#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bvm n LEU 2 N 0.00 0.67 0.15 0.00 0.00 -1.26 -3.99 117.00 112.56 1bvm n LEU 2 Ca 0.00 -0.13 0.12 0.00 0.00 0.00 0.00 56.01 56.00 1bvm n LEU 2 Cb 0.00 -0.12 0.53 0.00 0.00 0.00 0.00 43.42 43.83 1bvm n LEU 2 CO 0.00 0.12 0.86 4.11 0.00 0.00 0.00 177.39 182.48 1bvm h TRP 3 N 0.00 0.00 -0.64 1.96 5.08 -2.02 -2.93 115.95 117.39 1bvm h TRP 3 Ca 0.00 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 59.91 1bvm h TRP 3 Cb 0.61 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.74 1bvm h TRP 3 CO 0.00 0.00 0.17 1.96 -1.28 0.00 0.00 178.44 179.29 1bvm h GLN 4 N 0.00 1.03 -0.29 0.12 4.20 -2.01 -3.00 115.11 115.16 1bvm h GLN 4 Ca 0.00 -0.24 0.07 0.00 0.06 0.00 0.00 58.65 58.53 1bvm h GLN 4 Cb 0.31 -0.14 -0.08 0.00 0.30 0.00 0.00 27.48 27.87 1bvm h GLN 4 CO 0.00 0.92 -0.31 0.35 -0.67 0.00 0.00 178.83 179.12 1bvm h PHE 5 N 0.95 -0.86 -0.87 2.96 3.57 -1.80 0.45 116.94 121.34 1bvm h PHE 5 Ca 0.20 0.05 0.11 0.00 3.53 0.00 0.00 57.97 61.86 1bvm h PHE 5 Cb 0.35 0.42 -0.06 0.00 2.79 0.00 0.00 35.95 39.44 1bvm h PHE 5 CO 0.03 -0.38 0.56 -0.91 -2.23 0.00 0.00 178.31 175.38 1bvm h ASN 6 N -0.30 0.73 -0.85 0.41 4.21 -1.72 -0.51 115.58 117.56 1bvm h ASN 6 Ca 0.14 0.03 0.06 0.00 1.21 0.00 0.00 56.30 57.74 1bvm h ASN 6 Cb 0.53 -0.12 -0.05 0.00 -1.12 0.00 0.00 38.32 37.55 1bvm h ASN 6 CO -0.45 0.42 0.55 1.23 -1.29 0.00 0.00 177.43 177.89 1bvm h GLY 7 N 0.80 1.20 0.84 2.83 0.00 -0.79 -1.38 103.07 106.58 1bvm h GLY 7 Ca 0.41 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 47.36 1bvm h GLY 7 CO -0.18 0.29 -0.00 -0.33 0.00 0.00 0.00 176.54 176.32 1bvm h MET 8 N 0.96 -0.00 -0.69 4.80 2.86 -0.61 -2.61 114.93 119.64 1bvm h MET 8 Ca 0.36 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 58.01 1bvm h MET 8 Cb 0.18 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.81 1bvm h MET 8 CO -0.13 0.16 0.46 0.82 1.06 0.00 0.00 176.91 179.28 1bvm h ILE 9 N -0.16 1.18 -0.98 -1.22 2.04 -1.34 -2.04 117.51 114.99 1bvm h ILE 9 Ca -0.00 -0.33 0.14 0.00 1.00 0.00 0.00 64.86 65.67 1bvm h ILE 9 Cb 0.16 0.16 -0.09 0.00 -0.74 0.00 0.00 36.82 36.32 1bvm h ILE 9 CO 0.00 0.17 0.62 0.11 0.00 0.00 0.00 178.15 179.05 1bvm h LYS 10 N 0.94 0.87 -0.10 2.37 1.57 -1.10 0.55 116.57 121.66 1bvm h LYS 10 Ca 0.25 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1bvm h LYS 10 Cb -0.11 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.00 1bvm h LYS 10 CO -0.05 0.57 0.06 0.00 -0.57 0.00 0.00 179.45 179.46 1bvm h LYS 12 N 0.12 0.14 -2.49 0.00 1.57 -1.08 -3.37 116.57 111.45 1bvm h LYS 12 Ca 0.04 -0.11 -0.59 0.00 -1.87 0.00 0.00 60.65 58.11 1bvm h LYS 12 Cb 0.01 0.02 -0.39 0.00 0.08 0.00 0.00 32.23 31.95 1bvm h LYS 12 CO -0.01 0.75 -0.88 -0.89 -0.57 0.00 0.00 179.45 177.85 1bvm n ILE 13 N -3.81 -0.30 0.27 1.86 5.41 0.18 -4.88 119.36 118.09 1bvm n ILE 13 Ca -0.02 -3.92 0.13 0.00 1.00 0.00 0.00 62.75 59.94 1bvm n ILE 13 Cb 0.65 -1.84 0.31 0.00 -0.71 0.00 0.00 39.64 38.06 1bvm n ILE 13 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 1bvm h PRO 14 N 5.32 0.00 -0.16 0.38 0.13 -1.32 -3.04 132.00 133.31 1bvm h PRO 14 Ca 0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.35 1bvm h PRO 14 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1bvm h PRO 14 CO 0.49 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.13 1bvm n SER 15 N -3.02 1.28 -3.79 1.44 3.41 -1.26 -4.77 113.62 106.92 1bvm n SER 15 Ca 0.03 -1.74 -0.19 0.00 -0.26 0.00 0.00 58.87 56.71 1bvm n SER 15 Cb 0.46 -0.11 -0.17 0.00 -0.26 0.00 0.00 64.21 64.14 1bvm n SER 15 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1bvm s SER 16 N -1.40 0.82 -0.15 4.04 0.01 -1.15 -5.11 113.70 110.76 1bvm s SER 16 Ca 0.27 -0.02 -0.29 0.00 1.31 0.00 0.00 55.95 