#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wwx s SER 2 N 0.00 -1.40 -0.25 1.61 0.01 -1.26 -5.13 113.70 107.28 1wwx s SER 2 Ca 0.00 -0.04 -0.04 0.00 1.31 0.00 0.00 55.95 57.18 1wwx s SER 2 Cb 0.00 1.85 0.13 0.00 0.21 0.00 0.00 66.02 68.22 1wwx s SER 2 CO 0.00 -0.23 0.44 -0.94 0.41 0.00 0.00 173.24 172.92 1wwx s SER 3 N 2.61 -0.25 0.64 2.44 1.04 -1.26 -5.17 113.70 113.76 1wwx s SER 3 Ca 0.14 0.59 0.07 0.00 0.48 0.00 0.00 55.95 57.23 1wwx s SER 3 Cb -0.07 1.43 0.11 0.00 0.10 0.00 0.00 66.02 67.59 1wwx s SER 3 CO -0.21 -0.27 0.88 -0.83 0.98 0.00 0.00 173.24 173.79 1wwx s GLY 4 N 2.64 1.70 0.42 7.32 0.00 -1.26 -5.08 107.32 113.06 1wwx s GLY 4 Ca 0.10 -2.14 -0.24 0.00 0.00 0.00 0.00 44.72 42.44 1wwx s GLY 4 CO -0.16 -1.60 1.11 -0.45 0.00 0.00 0.00 173.10 172.00 1wwx s SER 5 N -4.74 6.54 0.05 1.64 0.15 -1.26 -5.05 113.70 111.03 1wwx s SER 5 Ca 0.64 2.17 0.05 0.00 0.70 0.00 0.00 55.95 59.51 1wwx s SER 5 Cb -0.05 -2.60 -0.04 0.00 -1.71 0.00 0.00 66.02 61.63 1wwx s SER 5 CO 0.41 -0.65 -0.06 -0.44 1.20 0.00 0.00 173.24 173.71 1wwx s SER 6 N -1.42 4.67 -0.47 5.45 0.01 -1.26 -5.08 113.70 115.59 1wwx s SER 6 Ca 0.59 -0.22 0.05 0.00 1.31 0.00 0.00 55.95 57.68 1wwx s SER 6 Cb -0.26 -1.04 0.18 0.00 0.21 0.00 0.00 66.02 65.11 1wwx s SER 6 CO 0.32 0.22 0.40 0.61 0.41 0.00 0.00 173.24 175.20 1wwx n GLY 7 N 1.05 2.64 3.74 3.44 0.00 -1.26 -5.11 105.19 109.69 1wwx n GLY 7 Ca -0.14 -1.62 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 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 -0.43 7.11 -0.07 1.61 0.15 -1.26 -5.03 113.70 115.78 1wwx s SER 8 Ca 0.32 2.19 -0.00 0.00 0.70 0.00 0.00 55.95 59.16 1wwx s SER 8 Cb 0.04 -2.60 0.02 0.00 -1.71 0.00 0.00 66.02 61.77 1wwx s SER 8 CO -0.18 -0.36 -0.03 -0.55 1.20 0.00 0.00 173.24 173.32 1wwx s SER 9 N 0.17 1.48 0.17 5.45 0.15 -1.26 -5.02 113.70 114.83 1wwx s SER 9 Ca 0.53 -0.14 0.00 0.00 0.70 0.00 0.00 55.95 57.04 1wwx s SER 9 Cb -0.32 -0.52 0.00 0.00 -1.71 0.00 0.00 66.02 63.47 1wwx s SER 9 CO 0.36 -0.13 0.00 1.41 1.20 0.00 0.00 173.24 176.08 1wwx n HIS 10 N 4.70 -1.97 0.20 3.44 8.25 -1.26 -4.38 115.22 124.20 1wwx n HIS 10 Ca -0.14 1.03 -0.15 0.00 -0.26 0.00 0.00 57.72 58.19 1wwx n HIS 10 Cb 0.50 -2.36 -0.08 0.00 1.12 0.00 0.00 29.99 29.17 1wwx n HIS 10 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1wwx h LEU 11 N 1.17 -0.38 -1.85 2.41 5.85 -1.99 -2.12 115.31 118.41 1wwx h LEU 11 Ca 0.00 0.00 0.46 0.00 0.84 0.00 0.00 57.88 59.18 1wwx h LEU 11 Cb 0.00 0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.05 1wwx h LEU 11 CO 0.00 -0.26 1.09 4.11 -0.34 0.00 0.00 178.44 183.04 1wwx h TRP 12 N -0.46 0.14 0.24 1.25 5.08 -1.95 0.93 115.95 121.18 1wwx h TRP 12 Ca -0.05 0.01 -0.33 0.00 1.08 0.00 0.00 58.89 59.60 1wwx h TRP 12 Cb 0.35 -0.04 0.03 0.00 -3.00 0.00 0.00 29.16 26.51 1wwx h TRP 12 CO -0.05 -0.04 -1.50 0.93 -1.28 0.00 0.00 178.44 176.50 1wwx h GLU 13 N 0.04 0.50 0.09 0.12 5.08 -1.61 -2.78 114.58 116.03 1wwx h GLU 13 Ca 0.78 -0.86 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1wwx h GLU 13 Cb 2.95 0.32 0.00 0.00 0.50 0.00 0.00 28.75 32.52 1wwx h GLU 13 CO -0.10 1.41 -0.04 0.35 -1.00 0.00 0.00 179.01 179.62 1wwx h PHE 14 N 0.14 -0.11 -0.33 4.33 3.04 0.14 0.98 116.94 125.12 1wwx h PHE 14 Ca -0.26 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.65 1wwx h PHE 14 Cb 2.15 0.04 -0.02 0.00 2.56 0.00 0.00 35.95 40.68 1wwx h PHE 14 CO 0.12 0.14 0.04 -0.24 -2.02 0.00 0.00 178.31 176.35 1wwx h VAL 15 N -0.37 1.18 -0.05 1.41 3.04 -1.04 -2.62 116.25 117.80 1wwx h VAL 15 Ca -0.01 -0.66 -0.03 0.00 -1.01 0.00 0.00 66.70 64.98 1wwx h VAL 15 Cb 0.31 0.88 0.00 0.00 -2.01 0.00 0.00 31.29 30.47 1wwx h VAL 15 CO 0.02 0.23 -0.10 -0.09 -1.01 0.00 0.00 177.57 176.62 1wwx h ARG 16 N 0.48 0.15 -0.88 4.17 2.43 -1.35 -3.17 114.38 116.22 1wwx h ARG 16 Ca 0.11 -0.10 0.16 0.00 -0.81 0.00 0.00 59.98 59.34 1wwx h ARG 16 Cb 0.25 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.75 1wwx h ARG 16 CO 0.00 0.69 0.57 0.22 -1.51 0.00 0.00 179.97 179.94 1wwx h ASP 17 N -0.37 0.54 -0.77 -3.80 3.58 -0.63 -0.41 116.42 114.56 1wwx h ASP 17 Ca 0.00 0.04 0.05 0.00 0.42 0.00 0.00 57.03 57.54 1wwx h ASP 17 Cb 0.69 -0.06 -0.05 0.00 1.72 0.00 0.00 39.33 41.62 1wwx h ASP 17 CO 0.02 0.26 0.47 -0.07 -2.88 0.00 0.00 179.24 177.04 1wwx h LEU 18 N 0.57 0.75 -0.85 2.28 3.38 -1.45 0.61 115.31 120.60 1wwx h LEU 18 Ca 0.45 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.39 1wwx h LEU 18 Cb 0.88 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.44 1wwx h LEU 18 CO -0.19 0.50 0.35 -0.07 0.09 0.00 0.00 178.44 179.12 1wwx h LEU 19 N 0.89 1.09 0.00 1.67 3.38 -1.12 -2.17 115.31 119.05 1wwx h LEU 19 Ca 0.33 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1wwx h LEU 19 Cb 0.10 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.57 1wwx h LEU 19 CO -0.15 0.94 -0.16 -0.07 0.09 0.00 0.00 178.44 179.10 1wwx h LEU 20 N 1.17 0.00 -7.31 1.67 3.38 -1.13 -3.38 115.31 109.71 1wwx h LEU 20 Ca 0.27 -0.03 -0.69 0.00 0.09 0.00 0.00 57.88 57.52 1wwx h LEU 20 Cb 0.17 0.00 -0.36 0.00 0.09 0.00 0.00 40.66 40.56 1wwx h LEU 20 CO -0.03 0.01 -0.17 -0.44 0.09 0.00 0.00 178.44 177.90 1wwx s SER 21 N -5.10 5.80 0.00 -0.43 0.01 0.21 -4.88 113.70 109.30 1wwx s SER 21 Ca 0.08 -3.68 0.15 0.00 1.31 0.00 0.00 55.95 53.82 1wwx s SER 21 Cb 0.10 -1.87 0.82 0.00 0.21 0.00 0.00 66.02 65.28 1wwx s SER 21 CO 0.65 -0.18 1.39 -0.81 0.41 0.00 0.00 173.24 174.70 1wwx n PRO 22 N 2.37 0.32 0.06 12.44 -0.04 -1.25 -1.75 135.00 147.14 1wwx n PRO 22 Ca 0.20 0.09 0.04 0.00 -0.04 0.00 0.00 63.50 63.79 1wwx n PRO 22 Cb 0.37 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.27 1wwx n PRO 22 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1wwx n GLU 23 N -1.18 0.62 -0.11 0.54 2.13 -1.26 -4.35 120.64 117.03 1wwx n GLU 23 Ca 0.09 0.19 -0.15 0.00 0.66 0.00 0.00 57.16 57.95 1wwx n GLU 23 Cb 0.09 -1.81 -0.11 0.00 0.27 0.00 0.00 31.44 29.88 1wwx n GLU 23 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1wwx n GLU 24 N -2.82 0.65 -2.52 5.31 -0.58 -0.93 -4.95 120.64 114.80 1wwx n GLU 24 Ca -0.06 0.11 -0.41 0.00 -0.42 0.00 0.00 57.16 56.37 1wwx n GLU 24 Cb 0.74 -1.46 -0.04 0.00 -0.57 0.00 0.00 31.44 30.12 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 -6.08 7.23 -0.66 1.62 2.47 -0.72 -5.00 114.94 113.81 1wwx s ASN 25 Ca -0.28 2.00 0.01 0.00 0.42 0.00 0.00 52.86 55.02 1wwx s ASN 25 Cb 0.08 -2.59 0.16 0.00 -1.45 0.00 0.00 41.25 37.45 1wwx s ASN 25 CO 0.56 -0.29 0.46 0.00 -3.72 0.00 0.00 177.10 174.10 1wwx n GLY 27 N 2.78 -0.37 0.09 0.00 0.00 -1.26 -4.82 105.19 101.60 1wwx n GLY 27 Ca 0.12 0.13 -0.06 0.00 0.00 0.00 0.00 46.02 46.21 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 -4.34 1.26 -4.31 -0.61 5.41 -1.26 -4.27 119.36 111.24 1wwx n ILE 28 Ca -0.01 -0.79 -0.17 0.00 1.00 0.00 0.00 62.75 62.78 1wwx n ILE 28 Cb 0.53 -0.54 -0.10 0.00 -0.71 0.00 0.00 39.64 38.82 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 -5.52 1.60 0.01 1.39 1.43 -1.26 -1.42 118.68 114.90 1wwx s LEU 29 Ca -0.08 -1.42 -0.10 0.00 -1.03 0.00 0.00 54.13 51.49 1wwx s LEU 29 Cb 0.08 0.09 0.01 0.00 0.03 0.00 0.00 46.19 46.40 1wwx s LEU 29 CO 0.84 -0.78 0.20 -1.61 0.23 0.00 0.00 176.35 175.23 1wwx s GLU 30 N -4.00 0.59 -0.34 1.70 0.41 0.69 -4.77 118.70 112.98 1wwx s GLU 30 Ca 0.37 -0.39 -0.15 0.00 -0.41 0.00 0.00 54.97 54.39 1wwx s GLU 30 Cb 0.07 0.25 -0.01 0.00 -1.78 0.00 0.00 34.13 32.66 1wwx s GLU 30 CO 0.14 -0.15 0.38 -1.58 -0.49 0.00 0.00 175.26 173.56 1wwx s TRP 31 N -1.62 3.21 -0.07 1.61 0.23 -1.26 -0.49 118.94 120.54 1wwx s TRP 31 Ca -0.12 0.02 -0.05 0.00 -2.03 0.00 0.00 56.10 53.91 1wwx s TRP 31 Cb -0.06 -2.69 -0.27 0.00 0.03 0.00 0.00 33.47 30.48 1wwx s TRP 31 CO 0.01 -0.43 0.56 0.93 0.96 0.00 0.00 176.95 178.98 1wwx h GLU 32 N 8.45 0.27 -0.72 4.98 4.39 -1.48 -3.45 114.58 127.02 1wwx h GLU 32 Ca -0.30 -0.46 -0.06 0.00 0.34 0.00 0.00 59.36 58.88 1wwx h GLU 32 Cb 1.14 0.17 -0.17 0.00 -0.10 0.00 0.00 28.75 29.80 1wwx h GLU 32 CO 0.70 1.15 -0.35 -0.51 -1.16 0.00 0.00 179.01 178.84 1wwx s ASP 33 N -7.00 -1.06 0.28 1.42 1.01 -1.05 -4.99 116.67 105.28 1wwx s ASP 33 Ca -0.16 -1.03 -0.03 0.00 0.71 0.00 0.00 52.55 52.04 1wwx s ASP 33 Cb 0.06 1.38 0.57 0.00 1.01 0.00 0.00 42.92 45.94 1wwx s ASP 33 CO 0.81 -0.06 1.47 0.54 0.21 0.00 0.00 175.17 178.14 1wwx n ARG 34 N 3.24 -0.08 -0.14 8.23 5.12 -1.26 0.46 116.66 132.23 1wwx n ARG 34 Ca 0.14 1.43 -0.07 0.00 -1.93 0.00 0.00 57.85 57.42 1wwx n ARG 34 Cb 0.59 -2.21 -0.02 0.00 -1.16 0.00 0.00 32.46 29.67 1wwx n ARG 34 CO 0.00 0.00 0.00 1.05 -1.93 0.00 0.00 177.63 176.75 1wwx h GLU 35 N 0.00 -0.23 0.00 5.56 4.11 -1.86 0.21 114.58 122.36 1wwx h GLU 35 Ca 0.51 0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.95 1wwx h GLU 35 Cb 0.92 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.22 1wwx h GLU 35 CO -0.93 -0.16 0.00 1.96 0.07 0.00 0.00 179.01 179.96 1wwx h GLN 36 N -0.24 0.00 -0.06 1.06 4.20 -0.70 -3.46 115.11 115.92 1wwx h GLN 36 Ca 0.18 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.87 1wwx h GLN 36 Cb 0.55 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 1wwx h GLN 36 CO -0.59 0.00 -0.02 0.41 -0.67 0.00 0.00 178.83 177.96 1wwx n GLY 37 N 1.00 0.49 3.73 3.46 0.00 0.17 -4.71 105.19 109.33 1wwx n GLY 37 Ca 0.04 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.03 4.68 0.05 -0.61 1.01 -1.14 -3.06 121.20 120.10 1wwx s ILE 38 Ca 0.00 1.86 0.01 0.00 0.00 0.00 0.00 60.65 62.52 1wwx s ILE 38 Cb 0.00 -4.23 -0.03 0.00 0.01 0.00 0.00 42.46 38.21 1wwx s ILE 38 CO 0.00 0.31 -0.06 0.72 0.00 0.00 0.00 174.94 175.91 1wwx s PHE 39 N 0.19 0.61 -0.02 3.97 -0.71 0.02 -1.15 117.98 120.89 1wwx s PHE 39 Ca 0.44 -0.71 0.05 0.00 -1.04 0.00 0.00 56.93 55.66 1wwx s PHE 39 Cb -0.22 -0.38 -0.03 0.00 -1.21 0.00 0.00 43.02 41.18 1wwx s PHE 39 CO 0.26 -0.18 -0.15 0.50 -1.34 0.00 0.00 175.22 174.32 1wwx s ARG 40 N -2.54 2.38 -1.02 1.99 3.52 0.35 -0.90 118.95 122.73 1wwx s ARG 40 Ca -0.03 -0.78 -0.14 0.00 -0.13 0.00 0.00 55.73 54.65 1wwx s ARG 40 Cb -0.03 -2.33 0.19 0.00 -1.56 0.00 0.00 34.95 31.22 1wwx s ARG 40 CO -0.03 0.60 1.12 0.08 -0.81 0.00 0.00 175.30 176.26 1wwx s VAL 41 N -0.81 5.28 0.15 7.11 1.01 0.82 -0.22 120.40 133.74 1wwx s VAL 41 Ca 0.13 -2.46 -0.20 0.00 0.00 0.00 0.00 61.98 59.45 1wwx s VAL 41 Cb -0.11 -4.71 0.04 0.00 0.00 0.00 0.00 36.38 31.61 1wwx s VAL 41 CO 0.03 -1.36 1.66 0.58 0.00 0.00 0.00 175.10 176.00 1wwx h VAL 42 N 4.82 0.53 -3.39 2.92 2.07 -1.51 -3.34 116.25 118.34 1wwx h VAL 42 Ca 0.19 0.00 -0.72 0.00 0.82 0.00 0.00 66.70 67.00 