#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ywx s ASP 2 N 0.00 5.14 0.07 6.12 1.01 -0.76 -5.00 116.67 123.25 1ywx s ASP 2 Ca 0.00 -1.07 0.09 0.00 0.71 0.00 0.00 52.55 52.28 1ywx s ASP 2 Cb 0.00 -1.83 -0.03 0.00 1.01 0.00 0.00 42.92 42.07 1ywx s ASP 2 CO 0.00 -0.28 -0.25 -0.63 0.21 0.00 0.00 175.17 174.22 1ywx s ILE 3 N 1.39 2.03 -0.02 0.77 1.01 -1.26 0.15 121.20 125.26 1ywx s ILE 3 Ca -0.01 -1.44 -0.00 0.00 0.00 0.00 0.00 60.65 59.19 1ywx s ILE 3 Cb -0.19 -1.76 0.03 0.00 0.01 0.00 0.00 42.46 40.55 1ywx s ILE 3 CO 0.02 0.24 0.03 -0.55 0.00 0.00 0.00 174.94 174.67 1ywx s SER 4 N -1.46 0.26 0.28 3.58 0.15 -0.31 -4.96 113.70 111.23 1ywx s SER 4 Ca 0.11 0.03 -0.29 0.00 0.70 0.00 0.00 55.95 56.50 1ywx s SER 4 Cb -0.10 -0.11 -0.09 0.00 -1.71 0.00 0.00 66.02 64.01 1ywx s SER 4 CO 0.03 -0.14 1.03 -0.63 1.20 0.00 0.00 173.24 174.73 1ywx s ILE 5 N 1.19 3.75 -0.12 6.45 -1.09 -1.26 0.28 121.20 130.40 1ywx s ILE 5 Ca -0.08 1.69 -0.12 0.00 -2.23 0.00 0.00 60.65 59.91 1ywx s ILE 5 Cb -0.13 -4.04 -0.05 0.00 -1.58 0.00 0.00 42.46 36.65 1ywx s ILE 5 CO -0.03 0.35 -0.25 -0.38 -1.23 0.00 0.00 174.94 173.39 1ywx n ILE 6 N 1.09 1.36 -4.12 2.92 2.08 -0.32 -4.90 119.36 117.46 1ywx n ILE 6 Ca -0.00 0.11 -0.08 0.00 0.56 0.00 0.00 62.75 63.33 1ywx n ILE 6 Cb 0.46 -2.06 -0.10 0.00 -0.75 0.00 0.00 39.64 37.20 1ywx n ILE 6 CO 0.00 0.00 0.00 -0.44 0.56 0.00 0.00 176.55 176.67 1ywx s SER 7 N -6.13 0.40 -0.43 4.38 0.01 -1.01 -5.03 113.70 105.90 1ywx s SER 7 Ca -0.22 -1.11 0.02 0.00 1.31 0.00 0.00 55.95 55.95 1ywx s SER 7 Cb 0.05 0.25 0.15 0.00 0.21 0.00 0.00 66.02 66.67 1ywx s SER 7 CO 0.32 -0.67 0.27 1.51 0.41 0.00 0.00 173.24 175.08 1ywx s ASP 8 N -2.99 3.11 0.28 2.44 1.47 -1.26 -2.55 116.67 117.17 1ywx s ASP 8 Ca 0.16 -2.66 -0.04 0.00 1.18 0.00 0.00 52.55 51.19 1ywx s ASP 8 Cb 0.08 -0.77 -0.05 0.00 -0.34 0.00 0.00 42.92 41.84 1ywx s ASP 8 CO -0.04 -0.25 0.53 -0.13 0.68 0.00 0.00 175.17 175.96 1ywx s ARG 9 N 0.39 3.61 -0.05 2.11 0.52 0.30 -5.01 118.95 120.82 1ywx s ARG 9 Ca 0.21 -0.05 0.03 0.00 -0.52 0.00 0.00 55.73 55.40 1ywx s ARG 9 Cb -0.17 -2.68 0.01 0.00 0.52 0.00 0.00 34.95 32.63 1ywx s ARG 9 CO -0.05 0.24 -0.13 1.21 0.02 0.00 0.00 175.30 176.59 1ywx s ASN 10 N -3.18 1.82 -0.48 0.23 2.47 -1.26 -2.28 114.94 112.27 1ywx s ASN 10 Ca 0.43 -0.30 0.03 0.00 0.42 0.00 0.00 52.86 53.44 1ywx s ASN 10 Cb -0.11 -0.69 0.13 0.00 -1.45 0.00 0.00 41.25 39.13 1ywx s ASN 10 CO 0.30 0.08 0.23 0.20 -3.72 0.00 0.00 177.10 174.18 1ywx s ASN 11 N 0.40 4.22 0.09 -4.21 0.01 0.40 -4.88 114.94 110.97 1ywx s ASN 11 Ca -0.10 -2.80 -0.13 0.00 -0.71 0.00 0.00 52.86 49.13 1ywx s ASN 11 Cb -0.13 -1.50 -0.19 0.00 0.41 0.00 0.00 41.25 39.84 1ywx s ASN 11 CO 0.03 -0.26 1.24 1.55 -1.51 0.00 0.00 177.10 178.15 1ywx h PRO 12 N 6.71 0.71 -0.06 -0.60 0.13 -1.93 1.13 132.00 138.10 1ywx h PRO 12 Ca -0.06 -0.69 0.01 0.00 -0.87 0.00 0.00 66.00 64.38 1ywx h PRO 12 Cb 0.92 0.18 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1ywx h PRO 12 CO 0.62 1.28 -0.04 -0.07 -0.23 0.00 0.00 178.00 179.57 1ywx h LEU 13 N 0.43 -0.13 -1.15 1.56 4.07 -1.92 0.69 115.31 118.87 1ywx h LEU 13 Ca -0.10 0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.88 1ywx h LEU 13 Cb 1.59 0.06 0.00 0.00 1.08 0.00 0.00 40.66 43.39 1ywx h LEU 13 CO 0.19 -0.01 0.00 -0.07 -1.08 0.00 0.00 178.44 177.46 1ywx h LEU 14 N -0.00 0.00 -0.35 1.67 3.38 -2.01 -3.46 115.31 114.55 1ywx h LEU 14 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1ywx