57.21 1bvm s SER 16 Cb 0.14 -0.26 -0.02 0.00 0.21 0.00 0.00 66.02 66.08 1bvm s SER 16 CO 0.21 -0.14 1.40 -1.61 0.41 0.00 0.00 173.24 173.51 1bvm s GLU 17 N 1.42 4.15 0.11 12.44 8.01 -1.26 -4.90 118.70 138.67 1bvm s GLU 17 Ca -0.04 1.77 -0.11 0.00 0.01 0.00 0.00 54.97 56.59 1bvm s GLU 17 Cb -0.13 -3.86 -0.13 0.00 -4.31 0.00 0.00 34.13 25.70 1bvm s GLU 17 CO -0.03 -0.84 1.32 -1.00 0.01 0.00 0.00 175.26 174.72 1bvm h PRO 18 N 8.90 0.75 0.00 0.39 0.13 -1.88 -2.28 132.00 138.01 1bvm h PRO 18 Ca -0.30 -0.62 0.00 0.00 -0.87 0.00 0.00 66.00 64.21 1bvm h PRO 18 Cb 1.13 0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1bvm h PRO 18 CO 0.97 1.23 0.00 1.28 -0.23 0.00 0.00 178.00 181.25 1bvm n LEU 19 N -3.92 0.00 -0.88 1.56 4.77 -1.26 -2.43 117.00 114.84 1bvm n LEU 19 Ca -0.07 0.23 0.04 0.00 -0.03 0.00 0.00 56.01 56.18 1bvm n LEU 19 Cb 0.75 -0.23 0.06 0.00 -2.33 0.00 0.00 43.42 41.67 1bvm n LEU 19 CO 0.53 -0.10 0.23 0.18 -1.33 0.00 0.00 177.39 176.89 1bvm n LEU 20 N -1.23 1.19 0.00 2.23 4.77 -1.13 -4.83 117.00 118.00 1bvm n LEU 20 Ca 0.09 -2.20 0.00 0.00 -0.03 0.00 0.00 56.01 53.87 1bvm n LEU 20 Cb 0.12 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1bvm n LEU 20 CO 0.12 0.62 0.00 -0.67 -1.33 0.00 0.00 177.39 176.13 1bvm n ASP 21 N -0.17 0.00 0.00 -1.43 -0.08 -0.87 -4.91 116.55 109.08 1bvm n ASP 21 Ca 0.08 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.36 1bvm n ASP 21 Cb 0.88 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.34 1bvm n ASP 21 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1bvm n PHE 22 N 0.00 -0.08 -1.97 -0.67 3.72 -1.04 -4.76 117.46 112.65 1bvm n PHE 22 Ca 0.00 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.12 1bvm n PHE 22 Cb 0.00 0.02 0.09 0.00 -0.94 0.00 0.00 39.48 38.64 1bvm n PHE 22 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1bvm s ASN 23 N -1.18 4.55 -0.97 4.37 3.84 -1.02 -4.34 114.94 120.19 1bvm s ASN 23 Ca 0.00 0.69 -0.13 0.00 0.21 0.00 0.00 52.86 53.63 1bvm s ASN 23 Cb 0.00 -1.21 0.01 0.00 -0.55 0.00 0.00 41.25 39.50 1bvm s ASN 23 CO 0.00 -1.85 0.66 -3.20 -2.79 0.00 0.00 177.10 169.91 1bvm n ASN 24 N -3.23 -4.91 -3.86 -4.21 2.85 -1.22 -4.92 115.26 95.76 1bvm n ASN 24 Ca 0.08 -1.01 -0.09 0.00 -0.11 0.00 0.00 54.58 53.45 1bvm n ASN 24 Cb 0.61 -2.12 -0.07 0.00 1.24 0.00 0.00 39.78 39.44 1bvm n ASN 24 CO 0.00 0.00 0.00 -0.47 -2.11 0.00 0.00 177.26 174.68 1bvm s TYR 25 N -3.20 0.17 0.00 1.20 6.14 -0.40 -3.96 117.35 117.30 1bvm s TYR 25 Ca 0.20 -0.56 0.00 0.00 0.64 0.00 0.00 57.07 57.35 1bvm s TYR 25 Cb -0.10 0.00 0.00 0.00 0.42 0.00 0.00 41.96 42.28 1bvm s TYR 25 CO 0.91 -0.64 0.00 0.41 0.64 0.00 0.00 175.55 176.87 1bvm n GLY 26 N -0.15 0.26 0.08 8.97 0.00 -1.25 -3.11 105.19 109.99 1bvm n GLY 26 Ca -0.12 -0.62 -0.02 0.00 0.00 0.00 0.00 46.02 45.26 1bvm n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bvm n TYR 28 N -2.80 0.36 -1.43 0.00 4.01 -1.26 -3.06 117.16 112.97 1bvm n TYR 28 Ca -0.14 0.15 -0.47 0.00 -0.16 0.00 0.00 57.90 57.28 1bvm n TYR 28 Cb 0.89 -0.88 -0.10 0.00 -0.31 0.00 0.00 39.34 38.94 1bvm n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1bvm n GLY 30 N 6.66 3.55 2.88 0.00 0.00 -1.26 -1.27 105.19 115.75 1bvm n GLY 30 Ca 0.51 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 1bvm n GLY 30 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1bvm n LEU 31 N 0.00 6.57 0.00 0.99 7.94 -1.26 -4.83 117.00 126.40 1bvm n LEU 31 Ca 0.00 -4.31 0.00 0.00 -1.11 0.00 0.00 56.01 50.59 1bvm n LEU 31 Cb 0.00 -1.60 0.00 0.00 0.53 0.00 0.00 43.42 42.35 1bvm n LEU 31 CO 0.00 1.11 0.00 0.61 -1.11 0.00 0.00 177.39 178.00 1bvm n GLY 32 N 3.75 0.52 0.00 -3.96 0.00 -1.26 -5.17 105.19 99.06 1bvm n GLY 32 Ca 0.47 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.85 