#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d1p s LYS 6 N 0.00 2.65 0.19 -0.52 1.02 -1.26 -4.98 119.74 116.85 1d1p s LYS 6 Ca 0.00 -0.95 0.08 0.00 0.02 0.00 0.00 55.97 55.12 1d1p s LYS 6 Cb 0.00 -2.52 -0.04 0.00 -0.52 0.00 0.00 37.83 34.75 1d1p s LYS 6 CO 0.00 0.49 -0.01 0.96 -0.92 0.00 0.00 175.35 175.86 1d1p s ILE 7 N -1.66 3.60 -0.07 2.17 -4.36 -0.22 -4.71 121.20 115.94 1d1p s ILE 7 Ca 0.29 -1.55 0.05 0.00 -0.26 0.00 0.00 60.65 59.18 1d1p s ILE 7 Cb -0.10 -2.83 -0.01 0.00 1.25 0.00 0.00 42.46 40.78 1d1p s ILE 7 CO 0.21 -0.16 -0.24 -0.44 0.24 0.00 0.00 174.94 174.55 1d1p s SER 8 N -3.06 3.16 -0.04 4.36 0.01 -1.26 -0.32 113.70 116.54 1d1p s SER 8 Ca 0.28 -0.51 0.04 0.00 1.31 0.00 0.00 55.95 57.07 1d1p s SER 8 Cb -0.09 -1.05 -0.00 0.00 0.21 0.00 0.00 66.02 65.09 1d1p s SER 8 CO 0.18 0.22 -0.15 -0.69 0.41 0.00 0.00 173.24 173.21 1d1p s VAL 9 N -0.01 1.25 -0.05 3.43 1.01 -0.26 -1.13 120.40 124.66 1d1p s VAL 9 Ca -0.08 -0.62 0.05 0.00 0.00 0.00 0.00 61.98 61.33 1d1p s VAL 9 Cb -0.15 -1.09 -0.01 0.00 0.00 0.00 0.00 36.38 35.14 1d1p s VAL 9 CO 0.05 0.37 -0.20 0.00 0.00 0.00 0.00 175.10 175.32 1d1p s ALA 10 N 0.09 1.79 -0.07 5.51 0.00 -0.01 -1.32 121.76 127.75 1d1p s ALA 10 Ca -0.04 -0.84 -0.03 0.00 0.00 0.00 0.00 51.96 51.05 1d1p s ALA 10 Cb -0.11 -0.58 -0.04 0.00 0.00 0.00 0.00 23.12 22.40 1d1p s ALA 10 CO 0.02 0.33 0.07 -0.06 0.00 0.00 0.00 175.76 176.12 1d1p s PHE 11 N -0.03 3.34 -0.01 0.00 0.40 0.35 0.01 117.98 122.03 1d1p s PHE 11 Ca -0.04 0.30 0.04 0.00 -0.60 0.00 0.00 56.93 56.63 1d1p s PHE 11 Cb -0.13 -1.82 -0.01 0.00 0.51 0.00 0.00 43.02 41.57 1d1p s PHE 11 CO 0.03 0.58 -0.12 0.42 0.70 0.00 0.00 175.22 176.83 1d1p s ILE 12 N -1.02 0.94 0.07 0.64 -1.09 0.89 -1.22 121.20 120.41 1d1p s ILE 12 Ca 0.17 -0.50 0.01 0.00 -2.23 0.00 0.00 60.65 58.10 1d1p s ILE 12 Cb -0.12 -0.79 -0.01 0.00 -1.58 0.00 0.00 42.46 39.97 1d1p s ILE 12 CO 0.06 0.27 0.05 0.00 -1.23 0.00 0.00 174.94 174.09 1d1p h LEU 14 N 0.00 -0.11 -2.65 0.00 5.85 -1.95 -2.40 115.31 114.05 1d1p h LEU 14 Ca -0.05 -0.42 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1d1p h LEU 14 Cb 0.25 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.31 1d1p h LEU 14 CO 0.08 0.41 0.00 0.61 -0.34 0.00 0.00 178.44 179.19 1d1p n GLY 15 N 0.35 2.29 4.20 3.75 0.00 -1.26 -1.51 105.19 113.00 1d1p n GLY 15 Ca -0.08 -0.44 -0.33 0.00 0.00 0.00 0.00 46.02 45.17 1d1p n GLY 15 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1d1p n ASN 16 N 0.72 -1.41 0.00 1.61 4.05 -1.26 -4.47 115.26 114.50 1d1p n ASN 16 Ca 0.13 -1.09 0.00 0.00 0.45 0.00 0.00 54.58 54.07 1d1p n ASN 16 Cb 0.44 -2.48 0.00 0.00 1.23 0.00 0.00 39.78 38.97 1d1p n ASN 16 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 177.26 174.54 1d1p n PHE 17 N -4.39 0.00 -0.05 1.20 7.35 -1.26 -4.57 117.46 115.74 1d1p n PHE 17 Ca -0.11 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.48 1d1p n PHE 17 Cb 0.58 0.04 -0.03 0.00 0.35 0.00 0.00 39.48 40.42 1d1p n PHE 17 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1d1p h ARG 19 N -0.63 0.00 -0.25 0.00 3.08 -1.97 -3.35 114.38 111.27 1d1p h ARG 19 Ca -0.12 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.87 1d1p h ARG 19 Cb 0.83 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.87 1d1p h ARG 19 CO -0.07 0.33 -0.09 0.66 -1.07 0.00 0.00 179.97 179.73 1d1p h SER 20 N -1.00 0.38 -0.33 7.04 4.64 -1.90 -0.70 113.55 121.67 1d1p h SER 20 Ca -0.04 -0.08 -0.04 0.00 -0.47 0.00 0.00 61.79 61.17 1d1p h SER 20 Cb 0.46 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 1d1p h SER 20 CO -0.02 0.51 0.10 -0.65 -0.87 0.00 0.00 176.83 175.89 1d1p h PRO 21 N 0.38 0.60 -0.30 4.77 0.11 -1.85 0.23 132.00 135.94 1d1p h PRO 21 Ca 0.08 -0.10 -0.07 0.00 0.11 0.00 0.00 66.00 66.02 1d1p h PRO 21 Cb 0.39 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.39 1d1p h PRO 21 CO 0.02 0.55 -0.07 1.98 -0.21 0.00 0.00 178.00 180.27 1d1p h MET 22 N 0.59 0.58 -0.85 1.05 4.05 -1.53 -1.49 114.93 117.32 1d1p h MET 22 Ca 0.14 -0.22 -0.03 0.00 -0.28 0.00 0.00 59.70 59.30 1d1p h MET 22 Cb 0.23 -0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 30.95 1d1p h MET 22 CO -0.00 0.77 0.41 0.00 0.23 0.00 0.00 176.91 178.31 1d1p h ALA 23 N 0.79 1.10 -0.23 0.39 0.00 -0.61 -1.07 119.26 119.64 1d1p h ALA 23 Ca 0.08 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1d1p h ALA 23 Cb 0.55 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1d1p h ALA 23 CO 0.03 0.67 0.05 1.49 0.00 0.00 0.00 179.25 181.49 1d1p h GLU 24 N 1.22 0.37 -0.11 0.00 4.81 -0.82 -1.10 114.58 118.95 1d1p h GLU 24 Ca 0.29 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.43 1d1p h GLU 24 Cb 0.13 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1d1p h GLU 24 CO -0.04 0.49 0.06 0.00 -0.73 0.00 0.00 179.01 178.79 1d1p h ALA 25 N 0.87 0.14 -0.52 2.92 0.00 -1.06 -1.18 119.26 120.43 1d1p h ALA 25 Ca 0.07 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1d1p h ALA 25 Cb 0.29 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1d1p h ALA 25 CO 0.00 -0.30 0.19 0.82 0.00 0.00 0.00 179.25 179.96 1d1p h ILE 26 N 0.06 1.22 -0.52 0.00 2.04 -1.22 -1.86 117.51 117.23 1d1p h ILE 26 Ca 0.04 -0.70 -0.02 0.00 1.00 0.00 0.00 