h LEU 14 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1ywx h LEU 14 CO -0.06 0.00 0.00 1.67 0.09 0.00 0.00 178.44 180.14 1ywx n GLN 15 N -2.87 0.00 -4.44 1.13 7.27 0.24 -5.00 117.38 113.72 1ywx n GLN 15 Ca 0.01 0.00 -0.21 0.00 0.07 0.00 0.00 57.00 56.87 1ywx n GLN 15 Cb 0.31 -3.01 -0.10 0.00 2.41 0.00 0.00 30.24 29.84 1ywx n GLN 15 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1ywx s ARG 16 N -4.21 1.57 -0.14 3.69 0.52 0.38 -3.82 118.95 116.94 1ywx s ARG 16 Ca 0.00 -1.82 0.01 0.00 -0.52 0.00 0.00 55.73 53.40 1ywx s ARG 16 Cb 0.00 -1.09 -0.00 0.00 0.52 0.00 0.00 34.95 34.38 1ywx s ARG 16 CO 0.00 -0.02 -0.17 0.50 0.02 0.00 0.00 175.30 175.63 1ywx s ARG 17 N -3.77 3.18 -0.38 3.54 6.06 0.11 -0.45 118.95 127.24 1ywx s ARG 17 Ca 0.31 -0.77 -0.07 0.00 -2.50 0.00 0.00 55.73 52.69 1ywx s ARG 17 Cb 0.05 -2.56 0.06 0.00 0.06 0.00 0.00 34.95 32.56 1ywx s ARG 17 CO 0.13 0.04 0.19 -1.21 -2.50 0.00 0.00 175.30 171.95 1ywx s GLU 18 N 0.73 2.56 -0.06 5.12 2.02 -0.96 -0.77 118.70 127.33 1ywx s GLU 18 Ca -0.07 -1.37 0.04 0.00 0.02 0.00 0.00 54.97 53.59 1ywx s GLU 18 Cb -0.16 -3.63 -0.00 0.00 0.10 0.00 0.00 34.13 30.45 1ywx s GLU 18 CO 0.01 -0.84 -0.19 0.42 0.02 0.00 0.00 175.26 174.68 1ywx s ILE 19 N 1.39 1.62 -0.02 -1.63 1.01 0.06 -0.54 121.20 123.09 1ywx s ILE 19 Ca 0.01 -0.80 0.03 0.00 0.00 0.00 0.00 60.65 59.90 1ywx s ILE 19 Cb -0.21 -1.40 -0.03 0.00 0.01 0.00 0.00 42.46 40.82 1ywx s ILE 19 CO 0.02 0.46 -0.09 -0.75 0.00 0.00 0.00 174.94 174.58 1ywx s LYS 20 N 0.20 2.56 0.38 2.79 2.36 -1.06 0.75 119.74 127.73 1ywx s LYS 20 Ca -0.09 -0.68 -0.11 0.00 -2.55 0.00 0.00 55.97 52.53 1ywx s LYS 20 Cb -0.14 -2.48 0.04 0.00 -1.05 0.00 0.00 37.83 34.20 1ywx s LYS 20 CO 0.04 0.62 0.69 1.97 1.55 0.00 0.00 175.35 180.22 1ywx n PHE 21 N 1.89 -2.07 -4.36 4.03 1.16 -0.95 -1.17 117.46 115.98 1ywx n PHE 21 Ca -0.17 -1.97 -0.20 0.00 -1.87 0.00 0.00 57.45 53.24 1ywx n PHE 21 Cb 0.53 0.80 -0.10 0.00 -1.61 0.00 0.00 39.48 39.09 1ywx n PHE 21 CO 0.00 0.00 0.00 0.99 -1.87 0.00 0.00 176.76 175.88 1ywx s THR 22 N -2.33 1.87 -0.10 1.97 2.01 0.14 -2.34 115.64 116.86 1ywx s THR 22 Ca 0.19 -2.19 -0.06 0.00 0.31 0.00 0.00 61.69 59.95 1ywx s THR 22 Cb -0.04 -2.04 0.04 0.00 0.01 0.00 0.00 72.50 70.47 1ywx s THR 22 CO 0.14 -0.51 0.24 0.54 -0.69 0.00 0.00 174.62 174.34 1ywx s VAL 23 N -2.72 -0.03 0.06 3.82 0.11 0.27 -1.16 120.40 120.74 1ywx s VAL 23 Ca 0.22 0.11 0.03 0.00 -2.93 0.00 0.00 61.98 59.42 1ywx s VAL 23 Cb -0.02 -0.36 -0.03 0.00 -1.53 0.00 0.00 36.38 34.44 1ywx s VAL 23 CO 0.08 0.05 -0.11 -0.55 -3.33 0.00 0.00 175.10 171.24 1ywx s SER 24 N 0.99 1.23 0.22 3.54 0.15 0.12 0.35 113.70 120.31 1ywx s SER 24 Ca -0.07 -0.60 -0.22 0.00 0.70 0.00 0.00 55.95 55.76 1ywx s SER 24 Cb -0.08 0.00 0.04 0.00 -1.71 0.00 0.00 66.02 64.27 1ywx s SER 24 CO -0.06 -0.16 0.70 0.72 1.20 0.00 0.00 173.24 175.64 1ywx s PHE 25 N -1.44 -0.31 -0.33 3.44 -0.12 -1.18 -1.82 117.98 116.22 1ywx s PHE 25 Ca -0.05 -0.04 0.02 0.00 -0.05 0.00 0.00 56.93 56.80 1ywx s PHE 25 Cb -0.09 0.65 0.09 0.00 -0.63 0.00 0.00 43.02 43.03 1ywx s PHE 25 CO 0.01 -1.05 0.03 -0.51 -0.05 0.00 0.00 175.22 173.65 1ywx s ASP 26 N -2.85 4.79 0.53 1.98 1.01 -1.26 -4.79 116.67 116.08 1ywx s ASP 26 Ca 0.07 -1.87 0.00 0.00 0.71 0.00 0.00 52.55 51.46 1ywx s ASP 26 Cb -0.04 -1.65 0.00 0.00 1.01 0.00 0.00 42.92 42.24 1ywx s ASP 26 CO -0.01 -0.35 0.00 0.00 0.21 0.00 0.00 175.17 175.02 1ywx n ALA 27 N 4.39 -2.65 -1.86 5.23 0.00 -1.26 -5.02 120.51 119.34 1ywx n ALA 27 Ca -0.03 0.65 -0.02 0.00 0.00 0.00 0.00 53.44 54.04 1ywx n ALA 27 Cb 0.42 -1.35 -0.02 0.00 0.00 0.00 0.00 19.45 18.50 1ywx n ALA 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ywx n ALA 28 N -3.38 -3.21 -2.55 0.00 0.00 -1.26 -4.98 120.51 105.13 1ywx n ALA 28 Ca -0.05 0.84 -0.41 0.00 0.00 0.00 0.00 53.44 53.82 1ywx n ALA 28 Cb 0.52 -1.65 -0.09 0.00 0.00 0.00 0.00 19.45 18.22 1ywx n ALA 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ywx s THR 29 N -0.24 5.16 0.00 0.00 2.01 -1.26 -5.03 115.64 116.28 1ywx s THR 29 Ca -0.10 0.11 0.00 0.00 0.31 0.00 0.00 61.69 62.01 1ywx s THR 29 Cb 0.01 -3.82 0.00 0.00 0.01 0.00 0.00 72.50 68.69 1ywx s THR 29 CO 0.26 -0.08 0.00 -0.81 -0.69 0.00 0.00 174.62 173.30 1ywx n PRO 30 N 5.41 0.69 -4.57 4.92 -0.04 -1.26 -5.11 135.00 135.04 1ywx n PRO 30 Ca -0.09 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.10 1ywx n PRO 30 Cb 0.49 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.87 1ywx n PRO 30 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1ywx s SER 31 N -1.25 3.08 0.02 3.54 0.01 -1.26 -4.98 113.70 112.86 1ywx s SER 31 Ca 0.00 -1.66 -0.25 0.00 1.31 0.00 0.00 55.95 55.35 1ywx s SER 31 Cb 0.00 0.48 -0.17 0.00 0.21 0.00 0.00 66.02 66.54 1ywx s SER 31 CO 0.00 -0.90 1.38 0.40 0.41 0.00 0.00 173.24 174.53 1ywx h ILE 32 N 1.70 0.87 -1.00 1.44 2.04 -1.96 1.44 117.51 122.04 1ywx h ILE 32 Ca -0.37 -0.54 0.01 0.00 1.00 0.00 0.00 64.86 64.96 1ywx h ILE 32 Cb 1.28 1.19 -0.05 0.00 -0.74 0.00 0.00 36.82 38.50 1ywx h ILE 32 CO 0.61 0.12 0.67 0.50 0.00 0.00 0.00 178.15 180.04 1ywx h LYS 33 N -0.55 1.31 0.00 2.37 3.11 -1.97 1.53 116.57 122.36 1ywx h LYS 33 Ca -0.03 -0.08 -0.11 0.00 -2.81 0.00 0.00 60.65 57.62 1ywx h LYS 33 Cb 0.41 -0.30 -0.02 0.00 -1.00 0.00 0.00 32.23 31.33 1ywx h LYS 33 CO 0.05 0.87 -0.53 -0.44 -2.81 0.00 0.00 179.45 176.59 1ywx h ASP 34 N 1.35 0.00 0.28 4.20 3.32 -1.92 -2.97 116.42 120.68 1ywx h ASP 34 Ca 0.37 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 57.12 1ywx h ASP 34 Cb -0.14 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.44 1ywx h ASP 34 CO -0.09 0.53 -1.33 0.58 -1.72 0.00 0.00 179.24 177.22 1ywx h VAL 35 N 0.00 1.32 -0.14 -1.35 2.07 0.38 -3.15 116.25 115.38 1ywx h VAL 35 Ca -0.01 -2.66 0.04 0.00 0.82 0.00 0.00 66.70 64.90 1ywx h VAL 35 Cb 1.10 2.86 -0.01 0.00 -1.52 0.00 0.00 31.29 33.73 1ywx h VAL 35 CO 0.07 0.80 0.13 0.07 0.02 0.00 0.00 177.57 178.66 1ywx h LYS 36 N 0.19 0.00 0.01 1.57 2.10 0.22 -1.69 116.57 118.98 1ywx h LYS 36 Ca -0.20 0.00 0.03 0.00 -2.00 0.00 0.00 60.65 58.48 1ywx h LYS 36 Cb 2.01 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 33.29 1ywx h LYS 36 CO 0.25 0.00 -0.36 0.52 -2.00 0.00 0.00 179.45 177.85 1ywx h MET 37 N 0.00 -0.51 0.04 0.07 2.86 -1.48 1.57 114.93 117.48 1ywx h MET 37 Ca 0.07 0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1ywx h MET 37 Cb 0.33 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1ywx h MET 37 CO -0.00 -0.34 -0.02 0.87 1.06 0.00 0.00 176.91 178.48 1ywx h LYS 38 N -0.53 -0.05 -0.93 1.72 6.56 -1.57 -2.97 116.57 118.81 1ywx h LYS 38 Ca 0.05 0.00 0.22 0.00 -1.06 0.00 0.00 60.65 59.87 1ywx h LYS 38 Cb 0.61 0.01 -0.07 0.00 -0.57 0.00 0.00 32.23 32.21 1ywx h LYS 38 CO -0.28 0.45 0.62 -0.07 -2.06 0.00 0.00 179.45 178.11 1ywx h LEU 39 N -0.57 0.38 -0.70 2.94 3.38 -1.14 0.58 115.31 120.19 1ywx h LEU 39 Ca -0.00 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.02 