1bvm n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bvm n GLY 33 N -1.55 0.50 3.65 -0.02 0.00 -1.26 -4.55 105.19 101.96 1bvm n GLY 33 Ca 0.00 -1.80 -0.02 0.00 0.00 0.00 0.00 46.02 44.20 1bvm n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bvm s SER 34 N -1.42 -0.01 0.00 1.61 1.04 -1.17 -4.80 113.70 108.95 1bvm s SER 34 Ca 0.00 0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.45 1bvm s SER 34 Cb 0.00 0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.14 1bvm s SER 34 CO 0.00 -0.00 0.00 0.61 0.98 0.00 0.00 173.24 174.83 1bvm n GLY 35 N 1.46 3.20 3.35 7.32 0.00 -1.26 -4.87 105.19 114.39 1bvm n GLY 35 Ca -0.09 -1.74 -0.40 0.00 0.00 0.00 0.00 46.02 43.78 1bvm n GLY 35 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1bvm n THR 36 N -1.96 1.04 -1.32 2.61 -1.04 -1.25 -4.85 114.28 107.50 1bvm n THR 36 Ca 0.00 -0.50 -0.30 0.00 -2.04 0.00 0.00 64.05 61.21 1bvm n THR 36 Cb 0.00 -0.27 0.11 0.00 -1.82 0.00 0.00 70.33 68.34 1bvm n THR 36 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1bvm s PRO 37 N -1.38 1.89 -0.10 -2.82 0.04 -1.26 -4.78 135.00 126.60 1bvm s PRO 37 Ca 0.62 0.92 0.11 0.00 0.04 0.00 0.00 61.00 62.68 1bvm s PRO 37 Cb -0.54 -1.87 -0.15 0.00 0.04 0.00 0.00 34.50 31.98 1bvm s PRO 37 CO 0.61 -1.83 0.07 1.33 0.04 0.00 0.00 177.00 177.22 1bvm n VAL 38 N -3.61 0.71 -3.59 -0.36 0.24 -1.26 -4.99 118.33 105.46 1bvm n VAL 38 Ca 0.08 -0.47 -0.11 0.00 -2.04 0.00 0.00 64.34 61.80 1bvm n VAL 38 Cb 0.54 -0.59 -0.03 0.00 -1.47 0.00 0.00 33.84 32.29 1bvm n VAL 38 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1bvm s ASP 39 N -4.32 -0.36 0.35 -1.34 1.01 -1.26 -4.99 116.67 105.76 1bvm s ASP 39 Ca -0.06 -0.26 0.15 0.00 0.71 0.00 0.00 52.55 53.10 1bvm s ASP 39 Cb 0.04 0.55 1.13 0.00 1.01 0.00 0.00 42.92 45.65 1bvm s ASP 39 CO 0.48 -0.96 1.64 0.44 0.21 0.00 0.00 175.17 176.98 1bvm h ASP 40 N 2.18 0.43 0.05 0.27 3.32 -1.97 0.33 116.42 121.04 1bvm h ASP 40 Ca -0.32 0.21 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 1bvm h ASP 40 Cb 1.28 0.18 0.00 0.00 0.22 0.00 0.00 39.33 41.01 1bvm h ASP 40 CO 0.41 -0.21 -0.03 0.25 -1.72 0.00 0.00 179.24 177.94 1bvm h LEU 41 N 0.24 -0.06 -1.02 1.55 5.85 -1.91 -2.45 115.31 117.50 1bvm h LEU 41 Ca 0.75 -0.07 0.04 0.00 0.84 0.00 0.00 57.88 59.44 1bvm h LEU 41 Cb 1.78 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 42.76 1bvm h LEU 41 CO -0.65 0.03 0.65 -0.78 -0.34 0.00 0.00 178.44 177.35 1bvm h ASP 42 N -0.14 1.09 -0.88 1.25 3.58 -0.82 -0.27 116.42 120.22 1bvm h ASP 42 Ca -0.01 -0.01 0.20 0.00 0.42 0.00 0.00 57.03 57.63 1bvm h ASP 42 Cb 0.12 -0.25 -0.06 0.00 1.72 0.00 0.00 39.33 40.86 1bvm h ASP 42 CO 0.01 0.74 0.59 0.03 -2.88 0.00 0.00 179.24 177.73 1bvm h ARG 43 N 1.26 0.39 -0.16 0.28 2.47 -0.60 0.01 114.38 118.04 1bvm h ARG 43 Ca 0.40 -0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 59.07 1bvm h ARG 43 Cb 0.00 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.23 1bvm h ARG 43 CO -0.12 0.26 -0.01 0.00 0.56 0.00 0.00 179.97 180.66 1bvm h GLN 46 N 1.32 0.31 -0.21 0.00 4.15 -1.11 0.12 115.11 119.68 1bvm h GLN 46 Ca 0.38 -0.02 0.06 0.00 0.77 0.00 0.00 58.65 59.84 1bvm h GLN 46 Cb -0.10 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.51 1bvm h GLN 46 CO -0.10 0.20 0.15 1.15 -1.93 0.00 0.00 178.83 178.31 1bvm h THR 47 N 0.32 0.90 -0.05 2.39 2.02 -0.91 -1.58 112.91 116.00 1bvm h THR 47 Ca 0.18 -0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.36 1bvm h THR 47 Cb 0.15 0.89 -0.00 0.00 -1.74 0.00 0.00 68.15 67.45 1bvm h THR 47 CO -0.18 0.00 0.02 -0.74 0.37 0.00 0.00 175.52 175.00 1bvm h HIS 48 N 0.01 0.07 -0.65 3.16 -0.00 -0.10 0.71 115.15 118.35 1bvm h HIS 48 Ca 0.10 -0.00 0.01 0.00 -0.00 0.00 0.00 60.37 60.47 1bvm h HIS 