#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c8p n ILE 2 N 0.00 1.68 -0.00 2.02 3.06 -1.26 -4.91 119.36 119.95 1c8p n ILE 2 Ca 0.00 -0.39 -0.13 0.00 -2.50 0.00 0.00 62.75 59.73 1c8p n ILE 2 Cb 0.00 -0.72 -0.09 0.00 0.54 0.00 0.00 39.64 39.38 1c8p n ILE 2 CO 0.00 0.00 0.00 1.56 -2.50 0.00 0.00 176.55 175.61 1c8p h GLN 3 N -0.40 0.04 -2.51 9.51 4.20 -1.96 -3.43 115.11 120.55 1c8p h GLN 3 Ca -0.45 -0.01 -0.26 0.00 0.06 0.00 0.00 58.65 57.98 1c8p h GLN 3 Cb 1.35 -0.00 -0.34 0.00 0.30 0.00 0.00 27.48 28.79 1c8p h GLN 3 CO 0.42 0.35 -0.58 1.41 -0.67 0.00 0.00 178.83 179.77 1c8p s MET 4 N -4.91 0.20 -0.27 1.46 1.75 -1.26 -5.02 119.30 111.25 1c8p s MET 4 Ca -0.15 0.41 -0.29 0.00 -1.25 0.00 0.00 55.69 54.42 1c8p s MET 4 Cb 0.03 -0.76 -0.06 0.00 2.84 0.00 0.00 34.83 36.89 1c8p s MET 4 CO 0.68 -0.55 2.25 0.00 -0.65 0.00 0.00 175.02 176.75 1c8p n ALA 5 N 5.34 1.59 -0.77 4.11 0.00 -1.26 -4.43 120.51 125.08 1c8p n ALA 5 Ca -0.05 -0.31 -0.33 0.00 0.00 0.00 0.00 53.44 52.74 1c8p n ALA 5 Cb 0.50 -2.91 0.13 0.00 0.00 0.00 0.00 19.45 17.16 1c8p n ALA 5 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1c8p n PRO 6 N 8.74 -0.62 0.00 0.00 -0.02 -1.26 -4.98 135.00 136.86 1c8p n PRO 6 Ca 0.32 -0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 1c8p n PRO 6 Cb 0.43 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 1c8p n PRO 6 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1c8p n PRO 7 N -1.56 1.36 -3.62 0.52 -0.02 -1.26 -5.02 135.00 125.40 1c8p n PRO 7 Ca 0.05 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.13 1c8p n PRO 7 Cb 0.56 0.00 -0.09 0.00 -0.02 0.00 0.00 33.50 33.95 1c8p n PRO 7 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1c8p s SER 8 N -1.05 5.58 0.21 2.55 0.01 -1.22 -4.93 113.70 114.86 1c8p s SER 8 Ca 0.00 -2.16 -0.30 0.00 1.31 0.00 0.00 55.95 54.80 1c8p s SER 8 Cb 0.00 -1.95 -0.08 0.00 0.21 0.00 0.00 66.02 64.19 1c8p s SER 8 CO 0.00 -0.59 0.95 -0.22 0.41 0.00 0.00 173.24 173.78 1c8p s LEU 9 N 0.99 4.62 -0.30 2.44 2.96 -1.26 -3.74 118.68 124.38 1c8p s LEU 9 Ca 0.09 1.92 -0.11 0.00 -0.22 0.00 0.00 54.13 55.82 1c8p s LEU 9 Cb -0.23 -3.61 0.12 0.00 0.50 0.00 0.00 46.19 42.98 1c8p s LEU 9 CO -0.03 0.10 0.66 0.54 -1.32 0.00 0.00 176.35 176.31 1c8p s ASN 10 N -0.92 -1.11 -0.13 3.68 2.20 -1.25 -4.94 114.94 112.47 1c8p s ASN 10 Ca 0.42 1.56 -0.23 0.00 -0.94 0.00 0.00 52.86 53.67 1c8p s ASN 10 Cb -0.26 2.19 -0.03 0.00 -2.00 0.00 0.00 41.25 41.16 1c8p s ASN 10 CO 0.32 -0.22 0.71 0.68 -2.94 0.00 0.00 177.10 175.65 1c8p s VAL 11 N 2.74 5.00 -0.12 3.54 -7.23 -1.26 -0.26 120.40 122.82 1c8p s VAL 11 Ca -0.06 1.41 0.00 0.00 -1.81 0.00 0.00 61.98 61.52 1c8p s VAL 11 Cb -0.11 -4.03 0.02 0.00 0.56 0.00 0.00 36.38 32.82 1c8p s VAL 11 CO -0.19 0.16 -0.11 0.42 -0.31 0.00 0.00 175.10 175.06 1c8p s THR 12 N 1.45 1.29 0.60 5.32 -4.23 0.45 -4.90 115.64 115.63 1c8p s THR 12 Ca 0.35 -0.48 -0.01 0.00 -1.18 0.00 0.00 61.69 60.38 1c8p s THR 12 Cb -0.17 -1.24 0.05 0.00 1.34 0.00 0.00 72.50 72.48 1c8p s THR 12 CO 0.14 0.41 0.85 -1.59 -0.54 0.00 0.00 174.62 173.89 1c8p s LYS 13 N 1.42 2.39 -0.28 3.99 -2.85 -1.26 -1.36 119.74 121.79 1c8p s LYS 13 Ca 0.01 -0.69 0.12 0.00 -1.00 0.00 0.00 55.97 54.41 1c8p s LYS 13 Cb -0.13 -2.40 0.36 0.00 -2.06 0.00 0.00 37.83 33.59 1c8p s LYS 13 CO -0.07 -0.89 1.43 -0.25 0.10 0.00 0.00 175.35 175.67 1c8p n ASP 14 N -2.51 -1.15 0.00 0.03 9.92 -1.03 -4.95 116.55 116.86 1c8p n ASP 14 Ca 0.09 -2.17 0.00 0.00 -0.53 0.00 0.00 54.79 52.17 1c8p n ASP 14 Cb 0.60 0.54 0.00 0.00 -0.64 0.00 0.00 41.12 41.61 1c8p n ASP 14 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1c8p n GLY 15 N -1.24 0.55 5.00 0.44 0.00 -1.26 -4.80 105.19 103.88 1c8p n GLY 15 Ca -0.17 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.09 1c8p n GLY 15 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1c8p n ASP 16 N 0.00 0.00 -4.68 1.61 8.00 -1.26 -4.92 116.55 115.31 1c8p n ASP 16 Ca 0.00 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.08 1c8p n ASP 16 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 1c8p n ASP 16 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1c8p s SER 17 N 0.00 6.78 0.40 -2.24 0.01 -1.26 -5.01 113.70 112.38 1c8p s SER 17 Ca 0.00 2.14 0.04 0.00 1.31 0.00 0.00 55.95 59.44 1c8p s SER 17 Cb 0.00 -2.55 -0.00 0.00 0.21 0.00 0.00 66.02 63.68 1c8p s SER 17 CO 0.00 -0.80 0.58 -0.31 0.41 0.00 0.00 173.24 173.12 1c8p s TYR 18 N 3.02 3.09 -0.27 2.43 1.51 -1.24 -2.46 117.35 123.43 1c8p s TYR 18 Ca 0.67 -0.06 -0.19 0.00 -1.01 0.00 0.00 57.07 56.47 1c8p s TYR 18 Cb -0.32 -2.22 0.08 0.00 -0.11 0.00 0.00 41.96 39.39 1c8p s TYR 18 CO 0.27 -0.26 0.69 -1.54 -1.11 0.00 0.00 175.55 173.60 1c8p s SER 19 N -4.23 -0.87 0.70 2.29 1.04 -0.47 -0.82 113.70 111.35 1c8p s SER 19 Ca 0.48 1.48 -0.08 0.00 0.48 0.00 0.00 55.95 58.31 1c8p s SER 19 Cb -0.10 1.41 0.05 0.00 0.10 0.00 0.00 66.02 67.48 1c8p s SER 19 CO 0.34 -0.24 1.03 -0.76 0.98 0.00 0.00 173.24 174.59 1c8p s LEU 20 N 1.16 2.84 -0.45 2.42 1.43 -1.25 0.17 118.68 125.00 1c8p s LEU 20 Ca -0.06 0.62 0.05 0.00 -1.03 0.00 0.00 54.13 53.71 1c8p s LEU 20 Cb -0.05 -3.29 0.18 0.00 0.03 0.00 0.00 46.19 43.06 1c8p s LEU 20 CO -0.12 -1.53 0.47 -0.13 0.23 0.00 0.00 176.35 175.27 1c8p s ARG 21 N -5.27 0.96 -0.33 1.70 0.52 0.64 -3.75 118.95 113.42 1c8p s ARG 21 Ca 0.59 -1.76 -0.15 0.00 -0.52 0.00 0.00 55.73 53.89 1c8p s ARG 21 Cb -0.11 -0.96 -0.02 0.00 0.52 0.00 0.00 34.95 34.39 1c8p s ARG 21 CO 0.46 -1.37 0.38 1.67 0.02 0.00 0.00 175.30 176.46 1c8p s TRP 22 N 0.33 3.21 -0.11 -0.53 -2.14 -0.24 -3.90 118.94 115.56 1c8p s TRP 22 Ca 0.32 0.07 -0.00 0.00 2.66 0.00 0.00 56.10 59.14 1c8p s TRP 22 Cb 0.03 -2.68 -0.02 0.00 -3.10 0.00 0.00 33.47 27.69 1c8p s TRP 22 CO -0.15 -0.41 -0.10 -2.00 -2.66 0.00 0.00 176.95 171.62 1c8p s GLU 23 N 2.07 3.21 0.29 3.25 2.56 -1.25 -4.35 118.70 124.48 1c8p s GLU 23 Ca 0.13 -0.63 0.04 0.00 0.00 0.00 0.00 54.97 54.51 1c8p s GLU 23 Cb -0.16 -2.64 -0.03 0.00 2.00 0.00 0.00 34.13 33.30 1c8p s GLU 23 CO 0.12 0.35 0.44 0.95 -0.56 0.00 0.00 175.26 176.55 1c8p s THR 24 N 0.01 4.96 -0.03 -1.70 -4.23 -1.26 -3.38 115.64 110.01 1c8p s THR 24 Ca -0.03 -0.85 0.01 0.00 -1.18 0.00 0.00 61.69 59.65 1c8p s THR 24 Cb -0.14 -3.77 0.04 0.00 1.34 0.00 0.00 72.50 69.98 1c8p s THR 24 CO 0.04 -0.35 0.55 1.15 -0.54 0.00 0.00 174.62 175.46 1c8p n MET 25 N -1.57 0.14 -0.10 3.99 0.00 -1.26 -4.99 117.12 113.32 1c8p n MET 25 Ca -0.06 -0.14 0.06 0.00 0.00 0.00 0.00 57.70 57.56 1c8p n MET 25 Cb 0.57 0.12 0.10 0.00 0.00 0.00 0.00 33.22 34.01 1c8p n MET 25 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1c8p n LYS 26 N -0.15 2.31 0.03 3.17 4.01 -1.26 -4.87 118.16 121.39 1c8p n LYS 26 Ca -0.02 -2.15 0.00 0.00 -0.51 0.00 0.00 58.31 55.63 1c8p n LYS 26 Cb 0.51 -1.33 0.00 0.00 -0.51 0.00 0.00 35.03 33.70 1c8p n LYS 26 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1c8p n MET 27 N -0.75 0.00 -3.04 1.97 0.00 -1.26 -5.03 117.12 109.00 1c8p n MET 27 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 57.70 57.58 1c8p n MET 27 Cb 0.50 0.00 0.02 0.00 0.00 0.00 0.00 33.22 33.74 1c8p n MET 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1c8p n ARG 28 N -2.65 -4.27 -0.07 3.17 1.74 -1.26 -4.88 116.66 108.44 1c8p n ARG 28 Ca 0.00 0.80 -0.15 0.00 -0.77 0.00 0.00 57.85 57.73 1c8p n ARG 28 Cb 0.00 -5.61 -0.05 0.00 -1.02 0.00 0.00 32.46 25.78 1c8p n ARG 28 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 1c8p h TYR 29 N -1.16 1.08 0.00 -1.55 0.05 -2.02 -3.49 116.97 109.88 1c8p h TYR 29 Ca -0.50 -0.41 0.00 0.00 0.05 0.00 0.00 58.73 57.88 1c8p h TYR 29 Cb 1.34 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 38.89 1c8p h TYR 29 CO 0.57 1.24 0.00 -1.91 -1.05 0.00 0.00 178.16 177.01 1c8p n GLU 30 N -4.01 0.00 0.17 4.88 4.07 -1.26 -4.97 120.64 119.51 1c8p n GLU 30 Ca -0.05 0.00 0.01 0.00 -0.06 0.00 0.00 57.16 57.06 1c8p n GLU 30 Cb 0.65 0.00 0.31 0.00 -0.06 0.00 0.00 31.44 32.34 1c8p n GLU 30 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1c8p h HIS 31 N 0.00 0.03 -0.28 4.31 3.86 -2.05 -3.48 115.15 117.55 1c8p h HIS 31 Ca 0.00 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1c8p h HIS 31 Cb 0.00 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 28.46 1c8p h HIS 31 CO 0.00 0.44 -0.00 -0.89 0.86 0.00 0.00 177.93 178.34 1c8p n ILE 32 N -4.04 0.00 -0.97 2.45 5.41 -1.26 -4.57 119.36 116.38 1c8p n ILE 32 Ca -0.02 0.00 0.05 0.00 1.00 0.00 0.00 62.75 63.78 1c8p n ILE 32 Cb 0.45 -0.00 0.07 0.00 -0.71 0.00 0.00 39.64 39.45 1c8p n ILE 32 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1c8p n ASP 33 N -3.87 1.64 -0.73 4.38 9.92 -1.26 -4.69 116.55 121.93 1c8p n ASP 33 Ca 0.00 -2.44 -0.03 0.00 -0.53 0.00 0.00 54.79 51.79 1c8p n ASP 33 Cb 0.00 -0.25 -0.03 0.00 -0.64 0.00 0.00 41.12 40.21 1c8p n ASP 33 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 1c8p n HIS 34 N -0.82 0.00 -2.74 1.24 8.25 -1.26 -4.50 115.22 115.39 1c8p n HIS 34 Ca 0.08 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.11 1c8p n HIS 34 Cb 0.54 -0.08 -0.03 0.00 1.12 0.00 0.00 29.99 31.54 1c8p n HIS 34 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1c8p s THR 35 N 0.00 4.65 -0.14 1.59 2.01 -1.24 -1.98 115.64 120.52 1c8p s THR 35 Ca 0.16 1.67 -0.06 0.00 0.31 0.00 0.00 61.69 63.77 1c8p s THR 35 Cb -0.10 -4.30 -0.04 0.00 0.01 0.00 0.00 72.50 68.07 1c8p s THR 35 CO 0.07 -0.31 0.06 -0.36 -0.69 0.00 0.00 174.62 173.38 1c8p s PHE 36 N 3.30 3.29 -0.36 4.92 0.40 0.71 -3.68 117.98 126.56 1c8p s PHE 36 Ca 0.41 0.18 -0.06 0.00 -0.60 0.00 0.00 56.93 56.86 1c8p s PHE 36 Cb -0.14 -1.97 0.06 0.00 0.51 0.00 0.00 43.02 41.48 1c8p s PHE 36 CO 0.12 0.35 0.14 -1.21 0.70 0.00 0.00 175.22 175.31 1c8p s GLU 37 N -0.23 2.49 -0.01 0.44 2.02 -0.80 0.17 118.70 122.78 1c8p s GLU 37 Ca 0.08 -1.36 -0.18 0.00 0.02 0.00 0.00 54.97 53.54 1c8p s GLU 37 Cb -0.12 -3.52 -0.06 0.00 0.10 0.00 0.00 34.13 30.54 1c8p s GLU 37 CO 0.01 -0.79 0.49 0.42 0.02 0.00 0.00 175.26 175.42 1c8p s ILE 38 N 1.35 4.97 -0.03 -1.63 1.09 0.29 -1.97 121.20 125.27 1c8p s ILE 38 Ca 0.00 1.02 -0.02 0.00 -1.10 0.00 0.00 60.65 60.56 1c8p s ILE 38 Cb -0.21 -3.82 0.02 0.00 -1.06 0.00 0.00 42.46 37.39 1c8p s ILE 38 CO 0.01 0.49 0.08 -1.58 -0.10 0.00 0.00 174.94 173.85 1c8p s GLN 39 N -0.57 0.07 -0.08 2.79 0.74 -0.62 0.16 119.66 122.16 1c8p s GLN 39 Ca 0.27 0.17 -0.03 0.00 