#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bpv n PRO 1 N 0.00 0.46 -3.64 1.43 -0.04 -1.26 -4.84 135.00 127.10 1bpv n PRO 1 Ca 0.00 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.31 1bpv n PRO 1 Cb 0.00 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.38 1bpv n PRO 1 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1bpv s ILE 2 N -0.40 0.02 -0.06 0.52 2.07 -1.26 -0.72 121.20 121.36 1bpv s ILE 2 Ca 0.00 -0.13 0.02 0.00 -1.41 0.00 0.00 60.65 59.13 1bpv s ILE 2 Cb 0.00 -0.82 0.01 0.00 0.13 0.00 0.00 42.46 41.79 1bpv s ILE 2 CO 0.00 -0.07 -0.11 -1.81 -1.91 0.00 0.00 174.94 171.04 1bpv s ASP 3 N -0.69 1.59 0.85 4.50 1.11 -1.26 -4.79 116.67 117.98 1bpv s ASP 3 Ca -0.08 -0.26 -0.12 0.00 0.18 0.00 0.00 52.55 52.27 1bpv s ASP 3 Cb -0.03 -0.74 0.13 0.00 1.07 0.00 0.00 42.92 43.35 1bpv s ASP 3 CO 0.05 0.02 1.20 -2.16 1.18 0.00 0.00 175.17 175.46 1bpv s PRO 4 N 0.70 1.42 1.19 8.23 0.04 -1.26 -4.49 135.00 140.83 1bpv s PRO 4 Ca -0.14 -0.24 -0.17 0.00 0.04 0.00 0.00 61.00 60.49 1bpv s PRO 4 Cb -0.15 -1.96 0.22 0.00 0.04 0.00 0.00 34.50 32.64 1bpv s PRO 4 CO 0.03 -1.88 0.46 -2.30 0.04 0.00 0.00 177.00 173.35 1bpv n PRO 5 N -3.42 -2.57 -0.14 0.56 -0.02 -1.26 -4.18 135.00 123.97 1bpv n PRO 5 Ca 0.11 -0.74 0.00 0.00 -2.02 0.00 0.00 63.50 60.85 1bpv n PRO 5 Cb 0.60 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 1bpv n PRO 5 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bpv n GLY 6 N 1.85 0.26 3.63 -1.23 0.00 -1.26 -4.81 105.19 103.63 1bpv n GLY 6 Ca 0.04 -1.82 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 1bpv n GLY 6 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bpv s LYS 7 N -0.08 3.95 0.51 1.61 2.36 -1.26 -4.69 119.74 122.14 1bpv s LYS 7 Ca 0.00 1.04 -0.20 0.00 -2.55 0.00 0.00 55.97 54.26 1bpv s LYS 7 Cb 0.00 -3.81 -0.07 0.00 -1.05 0.00 0.00 37.83 32.89 1bpv s LYS 7 CO 0.00 -1.06 1.09 -2.14 1.55 0.00 0.00 175.35 174.79 1bpv s PRO 8 N 3.97 3.61 -0.23 4.03 0.02 -1.26 -4.57 135.00 140.57 1bpv s PRO 8 Ca 0.49 1.51 -0.03 0.00 0.02 0.00 0.00 61.00 63.00 1bpv s PRO 8 Cb -0.13 -2.10 0.11 0.00 0.02 0.00 0.00 34.50 32.41 1bpv s PRO 8 CO 0.21 -0.62 0.27 0.08 -0.33 0.00 0.00 177.00 176.61 1bpv s VAL 9 N -1.84 -0.40 -0.67 3.83 1.01 -0.73 -4.54 120.40 117.06 1bpv s VAL 9 Ca 0.69 -0.18 -0.26 0.00 0.00 0.00 0.00 61.98 62.23 1bpv s VAL 9 Cb -0.21 -0.77 -0.12 0.00 0.00 0.00 0.00 36.38 35.28 1bpv s VAL 9 CO 0.25 -0.24 2.42 -2.65 0.00 0.00 0.00 175.10 174.87 1bpv n PRO 10 N 5.33 0.74 -0.22 2.72 -0.02 -1.25 -2.29 135.00 140.01 1bpv n PRO 10 Ca -0.04 -0.45 0.03 0.00 -2.02 0.00 0.00 63.50 61.01 1bpv n PRO 10 Cb 0.49 -3.49 0.14 0.00 -0.02 0.00 0.00 33.50 30.63 1bpv n PRO 10 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1bpv h LEU 11 N 20.88 0.07 -8.81 2.45 -0.00 0.03 -3.41 115.31 126.53 1bpv h LEU 11 Ca -0.10 0.12 -0.63 0.00 -0.00 0.00 0.00 57.88 57.27 1bpv h LEU 11 Cb 1.13 0.15 -0.22 0.00 -0.00 0.00 0.00 40.66 41.71 1bpv h LEU 11 CO 1.09 0.02 -0.85 0.21 -0.00 0.00 0.00 178.44 178.92 1bpv s ASN 12 N -5.30 2.97 -0.43 -0.43 2.47 -0.74 -4.99 114.94 108.49 1bpv s ASN 12 Ca -0.13 -0.73 0.04 0.00 0.42 0.00 0.00 52.86 52.47 1bpv s ASN 12 Cb 0.19 -0.18 0.17 0.00 -1.45 0.00 0.00 41.25 39.98 1bpv s ASN 12 CO 0.75 0.12 0.41 0.27 -3.72 0.00 0.00 177.10 174.93 1bpv s ILE 13 N -1.15 0.05 0.62 -5.21 -4.36 -1.26 0.78 121.20 110.67 1bpv s ILE 13 Ca 0.11 -2.25 -0.14 0.00 -0.26 0.00 0.00 60.65 58.11 1bpv s ILE 13 Cb -0.10 -0.99 -0.03 0.00 1.25 0.00 0.00 42.46 42.60 1bpv s ILE 13 CO 0.05 -0.97 1.05 -0.89 0.24 0.00 0.00 174.94 174.42 1bpv s THR 14 N 0.29 3.96 -0.71 8.37 2.01 0.27 -4.81 115.64 125.03 1bpv s THR 14 Ca 0.31 0.82 0.10 0.00 0.31 0.00 0.00 61.69 63.23 1bpv s THR 14 Cb 0.02 -3.42 0.09 0.00 0.01 0.00 0.00 72.50 69.20 1bpv s THR 14 CO -0.16 -0.65 1.30 -2.11 -0.69 0.00 0.00 174.62 172.31 1bpv n ARG 15 N -2.37 0.06 -0.52 4.92 -4.01 -1.26 -2.32 116.66 111.16 1bpv n ARG 15 Ca 0.08 0.52 0.00 0.00 -1.04 0.00 0.00 57.85 57.41 1bpv n ARG 15 Cb 0.53 -1.67 0.00 0.00 -3.04 0.00 0.00 32.46 28.28 1bpv n ARG 15 CO 0.00 0.00 0.00 0.72 -3.04 0.00 0.00 177.63 175.31 1bpv n HIS 16 N -1.79 0.00 0.00 2.89 8.25 -1.26 -3.57 115.22 119.74 1bpv n HIS 16 Ca -0.00 -0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1bpv n HIS 16 Cb 0.04 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.10 1bpv n HIS 16 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1bpv n THR 17 N 0.01 0.00 -4.16 1.59 -2.24 -0.98 -4.11 114.28 104.39 1bpv n THR 17 Ca 0.00 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.44 1bpv n THR 17 Cb 0.71 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.81 1bpv n THR 17 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1bpv s VAL 18 N 0.00 3.95 -0.08 2.28 -7.23 -0.23 -0.56 120.40 118.52 1bpv s VAL 18 Ca 0.00 -0.32 -0.11 0.00 -1.81 0.00 0.00 61.98 59.73 1bpv s VAL 18 Cb 0.00 -2.77 -0.05 0.00 0.56 0.00 0.00 36.38 34.12 1bpv s VAL 18 CO 0.00 0.45 0.28 -0.89 -0.31 0.00 0.00 175.10 174.62 1bpv s THR 19 N 0.81 5.28 0.12 5.32 2.01 0.23 0.56 115.64 129.97 1bpv s THR 19 Ca 0.00 0.52 -0.01 0.00 0.31 0.00 0.00 61.69 62.52 1bpv s THR 19 Cb -0.14 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.76 1bpv s THR 19 CO 0.02 0.55 0.03 -1.48 -0.69 0.00 0.00 174.62 173.06 1bpv s LEU 20 N -0.71 1.94 0.03 4.42 2.34 -0.35 0.77 118.68 127.11 1bpv s LEU 20 Ca 0.19 -1.17 -0.18 0.00 0.06 0.00 0.00 54.13 53.03 1bpv s LEU 20 Cb -0.14 0.25 0.03 0.00 -0.56 0.00 0.00 46.19 45.77 1bpv s LEU 20 CO 0.07 -0.69 0.39 -0.75 -1.06 0.00 0.00 176.35 174.32 1bpv s LYS 21 N -4.01 0.87 0.05 1.48 2.36 -0.97 -2.25 119.74 117.27 1bpv s LYS 21 Ca 0.21 -0.32 0.00 0.00 -2.55 0.00 0.00 55.97 53.31 1bpv s LYS 21 Cb 0.07 0.39 0.00 0.00 -1.05 0.00 0.00 37.83 37.24 1bpv s LYS 21 CO -0.00 -0.29 0.07 -2.67 1.55 0.00 0.00 175.35 174.01 1bpv n TRP 22 N 0.66 -0.50 -0.03 4.03 2.14 -1.23 -1.77 117.44 120.75 1bpv n TRP 22 Ca -0.19 -0.38 0.00 0.00 2.07 0.00 0.00 57.50 59.00 1bpv n TRP 22 Cb 0.59 0.08 0.00 0.00 -0.81 0.00 0.00 31.31 31.17 1bpv n TRP 22 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1bpv n ALA 23 N -2.64 0.00 -3.04 -1.67 0.00 -1.26 -4.87 120.51 107.03 1bpv n ALA 23 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.30 1bpv n ALA 23 Cb 0.09 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.41 1bpv n ALA 23 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1bpv s LYS 24 N 0.05 0.11 0.32 0.00 2.36 -1.26 -4.16 119.74 117.17 1bpv s LYS 24 Ca 0.00 0.15 -0.14 0.00 -2.55 0.00 0.00 55.97 53.43 1bpv s LYS 24 Cb 0.00 0.04 -0.11 0.00 -1.05 0.00 0.00 37.83 36.71 1bpv s LYS 24 CO 0.00 -0.03 -0.01 -2.30 1.55 0.00 0.00 175.35 174.56 1bpv n PRO 25 N 3.12 0.00 -0.43 4.03 -0.02 -1.26 -4.85 135.00 135.59 1bpv n PRO 25 Ca -0.13 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.45 1bpv n PRO 25 Cb 0.59 -0.72 0.32 0.00 -0.02 0.00 0.00 33.50 33.66 1bpv n PRO 25 