48 Cb 0.39 -0.02 -0.03 0.00 -0.00 0.00 0.00 27.41 27.74 1bvm h HIS 48 CO -0.00 0.19 0.43 -0.44 -0.00 0.00 0.00 177.93 178.10 1bvm h ASP 49 N -0.06 0.75 0.24 3.26 3.32 -0.93 -0.25 116.42 122.75 1bvm h ASP 49 Ca 0.02 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 1bvm h ASP 49 Cb 0.14 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 1bvm h ASP 49 CO -0.00 0.55 -0.10 0.78 -1.72 0.00 0.00 179.24 178.74 1bvm h ASN 50 N 0.88 0.00 0.04 6.45 2.35 -1.05 -2.48 115.58 121.78 1bvm h ASN 50 Ca 0.24 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.77 1bvm h ASN 50 Cb -0.10 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.29 1bvm h ASN 50 CO -0.05 0.10 -0.88 0.00 -1.65 0.00 0.00 177.43 174.95 1bvm h TYR 52 N 0.07 0.00 0.11 0.00 -1.99 -0.81 -1.66 116.97 112.70 1bvm h TYR 52 Ca -0.12 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.60 1bvm h TYR 52 Cb 1.58 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.31 1bvm h TYR 52 CO 0.14 0.06 -0.05 0.87 -0.00 0.00 0.00 178.16 179.18 1bvm h LYS 53 N 0.00 -0.14 -0.96 4.88 1.79 -1.45 -2.84 116.57 117.85 1bvm h LYS 53 Ca -0.00 0.01 0.21 0.00 -2.18 0.00 0.00 60.65 58.69 1bvm h LYS 53 Cb 0.18 0.03 -0.08 0.00 -1.58 0.00 0.00 32.23 30.78 1bvm h LYS 53 CO 0.01 0.36 0.62 1.96 -1.08 0.00 0.00 179.45 181.32 1bvm h GLN 54 N -0.84 0.49 -0.47 3.15 1.08 -1.28 0.55 115.11 117.78 1bvm h GLN 54 Ca -0.01 -0.03 -0.04 0.00 -1.45 0.00 0.00 58.65 57.12 1bvm h GLN 54 Cb 0.56 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.86 1bvm h GLN 54 CO 0.02 0.32 0.13 0.00 -0.95 0.00 0.00 178.83 178.36 1bvm h ALA 55 N 1.62 1.35 0.32 3.87 0.00 -1.24 -0.49 119.26 124.68 1bvm h ALA 55 Ca 0.53 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 1bvm h ALA 55 Cb 1.18 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1bvm h ALA 55 CO -0.26 0.47 -0.15 0.87 0.00 0.00 0.00 179.25 180.18 1bvm h LYS 56 N 0.69 -0.41 -0.51 0.00 1.57 0.32 -3.05 116.57 115.18 1bvm h LYS 56 Ca 0.16 0.03 0.11 0.00 -1.87 0.00 0.00 60.65 59.08 1bvm h LYS 56 Cb 0.23 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 1bvm h LYS 56 CO -0.01 -0.08 0.35 0.87 -0.57 0.00 0.00 179.45 180.02 1bvm h LYS 57 N -0.87 0.20 -6.04 3.15 6.56 -1.25 -3.05 116.57 115.28 1bvm h LYS 57 Ca -0.04 -0.01 -0.82 0.00 -1.06 0.00 0.00 60.65 58.71 1bvm h LYS 57 Cb 0.52 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 32.14 1bvm h LYS 57 CO 0.07 0.14 0.84 -0.11 -2.06 0.00 0.00 179.45 178.33 1bvm n LEU 58 N -4.45 1.51 -0.31 2.94 7.94 -0.20 -4.60 117.00 119.84 1bvm n LEU 58 Ca 0.08 1.08 -0.04 0.00 -1.11 0.00 0.00 56.01 56.02 1bvm n LEU 58 Cb 0.43 -0.97 0.01 0.00 0.53 0.00 0.00 43.42 43.43 1bvm n LEU 58 CO 0.35 -0.71 0.59 0.44 -1.11 0.00 0.00 177.39 176.95 1bvm h ASP 59 N 6.30 -1.40 -0.18 1.96 5.19 -1.88 0.50 116.42 126.92 1bvm h ASP 59 Ca -0.40 0.28 0.05 0.00 -0.62 0.00 0.00 57.03 56.33 1bvm h ASP 59 Cb 1.36 0.70 -0.07 0.00 0.18 0.00 0.00 39.33 41.50 1bvm h ASP 59 CO 0.99 -0.30 -0.41 0.28 -3.12 0.00 0.00 179.24 176.68 1bvm h SER 60 N -0.08 -1.29 -0.60 6.45 0.02 -1.92 -1.36 113.55 114.76 1bvm h SER 60 Ca 0.28 0.18 -0.05 0.00 -0.84 0.00 0.00 61.79 61.36 1bvm h SER 60 Cb 0.57 0.54 -0.03 0.00 0.14 0.00 0.00 62.40 63.62 1bvm h SER 60 CO -0.85 -0.41 0.20 0.00 -1.14 0.00 0.00 176.83 174.63 1bvm n LYS 62 N -4.28 0.10 -2.50 0.00 4.81 0.16 -2.64 118.16 113.81 1bvm n LYS 62 Ca 0.05 0.49 -0.16 0.00 -0.87 0.00 0.00 58.31 57.82 1bvm n LYS 62 Cb 0.21 -1.76 0.02 0.00 0.02 0.00 0.00 35.03 33.52 1bvm n LYS 62 CO 0.00 0.00 0.00 1.55 1.17 0.00 0.00 177.40 180.12 1bvm n VAL 63 N -1.96 1.80 0.00 3.15 3.14 -0.62 -4.82 118.33 119.03 1bvm n VAL 63 Ca 0.01 -3.83 0.00 0.00 -2.96 0.00 0.00 64.34 57.56 1bvm n VAL 63 Cb 0.10 -0.16 0.00 0.00 -1.06 0.00 0.00 33.84 32.72 1bvm