 4.17 -0.01 1.61 3.52 -1.26 -3.81 118.95 124.15 1wwx s ARG 80 Ca -0.05 2.48 0.06 0.00 -0.13 0.00 0.00 55.73 58.08 1wwx s ARG 80 Cb -0.15 -3.27 -0.02 0.00 -1.56 0.00 0.00 34.95 29.95 1wwx s ARG 80 CO -0.03 -0.71 -0.20 0.08 -0.81 0.00 0.00 175.30 173.63 1wwx s VAL 81 N 1.66 1.58 -0.40 7.11 1.01 -1.26 -5.01 120.40 125.08 1wwx s VAL 81 Ca 0.74 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.85 1wwx s VAL 81 Cb -0.45 -1.32 0.22 0.00 0.00 0.00 0.00 36.38 34.82 1wwx s VAL 81 CO 0.32 0.41 1.10 0.47 0.00 0.00 0.00 175.10 177.41 1wwx n ASP 82 N 2.49 2.88 -4.86 3.32 8.00 -1.26 -4.86 116.55 122.26 1wwx n ASP 82 Ca -0.15 -2.39 -0.24 0.00 0.71 0.00 0.00 54.79 52.71 1wwx n ASP 82 Cb 0.53 -0.58 -0.03 0.00 -0.02 0.00 0.00 41.12 41.02 1wwx n ASP 82 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1wwx s ARG 83 N -1.20 2.33 -0.19 -1.24 0.52 -1.26 -5.12 118.95 112.79 1wwx s ARG 83 Ca 0.17 -1.84 -0.08 0.00 -0.52 0.00 0.00 55.73 53.45 1wwx s ARG 83 Cb 0.13 -2.15 -0.04 0.00 0.52 0.00 0.00 34.95 33.41 1wwx s ARG 83 CO 0.04 -0.39 0.09 0.50 0.02 0.00 0.00 175.30 175.56 1wwx s ARG 84 N -4.16 4.05 -1.32 3.54 3.52 -1.26 -4.38 118.95 118.94 1wwx s ARG 84 Ca 0.40 -0.30 -0.03 0.00 -0.13 0.00 0.00 55.73 55.66 1wwx s ARG 84 Cb -0.01 -3.30 0.02 0.00 -1.56 0.00 0.00 34.95 30.10 1wwx s ARG 84 CO 0.23 0.27 0.25 1.28 -0.81 0.00 0.00 175.30 176.52 1wwx n LEU 85 N 3.58 -1.68 -3.89 -0.88 4.32 -1.26 -4.92 117.00 112.27 1wwx n LEU 85 Ca -0.16 -0.08 -0.26 0.00 -0.02 0.00 0.00 56.01 55.49 1wwx n LEU 85 Cb 0.52 -2.43 -0.17 0.00 -1.62 0.00 0.00 43.42 39.72 1wwx n LEU 85 CO 0.36 0.00 -0.43 -0.69 -1.22 0.00 0.00 177.39 175.41 1wwx s VAL 86 N -2.87 0.88 0.37 4.08 1.01 -1.26 -0.39 120.40 122.22 1wwx s VAL 86 Ca 0.16 -0.21 0.05 0.00 0.00 0.00 0.00 61.98 61.98 1wwx s VAL 86 Cb -0.08 -0.92 -0.07 0.00 0.00 0.00 0.00 36.38 35.31 1wwx s VAL 86 CO 0.20 0.34 0.04 -0.31 0.00 0.00 0.00 175.10 175.37 1wwx s TYR 87 N 1.65 2.15 -0.12 5.22 1.51 0.78 -4.61 117.35 123.93 1wwx s TYR 87 Ca 0.03 -0.87 -0.11 0.00 -1.01 0.00 0.00 57.07 55.11 1wwx s TYR 87 Cb -0.13 -1.47 0.03 0.00 -0.11 0.00 0.00 41.96 40.29 1wwx s TYR 87 CO -0.06 0.16 0.32 0.21 -1.11 0.00 0.00 175.55 175.07 1wwx s LYS 88 N -3.82 0.36 -0.04 -0.62 2.20 -1.25 -0.24 119.74 116.34 1wwx s LYS 88 Ca 0.34 0.48 -0.30 0.00 -0.36 0.00 0.00 55.97 56.13 1wwx s LYS 88 Cb 0.09 0.15 -0.03 0.00 -1.51 0.00 0.00 37.83 36.53 1wwx s LYS 88 CO 