1ywx h LEU 39 Cb 0.52 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 1ywx h LEU 39 CO 0.01 0.14 0.45 0.58 0.09 0.00 0.00 178.44 179.71 1ywx h VAL 40 N 0.37 1.15 -0.06 1.22 2.07 0.24 1.46 116.25 122.70 1ywx h VAL 40 Ca 0.49 -0.31 -0.19 0.00 0.82 0.00 0.00 66.70 67.50 1ywx h VAL 40 Cb 1.28 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.21 1ywx h VAL 40 CO -0.18 0.17 -0.77 0.00 0.02 0.00 0.00 177.57 176.80 1ywx h ALA 41 N 1.27 0.54 0.16 1.67 0.00 0.04 1.44 119.26 124.38 1ywx h ALA 41 Ca 0.26 -0.63 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1ywx h ALA 41 Cb -0.07 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1ywx h ALA 41 CO -0.07 0.77 -0.08 0.28 0.00 0.00 0.00 179.25 180.15 1ywx h VAL 42 N 0.27 0.97 -0.03 0.00 2.07 0.43 -3.16 116.25 116.80 1ywx h VAL 42 Ca -0.04 -0.75 -0.18 0.00 0.82 0.00 0.00 66.70 66.55 1ywx h VAL 42 Cb 1.36 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 32.54 1ywx h VAL 42 CO 0.13 0.17 -0.75 -0.07 0.02 0.00 0.00 177.57 177.07 1ywx h LEU 43 N -0.59 0.28 -2.64 2.57 3.38 0.20 -3.48 115.31 115.03 1ywx h LEU 43 Ca -0.02 -0.20 -0.23 0.00 0.09 0.00 0.00 57.88 57.52 1ywx h LEU 43 Cb 0.45 -0.08 0.11 0.00 0.09 0.00 0.00 40.66 41.22 1ywx h LEU 43 CO 0.04 0.93 -0.65 -3.20 0.09 0.00 0.00 178.44 175.65 1ywx n ASN 44 N -3.76 -6.64 -2.20 -0.43 5.15 0.49 -5.02 115.26 102.85 1ywx n ASN 44 Ca -0.03 -0.60 -0.10 0.00 -0.60 0.00 0.00 54.58 53.24 1ywx n ASN 44 Cb 0.72 -4.73 -0.04 0.00 -0.53 0.00 0.00 39.78 35.21 1ywx n ASN 44 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ywx n ALA 45 N -2.98 0.30 -1.64 5.20 0.00 -1.19 -5.05 120.51 115.16 1ywx n ALA 45 Ca -0.07 -1.03 -0.39 0.00 0.00 0.00 0.00 53.44 51.95 1ywx n ALA 45 Cb 0.58 0.84 -0.03 0.00 0.00 0.00 0.00 19.45 20.84 1ywx n ALA 45 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1ywx s ASN 46 N -2.26 4.86 0.51 0.00 3.84 -1.26 -4.77 114.94 115.86 1ywx s ASN 46 Ca 0.21 1.25 0.26 0.00 0.21 0.00 0.00 52.86 54.78 1ywx s ASN 46 Cb 0.01 -2.51 1.37 0.00 -0.55 0.00 0.00 41.25 39.57 1ywx s ASN 46 CO 0.15 -2.53 2.05 0.07 -2.79 0.00 0.00 177.10 174.05 1ywx h LYS 47 N 17.63 0.00 0.45 0.43 5.09 -1.93 -3.03 116.57 135.21 1ywx h LYS 47 Ca -0.29 0.00 -0.02 0.00 0.09 0.00 0.00 60.65 60.43 1ywx h LYS 47 Cb 1.25 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.58 1ywx h LYS 47 CO 1.10 0.13 -0.25 1.96 -2.09 0.00 0.00 179.45 180.31 1ywx h GLN 48 N 0.00 -0.62 -2.15 0.07 4.20 -2.02 -3.04 115.11 111.55 1ywx h GLN 48 Ca -0.00 0.04 -0.59 0.00 0.06 0.00 0.00 58.65 58.16 1ywx h GLN 48 Cb 0.35 0.14 -0.18 0.00 0.30 0.00 0.00 27.48 28.10 1ywx h GLN 48 CO 0.02 -0.41 0.95 1.33 -0.67 0.00 0.00 178.83 180.04 1ywx n VAL 49 N -3.85 3.91 -4.30 -0.54 0.24 -1.17 -4.87 118.33 107.76 1ywx n VAL 49 Ca -0.08 -3.55 -0.19 0.00 -2.04 0.00 0.00 64.34 58.48 1ywx n VAL 49 Cb 0.26 -1.67 -0.15 0.00 -1.47 0.00 0.00 33.84 30.81 1ywx n VAL 49 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1ywx s LEU 50 N -2.43 1.74 0.33 1.34 0.20 -1.15 -2.17 118.68 116.53 1ywx s LEU 50 Ca 0.56 -0.16 -0.10 0.00 0.69 0.00 0.00 54.13 55.13 1ywx s LEU 50 Cb 0.33 -0.47 0.02 0.00 -0.43 0.00 0.00 46.19 45.64 1ywx s LEU 50 CO -0.21 0.04 0.59 -0.69 -0.29 0.00 0.00 176.35 175.79 1ywx s VAL 51 N 0.26 0.00 0.02 1.68 1.01 -1.18 -4.97 120.40 117.23 1ywx s VAL 51 Ca -0.04 -1.33 0.01 0.00 0.00 0.00 0.00 61.98 60.62 1ywx s VAL 51 Cb -0.08 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1ywx