#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bvh s GLU 2 N 0.00 3.34 0.50 0.00 0.41 -1.26 -5.08 118.70 116.61 1bvh s GLU 2 Ca 0.00 -0.72 -0.19 0.00 -0.41 0.00 0.00 54.97 53.65 1bvh s GLU 2 Cb 0.00 -3.55 -0.08 0.00 -1.78 0.00 0.00 34.13 28.73 1bvh s GLU 2 CO 0.00 -0.41 1.02 -0.65 -0.49 0.00 0.00 175.26 174.73 1bvh s GLN 3 N 1.61 3.79 0.22 1.61 -0.21 -1.26 -5.06 119.66 120.36 1bvh s GLN 3 Ca 0.05 1.23 0.02 0.00 0.02 0.00 0.00 55.36 56.67 1bvh s GLN 3 Cb -0.17 -2.10 -0.05 0.00 1.00 0.00 0.00 33.01 31.69 1bvh s GLN 3 CO 0.06 -0.42 0.04 0.08 -2.12 0.00 0.00 175.29 172.93 1bvh s VAL 4 N -2.21 0.72 -1.29 1.09 1.01 -1.26 -5.05 120.40 113.42 1bvh s VAL 4 Ca 0.64 -2.00 -0.18 0.00 0.00 0.00 0.00 61.98 60.44 1bvh s VAL 4 Cb -0.14 -2.40 0.03 0.00 0.00 0.00 0.00 36.38 33.88 1bvh s VAL 4 CO 0.24 -0.24 1.86 0.35 0.00 0.00 0.00 175.10 177.31 1bvh n THR 5 N -0.38 3.48 -1.65 3.92 -2.24 -1.26 -4.86 114.28 111.29 1bvh n THR 5 Ca -0.03 -3.52 -0.65 0.00 -2.27 0.00 0.00 64.05 57.58 1bvh n THR 5 Cb 0.65 -2.37 -0.10 0.00 -2.10 0.00 0.00 70.33 66.41 1bvh n THR 5 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1bvh n LYS 6 N 7.94 0.17 -3.90 -0.78 4.81 -0.73 -4.08 118.16 121.59 1bvh n LYS 6 Ca 0.49 0.06 -0.36 0.00 -0.87 0.00 0.00 58.31 57.63 1bvh n LYS 6 Cb 0.45 -1.60 -0.12 0.00 0.02 0.00 0.00 35.03 33.78 1bvh n LYS 6 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1bvh s SER 7 N 3.68 5.03 -0.12 3.14 0.01 -1.26 -1.79 113.70 122.39 1bvh s SER 7 Ca 1.07 -0.19 0.01 0.00 1.31 0.00 0.00 55.95 58.15 1bvh s SER 7 Cb -1.43 -1.88 0.02 0.00 0.21 0.00 0.00 66.02 62.93 1bvh s SER 7 CO 0.77 0.02 -0.13 0.54 0.41 0.00 0.00 173.24 174.84 1bvh s VAL 8 N 1.28 1.42 0.05 3.43 0.11 -0.32 -0.97 120.40 125.40 1bvh s VAL 8 Ca 0.04 -0.56 0.09 0.00 -2.93 0.00 0.00 61.98 58.62 1bvh s VAL 8 Cb -0.15 -1.34 -0.03 0.00 -1.53 0.00 0.00 36.38 33.34 1bvh s VAL 8 CO 0.02 0.43 -0.24 -1.48 -3.33 0.00 0.00 175.10 170.51 1bvh s LEU 9 N 1.31 2.18 0.23 2.54 0.05 -1.05 -2.15 118.68 121.79 1bvh s LEU 9 Ca -0.00 -0.58 0.06 0.00 0.05 0.00 0.00 54.13 53.66 1bvh s LEU 9 Cb -0.14 -1.14 -0.03 0.00 -2.05 0.00 0.00 46.19 42.83 1bvh s LEU 9 CO -0.06 0.20 0.24 -0.36 -0.55 0.00 0.00 176.35 175.82 1bvh s PHE 10 N -0.84 3.23 -0.01 3.48 0.08 -0.63 -2.47 117.98 120.82 1bvh s PHE 10 Ca 0.10 -0.05 -0.06 0.00 0.12 0.00 0.00 56.93 57.03 1bvh s PHE 10 Cb -0.09 -1.48 0.00 0.00 -0.57 0.00 0.00 43.02 40.88 1bvh s PHE 10 CO 0.02 0.50 0.13 0.08 -0.10 0.00 0.00 175.22 175.85 1bvh s VAL 11 N -2.00 0.06 -0.24 -0.44 1.01 -0.09 0.12 120.40 118.83 1bvh s VAL 11 Ca 0.33 -0.50 -0.26 0.00 0.00 0.00 0.00 61.98 61.55 1bvh s VAL 11 Cb -0.09 -0.36 0.07 0.00 0.00 0.00 0.00 36.38 36.00 1bvh s VAL 11 CO 0.26 -0.28 0.73 0.00 0.00 0.00 0.00 175.10 175.81 1bvh h LEU 13 N 4.67 -0.38 0.00 0.00 5.85 -1.89 -3.21 115.31 120.35 1bvh h LEU 13 Ca -0.29 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.49 1bvh h LEU 13 Cb 1.16 0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.35 1bvh h LEU 13 CO 0.10 -0.07 0.00 0.61 -0.34 0.00 0.00 178.44 178.74 1bvh n GLY 14 N -1.07 -3.13 2.93 3.75 0.00 -1.26 -4.82 105.19 101.59 1bvh n GLY 14 Ca -0.00 0.19 -0.17 0.00 0.00 0.00 0.00 46.02 46.04 1bvh n GLY 14 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1bvh n ASN 15 N -0.63 -5.07 -0.16 1.61 4.05 -1.21 -4.88 115.26 108.97 1bvh n ASN 15 Ca 0.00 -0.35 0.00 0.00 0.45 0.00 0.00 54.58 54.68 1bvh n ASN 15 Cb 0.00 -3.71 0.00 0.00 1.23 0.00 0.00 39.78 37.30 1bvh n ASN 15 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51 