64.86 65.17 1d1p h ILE 26 Cb 0.11 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 1d1p h ILE 26 CO -0.01 0.26 0.23 0.15 0.00 0.00 0.00 178.15 178.79 1d1p h PHE 27 N 0.70 0.77 -0.85 1.37 3.57 -1.04 -1.15 116.94 120.32 1d1p h PHE 27 Ca 0.17 -0.05 0.03 0.00 3.53 0.00 0.00 57.97 61.65 1d1p h PHE 27 Cb 0.22 -0.23 -0.05 0.00 2.79 0.00 0.00 35.95 38.68 1d1p h PHE 27 CO 0.01 0.62 0.55 0.87 -2.23 0.00 0.00 178.31 178.13 1d1p h LYS 28 N 0.70 1.05 -0.49 1.11 1.57 -1.05 -1.54 116.57 117.92 1d1p h LYS 28 Ca 0.18 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1d1p h LYS 28 Cb 0.16 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 1d1p h LYS 28 CO -0.02 0.69 0.28 1.25 -0.57 0.00 0.00 179.45 181.09 1d1p h HIS 29 N 1.08 0.65 -0.21 -1.35 2.76 -0.85 -1.66 115.15 115.56 1d1p h HIS 29 Ca 0.33 -0.01 -0.16 0.00 -2.20 0.00 0.00 60.37 58.34 1d1p h HIS 29 Cb -0.02 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 28.73 1d1p h HIS 29 CO -0.02 0.46 -0.52 0.93 -1.30 0.00 0.00 177.93 177.48 1d1p h GLU 30 N 0.65 0.60 -0.64 5.26 4.39 -0.96 -0.98 114.58 122.89 1d1p h GLU 30 Ca 0.17 -0.36 0.01 0.00 0.34 0.00 0.00 59.36 59.52 1d1p h GLU 30 Cb 0.01 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.67 1d1p h GLU 30 CO -0.03 0.97 0.41 0.28 -1.16 0.00 0.00 179.01 179.49 1d1p h VAL 31 N 0.46 1.14 0.71 3.13 2.07 -1.05 -1.08 116.25 121.64 1d1p h VAL 31 Ca 0.02 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 1d1p h VAL 31 Cb 1.07 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 1d1p h VAL 31 CO 0.10 0.15 -0.42 -0.33 0.02 0.00 0.00 177.57 177.09 1d1p h GLU 32 N 0.84 -1.02 -0.96 1.57 3.07 -1.02 -0.97 114.58 116.09 1d1p h GLU 32 Ca 0.24 0.07 0.30 0.00 -0.50 0.00 0.00 59.36 59.46 1d1p h GLU 32 Cb -0.07 0.23 -0.18 0.00 -0.84 0.00 0.00 28.75 27.89 1d1p h GLU 32 CO -0.06 -0.68 0.14 1.63 -1.40 0.00 0.00 179.01 178.64 1d1p n LYS 33 N -5.08 -0.07 0.00 2.33 5.02 -0.40 0.09 118.16 120.05 1d1p n LYS 33 Ca -0.13 1.41 0.14 0.00 -2.02 0.00 0.00 58.31 57.71 1d1p n LYS 33 Cb 0.43 -2.31 0.51 0.00 -0.02 0.00 0.00 35.03 33.65 1d1p n LYS 33 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1d1p n ALA 34 N -2.97 2.60 -3.40 7.82 0.00 -0.43 -4.95 120.51 119.17 1d1p n ALA 34 Ca 0.26 -0.45 -0.17 0.00 0.00 0.00 0.00 53.44 53.08 1d1p n ALA 34 Cb 0.86 -1.16 0.09 0.00 0.00 0.00 0.00 19.45 19.24 1d1p n ALA 34 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1d1p n ASN 35 N 0.16 -2.55 -0.36 0.00 5.03 0.11 -4.91 115.26 112.75 1d1p n ASN 35 Ca 0.19 -0.59 0.04 0.00 0.87 0.00 0.00 54.58 55.08 1d1p n ASN 35 Cb 0.36 -4.96 0.06 0.00 -1.02 0.00 0.00 39.78 34.22 1d1p n ASN 35 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1d1p n LEU 36 N -4.13 2.01 -0.37 3.41 4.77 -0.79 -4.70 117.00 117.19 1d1p n LEU 36 Ca -0.25 -1.37 0.32 0.00 -0.03 0.00 0.00 56.01 54.68 1d1p n LEU 36 Cb 0.65 -0.06 0.63 0.00 -2.33 0.00 0.00 43.42 42.32 1d1p n LEU 36 CO 0.59 0.45 1.27 -0.33 -1.33 0.00 0.00 177.39 178.05 1d1p h GLU 37 N 1.46 0.17 0.00 3.23 3.07 -1.91 0.69 114.58 121.30 1d1p h GLU 37 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1d1p h GLU 37 Cb 0.44 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 1d1p h GLU 37 CO 0.00 0.11 0.00 -2.95 -1.40 0.00 0.00 179.01 174.77 1d1p h ASN 38 N 0.18 0.00 0.85 1.42 -1.07 -1.96 -2.53 115.58 112.46 1d1p h ASN 38 Ca 0.66 0.00 0.00 0.00 0.07 0.00 0.00 56.30 57.03 1d1p h ASN 38 Cb 2.12 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 38.37 1d1p h ASN 38 CO -0.22 0.00 -0.23 0.54 0.07 0.00 0.00 177.43 177.60 1d1p n ARG 39 N -2.70 0.04 -4.25 4.14 5.12 0.24 -4.88 116.66 114.38 1d1p n ARG 39 Ca 0.01 0.02 -0.29 0.00 -1.93 0.00 0.00 57.85 55.67 1d1p n ARG 39 Cb 0.28 -1.54 -0.10 0.00 -1.16 0.00 0.00 32.46 29.94 1d1p n ARG 39 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1d1p s PHE 40 N -3.02 2.68 -0.05 -1.55 0.40 -0.96 -1.06 117.98 114.42 1d1p s PHE 40 Ca 0.12 -0.19 -0.07 0.00 -0.60 0.00 0.00 56.93 56.19 1d1p s PHE 40 Cb 0.17 -1.39 -0.02 0.00 0.51 0.00 0.00 43.02 42.29 1d1p s PHE 40 CO 0.61 0.43 -0.14 -1.71 0.70 0.00 0.00 175.22 175.11 1d1p n ASN 41 N 0.64 0.98 -4.28 1.36 4.05 0.56 -4.78 115.26 113.79 1d1p n ASN 41 Ca -0.14 0.16 -0.28 0.00 0.45 0.00 0.00 54.58 54.77 1d1p n ASN 41 Cb 0.53 -0.49 -0.15 0.00 1.23 0.00 0.00 39.78 40.89 1d1p n ASN 41 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 1d1p s LYS 42 N -1.94 1.68 -0.22 1.20 1.02 -1.25 -5.01 119.74 115.22 1d1p s LYS 42 Ca -0.11 -0.94 -0.03 0.00 0.02 0.00 0.00 55.97 54.91 1d1p s LYS 42 Cb 0.02 -1.74 0.07 0.00 -0.52 0.00 0.00 37.83 35.65 1d1p s LYS 42 CO 0.17 0.46 0.06 0.42 -0.92 0.00 0.00 175.35 175.54 1d1p s ILE 43 N -0.70 0.42 0.40 2.17 1.01 -1.26 -1.10 121.20 122.15 1d1p s ILE 43 Ca 0.09 -0.64 0.04 0.00 0.00 0.00 0.00 60.65 60.14 1d1p s ILE 43 Cb -0.09 -1.05 -0.02 0.00 0.01 0.00 0.00 42.46 41.31 1d1p s ILE 43 CO 0.01 -0.34 0.16 -1.81 0.00 0.00 0.00 174.94 172.96 1d1p s ASP 44 N 1.89 2.62 -0.06 3.58 1.11 -0.43 -5.01 116.67 120.36 1d1p s ASP 44 Ca 0.02 -1.71 -0.07 0.00 0.18 0.00 0.00 52.55 50.97 1d1p s ASP 44 Cb -0.17 0.55 0.02 0.00 1.07 0.00 0.00 42.92 44.39 1d1p s ASP 44 CO -0.14 -0.98 0.19 -0.94 1.18 0.00 0.00 175.17 174.49 1d1p s SER 45 N -3.57 -0.18 0.18 