0.05 0.00 0.00 55.36 55.81 1c8p s GLN 39 Cb -0.17 -0.04 0.05 0.00 1.10 0.00 0.00 33.01 33.94 1c8p s GLN 39 CO 0.15 -0.06 0.15 1.52 -0.55 0.00 0.00 175.29 176.49 1c8p s TYR 40 N 0.40 -0.15 0.00 1.67 1.13 -1.17 -0.13 117.35 119.10 1c8p s TYR 40 Ca -0.03 0.56 0.00 0.00 -1.41 0.00 0.00 57.07 56.19 1c8p s TYR 40 Cb -0.04 -0.29 0.00 0.00 -1.10 0.00 0.00 41.96 40.52 1c8p s TYR 40 CO -0.02 -0.26 0.00 2.89 -2.51 0.00 0.00 175.55 175.65 1c8p n ARG 41 N 5.32 3.70 -3.99 -3.49 1.85 -0.39 -2.94 116.66 116.72 1c8p n ARG 41 Ca -0.04 0.00 -0.08 0.00 -1.00 0.00 0.00 57.85 56.73 1c8p n ARG 41 Cb 0.50 0.00 -0.09 0.00 -1.05 0.00 0.00 32.46 31.82 1c8p n ARG 41 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1c8p s LYS 42 N 1.17 0.68 0.39 2.89 1.02 -1.26 -1.44 119.74 123.18 1c8p s LYS 42 Ca 0.00 -1.06 0.27 0.00 0.02 0.00 0.00 55.97 55.20 1c8p s LYS 42 Cb 0.00 0.25 1.38 0.00 -0.52 0.00 0.00 37.83 38.94 1c8p s LYS 42 CO 0.00 -0.16 1.82 0.22 -0.92 0.00 0.00 175.35 176.30 1c8p h ASP 43 N 3.12 0.00 0.00 2.83 1.82 -1.91 -2.58 116.42 119.70 1c8p h ASP 43 Ca -0.34 0.00 -0.33 0.00 -0.39 0.00 0.00 57.03 55.97 1c8p h ASP 43 Cb 1.17 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 41.12 1c8p h ASP 43 CO 0.60 0.00 -2.25 1.07 -1.61 0.00 0.00 179.24 177.05 1c8p n THR 44 N -2.45 1.25 -2.44 2.25 5.66 -1.26 -5.01 114.28 112.28 1c8p n THR 44 Ca -0.01 -0.62 -0.10 0.00 -3.05 0.00 0.00 64.05 60.27 1c8p n THR 44 Cb 0.09 -0.92 0.05 0.00 -1.55 0.00 0.00 70.33 68.00 1c8p n THR 44 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1c8p n ALA 45 N -2.91 0.11 -2.47 1.79 0.00 -0.97 -5.13 120.51 110.93 1c8p n ALA 45 Ca -0.34 -0.89 -0.23 0.00 0.00 0.00 0.00 53.44 51.97 1c8p n ALA 45 Cb 1.00 0.15 -0.10 0.00 0.00 0.00 0.00 19.45 20.50 1c8p n ALA 45 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1c8p s THR 46 N -1.25 2.06 0.30 0.00 -4.23 -1.26 -4.40 115.64 106.86 1c8p s THR 46 Ca 0.30 -2.23 0.04 0.00 -1.18 0.00 0.00 61.69 58.63 1c8p s THR 46 Cb -0.02 -2.45 0.29 0.00 1.34 0.00 0.00 72.50 71.67 1c8p s THR 46 CO 0.20 -0.32 1.80 -0.50 -0.54 0.00 0.00 174.62 175.26 1c8p h TRP 47 N 2.21 1.10 -1.06 3.99 4.06 -1.95 0.58 115.95 124.88 1c8p h TRP 47 Ca -0.41 0.03 0.28 0.00 2.06 0.00 0.00 58.89 60.86 1c8p h TRP 47 Cb 1.24 -0.34 -0.08 0.00 -1.00 0.00 0.00 29.16 28.99 1c8p h TRP 47 CO 0.75 0.32 0.71 0.87 -3.56 0.00 0.00 178.44 177.53 1c8p h LYS 48 N 0.85 0.25 0.00 0.49 1.79 -2.00 0.49 116.57 118.44 1c8p h LYS 48 Ca 0.55 -0.01 -0.13 0.00 -2.18 0.00 0.00 60.65 58.88 1c8p h LYS 48 Cb 0.75 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.32 1c8p h LYS 48 CO -0.34 0.16 -1.12 0.22 -1.08 0.00 0.00 179.45 177.30 1c8p h ASP 49 N 0.26 0.00 -3.05 0.86 3.58 -1.31 -3.47 116.42 113.29 1c8p h ASP 49 Ca 0.57 0.00 -0.56 0.00 0.42 0.00 0.00 57.03 57.46 1c8p h ASP 49 Cb 1.71 0.00 0.20 0.00 1.72 0.00 0.00 39.33 42.96 1c8p h ASP 49 CO -0.19 0.48 -0.63 -1.54 -2.88 0.00 0.00 179.24 174.48 1c8p n SER 50 N -2.95 -2.02 -4.73 2.28 3.41 0.17 -4.95 113.62 104.84 1c8p n SER 50 Ca -0.05 0.50 -0.37 0.00 -0.26 0.00 0.00 58.87 58.69 1c8p n SER 50 Cb 0.77 -1.14 -0.07 0.00 -0.26 0.00 0.00 64.21 63.51 1c8p n SER 50 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1c8p s LYS 51 N -2.73 4.29 -0.44 4.33 1.02 -1.15 -4.89 119.74 120.17 1c8p s LYS 51 Ca 0.61 0.23 -0.16 0.00 0.02 0.00 0.00 55.97 56.67 1c8p s LYS 51 Cb -0.32 -3.43 0.04 0.00 -0.52 0.00 0.00 37.83 33.61 1c8p s LYS 51 CO 0.63 0.21 0.40 