s VAL 51 CO 0.00 0.00 0.06 0.54 0.00 0.00 0.00 175.10 175.70 1ywx s VAL 52 N -3.12 4.53 -0.12 2.92 0.11 -1.26 -2.66 120.40 120.80 1ywx s VAL 52 Ca 0.23 -0.56 -0.10 0.00 -2.93 0.00 0.00 61.98 58.62 1ywx s VAL 52 Cb -0.02 -3.09 -0.08 0.00 -1.53 0.00 0.00 36.38 31.65 1ywx s VAL 52 CO 0.14 0.29 0.18 0.44 -3.33 0.00 0.00 175.10 172.83 1ywx h ASP 53 N 3.93 0.00 -4.62 3.54 5.19 -0.97 -3.45 116.42 120.04 1ywx h ASP 53 Ca -0.48 -0.28 0.19 0.00 -0.62 0.00 0.00 57.03 55.83 1ywx h ASP 53 Cb 1.18 0.00 -0.16 0.00 0.18 0.00 0.00 39.33 40.53 1ywx h ASP 53 CO 0.62 0.71 0.64 -0.89 -3.12 0.00 0.00 179.24 177.20 1ywx s THR 54 N -1.85 0.00 0.25 0.35 2.01 -1.08 -4.98 115.64 110.35 1ywx s THR 54 Ca -0.08 -0.07 0.02 0.00 0.31 0.00 0.00 61.69 61.86 1ywx s THR 54 Cb -0.00 -1.15 -0.04 0.00 0.01 0.00 0.00 72.50 71.32 1ywx s THR 54 CO 0.23 0.00 0.15 -0.22 -0.69 0.00 0.00 174.62 174.10 1ywx s LEU 55 N -2.44 1.43 -0.29 4.42 2.96 -1.26 0.76 118.68 124.25 1ywx s LEU 55 Ca 0.08 -1.48 -0.13 0.00 -0.22 0.00 0.00 54.13 52.37 1ywx s LEU 55 Cb -0.01 0.32 0.12 0.00 0.50 0.00 0.00 46.19 47.12 1ywx s LEU 55 CO -0.06 -0.87 0.74 -1.81 -1.32 0.00 0.00 176.35 173.03 1ywx s ASP 56 N -3.26 -0.95 0.41 3.68 1.11 0.46 -4.89 116.67 113.23 1ywx s ASP 56 Ca 0.38 1.38 -0.24 0.00 0.18 0.00 0.00 52.55 54.25 1ywx s ASP 56 Cb 0.06 1.85 -0.08 0.00 1.07 0.00 0.00 42.92 45.81 1ywx s ASP 56 CO 0.16 -0.20 1.13 -1.58 1.18 0.00 0.00 175.17 175.86 1ywx s GLN 57 N 2.32 4.04 -0.11 8.23 0.74 -1.26 0.46 119.66 134.07 1ywx s GLN 57 Ca -0.07 1.72 -0.16 0.00 0.05 0.00 0.00 55.36 56.90 1ywx s GLN 57 Cb -0.08 -2.59 -0.05 0.00 1.10 0.00 0.00 33.01 31.39 1ywx s GLN 57 CO -0.19 -0.30 0.42 0.42 -0.55 0.00 0.00 175.29 175.09 1ywx s ILE 58 N -1.51 5.19 -0.07 -2.34 -1.09 0.51 -4.84 121.20 117.05 1ywx s ILE 58 Ca 0.58 0.83 -0.26 0.00 -2.23 0.00 0.00 60.65 59.57 1ywx s ILE 58 Cb -0.28 -3.75 -0.24 0.00 -1.58 0.00 0.00 42.46 36.62 1ywx s ILE 58 CO 0.34 0.38 0.99 0.15 -1.23 0.00 0.00 174.94 175.57 1ywx h PHE 59 N 6.38 0.15 -0.86 3.97 3.04 -1.95 -3.35 116.94 124.31 1ywx h PHE 59 Ca -0.43 -0.08 0.08 0.00 3.98 0.00 0.00 57.97 61.52 1ywx h PHE 59 Cb 1.18 -0.02 -0.11 0.00 2.56 0.00 0.00 35.95 39.57 1ywx h PHE 59 CO 0.63 0.90 -0.50 0.41 -2.02 0.00 0.00 178.31 177.72 1ywx n GLY 60 N 1.10 -2.23 0.00 2.40 0.00 -1.26 -4.72 105.19 100.48 1ywx n GLY 60 Ca -0.10 1.03 0.00 0.00 0.00 0.00 0.00 46.02 46.95 1ywx n GLY 60 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ywx n LYS 61 N -5.09 2.30 -1.37 1.61 2.85 -1.25 -5.02 118.16 112.19 1ywx n LYS 61 Ca 0.02 0.00 -0.33 0.00 -1.05 0.00 0.00 58.31 56.95 1ywx n LYS 61 Cb 0.23 0.00 0.06 0.00 -0.65 0.00 0.00 35.03 34.68 1ywx n LYS 61 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1ywx n LEU 62 N 0.00 7.50 -4.99 -5.58 4.77 -1.26 -4.58 117.00 112.86 1ywx n LEU 62 Ca 0.00 -4.24 -0.19 0.00 -0.03 0.00 0.00 56.01 51.55 1ywx n LEU 62 Cb 0.00 -1.01 0.03 0.00 -2.33 0.00 0.00 43.42 40.11 1ywx n LEU 62 CO 0.00 1.49 0.26 -0.70 -1.33 0.00 0.00 177.39 177.11 1ywx s GLU 63 N -3.56 2.66 -0.28 3.23 2.12 -1.26 -3.11 118.70 118.51 1ywx s GLU 63 Ca 0.59 -1.05 -0.07 0.00 0.36 0.00 0.00 54.97 54.80 1ywx s GLU 63 Cb 0.46 -2.63 0.14 0.00 0.26 0.00 0.00 34.13 32.37 1ywx s GLU 63 CO -0.07 -0.51 0.58 0.00 -0.54 0.00 0.00 175.26 174.72 1ywx s ALA 64 N -2.56 -1.91 -0.07 6.30 0.00 0.16 0.19 121.76 123.87 1ywx s ALA 64 Ca 0.56 1.99 -0.04 0.00 0.00 0.00 0.00 51.96 54.47 1ywx s ALA 64 Cb -0.10 -1.81 -0.04 0.00 