1bvh n ILE 16 N -4.26 0.00 0.00 -1.44 -6.64 -1.26 -4.78 119.36 100.98 1bvh n ILE 16 Ca -0.01 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.97 1bvh n ILE 16 Cb 0.55 0.69 0.00 0.00 -1.44 0.00 0.00 39.64 39.44 1bvh n ILE 16 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1bvh n ARG 18 N 0.00 3.25 0.00 0.00 1.74 -1.26 -3.88 116.66 116.51 1bvh n ARG 18 Ca 0.00 -3.33 0.00 0.00 -0.77 0.00 0.00 57.85 53.75 1bvh n ARG 18 Cb 0.00 -3.22 0.00 0.00 -1.02 0.00 0.00 32.46 28.22 1bvh n ARG 18 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1bvh n SER 19 N 6.28 0.00 0.32 0.55 7.64 -1.26 -4.70 113.62 122.45 1bvh n SER 19 Ca 0.45 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.45 1bvh n SER 19 Cb 0.42 0.00 0.69 0.00 -1.01 0.00 0.00 64.21 64.30 1bvh n SER 19 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1bvh h PRO 20 N 0.00 0.00 -0.02 1.43 0.11 -1.88 0.10 132.00 131.74 1bvh h PRO 20 Ca 0.00 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.85 1bvh h PRO 20 Cb 0.00 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.13 1bvh h PRO 20 CO 0.00 0.00 -1.01 0.82 -0.21 0.00 0.00 178.00 177.60 1bvh h ILE 21 N 0.00 1.28 -0.82 4.15 2.04 -1.93 -1.76 117.51 120.48 1bvh h ILE 21 Ca 0.00 -2.23 -0.04 0.00 1.00 0.00 0.00 64.86 63.59 1bvh h ILE 21 Cb 0.83 2.34 -0.04 0.00 -0.74 0.00 0.00 36.82 39.21 1bvh h ILE 21 CO 0.00 0.69 0.35 0.00 0.00 0.00 0.00 178.15 179.18 1bvh h ALA 22 N 0.43 1.06 0.43 1.87 0.00 -0.94 -1.04 119.26 121.07 1bvh h ALA 22 Ca -0.12 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 1bvh h ALA 22 Cb 1.66 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1bvh h ALA 22 CO 0.20 0.67 -0.21 1.49 0.00 0.00 0.00 179.25 181.40 1bvh h GLU 23 N 1.18 -0.55 -1.23 0.00 4.22 -1.56 -2.61 114.58 114.03 1bvh h GLU 23 Ca 0.27 0.04 0.36 0.00 0.08 0.00 0.00 59.36 60.11 1bvh h GLU 23 Cb 0.19 0.13 -0.09 0.00 0.50 0.00 0.00 28.75 29.47 1bvh h GLU 23 CO -0.03 -0.33 0.82 0.00 -2.18 0.00 0.00 179.01 177.30 1bvh h ALA 24 N -1.04 2.71 -0.15 2.92 0.00 -1.30 0.46 119.26 122.85 1bvh h ALA 24 Ca -0.06 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1bvh h ALA 24 Cb 0.48 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1bvh h ALA 24 CO 0.10 -1.18 -0.00 0.28 0.00 0.00 0.00 179.25 178.44 1bvh h VAL 25 N 0.18 1.25 -0.86 0.00 2.07 -1.08 -2.58 116.25 115.22 1bvh h VAL 25 Ca 0.68 -0.84 0.21 0.00 0.82 0.00 0.00 66.70 67.57 1bvh h VAL 25 Cb 2.18 1.51 -0.12 0.00 -1.52 0.00 0.00 31.29 33.34 1bvh h VAL 25 CO -0.25 0.25 0.33 0.15 0.02 0.00 0.00 177.57 178.07 1bvh h PHE 26 N 0.01 0.55 0.31 1.57 3.04 0.31 1.70 116.94 124.43 1bvh h PHE 26 Ca 0.04 0.04 -0.01 0.00 3.98 0.00 0.00 57.97 62.03 1bvh h PHE 26 Cb 0.38 -0.11 -0.02 0.00 2.56 0.00 0.00 35.95 38.76 1bvh h PHE 26 CO 0.03 -0.07 -0.37 -0.09 -2.02 0.00 0.00 178.31 175.79 1bvh h ARG 27 N 0.36 -0.67 -0.08 1.11 1.12 -1.17 -0.49 114.38 114.56 1bvh h ARG 27 Ca 0.53 0.05 0.00 0.00 -1.11 0.00 0.00 59.98 59.45 1bvh h ARG 27 Cb 0.99 0.15 0.00 0.00 -0.01 0.00 0.00 29.97 31.11 1bvh h ARG 27 CO -0.54 -0.45 0.00 1.17 -3.11 0.00 0.00 179.97 177.05 1bvh n LYS 28 N -4.62 1.00 -0.10 0.20 3.00 -0.31 -2.61 118.16 114.72 1bvh n LYS 28 Ca -0.08 0.00 -0.14 0.00 -0.00 0.00 0.00 58.31 58.09 1bvh n LYS 28 Cb 0.33 -1.04 -0.14 0.00 0.00 0.00 0.00 35.03 34.18 1bvh n LYS 28 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1bvh n LEU 29 N -0.46 1.44 -0.05 3.14 7.94 0.56 -4.16 117.00 125.42 1bvh n LEU 29 Ca 0.00 -0.01 -0.22 0.00 -1.11 0.00 0.00 56.01 54.67 1bvh n LEU 29 Cb 0.02 -0.20 -0.13 0.00 