#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 -4.66 -4.41 1.61 2.88 -1.26 -4.98 113.62 102.81 1wwx n SER 2 Ca 0.00 -0.68 -0.34 0.00 -1.33 0.00 0.00 58.87 56.52 1wwx n SER 2 Cb 0.00 -4.46 -0.13 0.00 -0.75 0.00 0.00 64.21 58.86 1wwx n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1wwx s SER 3 N -3.56 4.40 0.00 -3.46 0.15 -1.26 -5.01 113.70 104.97 1wwx s SER 3 Ca 0.48 -0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.87 1wwx s SER 3 Cb -0.23 -1.71 0.00 0.00 -1.71 0.00 0.00 66.02 62.37 1wwx s SER 3 CO 0.78 0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.95 1wwx n GLY 4 N 3.86 1.28 3.15 9.45 0.00 -1.26 -4.30 105.19 117.37 1wwx n GLY 4 Ca -0.18 0.51 0.05 0.00 0.00 0.00 0.00 46.02 46.41 1wwx n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wwx s SER 5 N -3.15 -0.53 0.00 1.61 1.04 -1.26 -5.18 113.70 106.23 1wwx s SER 5 Ca 0.00 0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.71 1wwx s SER 5 Cb 0.00 1.43 0.00 0.00 0.10 0.00 0.00 66.02 67.55 1wwx s SER 5 CO 0.00 -0.10 0.00 -0.24 0.98 0.00 0.00 173.24 173.88 1wwx n SER 6 N 5.42 0.00 0.00 7.02 2.88 -1.26 -5.13 113.62 122.54 1wwx n SER 6 Ca -0.04 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.50 1wwx n SER 6 Cb 0.54 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 1wwx n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wwx n GLY 7 N -0.07 0.79 3.26 0.46 0.00 -1.26 -5.04 105.19 103.33 1wwx n GLY 7 Ca 0.00 -0.40 -0.14 0.00 0.00 0.00 0.00 46.02 45.49 1wwx n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wwx s SER 8 N 0.00 -0.23 -0.25 1.61 0.01 -1.26 -5.14 113.70 108.44 1wwx s SER 8 Ca 0.00 0.15 0.01 0.00 1.31 0.00 0.00 55.95 57.42 1wwx s SER 8 Cb 0.00 0.34 0.07 0.00 0.21 0.00 0.00 66.02 66.64 1wwx s SER 8 CO 0.00 -0.45 -0.04 -0.94 0.41 0.00 0.00 173.24 172.22 1wwx s SER 9 N -1.28 3.98 -0.03 2.44 1.04 -1.26 -5.03 113.70 113.56 1wwx s SER 9 Ca -0.13 -1.29 0.00 0.00 0.48 0.00 0.00 55.95 55.01 1wwx s SER 9 Cb -0.05 -1.22 0.03 0.00 0.10 0.00 0.00 66.02 64.87 1wwx s SER 9 CO 0.05 -0.25 -0.01 -1.00 0.98 0.00 0.00 173.24 173.01 1wwx s HIS 10 N 1.35 0.39 0.09 5.02 3.76 -1.26 -5.05 115.29 119.59 1wwx s HIS 10 Ca -0.04 -0.04 -0.17 0.00 -0.15 0.00 0.00 55.06 54.66 1wwx s HIS 10 Cb -0.19 -0.46 -0.04 0.00 1.11 0.00 0.00 32.58 33.00 1wwx s HIS 10 CO -0.07 -0.14 1.14 -0.11 -0.85 0.00 0.00 174.74 174.70 1wwx n LEU 11 N 4.14 -0.58 -0.39 0.89 -0.00 -1.26 0.20 117.00 120.00 1wwx n LEU 11 Ca -0.26 1.27 0.31 0.00 -0.00 0.00 0.00 56.01 57.34 1wwx n LEU 11 Cb 0.50 -0.27 0.61 0.00 -0.00 0.00 0.00 43.42 44.27 1wwx n LEU 11 CO 0.22 -0.94 1.25 4.11 -0.00 0.00 0.00 177.39 182.04 1wwx h TRP 12 N 0.00 0.47 0.06 1.96 5.08 -1.97 0.47 115.95 122.02 1wwx h TRP 12 Ca 0.09 0.02 -0.26 0.00 1.08 0.00 0.00 58.89 59.81 1wwx h TRP 12 Cb 0.22 -0.13 0.02 0.00 -3.00 0.00 0.00 29.16 26.28 1wwx h TRP 12 CO -0.84 -0.05 -1.07 0.93 -1.28 0.00 0.00 178.44 176.13 1wwx h GLU 13 N 0.20 0.63 0.08 0.12 5.08 0.19 -2.78 114.58 118.10 1wwx h GLU 13 Ca 0.69 -0.75 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1wwx h GLU 13 Cb 2.14 0.23 -0.01 0.00 0.50 0.00 0.00 28.75 31.61 1wwx h GLU 13 CO -0.29 1.32 -0.09 0.35 -1.00 0.00 0.00 179.01 179.31 1wwx h PHE 14 N 0.26 -0.23 -0.87 4.33 3.04 0.37 0.21 116.94 124.04 1wwx h PHE 14 Ca -0.15 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.79 1wwx h PHE 14 Cb 1.74 0.09 -0.04 0.00 2.56 0.00 0.00 35.95 40.30 1wwx h PHE 14 CO 0.12 -0.14 0.48 -0.24 -2.02 0.00 0.00 178.31 176.51 1wwx h VAL 15 N -0.20 1.25 -0.03 1.41 3.04 -1.27 -2.50 116.25 117.95 1wwx h VAL 15 Ca 0.01 -0.61 -0.00 0.00 -1.01 0.00 0.00 66.70 65.08 1wwx h VAL 15 Cb 0.20 0.07 -0.00 0.00 -2.01 0.00 0.00 31.29 29.55 1wwx h VAL 15 CO -0.03 0.28 0.00 -0.09 -1.01 0.00 0.00 177.57 176.72 1wwx h ARG 16 N 1.21 0.04 -0.96 4.17 2.43 -1.18 -2.92 114.38 117.17 1wwx h ARG 16 Ca 0.31 -0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.65 1wwx h ARG 16 Cb 0.02 -0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 29.48 1wwx h ARG 16 CO -0.05 0.28 0.61 0.22 -1.51 0.00 0.00 179.97 179.52 1wwx h ASP 17 N -0.20 0.67 -0.58 -3.80 3.58 -0.42 -0.66 116.42 115.00 1wwx h ASP 17 Ca 0.01 0.07 0.08 0.00 0.42 0.00 0.00 57.03 57.61 1wwx h ASP 17 Cb 0.26 -0.06 -0.07 0.00 1.72 0.00 0.00 39.33 41.18 1wwx h ASP 17 CO 0.00 0.28 0.22 -0.07 -2.88 0.00 0.00 179.24 176.79 1wwx h LEU 18 N 0.67 0.23 -0.69 2.28 3.38 -1.25 0.85 115.31 120.79 1wwx h LEU 18 Ca 0.52 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.55 1wwx h LEU 18 Cb 0.91 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 1wwx h LEU 18 CO -0.28 0.15 0.42 -0.07 0.09 0.00 0.00 178.44 178.75 1wwx h LEU 19 N 0.41 0.83 0.00 1.67 3.38 -1.13 -1.65 115.31 118.82 1wwx h LEU 19 Ca 0.29 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1wwx h LEU 19 Cb 0.33 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1wwx h LEU 19 CO -0.28 0.64 -0.01 0.18 0.09 0.00 0.00 178.44 179.06 1wwx n LEU 20 N -4.55 0.57 -3.94 1.67 4.77 -0.64 -4.33 117.00 110.54 1wwx n LEU 20 Ca 0.06 0.55 -0.30 0.00 -0.03 0.00 0.00 56.01 56.29 1wwx n LEU 20 Cb 0.05 -0.37 -0.12 0.00 -2.33 0.00 0.00 43.42 40.65 1wwx n LEU 20 CO 0.37 -0.12 -0.04 -0.44 -1.33 0.00 0.00 177.39 175.82 1wwx s SER 21 N -4.06 4.79 0.00 -1.43 0.01 0.29 -4.91 113.70 108.39 1wwx s SER 21 Ca 0.12 -3.54 0.14 0.00 1.31 0.00 0.00 55.95 53.98 1wwx s SER 21 Cb 0.14 -1.67 0.61 0.00 0.21 0.00 0.00 66.02 65.31 1wwx s SER 21 CO 0.58 -0.15 1.45 -0.81 0.41 0.00 0.00 173.24 174.72 1wwx n PRO 22 N 2.42 0.01 0.10 12.44 -0.04 -1.24 -1.93 135.00 146.76 1wwx n PRO 22 Ca 0.15 0.25 -0.03 0.00 -0.04 0.00 0.00 63.50 63.83 1wwx n PRO 22 Cb 0.34 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.32 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 -1.91 -3.35 114.58 114.95 1wwx h GLU 23 Ca 0.00 0.00 -0.40 0.00 -1.00 0.00 0.00 59.36 57.96 1wwx h GLU 23 Cb 0.24 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.42 1wwx h GLU 23 CO 0.00 0.78 -2.47 0.39 -1.00 0.00 0.00 179.01 176.71 1wwx n GLU 24 N -3.47 0.65 -2.51 2.33 -0.58 -1.03 -4.93 120.64 111.10 1wwx n GLU 24 Ca -0.00 0.16 -0.42 0.00 -0.42 0.00 0.00 57.16 56.48 1wwx n GLU 24 Cb 0.79 -1.52 -0.03 0.00 -0.57 0.00 0.00 31.44 30.11 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 -6.60 7.15 -0.63 1.62 2.47 -0.81 -5.00 114.94 113.13 1wwx s ASN 25 Ca -0.35 1.87 0.01 0.00 0.42 0.00 0.00 52.86 54.81 1wwx s ASN 25 Cb 0.09 -2.57 0.16 0.00 -1.45 0.00 0.00 41.25 37.48 1wwx s ASN 25 CO 0.60 -0.45 0.42 0.00 -3.72 0.00 0.00 177.10 173.95 1wwx n GLY 27 N 2.92 -0.47 0.10 0.00 0.00 -1.26 -4.85 105.19 101.64 1wwx n GLY 27 Ca 0.11 0.15 -0.13 0.00 0.00 0.00 0.00 46.02 46.15 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 -4.48 1.62 -4.35 -0.61 5.41 -1.26 -4.10 119.36 111.58 1wwx n ILE 28 Ca 0.07 -0.75 -0.19 0.00 1.00 0.00 0.00 62.75 62.88 1wwx n ILE 28 Cb 0.50 -1.18 -0.10 0.00 -0.71 0.00 0.00 39.64 38.16 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 -6.30 1.73 -0.03 1.39 1.43 -1.26 -0.14 118.68 115.50 1wwx