0.27 1.04 -1.26 -0.50 113.70 109.68 1d1p s SER 45 Ca 0.26 0.33 -0.01 0.00 0.48 0.00 0.00 55.95 57.01 1d1p s SER 45 Cb 0.02 0.37 -0.04 0.00 0.10 0.00 0.00 66.02 66.47 1d1p s SER 45 CO 0.17 -0.10 0.09 -0.36 0.98 0.00 0.00 173.24 174.02 1d1p s PHE 46 N -0.05 1.08 0.25 5.02 0.40 -0.36 -4.66 117.98 119.66 1d1p s PHE 46 Ca -0.02 -1.28 0.11 0.00 -0.60 0.00 0.00 56.93 55.14 1d1p s PHE 46 Cb -0.02 -0.57 -0.05 0.00 0.51 0.00 0.00 43.02 42.90 1d1p s PHE 46 CO 0.00 -0.54 -0.20 0.20 0.70 0.00 0.00 175.22 175.38 1d1p s GLY 47 N -3.13 1.80 0.08 4.36 0.00 -0.56 -2.67 107.32 107.20 1d1p s GLY 47 Ca 0.32 -1.80 0.01 0.00 0.00 0.00 0.00 44.72 43.25 1d1p s GLY 47 CO 0.08 -1.88 1.13 -0.91 0.00 0.00 0.00 173.10 171.52 1d1p h THR 48 N 2.51 1.50 -2.59 0.90 1.35 -0.84 -1.45 112.91 114.29 1d1p h THR 48 Ca -0.41 -3.14 -0.44 0.00 -0.55 0.00 0.00 66.41 61.87 1d1p h THR 48 Cb 1.24 2.86 0.05 0.00 -1.73 0.00 0.00 68.15 70.58 1d1p h THR 48 CO 0.57 0.90 -0.02 -0.94 -0.25 0.00 0.00 175.52 175.78 1d1p s SER 49 N -6.92 5.28 0.00 5.36 1.04 -0.57 -4.77 113.70 113.12 1d1p s SER 49 Ca -0.03 0.03 0.10 0.00 0.48 0.00 0.00 55.95 56.53 1d1p s SER 49 Cb 0.08 -0.92 0.22 0.00 0.10 0.00 0.00 66.02 65.50 1d1p s SER 49 CO 0.85 -1.14 1.11 -0.46 0.98 0.00 0.00 173.24 174.58 1d1p n ASN 50 N -2.36 2.55 0.10 7.02 0.23 -1.26 -4.67 115.26 116.87 1d1p n ASN 50 Ca 0.08 -1.82 0.20 0.00 -0.53 0.00 0.00 54.58 52.51 1d1p n ASN 50 Cb 0.60 -0.15 0.75 0.00 -2.08 0.00 0.00 39.78 38.90 1d1p n ASN 50 CO 0.00 0.00 0.00 1.88 -0.93 0.00 0.00 177.26 178.21 1d1p h TYR 51 N 1.98 0.00 0.00 -2.53 -1.99 -1.92 -2.59 116.97 109.91 1d1p h TYR 51 Ca 0.00 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 1d1p h TYR 51 Cb 0.63 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 39.31 1d1p h TYR 51 CO 0.15 0.00 -0.39 0.72 -0.00 0.00 0.00 178.16 178.63 1d1p n HIS 52 N -3.72 0.00 -1.82 4.88 8.25 -1.26 -5.04 115.22 116.51 1d1p n HIS 52 Ca 0.07 -1.06 -0.41 0.00 -0.26 0.00 0.00 57.72 56.06 1d1p n HIS 52 Cb 0.61 -0.18 -0.00 0.00 1.12 0.00 0.00 29.99 31.53 1d1p n HIS 52 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1d1p s VAL 53 N -2.40 2.10 0.00 1.59 1.01 -0.98 -1.32 120.40 120.41 1d1p s VAL 53 Ca 0.32 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.40 1d1p s VAL 53 Cb 0.31 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.62 1d1p s VAL 53 CO -0.04 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.69 1d1p n GLY 54 N 0.67 2.71 3.86 4.51 0.00 0.77 -4.83 105.19 112.89 1d1p n GLY 54 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 1d1p n GLY 54 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1d1p s GLU 55 N -0.22 3.90 0.55 1.61 2.02 -0.43 -4.53 118.70 121.60 1d1p s GLU 55 Ca 0.00 0.54 -0.12 0.00 0.02 0.00 0.00 54.97 55.41 1d1p s GLU 55 Cb 0.00 -2.45 -0.05 0.00 0.10 0.00 0.00 34.13 31.73 1d1p s GLU 55 CO 0.00 0.12 0.96 -1.12 0.02 0.00 0.00 175.26 175.24 1d1p s SER 56 N -2.57 6.38 0.93 -0.19 0.01 -1.26 0.13 113.70 117.13 1d1p s SER 56 Ca 0.52 1.38 -0.11 0.00 1.31 0.00 0.00 55.95 59.06 1d1p s SER 56 Cb -0.10 -2.44 0.13 0.00 0.21 0.00 0.00 66.02 63.82 1d1p s SER 56 CO 0.22 -0.70 1.00 -2.65 0.41 0.00 0.00 173.24 171.52 1d1p n PRO 57 N -2.19 -0.48 -1.54 12.44 -0.02 -1.26 -4.89 135.00 137.06 1d1p n PRO 57 Ca 0.05 -0.08 -0.49 0.00 -2.02 0.00 0.00 63.50 60.96 1d1p n PRO 57 Cb 0.54 -2.27 -0.04 0.00 -0.02 0.00 0.00 33.50 31.71 1d1p n PRO 57 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1d1p n ASP 58 N -3.71 0.80 0.19 2.55 2.03 -0.09 -4.77 116.55 113.54 1d1p n ASP 58 Ca 0.11 1.15 0.11 0.00 0.52 0.00 0.00 54.79 56.68 1d1p n ASP 58 Cb 0.52 -1.16 0.65 0.00 -0.72 0.00 0.00 41.12 40.42 1d1p n ASP 58 CO 0.00 0.00 0.00 1.12 -1.92 0.00 0.00 177.20 176.40 1d1p h HIS 59 N 2.76 0.01 0.00 -0.67 2.07 -1.91 -0.41 115.15 116.99 1d1p h HIS 59 Ca -0.41 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.00 1d1p h HIS 59 Cb 1.37 -0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.33 1d1p h HIS 59 CO 0.51 0.00 -0.54 0.00 -3.07 0.00 0.00 177.93 174.84 1d1p h ARG 60 N 0.01 0.00 -0.16 5.12 3.08 -1.98 0.18 114.38 120.62 1d1p h ARG 60 Ca 0.07 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.02 1d1p h ARG 60 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.32 1d1p h ARG 60 CO -0.00 0.54 -0.29 1.15 -1.07 0.00 0.00 179.97 180.31 1d1p h THR 61 N 0.00 1.35 -0.32 2.04 2.02 -1.43 -2.29 112.91 114.28 1d1p h THR 61 Ca -0.01 -1.52 -0.01 0.00 0.77 0.00 0.00 66.41 65.64 1d1p h THR 61 Cb 1.04 1.93 -0.01 0.00 -1.74 0.00 0.00 68.15 69.37 1d1p h THR 61 CO 0.07 0.46 0.16 0.58 0.37 0.00 0.00 175.52 177.16 1d1p h VAL 62 N 0.12 1.15 -0.84 3.16 2.07 -1.09 -2.28 116.25 118.54 1d1p h VAL 62 Ca 0.01 -0.43 0.07 0.00 0.82 0.00 0.00 66.70 67.17 1d1p h VAL 62 Cb 0.87 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 31.43 1d1p h VAL 62 CO 0.06 0.16 0.51 0.28 0.02 0.00 0.00 177.57 178.61 1d1p h SER 63 N 0.38 0.79 -0.47 0.57 0.02 -0.67 -0.34 113.55 113.83 1d1p h SER 63 Ca 0.11 0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 60.99 1d1p h SER 63 Cb 0.11 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 1d1p h SER 63 CO -0.01 0.49 -0.06 0.40 -1.14 0.00 0.00 176.83 176.51 1d1p h ILE 64 N 0.92 1.27 