n VAL 63 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1bvm n LEU 64 N -0.45 0.00 -0.45 6.55 4.77 -1.08 -4.97 117.00 121.36 1bvm n LEU 64 Ca 0.25 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 1bvm n LEU 64 Cb 0.81 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 1bvm n LEU 64 CO 0.27 -0.18 0.25 0.52 -1.33 0.00 0.00 177.39 176.92 1bvm n VAL 65 N -1.54 0.00 -3.92 4.08 0.31 -1.26 -5.03 118.33 110.97 1bvm n VAL 65 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 64.05 1bvm n VAL 65 Cb 0.00 0.45 0.01 0.00 -0.91 0.00 0.00 33.84 33.39 1bvm n VAL 65 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1bvm n ASP 66 N 0.00 -2.20 -2.68 4.52 -0.08 -1.26 -4.80 116.55 110.05 1bvm n ASP 66 Ca 0.00 -0.78 -0.05 0.00 -1.51 0.00 0.00 54.79 52.45 1bvm n ASP 66 Cb 0.65 -0.93 0.10 0.00 2.34 0.00 0.00 41.12 43.28 1bvm n ASP 66 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1bvm n ASN 67 N -0.92 -1.53 -2.71 1.67 2.85 -1.26 -5.02 115.26 108.33 1bvm n ASN 67 Ca -0.07 -2.30 -0.18 0.00 -0.11 0.00 0.00 54.58 51.92 1bvm n ASN 67 Cb 0.34 1.30 -0.07 0.00 1.24 0.00 0.00 39.78 42.59 1bvm n ASN 67 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1bvm n PRO 68 N 0.60 2.03 -0.42 1.20 -0.04 -1.26 -3.80 135.00 133.30 1bvm n PRO 68 Ca -0.02 -1.22 0.01 0.00 -0.04 0.00 0.00 63.50 62.23 1bvm n PRO 68 Cb 0.74 -2.22 0.01 0.00 -0.04 0.00 0.00 33.50 31.98 1bvm n PRO 68 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 1bvm n TYR 69 N 3.37 0.00 0.00 0.54 4.19 -1.26 -4.91 117.16 119.09 1bvm n TYR 69 Ca 0.43 -0.09 0.00 0.00 3.31 0.00 0.00 57.90 61.55 1bvm n TYR 69 Cb 0.39 -0.05 0.00 0.00 0.49 0.00 0.00 39.34 40.16 1bvm n TYR 69 CO 0.00 0.00 0.00 -2.37 0.91 0.00 0.00 176.86 175.40 1bvm n THR 70 N -0.13 0.00 0.78 2.97 5.66 -1.25 -4.64 114.28 117.68 1bvm n THR 70 Ca 0.01 0.00 0.11 0.00 -3.05 0.00 0.00 64.05 61.13 1bvm n THR 70 Cb 0.68 0.00 0.06 0.00 -1.55 0.00 0.00 70.33 69.51 1bvm n THR 70 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1bvm n ASN 71 N 0.00 0.66 -2.58 1.09 5.15 -1.26 -4.45 115.26 113.87 1bvm n ASN 71 Ca 0.00 -0.38 -0.04 0.00 -0.60 0.00 0.00 54.58 53.55 1bvm n ASN 71 Cb 0.00 0.68 -0.03 0.00 -0.53 0.00 0.00 39.78 39.90 1bvm n ASN 71 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1bvm n ASN 72 N -1.73 -2.88 -4.83 1.20 4.05 -1.26 -5.01 115.26 104.80 1bvm n ASN 72 Ca 0.03 1.43 -0.22 0.00 0.45 0.00 0.00 54.58 56.27 1bvm n ASN 72 Cb 0.39 -4.87 -0.04 0.00 1.23 0.00 0.00 39.78 36.48 1bvm n ASN 72 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 177.26 173.49 1bvm s TYR 73 N -0.58 3.13 -0.08 1.20 -0.85 -1.26 -5.10 117.35 113.82 1bvm s TYR 73 Ca -0.20 -0.10 -0.15 0.00 -0.52 0.00 0.00 57.07 56.11 1bvm s TYR 73 Cb 0.01 -1.42 -0.05 0.00 0.38 0.00 0.00 41.96 40.88 1bvm s TYR 73 CO 0.54 0.52 0.38 -1.12 -1.52 0.00 0.00 175.55 174.35 1bvm s SER 74 N -3.76 6.66 0.09 -0.18 0.01 -1.26 -5.07 113.70 110.19 1bvm s SER 74 Ca 0.33 0.79 -0.13 0.00 1.31 0.00 0.00 55.95 58.24 1bvm s SER 74 Cb -0.08 -2.23 0.02 0.00 0.21 0.00 0.00 66.02 63.94 1bvm s SER 74 CO 0.25 0.20 0.31 -0.72 0.41 0.00 0.00 173.24 173.69 1bvm s TYR 75 N -0.28 -0.08 0.33 2.43 1.13 -1.26 -2.08 117.35 117.55 1bvm s TYR 75 Ca 0.22 -0.20 0.06 0.00 -1.41 0.00 0.00 57.07 55.74 1bvm s TYR 75 Cb -0.15 0.12 -0.06 0.00 -1.10 0.00 0.00 41.96 40.76 1bvm s TYR 75 CO 0.10 -0.59 -0.02 0.45 -2.51 0.00 0.00 175.55 172.98 1bvm s SER 76 N -2.55 3.06 0.27 -0.18 0.15 0.74 -4.89 113.70 110.30 1bvm s SER 76 Ca 0.01 -1.28 0.06 0.00 0.70 0.00 0.00 55.95 55.44 1bvm s SER 76 Cb 0.02 -0.23 -0.06 0.00 -1.71 0.00 0.00 66.02 64.05 1bvm s SER 76 CO -0.09 -0.41 -0.05 0.00 1.20 0.00 0.00 173.24 173.89 1bvm n SER 78 N -0.56 0.00 -4.09 0.00 3.41 -0.81 -4.89 113.62 106.68 1bvm n SER 78 