s LEU 29 Ca -0.13 -1.49 -0.05 0.00 -1.03 0.00 0.00 54.13 51.43 1wwx s LEU 29 Cb 0.07 0.06 0.01 0.00 0.03 0.00 0.00 46.19 46.36 1wwx s LEU 29 CO 0.79 -0.81 0.12 -1.61 0.23 0.00 0.00 176.35 175.07 1wwx s GLU 30 N -3.90 0.24 -0.77 1.70 2.02 -0.30 -4.75 118.70 112.94 1wwx s GLU 30 Ca 0.35 -0.02 -0.22 0.00 0.02 0.00 0.00 54.97 55.11 1wwx s GLU 30 Cb 0.06 0.11 0.09 0.00 0.10 0.00 0.00 34.13 34.48 1wwx s GLU 30 CO 0.16 -0.04 1.07 -1.58 0.02 0.00 0.00 175.26 174.88 1wwx s TRP 31 N -0.39 2.78 0.11 1.61 0.23 -1.26 -1.46 118.94 120.56 1wwx s TRP 31 Ca -0.05 -0.81 -0.02 0.00 -2.03 0.00 0.00 56.10 53.20 1wwx s TRP 31 Cb -0.03 -4.34 -0.19 0.00 0.03 0.00 0.00 33.47 28.94 1wwx s TRP 31 CO 0.00 -1.64 1.23 0.93 0.96 0.00 0.00 176.95 178.43 1wwx h GLU 32 N 9.38 0.25 -1.09 4.98 4.39 -1.75 -3.44 114.58 127.31 1wwx h GLU 32 Ca -0.11 -0.36 0.01 0.00 0.34 0.00 0.00 59.36 59.24 1wwx h GLU 32 Cb 1.05 0.12 -0.22 0.00 -0.10 0.00 0.00 28.75 29.61 1wwx h GLU 32 CO 1.18 1.12 -0.38 -0.51 -1.16 0.00 0.00 179.01 179.27 1wwx s ASP 33 N -7.05 -1.37 0.11 1.42 1.01 -0.83 -4.96 116.67 105.00 1wwx s ASP 33 Ca -0.04 0.25 -0.16 0.00 0.71 0.00 0.00 52.55 53.31 1wwx s ASP 33 Cb 0.08 1.95 -0.04 0.00 1.01 0.00 0.00 42.92 45.92 1wwx s ASP 33 CO 0.86 -0.30 1.57 0.03 0.21 0.00 0.00 175.17 177.54 1wwx h ARG 34 N 8.02 0.59 -0.09 8.23 2.47 -1.85 0.96 114.38 132.71 1wwx h ARG 34 Ca -0.06 -0.18 0.00 0.00 -1.26 0.00 0.00 59.98 58.49 1wwx h ARG 34 Cb 1.18 -0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 29.43 1wwx h ARG 34 CO 0.18 0.70 0.06 0.93 0.56 0.00 0.00 179.97 182.39 1wwx h GLU 35 N 0.41 0.11 0.00 0.04 4.39 -1.96 -2.74 114.58 114.83 1wwx h GLU 35 Ca 0.10 -0.01 -0.15 0.00 0.34 0.00 0.00 59.36 59.64 1wwx h GLU 35 Cb 0.41 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.02 1wwx h GLU 35 CO 0.01 0.07 -0.72 1.96 -1.16 0.00 0.00 179.01 179.18 1wwx h GLN 36 N 0.12 0.00 -0.05 2.33 4.20 -1.97 -3.48 115.11 116.26 1wwx h GLN 36 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1wwx h GLN 36 Cb -0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.77 1wwx h GLN 36 CO -0.01 0.72 0.00 0.41 -0.67 0.00 0.00 178.83 179.28 1wwx n GLY 37 N 0.76 1.00 3.82 3.46 0.00 0.31 -4.80 105.19 109.74 1wwx n GLY 37 Ca -0.00 -0.53 -0.37 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.05 5.31 0.02 -0.61 1.01 0.28 -2.05 121.20 123.12 1wwx s ILE 38 Ca 0.00 0.48 -0.01 0.00 0.00 0.00 0.00 60.65 61.12 1wwx s ILE 38 Cb 0.00 -3.55 -0.02 0.00 0.01 0.00 0.00 42.46 38.90 1wwx s ILE 38 CO 0.00 0.54 -0.01 0.72 0.00 0.00 0.00 174.94 176.19 1wwx s PHE 39 N -0.59 0.26 0.04 3.97 -0.71 0.58 -1.95 117.98 119.58 1wwx s PHE 39 Ca 0.17 -0.55 0.05 0.00 -1.04 0.00 0.00 56.93 55.56 1wwx s PHE 39 Cb -0.14 -0.20 -0.04 0.00 -1.21 0.00 0.00 43.02 41.44 1wwx s PHE 39 CO 0.06 -0.22 -0.07 0.50 -1.34 0.00 0.00 175.22 174.15 1wwx s ARG 40 N -1.71 2.41 -1.12 1.99 3.52 -0.53 -0.68 118.95 122.84 1wwx s ARG 40 Ca -0.13 -0.83 -0.14 0.00 -0.13 0.00 0.00 55.73 54.50 1wwx s ARG 40 Cb -0.08 -2.44 0.19 0.00 -1.56 0.00 0.00 34.95 31.06 1wwx s ARG 40 CO -0.02 0.57 1.27 0.08 -0.81 0.00 0.00 175.30 176.39 1wwx s VAL 41 N -1.09 5.22 0.19 7.11 1.01 -0.07 -1.15 120.40 131.63 1wwx s VAL 41 Ca 0.19 -2.61 -0.16 0.00 0.00 0.00 0.00 61.98 59.40 1wwx s VAL 41 Cb -0.11 -4.80 0.16 0.00 0.00 0.00 0.00 36.38 31.63 1wwx s VAL 41 CO 0.10 -1.47 1.65 0.58 0.00 0.00 0.00 175.10 175.96 1wwx h VAL 42 N 4.66 0.49 -3.69 2.92 2.07 -0.82 -3.35 116.25 118.54 1wwx h VAL 42 Ca 0.25 0.00 -0.68 0.00 0.82 