0.53 0.00 0.00 43.42 43.64 1bvh n LEU 29 CO 0.00 0.69 -0.74 0.55 -1.11 0.00 0.00 177.39 176.78 1bvh n VAL 30 N -3.03 1.66 -0.21 1.96 3.14 -0.45 -3.43 118.33 117.99 1bvh n VAL 30 Ca -0.37 -0.39 0.31 0.00 -2.96 0.00 0.00 64.34 60.93 1bvh n VAL 30 Cb 1.08 -1.85 0.73 0.00 -1.06 0.00 0.00 33.84 32.73 1bvh n VAL 30 CO 0.00 0.00 0.00 0.74 -6.46 0.00 0.00 176.83 171.11 1bvh h THR 31 N -0.41 0.43 0.18 1.55 2.02 -1.72 0.64 112.91 115.60 1bvh h THR 31 Ca -0.41 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 66.46 1bvh h THR 31 Cb 1.72 0.47 0.02 0.00 -1.74 0.00 0.00 68.15 68.62 1bvh h THR 31 CO -0.06 0.00 -1.39 -0.78 0.37 0.00 0.00 175.52 173.67 1bvh h ASP 32 N 0.00 0.59 0.73 4.18 3.58 -1.72 -3.15 116.42 120.62 1bvh h ASP 32 Ca 0.46 -0.65 0.00 0.00 0.42 0.00 0.00 57.03 57.26 1bvh h ASP 32 Cb 1.95 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 42.81 1bvh h ASP 32 CO -0.00 1.52 0.00 1.67 -2.88 0.00 0.00 179.24 179.54 1bvh n GLN 33 N -3.60 0.05 -2.19 0.28 -0.06 0.20 -4.87 117.38 107.20 1bvh n GLN 33 Ca -0.13 0.21 -0.02 0.00 -2.00 0.00 0.00 57.00 55.06 1bvh n GLN 33 Cb 1.06 -1.58 0.00 0.00 -4.06 0.00 0.00 30.24 25.67 1bvh n GLN 33 CO 0.00 0.00 0.00 -1.71 -0.20 0.00 0.00 177.06 175.15 1bvh n ASN 34 N -1.66 -1.65 0.00 1.69 4.05 0.24 -4.93 115.26 113.00 1bvh n ASN 34 Ca 0.04 -0.01 0.00 0.00 0.45 0.00 0.00 54.58 55.06 1bvh n ASN 34 Cb 0.24 -0.84 0.00 0.00 1.23 0.00 0.00 39.78 40.41 1bvh n ASN 34 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51 1bvh n ILE 35 N -3.63 0.32 0.16 -1.44 -5.35 -1.06 -4.69 119.36 103.67 1bvh n ILE 35 Ca -0.01 -0.58 0.04 0.00 -0.27 0.00 0.00 62.75 61.93 1bvh n ILE 35 Cb 0.51 0.94 0.47 0.00 -1.74 0.00 0.00 39.64 39.82 1bvh n ILE 35 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1bvh h SER 36 N 0.00 0.15 -0.27 7.28 4.64 -1.87 -1.42 113.55 122.07 1bvh h SER 36 Ca 0.00 -0.02 0.08 0.00 -0.47 0.00 0.00 61.79 61.38 1bvh h SER 36 Cb 0.27 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 1bvh h SER 36 CO 0.00 0.26 0.32 -0.78 -0.87 0.00 0.00 176.83 175.75 1bvh h ASP 37 N 0.16 0.00 -0.66 4.97 1.82 -1.93 -1.51 116.42 119.28 1bvh h ASP 37 Ca 0.04 0.00 -0.45 0.00 -0.39 0.00 0.00 57.03 56.23 1bvh h ASP 37 Cb 0.24 0.00 -0.42 0.00 0.68 0.00 0.00 39.33 39.83 1bvh h ASP 37 CO 0.01 0.00 -0.92 0.59 -1.61 0.00 0.00 179.24 177.31 1bvh n ASN 38 N -3.68 3.81 -3.43 2.28 5.03 -0.55 -4.96 115.26 113.76 1bvh n ASN 38 Ca 0.04 -3.18 -0.17 0.00 0.87 0.00 0.00 54.58 52.14 1bvh n ASN 38 Cb 0.46 -0.39 -0.11 0.00 -1.02 0.00 0.00 39.78 38.72 1bvh n ASN 38 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 1bvh s TRP 39 N -3.66 -0.43 -0.46 3.10 0.52 -0.57 -1.78 118.94 115.65 1bvh s TRP 39 Ca 0.43 0.08 -0.17 0.00 0.02 0.00 0.00 56.10 56.47 1bvh s TRP 39 Cb 0.38 -0.37 0.05 0.00 -1.15 0.00 0.00 33.47 32.38 1bvh s TRP 39 CO 0.01 -0.79 0.46 0.08 0.02 0.00 0.00 176.95 176.73 1bvh s VAL 40 N 2.37 5.11 0.03 4.03 1.01 -0.74 -4.84 120.40 127.37 1bvh s VAL 40 Ca 0.09 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.37 1bvh s VAL 40 Cb -0.15 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.06 1bvh s VAL 40 CO -0.24 -0.58 0.02 -0.63 0.00 0.00 0.00 175.10 173.67 1bvh s ILE 41 N 2.02 4.24 0.00 2.22 1.09 -1.26 -1.17 121.20 128.34 1bvh s ILE 41 Ca 0.09 -0.68 0.00 0.00 -1.10 0.00 0.00 60.65 58.96 1bvh s ILE 41 Cb -0.21 -2.94 0.00 0.00 -1.06 0.00 0.00 42.46 38.25 1bvh s ILE 41 CO 0.10 0.29 0.00 0.47 -0.10 0.00 0.00 174.94 175.70 1bvh n ASP 42 N 1.08 0.00 -3.57 3.58 9.92 -0.92 -4.91 116.55 121.73 1bvh n ASP 42 Ca -0.13 -0.49 -0.17 0.00 -0.53 0.00 0.00 54.79 53.46 1bvh n ASP 42 Cb 0.52 0.00 -0.09 0.00 -0.64 0.00 0.00 41.12 40.92 1bvh n ASP 42 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 1bvh s SER 43 N 0.03 1.28 0.06 -2.24 0.15 -1.26 -1.61 113.70 110.11 1bvh s SER 43 Ca 0.00 -1.66 -0.26 0.00 0.70 0.00 0.00 55.95 54.72 1bvh s SER 43 Cb 0.00 0.51 0.09 0.00 -1.71 0.00 0.00 66.02 64.91 1bvh s SER 43 CO 0.00 -1.01 0.76 -0.83 1.20 0.00 0.00 173.24 173.36 1bvh s GLY 44 N -3.32 -0.53 0.00 9.45 0.00 0.32 -4.74 107.32 108.51 1bvh s GLY 44 Ca 0.40 0.84 0.00 0.00 0.00 0.00 0.00 44.72 45.96 1bvh s GLY 44 CO 0.24 0.31 0.00 0.00 0.00 0.00 0.00 173.10 173.65 1bvh n ALA 45 N -0.22 1.56 -0.96 3.20 0.00 -1.20 -1.94 120.51 120.95 1bvh n ALA 45 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1bvh n ALA 45 Cb 0.63 0.14 0.00 0.00 0.00 0.00 0.00 19.45 20.22 1bvh n ALA 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1bvh n VAL 46 N -1.34 0.00 -4.49 0.00 0.31 -1.26 -4.07 118.33 107.47 1bvh n VAL 46 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 64.34 64.06 1bvh n VAL 46 Cb 0.26 -0.22 -0.17 0.00 -0.91 0.00 0.00 33.84 32.80 1bvh n VAL 46 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1bvh s SER 47 N -2.25 2.24 0.00 4.52 1.04 -1.26 -4.98 113.70 113.01 1bvh s SER 47 Ca 0.00 -0.38 0.21 0.00 0.48 0.00 0.00 55.95 56.26 1bvh s SER 47 Cb 0.00 -1.00 1.24 0.00 0.10 0.00 0.00 66.02 66.36 1bvh s SER 47 CO 0.00 0.02 1.72 -0.67 0.98 0.00 0.00 173.24 175.28 1bvh n ASP 48 N 4.11 0.00 -0.91 7.02 2.03 -1.26 -2.59 116.55 124.95 1bvh n ASP 48 Ca -0.20 -1.10 0.11 0.00 0.52 0.00 0.00 54.79 54.12 1bvh n ASP 48 Cb 0.51 0.00 0.12 0.00 -0.72 0.00 0.00 41.12 41.03 1bvh n ASP 48 CO 0.00 0.00 0.00 -2.67 -1.92 0.00 0.00 177.20 172.61 1bvh n TRP 49 N -0.87 0.13 -0.10 -0.67 4.27 -1.26 -4.20 117.44 114.74 1bvh n TRP 49 Ca 0.16 -0.07 0.00 0.00 -3.89 0.00 0.00 57.50 53.69 1bvh n TRP 49 Cb 0.07 -0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.02 1bvh n TRP 49 CO 0.00 0.00 0.00 0.09 -2.29 0.00 0.00 177.69 175.49 1bvh n ASN 50 N 1.23 1.69 -4.56 -0.67 4.13 -1.07 -4.89 115.26 111.13 1bvh n ASN 50 Ca 0.14 -1.79 -0.31 0.00 1.68 0.00 0.00 54.58 54.29 1bvh n ASN 50 Cb 0.54 0.00 -0.04 0.00 -1.54 0.00 0.00 39.78 38.74 1bvh n ASN 50 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1bvh s VAL 51 N -0.79 3.50 0.00 2.41 1.01 -1.25 -1.87 120.40 123.42 1bvh s VAL 51 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.70 1bvh s VAL 51 Cb 0.00 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 32.21 1bvh s VAL 51 CO 0.00 -1.11 0.00 0.61 0.00 0.00 0.00 175.10 174.60 1bvh n GLY 52 N 6.58 1.27 3.52 4.51 0.00 -0.03 -4.95 105.19 116.09 1bvh n GLY 52 Ca 0.34 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.93 1bvh n GLY 52 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bvh s ARG 53 N -0.18 3.91 0.68 1.61 0.52 -0.78 -4.91 118.95 119.80 1bvh s ARG 53 Ca 0.00 -2.02 -0.17 0.00 -0.52 0.00 0.00 55.73 53.01 1bvh s ARG 53 Cb 0.00 -5.27 -0.12 0.00 0.52 0.00 0.00 34.95 30.08 1bvh s ARG 53 CO 0.00 -2.02 -0.06 -1.13 0.02 0.00 0.00 175.30 172.11 1bvh n SER 54 N 7.32 -3.36 -3.33 0.23 3.41 -1.26 -4.66 113.62 111.98 1bvh n SER 54 Ca 0.39 0.54 -0.10 0.00 -0.26 0.00 0.00 58.87 59.43 1bvh n SER 54 Cb 0.46 -0.95 0.10 0.00 -0.26 0.00 0.00 64.21 63.56 1bvh n SER 54 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1bvh n PRO 55 N 1.01 -1.00 -3.04 4.33 -0.02 -1.26 -4.85 135.00 130.17 1bvh n PRO 55 Ca 0.07 -0.50 -0.39 0.00 -2.02 0.00 0.00 63.50 60.65 1bvh n PRO 55 Cb 0.50 -0.99 -0.06 0.00 -0.02 0.00 0.00 33.50 32.93 1bvh n PRO 55 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1bvh s ASP 56 N -1.87 7.30 0.65 2.55 1.11 0.27 -4.86 116.67 121.82 1bvh s ASP 56 Ca 0.23 1.54 0.26 0.00 0.18 0.00 0.00 52.55 54.76 1bvh s ASP 56 Cb -0.04 -2.47 1.37 0.00 1.07 0.00 0.00 42.92 42.85 1bvh s ASP 56 CO 0.19 0.19 1.78 -0.65 1.18 0.00 0.00 175.17 177.86 1bvh h PRO 57 N 4.59 0.00 0.15 8.23 0.11 -1.90 0.18 132.00 143.35 1bvh h PRO 57 Ca -0.47 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.28 1bvh h PRO 57 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1bvh h PRO 57 CO 0.66 0.00 -1.87 0.00 -0.21 0.00 0.00 178.00 176.59 1bvh h ARG 58 N 0.00 0.32 -0.18 1.05 3.08 -1.97 -3.33 114.38 113.35 1bvh h ARG 58 Ca 0.05 -0.54 0.00 0.00 0.07 0.00 0.00 59.98 59.56 1bvh h ARG 58 Cb 0.99 0.20 0.00 0.00 0.08 0.00 0.00 29.97 31.24 1bvh h ARG 58 CO -0.00 1.24 0.00 0.00 -1.07 0.00 0.00 179.97 180.14 1bvh n ALA 59 N -2.92 2.51 0.06 0.04 0.00 0.35 -3.82 120.51 116.74 1bvh n ALA 59 Ca -0.28 -0.45 -0.20 0.00 0.00 0.00 0.00 53.44 52.51 1bvh n ALA 59 Cb 1.06 -1.08 -0.15 0.00 0.00 0.00 0.00 19.45 19.29 1bvh n ALA 59 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1bvh h VAL 60 N 1.68 0.99 0.00 0.00 3.04 -0.91 -3.30 116.25 117.75 1bvh h VAL 60 Ca 0.00 -2.60 0.00 0.00 -1.01 0.00 0.00 66.70 63.09 1bvh h VAL 60 Cb 0.37 2.74 0.00 0.00 -2.01 0.00 0.00 31.29 32.40 1bvh h VAL 60 CO 0.00 0.84 0.00 0.28 -1.01 0.00 0.00 177.57 177.68 1bvh h SER 61 N 0.09 0.00 0.54 3.17 0.02 -1.73 -2.98 113.55 112.66 1bvh h SER 61 Ca -0.31 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.54 1bvh h SER 61 Cb 2.07 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.59 1bvh h SER 61 CO 0.17 0.00 -0.48 0.00 -1.14 0.00 0.00 176.83 175.37 1bvh h LEU 63 N 0.00 0.00 -0.12 0.00 3.38 -1.66 -3.33 115.31 113.58 1bvh h LEU 63 Ca -0.00 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1bvh h LEU 63 Cb 0.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1bvh h LEU 63 CO 0.06 1.02 0.00 -1.14 0.09 0.00 0.00 178.44 178.47 1bvh n ARG 64 N -4.57 0.02 0.00 1.13 0.63 -1.14 -1.38 116.66 111.35 1bvh n ARG 64 Ca -0.16 0.41 0.00 0.00 -0.92 0.00 0.00 57.85 57.19 1bvh n ARG 64 Cb 0.41 -1.55 0.00 0.00 0.45 0.00 0.00 32.46 31.77 1bvh n ARG 64 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1bvh n ASN 65 N -1.58 0.00 0.18 6.15 3.02 0.02 -3.90 115.26 119.16 1bvh n ASN 65 Ca 0.01 0.28 0.06 0.00 -0.03 0.00 0.00 54.58 54.90 1bvh n ASN 65 Cb 0.07 0.00 0.28 0.00 -0.61 0.00 0.00 39.78 39.52 1bvh n ASN 65 CO 0.00 0.00 0.00 1.12 -2.62 0.00 0.00 177.26 175.76 1bvh h HIS 66 N 0.00 0.00 0.00 3.10 2.07 -1.77 -3.48 115.15 115.08 1bvh h HIS 66 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1bvh h HIS 66 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 1bvh h HIS 66 CO 0.00 0.36 0.00 0.41 -3.07 0.00 0.00 177.93 175.63 1bvh n GLY 67 N 0.53 2.96 0.00 6.13 0.00 -0.81 -5.10 105.19 108.90 1bvh n GLY 67 Ca 0.01 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1bvh n GLY 67 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1bvh n ILE 68 N 0.00 0.00 -1.01 -0.61 2.08 -0.48 -4.89 119.36 114.45 1bvh n ILE 68 Ca 0.00 0.00 0.11 0.00 0.56 0.00 0.00 62.75 63.42 1bvh n ILE 68 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 39.64 38.85 1bvh n ILE 68 CO 0.00 0.00 0.00 -0.46 0.56 0.00 0.00 176.55 176.65 1bvh n ASN 69 N -1.33 -5.14 0.10 4.38 0.23 -1.26 -4.58 115.26 107.66 1bvh n ASN 69 Ca 0.00 0.53 0.00 0.00 -0.53 0.00 0.00 54.58 54.58 1bvh n ASN 69 Cb 0.00 -3.23 