0.15 3.27 1.08 -1.27 0.08 117.51 123.01 1d1p h ILE 64 Ca 0.38 -1.16 -0.01 0.00 -0.39 0.00 0.00 64.86 63.68 1d1p h ILE 64 Cb 0.22 1.06 0.00 0.00 -3.07 0.00 0.00 36.82 35.03 1d1p h ILE 64 CO -0.19 0.40 -0.07 0.00 -0.69 0.00 0.00 178.15 177.60 1d1p h LYS 66 N -0.23 0.66 -0.33 0.00 1.57 -0.98 0.33 116.57 117.59 1d1p h LYS 66 Ca -0.02 -0.04 0.10 0.00 -1.87 0.00 0.00 60.65 58.82 1d1p h LYS 66 Cb 0.17 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1d1p h LYS 66 CO 0.03 0.44 0.25 0.37 -0.57 0.00 0.00 179.45 179.97 1d1p h GLN 67 N 0.68 0.00 -0.56 3.15 4.15 -0.63 -0.76 115.11 121.14 1d1p h GLN 67 Ca 0.36 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.78 1d1p h GLN 67 Cb 0.34 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.03 1d1p h GLN 67 CO -0.25 0.00 0.00 0.72 -1.93 0.00 0.00 178.83 177.37 1d1p n HIS 68 N -4.34 0.84 -2.81 3.99 8.25 -0.24 -4.96 115.22 115.95 1d1p n HIS 68 Ca 0.05 -0.53 -0.15 0.00 -0.26 0.00 0.00 57.72 56.84 1d1p n HIS 68 Cb 0.42 -0.05 0.03 0.00 1.12 0.00 0.00 29.99 31.51 1d1p n HIS 68 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1d1p n GLY 69 N 1.06 -0.08 3.52 -1.41 0.00 -0.29 -5.01 105.19 102.98 1d1p n GLY 69 Ca 0.20 -0.18 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 1d1p n GLY 69 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1d1p s VAL 70 N -2.98 3.91 0.16 1.61 1.01 -0.06 -5.00 120.40 119.04 1d1p s VAL 70 Ca 0.22 -0.36 -0.27 0.00 0.00 0.00 0.00 61.98 61.58 1d1p s VAL 70 Cb -0.10 -2.70 -0.08 0.00 0.00 0.00 0.00 36.38 33.50 1d1p s VAL 70 CO 0.27 0.51 0.84 -0.75 0.00 0.00 0.00 175.10 175.97 1d1p s LYS 71 N 0.22 4.64 -0.07 2.72 2.36 -1.26 -3.89 119.74 124.46 1d1p s LYS 71 Ca -0.02 1.26 -0.03 0.00 -2.55 0.00 0.00 55.97 54.63 1d1p s LYS 71 Cb -0.14 -3.30 0.04 0.00 -1.05 0.00 0.00 37.83 33.39 1d1p s LYS 71 CO 0.03 0.47 0.14 -1.50 1.55 0.00 0.00 175.35 176.04 1d1p s ILE 72 N -0.82 -0.13 -0.22 5.43 2.07 -1.26 -4.77 121.20 121.49 1d1p s ILE 72 Ca 0.39 0.25 -0.03 0.00 -1.41 0.00 0.00 60.65 59.85 1d1p s ILE 72 Cb -0.23 -0.25 0.10 0.00 0.13 0.00 0.00 42.46 42.21 1d1p s ILE 72 CO 0.28 0.11 0.23 0.21 -1.91 0.00 0.00 174.94 173.85 1d1p s ASN 73 N 1.61 1.53 0.01 4.50 2.47 -1.26 -5.10 114.94 118.69 1d1p s ASN 73 Ca -0.04 -0.35 -0.20 0.00 0.42 0.00 0.00 52.86 52.68 1d1p s ASN 73 Cb -0.12 0.36 0.04 0.00 -1.45 0.00 0.00 41.25 40.09 1d1p s ASN 73 CO -0.06 -0.34 0.44 -2.28 -3.72 0.00 0.00 177.10 171.14 1d1p s HIS 74 N 2.32 -0.33 -0.03 0.43 2.46 -1.26 -5.12 115.29 113.75 1d1p s HIS 74 Ca 0.07 0.44 0.04 0.00 0.47 0.00 0.00 55.06 56.08 1d1p s HIS 74 Cb -0.15 0.23 -0.00 0.00 -0.13 0.00 0.00 32.58 32.52 1d1p s HIS 74 CO -0.16 -0.53 -0.14 0.15 -2.47 0.00 0.00 174.74 171.58 1d1p s LYS 75 N -1.86 1.46 0.26 2.88 1.02 -1.26 -4.10 119.74 118.15 1d1p s LYS 75 Ca -0.09 -0.51 -0.31 0.00 0.02 0.00 0.00 55.97 55.08 1d1p s LYS 75 Cb -0.02 -1.31 -0.12 0.00 -0.52 0.00 0.00 37.83 35.86 1d1p s LYS 75 CO 0.02 0.22 1.55 0.41 -0.92 0.00 0.00 175.35 176.63 1d1p n GLY 76 N 3.12 1.18 3.13 -3.33 0.00 0.12 -4.69 105.19 104.72 1d1p n GLY 76 Ca -0.18 0.50 -0.11 0.00 0.00 0.00 0.00 46.02 46.23 1d1p n GLY 76 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1d1p s LYS 77 N -0.26 0.73 -0.12 1.61 -2.85 -1.26 -0.16 119.74 117.43 1d1p s LYS 77 Ca 0.67 -1.15 -0.04 0.00 -1.00 0.00 0.00 55.97 54.46 1d1p s LYS 77 Cb -0.55 -0.23 -0.03 0.00 -2.06 0.00 0.00 37.83 34.95 1d1p s LYS 77 CO 0.47 0.00 0.02 -1.14 0.10 0.00 0.00 175.35 174.80 1d1p s GLN 78 N -3.10 3.31 0.63 1.78 0.74 -1.26 -1.49 119.66 120.26 1d1p s GLN 78 Ca 0.05 -0.38 -0.19 0.00 0.05 0.00 0.00 55.36 54.89 1d1p s GLN 78 Cb 0.00 -2.92 -0.02 0.00 1.10 0.00 0.00 33.01 31.17 1d1p s GLN 78 CO -0.03 0.57 1.28 -1.50 -0.55 0.00 0.00 175.29 175.06 1d1p s ILE 79 N -0.50 2.18 0.12 -2.34 2.07 -0.55 -4.85 121.20 117.34 1d1p s ILE 79 Ca 0.09 0.11 0.04 0.00 -1.41 0.00 0.00 60.65 59.48 1d1p s ILE 79 Cb -0.12 -3.05 -0.04 0.00 0.13 0.00 0.00 42.46 39.38 1d1p s ILE 79 CO 0.02 -0.02 -0.10 -0.54 -1.91 0.00 0.00 174.94 172.39 1d1p s LYS 80 N -3.32 0.95 0.53 3.50 -0.14 -1.26 -4.97 119.74 115.03 1d1p s LYS 80 Ca 0.81 -1.30 0.19 0.00 -1.36 0.00 0.00 55.97 54.30 1d1p s LYS 80 Cb -0.36 -0.57 1.35 0.00 -1.68 0.00 0.00 37.83 36.57 1d1p s LYS 80 CO 0.39 0.08 2.15 1.79 -0.76 0.00 0.00 175.35 178.99 1d1p h THR 81 N 3.18 0.91 -0.08 2.17 1.35 -1.96 -1.05 112.91 117.43 1d1p h THR 81 Ca -0.37 0.00 -0.02 0.00 -0.55 0.00 0.00 66.41 65.47 1d1p h THR 81 Cb 1.19 0.98 -0.01 0.00 -1.73 0.00 0.00 68.15 68.58 1d1p h THR 81 CO 0.58 0.00 -0.06 0.07 -0.25 0.00 0.00 175.52 175.86 1d1p h LYS 82 N 0.00 0.11 -0.02 4.72 2.10 -1.98 -2.18 116.57 119.32 1d1p h LYS 82 Ca 0.02 -0.01 0.01 0.00 -2.00 0.00 0.00 60.65 58.66 1d1p h LYS 82 Cb 0.09 -0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 31.40 1d1p h LYS 82 CO -0.00 0.18 0.02 0.45 -2.00 0.00 0.00 179.45 178.10 1d1p h HIS 83 N 0.11 0.00 0.00 0.07 3.86 -1.60 -1.14 115.15 116.44 1d1p h HIS 83 Ca 0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1d1p h HIS 83 Cb 0.18 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.65 1d1p h HIS 83 CO 0.00 0.00 0.00 1.19 0.86 0.00 0.00 177.93 179.98 1d1p n PHE 84 N -3.81 0.71 0.71 2.45 3.01 -0.82 -1.27 117.46 118.44 