0.00 0.00 66.70 67.09 1wwx h VAL 42 Cb 0.91 0.49 -0.35 0.00 -1.52 0.00 0.00 31.29 30.82 1wwx h VAL 42 CO 1.14 0.00 -0.68 -0.54 0.02 0.00 0.00 177.57 177.51 1wwx s LYS 43 N -6.22 2.11 0.28 1.57 1.02 -0.45 -4.94 119.74 113.10 1wwx s LYS 43 Ca -0.14 -1.54 0.26 0.00 0.02 0.00 0.00 55.97 54.57 1wwx s LYS 43 Cb 0.17 -3.26 0.79 0.00 -0.52 0.00 0.00 37.83 35.01 1wwx s LYS 43 CO 0.72 -0.80 1.75 0.66 -0.92 0.00 0.00 175.35 176.76 1wwx h SER 44 N 7.91 0.00 0.10 2.83 4.64 -1.86 -2.48 113.55 124.68 1wwx h SER 44 Ca -0.15 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.84 1wwx h SER 44 Cb 1.05 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.12 1wwx h SER 44 CO 0.57 0.00 -1.78 1.05 -0.87 0.00 0.00 176.83 175.80 1wwx h GLU 45 N 0.00 0.21 -0.31 4.77 4.11 -1.95 -3.30 114.58 118.11 1wwx h GLU 45 Ca 0.00 -0.35 -0.15 0.00 0.07 0.00 0.00 59.36 58.93 1wwx h GLU 45 Cb 0.71 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 1wwx h GLU 45 CO 0.00 1.17 -0.39 0.00 0.07 0.00 0.00 179.01 179.86 1wwx h ALA 46 N -0.08 0.72 -0.28 1.06 0.00 -1.97 -0.94 119.26 117.77 1wwx h ALA 46 Ca -0.40 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.07 1wwx h ALA 46 Cb 1.84 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 1wwx h ALA 46 CO 0.02 0.66 0.19 1.25 0.00 0.00 0.00 179.25 181.36 1wwx h LEU 47 N 0.61 0.32 -0.08 0.00 5.85 -1.62 -1.39 115.31 119.00 1wwx h LEU 47 Ca 0.05 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 1wwx h LEU 47 Cb 0.94 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.89 1wwx h LEU 47 CO 0.09 0.23 -0.11 0.00 -0.34 0.00 0.00 178.44 178.31 1wwx h ALA 48 N 1.11 0.11 -0.67 1.25 0.00 -1.63 -1.92 119.26 117.51 1wwx h ALA 48 Ca 0.10 -0.32 0.14 0.00 0.00 0.00 0.00 54.91 54.83 1wwx h ALA 48 Cb -0.04 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 17.63 1wwx h ALA 48 CO -0.03 -0.02 0.13 0.87 0.00 0.00 0.00 179.25 180.20 1wwx h LYS 49 N -0.25 0.23 -0.37 0.00 1.57 -1.08 0.14 116.57 116.81 1wwx h LYS 49 Ca 0.01 -0.01 -0.13 0.00 -1.87 0.00 0.00 60.65 58.64 1wwx h LYS 49 Cb 0.66 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 1wwx h LYS 49 CO 0.03 0.15 -0.29 0.52 -0.57 0.00 0.00 179.45 179.29 1wwx h MET 50 N 0.24 0.85 0.28 3.15 2.86 -1.28 -3.18 114.93 117.86 1wwx h MET 50 Ca 0.36 -0.42 -0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1wwx h MET 50 Cb 0.59 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 1wwx h MET 50 CO -0.48 1.06 -0.23 2.35 1.06 0.00 0.00 176.91 180.68 1wwx h TRP 51 N 0.65 -0.60 -0.74 -0.22 -0.00 -0.32 -2.83 115.95 111.90 1wwx h TRP 51 Ca 0.07 -0.00 0.16 0.00 -0.00 0.00 0.00 58.89 59.12 1wwx h TRP 51 Cb 0.87 0.22 -0.13 0.00 -0.00 0.00 0.00 29.16 30.12 1wwx h TRP 51 CO 0.06 -0.34 -0.07 0.78 -0.00 0.00 0.00 178.44 178.87 1wwx h GLY 52 N -0.52 0.70 -0.04 2.65 0.00 -0.83 0.25 103.07 105.29 1wwx h GLY 52 Ca -0.02 0.16 0.23 0.00 0.00 0.00 0.00 47.33 47.70 1wwx h GLY 52 CO -0.02 -0.28 0.61 1.46 0.00 0.00 0.00 176.54 178.31 1wwx h GLN 53 N 0.06 0.61 -0.44 4.80 1.08 -1.48 1.01 115.11 120.75 1wwx h GLN 53 Ca 0.38 -0.04 -0.07 0.00 -1.45 0.00 0.00 58.65 57.48 1wwx h GLN 53 Cb 0.64 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.91 1wwx h GLN 53 CO -0.69 0.40 0.00 0.00 -0.95 0.00 0.00 178.83 177.59 1wwx h ARG 54 N 0.63 0.71 -0.56 1.46 2.47 -0.45 -2.48 114.38 116.15 1wwx h ARG 54 Ca 0.61 -0.18 0.00 0.00 -1.26 0.00 0.00 59.98 59.15 1wwx h ARG 54 Cb 1.14 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 29.37 1wwx h ARG 54 CO -0.42 0.73 0.00 