0.00 0.00 -2.08 0.00 0.00 39.78 34.47 1bvh n ASN 69 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1bvh n THR 70 N -3.17 0.00 -3.01 5.53 -2.24 -1.26 -4.76 114.28 105.37 1bvh n THR 70 Ca -0.01 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.54 1bvh n THR 70 Cb 0.61 -0.06 0.02 0.00 -2.10 0.00 0.00 70.33 68.80 1bvh n THR 70 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bvh n ALA 71 N -2.92 -0.96 -3.68 6.98 0.00 -1.26 -4.96 120.51 113.71 1bvh n ALA 71 Ca 0.00 0.24 -0.11 0.00 0.00 0.00 0.00 53.44 53.57 1bvh n ALA 71 Cb 0.00 -3.49 -0.12 0.00 0.00 0.00 0.00 19.45 15.84 1bvh n ALA 71 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1bvh s HIS 72 N -3.11 -0.54 -0.38 0.00 5.04 -1.26 -5.02 115.29 110.02 1bvh s HIS 72 Ca 0.28 1.15 0.06 0.00 -1.54 0.00 0.00 55.06 55.01 1bvh s HIS 72 Cb -0.13 0.14 0.65 0.00 0.04 0.00 0.00 32.58 33.28 1bvh s HIS 72 CO 0.35 -0.36 1.79 1.17 -2.34 0.00 0.00 174.74 175.35 1bvh n LYS 73 N 4.85 2.79 -0.59 2.88 3.00 -1.26 -4.85 118.16 124.98 1bvh n LYS 73 Ca -0.15 -2.78 0.00 0.00 -0.00 0.00 0.00 58.31 55.38 1bvh n LYS 73 Cb 0.52 -2.11 0.00 0.00 0.00 0.00 0.00 35.03 33.44 1bvh n LYS 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1bvh n ALA 74 N -0.59 -2.56 -3.03 3.14 0.00 -1.26 -0.86 120.51 115.35 1bvh n ALA 74 Ca 0.47 0.15 -0.12 0.00 0.00 0.00 0.00 53.44 53.94 1bvh n ALA 74 Cb 1.46 -0.80 -0.12 0.00 0.00 0.00 0.00 19.45 19.98 1bvh n ALA 74 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1bvh s ARG 75 N -3.65 0.23 -0.05 0.00 1.81 -1.26 -1.21 118.95 114.83 1bvh s ARG 75 Ca 0.00 0.06 -0.30 0.00 -1.72 0.00 0.00 55.73 53.77 1bvh s ARG 75 Cb 0.00 0.10 -0.06 0.00 -0.45 0.00 0.00 34.95 34.55 1bvh s ARG 75 CO 0.00 -0.04 1.69 -1.14 -0.68 0.00 0.00 175.30 175.13 1bvh s GLN 76 N -0.25 4.17 1.05 3.54 0.74 -1.26 -3.25 119.66 124.39 1bvh s GLN 76 Ca -0.03 2.23 -0.23 0.00 0.05 0.00 0.00 55.36 57.38 1bvh s GLN 76 Cb -0.03 -4.01 -0.05 0.00 1.10 0.00 0.00 33.01 30.02 1bvh s GLN 76 CO 0.00 -0.86 -0.82 0.28 -0.55 0.00 0.00 175.29 173.34 1bvh n VAL 77 N 5.50 0.00 -3.96 1.34 0.31 -1.26 -4.91 118.33 115.35 1bvh n VAL 77 Ca 0.18 -0.13 -0.11 0.00 -0.01 0.00 0.00 64.34 64.27 1bvh n VAL 77 Cb 0.43 -0.27 -0.02 0.00 -0.91 0.00 0.00 33.84 33.06 1bvh n VAL 77 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1bvh s THR 78 N -2.10 0.00 0.08 2.52 -4.23 -1.26 -4.94 115.64 105.71 1bvh s THR 78 Ca 0.44 -1.31 -0.18 0.00 -1.18 0.00 0.00 61.69 59.46 1bvh s THR 78 Cb 0.01 -2.56 -0.09 0.00 1.34 0.00 0.00 72.50 71.19 1bvh s THR 78 CO 0.64 0.00 1.45 0.50 -0.54 0.00 0.00 174.62 176.67 1bvh h LYS 79 N 2.10 0.51 -0.57 3.99 3.11 -1.95 -2.22 116.57 121.54 1bvh h LYS 79 Ca -0.28 -0.21 0.04 0.00 -2.81 0.00 0.00 60.65 57.38 1bvh h LYS 79 Cb 1.25 -0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 32.42 1bvh h LYS 79 CO 0.37 0.75 0.33 1.49 -2.81 0.00 0.00 179.45 179.58 1bvh h GLU 80 N 0.23 0.61 -0.03 1.90 4.81 -1.99 -1.02 114.58 119.10 1bvh h GLU 80 Ca 0.06 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 1bvh h GLU 80 Cb 0.59 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 1bvh h GLU 80 CO 0.03 0.41 -0.21 -0.44 -0.73 0.00 0.00 179.01 178.07 1bvh h ASP 81 N 0.63 0.04 0.24 1.04 5.19 -1.94 0.43 116.42 122.05 1bvh h ASP 81 Ca 0.24 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.63 1bvh h ASP 81 Cb 0.08 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.58 1bvh h ASP 81 CO -0.13 0.25 -0.12 -0.26 -3.12 0.00 0.00 179.24 175.87 1bvh h PHE 82 N 0.04 -0.30 0.00 4.55 0.04 -0.55 -2.00 116.94 118.72 