Ca -0.05 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.22 1bvm n SER 78 Cb 0.63 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.54 1bvm n SER 78 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1bvm n ASN 79 N 0.00 -0.92 -4.08 4.04 3.02 -1.26 0.19 115.26 116.26 1bvm n ASN 79 Ca 0.00 -1.15 -0.34 0.00 -0.03 0.00 0.00 54.58 53.06 1bvm n ASN 79 Cb 0.00 -1.41 -0.04 0.00 -0.61 0.00 0.00 39.78 37.73 1bvm n ASN 79 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1bvm n ASN 80 N -2.23 -2.84 -4.25 6.41 5.03 -1.26 -4.91 115.26 111.22 1bvm n ASN 80 Ca -0.22 -0.89 -0.14 0.00 0.87 0.00 0.00 54.58 54.21 1bvm n ASN 80 Cb 0.57 -2.37 -0.10 0.00 -1.02 0.00 0.00 39.78 36.86 1bvm n ASN 80 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1bvm s GLU 81 N -6.76 1.05 -0.10 3.52 2.02 0.50 -4.52 118.70 114.41 1bvm s GLU 81 Ca 0.68 -1.43 0.01 0.00 0.02 0.00 0.00 54.97 54.25 1bvm s GLU 81 Cb -0.38 -0.63 -0.02 0.00 0.10 0.00 0.00 34.13 33.21 1bvm s GLU 81 CO 0.83 0.08 -0.14 0.42 0.02 0.00 0.00 175.26 176.47 1bvm s ILE 82 N -3.23 3.00 -0.12 -1.63 1.01 -1.26 -1.93 121.20 117.04 1bvm s ILE 82 Ca 0.16 -0.70 -0.02 0.00 0.00 0.00 0.00 60.65 60.08 1bvm s ILE 82 Cb 0.02 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.24 1bvm s ILE 82 CO 0.01 0.55 -0.04 -0.89 0.00 0.00 0.00 174.94 174.56 1bvm s THR 83 N -0.02 3.86 -0.16 2.92 2.01 0.56 -4.90 115.64 119.92 1bvm s THR 83 Ca -0.04 -0.39 0.00 0.00 0.31 0.00 0.00 61.69 61.58 1bvm s THR 83 Cb -0.14 -2.65 -0.00 0.00 0.01 0.00 0.00 72.50 69.71 1bvm s THR 83 CO 0.04 0.54 -0.15 0.00 -0.69 0.00 0.00 174.62 174.36 1bvm n SER 85 N 4.04 1.16 -0.04 0.00 7.64 -0.88 -4.79 113.62 120.75 1bvm n SER 85 Ca -0.19 1.16 0.02 0.00 1.01 0.00 0.00 58.87 60.87 1bvm n SER 85 Cb 0.52 -0.96 0.34 0.00 -1.01 0.00 0.00 64.21 63.10 1bvm n SER 85 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1bvm h SER 86 N 4.88 0.55 -0.16 6.43 4.64 -1.97 -1.00 113.55 126.93 1bvm h SER 86 Ca -0.46 -0.05 0.05 0.00 -0.47 0.00 0.00 61.79 60.86 1bvm h SER 86 Cb 1.37 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 63.32 1bvm h SER 86 CO 0.89 0.48 0.37 -0.33 -0.87 0.00 0.00 176.83 177.36 1bvm h GLU 87 N 0.62 0.00 -6.14 4.77 5.08 -2.00 -3.42 114.58 113.49 1bvm h GLU 87 Ca 0.16 0.00 -0.75 0.00 -1.00 0.00 0.00 59.36 57.77 1bvm h GLU 87 Cb 0.08 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.35 1bvm h GLU 87 CO -0.02 0.00 0.75 0.09 -1.00 0.00 0.00 179.01 178.83 1bvm n ASN 88 N -3.24 1.98 -2.32 1.42 4.13 -0.38 -4.93 115.26 111.91 1bvm n ASN 88 Ca 0.02 1.10 -0.00 0.00 1.68 0.00 0.00 54.58 57.38 1bvm n ASN 88 Cb 0.46 -1.11 0.00 0.00 -1.54 0.00 0.00 39.78 37.60 1bvm n ASN 88 CO 0.00 0.00 0.00 -0.46 0.28 0.00 0.00 177.26 177.08 1bvm n ASN 89 N 4.46 -0.64 -0.15 6.41 0.23 -1.26 -4.07 115.26 120.25 1bvm n ASN 89 Ca 0.25 -0.68 -0.03 0.00 -0.53 0.00 0.00 54.58 53.59 1bvm n ASN 89 Cb 0.11 -0.00 0.04 0.00 -2.08 0.00 0.00 39.78 37.85 1bvm n ASN 89 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1bvm h ALA 90 N -2.00 0.39 0.74 -2.53 0.00 -1.97 1.32 119.26 115.20 1bvm h ALA 90 Ca -0.00 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1bvm h ALA 90 Cb 0.00 0.30 0.01 0.00 0.00 0.00 0.00 17.79 18.10 1bvm h ALA 90 CO 0.00 -0.42 -0.35 0.00 0.00 0.00 0.00 179.25 178.48 1bvm h GLU 92 N -1.26 0.50 -0.07 0.00 4.57 -1.82 0.39 114.58 116.89 1bvm h GLU 92 Ca -0.10 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 57.97 1bvm h GLU 92 Cb 0.76 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.25 1bvm h GLU 92 CO 0.17 0.33 -0.27 0.00 -1.18 0.00 0.00 179.01 178.06 1bvm h ALA 93 N 1.70 0.12 -0.33 2.92 0.00 0.18 -2.15 119.26 121.70 1bvm h ALA 93 Ca 0.24 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 1bvm h ALA 93 Cb 0.30 