0.16 -0.06 1.03 -0.06 -0.36 0.00 0.00 175.35 176.06 1wwx s PHE 89 N 0.34 3.54 0.00 4.03 0.08 -1.20 0.14 117.98 124.91 1wwx s PHE 89 Ca -0.01 1.58 0.00 0.00 0.12 0.00 0.00 56.93 58.62 1wwx s PHE 89 Cb -0.03 -3.20 0.00 0.00 -0.57 0.00 0.00 43.02 39.22 1wwx s PHE 89 CO -0.01 -0.33 0.00 0.41 -0.10 0.00 0.00 175.22 175.19 1wwx n GLY 90 N 3.04 -0.28 0.06 4.36 0.00 -0.09 -4.77 105.19 107.51 1wwx n GLY 90 Ca 0.08 -1.30 0.11 0.00 0.00 0.00 0.00 46.02 44.91 1wwx n GLY 90 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1wwx n LYS 91 N 0.00 0.58 0.11 1.61 0.00 -1.24 -4.13 118.16 115.08 1wwx n LYS 91 Ca 0.00 -0.04 -0.01 0.00 -0.00 0.00 0.00 58.31 58.27 1wwx n LYS 91 Cb 0.00 -1.66 0.27 0.00 -0.00 0.00 0.00 35.03 33.65 1wwx n LYS 91 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.40 176.49 1wwx h ASN 92 N 0.00 0.22 -4.24 -5.58 -0.26 -1.83 -3.44 115.58 100.46 1wwx h ASN 92 Ca 0.00 -0.08 -0.49 0.00 -0.56 0.00 0.00 56.30 55.17 1wwx h ASN 92 Cb 0.96 -0.06 0.12 0.00 -1.06 0.00 0.00 38.32 38.28 1wwx h ASN 92 CO 0.00 0.55 0.31 0.00 -1.06 0.00 0.00 177.43 177.24 1wwx s ALA 93 N -4.29 2.07 -0.11 -0.83 0.00 -1.26 -4.90 121.76 112.43 1wwx s ALA 93 Ca -0.05 -0.17 -0.24 0.00 0.00 0.00 0.00 51.96 51.51 1wwx s ALA 93 Cb 0.14 -3.13 0.06 0.00 0.00 0.00 0.00 23.12 20.19 1wwx s ALA 93 CO 0.76 -1.89 0.58 -3.38 0.00 0.00 0.00 175.76 171.83 1wwx s HIS 94 N -3.10 -0.57 0.00 0.00 -3.43 -1.26 -4.97 115.29 101.96 1wwx s HIS 94 Ca 0.61 1.16 0.00 0.00 -0.80 0.00 0.00 55.06 56.04 1wwx s HIS 94 Cb -0.15 0.28 0.00 0.00 -1.43 0.00 0.00 32.58 31.28 1wwx s HIS 94 CO 0.55 -0.45 0.00 0.41 -2.00 0.00 0.00 174.74 173.25 1wwx n GLY 95 N 1.71 3.43 0.07 -1.38 0.00 -1.26 -4.93 105.19 102.83 1wwx n GLY 95 Ca -0.17 -1.07 -0.11 0.00 0.00 0.00 0.00 46.02 44.67 1wwx n GLY 95 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1wwx h TRP 96 N 0.00 0.00 -3.38 1.61 5.08 -1.95 -3.46 115.95 113.85 1wwx h TRP 96 Ca 0.00 0.00 -0.57 0.00 1.08 0.00 0.00 58.89 59.40 1wwx h TRP 96 Cb 0.00 0.00 0.15 0.00 -3.00 0.00 0.00 29.16 26.31 1wwx h TRP 96 CO 0.00 0.75 0.09 0.00 -1.28 0.00 0.00 178.44 178.00 1wwx n GLN 97 N -4.64 1.01 -2.09 0.12 10.64 -1.26 -4.98 117.38 116.18 1wwx n GLN 97 Ca -0.09 0.38 -0.28 0.00 -1.83 0.00 0.00 57.00 55.18 1wwx n GLN 97 Cb 0.37 -2.09 0.06 0.00 -0.86 0.00 0.00 30.24 27.72 1wwx n GLN 97 CO 0.00 0.00 0.00 -2.00 -1.83 0.00 0.00 177.06 173.23 1wwx s GLU 98 N -2.47 2.43 -0.13 2.61 2.56 -1.26 -5.08 118.70 117.36 1wwx s GLU 98 Ca 0.71 0.05 -0.01 0.00 0.00 0.00 0.00 54.97 55.73 1wwx s GLU 98 Cb -0.46 -2.10 -0.02 0.00 2.00 0.00 0.00 34.13 33.56 1wwx s GLU 98 CO 0.51 -1.18 -0.12 0.16 -0.56 0.00 0.00 175.26 174.07 1wwx s ASP 99 N -4.46 4.15 -0.05 -1.70 1.47 -1.26 -5.09 116.67 109.73 1wwx s ASP 99 Ca 0.59 -0.29 -0.30 0.00 1.18 0.00 0.00 52.55 53.73 1wwx s ASP 99 Cb -0.11 -1.62 -0.04 0.00 -0.34 0.00 0.00 42.92 40.81 1wwx s ASP 99 CO 0.47 0.17 1.30 -0.54 0.68 0.00 0.00 175.17 177.25 1wwx s LYS 100 N 0.32 4.30 0.16 2.11 1.02 -1.26 -5.01 119.74 121.38 1wwx s LYS 100 Ca -0.09 1.79 -0.05 0.00 0.02 0.00 0.00 55.97 57.64 1wwx s LYS 100 Cb -0.15 -3.61 -0.02 0.00 -0.52 0.00 0.00 37.83 33.52 1wwx s LYS 100 CO 0.05 -0.54 0.19 -0.51 -0.92 0.00 0.00 175.35 173.62 1wwx s LEU 101 N 2.53 1.26 -0.66 3.17 1.43 -1.26 -5.10 118.68 120.04 1wwx s LEU 101 Ca 0.59 -1.06 -0.27 0.00 -1.03 0.00 0.00 54.13 52.37 1wwx s LEU 101 Cb -0.27 0.80 -0.00 0.00 0.03 0.00 0.00 46.19 46.75 1wwx s LEU 101 CO 0.23 -0.84 1.64 -0.55 0.23 0.00 0.00 176.35 177.06 1wwx s SER 102 N -3.02 5.61 0.00 2.29 0.15 -1.26 -4.87 113.70 112.60 1wwx s SER 102 Ca 0.22 0.04 0.00 0.00 0.70 0.00 0.00 55.95 56.91 1wwx s SER 102 Cb 0.05 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.82 1wwx s SER 102 CO 0.02 -2.17 0.00 0.61 1.20 0.00 0.00 173.24 172.90 1wwx n GLY 103 N 5.58 2.13 3.77 9.45 0.00 -1.26 -5.16 105.19 119.69 1wwx n GLY 103 Ca 0.14 -0.29 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 1wwx n GLY 103 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wwx s PRO 104 N -1.70 2.77 -0.01 1.61 0.04 -1.26 -5.07 135.00 131.38 1wwx s PRO 104 Ca 0.00 1.37 -0.15 0.00 0.04 0.00 0.00 61.00 62.26 1wwx s PRO 104 Cb 0.00 -1.95 0.02 0.00 0.04 0.00 0.00 34.50 32.62 1wwx s PRO 104 CO 0.00 -1.27 0.32 -1.12 0.04 0.00 0.00 177.00 174.97 1wwx s SER 105 N -2.64 -0.19 -0.30 6.66 0.01 -1.26 -5.14 113.70 110.83 1wwx s SER 105 Ca 0.66 0.05 -0.08 0.00 1.31 0.00 0.00 55.95 57.90 1wwx s SER 105 Cb -0.20 0.32 0.19 0.00 0.21 0.00 0.00 66.02 66.54 1wwx s SER 105 CO 0.42 -0.48 0.91 -0.55 0.41 0.00 0.00 173.24 173.95 1wwx s SER 106 N -1.45 -0.77 0.00 2.44 0.15 -1.26 -5.33 113.70 107.48 1wwx s SER 106 Ca -0.12 0.28 0.00 0.00 0.70 0.00 0.00 55.95 56.81 1wwx s SER 106 Cb -0.04 1.57 0.00 0.00 -1.71 0.00 0.00 66.02 65.83 1wwx s SER 106 CO 0.03 -0.14 0.00 0.61 1.20 0.00 0.00 173.24 174.94