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1bpv n GLU 26 N 1.02 2.94 0.04 -0.52 -0.58 -1.26 -4.82 120.64 117.46 1bpv n GLU 26 Ca 0.07 -2.56 0.00 0.00 -0.42 0.00 0.00 57.16 54.25 1bpv n GLU 26 Cb 0.31 -1.65 0.00 0.00 -0.57 0.00 0.00 31.44 29.53 1bpv n GLU 26 CO 0.00 0.00 0.00 0.98 -0.48 0.00 0.00 177.13 177.63 1bpv n TYR 27 N 1.37 -2.01 -3.83 -0.32 9.36 -1.26 -5.04 117.16 115.42 1bpv n TYR 27 Ca 0.24 0.27 -0.25 0.00 3.32 0.00 0.00 57.90 61.48 1bpv n TYR 27 Cb 0.67 0.91 0.01 0.00 -0.63 0.00 0.00 39.34 40.31 1bpv n TYR 27 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1bpv n THR 28 N -2.39 -3.48 0.00 2.97 -2.24 -1.26 -4.50 114.28 103.37 1bpv n THR 28 Ca 0.00 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1bpv n THR 28 Cb 0.00 -3.22 0.00 0.00 -2.10 0.00 0.00 70.33 65.01 1bpv n THR 28 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bpv n GLY 29 N -1.69 1.56 0.95 3.38 0.00 0.10 -0.17 105.19 109.31 1bpv n GLY 29 Ca -0.22 0.58 0.05 0.00 0.00 0.00 0.00 46.02 46.44 1bpv n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bpv n GLY 30 N 0.00 3.39 1.73 -0.02 0.00 -1.26 -4.63 105.19 104.40 1bpv n GLY 30 Ca 0.00 -1.10 -0.14 0.00 0.00 0.00 0.00 46.02 44.79 1bpv n GLY 30 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1bpv n PHE 31 N -0.46 -0.30 -2.54 1.61 3.72 0.76 -4.99 117.46 115.27 1bpv n PHE 31 Ca 0.13 -1.12 0.02 0.00 -0.05 0.00 0.00 57.45 56.43 1bpv n PHE 31 Cb 0.87 -0.18 0.02 0.00 -0.94 0.00 0.00 39.48 39.25 1bpv n PHE 31 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1bpv n LYS 32 N -0.85 0.49 0.00 -1.08 2.85 -1.26 -4.82 118.16 113.49 1bpv n LYS 32 Ca -0.05 -2.23 0.00 0.00 -1.05 0.00 0.00 58.31 54.98 1bpv n LYS 32 Cb 0.29 -0.33 0.00 0.00 -0.65 0.00 0.00 35.03 34.35 1bpv n LYS 32 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 1bpv n ILE 33 N 0.08 0.00 0.00 0.58 2.08 -1.26 -4.62 119.36 116.22 1bpv n ILE 33 Ca 0.01 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.32 1bpv n ILE 33 Cb 1.00 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.89 1bpv n ILE 33 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 1bpv n THR 34 N 0.00 0.00 -3.65 1.39 -2.24 -1.26 -4.02 114.28 104.50 1bpv n THR 34 Ca 0.00 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.76 1bpv n THR 34 Cb 0.00 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.16 1bpv n THR 34 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1bpv s SER 35 N -3.79 -0.01 -0.05 3.42 0.15 -1.26 -4.35 113.70 107.81 1bpv s SER 35 Ca 0.00 0.02 0.05 0.00 0.70 0.00 0.00 55.95 56.72 1bpv s SER 35 Cb 0.00 0.02 -0.02 0.00 -1.71 0.00 0.00 66.02 64.31 1bpv s SER 35 CO 0.00 -0.00 -0.19 -0.31 1.20 0.00 0.00 173.24 173.94 1bpv s TYR 36 N -0.09 2.57 -0.12 3.44 2.02 0.61 -4.06 117.35 121.72 1bpv s TYR 36 Ca 0.08 -0.34 0.01 0.00 -0.37 0.00 0.00 57.07 56.45 1bpv s TYR 36 Cb -0.05 -1.60 -0.01 0.00 -0.40 0.00 0.00 41.96 39.90 1bpv s TYR 36 CO -0.16 0.04 -0.17 0.42 -1.57 0.00 0.00 175.55 174.11 1bpv s ILE 37 N -0.55 2.66 -0.28 2.71 1.01 0.12 -3.60 121.20 123.27 1bpv s ILE 37 Ca 0.08 -0.80 -0.04 0.00 0.00 0.00 0.00 60.65 59.89 1bpv s ILE 37 Cb -0.11 -2.09 0.03 0.00 0.01 0.00 0.00 42.46 40.30 1bpv s ILE 37 CO 0.01 0.54 0.01 -0.69 0.00 0.00 0.00 174.94 174.80 1bpv s VAL 38 N 0.41 3.30 0.03 2.92 1.01 -1.26 0.47 120.40 127.28 1bpv s VAL 38 Ca -0.13 -1.01 -0.27 0.00 0.00 0.00 0.00 61.98 60.57 1bpv s VAL 38 Cb -0.17 -2.75 -0.05 0.00 0.00 0.00 0.00 36.38 33.42 1bpv s VAL 38 CO 0.06 0.07 0.84 -1.61 0.00 0.00 0.00 175.10 174.46 1bpv s GLU 39 N 1.37 4.54 -0.18 2.72 2.02 0.39 -1.23 118.70 128.34 1bpv s GLU 39 Ca -0.00 1.19 -0.15 0.00 0.02 0.00 0.00 54.97 56.03 1bpv s GLU 39 Cb -0.18 -3.40 -0.04 0.00 0.10 0.00 0.00 34.13 30.61 1bpv s GLU 39 CO -0.01 0.16 0.34 0.21 0.02 0.00 0.00 175.26 175.98 1bpv s LYS 40 N 0.32 4.23 -0.57 1.61 2.20 0.18 -0.95 119.74 126.76 1bpv s LYS 40 Ca 0.43 0.14 -0.07 0.00 -0.36 0.00 0.00 55.97 56.11 1bpv s LYS 40 Cb -0.21 -3.47 0.15 0.00 -1.51 0.00 0.00 37.83 32.79 1bpv s LYS 40 CO 0.25 0.13 0.43 0.50 -0.36 0.00 0.00 175.35 176.29 1bpv s ARG 41 N 0.80 2.62 0.41 4.03 3.52 0.20 0.12 118.95 130.65 1bpv s ARG 41 Ca 0.18 -2.15 -0.26 0.00 -0.13 0.00 0.00 55.73 53.36 1bpv s ARG 41 Cb -0.14 -3.89 -0.09 0.00 -1.56 0.00 0.00 34.95 29.27 1bpv s ARG 41 CO 0.06 -1.19 1.35 0.16 -0.81 0.00 0.00 175.30 174.87 1bpv s ASP 42 N 1.80 6.26 -0.06 -2.12 1.47 -1.25 -2.34 116.67 120.43 1bpv s ASP 42 Ca 0.12 2.76 0.04 0.00 1.18 0.00 0.00 52.55 56.65 1bpv s ASP 42 Cb -0.21 -2.65 -0.00 0.00 -0.34 0.00 0.00 42.92 39.72 1bpv s ASP 42 CO -0.03 -0.90 -0.20 -0.76 0.68 0.00 0.00 175.17 173.96 1bpv s LEU 43 N -2.40 1.94 -0.44 2.11 1.43 -0.39 0.16 118.68 121.10 1bpv s LEU 43 Ca 0.57 -0.43 -0.03 0.00 -1.03 0.00 0.00 54.13 53.21 1bpv s LEU 43 Cb -0.40 -1.14 0.11 0.00 0.03 0.00 0.00 46.19 44.79 1bpv s LEU 43 CO 0.52 0.15 2.58 -0.81 0.23 0.00 0.00 176.35 179.03 1bpv n PRO 44 N 3.31 2.30 -2.91 1.29 -0.04 -1.26 -3.86 135.00 133.83 1bpv n PRO 44 Ca -0.19 -2.25 -0.23 0.00 -0.04 0.00 0.00 63.50 60.79 1bpv n PRO 44 Cb 0.53 -2.05 -0.02 0.00 -0.04 0.00 0.00 33.50 31.91 1bpv n PRO 44 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1bpv n ASN 45 N 0.68 3.28 -4.09 3.54 5.03 -0.06 -5.11 115.26 118.54 1bpv n ASN 45 Ca 0.46 -3.43 -0.35 0.00 0.87 0.00 0.00 54.58 52.13 1bpv n ASN 45 Cb 0.55 -0.56 0.06 0.00 -1.02 0.00 0.00 39.78 38.81 1bpv n ASN 45 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1bpv n GLY 46 N -0.13 -4.05 0.00 7.41 0.00 0.43 -3.74 105.19 105.11 1bpv n GLY 46 Ca 0.29 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1bpv n GLY 46 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1bpv n ARG 47 N 1.60 0.00 -2.74 1.61 1.85 -1.26 -4.71 116.66 113.01 1bpv n ARG 47 Ca -0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 57.85 56.78 1bpv n ARG 47 Cb 0.56 0.00 0.01 0.00 -1.05 0.00 0.00 32.46 31.98 1bpv n ARG 47 CO 0.00 0.00 0.00 0.91 -0.01 0.00 0.00 177.63 178.53 1bpv n TRP 48 N -0.14 -3.33 -5.17 2.89 7.02 0.33 -4.93 117.44 114.11 1bpv n TRP 48 Ca 0.00 1.36 -0.32 0.00 -1.02 0.00 0.00 57.50 57.53 1bpv n TRP 48 Cb 0.00 -3.91 -0.16 0.00 -2.42 0.00 0.00 31.31 24.82 1bpv n TRP 48 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1bpv s LEU 49 N -2.35 2.23 -0.88 -0.99 2.01 0.20 -4.39 118.68 114.50 1bpv s LEU 49 Ca 0.20 -0.44 -0.22 0.00 0.01 0.00 0.00 54.13 53.68 1bpv s LEU 49 Cb -0.06 -1.42 -0.22 0.00 0.01 0.00 0.00 46.19 44.50 1bpv s LEU 49 CO 0.72 0.26 2.41 0.29 1.01 0.00 0.00 176.35 181.04 1bpv n LYS 50 N 2.86 0.27 0.09 1.70 5.02 -1.26 0.47 118.16 127.32 1bpv n LYS 50 Ca -0.17 -0.16 -0.22 0.00 -2.02 0.00 0.00 58.31 55.73 1bpv n LYS 50 Cb 0.52 -2.06 -0.15 0.00 -0.02 0.00 0.00 35.03 33.32 1bpv n LYS 50 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1bpv h ALA 51 N 13.05 -0.11 0.35 7.82 0.00 -1.51 -3.37 119.26 135.49 1bpv h ALA 51 Ca -0.04 -0.80 -0.00 0.00 0.00 0.00 0.00 54.91 54.07 1bpv h ALA 51 Cb 1.18 