0.99 -0.92 0.00 0.00 175.35 176.66 1c8p s THR 52 N 0.52 5.16 -0.14 2.17 2.01 -1.26 -3.06 115.64 121.03 1c8p s THR 52 Ca 0.20 -0.66 -0.08 0.00 0.31 0.00 0.00 61.69 61.46 1c8p s THR 52 Cb -0.14 -4.06 -0.04 0.00 0.01 0.00 0.00 72.50 68.27 1c8p s THR 52 CO 0.06 -0.47 0.13 -1.61 -0.69 0.00 0.00 174.62 172.04 1c8p s GLU 53 N 1.91 3.67 -0.68 4.92 8.01 0.44 -4.94 118.70 132.02 1c8p s GLU 53 Ca 0.08 -0.18 -0.06 0.00 0.01 0.00 0.00 54.97 54.82 1c8p s GLU 53 Cb -0.20 -3.24 0.18 0.00 -4.31 0.00 0.00 34.13 26.55 1c8p s GLU 53 CO 0.10 0.62 0.53 0.95 0.01 0.00 0.00 175.26 177.47 1c8p s THR 54 N -0.56 4.24 0.15 3.63 -4.23 -1.26 0.11 115.64 117.72 1c8p s THR 54 Ca 0.12 -2.83 -0.15 0.00 -1.18 0.00 0.00 61.69 57.65 1c8p s THR 54 Cb -0.12 -3.71 -0.07 0.00 1.34 0.00 0.00 72.50 69.94 1c8p s THR 54 CO 0.02 -0.92 0.58 -0.76 -0.54 0.00 0.00 174.62 173.00 1c8p s LEU 55 N -0.01 4.35 -0.15 4.79 1.02 0.13 -4.96 118.68 123.85 1c8p s LEU 55 Ca 0.17 1.14 0.02 0.00 0.02 0.00 0.00 54.13 55.48 1c8p s LEU 55 Cb -0.17 -3.30 0.01 0.00 0.02 0.00 0.00 46.19 42.75 1c8p s LEU 55 CO -0.05 0.10 -0.19 -1.10 0.02 0.00 0.00 176.35 175.13 1c8p s GLN 56 N -1.91 2.78 -1.54 1.70 -0.21 -1.26 -0.21 119.66 119.01 1c8p s GLN 56 Ca 0.38 -0.76 -0.15 0.00 0.02 0.00 0.00 55.36 54.85 1c8p s GLN 56 Cb -0.16 -2.33 0.12 0.00 1.00 0.00 0.00 33.01 31.64 1c8p s GLN 56 CO 0.19 -0.10 0.75 0.09 -2.12 0.00 0.00 175.29 174.10 1c8p n ASN 57 N 4.33 -3.78 -4.72 5.90 5.03 -0.84 -4.95 115.26 116.24 1c8p n ASN 57 Ca -0.20 -0.77 -0.25 0.00 0.87 0.00 0.00 54.58 54.23 1c8p n ASN 57 Cb 0.51 -3.08 -0.08 0.00 -1.02 0.00 0.00 39.78 36.11 1c8p n ASN 57 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1c8p s ALA 58 N -3.17 3.51 -0.04 5.41 0.00 -1.26 -5.05 121.76 121.15 1c8p s ALA 58 Ca 0.63 -2.14 0.06 0.00 0.00 0.00 0.00 51.96 50.52 1c8p s ALA 58 Cb -0.34 -0.30 0.10 0.00 0.00 0.00 0.00 23.12 22.58 1c8p s ALA 58 CO 0.78 -0.15 1.05 0.72 0.00 0.00 0.00 175.76 178.15 1c8p n HIS 59 N -1.19 0.00 0.00 0.00 8.25 -1.26 -4.94 115.22 116.08 1c8p n HIS 59 Ca -0.02 -0.30 0.00 0.00 -0.26 0.00 0.00 57.72 57.14 1c8p n HIS 59 Cb 0.65 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.68 1c8p n HIS 59 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1c8p n SER 60 N -0.37 0.00 -0.75 0.41 3.41 -1.26 -1.08 113.62 113.99 1c8p n SER 60 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 1c8p n SER 60 Cb 0.70 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.65 1c8p n SER 60 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 175.04 176.03 1c8p n MET 61 N -0.25 0.32 -3.47 4.33 0.00 -1.25 -4.97 117.12 111.84 1c8p n MET 61 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 57.70 57.43 1c8p n MET 61 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 33.22 33.13 1c8p n MET 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1c8p n ALA 62 N -3.00 3.08 -1.48 3.17 0.00 -1.26 -3.94 120.51 117.08 1c8p n ALA 62 Ca 0.00 -3.77 -0.34 0.00 0.00 0.00 0.00 53.44 49.32 1c8p n ALA 62 Cb 0.00 -0.85 -0.17 0.00 0.00 0.00 0.00 19.45 18.42 1c8p n ALA 62 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1c8p n LEU 63 N 1.99 -0.29 -0.11 0.00 4.77 -0.00 -4.76 117.00 118.60 1c8p n LEU 63 Ca 0.25 -0.06 -0.20 0.00 -0.03 0.00 0.00 56.01 55.98 1c8p n LEU 63 Cb 0.45 -0.78 -0.09 0.00 -2.33 0.00 0.00 43.42 40.67 1c8p n LEU 63 CO 0.20 -0.95 -0.74 -0.81 -1.33 0.00 0.00 177.39 173.76 1c8p n PRO 64 N 7.44 0.55 -2.72 3.23 -0.04 -1.26 -3.62 135.00 138.57 1c8p n PRO 64 Ca 0.66 0.46 -0.43 0.00 -0.04 0.00 0.00 63.50 64.14 1c8p n PRO 64 Cb 0.07 -1.65 0.00 0.00 -0.04 0.00 0.00 33.50 31.88 1c8p n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1c8p n ALA 65 N -3.76 4.51 -3.92 0.55 0.00 -1.26 -4.96 120.51 111.67 1c8p n ALA 65 Ca -0.32 -4.30 -0.05 0.00 0.00 0.00 0.00 53.44 48.77 1c8p n ALA 65 Cb 0.64 -2.99 -0.01 0.00 0.00 0.00 0.00 19.45 17.09 1c8p n ALA 65 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1c8p n LEU 66 N 4.74 0.00 -3.77 0.00 4.77 -1.26 -5.00 117.00 116.48 1c8p n LEU 66 Ca 0.37 -0.54 -0.14 0.00 -0.03 0.00 0.00 56.01 55.68 1c8p n LEU 66 Cb 0.40 0.04 -0.15 0.00 -2.33 0.00 0.00 43.42 41.38 1c8p n LEU 66 CO 0.70 -0.16 -0.28 -1.61 -1.33 0.00 0.00 177.39 174.70 1c8p s GLU 67 N -2.35 0.04 0.88 3.23 0.41 -1.26 -5.16 118.70 114.49 1c8p s GLU 67 Ca 0.02 0.27 -0.12 0.00 -0.41 0.00 0.00 54.97 54.73 1c8p s GLU 67 Cb -0.00 -0.18 0.12 0.00 -1.78 0.00 0.00 34.13 32.29 1c8p s GLU 67 CO 0.01 -0.15 1.12 -1.25 -0.49 0.00 0.00 175.26 174.51 1c8p s PRO 68 N 0.99 1.43 -1.32 0.39 0.04 -1.26 -3.70 135.00 131.56 1c8p s PRO 68 Ca -0.08 0.44 0.00 0.00 0.04 0.00 0.00 61.00 61.40 1c8p s PRO 68 Cb -0.11 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.57 1c8p s PRO 68 CO -0.04 -2.03 0.00 0.45 0.04 0.00 0.00 177.00 175.42 1c8p n SER 69 N -3.68 -3.97 -3.86 6.66 2.88 -1.26 -4.92 113.62 105.48 1c8p n SER 69 Ca 0.07 0.25 -0.11 0.00 -1.33 0.00 0.00 58.87 57.74 1c8p n SER 69 Cb 0.58 -3.51 -0.11 0.00 -0.75 0.00 0.00 64.21 60.42 1c8p n SER 69 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1c8p s THR 70 N -2.44 0.05 0.79 2.46 2.01 -1.24 -4.98 115.64 112.29 1c8p s THR 70 Ca 0.00 -0.43 -0.12 0.00 0.31 0.00 0.00 61.69 61.45 1c8p s THR 70 Cb 0.00 -0.33 0.07 0.00 0.01 0.00 0.00 72.50 72.25 1c8p s THR 70 CO 0.00 -0.24 1.16 -0.13 -0.69 0.00 0.00 174.62 174.72 1c8p s ARG 71 N -0.81 2.10 -0.09 4.92 0.52 -1.26 -2.43 118.95 121.89 1c8p s ARG 71 Ca -0.09 0.21 -0.04 0.00 -0.52 0.00 0.00 55.73 55.30 1c8p s ARG 71 Cb -0.05 -1.96 0.05 0.00 0.52 0.00 0.00 34.95 33.51 1c8p s ARG 71 CO 0.01 -1.52 0.19 0.71 0.02 0.00 0.00 175.30 174.70 1c8p s TYR 72 N -3.50 -0.24 -0.45 -0.53 1.51 0.12 -3.17 117.35 111.08 1c8p s TYR 72 Ca 0.61 0.70 -0.09 0.00 -1.01 0.00 0.00 57.07 57.29 1c8p s TYR 72 Cb -0.11 -0.19 0.11 0.00 -0.11 0.00 0.00 41.96 41.65 1c8p s TYR 72 CO 0.50 -0.29 0.31 -1.58 -1.11 0.00 0.00 175.55 173.38 1c8p s TRP 73 N 2.24 3.42 0.46 2.71 0.52 -0.52 -1.53 118.94 126.24 1c8p s TRP 73 Ca 0.02 -1.84 0.08 0.00 0.02 0.00 0.00 56.10 54.37 1c8p s TRP 73 Cb -0.12 -3.34 0.02 0.00 -1.15 0.00 0.00 33.47 28.88 1c8p s TRP 73 CO -0.06 -0.96 0.53 0.00 0.02 0.00 0.00 176.95 176.47 1c8p s ALA 74 N 1.36 4.39 0.21 0.98 0.00 -0.61 -1.26 121.76 126.82 1c8p s ALA 74 Ca 0.05 -1.80 -0.22 0.00 0.00 0.00 0.00 51.96 49.99 1c8p s ALA 74 Cb -0.25 -1.28 0.05 0.00 0.00 0.00 0.00 23.12 21.63 1c8p s ALA 74 CO -0.00 -0.39 0.70 -0.98 0.00 0.00 0.00 175.76 175.09 1c8p s ARG 75 N -4.32 1.51 -0.15 0.00 1.04 0.81 -1.24 118.95 116.60 1c8p s ARG 75 Ca 0.52 -0.74 -0.08 0.00 -1.04 0.00 0.00 55.73 54.38 1c8p s ARG 75 Cb -0.06 0.58 0.05 0.00 -2.04 0.00 0.00 34.95 33.48 1c8p s ARG 75 CO 0.31 -0.68 0.36 0.54 -0.04 0.00 0.00 175.30 175.79 1c8p s VAL 76 N -3.77 -0.03 -0.09 4.99 0.11 -1.26 -1.59 120.40 118.76 1c8p s VAL 76 Ca 0.07 0.11 -0.11 0.00 -2.93 0.00 0.00 61.98 59.11 1c8p s VAL 76 Cb -0.04 -0.54 -0.05 0.00 -1.53 0.00 