1wwx h VAL 42 Cb 0.96 0.53 -0.30 0.00 -1.52 0.00 0.00 31.29 30.95 1wwx h VAL 42 CO 1.04 0.00 -0.45 -0.54 0.02 0.00 0.00 177.57 177.64 1wwx s LYS 43 N -6.16 2.40 0.31 1.57 1.02 -0.72 -4.92 119.74 113.25 1wwx s LYS 43 Ca -0.14 -1.68 0.16 0.00 0.02 0.00 0.00 55.97 54.33 1wwx s LYS 43 Cb 0.13 -3.79 0.29 0.00 -0.52 0.00 0.00 37.83 33.93 1wwx s LYS 43 CO 0.69 -1.09 1.55 0.66 -0.92 0.00 0.00 175.35 176.24 1wwx h SER 44 N 8.34 0.00 0.47 2.83 4.64 -1.86 -1.96 113.55 126.01 1wwx h SER 44 Ca -0.20 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 60.82 1wwx h SER 44 Cb 1.07 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.17 1wwx h SER 44 CO 0.79 0.46 -1.39 1.05 -0.87 0.00 0.00 176.83 176.87 1wwx h GLU 45 N 0.00 0.37 0.01 4.77 4.11 -1.95 -3.27 114.58 118.62 1wwx h GLU 45 Ca -0.00 -0.62 -0.24 0.00 0.07 0.00 0.00 59.36 58.56 1wwx h GLU 45 Cb 1.22 0.23 0.01 0.00 0.50 0.00 0.00 28.75 30.71 1wwx h GLU 45 CO 0.06 1.29 -1.00 0.00 0.07 0.00 0.00 179.01 179.43 1wwx h ALA 46 N 0.41 0.27 -0.58 1.06 0.00 -1.97 -2.50 119.26 115.94 1wwx h ALA 46 Ca -0.20 -0.72 0.08 0.00 0.00 0.00 0.00 54.91 54.07 1wwx h ALA 46 Cb 2.05 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 19.79 1wwx h ALA 46 CO 0.22 0.78 0.24 1.25 0.00 0.00 0.00 179.25 181.74 1wwx h LEU 47 N 0.27 0.28 -0.02 0.00 5.85 -1.47 -0.46 115.31 119.78 1wwx h LEU 47 Ca -0.10 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1wwx h LEU 47 Cb 1.64 0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.70 1wwx h LEU 47 CO 0.18 0.18 -0.06 0.00 -0.34 0.00 0.00 178.44 178.40 1wwx h ALA 48 N 1.37 0.03 -0.74 1.25 0.00 -1.62 -2.39 119.26 117.16 1wwx h ALA 48 Ca 0.28 -0.35 0.16 0.00 0.00 0.00 0.00 54.91 55.01 1wwx h ALA 48 Cb 0.30 -0.00 -0.11 0.00 0.00 0.00 0.00 17.79 17.98 1wwx h ALA 48 CO -0.26 -0.10 0.17 -0.22 0.00 0.00 0.00 179.25 178.84 1wwx h LYS 49 N -0.54 0.25 -0.26 0.00 3.64 -1.18 0.14 116.57 118.61 1wwx h LYS 49 Ca -0.00 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.30 1wwx h LYS 49 Cb 0.71 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.47 1wwx h LYS 49 CO 0.01 0.16 -0.10 0.52 -2.27 0.00 0.00 179.45 177.78 1wwx h MET 50 N 0.25 0.52 0.01 1.90 2.86 -1.14 -3.15 114.93 116.19 1wwx h MET 50 Ca 0.42 -0.22 0.02 0.00 -2.06 0.00 0.00 59.70 57.87 1wwx h MET 50 Cb 0.72 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.33 1wwx h MET 50 CO -0.53 0.76 -0.17 2.35 1.06 0.00 0.00 176.91 180.38 1wwx h TRP 51 N 0.25 -0.45 -0.75 -0.22 -0.00 -0.59 -2.53 115.95 111.65 1wwx h TRP 51 Ca 0.06 0.01 0.17 0.00 -0.00 0.00 0.00 58.89 59.14 1wwx h TRP 51 Cb 0.59 0.20 -0.13 0.00 -0.00 0.00 0.00 29.16 29.83 1wwx h TRP 51 CO 0.06 -0.25 0.05 0.78 -0.00 0.00 0.00 178.44 179.08 1wwx h GLY 52 N -0.29 0.90 0.50 2.65 0.00 -0.83 0.46 103.07 106.47 1wwx h GLY 52 Ca 0.05 0.07 0.20 0.00 0.00 0.00 0.00 47.33 47.66 1wwx h GLY 52 CO -0.16 -0.28 0.54 1.46 0.00 0.00 0.00 176.54 178.10 1wwx h GLN 53 N 0.14 0.13 -0.02 4.80 4.20 -1.41 0.96 115.11 123.91 1wwx h GLN 53 Ca 0.42 -0.01 -0.22 0.00 0.06 0.00 0.00 58.65 58.90 1wwx h GLN 53 Cb 0.74 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.50 1wwx h GLN 53 CO -0.63 0.09 -0.91 0.00 -0.67 0.00 0.00 178.83 176.71 1wwx h ARG 54 N 0.14 0.44 -0.71 1.46 2.47 -0.04 -3.16 114.38 114.97 1wwx h ARG 54 Ca 0.38 -0.45 0.00 0.00 -1.26 0.00 0.00 59.98 58.65 1wwx h ARG 54 Cb 1.28 0.12 0.00 0.00 -1.65 0.00 0.00 29.97 29.73 1wwx h ARG 54 CO -0.05 1.10 0.00 1.63 0.56 0.00 0.00 179.97 183.21 1wwx n LYS 55 N -3.77 2.84 -2.64 0.04 4.76 0.46 -4.90 118.16 114.96 1wwx n LYS 55 Ca -0.07 -2.62 -0.17 0.00 -2.87 0.00 0.00 58.31 52.59 1wwx n LYS 55 Cb 0.81 -1.62 -0.00 0.00 -1.84 0.00 0.00 35.03 32.39 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 1.51 -2.62 -3.23 1.97 4.76 0.30 -4.90 118.16 115.96 1wwx n LYS 56 Ca 0.24 0.71 -0.46 0.00 -2.87 0.00 0.00 58.31 55.94 1wwx n LYS 56 Cb 0.65 -5.37 -0.01 0.00 -1.84 0.00 0.00 35.03 28.45 1wwx n LYS 56 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1wwx s ASN 57 N -2.22 6.92 0.65 4.39 3.84 0.09 -4.86 114.94 123.75 1wwx s ASN 57 Ca 0.10 -2.85 0.35 0.00 0.21 0.00 0.00 52.86 50.67 1wwx s ASN 57 Cb -0.05 -2.26 1.91 0.00 -0.55 0.00 0.00 41.25 40.31 1wwx s ASN 57 CO 0.12 -0.60 2.07 0.44 -2.79 0.00 0.00 177.10 176.35 1wwx h ASP 58 N 7.61 0.00 -0.78 -4.21 3.32 -1.90 0.24 116.42 120.70 1wwx h ASP 58 Ca 0.15 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.84 1wwx h ASP 58 Cb 0.98 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.31 1wwx h ASP 58 CO 0.92 0.00 0.39 -2.11 -1.72 0.00 0.00 179.24 176.72 1wwx n ARG 59 N -2.93 2.51 -2.46 3.56 1.85 -1.26 -4.99 116.66 112.94 1wwx n ARG 59 Ca -0.02 -3.06 -0.41 0.00 -1.00 0.00 0.00 57.85 53.35 1wwx n ARG 59 Cb 0.26 -2.10 -0.04 0.00 -1.05 0.00 0.00 32.46 29.53 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 -3.21 4.52 -0.11 2.89 1.75 0.84 -4.97 119.30 121.01 1wwx s MET 60 Ca 0.53 1.76 -0.17 0.00 -1.25 0.00 0.00 55.69 56.56 1wwx s MET 60 Cb 0.45 -3.29 0.04 0.00 2.84 0.00 0.00 34.83 34.87 1wwx s MET 60 CO 0.09 -0.06 0.44 -0.08 -0.65 0.00 0.00 175.02 174.77 1wwx s THR 61 N 0.19 0.02 0.57 10.11 -1.32 -1.26 -4.59 115.64 119.36 1wwx s THR 61 Ca 0.53 -0.13 0.41 0.00 -1.21 0.00 0.00 61.69 61.29 1wwx s THR 61 Cb -0.30 -0.67 0.61 0.00 -1.51 0.00 0.00 72.50 70.63 1wwx s THR 61 CO 0.34 -0.07 1.57 0.22 -2.21 0.00 0.00 174.62 174.47 1wwx h TYR 62 N 4.72 0.00 -0.49 9.09 3.20 -1.90 1.04 116.97 132.63 1wwx h TYR 62 Ca -0.28 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.55 1wwx h TYR 62 Cb 1.17 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.42 1wwx h TYR 62 CO 0.43 0.00 0.15 1.49 -1.64 0.00 0.00 178.16 178.59 1wwx h GLU 63 N 0.00 0.76 0.10 1.82 4.81 -1.95 -1.32 114.58 118.80 1wwx h GLU 63 Ca 0.73 -0.16 -0.30 0.00 -0.13 0.00 0.00 59.36 59.49 1wwx h GLU 63 Cb 3.16 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 32.42 1wwx h GLU 63 CO -0.01 0.71 -1.55 0.87 -0.73 0.00 0.00 179.01 178.30 1wwx h LYS 64 N 0.66 0.21 -0.92 1.92 1.57 0.60 -3.34 116.57 117.27 1wwx h LYS 64 Ca 0.16 -0.37 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1wwx h LYS 64 Cb 0.27 0.14 -0.05 0.00 0.08 0.00 0.00 32.23 32.67 1wwx h LYS 64 CO -0.01 1.05 0.59 1.25 -0.57 0.00 0.00 179.45 181.77 1wwx h LEU 65 N 0.06 1.07 -1.61 2.94 6.46 -0.77 -1.85 115.31 121.61 1wwx h LEU 65 Ca -0.25 -0.04 0.12 0.00 -0.12 0.00 0.00 57.88 57.59 1wwx h LEU 65 Cb 2.00 -0.27 -0.04 0.00 -0.73 0.00 0.00 40.66 41.62 1wwx h LEU 65 CO 0.15 0.79 0.45 0.77 -0.62 0.00 0.00 178.44 179.98 1wwx h SER 66 N 1.25 0.38 -0.97 1.25 4.64 -1.36 -1.99 113.55 116.75 1wwx h SER 66 Ca 0.33 0.01 0.32 0.00 -0.47 0.00 0.00 61.79 61.99 1wwx h SER 66 Cb -0.12 -0.06 -0.17 0.00 -0.31 0.00 0.00 62.40 61.74 1wwx h SER 66 CO -0.07 0.22 0.31 0.08 -0.87 0.00 0.00 176.83 176.49 1wwx h ARG 67 N 0.42 0.08 -0.02 4.77 0.11 -1.49 1.31 114.38 119.55 1wwx h ARG 67 Ca 0.32 -0.00 -0.17 0.00 0.10 0.00 0.00 59.98 60.22 1wwx h ARG 67 Cb 0.68 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.74 1wwx h ARG 67 CO -0.10 0.05 -0.75 0.00 