1d1p n PHE 84 Ca -0.03 0.31 0.07 0.00 1.01 0.00 0.00 57.45 58.82 1d1p n PHE 84 Cb 0.11 -1.00 -0.06 0.00 -0.01 0.00 0.00 39.48 38.52 1d1p n PHE 84 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1d1p n ASP 85 N -2.18 0.99 0.03 4.37 8.00 -0.44 -1.01 116.55 126.31 1d1p n ASP 85 Ca 0.01 -1.00 0.11 0.00 0.71 0.00 0.00 54.79 54.62 1d1p n ASP 85 Cb 0.16 0.83 -0.11 0.00 -0.02 0.00 0.00 41.12 41.98 1d1p n ASP 85 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1d1p n GLU 86 N -0.96 0.61 -4.55 -1.24 1.02 -0.40 -4.82 120.64 110.30 1d1p n GLU 86 Ca 0.04 -0.09 -0.30 0.00 -0.02 0.00 0.00 57.16 56.79 1d1p n GLU 86 Cb 0.26 -1.62 -0.13 0.00 -0.02 0.00 0.00 31.44 29.94 1d1p n GLU 86 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1d1p s TYR 87 N -3.45 2.39 0.07 -0.32 1.51 -0.94 -4.85 117.35 111.76 1d1p s TYR 87 Ca -0.05 -0.35 0.05 0.00 -1.01 0.00 0.00 57.07 55.71 1d1p s TYR 87 Cb 0.13 -1.33 -0.24 0.00 -0.11 0.00 0.00 41.96 40.41 1d1p s TYR 87 CO 0.87 0.28 1.09 -0.44 -1.11 0.00 0.00 175.55 176.23 1d1p h ASP 88 N 4.19 0.13 -3.42 2.29 3.32 -1.47 -3.06 116.42 118.39 1d1p h ASP 88 Ca -0.49 -0.15 -0.42 0.00 0.02 0.00 0.00 57.03 55.99 1d1p h ASP 88 Cb 1.16 -0.04 -0.35 0.00 0.22 0.00 0.00 39.33 40.32 1d1p h ASP 88 CO 0.43 1.13 -0.77 -0.31 -1.72 0.00 0.00 179.24 177.99 1d1p s TYR 89 N -2.67 0.78 -0.27 4.55 1.51 -1.06 -1.54 117.35 118.65 1d1p s TYR 89 Ca -0.02 -0.23 0.02 0.00 -1.01 0.00 0.00 57.07 55.83 1d1p s TYR 89 Cb 0.09 -0.71 0.06 0.00 -0.11 0.00 0.00 41.96 41.28 1d1p s TYR 89 CO 0.84 -0.22 -0.08 0.42 -1.11 0.00 0.00 175.55 175.39 1d1p s ILE 90 N 1.07 2.41 -0.31 2.71 1.01 -0.61 -0.83 121.20 126.64 1d1p s ILE 90 Ca -0.09 -1.55 -0.08 0.00 0.00 0.00 0.00 60.65 58.93 1d1p s ILE 90 Cb -0.14 -2.40 0.01 0.00 0.01 0.00 0.00 42.46 39.94 1d1p s ILE 90 CO -0.01 -0.04 0.12 -0.63 0.00 0.00 0.00 174.94 174.38 1d1p s ILE 91 N 1.15 4.19 0.52 2.92 1.01 0.10 -1.44 121.20 129.64 1d1p s ILE 91 Ca -0.08 -0.69 -0.05 0.00 0.00 0.00 0.00 60.65 59.84 1d1p s ILE 91 Cb -0.20 -3.20 -0.02 0.00 0.01 0.00 0.00 42.46 39.06 1d1p s ILE 91 CO -0.04 0.01 0.81 -0.83 0.00 0.00 0.00 174.94 174.89 1d1p s GLY 92 N 1.53 1.54 -0.14 6.18 0.00 0.13 -0.08 107.32 116.48 1d1p s GLY 92 Ca 0.03 -0.65 -0.09 0.00 0.00 0.00 0.00 44.72 44.01 1d1p s GLY 92 CO 0.04 -0.44 0.30 1.03 0.00 0.00 0.00 173.10 174.03 1d1p n MET 93 N -2.36 0.72 -4.36 2.90 0.00 -1.04 -1.22 117.12 111.77 1d1p n MET 93 Ca 0.02 0.30 -0.20 0.00 0.00 0.00 0.00 57.70 57.82 1d1p n MET 93 Cb 0.56 -1.70 -0.09 0.00 0.00 0.00 0.00 33.22 32.00 1d1p n MET 93 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 175.97 176.13 1d1p s ASP 94 N -7.00 1.79 0.29 7.83 1.47 -1.26 -2.07 116.67 117.72 1d1p s ASP 94 Ca -0.24 -1.62 -0.01 0.00 1.18 0.00 0.00 52.55 51.87 1d1p s ASP 94 Cb 0.07 0.44 0.43 0.00 -0.34 0.00 0.00 42.92 43.52 1d1p s ASP 94 CO 0.73 -0.93 1.85 -0.33 0.68 0.00 0.00 175.17 177.17 1d1p h GLU 95 N 2.12 0.82 -0.16 2.11 4.39 -1.96 -1.72 114.58 120.18 1d1p h GLU 95 Ca -0.32 -0.15 -0.02 0.00 0.34 0.00 0.00 59.36 59.20 1d1p h GLU 95 Cb 1.25 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.76 1d1p h GLU 95 CO 0.50 0.72 -0.01 0.66 -1.16 0.00 0.00 179.01 179.72 1d1p h SER 96 N 0.80 0.21 0.02 1.42 4.64 -2.00 -0.15 113.55 118.50 1d1p h SER 96 Ca 0.18 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1d1p h SER 96 Cb 0.24 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1d1p h SER 96 CO -0.01 0.27 -0.01 0.78 -0.87 0.00 0.00 176.83 176.99 1d1p h ASN 97 N 0.23 -0.02 -0.64 4.97 -0.26 -1.73 -2.73 115.58 115.41 1d1p h ASN 97 Ca 0.06 -0.30 0.07 0.00 -0.56 0.00 0.00 56.30 55.57 1d1p h ASN 97 Cb 0.18 0.01 -0.06 0.00 -1.06 0.00 0.00 38.32 37.38 1d1p h ASN 97 CO 0.00 0.29 0.32 0.40 -1.06 0.00 0.00 177.43 177.38 1d1p h ILE 98 N -0.34 0.89 -0.11 2.81 1.08 -1.12 -1.57 117.51 119.15 1d1p h ILE 98 Ca -0.00 -0.20 0.03 0.00 -0.39 0.00 0.00 64.86 64.30 1d1p h ILE 98 Cb 0.32 0.27 -0.03 0.00 -3.07 0.00 0.00 36.82 34.31 1d1p h ILE 98 CO 0.00 0.10 -0.08 -1.13 -0.69 0.00 0.00 178.15 176.36 1d1p h ASN 99 N 0.57 -0.26 -0.76 1.72 -0.73 -0.92 -0.24 115.58 114.96 1d1p h ASN 99 Ca 0.30 0.06 -0.03 0.00 1.87 0.00 0.00 56.30 58.50 1d1p h ASN 99 Cb 0.27 0.14 -0.04 0.00 0.27 0.00 0.00 38.32 38.96 1d1p h ASN 99 CO -0.23 -0.11 0.37 0.78 -0.37 0.00 0.00 177.43 177.87 1d1p h ASN 100 N -0.10 1.00 -0.37 1.15 2.35 -1.17 -2.48 115.58 115.96 1d1p h ASN 100 Ca 0.07 -0.11 -0.06 0.00 -0.55 0.00 0.00 56.30 55.65 1d1p h ASN 100 Cb 0.20 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 1d1p h ASN 100 CO -0.16 0.84 0.00 -0.07 -1.65 0.00 0.00 177.43 176.39 1d1p h LEU 101 N 1.10 0.63 -1.36 1.61 3.38 -0.75 -2.33 115.31 117.60 1d1p h LEU 101 Ca 0.27 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1d1p h LEU 101 Cb 0.11 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1d1p h LEU 101 CO -0.03 0.79 0.02 0.11 0.09 0.00 0.00 178.44 179.41 1d1p h LYS 102 N 0.46 0.44 -0.32 1.13 1.57 -0.92 -1.07 116.57 117.86 1d1p h LYS 102 Ca 0.10 -0.08 -0.12 0.00 -1.87 0.00 0.00 60.65 58.68 1d1p h LYS 102 Cb 0.46 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1d1p h LYS 102 CO 0.02 0.46 -0.30 0.87 -0.57 0.00 0.00 179.45 179.93 1d1p h LYS 103 N 0.43 0.66 -0.00 3.15 