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 1bpv h ALA 51 CO 1.36 0.56 -0.46 -2.95 0.00 0.00 0.00 179.25 177.76 1bpv h ASN 52 N -0.12 -1.31 -7.05 0.00 -1.07 -1.85 -3.40 115.58 100.79 1bpv h ASN 52 Ca -0.21 0.12 -0.61 0.00 0.07 0.00 0.00 56.30 55.67 1bpv h ASN 52 Cb 1.91 0.45 -0.22 0.00 -2.07 0.00 0.00 38.32 38.39 1bpv h ASN 52 CO 0.21 -0.59 -0.94 0.33 0.07 0.00 0.00 177.43 176.51 1bpv n PHE 53 N -5.52 -1.23 -1.96 4.14 -0.00 -1.26 -4.76 117.46 106.88 1bpv n PHE 53 Ca -0.10 0.60 -0.04 0.00 -0.00 0.00 0.00 57.45 57.91 1bpv n PHE 53 Cb 0.42 -2.67 -0.04 0.00 -0.00 0.00 0.00 39.48 37.19 1bpv n PHE 53 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1bpv n SER 54 N -2.79 -0.63 -2.25 -2.13 3.41 -1.26 -5.12 113.62 102.85 1bpv n SER 54 Ca -0.29 -1.57 0.00 0.00 -0.26 0.00 0.00 58.87 56.75 1bpv n SER 54 Cb 0.67 0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 1bpv n SER 54 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1bpv n ASN 55 N 0.00 -8.77 -3.76 4.04 4.05 -1.26 -4.90 115.26 104.66 1bpv n ASN 55 Ca -0.18 1.68 -0.35 0.00 0.45 0.00 0.00 54.58 56.18 1bpv n ASN 55 Cb 0.61 -4.96 -0.04 0.00 1.23 0.00 0.00 39.78 36.62 1bpv n ASN 55 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 177.26 173.83 1bpv n ILE 56 N 1.90 3.80 0.07 -1.44 5.41 -1.24 -4.91 119.36 122.95 1bpv n ILE 56 Ca 0.00 -5.54 -0.16 0.00 1.00 0.00 0.00 62.75 58.05 1bpv n ILE 56 Cb 0.00 -2.12 -0.09 0.00 -0.71 0.00 0.00 39.64 36.72 1bpv n ILE 56 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1bpv h LEU 57 N 4.93 -1.59-10.27 1.39 3.38 -1.89 0.17 115.31 111.44 1bpv h LEU 57 Ca 0.20 0.18 -0.49 0.00 0.09 0.00 0.00 57.88 57.85 1bpv h LEU 57 Cb 0.65 0.60 0.03 0.00 0.09 0.00 0.00 40.66 42.04 1bpv h LEU 57 CO 1.07 -0.53 0.12 -1.83 0.09 0.00 0.00 178.44 177.36 1bpv s GLU 58 N -5.77 3.59 0.00 1.13 -1.05 -1.26 -4.24 118.70 111.09 1bpv s GLU 58 Ca -0.16 0.27 0.15 0.00 -0.15 0.00 0.00 54.97 55.07 1bpv s GLU 58 Cb 0.07 -2.37 0.69 0.00 -0.44 0.00 0.00 34.13 32.07 1bpv s GLU 58 CO 0.61 -0.18 1.44 0.27 0.95 0.00 0.00 175.26 178.36 1bpv n ASN 59 N -2.07 0.00 -4.40 0.83 6.94 -1.26 -4.45 115.26 110.84 1bpv n ASN 59 Ca 0.01 0.29 -0.44 0.00 -0.02 0.00 0.00 54.58 54.42 1bpv n ASN 59 Cb 0.55 -0.40 -0.07 0.00 -2.36 0.00 0.00 39.78 37.50 1bpv n ASN 59 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 1bpv s GLU 60 N -2.79 3.02 0.14 -3.83 2.12 -1.26 -3.47 118.70 112.63 1bpv s GLU 60 Ca 0.11 -1.22 -0.04 0.00 0.36 0.00 0.00 54.97 54.18 1bpv s GLU 60 Cb 0.10 -4.13 -0.03 0.00 0.26 0.00 0.00 34.13 30.33 1bpv s GLU 60 CO 0.25 -1.10 0.13 0.12 -0.54 0.00 0.00 175.26 174.12 1bpv s PHE 61 N 1.95 0.72 -0.16 5.30 5.36 -0.96 -5.00 117.98 125.19 1bpv s PHE 61 Ca 0.07 -1.08 0.01 0.00 -0.96 0.00 0.00 56.93 54.97 1bpv s PHE 61 Cb -0.23 -0.34 0.02 0.00 -0.34 0.00 0.00 43.02 42.13 1bpv s PHE 61 CO 0.08 -0.59 -0.19 0.99 -1.46 0.00 0.00 175.22 174.05 1bpv s THR 62 N -4.02 1.96 -0.45 0.12 2.01 -1.26 -1.21 115.64 112.78 1bpv s THR 62 Ca 0.22 -0.89 -0.28 0.00 0.31 0.00 0.00 61.69 61.06 1bpv s THR 62 Cb 0.06 -1.77 0.03 0.00 0.01 0.00 0.00 72.50 70.83 1bpv s THR 62 CO 0.01 0.52 1.06 -0.69 -0.69 0.00 0.00 174.62 174.84 1bpv s VAL 63 N 1.20 4.33 0.00 3.82 1.01 0.19 -4.87 120.40 126.08 1bpv s VAL 63 Ca 0.02 1.13 0.00 0.00 0.00 0.00 0.00 61.98 63.12 1bpv s VAL 63 Cb -0.14 -4.53 0.00 0.00 0.00 0.00 0.00 36.38 31.72 1bpv s VAL 63 CO -0.10 -0.89 0.00 -0.24 0.00 0.00 0.00 175.10 173.87 1bpv n SER 64 N 7.52 0.00 -1.77 3.32 