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1bvm h ALA 93 CO -0.07 0.14 -0.09 0.35 0.00 0.00 0.00 179.25 179.58 1bvm h PHE 94 N -0.20 0.72 -0.32 0.00 3.04 0.50 -2.63 116.94 118.05 1bvm h PHE 94 Ca -0.01 -0.16 -0.01 0.00 3.98 0.00 0.00 57.97 61.77 1bvm h PHE 94 Cb 0.91 -0.18 -0.02 0.00 2.56 0.00 0.00 35.95 39.23 1bvm h PHE 94 CO 0.13 0.82 0.16 0.82 -2.02 0.00 0.00 178.31 178.22 1bvm h ILE 95 N 0.42 1.11 0.00 1.41 2.04 -0.30 -0.34 117.51 121.85 1bvm h ILE 95 Ca 0.08 -0.29 -0.06 0.00 1.00 0.00 0.00 64.86 65.59 1bvm h ILE 95 Cb 0.59 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 1bvm h ILE 95 CO 0.03 0.12 -0.27 0.00 0.00 0.00 0.00 178.15 178.04 1bvm h ASN 97 N 0.00 0.11 -0.22 0.00 2.35 -0.73 -2.45 115.58 114.63 1bvm h ASN 97 Ca -0.00 -0.12 -0.03 0.00 -0.55 0.00 0.00 56.30 55.60 1bvm h ASN 97 Cb 0.73 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.05 1bvm h ASN 97 CO 0.04 1.10 0.02 0.00 -1.65 0.00 0.00 177.43 176.93 1bvm h ASP 99 N 0.16 0.85 -0.16 0.00 5.19 -1.63 -2.90 116.42 117.92 1bvm h ASP 99 Ca 0.06 -0.49 -0.10 0.00 -0.62 0.00 0.00 57.03 55.88 1bvm h ASP 99 Cb 0.36 -0.25 -0.00 0.00 0.18 0.00 0.00 39.33 39.62 1bvm h ASP 99 CO 0.01 1.27 -0.28 -0.09 -3.12 0.00 0.00 179.24 177.03 1bvm h ARG 100 N 0.55 0.48 -0.37 3.56 2.43 -1.36 -2.42 114.38 117.24 1bvm h ARG 100 Ca -0.01 -0.29 0.07 0.00 -0.81 0.00 0.00 59.98 58.93 1bvm h ARG 100 Cb 1.23 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.80 1bvm h ARG 100 CO 0.13 0.89 0.26 -0.91 -1.51 0.00 0.00 179.97 178.83 1bvm h ASN 101 N 0.11 0.18 0.10 -3.80 2.35 0.20 0.12 115.58 114.83 1bvm h ASN 101 Ca 0.01 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.51 1bvm h ASN 101 Cb 0.86 -0.04 0.03 0.00 0.05 0.00 0.00 38.32 39.22 1bvm h ASN 101 CO 0.06 0.11 -1.06 0.00 -1.65 0.00 0.00 177.43 174.90 1bvm h ALA 102 N 1.81 -0.01 -0.27 -0.83 0.00 -1.40 -2.95 119.26 115.61 1bvm h ALA 102 Ca 0.17 -0.72 -0.06 0.00 0.00 0.00 0.00 54.91 54.29 1bvm h ALA 102 Cb 0.41 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1bvm h ALA 102 CO -0.03 0.57 -0.08 0.00 0.00 0.00 0.00 179.25 179.72 1bvm h ALA 103 N 0.26 0.37 -0.97 0.00 0.00 -0.87 -2.64 119.26 115.40 1bvm h ALA 103 Ca -0.16 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.49 1bvm h ALA 103 Cb 1.76 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 19.40 1bvm h ALA 103 CO 0.20 0.19 0.64 0.82 0.00 0.00 0.00 179.25 181.11 1bvm h ILE 104 N 0.27 1.22 -0.62 0.00 2.04 -1.10 -2.19 117.51 117.13 1bvm h ILE 104 Ca 0.07 -0.44 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 1bvm h ILE 104 Cb 0.56 -0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.43 1bvm h ILE 104 CO 0.03 0.24 0.25 0.00 0.00 0.00 0.00 178.15 178.67 1bvm h PHE 106 N 0.87 0.96 0.00 0.00 0.04 -1.03 0.68 116.94 118.45 1bvm h PHE 106 Ca 0.21 0.03 0.00 0.00 2.80 0.00 0.00 57.97 61.01 1bvm h PHE 106 Cb 0.20 -0.29 0.00 0.00 2.20 0.00 0.00 35.95 38.05 1bvm h PHE 106 CO 0.01 0.26 -0.09 -1.13 -0.60 0.00 0.00 178.31 176.76 1bvm n SER 107 N -4.67 0.11 -1.04 2.17 3.41 -0.87 -3.24 113.62 109.49 1bvm n SER 107 Ca 0.21 0.36 0.12 0.00 -0.26 0.00 0.00 58.87 59.31 1bvm n SER 107 Cb 0.56 -0.37 0.21 0.00 -0.26 0.00 0.00 64.21 64.35 1bvm n SER 107 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1bvm n LYS 108 N -1.52 2.39 -4.11 4.33 5.02 0.23 -4.96 118.16 119.54 1bvm n LYS 108 Ca 0.07 -2.07 -0.09 0.00 -2.02 0.00 0.00 58.31 54.20 1bvm n LYS 108 Cb 0.34 -1.49 -0.10 0.00 -0.02 0.00 0.00 35.03 33.76 1bvm n LYS 108 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1bvm s VAL 109 N -1.66 0.14 0.89 -0.18 -7.23 -0.78 -5.05 120.40 106.53 1bvm s VAL 109 Ca 0.36 -1.82 -0.12 0.00 -1.81 0.00 0.00 61.98 58.59 1bvm s VAL 109 Cb 0.22 -1.82 0.13 0.00 0.56 0.00 0.00 36.38 