1bvh h PHE 82 Ca 0.01 -0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.77 1bvh h PHE 82 Cb 0.40 0.10 -0.00 0.00 2.20 0.00 0.00 35.95 38.65 1bvh h PHE 82 CO 0.00 -0.19 -0.00 -0.24 -0.60 0.00 0.00 178.31 177.28 1bvh h VAL 83 N -0.39 0.01 -0.10 -0.55 3.04 -1.49 -1.57 116.25 115.20 1bvh h VAL 83 Ca -0.03 -0.21 -0.12 0.00 -1.01 0.00 0.00 66.70 65.33 1bvh h VAL 83 Cb 0.25 1.20 -0.01 0.00 -2.01 0.00 0.00 31.29 30.72 1bvh h VAL 83 CO 0.05 0.00 -0.47 0.74 -1.01 0.00 0.00 177.57 176.88 1bvh h THR 84 N 0.00 1.33 -2.36 3.17 2.02 -0.76 -3.40 112.91 112.92 1bvh h THR 84 Ca -0.00 -1.67 -0.53 0.00 0.77 0.00 0.00 66.41 64.98 1bvh h THR 84 Cb 0.20 1.78 -0.06 0.00 -1.74 0.00 0.00 68.15 68.34 1bvh h THR 84 CO 0.00 0.50 -0.55 -0.36 0.37 0.00 0.00 175.52 175.48 1bvh s PHE 85 N -4.02 3.09 -1.38 3.16 0.08 -0.67 -4.91 117.98 113.33 1bvh s PHE 85 Ca -0.04 -0.09 0.13 0.00 0.12 0.00 0.00 56.93 57.04 1bvh s PHE 85 Cb 0.13 -1.42 0.05 0.00 -0.57 0.00 0.00 43.02 41.21 1bvh s PHE 85 CO 0.78 0.53 0.81 -0.25 -0.10 0.00 0.00 175.22 176.99 1bvh n ASP 86 N -0.90 1.71 -3.90 1.36 9.92 -1.05 0.08 116.55 123.76 1bvh n ASP 86 Ca -0.08 -1.36 -0.14 0.00 -0.53 0.00 0.00 54.79 52.69 1bvh n ASP 86 Cb 0.57 0.26 -0.14 0.00 -0.64 0.00 0.00 41.12 41.16 1bvh n ASP 86 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1bvh s TYR 87 N -1.37 0.19 -0.20 1.24 1.51 -0.15 -1.72 117.35 116.85 1bvh s TYR 87 Ca 0.13 -0.03 -0.05 0.00 -1.01 0.00 0.00 57.07 56.10 1bvh s TYR 87 Cb 0.11 -0.12 0.10 0.00 -0.11 0.00 0.00 41.96 41.93 1bvh s TYR 87 CO 0.25 -0.00 0.37 0.42 -1.11 0.00 0.00 175.55 175.48 1bvh s ILE 88 N -0.03 -0.59 0.11 2.71 1.01 -0.51 -2.52 121.20 121.38 1bvh s ILE 88 Ca 0.01 0.10 0.06 0.00 0.00 0.00 0.00 60.65 60.82 1bvh s ILE 88 Cb -0.01 -0.68 -0.04 0.00 0.01 0.00 0.00 42.46 41.75 1bvh s ILE 88 CO -0.00 0.01 -0.14 -0.76 0.00 0.00 0.00 174.94 174.05 1bvh s LEU 89 N 2.55 2.39 0.38 2.97 1.43 -1.03 0.41 118.68 127.77 1bvh s LEU 89 Ca 0.04 -0.78 0.06 0.00 -1.03 0.00 0.00 54.13 52.41 1bvh s LEU 89 Cb -0.13 -0.55 -0.07 0.00 0.03 0.00 0.00 46.19 45.47 1bvh s LEU 89 CO -0.13 -0.13 0.02 0.00 0.23 0.00 0.00 176.35 176.34 1bvh n MET 91 N -0.87 3.05 0.00 0.00 2.81 -0.77 -2.45 117.12 118.90 1bvh n MET 91 Ca -0.04 -2.97 0.00 0.00 -1.81 0.00 0.00 57.70 52.88 1bvh n MET 91 Cb 0.67 -3.33 0.00 0.00 -0.71 0.00 0.00 33.22 29.85 1bvh n MET 91 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1bvh n ASP 92 N 6.77 0.00 0.00 7.83 5.75 -1.26 -4.59 116.55 131.05 1bvh n ASP 92 Ca 0.49 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.27 1bvh n ASP 92 Cb 0.42 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.51 1bvh n ASP 92 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1bvh n GLU 93 N 0.00 0.00 -2.88 0.11 1.02 -1.26 -3.09 120.64 114.54 1bvh n GLU 93 Ca 0.00 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 56.70 1bvh n GLU 93 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.40 1bvh n GLU 93 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1bvh s SER 94 N -4.00 6.73 -0.59 1.62 0.01 -1.26 -4.91 113.70 111.29 1bvh s SER 94 Ca 0.00 -2.22 -0.05 0.00 1.31 0.00 0.00 55.95 54.98 1bvh s SER 94 Cb 0.00 -2.42 -0.20 0.00 0.21 0.00 0.00 66.02 63.61 1bvh s SER 94 CO 0.00 -1.04 1.63 -3.20 0.41 0.00 0.00 173.24 171.04 1bvh n ASN 95 N 6.65 -1.61 -2.80 2.44 4.05 -1.18 -2.30 115.26 120.52 1bvh n ASN 95 Ca 0.29 -0.84 -0.17 0.00 0.45 0.00 0.00 54.58 54.31 1bvh n ASN 95 Cb 0.48 -0.53 -0.03 0.00 1.23 0.00 0.00 39.78 40.92 1bvh n ASN 95 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 