0.00 36.38 34.22 1c8p s VAL 76 CO -0.01 0.04 0.27 -0.13 -3.33 0.00 0.00 175.10 171.94 1c8p s ARG 77 N 1.32 3.83 -0.06 1.54 0.52 -0.83 -1.16 118.95 124.12 1c8p s ARG 77 Ca -0.09 0.11 0.01 0.00 -0.52 0.00 0.00 55.73 55.23 1c8p s ARG 77 Cb -0.09 -3.27 0.02 0.00 0.52 0.00 0.00 34.95 32.14 1c8p s ARG 77 CO -0.11 0.60 -0.05 0.54 0.02 0.00 0.00 175.30 176.30 1c8p s VAL 78 N -0.62 0.62 0.14 3.52 0.11 -1.26 -1.90 120.40 121.02 1c8p s VAL 78 Ca 0.18 -0.13 0.08 0.00 -2.93 0.00 0.00 61.98 59.18 1c8p s VAL 78 Cb -0.14 -0.66 -0.04 0.00 -1.53 0.00 0.00 36.38 34.01 1c8p s VAL 78 CO 0.07 0.26 -0.17 -0.60 -3.33 0.00 0.00 175.10 171.33 1c8p s ARG 79 N 1.18 1.19 -0.36 1.54 6.06 -1.24 -4.08 118.95 123.24 1c8p s ARG 79 Ca -0.07 -1.33 -0.00 0.00 -2.50 0.00 0.00 55.73 51.83 1c8p s ARG 79 Cb -0.14 -1.22 0.13 0.00 0.06 0.00 0.00 34.95 33.77 1c8p s ARG 79 CO -0.01 0.25 0.18 0.99 -2.50 0.00 0.00 175.30 174.21 1c8p s THR 80 N -1.95 0.57 -0.07 4.11 2.01 -1.26 -3.72 115.64 115.34 1c8p s THR 80 Ca 0.13 -1.73 -0.07 0.00 0.31 0.00 0.00 61.69 60.33 1c8p s THR 80 Cb -0.06 -1.42 -0.02 0.00 0.01 0.00 0.00 72.50 71.00 1c8p s THR 80 CO 0.05 -0.87 -0.13 -0.24 -0.69 0.00 0.00 174.62 172.74 1c8p n SER 81 N 4.25 0.76 0.00 3.53 2.88 -1.26 -5.07 113.62 118.71 1c8p n SER 81 Ca 0.06 0.16 0.00 0.00 -1.33 0.00 0.00 58.87 57.76 1c8p n SER 81 Cb 0.38 -0.60 0.00 0.00 -0.75 0.00 0.00 64.21 63.24 1c8p n SER 81 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1c8p n ARG 82 N -3.26 -0.84 0.00 -1.46 1.74 -1.26 -4.87 116.66 106.71 1c8p n ARG 82 Ca -0.05 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 1c8p n ARG 82 Cb 0.19 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.63 1c8p n ARG 82 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1c8p n THR 83 N -1.37 0.00 0.25 0.55 -2.24 -1.26 0.15 114.28 110.35 1c8p n THR 83 Ca 0.00 1.13 0.17 0.00 -2.27 0.00 0.00 64.05 63.09 1c8p n THR 83 Cb 0.00 -1.52 0.89 0.00 -2.10 0.00 0.00 70.33 67.60 1c8p n THR 83 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1c8p h GLY 84 N 0.00 0.00 0.00 3.38 0.00 -1.98 -3.46 103.07 101.01 1c8p h GLY 84 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1c8p h GLY 84 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 176.54 179.52 1c8p n TYR 85 N -3.65 -1.02 0.00 5.60 9.36 0.39 -5.00 117.16 122.84 1c8p n TYR 85 Ca -0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1c8p n TYR 85 Cb 0.25 0.09 0.00 0.00 -0.63 0.00 0.00 39.34 39.06 1c8p n TYR 85 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 1c8p n ASN 86 N -3.65 0.00 -0.63 2.98 2.04 -1.26 -4.91 115.26 109.84 1c8p n ASN 86 Ca 0.00 0.00 -0.03 0.00 -0.44 0.00 0.00 54.58 54.11 1c8p n ASN 86 Cb 0.00 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 37.22 1c8p n ASN 86 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1c8p n GLY 87 N 0.00 0.20 3.57 4.83 0.00 -1.26 -5.14 105.19 107.39 1c8p n GLY 87 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1c8p n GLY 87 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1c8p s ILE 88 N 0.00 3.51 0.31 -0.61 2.07 -1.26 -5.13 121.20 120.08 1c8p s ILE 88 Ca 0.00 -0.83 0.10 0.00 -1.41 0.00 0.00 60.65 58.51 1c8p s ILE 88 Cb 0.00 -2.51 -0.06 0.00 0.13 0.00 0.00 42.46 40.02 1c8p s ILE 88 CO 0.00 0.39 -0.12 0.26 -1.91 0.00 0.00 174.94 173.57 1c8p s TRP 89 N -0.97 2.27 0.00 3.50 0.52 -1.26 -4.87 118.94 118.13 1c8p s TRP 89 Ca 0.16 -0.49 0.00 0.00 0.02 0.00 0.00 56.10 55.79 1c8p s