35.47 1bvm s VAL 109 CO 0.31 -0.66 1.13 -2.16 -0.31 0.00 0.00 175.10 173.41 1bvm s PRO 110 N -3.99 1.29 -0.06 4.82 0.04 -1.26 -4.90 135.00 130.94 1bvm s PRO 110 Ca 0.17 0.36 0.05 0.00 0.04 0.00 0.00 61.00 61.62 1bvm s PRO 110 Cb 0.07 -1.85 -0.00 0.00 0.04 0.00 0.00 34.50 32.76 1bvm s PRO 110 CO -0.03 -2.11 -0.21 -0.47 0.04 0.00 0.00 177.00 174.22 1bvm s TYR 111 N -3.25 2.18 -0.59 0.56 6.14 -1.26 -4.47 117.35 116.66 1bvm s TYR 111 Ca 0.63 -0.72 -0.05 0.00 0.64 0.00 0.00 57.07 57.58 1bvm s TYR 111 Cb -0.15 -1.45 0.15 0.00 0.42 0.00 0.00 41.96 40.93 1bvm s TYR 111 CO 0.54 -0.26 0.42 -0.80 0.64 0.00 0.00 175.55 176.09 1bvm s ASN 112 N 0.08 5.45 0.46 4.32 0.01 -1.26 -4.92 114.94 119.08 1bvm s ASN 112 Ca -0.08 -2.57 0.19 0.00 -0.71 0.00 0.00 52.86 49.68 1bvm s ASN 112 Cb -0.14 -1.90 1.16 0.00 0.41 0.00 0.00 41.25 40.77 1bvm s ASN 112 CO 0.05 -0.46 1.95 0.50 -1.51 0.00 0.00 177.10 177.62 1bvm h LYS 113 N 7.47 0.28 0.00 -0.60 3.11 -1.99 0.19 116.57 125.03 1bvm h LYS 113 Ca -0.05 -0.02 -0.05 0.00 -2.81 0.00 0.00 60.65 57.72 1bvm h LYS 113 Cb 0.99 -0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 32.15 1bvm h LYS 113 CO 0.73 0.18 -0.25 0.93 -2.81 0.00 0.00 179.45 178.23 1bvm h GLU 114 N 0.29 0.00 0.00 1.90 5.08 -2.03 -1.40 114.58 118.41 1bvm h GLU 114 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1bvm h GLU 114 Cb 0.87 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1bvm h GLU 114 CO -0.08 0.25 0.00 0.72 -1.00 0.00 0.00 179.01 178.91 1bvm n HIS 115 N -4.05 0.00 -2.02 4.33 8.25 0.67 -4.81 115.22 117.59 1bvm n HIS 115 Ca -0.02 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.04 1bvm n HIS 115 Cb 0.32 -0.32 -0.00 0.00 1.12 0.00 0.00 29.99 31.11 1bvm n HIS 115 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1bvm s LYS 116 N -2.64 4.00 -1.19 -0.41 2.36 -0.53 -3.24 119.74 118.09 1bvm s LYS 116 Ca 0.20 2.22 -0.07 0.00 -2.55 0.00 0.00 55.97 55.77 1bvm s LYS 116 Cb 0.15 -2.80 -0.02 0.00 -1.05 0.00 0.00 37.83 34.11 1bvm s LYS 116 CO 0.35 -0.49 0.80 0.09 1.55 0.00 0.00 175.35 177.66 1bvm n ASN 117 N 0.21 -3.68 -4.86 1.43 3.02 -1.25 -4.96 115.26 105.16 1bvm n ASN 117 Ca 0.03 -0.83 -0.29 0.00 -0.03 0.00 0.00 54.58 53.47 1bvm n ASN 117 Cb 0.43 -4.27 0.10 0.00 -0.61 0.00 0.00 39.78 35.43 1bvm n ASN 117 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1bvm s LEU 118 N -6.27 2.43 -0.15 3.41 2.96 -1.20 -5.04 118.68 114.83 1bvm s LEU 118 Ca 0.24 0.79 -0.14 0.00 -0.22 0.00 0.00 54.13 54.80 1bvm s LEU 118 Cb -0.06 -3.24 -0.05 0.00 0.50 0.00 0.00 46.19 43.34 1bvm s LEU 118 CO 0.80 -2.03 0.29 -0.62 -1.32 0.00 0.00 176.35 173.47 1bvm s ASP 119 N -4.51 6.46 0.57 3.68 -1.08 -1.26 -4.94 116.67 115.59 1bvm s ASP 119 Ca 0.63 0.54 0.29 0.00 -0.52 0.00 0.00 52.55 53.49 1bvm s ASP 119 Cb -0.11 -2.18 1.60 0.00 -1.46 0.00 0.00 42.92 40.77 1bvm s ASP 119 CO 0.50 0.13 1.89 0.11 0.52 0.00 0.00 175.17 178.32 1bvm h LYS 120 N 6.45 0.00 0.00 4.34 1.57 -1.98 0.11 116.57 127.05 1bvm h LYS 120 Ca -0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1bvm h LYS 120 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 1bvm h LYS 120 CO 0.74 0.00 0.00 0.87 -0.57 0.00 0.00 179.45 180.49 1bvm h LYS 121 N 0.00 0.00 -0.00 3.15 6.56 -2.00 0.34 116.57 124.62 1bvm h LYS 121 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1bvm h LYS 121 Cb 0.43 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.09 1bvm h LYS 121 CO 0.00 0.00 -0.69 0.09 -2.06 0.00 0.00 179.45 176.79 1bvm n ASN 122 N -2.30 0.81 -0.89 0.86 3.02 0.37 -5.22 115.26 111.90 1bvm n ASN 122 Ca -0.00 -0.65 0.12 0.00 -0.03 0.00 0.00 54.58 54.02 1bvm n ASN 122 Cb 0.11 0.56 0.16 0.00 -0.61 0.00 0.00 39.78 40.01 1bvm n ASN 122 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64