1.63 0.56 0.00 0.00 179.97 182.47 1wwx n LYS 55 N -4.23 3.51 -2.94 0.04 4.76 0.10 -4.93 118.16 114.46 1wwx n LYS 55 Ca 0.02 -2.77 -0.18 0.00 -2.87 0.00 0.00 58.31 52.51 1wwx n LYS 55 Cb 0.28 -1.80 -0.00 0.00 -1.84 0.00 0.00 35.03 31.68 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 0.86 -3.04 -3.20 1.97 5.02 0.31 -4.88 118.16 115.20 1wwx n LYS 56 Ca 0.23 0.55 -0.45 0.00 -2.02 0.00 0.00 58.31 56.62 1wwx n LYS 56 Cb 0.82 -5.22 -0.01 0.00 -0.02 0.00 0.00 35.03 30.60 1wwx n LYS 56 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1wwx s ASN 57 N -2.42 6.93 0.62 4.39 3.84 0.43 -4.86 114.94 123.87 1wwx s ASN 57 Ca 0.22 -2.85 0.30 0.00 0.21 0.00 0.00 52.86 50.74 1wwx s ASN 57 Cb -0.11 -2.28 1.62 0.00 -0.55 0.00 0.00 41.25 39.93 1wwx s ASN 57 CO 0.27 -0.62 1.97 0.44 -2.79 0.00 0.00 177.10 176.37 1wwx h ASP 58 N 7.61 0.00 -0.99 -4.21 3.32 -1.90 0.45 116.42 120.69 1wwx h ASP 58 Ca 0.17 0.00 -0.65 0.00 0.02 0.00 0.00 57.03 56.56 1wwx h ASP 58 Cb 0.97 0.00 -0.32 0.00 0.22 0.00 0.00 39.33 40.20 1wwx h ASP 58 CO 0.96 0.00 0.49 -2.11 -1.72 0.00 0.00 179.24 176.86 1wwx n ARG 59 N -3.41 2.91 -3.34 3.56 1.85 -1.26 -4.98 116.66 111.99 1wwx n ARG 59 Ca 0.03 -3.51 -0.38 0.00 -1.00 0.00 0.00 57.85 52.98 1wwx n ARG 59 Cb 0.46 -2.29 -0.06 0.00 -1.05 0.00 0.00 32.46 29.52 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 -3.79 4.30 -0.02 2.89 1.75 0.15 -5.01 119.30 119.56 1wwx s MET 60 Ca 0.61 0.44 -0.18 0.00 -1.25 0.00 0.00 55.69 55.32 1wwx s MET 60 Cb 0.48 -3.41 0.03 0.00 2.84 0.00 0.00 34.83 34.78 1wwx s MET 60 CO -0.02 0.22 0.38 -0.08 -0.65 0.00 0.00 175.02 174.88 1wwx s THR 61 N 0.41 0.05 0.22 10.11 -1.32 -1.26 -4.44 115.64 119.39 1wwx s THR 61 Ca 0.26 -0.37 -0.16 0.00 -1.21 0.00 0.00 61.69 60.20 1wwx s THR 61 Cb -0.15 -0.68 0.23 0.00 -1.51 0.00 0.00 72.50 70.39 1wwx s THR 61 CO 0.11 -0.21 1.43 0.00 -2.21 0.00 0.00 174.62 173.74 1wwx n TYR 62 N 1.24 0.05 -0.33 9.09 9.36 -1.26 0.13 117.16 135.45 1wwx n TYR 62 Ca -0.21 1.13 0.26 0.00 3.32 0.00 0.00 57.90 62.41 1wwx n TYR 62 Cb 0.56 -0.86 0.50 0.00 -0.63 0.00 0.00 39.34 38.92 1wwx n TYR 62 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 1wwx h GLU 63 N 0.00 0.14 0.00 2.98 5.08 -1.97 0.22 114.58 121.03 1wwx h GLU 63 Ca 0.33 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.56 1wwx h GLU 63 Cb 0.56 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 1wwx h GLU 63 CO -0.92 0.09 -0.68 0.87 -1.00 0.00 0.00 179.01 177.38 1wwx h LYS 64 N 0.14 0.00 -0.87 2.33 1.57 0.69 -3.37 116.57 117.06 1wwx h LYS 64 Ca 0.76 0.00 0.23 0.00 -1.87 0.00 0.00 60.65 59.77 1wwx h LYS 64 Cb 1.86 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 34.03 1wwx h LYS 64 CO -0.71 0.86 0.14 1.25 -0.57 0.00 0.00 179.45 180.42 1wwx h LEU 65 N -1.00 -0.18 -1.43 2.94 6.46 0.70 0.63 115.31 123.43 1wwx h LEU 65 Ca -0.18 0.21 0.30 0.00 -0.12 0.00 0.00 57.88 58.10 1wwx h LEU 65 Cb 1.05 0.33 -0.09 0.00 -0.73 0.00 0.00 40.66 41.22 1wwx h LEU 65 CO -0.11 -0.21 0.71 0.77 -0.62 0.00 0.00 178.44 178.99 1wwx h SER 66 N 0.14 0.37 -1.00 1.25 4.64 -0.77 0.09 113.55 118.27 1wwx h SER 66 Ca 0.53 0.08 0.39 0.00 -0.47 0.00 0.00 61.79 62.32 1wwx h SER 66 Cb 1.05 0.03 -0.18 0.00 -0.31 0.00 0.00 62.40 63.00 1wwx h SER 66 CO -0.71 0.03 0.49 0.08 -0.87 0.00 0.00 176.83 175.85 1wwx h ARG 67 N 0.30 0.04 0.01 4.77 0.11 0.10 1.69 114.38 121.41 1wwx h ARG 67 Ca 0.63 -0.00 -0.21 0.00 0.10 0.00 0.00 59.98 60.49 1wwx h ARG 67 Cb 1.75 -0.01 -0.03 0.00 1.11 0.00 0.00 29.97 32.79 1wwx h ARG 