0.00 0.00 0.00 23.12 21.17 1ywx s ALA 64 CO 0.36 -1.04 0.11 -2.00 0.00 0.00 0.00 175.76 173.20 1ywx s GLU 65 N 2.82 3.29 0.30 0.00 2.12 0.17 0.95 118.70 128.35 1ywx s GLU 65 Ca 0.03 -0.28 -0.17 0.00 0.36 0.00 0.00 54.97 54.91 1ywx s GLU 65 Cb -0.13 -3.04 0.02 0.00 0.26 0.00 0.00 34.13 31.24 1ywx s GLU 65 CO -0.18 0.72 0.68 0.20 -0.54 0.00 0.00 175.26 176.13 1ywx s GLY 66 N -1.33 0.21 -0.11 -1.50 0.00 -0.99 0.18 107.32 103.78 1ywx s GLY 66 Ca 0.19 -0.58 0.03 0.00 0.00 0.00 0.00 44.72 44.36 1ywx s GLY 66 CO 0.09 -0.29 -0.21 -0.47 0.00 0.00 0.00 173.10 172.22 1ywx s TYR 67 N -3.55 2.64 -0.19 1.90 5.04 0.23 -2.25 117.35 121.17 1ywx s TYR 67 Ca 0.15 -0.94 -0.07 0.00 -2.44 0.00 0.00 57.07 53.76 1ywx s TYR 67 Cb -0.04 -1.76 -0.04 0.00 0.35 0.00 0.00 41.96 40.47 1ywx s TYR 67 CO 0.09 -0.37 0.07 0.00 -1.34 0.00 0.00 175.55 174.00 1ywx s ALA 68 N 0.37 3.38 0.13 3.97 0.00 0.23 -0.29 121.76 129.53 1ywx s ALA 68 Ca -0.16 -0.80 0.09 0.00 0.00 0.00 0.00 51.96 51.10 1ywx s ALA 68 Cb -0.17 -1.95 -0.04 0.00 0.00 0.00 0.00 23.12 20.96 1ywx s ALA 68 CO 0.07 0.08 -0.20 0.21 0.00 0.00 0.00 175.76 175.93 1ywx s LYS 69 N 0.55 1.71 -0.04 0.00 2.36 -1.09 -0.76 119.74 122.47 1ywx s LYS 69 Ca 0.03 -1.23 0.05 0.00 -2.55 0.00 0.00 55.97 52.28 1ywx s LYS 69 Cb -0.13 -2.06 -0.01 0.00 -1.05 0.00 0.00 37.83 34.58 1ywx s LYS 69 CO 0.01 0.47 -0.20 0.42 1.55 0.00 0.00 175.35 177.60 1ywx s ILE 70 N -1.17 1.66 0.57 5.43 1.01 0.05 -3.08 121.20 125.67 1ywx s ILE 70 Ca 0.18 -0.86 0.04 0.00 0.00 0.00 0.00 60.65 60.01 1ywx s ILE 70 Cb -0.10 -1.41 0.07 0.00 0.01 0.00 0.00 42.46 41.03 1ywx s ILE 70 CO 0.10 0.47 0.79 -0.31 0.00 0.00 0.00 174.94 175.99 1ywx s TYR 71 N -0.14 2.16 0.00 3.97 1.51 -0.92 -0.71 117.35 123.21 1ywx s TYR 71 Ca -0.01 -0.34 0.00 0.00 -1.01 0.00 0.00 57.07 55.71 1ywx s TYR 71 Cb -0.11 -2.60 0.00 0.00 -0.11 0.00 0.00 41.96 39.13 1ywx s TYR 71 CO 0.02 -1.06 0.00 0.09 -1.11 0.00 0.00 175.55 173.49 1ywx n ASN 72 N -2.34 2.04 -3.67 2.29 3.02 -1.25 -4.88 115.26 110.47 1ywx n ASN 72 Ca 0.12 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.58 1ywx n ASN 72 Cb 0.60 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.68 1ywx n ASN 72 CO 0.00 0.00 0.00 1.51 -2.62 0.00 0.00 177.26 176.15 1ywx s ASP 73 N -4.33 -0.53 0.64 6.41 1.47 -1.26 -5.01 116.67 114.07 1ywx s ASP 73 Ca 0.00 1.06 0.43 0.00 1.18 0.00 0.00 52.55 55.23 1ywx s ASP 73 Cb 0.00 1.17 2.34 0.00 -0.34 0.00 0.00 42.92 46.10 1ywx s ASP 73 CO 0.00 -0.22 2.33 -0.33 0.68 0.00 0.00 175.17 177.63 1ywx h GLU 74 N 7.55 0.00 -0.15 2.11 5.08 -1.97 -1.83 114.58 125.36 1ywx h GLU 74 Ca -0.27 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.12 1ywx h GLU 74 Cb 1.16 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.38 1ywx h GLU 74 CO 0.20 0.00 -0.03 0.87 -1.00 0.00 0.00 179.01 179.05 1ywx h LYS 75 N 0.00 0.01 0.12 2.33 1.79 -1.99 1.04 116.57 119.88 1ywx h LYS 75 Ca 0.00 -0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 1ywx h LYS 75 Cb 0.01 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 1ywx h LYS 75 CO 0.00 0.01 -0.06 0.00 -1.08 0.00 0.00 179.45 178.32 1ywx h ALA 76 N 1.14 -0.16 -0.75 3.86 0.00 -1.77 -3.26 119.26 118.33 1ywx h ALA 76 Ca 0.07 -0.25 0.16 0.00 0.00 0.00 0.00 54.91 54.89 1ywx h ALA 76 Cb 0.10 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 17.85 1ywx h ALA 76 CO -0.14 -0.28 0.23 1.98 0.00 0.00 0.00 179.25 181.04 1ywx h MET 77 N -0.79 0.33 -1.12 0.00 1.85 -1.35 1.83 114.93 