2.88 -1.26 -1.07 113.62 123.24 1bpv n SER 64 Ca 0.10 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.44 1bpv n SER 64 Cb 0.49 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.89 1bpv n SER 64 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1bpv n GLY 65 N 5.00 1.08 3.81 0.46 0.00 -1.26 -4.77 105.19 109.52 1bpv n GLY 65 Ca 0.00 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 1bpv n GLY 65 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bpv s LEU 66 N -4.91 2.14 0.00 0.99 1.43 -1.26 -5.07 118.68 112.00 1bpv s LEU 66 Ca 0.00 0.94 0.02 0.00 -1.03 0.00 0.00 54.13 54.06 1bpv s LEU 66 Cb 0.00 -3.31 -0.01 0.00 0.03 0.00 0.00 46.19 42.90 1bpv s LEU 66 CO 0.00 -2.39 -0.08 -0.89 0.23 0.00 0.00 176.35 173.22 1bpv s THR 67 N -3.34 0.62 0.37 5.49 2.01 -1.26 -4.80 115.64 114.72 1bpv s THR 67 Ca 0.63 -0.43 -0.25 0.00 0.31 0.00 0.00 61.69 61.94 1bpv s THR 67 Cb -0.14 -0.54 -0.09 0.00 0.01 0.00 0.00 72.50 71.74 1bpv s THR 67 CO 0.52 0.10 1.06 -1.61 -0.69 0.00 0.00 174.62 174.01 1bpv s GLU 68 N -0.37 4.29 -0.83 4.92 2.02 -1.23 -3.65 118.70 123.86 1bpv s GLU 68 Ca 0.02 1.58 -0.05 0.00 0.02 0.00 0.00 54.97 56.53 1bpv s GLU 68 Cb -0.04 -2.71 0.01 0.00 0.10 0.00 0.00 34.13 31.48 1bpv s GLU 68 CO -0.00 -0.04 0.72 -3.47 0.02 0.00 0.00 175.26 172.49 1bpv n ASP 69 N 0.27 -4.60 -3.47 -0.19 2.03 0.43 -4.96 116.55 106.06 1bpv n ASP 69 Ca 0.03 -0.33 -0.04 0.00 0.52 0.00 0.00 54.79 54.97 1bpv n ASP 69 Cb 0.48 -3.27 -0.06 0.00 -0.72 0.00 0.00 41.12 37.56 1bpv n ASP 69 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bpv s ALA 70 N -3.20 -1.60 0.14 -1.67 0.00 0.11 -5.04 121.76 110.50 1bpv s ALA 70 Ca 0.35 1.64 -0.31 0.00 0.00 0.00 0.00 51.96 53.63 1bpv s ALA 70 Cb -0.15 -1.70 -0.09 0.00 0.00 0.00 0.00 23.12 21.18 1bpv s ALA 70 CO 0.44 -1.05 1.44 0.00 0.00 0.00 0.00 175.76 176.59 1bpv s ALA 71 N 2.72 3.64 -0.15 0.00 0.00 -1.24 -4.17 121.76 122.56 1bpv s ALA 71 Ca 0.06 1.19 0.00 0.00 0.00 0.00 0.00 51.96 53.21 1bpv s ALA 71 Cb -0.14 -3.56 0.02 0.00 0.00 0.00 0.00 23.12 19.45 1bpv s ALA 71 CO -0.17 -0.66 -0.13 0.71 0.00 0.00 0.00 175.76 175.51 1bpv s TYR 72 N 1.04 2.14 -0.11 0.00 2.02 -0.60 -1.26 117.35 120.58 1bpv s TYR 72 Ca 0.66 -1.22 -0.05 0.00 -0.37 0.00 0.00 57.07 56.09 1bpv s TYR 72 Cb -0.39 -1.57 -0.04 0.00 -0.40 0.00 0.00 41.96 39.56 1bpv s TYR 72 CO 0.31 -0.67 0.09 -1.21 -1.57 0.00 0.00 175.55 172.50 1bpv s GLU 73 N 1.50 3.27 -0.08 -0.62 2.02 -0.99 -1.51 118.70 122.28 1bpv s GLU 73 Ca 0.04 -0.24 -0.00 0.00 0.02 0.00 0.00 54.97 54.79 1bpv s GLU 73 Cb -0.13 -3.04 0.02 0.00 0.10 0.00 0.00 34.13 31.09 1bpv s GLU 73 CO -0.10 0.75 -0.04 -0.06 0.02 0.00 0.00 175.26 175.83 1bpv s PHE 74 N -0.97 1.00 0.04 1.61 0.40 -1.01 0.59 117.98 119.64 1bpv s PHE 74 Ca 0.14 -0.39 -0.10 0.00 -0.60 0.00 0.00 56.93 55.98 1bpv s PHE 74 Cb -0.12 -0.94 -0.05 0.00 0.51 0.00 0.00 43.02 42.42 1bpv s PHE 74 CO 0.03 -0.37 0.36 0.50 0.70 0.00 0.00 175.22 176.45 1bpv s ARG 75 N 1.64 3.74 -0.17 0.44 3.52 -0.12 0.67 118.95 128.67 1bpv s ARG 75 Ca 0.01 0.16 0.01 0.00 -0.13 0.00 0.00 55.73 55.78 1bpv s ARG 75 Cb -0.13 -3.06 0.02 0.00 -1.56 0.00 0.00 34.95 30.22 1bpv s ARG 75 CO -0.05 0.61 -0.19 0.54 -0.81 0.00 0.00 175.30 175.41 1bpv s VAL 76 N -1.30 1.94 0.34 7.11 0.11 -0.96 0.15 120.40 127.80 1bpv s VAL 76 Ca 0.29 -0.87 0.08 0.00 -2.93 0.00 0.00 61.98 58.56 1bpv s VAL 76 Cb -0.14 -1.77 -0.04 0.00 -1.53 0.00 0.00 36.38 32.90 1bpv s VAL 76 CO 0.16 0.52 0.18 -0.63 -3.33 0.00 0.00 175.10 172.00 1bpv s ILE 77 N 1.33 3.08 -0.13 7.04 1.01 0.18 -0.06 121.20 133.64 1bpv s ILE 77 Ca 0.05 -1.63 -0.30 0.00 0.00 0.00 0.00 60.65 58.77 1bpv s ILE 77 Cb -0.13 -3.02 0.11 0.00 0.01 0.00 0.00 42.46 39.43 1bpv s ILE 77 CO -0.12 -0.17 0.89 0.00 0.00 0.00 0.00 174.94 175.54 1bpv s ALA 78 N -2.41 -1.88 0.48 9.38 0.00 -1.07 0.16 121.76 126.42 1bpv s ALA 78 Ca 0.39 1.53 0.07 0.00 0.00 0.00 0.00 51.96 53.94 1bpv s ALA 78 Cb -0.03 -0.54 0.08 0.00 0.00 0.00 0.00 23.12 22.63 1bpv s ALA 78 CO 0.23 -0.32 0.65 1.63 0.00 0.00 0.00 175.76 177.95 1bpv n LYS 79 N 0.91 0.61 -4.24 0.00 5.02 -1.26 0.16 118.16 119.37 1bpv n LYS 79 Ca -0.13 -2.42 -0.13 0.00 -2.02 0.00 0.00 58.31 53.61 1bpv n LYS 79 Cb 0.57 -0.23 -0.10 0.00 -0.02 0.00 0.00 35.03 35.25 1bpv n LYS 79 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1bpv s ASN 80 N -3.87 0.89 0.57 4.39 4.22 -1.26 -4.16 114.94 115.73 1bpv s ASN 80 Ca 0.48 -1.26 0.42 0.00 -2.14 0.00 0.00 52.86 50.36 1bpv s ASN 80 Cb -0.04 0.20 1.48 0.00 1.28 0.00 0.00 41.25 44.17 1bpv s ASN 80 CO 0.31 -0.68 1.52 0.00 -2.04 0.00 0.00 177.10 176.21 1bpv h ALA 81 N 2.64 3.51 0.00 3.54 0.00 -1.94 1.36 119.26 128.38 1bpv h ALA 81 Ca -0.37 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 1bpv h ALA 81 Cb 1.22 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 1bpv h ALA 81 CO 0.60 -2.13 -0.93 0.00 0.00 0.00 0.00 179.25 176.80 1bpv h ALA 82 N 0.91 0.55 0.00 0.00 0.00 -1.95 -3.48 119.26 115.28 1bpv h ALA 82 Ca 0.76 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.63 1bpv h ALA 82 Cb 3.35 0.01 0.00 0.00 0.00 0.00 0.00 17.79 21.15 1bpv h ALA 82 CO -0.01 0.04 0.00 0.41 0.00 0.00 0.00 179.25 179.70 1bpv n GLY 83 N 1.18 0.49 3.45 0.00 0.00 0.47 -4.99 105.19 105.79 1bpv n GLY 83 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1bpv n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bpv n ALA 84 N -1.83 2.92 -1.19 4.61 0.00 -1.26 -4.72 120.51 119.05 1bpv n ALA 84 Ca 0.00 -3.42 -0.36 0.00 0.00 0.00 0.00 53.44 49.67 1bpv n ALA 84 Cb 0.00 -3.55 -0.12 0.00 0.00 0.00 0.00 19.45 15.78 1bpv n ALA 84 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1bpv n ILE 85 N 6.86 0.00 -1.79 0.00 0.13 -1.26 -4.34 119.36 118.96 1bpv n ILE 85 Ca 0.48 0.00 -0.42 0.00 -1.10 0.00 0.00 62.75 61.70 1bpv n ILE 85 Cb 0.45 -0.41 -0.03 0.00 -0.84 0.00 0.00 39.64 38.82 1bpv n ILE 85 CO 0.00 0.00 0.00 -0.94 2.80 0.00 0.00 176.55 178.41 1bpv s SER 86 N 6.92 6.32 0.68 9.51 1.04 0.42 -4.91 113.70 133.68 1bpv s SER 86 Ca 1.08 2.31 -0.13 0.00 0.48 0.00 0.00 55.95 59.69 1bpv s SER 86 Cb -1.05 -2.53 -0.11 0.00 0.10 0.00 0.00 66.02 62.42 1bpv s SER 86 CO 0.42 -1.21 -0.50 -2.65 0.98 0.00 0.00 173.24 170.28 1bpv n PRO 87 N 7.68 0.00 -0.51 4.02 -0.02 -1.26 -2.59 135.00 142.31 1bpv n PRO 87 Ca 0.21 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.40 1bpv n PRO 87 Cb 0.43 -0.77 0.24 0.00 -0.02 0.00 0.00 33.50 33.38 1bpv n PRO 87 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1bpv n PRO 88 N 1.74 -2.25 -4.85 0.52 -0.04 -1.26 -4.45 135.00 124.40 1bpv n PRO 88 Ca 0.00 -0.62 -0.28 0.00 -0.04 0.00 0.00 63.50 62.56 1bpv n PRO 88 Cb 0.41 -2.14 -0.17 0.00 -0.04 0.00 0.00 33.50 31.56 1bpv n PRO 88 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1bpv s SER 89 N -2.37 2.40 -0.13 3.54 0.01 0.92 -4.88 113.70 113.19 1bpv s SER 89 Ca 0.67 -0.42 -0.12 0.00 1.31 0.00 0.00 55.95 57.39 1bpv s SER 89 Cb -0.24 -1.10 -0.05 0.00 0.21 0.00 