67 CO -0.29 0.03 -1.00 0.00 0.10 0.00 0.00 179.97 178.81 1wwx h ALA 68 N 1.98 0.36 -0.44 0.08 0.00 -1.13 -1.81 119.26 118.30 1wwx h ALA 68 Ca 0.81 -0.88 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 1wwx h ALA 68 Cb 2.07 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.71 1wwx h ALA 68 CO -0.76 1.19 -0.19 -0.07 0.00 0.00 0.00 179.25 179.42 1wwx h LEU 69 N 0.01 0.88 0.00 0.00 3.38 0.23 -1.56 115.31 118.26 1wwx h LEU 69 Ca -0.02 -0.31 -0.09 0.00 0.09 0.00 0.00 57.88 57.55 1wwx h LEU 69 Cb 1.75 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 42.25 1wwx h LEU 69 CO 0.14 1.05 -0.88 0.03 0.09 0.00 0.00 178.44 178.86 1wwx h ARG 70 N 0.76 0.00 0.00 1.13 2.47 -0.81 -3.28 114.38 114.65 1wwx h ARG 70 Ca 0.11 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.83 1wwx h ARG 70 Cb 0.72 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.04 1wwx h ARG 70 CO 0.06 0.24 -0.02 -0.92 0.56 0.00 0.00 179.97 179.89 1wwx h TYR 71 N 0.00 0.00 0.00 3.04 5.03 -1.18 -3.21 116.97 120.66 1wwx h TYR 71 Ca -0.06 0.00 -0.18 0.00 2.58 0.00 0.00 58.73 61.07 1wwx h TYR 71 Cb 1.32 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 39.57 1wwx h TYR 71 CO 0.00 0.00 -0.87 1.88 -1.32 0.00 0.00 178.16 177.85 1wwx h TYR 72 N 0.00 0.02 -0.27 -3.82 0.05 -1.34 -3.18 116.97 108.43 1wwx h TYR 72 Ca 0.00 -0.01 0.08 0.00 0.05 0.00 0.00 58.73 58.85 1wwx h TYR 72 Cb 0.82 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.54 1wwx h TYR 72 CO 0.00 0.87 0.23 1.88 -1.05 0.00 0.00 178.16 180.09 1wwx h TYR 73 N 0.01 0.00 -0.29 4.88 0.05 -1.69 0.47 116.97 120.40 1wwx h TYR 73 Ca -0.01 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.71 1wwx h TYR 73 Cb 1.53 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.26 1wwx h TYR 73 CO 0.00 0.00 -0.03 0.87 -1.05 0.00 0.00 178.16 177.95 1wwx h LYS 74 N 0.00 0.54 0.00 4.88 1.57 -1.74 -3.12 116.57 118.70 1wwx h LYS 74 Ca 0.13 -0.19 -0.06 0.00 -1.87 0.00 0.00 60.65 58.65 1wwx h LYS 74 Cb 0.58 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.84 1wwx h LYS 74 CO -0.00 0.71 -0.72 1.79 -0.57 0.00 0.00 179.45 180.66 1wwx h THR 75 N 0.32 0.33 0.00 -0.16 1.35 -1.39 -3.48 112.91 109.88 1wwx h THR 75 Ca 0.08 -1.53 0.00 0.00 -0.55 0.00 0.00 66.41 64.41 1wwx h THR 75 Cb 0.49 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 1wwx h THR 75 CO 0.02 0.19 0.00 0.61 -0.25 0.00 0.00 175.52 176.09 1wwx n GLY 76 N 1.22 2.56 0.33 5.82 0.00 0.15 -4.83 105.19 110.44 1wwx n GLY 76 Ca -0.01 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.29 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 0.03 -1.91 -0.61 1.08 -1.78 -3.29 117.51 111.03 1wwx h ILE 77 Ca 0.00 -0.01 -0.59 0.00 -0.39 0.00 0.00 64.86 63.87 1wwx h ILE 77 Cb 0.00 -0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 33.64 1wwx h ILE 77 CO 0.00 0.01 -0.62 -0.76 -0.69 0.00 0.00 178.15 176.09 1wwx s LEU 78 N -10.60 2.96 -0.16 1.44 1.43 -1.23 -0.28 118.68 112.24 1wwx s LEU 78 Ca -0.10 -1.02 0.01 0.00 -1.03 0.00 0.00 54.13 51.98 1wwx s LEU 78 Cb 0.33 -1.31 0.02 0.00 0.03 0.00 0.00 46.19 45.26 1wwx s LEU 78 CO 0.78 -0.25 -0.16 -1.61 0.23 0.00 0.00 176.35 175.34 1wwx s GLU 79 N -3.71 2.54 0.03 1.70 2.02 0.26 -4.27 118.70 117.26 1wwx s GLU 79 Ca 0.35 -0.65 -0.30 0.00 0.02 0.00 0.00 54.97 54.38 1wwx s GLU 79 Cb 0.01 -2.26 -0.09 0.00 0.10 0.00 0.00 34.13 31.89 1wwx s GLU 79 CO 0.19 -0.22 1.89 0.50 0.02 0.00 0.00 175.26 177.64 1wwx s ARG 80 N 1.40 4.15 -0.09 1.61 3.52 -1.26 -3.78 118.95 124.49 1wwx s ARG 80 