115.68 1ywx h MET 77 Ca -0.02 -0.02 0.31 0.00 -0.61 0.00 0.00 59.70 59.37 1ywx h MET 77 Cb 0.55 -0.07 -0.09 0.00 0.43 0.00 0.00 31.60 32.42 1ywx h MET 77 CO 0.03 0.22 0.73 0.00 -0.40 0.00 0.00 176.91 177.49 1ywx h ALA 78 N 1.59 2.47 0.00 0.39 0.00 0.11 0.03 119.26 123.85 1ywx h ALA 78 Ca 0.42 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.39 1ywx h ALA 78 Cb 0.70 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1ywx h ALA 78 CO -0.47 -0.91 -0.44 2.41 0.00 0.00 0.00 179.25 179.84 1ywx n THR 79 N -4.57 0.67 0.00 0.00 -1.04 0.15 -4.73 114.28 104.76 1ywx n THR 79 Ca 0.28 0.34 0.00 0.00 -2.04 0.00 0.00 64.05 62.63 1ywx n THR 79 Cb 1.04 -1.88 0.00 0.00 -1.82 0.00 0.00 70.33 67.67 1ywx n THR 79 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1ywx n ILE 80 N -3.37 0.00 -0.38 12.58 5.41 0.58 -4.52 119.36 129.65 1ywx n ILE 80 Ca -0.06 1.40 -0.28 0.00 1.00 0.00 0.00 62.75 64.81 1ywx n ILE 80 Cb 0.23 -1.91 0.26 0.00 -0.71 0.00 0.00 39.64 37.50 1ywx n ILE 80 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1ywx n GLU 81 N -2.60 -3.54 -4.41 0.38 4.71 -0.01 -5.01 120.64 110.17 1ywx n GLU 81 Ca 0.00 -1.03 -0.20 0.00 -0.01 0.00 0.00 57.16 55.92 1ywx n GLU 81 Cb 0.00 -1.93 -0.10 0.00 -1.01 0.00 0.00 31.44 28.40 1ywx n GLU 81 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 1ywx s THR 82 N -2.21 1.17 0.62 2.62 -4.23 -1.26 -4.79 115.64 107.56 1ywx s THR 82 Ca 0.63 -2.03 0.28 0.00 -1.18 0.00 0.00 61.69 59.39 1ywx s THR 82 Cb -0.16 -2.62 0.33 0.00 1.34 0.00 0.00 72.50 71.39 1ywx s THR 82 CO 0.58 -0.13 1.83 0.07 -0.54 0.00 0.00 174.62 176.43 1ywx h LYS 83 N 2.25 0.00 -0.16 3.99 -0.00 -1.93 0.33 116.57 121.04 1ywx h LYS 83 Ca -0.40 0.00 -0.01 0.00 -0.00 0.00 0.00 60.65 60.24 1ywx h LYS 83 Cb 1.24 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 33.46 1ywx h LYS 83 CO 0.67 0.00 0.07 1.03 -0.00 0.00 0.00 179.45 181.22 1ywx h SER 84 N 0.00 0.22 -0.12 7.07 0.87 -1.98 1.47 113.55 121.09 1ywx h SER 84 Ca 0.14 -0.15 -0.07 0.00 -1.23 0.00 0.00 61.79 60.49 1ywx h SER 84 Cb 1.14 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 63.04 1ywx h SER 84 CO -0.00 0.31 -0.20 0.58 -0.53 0.00 0.00 176.83 176.99 1ywx h VAL 85 N 0.12 1.38 0.00 2.23 2.07 -0.80 -2.79 116.25 118.47 1ywx h VAL 85 Ca 0.06 -1.46 -0.01 0.00 0.82 0.00 0.00 66.70 66.11 1ywx h VAL 85 Cb 0.15 2.05 -0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1ywx h VAL 85 CO -0.01 0.42 -0.05 -0.07 0.02 0.00 0.00 177.57 177.89 1ywx h LEU 86 N -0.08 0.00 0.31 2.57 4.07 -1.15 -1.87 115.31 119.16 1ywx h LEU 86 Ca 0.01 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.95 1ywx h LEU 86 Cb 0.78 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.52 1ywx h LEU 86 CO 0.05 0.05 -0.15 -0.33 -1.08 0.00 0.00 178.44 176.98 1ywx h GLU 87 N 0.00 -0.40 -0.15 1.13 5.08 0.23 -2.91 114.58 117.57 1ywx h GLU 87 Ca -0.00 0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.29 1ywx h GLU 87 Cb 0.36 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1ywx h GLU 87 CO 0.01 -0.16 -0.33 1.57 -1.00 0.00 0.00 179.01 179.11 1ywx h LYS 88 N -0.60 0.29 -6.15 2.33 2.10 -1.39 -3.40 116.57 109.76 1ywx h LYS 88 Ca -0.04 -0.12 -0.53 0.00 -2.00 0.00 0.00 60.65 57.96 1ywx h LYS 88 Cb 0.43 -0.01 -0.04 0.00 -0.90 0.00 0.00 32.23 31.71 1ywx h LYS 88 CO 0.07 0.59 1.29 1.21 -2.00 0.00 0.00 179.45 180.60 1ywx s ASN 89 N -6.86 5.62 1.01 7.07 2.47 -0.73 -4.94 114.94 118.57 1ywx s ASN 89 Ca -0.05 0.68 -0.19 0.00 0.42 0.00 