0.00 66.02 64.83 1bpv s SER 89 CO 0.65 0.09 0.42 -0.62 0.41 0.00 0.00 173.24 174.19 1bpv n GLU 90 N 3.72 0.00 -1.21 12.44 1.02 -1.26 -2.26 120.64 133.08 1bpv n GLU 90 Ca -0.21 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.58 1bpv n GLU 90 Cb 0.52 -0.38 0.10 0.00 -0.02 0.00 0.00 31.44 31.66 1bpv n GLU 90 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1bpv n PRO 91 N 1.13 0.29 -3.06 3.49 -0.02 -1.26 -4.12 135.00 131.45 1bpv n PRO 91 Ca 0.09 0.16 -0.35 0.00 -2.02 0.00 0.00 63.50 61.37 1bpv n PRO 91 Cb -0.01 -2.14 -0.06 0.00 -0.02 0.00 0.00 33.50 31.27 1bpv n PRO 91 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1bpv s SER 92 N -1.75 7.00 0.41 2.55 0.15 0.21 -4.77 113.70 117.49 1bpv s SER 92 Ca 0.70 1.44 -0.21 0.00 0.70 0.00 0.00 55.95 58.57 1bpv s SER 92 Cb -0.32 -2.43 -0.15 0.00 -1.71 0.00 0.00 66.02 61.41 1bpv s SER 92 CO 0.54 -0.07 0.10 0.47 1.20 0.00 0.00 173.24 175.48 1bpv n ASP 93 N 0.30 -2.80 -4.67 5.45 8.00 -1.26 -2.42 116.55 119.16 1bpv n ASP 93 Ca 0.00 0.81 -0.43 0.00 0.71 0.00 0.00 54.79 55.89 1bpv n ASP 93 Cb 0.52 -0.89 -0.02 0.00 -0.02 0.00 0.00 41.12 40.70 1bpv n ASP 93 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bpv s ALA 94 N -1.67 3.59 -0.40 2.24 0.00 -1.25 -4.40 121.76 119.86 1bpv s ALA 94 Ca 0.59 0.48 -0.13 0.00 0.00 0.00 0.00 51.96 52.90 1bpv s ALA 94 Cb -0.63 -3.57 0.03 0.00 0.00 0.00 0.00 23.12 18.95 1bpv s ALA 94 CO 0.63 -0.98 0.27 0.42 0.00 0.00 0.00 175.76 176.09 1bpv s ILE 95 N 2.93 4.91 0.41 0.00 1.09 -0.57 -4.55 121.20 125.42 1bpv s ILE 95 Ca 0.53 -0.85 0.20 0.00 -1.10 0.00 0.00 60.65 59.44 1bpv s ILE 95 Cb -0.22 -3.78 0.41 0.00 -1.06 0.00 0.00 42.46 37.81 1bpv s ILE 95 CO 0.16 -0.33 1.76 0.74 -0.10 0.00 0.00 174.94 177.17 1bpv h THR 96 N 5.78 0.47 -5.56 2.92 2.02 -1.89 -1.59 112.91 115.06 1bpv h THR 96 Ca -0.26 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 66.81 1bpv h THR 96 Cb 1.11 0.10 -0.07 0.00 -1.74 0.00 0.00 68.15 67.55 1bpv h THR 96 CO 0.73 0.06 -0.89 0.00 0.37 0.00 0.00 175.52 175.79 1bpv n ARG 98 N 1.98 0.00 -0.05 0.00 3.00 -1.26 0.16 116.66 120.49 1bpv n ARG 98 Ca -0.21 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.63 1bpv n ARG 98 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.81 1bpv n ARG 98 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 1bpv n ASP 99 N -2.14 0.00 -2.69 0.55 5.75 -1.26 -4.73 116.55 112.02 1bpv n ASP 99 Ca 0.00 -1.08 -0.07 0.00 -0.01 0.00 0.00 54.79 53.63 1bpv n ASP 99 Cb 0.00 -0.02 -0.01 0.00 -1.03 0.00 0.00 41.12 40.06 1bpv n ASP 99 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 1bpv n ASP 100 N 0.00 -1.06 -0.73 -1.12 2.03 -1.26 -4.51 116.55 109.90 1bpv n ASP 100 Ca 0.00 0.20 -0.03 0.00 0.52 0.00 0.00 54.79 55.48 1bpv n ASP 100 Cb 0.52 -1.03 -0.03 0.00 -0.72 0.00 0.00 41.12 39.86 1bpv n ASP 100 CO 0.00 0.00 0.00 0.55 -1.92 0.00 0.00 177.20 175.83 1bpv n VAL 101 N -2.58 0.00 0.00 5.18 3.14 -1.26 -4.97 118.33 117.84 1bpv n VAL 101 Ca 0.02 -0.02 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1bpv n VAL 101 Cb 0.46 0.24 0.00 0.00 -1.06 0.00 0.00 33.84 33.48 1bpv n VAL 101 CO 0.00 0.00 0.00 -1.84 -6.46 0.00 0.00 176.83 168.53 1bpv n GLU 102 N 0.01 0.00 -0.25 1.45 0.28 -1.26 -5.23 120.64 115.64 1bpv n GLU 102 Ca -0.12 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.88 1bpv n GLU 102 Cb 0.60 -0.30 0.00 0.00 1.43 0.00 0.00 31.44 33.16 1bpv n GLU 102 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97