1.57 -1.09 -3.14 116.57 118.14 1d1p h LYS 103 Ca 0.10 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 1d1p h LYS 103 Cb 0.26 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1d1p h LYS 103 CO 0.01 0.88 -0.50 0.44 -0.57 0.00 0.00 179.45 179.70 1d1p n ILE 104 N -4.08 0.00 -2.12 1.86 -5.35 -0.91 -4.90 119.36 103.87 1d1p n ILE 104 Ca -0.01 -0.02 -0.42 0.00 -0.27 0.00 0.00 62.75 62.03 1d1p n ILE 104 Cb 0.46 0.34 -0.03 0.00 -1.74 0.00 0.00 39.64 38.68 1d1p n ILE 104 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 1d1p s GLN 105 N -2.91 4.22 0.25 6.28 0.74 -0.44 -4.88 119.66 122.91 1d1p s GLN 105 Ca 0.13 2.07 -0.30 0.00 0.05 0.00 0.00 55.36 57.31 1d1p s GLN 105 Cb 0.18 -3.78 -0.11 0.00 1.10 0.00 0.00 33.01 30.40 1d1p s GLN 105 CO 0.68 -0.73 1.52 -2.14 -0.55 0.00 0.00 175.29 174.07 1d1p s PRO 106 N 3.28 4.21 0.36 1.67 0.02 -1.26 -4.95 135.00 138.33 1d1p s PRO 106 Ca 0.68 2.41 -0.28 0.00 0.02 0.00 0.00 61.00 63.83 1d1p s PRO 106 Cb -0.32 -3.09 -0.10 0.00 0.02 0.00 0.00 34.50 31.01 1d1p s PRO 106 CO 0.27 -0.53 1.38 -2.00 -0.33 0.00 0.00 177.00 175.79 1d1p s GLU 107 N -0.11 4.20 0.00 5.54 -6.30 -1.26 -2.22 118.70 118.55 1d1p s GLU 107 Ca 0.63 2.35 0.00 0.00 -2.50 0.00 0.00 54.97 55.45 1d1p s GLU 107 Cb -0.44 -2.99 0.00 0.00 0.00 0.00 0.00 34.13 30.70 1d1p s GLU 107 CO 0.42 -0.37 0.00 0.41 0.02 0.00 0.00 175.26 175.74 1d1p n GLY 108 N 0.65 0.70 3.83 -1.50 0.00 -1.26 -5.02 105.19 102.58 1d1p n GLY 108 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 1d1p n GLY 108 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1d1p s SER 109 N -2.52 6.29 0.08 1.61 1.04 -0.94 -4.99 113.70 114.27 1d1p s SER 109 Ca 0.00 1.65 -0.19 0.00 0.48 0.00 0.00 55.95 57.89 1d1p s SER 109 Cb 0.00 -2.52 -0.09 0.00 0.10 0.00 0.00 66.02 63.52 1d1p s SER 109 CO 0.00 -0.82 1.54 0.50 0.98 0.00 0.00 173.24 175.45 1d1p h LYS 110 N 0.67 0.37 -6.27 4.02 3.64 -1.84 -3.47 116.57 113.69 1d1p h LYS 110 Ca -0.47 -0.10 -0.66 0.00 -1.27 0.00 0.00 60.65 58.15 1d1p h LYS 110 Cb 1.20 -0.04 0.09 0.00 -0.41 0.00 0.00 32.23 33.07 1d1p h LYS 110 CO 0.60 0.53 0.06 0.00 -2.27 0.00 0.00 179.45 178.36 1d1p n ALA 111 N -2.31 -1.33 -2.63 5.00 0.00 -0.18 -4.90 120.51 114.16 1d1p n ALA 111 Ca -0.04 0.45 -0.37 0.00 0.00 0.00 0.00 53.44 53.48 1d1p n ALA 111 Cb 0.20 -1.92 -0.10 0.00 0.00 0.00 0.00 19.45 17.64 1d1p n ALA 111 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1d1p s LYS 112 N -0.75 4.03 -0.20 0.00 1.02 -0.59 -4.94 119.74 118.30 1d1p s LYS 112 Ca 0.69 -0.28 -0.16 0.00 0.02 0.00 0.00 55.97 56.25 1d1p s LYS 112 Cb -0.87 -3.58 -0.04 0.00 -0.52 0.00 0.00 37.83 32.82 1d1p s LYS 112 CO 0.55 -0.03 0.39 0.08 -0.92 0.00 0.00 175.35 175.42 1d1p s VAL 113 N 1.33 5.20 0.20 3.17 1.01 -1.26 -1.57 120.40 128.48 1d1p s VAL 113 Ca 0.08 0.68 -0.08 0.00 0.00 0.00 0.00 61.98 62.66 1d1p s VAL 113 Cb -0.14 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 1d1p s VAL 113 CO 0.07 0.25 0.31 0.00 0.00 0.00 0.00 175.10 175.73 1d1p s LEU 115 N -3.03 4.54 0.28 0.00 1.43 -1.26 0.19 118.68 120.83 1d1p s LEU 115 Ca 0.24 1.39 -0.03 0.00 -1.03 0.00 0.00 54.13 54.70 1d1p s LEU 115 Cb 0.03 -3.05 0.40 0.00 0.03 0.00 0.00 46.19 43.59 1d1p s LEU 115 CO 0.06 0.22 1.94 0.15 0.23 0.00 0.00 176.35 178.95 1d1p h PHE 116 N 4.64 1.12 0.00 0.29 -0.00 -1.45 -1.57 116.94 119.98 1d1p h PHE 116 Ca -0.48 0.03 0.00 0.00 -0.00 0.00 0.00 57.97 57.52 1d1p h PHE 116 Cb 1.21 -0.38 0.00 0.00 -0.00 0.00 0.00 35.95 36.78 1d1p h PHE 116 CO 0.66 0.68 0.00 0.41 -0.00 0.00 0.00 178.31 180.07 1d1p n GLY 117 N -1.40 -0.31 0.09 2.40 0.00 -1.25 -2.42 105.19 102.30 1d1p n GLY 117 Ca 0.11 -0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.19 1d1p n GLY 117 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1d1p n ASP 118 N -1.06 0.47 -1.25 1.61 8.00 -0.59 -1.36 116.55 122.37 1d1p n ASP 118 Ca 0.06 0.61 0.11 0.00 0.71 0.00 0.00 54.79 56.28 1d1p n ASP 118 Cb 0.03 -0.71 0.29 0.00 -0.02 0.00 0.00 41.12 40.71 1d1p n ASP 118 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 1d1p n TRP 119 N -2.02 0.82 -1.84 1.24 8.01 -1.02 -4.96 117.44 117.67 1d1p n TRP 119 Ca 0.03 -0.41 -0.33 0.00 -1.31 0.00 0.00 57.50 55.48 1d1p n TRP 119 Cb 0.22 0.00 0.03 0.00 -2.01 0.00 0.00 31.31 29.55 1d1p n TRP 119 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.69 177.89 1d1p s ASN 120 N -1.14 5.42 0.44 -0.99 2.47 -0.46 -4.80 114.94 115.88 1d1p s ASN 120 Ca 0.45 1.86 0.03 0.00 0.42 0.00 0.00 52.86 55.61 1d1p s ASN 120 Cb 0.24 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.51 1d1p s ASN 120 CO 0.32 -1.41 0.64 0.42 -3.72 0.00 0.00 177.10 173.34 1d1p s THR 121 N -2.51 3.67 -0.20 -5.21 -4.23 -1.26 -5.00 115.64 100.90 1d1p s THR 121 Ca 0.64 -0.69 0.01 0.00 -1.18 0.00 0.00 61.69 60.47 1d1p s THR 121 Cb -0.17 -3.33 0.23 0.00 1.34 0.00 0.00 72.50 70.57 1d1p s THR 121 CO 0.42 -0.20 1.59 0.59 -0.54 0.00 0.00 174.62 176.47 1d1p n ASN 122 N -2.01 4.33 -0.04 3.99 3.02 -1.26 -4.38 115.26 118.92 1d1p n ASN 122 Ca 0.03 -2.73 0.00 0.00 -0.03 0.00 0.00 54.58 51.85 1d1p n ASN 122 Cb 0.58 -0.79 0.00 0.00 -0.61 0.00 0.00 39.78 38.97 1d1p n ASN 122 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1d1p n ASP 123 N 0.11 1.22 0.00 6.41 5.75 -1.26 -5.03 116.55 123.75 1d1p n ASP 123 Ca 0.23 -1.18 0.00 0.00 -0.01 0.00 0.00 54.79 53.83 1d1p n ASP 123 Cb 0.82 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.90 1d1p n ASP 123 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1d1p n GLY 124 N -0.03 0.49 0.13 6.12 0.00 -1.26 -4.95 105.19 105.69 1d1p n GLY 124 Ca 0.01 -0.65 -0.13 0.00 0.00 0.00 0.00 46.02 45.25 1d1p n GLY 124 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1d1p h THR 125 N 0.00 0.95 -3.73 2.61 2.02 -1.96 -3.46 112.91 109.35 1d1p h THR 125 Ca 0.00 -0.67 -0.28 0.00 0.77 0.00 0.00 66.41 66.23 1d1p h THR 125 Cb 0.00 1.35 -0.17 0.00 -1.74 0.00 0.00 68.15 67.60 1d1p h THR 125 CO 0.00 0.15 -0.72 0.68 0.37 0.00 0.00 175.52 176.01 1d1p s VAL 126 N -4.79 0.85 0.52 3.16 -7.23 -1.26 -5.10 120.40 106.55 1d1p s VAL 126 Ca -0.15 -1.76 -0.20 0.00 -1.81 0.00 0.00 61.98 58.07 1d1p s VAL 126 Cb 0.03 -1.48 -0.07 0.00 0.56 0.00 0.00 36.38 35.42 1d1p s VAL 126 CO 0.60 -0.69 1.10 -1.10 -0.31 0.00 0.00 175.10 174.71 1d1p s GLN 127 N -3.20 3.51 0.15 4.82 -1.52 -1.26 -4.96 119.66 117.19 1d1p s GLN 127 Ca 0.08 1.52 -0.10 0.00 -1.95 0.00 0.00 55.36 54.91 1d1p s GLN 127 Cb 0.00 -2.04 -0.03 0.00 -0.22 0.00 0.00 33.01 30.73 1d1p s GLN 127 CO -0.02 -0.70 1.49 1.15 -0.25 0.00 0.00 175.29 176.96 1d1p h THR 128 N 1.32 1.27 -3.35 -0.19 2.02 -1.97 -3.44 112.91 108.56 1d1p h THR 128 Ca -0.50 -1.55 -0.56 0.00 0.77 0.00 0.00 66.41 64.57 1d1p h THR 128 Cb 1.25 1.37 -0.05 0.00 -1.74 0.00 0.00 68.15 68.97 1d1p h THR 128 CO 0.58 0.52 0.05 -0.63 0.37 0.00 0.00 175.52 176.40 1d1p s ILE 129 N -4.41 4.94 -0.86 3.11 -1.09 -1.26 -3.94 121.20 117.68 1d1p s ILE 129 Ca -0.11 1.37 -0.18 0.00 -2.23 0.00 0.00 60.65 59.51 1d1p s ILE 129 Cb 0.11 -4.00 0.15 0.00 -1.58 0.00 0.00 42.46 37.15 1d1p s ILE 129 CO 0.88 0.34 0.99 -0.63 -1.23 0.00 0.00 174.94 175.29 1d1p s ILE 130 N 0.24 4.97 0.41 2.92 1.01 -0.88 -5.02 121.20 124.85 1d1p s ILE 130 Ca 0.34 -1.73 -0.25 0.00 0.00 0.00 0.00 60.65 59.01 1d1p s ILE 130 Cb -0.18 -4.67 -0.08 0.00 0.01 0.00 0.00 42.46 37.54 1d1p s ILE 130 CO 0.18 -1.34 1.23 -1.61 0.00 0.00 0.00 174.94 173.40 1d1p s GLU 131 N 2.03 3.99 0.00 2.79 2.02 -1.26 -4.37 118.70 123.91 1d1p s GLU 131 Ca 0.26 1.98 -0.31 0.00 0.02 0.00 0.00 54.97 56.93 1d1p s GLU 131 Cb -0.08 -2.70 -0.09 0.00 0.10 0.00 0.00 34.13 31.35 1d1p s GLU 131 CO -0.07 -0.41 1.98 -3.47 0.02 0.00 0.00 175.26 173.30 1d1p n ASP 132 N 0.07 4.01 -0.46 -0.19 -0.08 -1.26 -4.88 116.55 113.76 1d1p n ASP 132 Ca 0.04 0.88 0.13 0.00 -1.51 0.00 0.00 54.79 54.33 1d1p n ASP 132 Cb 0.45 -1.50 0.32 0.00 2.34 0.00 0.00 41.12 42.73 1d1p n ASP 132 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1d1p n PRO 133 N 7.46 1.37 -0.25 -0.67 -0.04 -1.26 -4.60 135.00 137.02 1d1p n PRO 133 Ca 0.21 -0.93 0.01 0.00 -0.04 0.00 0.00 63.50 62.74 1d1p n PRO 133 Cb 0.39 -1.48 0.08 0.00 -0.04 0.00 0.00 33.50 32.45 1d1p n PRO 133 CO 0.00 0.00 0.00 2.35 -0.04 0.00 0.00 175.50 177.81 1d1p h TRP 134 N 2.27 -0.42 -0.00 0.54 2.91 -1.97 0.21 115.95 119.49 1d1p h TRP 134 Ca 0.00 0.07 0.00 0.00 1.13 0.00 0.00 58.89 60.09 1d1p h TRP 134 Cb 0.62 0.30 0.00 0.00 -0.51 0.00 0.00 29.16 29.57 1d1p h TRP 134 CO 0.00 -0.32 -0.10 0.66 -1.03 0.00 0.00 178.44 177.65 1d1p n TYR 135 N -5.48 0.00 -0.14 2.65 4.02 -1.26 -4.84 117.16 112.11 1d1p n TYR 135 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.98 1d1p n TYR 135 Cb 0.37 -0.21 0.00 0.00 -0.02 0.00 0.00 39.34 39.48 1d1p n TYR 135 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1d1p n GLY 136 N 1.29 1.14 3.35 2.72 0.00 0.72 -5.13 105.19 109.28 1d1p n GLY 136 Ca 0.14 -1.53 -0.20 0.00 0.00 0.00 0.00 46.02 44.43 1d1p n GLY 136 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1d1p s ASP 137 N -1.00 1.77 0.48 1.61 3.84 -1.26 -5.01 116.67 117.10 1d1p s ASP 137 Ca 0.00 -1.65 0.33 0.00 -0.00 0.00 0.00 52.55 51.23 1d1p s ASP 137 Cb 0.00 0.48 1.45 0.00 -1.38 0.00 0.00 42.92 43.47 1d1p s ASP 137 CO 0.00 -0.96 1.70 -0.29 -0.00 0.00 0.00 175.17 175.62 1d1p h ILE 138 N 2.12 0.27 -0.38 2.11 6.09 -1.97 0.91 117.51 126.66 1d1p h ILE 138 Ca -0.31 -0.04 0.00 0.00 -1.37 0.00 0.00 64.86 63.15 1d1p h ILE 138 Cb 1.25 0.15 -0.02 0.00 0.47 0.00 0.00 36.82 38.67 1d1p h ILE 138 CO 0.47 0.02 0.25 -0.61 -3.07 0.00 0.00 178.15 175.21 1d1p h GLN 139 N 0.11 0.50 -0.12 2.19 5.75 -1.99 -0.74 115.11 120.82 1d1p h GLN 139 Ca 0.72 -0.03 -0.19 0.00 -0.15 0.00 0.00 58.65 59.00 1d1p h GLN 139 Cb 2.46 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 30.89 1d1p h GLN 139 CO -0.20 0.33 -0.71 -0.44 -2.65 0.00 0.00 178.83 175.16 1d1p h ASP 140 N 0.51 0.61 -0.49 -0.69 3.32 0.48 -2.04 116.42 118.13 1d1p h ASP 140 Ca 0.14 -0.39 -0.10 0.00 0.02 0.00 0.00 57.03 56.70 1d1p h ASP 140 Cb -0.06 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 1d1p h ASP 140 CO -0.03 1.14 -0.09 -0.26 -1.72 0.00 0.00 179.24 178.28 1d1p h PHE 141 N 0.36 1.04 -0.84 4.55 -1.00 -1.33 -0.49 116.94 119.23 1d1p h PHE 141 Ca -0.03 -0.21 -0.00 0.00 2.81 0.00 0.00 57.97 60.54 1d1p h PHE 141 Cb 1.29 -0.26 -0.04 0.00 3.61 0.00 0.00 35.95 40.55 1d1p h PHE 141 CO 0.05 0.99 0.51 1.49 -1.61 0.00 0.00 178.31 179.74 1d1p h GLU 142 N 0.78 1.14 -0.49 1.51 4.57 -1.07 -0.98 114.58 