0.10 0.00 0.00 179.97 179.27 1wwx h ALA 68 N 1.94 0.68 -0.13 0.08 0.00 -1.53 -2.19 119.26 118.11 1wwx h ALA 68 Ca 0.69 -0.65 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1wwx h ALA 68 Cb 1.62 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.31 1wwx h ALA 68 CO -0.79 0.84 -0.30 -0.07 0.00 0.00 0.00 179.25 178.94 1wwx h LEU 69 N 0.12 0.25 0.00 0.00 3.38 0.15 -0.47 115.31 118.74 1wwx h LEU 69 Ca -0.02 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.76 1wwx h LEU 69 Cb 1.33 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 1wwx h LEU 69 CO 0.11 0.55 -0.85 0.03 0.09 0.00 0.00 178.44 178.37 1wwx h ARG 70 N 0.22 0.00 0.00 1.13 2.47 -0.84 -3.28 114.38 114.08 1wwx h ARG 70 Ca 0.03 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.75 1wwx h ARG 70 Cb 0.65 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.97 1wwx h ARG 70 CO 0.05 0.30 -0.49 -0.92 0.56 0.00 0.00 179.97 179.47 1wwx h TYR 71 N 0.00 0.00 0.00 3.04 3.20 -1.08 -3.26 116.97 118.87 1wwx h TYR 71 Ca -0.06 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.81 1wwx h TYR 71 Cb 1.36 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.63 1wwx h TYR 71 CO 0.00 0.00 0.00 0.66 -1.64 0.00 0.00 178.16 177.18 1wwx n TYR 72 N -2.18 0.21 0.07 -3.82 4.01 -0.21 -3.60 117.16 111.63 1wwx n TYR 72 Ca 0.04 0.06 -0.10 0.00 -0.16 0.00 0.00 57.90 57.74 1wwx n TYR 72 Cb 0.44 -0.60 -0.07 0.00 -0.31 0.00 0.00 39.34 38.80 1wwx n TYR 72 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 1wwx h TYR 73 N 0.00 -0.24 -0.80 -0.72 0.05 -1.71 0.40 116.97 113.94 1wwx h TYR 73 Ca 0.00 -0.01 0.07 0.00 0.05 0.00 0.00 58.73 58.84 1wwx h TYR 73 Cb 0.52 0.08 -0.06 0.00 1.01 0.00 0.00 36.73 38.28 1wwx h TYR 73 CO 0.00 0.16 0.48 1.57 -1.05 0.00 0.00 178.16 179.32 1wwx h LYS 74 N -0.90 0.84 0.00 4.88 2.10 -1.77 -0.03 116.57 121.69 1wwx h LYS 74 Ca -0.03 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 1wwx h LYS 74 Cb 0.50 -0.19 0.00 0.00 -0.90 0.00 0.00 32.23 31.64 1wwx h LYS 74 CO 0.04 0.55 0.00 1.79 -2.00 0.00 0.00 179.45 179.84 1wwx h THR 75 N 0.86 0.00 0.00 0.07 1.35 -1.64 -3.47 112.91 110.09 1wwx h THR 75 Ca 0.36 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 1wwx h THR 75 Cb 0.22 1.56 0.00 0.00 -1.73 0.00 0.00 68.15 68.19 1wwx h THR 75 CO -0.19 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.69 1wwx n GLY 76 N 0.58 1.77 0.32 5.82 0.00 -0.03 -4.85 105.19 108.81 1wwx n GLY 76 Ca 0.03 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.20 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 0.45 -1.61 -0.61 1.08 -0.63 -3.26 117.51 112.93 1wwx h ILE 77 Ca 0.00 -0.14 -0.59 0.00 -0.39 0.00 0.00 64.86 63.73 1wwx h ILE 77 Cb 0.00 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 33.65 1wwx h ILE 77 CO 0.00 0.08 -0.54 -0.76 -0.69 0.00 0.00 178.15 176.24 1wwx s LEU 78 N -10.46 3.01 -0.14 1.44 1.43 0.61 -0.84 118.68 113.72 1wwx s LEU 78 Ca -0.11 -1.20 0.02 0.00 -1.03 0.00 0.00 54.13 51.80 1wwx s LEU 78 Cb 0.26 -1.21 0.01 0.00 0.03 0.00 0.00 46.19 45.29 1wwx s LEU 78 CO 0.78 -0.51 -0.20 -1.61 0.23 0.00 0.00 176.35 175.05 1wwx s GLU 79 N -3.83 2.81 0.03 1.70 0.41 0.32 -4.12 118.70 116.03 1wwx s GLU 79 Ca 0.38 -0.77 -0.31 0.00 -0.41 0.00 0.00 54.97 53.86 1wwx s GLU 79 Cb 0.06 -2.34 -0.10 0.00 -1.78 0.00 0.00 34.13 29.98 1wwx s GLU 79 CO 0.21 -0.09 1.94 -2.13 -0.49 0.00 0.00 175.26 174.70 1wwx n ARG 80 N 4.28 2.77 -5.12 1.61 0.63 -1.26 -4.03 116.66 115.54 1wwx n ARG 80 Ca -0.20 1.01 -0.31 0.00 -0.92 0.00 0.00 57.85 57.44 