TRP 89 Cb -0.11 -1.22 0.00 0.00 -1.15 0.00 0.00 33.47 30.99 1c8p s TRP 89 CO 0.07 0.56 0.00 -1.13 0.02 0.00 0.00 176.95 176.47 1c8p n SER 90 N -0.70 0.00 -4.81 2.95 3.41 -1.26 -4.97 113.62 108.24 1c8p n SER 90 Ca -0.05 -0.72 -0.38 0.00 -0.26 0.00 0.00 58.87 57.46 1c8p n SER 90 Cb 0.62 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.52 1c8p n SER 90 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1c8p s GLU 91 N -1.24 4.23 0.38 4.33 2.02 -1.26 -4.78 118.70 122.37 1c8p s GLU 91 Ca 0.00 0.78 -0.26 0.00 0.02 0.00 0.00 54.97 55.51 1c8p s GLU 91 Cb 0.00 -3.11 -0.12 0.00 0.10 0.00 0.00 34.13 31.00 1c8p s GLU 91 CO 0.00 0.55 1.08 0.91 0.02 0.00 0.00 175.26 177.82 1c8p n TRP 92 N 1.32 1.45 -0.80 1.61 7.02 -1.26 -4.52 117.44 122.27 1c8p n TRP 92 Ca -0.07 0.59 -0.27 0.00 -1.02 0.00 0.00 57.50 56.73 1c8p n TRP 92 Cb 0.51 -2.28 0.23 0.00 -2.42 0.00 0.00 31.31 27.36 1c8p n TRP 92 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 1c8p n SER 93 N 0.70 -2.48 -4.67 -0.99 3.41 -0.30 -4.89 113.62 104.39 1c8p n SER 93 Ca 0.08 -1.02 -0.43 0.00 -0.26 0.00 0.00 58.87 57.24 1c8p n SER 93 Cb 0.37 -0.90 -0.02 0.00 -0.26 0.00 0.00 64.21 63.40 1c8p n SER 93 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1c8p s GLU 94 N -5.14 4.24 -0.20 4.33 2.56 -1.26 -4.63 118.70 118.60 1c8p s GLU 94 Ca 0.63 1.75 -0.38 0.00 0.00 0.00 0.00 54.97 56.97 1c8p s GLU 94 Cb -0.07 -3.75 -0.14 0.00 2.00 0.00 0.00 34.13 32.16 1c8p s GLU 94 CO 0.49 -0.68 1.79 0.00 -0.56 0.00 0.00 175.26 176.30 1c8p n ALA 95 N 6.41 0.20 -3.03 6.30 0.00 -1.26 -4.78 120.51 124.35 1c8p n ALA 95 Ca 0.14 0.35 -0.37 0.00 0.00 0.00 0.00 53.44 53.56 1c8p n ALA 95 Cb 0.45 -2.32 -0.12 0.00 0.00 0.00 0.00 19.45 17.45 1c8p n ALA 95 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1c8p s ARG 96 N 3.70 3.47 -0.17 0.00 1.81 -0.37 -4.90 118.95 122.49 1c8p s ARG 96 Ca 0.96 -0.61 -0.09 0.00 -1.72 0.00 0.00 55.73 54.27 1c8p s ARG 96 Cb -0.93 -3.39 -0.05 0.00 -0.45 0.00 0.00 34.95 30.13 1c8p s ARG 96 CO 0.60 -0.29 0.14 -1.54 -0.68 0.00 0.00 175.30 173.53 1c8p s SER 97 N 1.59 6.28 0.16 0.23 1.04 -1.25 -1.58 113.70 120.18 1c8p s SER 97 Ca 0.05 0.33 -0.10 0.00 0.48 0.00 0.00 55.95 56.71 1c8p s SER 97 Cb -0.16 -2.09 -0.00 0.00 0.10 0.00 0.00 66.02 63.87 1c8p s SER 97 CO 0.04 0.26 0.30 -1.66 0.98 0.00 0.00 173.24 173.17 1c8p s TRP 98 N -0.16 0.31 -0.09 5.02 -2.14 -0.58 -4.92 118.94 116.38 1c8p s TRP 98 Ca 0.11 -0.68 -0.06 0.00 2.66 0.00 0.00 56.10 58.13 1c8p s TRP 98 Cb -0.11 -0.00 -0.04 0.00 -3.10 0.00 0.00 33.47 30.21 1c8p s TRP 98 CO 0.00 -0.72 0.16 0.34 -2.66 0.00 0.00 176.95 174.07 1c8p s ASP 99 N -2.94 6.40 0.00 -2.66 2.15 -1.26 0.10 116.67 118.46 1c8p s ASP 99 Ca 0.15 0.46 0.18 0.00 0.43 0.00 0.00 52.55 53.77 1c8p s ASP 99 Cb 0.03 -2.06 0.75 0.00 -0.30 0.00 0.00 42.92 41.34 1c8p s ASP 99 CO -0.02 0.37 1.52 0.35 -0.17 0.00 0.00 175.17 177.23 1c8p n THR 100 N 1.72 0.17 -2.29 1.71 -2.24 -1.02 -4.97 114.28 107.36 1c8p n THR 100 Ca -0.18 -0.24 -0.02 0.00 -2.27 0.00 0.00 64.05 61.35 1c8p n THR 100 Cb 0.54 0.14 -0.01 0.00 -2.10 0.00 0.00 70.33 68.91 1c8p n THR 100 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1c8p n GLU 101 N -0.02 -4.54 0.00 -0.78 -0.58 -1.26 -4.59 120.64 108.87 1c8p n GLU 101 Ca 0.14 3.38 0.08 0.00 -0.42 0.00 0.00 57.16 60.34 1c8p n GLU 101 Cb 0.23 -4.42 0.48 0.00 -0.57 0.00 0.00 31.44 27.15 1c8p n GLU 101 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10