Ca 0.05 2.54 0.01 0.00 -0.13 0.00 0.00 55.73 58.19 1wwx s ARG 80 Cb -0.13 -4.05 -0.02 0.00 -1.56 0.00 0.00 34.95 29.19 1wwx s ARG 80 CO -0.11 -0.92 -0.11 0.08 -0.81 0.00 0.00 175.30 173.43 1wwx s VAL 81 N 4.13 3.31 -0.12 7.11 1.01 -1.26 -5.00 120.40 129.57 1wwx s VAL 81 Ca 0.85 -0.60 -0.00 0.00 0.00 0.00 0.00 61.98 62.22 1wwx s VAL 81 Cb -0.41 -2.36 0.08 0.00 0.00 0.00 0.00 36.38 33.69 1wwx s VAL 81 CO 0.39 0.56 1.99 0.47 0.00 0.00 0.00 175.10 178.51 1wwx n ASP 82 N 2.83 5.72 -4.25 3.32 9.92 -1.26 -4.84 116.55 127.99 1wwx n ASP 82 Ca -0.18 -2.65 -0.27 0.00 -0.53 0.00 0.00 54.79 51.16 1wwx n ASP 82 Cb 0.53 -1.09 -0.05 0.00 -0.64 0.00 0.00 41.12 39.86 1wwx n ASP 82 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1wwx n ARG 83 N 1.04 0.96 -3.60 -1.24 1.74 -1.26 -5.12 116.66 109.18 1wwx n ARG 83 Ca 0.11 -3.10 -0.38 0.00 -0.77 0.00 0.00 57.85 53.71 1wwx n ARG 83 Cb 0.53 0.80 -0.11 0.00 -1.02 0.00 0.00 32.46 32.67 1wwx n ARG 83 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1wwx s ARG 84 N -3.56 3.84 -1.38 5.56 6.06 -1.26 -4.41 118.95 123.79 1wwx s ARG 84 Ca 0.01 -0.39 -0.10 0.00 -2.50 0.00 0.00 55.73 52.75 1wwx s ARG 84 Cb -0.00 -3.64 0.07 0.00 0.06 0.00 0.00 34.95 31.45 1wwx s ARG 84 CO 0.01 -0.22 0.60 1.28 -2.50 0.00 0.00 175.30 174.46 1wwx n LEU 85 N 5.05 -1.85 -3.89 -0.88 7.99 -1.26 -4.89 117.00 117.26 1wwx n LEU 85 Ca -0.14 -0.47 -0.30 0.00 -0.01 0.00 0.00 56.01 55.08 1wwx n LEU 85 Cb 0.52 -2.29 -0.15 0.00 -0.11 0.00 0.00 43.42 41.38 1wwx n LEU 85 CO 0.33 0.22 -0.37 -0.69 -1.51 0.00 0.00 177.39 175.38 1wwx s VAL 86 N -3.04 1.48 0.41 4.08 1.01 -1.26 -0.89 120.40 122.20 1wwx s VAL 86 Ca 0.45 -1.56 0.08 0.00 0.00 0.00 0.00 61.98 60.95 1wwx s VAL 86 Cb -0.23 -1.97 -0.01 0.00 0.00 0.00 0.00 36.38 34.17 1wwx s VAL 86 CO 0.55 -0.42 0.46 -0.31 0.00 0.00 0.00 175.10 175.38 1wwx s TYR 87 N 1.35 2.77 -0.17 5.22 1.51 0.15 -4.49 117.35 123.69 1wwx s TYR 87 Ca 0.04 -0.44 -0.11 0.00 -1.01 0.00 0.00 57.07 55.55 1wwx s TYR 87 Cb -0.18 -2.24 0.05 0.00 -0.11 0.00 0.00 41.96 39.48 1wwx s TYR 87 CO -0.13 -0.23 0.42 0.21 -1.11 0.00 0.00 175.55 174.71 1wwx s LYS 88 N -4.22 0.42 0.11 -0.62 2.20 -1.25 -0.31 119.74 116.08 1wwx s LYS 88 Ca 0.51 0.75 -0.31 0.00 -0.36 0.00 0.00 55.97 56.56 1wwx s LYS 88 Cb -0.06 0.04 -0.07 0.00 -1.51 0.00 0.00 37.83 36.23 1wwx s LYS 88 CO 0.30 -0.13 1.25 -0.06 -0.36 0.00 0.00 175.35 176.35 1wwx s PHE 89 N 1.11 3.38 0.00 4.03 0.08 -0.87 0.88 117.98 126.60 1wwx s PHE 89 Ca -0.07 1.25 0.00 0.00 0.12 0.00 0.00 56.93 58.23 1wwx s PHE 89 Cb -0.07 -3.49 0.00 0.00 -0.57 0.00 0.00 43.02 38.89 1wwx s PHE 89 CO -0.10 -1.55 0.00 0.41 -0.10 0.00 0.00 175.22 173.88 1wwx n GLY 90 N 2.96 0.35 0.08 4.36 0.00 0.62 -4.71 105.19 108.84 1wwx n GLY 90 Ca 0.08 -1.46 0.07 0.00 0.00 0.00 0.00 46.02 44.72 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 0.63 0.12 1.61 2.85 -1.25 -4.11 118.16 118.02 1wwx n LYS 91 Ca 0.00 0.04 0.03 0.00 -1.05 0.00 0.00 58.31 57.33 1wwx n LYS 91 Cb 0.00 -1.71 0.41 0.00 -0.65 0.00 0.00 35.03 33.08 1wwx n LYS 91 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 177.40 176.44 1wwx h ASN 92 N 0.00 0.22 -3.45 -5.58 2.35 -1.82 -3.42 115.58 103.88 1wwx h ASN 92 Ca -0.08 -0.04 -0.54 0.00 -0.55 0.00 0.00 56.30 55.09 1wwx h ASN 92 Cb 1.22 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 39.50 1wwx h ASN 92 CO 0.01 0.35 0.26 0.00 -1.65 0.00 0.00 177.43 176.41 1wwx s ALA 93 N -4.79 3.27 -0.06 -0.83 0.00 -1.26 -4.88 121.76 113.20 1wwx s ALA 93 Ca -0.06 