1wwx n ARG 80 Cb 0.51 -2.95 -0.15 0.00 0.45 0.00 0.00 32.46 30.32 1wwx n ARG 80 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1wwx s VAL 81 N 4.15 2.29 -0.53 5.15 1.01 -1.26 -5.03 120.40 126.18 1wwx s VAL 81 Ca 0.88 -1.11 -0.02 0.00 0.00 0.00 0.00 61.98 61.73 1wwx s VAL 81 Cb -0.48 -1.84 0.24 0.00 0.00 0.00 0.00 36.38 34.31 1wwx s VAL 81 CO 0.43 0.52 2.26 0.47 0.00 0.00 0.00 175.10 178.78 1wwx n ASP 82 N 2.22 6.93 -4.00 3.32 9.92 -1.26 -4.91 116.55 128.78 1wwx n ASP 82 Ca -0.16 -3.40 -0.26 0.00 -0.53 0.00 0.00 54.79 50.44 1wwx n ASP 82 Cb 0.51 -1.10 -0.08 0.00 -0.64 0.00 0.00 41.12 39.82 1wwx n ASP 82 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1wwx s ARG 83 N -2.62 1.97 -0.14 -1.24 0.52 -1.26 -5.15 118.95 111.03 1wwx s ARG 83 Ca 0.51 -2.21 -0.05 0.00 -0.52 0.00 0.00 55.73 53.45 1wwx s ARG 83 Cb 0.38 -0.51 -0.04 0.00 0.52 0.00 0.00 34.95 35.30 1wwx s ARG 83 CO -0.14 -0.54 0.04 0.50 0.02 0.00 0.00 175.30 175.18 1wwx s ARG 84 N -3.65 3.55 -1.01 3.54 3.52 -1.26 -4.46 118.95 119.18 1wwx s ARG 84 Ca 0.23 -0.35 -0.06 0.00 -0.13 0.00 0.00 55.73 55.42 1wwx s ARG 84 Cb 0.02 -3.04 0.05 0.00 -1.56 0.00 0.00 34.95 30.41 1wwx s ARG 84 CO 0.16 0.48 0.26 1.28 -0.81 0.00 0.00 175.30 176.67 1wwx n LEU 85 N 2.86 -1.11 -3.78 -0.88 4.32 -1.26 -4.91 117.00 112.25 1wwx n LEU 85 Ca -0.18 -0.10 -0.28 0.00 -0.02 0.00 0.00 56.01 55.42 1wwx n LEU 85 Cb 0.53 -1.89 -0.16 0.00 -1.62 0.00 0.00 43.42 40.28 1wwx n LEU 85 CO 0.32 0.04 -0.38 -0.69 -1.22 0.00 0.00 177.39 175.47 1wwx s VAL 86 N -2.68 0.75 0.44 4.08 1.01 -1.26 -0.13 120.40 122.61 1wwx s VAL 86 Ca 0.23 -0.72 0.06 0.00 0.00 0.00 0.00 61.98 61.55 1wwx s VAL 86 Cb -0.13 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 1wwx s VAL 86 CO 0.29 -0.20 0.15 -0.31 0.00 0.00 0.00 175.10 175.03 1wwx s TYR 87 N 1.75 2.35 -0.16 5.22 1.51 -0.08 -4.66 117.35 123.29 1wwx s TYR 87 Ca -0.02 -0.69 -0.11 0.00 -1.01 0.00 0.00 57.07 55.24 1wwx s TYR 87 Cb -0.17 -1.87 0.05 0.00 -0.11 0.00 0.00 41.96 39.86 1wwx s TYR 87 CO -0.08 0.16 0.40 0.21 -1.11 0.00 0.00 175.55 175.13 1wwx s LYS 88 N -3.91 0.41 -0.09 -0.62 2.20 -1.26 -0.80 119.74 115.68 1wwx s LYS 88 Ca 0.33 0.69 -0.30 0.00 -0.36 0.00 0.00 55.97 56.33 1wwx s LYS 88 Cb 0.04 0.07 -0.03 0.00 -1.51 0.00 0.00 37.83 36.40 1wwx s LYS 88 CO 0.18 -0.12 1.22 -0.06 -0.36 0.00 0.00 175.35 176.22 1wwx s PHE 89 N 0.93 3.09 0.00 4.03 0.40 -1.17 0.12 117.98 125.38 1wwx s PHE 89 Ca -0.06 1.15 0.00 0.00 -0.60 0.00 0.00 56.93 57.42 1wwx s PHE 89 Cb -0.06 -3.45 0.00 0.00 0.51 0.00 0.00 43.02 40.02 1wwx s PHE 89 CO -0.07 -1.44 0.00 0.41 0.70 0.00 0.00 175.22 174.82 1wwx n GLY 90 N 3.44 -1.92 0.03 4.36 0.00 -0.02 -4.73 105.19 106.33 1wwx n GLY 90 Ca 0.12 -1.14 0.11 0.00 0.00 0.00 0.00 46.02 45.11 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 0.22 0.10 1.61 2.85 -1.23 -4.06 118.16 117.65 1wwx n LYS 91 Ca 0.00 -0.00 -0.06 0.00 -1.05 0.00 0.00 58.31 57.20 1wwx n LYS 91 Cb 0.00 -1.57 0.03 0.00 -0.65 0.00 0.00 35.03 32.83 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 0.10 -3.17 -5.58 -0.26 -1.82 -3.44 115.58 101.41 1wwx h ASN 92 Ca 0.00 -0.08 -0.54 0.00 -0.56 0.00 0.00 56.30 55.12 1wwx h ASN 92 Cb 0.67 -0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 37.89 1wwx h ASN 92 CO 0.00 0.87 0.60 0.00 -1.06 0.00 0.00 177.43 177.83 1wwx s ALA 93 N -3.22 3.41 0.02 -0.83 0.00 -1.26 -4.92 121.76 114.96 1wwx s ALA 93 Ca -0.01 0.71 0.06 0.00 0.00 0.00 0.00 51.96 52.72 1wwx s ALA 93 Cb 0.11 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.74 