0.00 52.86 53.72 1ywx s ASN 89 Cb 0.14 -2.53 -0.08 0.00 -1.45 0.00 0.00 41.25 37.33 1ywx s ASN 89 CO 0.77 -2.04 -0.59 1.17 -3.72 0.00 0.00 177.10 172.69 1ywx n LYS 90 N 8.81 -0.30 0.00 0.43 4.81 -1.26 -4.83 118.16 125.83 1ywx n LYS 90 Ca 0.20 -0.07 0.00 0.00 -0.87 0.00 0.00 58.31 57.57 1ywx n LYS 90 Cb 0.50 -1.30 0.00 0.00 0.02 0.00 0.00 35.03 34.25 1ywx n LYS 90 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1ywx n ILE 91 N -3.25 0.00 0.00 3.15 5.41 -1.26 -4.65 119.36 118.76 1ywx n ILE 91 Ca 0.00 1.37 0.00 0.00 1.00 0.00 0.00 62.75 65.13 1ywx n ILE 91 Cb 0.61 -1.90 0.00 0.00 -0.71 0.00 0.00 39.64 37.64 1ywx n ILE 91 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1ywx n GLU 92 N -2.44 0.00 -1.24 0.38 4.07 -1.26 -4.66 120.64 115.50 1ywx n GLU 92 Ca 0.00 0.00 -0.11 0.00 -0.06 0.00 0.00 57.16 56.99 1ywx n GLU 92 Cb 0.00 0.00 0.06 0.00 -0.06 0.00 0.00 31.44 31.44 1ywx n GLU 92 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22 1ywx n GLU 93 N 0.00 0.01 0.00 5.31 0.28 -1.26 -5.12 120.64 119.86 1ywx n GLU 93 Ca 0.00 -1.07 0.00 0.00 -0.16 0.00 0.00 57.16 55.93 1ywx n GLU 93 Cb 0.00 -0.39 0.00 0.00 1.43 0.00 0.00 31.44 32.48 1ywx n GLU 93 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 1ywx n GLU 94 N -1.94 2.06 0.00 3.44 0.28 -1.26 -5.12 120.64 118.11 1ywx n GLU 94 Ca 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.07 1ywx n GLU 94 Cb 0.25 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.12 1ywx n GLU 94 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1ywx n ALA 95 N -3.00 0.00 -0.28 -1.84 0.00 -1.26 -5.06 120.51 109.07 1ywx n ALA 95 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 1ywx n ALA 95 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 1ywx n ALA 95 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ywx n GLU 96 N 0.00 -0.30 -3.78 0.00 1.02 -1.26 -4.46 120.64 111.86 1ywx n GLU 96 Ca 0.00 1.30 -0.15 0.00 -0.02 0.00 0.00 57.16 58.29 1ywx n GLU 96 Cb 0.00 -1.92 -0.16 0.00 -0.02 0.00 0.00 31.44 29.35 1ywx n GLU 96 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ywx s ALA 97 N -5.03 0.05 0.10 0.62 0.00 -1.26 -5.05 121.76 111.19 1ywx s ALA 97 Ca -0.08 0.29 -0.30 0.00 0.00 0.00 0.00 51.96 51.87 1ywx s ALA 97 Cb 0.07 -0.23 -0.11 0.00 0.00 0.00 0.00 23.12 22.86 1ywx s ALA 97 CO 0.42 -0.10 1.61 1.49 0.00 0.00 0.00 175.76 179.19 1ywx h GLU 98 N 7.14 -0.63 0.00 0.00 4.81 -2.01 -3.47 114.58 120.43 1ywx h GLU 98 Ca -0.43 0.04 0.16 0.00 -0.13 0.00 0.00 59.36 59.00 1ywx h GLU 98 Cb 1.13 0.14 -0.04 0.00 0.63 0.00 0.00 28.75 30.62 1ywx h GLU 98 CO 0.48 -0.42 -0.21 1.33 -0.73 0.00 0.00 179.01 179.47 1ywx n VAL 99 N -5.44 0.00 -3.95 0.32 0.24 -1.26 -5.02 118.33 103.22 1ywx n VAL 99 Ca -0.08 0.00 -0.00 0.00 -2.04 0.00 0.00 64.34 62.22 1ywx n VAL 99 Cb 0.35 -0.20 0.02 0.00 -1.47 0.00 0.00 33.84 32.54 1ywx n VAL 99 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ywx s ALA 100 N -1.50 -2.05 0.23 2.33 0.00 -1.26 -4.85 121.76 114.64 1ywx s ALA 100 Ca 0.00 -0.16 0.06 0.00 0.00 0.00 0.00 51.96 51.85 1ywx s ALA 100 Cb 0.00 0.84 -0.05 0.00 0.00 0.00 0.00 23.12 23.91 1ywx s ALA 100 CO 0.00 -1.11 -0.07 -2.00 0.00 0.00 0.00 175.76 172.58 1ywx s GLU 101 N -2.06 1.36 0.00 0.00 2.12 -1.26 -5.17 118.70 113.68 1ywx s GLU 101 Ca 0.26 -1.65 0.00 0.00 0.36 0.00 0.00 54.97 53.94 1ywx s GLU 101 Cb -0.02 -0.91 0.00 0.00 0.26 0.00 0.00 34.13 33.46 1ywx s GLU 101 CO 0.02 0.04 0.00 0.39 -0.54 0.00 0.00 175.26 175.18