0.41 0.04 0.00 0.00 0.00 0.00 51.96 52.36 1wwx s ALA 93 Cb 0.16 -3.17 -0.00 0.00 0.00 0.00 0.00 23.12 20.11 1wwx s ALA 93 CO 0.73 -0.07 -0.20 -3.38 0.00 0.00 0.00 175.76 172.83 1wwx s HIS 94 N 0.41 2.08 0.00 0.00 -3.43 -1.26 -4.82 115.29 108.27 1wwx s HIS 94 Ca 0.45 -0.70 0.00 0.00 -0.80 0.00 0.00 55.06 54.00 1wwx s HIS 94 Cb -0.21 -1.40 0.00 0.00 -1.43 0.00 0.00 32.58 29.54 1wwx s HIS 94 CO 0.26 -0.26 0.00 0.41 -2.00 0.00 0.00 174.74 173.14 1wwx n GLY 95 N 3.29 3.14 0.07 -1.38 0.00 -1.26 -4.99 105.19 104.06 1wwx n GLY 95 Ca -0.19 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.73 1.61 5.08 -1.99 -3.47 115.95 114.45 1wwx h TRP 96 Ca 0.00 0.00 -0.59 0.00 1.08 0.00 0.00 58.89 59.38 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 0.61 -0.31 0.00 -1.28 0.00 0.00 178.44 177.47 1wwx n GLN 97 N -4.62 0.66 -3.98 0.12 10.64 -1.26 -4.98 117.38 113.96 1wwx n GLN 97 Ca -0.11 0.25 -0.24 0.00 -1.83 0.00 0.00 57.00 55.06 1wwx n GLN 97 Cb 0.34 -1.68 -0.03 0.00 -0.86 0.00 0.00 30.24 28.01 1wwx n GLN 97 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 1wwx s GLU 98 N -1.87 3.36 0.18 2.61 0.41 -1.26 -5.10 118.70 117.02 1wwx s GLU 98 Ca 0.66 -0.71 0.04 0.00 -0.41 0.00 0.00 54.97 54.55 1wwx s GLU 98 Cb -0.53 -2.88 -0.04 0.00 -1.78 0.00 0.00 34.13 28.91 1wwx s GLU 98 CO 0.56 0.48 0.24 0.34 -0.49 0.00 0.00 175.26 176.39 1wwx s ASP 99 N -3.53 6.01 0.44 -0.19 -1.08 -1.26 -5.13 116.67 111.93 1wwx s ASP 99 Ca 0.34 0.02 0.08 0.00 -0.52 0.00 0.00 52.55 52.47 1wwx s ASP 99 Cb -0.10 -1.71 0.00 0.00 -1.46 0.00 0.00 42.92 39.65 1wwx s ASP 99 CO 0.28 0.03 0.48 -0.54 0.52 0.00 0.00 175.17 175.94 1wwx s LYS 100 N -3.38 2.60 0.22 4.34 3.01 -1.26 -4.98 119.74 120.29 1wwx s LYS 100 Ca 0.33 -1.48 0.00 0.00 -1.01 0.00 0.00 55.97 53.81 1wwx s LYS 100 Cb -0.10 -2.51 0.00 0.00 -1.01 0.00 0.00 37.83 34.21 1wwx s LYS 100 CO 0.27 -0.30 0.00 -0.11 0.51 0.00 0.00 175.35 175.72 1wwx n LEU 101 N -1.72 -5.72 0.09 3.17 0.00 -1.26 -5.05 117.00 106.52 1wwx n LEU 101 Ca 0.06 2.92 0.00 0.00 0.00 0.00 0.00 56.01 58.99 1wwx n LEU 101 Cb 0.61 -2.86 0.00 0.00 0.00 0.00 0.00 43.42 41.16 1wwx n LEU 101 CO 0.41 -1.33 0.00 -0.24 0.00 0.00 0.00 177.39 176.23 1wwx n SER 102 N 1.39 -1.67 0.00 1.96 2.88 -1.26 -5.17 113.62 111.75 1wwx n SER 102 Ca 0.00 0.66 0.00 0.00 -1.33 0.00 0.00 58.87 58.20 1wwx n SER 102 Cb 0.00 1.84 0.00 0.00 -0.75 0.00 0.00 64.21 65.30 1wwx n SER 102 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wwx n GLY 103 N -1.19 -1.39 3.27 0.46 0.00 -1.26 -4.99 105.19 100.09 1wwx n GLY 103 Ca 0.00 -1.79 -0.28 0.00 0.00 0.00 0.00 46.02 43.95 1wwx n GLY 103 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wwx n PRO 104 N 0.00 -3.02 -2.43 1.61 -0.04 -1.26 -5.00 135.00 124.87 1wwx n PRO 104 Ca 0.00 -1.63 -0.37 0.00 -0.04 0.00 0.00 63.50 61.45 1wwx n PRO 104 Cb 0.00 -1.53 -0.03 0.00 -0.04 0.00 0.00 33.50 31.90 1wwx n PRO 104 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1wwx s SER 105 N -4.26 6.66 -0.34 3.54 1.04 -1.26 -5.03 113.70 114.05 1wwx s SER 105 Ca 0.66 2.18 -0.00 0.00 0.48 0.00 0.00 55.95 59.27 1wwx s SER 105 Cb -0.07 -2.60 0.11 0.00 0.10 0.00 0.00 66.02 63.57 1wwx s SER 105 CO 0.51 -0.57 0.13 -0.94 0.98 0.00 0.00 173.24 173.35 1wwx s SER 106 N -1.37 3.90 0.00 7.02 1.04 -1.26 -5.30 113.70 117.73 1wwx s SER 106 Ca 0.57 -1.86 0.00 0.00 0.48 0.00 0.00 55.95 55.14 1wwx s SER 106 Cb -0.26 -0.87 0.00 0.00 0.10 0.00 0.00 66.02 64.99 1wwx s SER 106 CO 0.33 -0.38 0.00 0.61 0.98 0.00 0.00 173.24 174.77