1wwx s ALA 93 CO 0.80 -0.56 -0.17 -3.38 0.00 0.00 0.00 175.76 172.46 1wwx s HIS 94 N 1.57 2.59 0.00 0.00 -3.43 -1.26 -4.69 115.29 110.07 1wwx s HIS 94 Ca 0.57 -0.24 0.00 0.00 -0.80 0.00 0.00 55.06 54.59 1wwx s HIS 94 Cb -0.26 -1.51 0.00 0.00 -1.43 0.00 0.00 32.58 29.38 1wwx s HIS 94 CO 0.26 0.23 0.00 0.41 -2.00 0.00 0.00 174.74 173.63 1wwx n GLY 95 N 1.76 3.37 0.13 -1.38 0.00 -1.26 -4.91 105.19 102.90 1wwx n GLY 95 Ca -0.16 -1.08 -0.22 0.00 0.00 0.00 0.00 46.02 44.56 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 0.58 -2.06 1.61 5.08 -1.98 -3.47 115.95 115.70 1wwx h TRP 96 Ca 0.00 -0.42 -0.50 0.00 1.08 0.00 0.00 58.89 59.05 1wwx h TRP 96 Cb 0.00 -0.02 0.24 0.00 -3.00 0.00 0.00 29.16 26.38 1wwx h TRP 96 CO 0.00 1.55 -1.66 1.04 -1.28 0.00 0.00 178.44 178.08 1wwx n GLN 97 N -3.86 -0.51 -1.04 0.12 6.02 -1.26 -4.70 117.38 112.14 1wwx n GLN 97 Ca -0.22 -0.14 0.14 0.00 -0.01 0.00 0.00 57.00 56.77 1wwx n GLN 97 Cb 0.95 -1.36 -0.04 0.00 1.02 0.00 0.00 30.24 30.81 1wwx n GLN 97 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1wwx n GLU 98 N 0.39 -2.08 -1.41 -1.09 2.13 -1.26 -5.00 120.64 112.32 1wwx n GLU 98 Ca 0.00 1.39 0.00 0.00 0.66 0.00 0.00 57.16 59.21 1wwx n GLU 98 Cb 0.63 -2.54 0.00 0.00 0.27 0.00 0.00 31.44 29.80 1wwx n GLU 98 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1wwx n ASP 99 N -4.35 -7.61 -3.78 4.31 9.92 -1.26 -4.80 116.55 108.98 1wwx n ASP 99 Ca 0.00 1.64 -0.27 0.00 -0.53 0.00 0.00 54.79 55.63 1wwx n ASP 99 Cb 0.62 -4.44 0.00 0.00 -0.64 0.00 0.00 41.12 36.66 1wwx n ASP 99 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1wwx n LYS 100 N -2.38 -1.15 -3.91 -1.24 4.81 -1.26 -4.76 118.16 108.27 1wwx n LYS 100 Ca 0.00 0.52 -0.11 0.00 -0.87 0.00 0.00 58.31 57.85 1wwx n LYS 100 Cb 0.40 -2.04 -0.13 0.00 0.02 0.00 0.00 35.03 33.28 1wwx n LYS 100 CO 0.00 0.00 0.00 -0.48 1.17 0.00 0.00 177.40 178.09 1wwx s LEU 101 N -5.30 2.07 -0.30 3.14 2.34 -1.26 -3.93 118.68 115.44 1wwx s LEU 101 Ca 0.10 -0.14 -0.17 0.00 0.06 0.00 0.00 54.13 53.98 1wwx s LEU 101 Cb -0.06 0.02 0.18 0.00 -0.56 0.00 0.00 46.19 45.77 1wwx s LEU 101 CO 0.84 -0.08 1.20 -0.44 -1.06 0.00 0.00 176.35 176.80 1wwx s SER 102 N -0.42 -0.04 0.06 1.48 0.01 -1.26 -5.07 113.70 108.47 1wwx s SER 102 Ca -0.05 0.01 -0.15 0.00 1.31 0.00 0.00 55.95 57.08 1wwx s SER 102 Cb -0.03 1.03 0.02 0.00 0.21 0.00 0.00 66.02 67.25 1wwx s SER 102 CO -0.00 -0.01 0.33 -0.83 0.41 0.00 0.00 173.24 173.14 1wwx s GLY 103 N 3.00 -0.16 0.16 3.44 0.00 -1.26 -5.06 107.32 107.44 1wwx s GLY 103 Ca 0.25 -0.00 -0.08 0.00 0.00 0.00 0.00 44.72 44.89 1wwx s GLY 103 CO -0.19 -0.23 1.50 -0.56 0.00 0.00 0.00 173.10 173.62 1wwx h PRO 104 N 2.98 0.84 -6.02 2.90 0.13 -2.09 -3.45 132.00 127.28 1wwx h PRO 104 Ca -0.32 -0.44 -0.59 0.00 -0.87 0.00 0.00 66.00 63.77 1wwx h PRO 104 Cb 1.21 0.02 -0.12 0.00 0.13 0.00 0.00 31.00 32.24 1wwx h PRO 104 CO 0.47 1.08 -0.64 -1.12 -0.23 0.00 0.00 178.00 177.55 1wwx s SER 105 N -6.85 4.05 0.11 1.44 0.01 -1.26 -5.16 113.70 106.05 1wwx s SER 105 Ca -0.10 -1.02 0.01 0.00 1.31 0.00 0.00 55.95 56.15 1wwx s SER 105 Cb 0.11 -0.49 -0.04 0.00 0.21 0.00 0.00 66.02 65.81 1wwx s SER 105 CO 0.87 -0.20 -0.05 -0.55 0.41 0.00 0.00 173.24 173.72 1wwx s SER 106 N -3.67 1.08 0.00 2.44 0.15 -1.26 -5.10 113.70 107.33 1wwx s SER 106 Ca 0.34 -1.04 0.00 0.00 0.70 0.00 0.00 55.95 55.95 1wwx s SER 106 Cb -0.00 0.11 0.00 0.00 -1.71 0.00 0.00 66.02 64.42 1wwx s SER 106 CO 0.18 -0.50 0.00 0.61 1.20 0.00 0.00 173.24 174.74