120.04 1d1p h GLU 142 Ca 0.13 -0.10 -0.12 0.00 -1.18 0.00 0.00 59.36 58.09 1d1p h GLU 142 Cb 0.64 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 28.97 1d1p h GLU 142 CO 0.04 0.79 -0.18 -0.92 -1.18 0.00 0.00 179.01 177.56 1d1p h TYR 143 N 1.15 1.10 -0.65 0.92 3.20 -1.09 -1.98 116.97 119.63 1d1p h TYR 143 Ca 0.30 -0.25 0.05 0.00 3.14 0.00 0.00 58.73 61.97 1d1p h TYR 143 Cb -0.05 -0.26 -0.05 0.00 1.54 0.00 0.00 36.73 37.90 1d1p h TYR 143 CO -0.00 1.06 0.36 -0.91 -1.64 0.00 0.00 178.16 177.03 1d1p h ASN 144 N 0.85 0.53 -0.37 -2.11 2.35 -0.58 -0.43 115.58 115.81 1d1p h ASN 144 Ca 0.12 0.03 0.03 0.00 -0.55 0.00 0.00 56.30 55.93 1d1p h ASN 144 Cb 0.75 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 39.00 1d1p h ASN 144 CO 0.06 0.35 0.16 0.15 -1.65 0.00 0.00 177.43 176.50 1d1p h PHE 145 N 0.67 0.30 -0.67 1.19 3.57 -0.83 0.31 116.94 121.48 1d1p h PHE 145 Ca 0.29 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.79 1d1p h PHE 145 Cb 0.17 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 1d1p h PHE 145 CO -0.08 0.14 0.37 -0.22 -2.23 0.00 0.00 178.31 176.30 1d1p h LYS 146 N 0.34 0.92 0.21 1.11 3.64 -0.77 -0.85 116.57 121.17 1d1p h LYS 146 Ca 0.16 -0.10 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1d1p h LYS 146 Cb 0.10 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1d1p h LYS 146 CO -0.14 0.69 -0.10 1.96 -2.27 0.00 0.00 179.45 179.59 1d1p h GLN 147 N 0.91 -0.27 -0.76 1.90 4.20 -0.63 -2.25 115.11 118.21 1d1p h GLN 147 Ca 0.24 0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.94 1d1p h GLN 147 Cb 0.02 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.83 1d1p h GLN 147 CO -0.04 -0.10 0.40 0.82 -0.67 0.00 0.00 178.83 179.24 1d1p h ILE 148 N -0.37 1.23 -0.22 2.54 2.04 -0.84 -1.19 117.51 120.70 1d1p h ILE 148 Ca -0.03 -0.61 0.01 0.00 1.00 0.00 0.00 64.86 65.23 1d1p h ILE 148 Cb 0.29 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.60 1d1p h ILE 148 CO 0.05 0.27 0.14 0.74 0.00 0.00 0.00 178.15 179.34 1d1p h THR 149 N 1.06 1.04 -0.36 -0.27 2.02 -1.13 0.92 112.91 116.18 1d1p h THR 149 Ca 0.26 -0.10 0.01 0.00 0.77 0.00 0.00 66.41 67.36 1d1p h THR 149 Cb 0.06 0.73 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 1d1p h THR 149 CO -0.04 0.05 0.23 0.22 0.37 0.00 0.00 175.52 176.35 1d1p h TYR 150 N 0.28 0.43 -0.00 3.16 3.20 -1.00 -2.34 116.97 120.69 1d1p h TYR 150 Ca 0.08 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.85 1d1p h TYR 150 Cb -0.02 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.10 1d1p h TYR 150 CO -0.07 0.26 -0.55 0.74 -1.64 0.00 0.00 178.16 176.90 1d1p h PHE 151 N 0.46 0.01 -0.84 -3.82 0.05 -1.00 -2.37 116.94 109.43 1d1p h PHE 151 Ca 0.14 -0.00 -0.01 0.00 3.82 0.00 0.00 57.97 61.92 1d1p h PHE 151 Cb -0.03 -0.00 -0.04 0.00 2.00 0.00 0.00 35.95 37.88 1d1p h PHE 151 CO -0.06 0.55 0.50 0.77 -0.18 0.00 0.00 178.31 179.89 1d1p h SER 152 N 0.01 1.02 -0.38 2.17 0.02 -0.39 0.41 113.55 116.40 1d1p h SER 152 Ca -0.01 -0.07 -0.10 0.00 -0.84 0.00 0.00 61.79 60.77 1d1p h SER 152 Cb 0.97 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.24 1d1p h SER 152 CO 0.07 0.79 -0.15 0.11 -1.14 0.00 0.00 176.83 176.51 1d1p h LYS 153 N 1.16 0.77 -0.59 3.45 1.57 -1.24 -0.83 116.57 120.85 1d1p h LYS 153 Ca 0.30 -0.32 -0.07 0.00 -1.87 0.00 0.00 60.65 58.68 1d1p h LYS 153 Cb -0.03 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1d1p h LYS 153 CO -0.05 0.94 0.08 1.96 -0.57 0.00 0.00 179.45 181.80 1d1p h GLN 154 N 0.57 0.97 0.04 3.15 1.08 -1.16 -0.57 115.11 119.19 1d1p h GLN 154 Ca 0.09 -0.25 -0.00 0.00 -1.45 0.00 0.00 58.65 57.03 1d1p h GLN 154 Cb 0.69 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 28.00 1d1p h GLN 154 CO 0.05 0.91 -0.02 0.35 -0.95 0.00 0.00 178.83 179.17 1d1p h PHE 155 N 0.91 -0.04 -0.03 2.96 3.57 -0.67 0.19 116.94 123.83 1d1p h PHE 155 Ca 0.18 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 1d1p h PHE 155 Cb 0.43 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.18 1d1p h PHE 155 CO 0.03 0.10 -0.02 -0.07 -2.23 0.00 0.00 178.31 176.11 1d1p h LEU 156 N -0.18 0.04 -0.12 0.59 3.38 -0.93 0.22 115.31 118.31 1d1p h LEU 156 Ca -0.00 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 1d1p h LEU 156 Cb 0.16 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 40.91 1d1p h LEU 156 CO 0.01 0.07 -0.51 0.50 0.09 0.00 0.00 178.44 178.59 1d1p h LYS 157 N 0.04 0.56 0.00 1.13 3.64 -0.50 -3.33 116.57 118.11 1d1p h LYS 157 Ca 0.01 -0.44 -0.08 0.00 -1.27 0.00 0.00 60.65 58.87 1d1p h LYS 157 Cb 0.07 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 1d1p h LYS 157 CO 0.00 1.07 -1.82 1.63 -2.27 0.00 0.00 179.45 178.06 1d1p n LYS 158 N -4.21 0.65 0.01 1.90 5.02 0.61 -4.51 118.16 117.64 1d1p n LYS 158 Ca -0.08 -0.06 0.11 0.00 -2.02 0.00 0.00 58.31 56.26 1d1p n LYS 158 Cb 0.61 -1.61 0.07 0.00 -0.02 0.00 0.00 35.03 34.08 1d1p n LYS 158 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1d1p n GLU 159 N -2.48 0.08 0.00 1.97 -0.58 0.72 -5.08 120.64 115.27 1d1p n GLU 159 Ca -0.09 -0.00 0.01 0.00 -0.42 0.00 0.00 57.16 56.66 1d1p n GLU 159 Cb 0.69 -1.52 0.01 0.00 -0.57 0.00 0.00 31.44 30.05 1d1p n GLU 159 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93