177.26 174.10 1bvh n LEU 96 N 4.89 -0.32 0.07 1.20 0.00 -1.26 -4.68 117.00 116.90 1bvh n LEU 96 Ca 0.40 -0.37 0.12 0.00 0.00 0.00 0.00 56.01 56.16 1bvh n LEU 96 Cb 0.27 -0.87 0.04 0.00 0.00 0.00 0.00 43.42 42.85 1bvh n LEU 96 CO 0.83 0.04 0.05 -1.14 0.00 0.00 0.00 177.39 177.17 1bvh n ARG 97 N -2.31 0.45 -0.04 1.96 0.63 -0.97 -3.68 116.66 112.70 1bvh n ARG 97 Ca 0.05 0.06 -0.09 0.00 -0.92 0.00 0.00 57.85 56.95 1bvh n ARG 97 Cb 0.30 -1.72 -0.03 0.00 0.45 0.00 0.00 32.46 31.46 1bvh n ARG 97 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1bvh n ASP 98 N -2.33 0.69 0.26 6.15 9.92 -1.26 -4.58 116.55 125.39 1bvh n ASP 98 Ca 0.01 0.12 0.17 0.00 -0.53 0.00 0.00 54.79 54.56 1bvh n ASP 98 Cb 0.50 -0.28 0.80 0.00 -0.64 0.00 0.00 41.12 41.50 1bvh n ASP 98 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 1bvh h LEU 99 N -0.31 0.00 -0.95 0.64 3.38 -1.89 -1.44 115.31 114.73 1bvh h LEU 99 Ca -0.20 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 1bvh h LEU 99 Cb 1.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 1bvh h LEU 99 CO -0.12 0.00 -0.19 -1.13 0.09 0.00 0.00 178.44 177.09 1bvh h ASN 100 N 0.00 0.00 0.86 -0.43 -0.00 -1.81 -2.89 115.58 111.31 1bvh h ASN 100 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 56.30 56.20 1bvh h ASN 100 Cb 0.26 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 38.57 1bvh h ASN 100 CO 0.00 0.19 -1.21 -0.09 -0.00 0.00 0.00 177.43 176.32 1bvh h ARG 101 N 0.00 0.00 -0.01 6.67 2.43 -1.51 -3.33 114.38 118.64 1bvh h ARG 101 Ca -0.00 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.10 1bvh h ARG 101 Cb 0.79 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.33 1bvh h ARG 101 CO 0.02 0.18 -0.31 0.87 -1.51 0.00 0.00 179.97 179.22 1bvh h LYS 102 N 0.00 0.01 0.00 0.20 1.79 -1.35 -1.77 116.57 115.45 1bvh h LYS 102 Ca -0.09 -0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.35 1bvh h LYS 102 Cb 1.34 -0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.99 1bvh h LYS 102 CO 0.03 0.33 -0.11 0.66 -1.08 0.00 0.00 179.45 179.27 1bvh h SER 103 N 0.01 0.00 0.15 0.86 4.64 -1.65 -2.83 113.55 114.73 1bvh h SER 103 Ca -0.00 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.16 1bvh h SER 103 Cb 0.56 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.65 1bvh h SER 103 CO 0.04 0.11 -0.60 -1.13 -0.87 0.00 0.00 176.83 174.39 1bvh h ASN 104 N 0.00 0.51 -0.11 4.97 -0.73 -1.47 -2.73 115.58 116.03 1bvh h ASN 104 Ca -0.00 -0.29 0.00 0.00 1.87 0.00 0.00 56.30 57.88 1bvh h ASN 104 Cb 0.73 -0.15 0.00 0.00 0.27 0.00 0.00 38.32 39.17 1bvh h ASN 104 CO 0.01 0.99 0.00 0.00 -0.37 0.00 0.00 177.43 178.07 1bvh n GLN 105 N -3.92 1.65 -3.29 6.67 10.64 -1.11 -4.81 117.38 123.22 1bvh n GLN 105 Ca -0.03 -0.97 -0.39 0.00 -1.83 0.00 0.00 57.00 53.77 1bvh n GLN 105 Cb 0.63 -1.42 -0.07 0.00 -0.86 0.00 0.00 30.24 28.51 1bvh n GLN 105 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 1bvh s VAL 106 N -1.87 5.12 -0.50 -0.39 1.01 -1.03 -4.98 120.40 117.76 1bvh s VAL 106 Ca 0.34 0.83 -0.28 0.00 0.00 0.00 0.00 61.98 62.87 1bvh s VAL 106 Cb 0.18 -3.79 -0.09 0.00 0.00 0.00 0.00 36.38 32.68 1bvh s VAL 106 CO 0.29 0.16 2.40 0.29 0.00 0.00 0.00 175.10 178.24 1bvh n LYS 107 N 5.04 1.05 -3.58 2.72 5.02 -1.26 -2.35 118.16 124.80 1bvh n LYS 107 Ca -0.06 0.11 -0.27 0.00 -2.02 0.00 0.00 58.31 56.07 1bvh n LYS 107 Cb 0.50 -3.07 0.05 0.00 -0.02 0.00 0.00 35.03 32.49 1bvh n LYS 107 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1bvh n ASN 108 N 14.00 -5.32 -4.51 4.39 4.13 -1.26 -4.87 115.26 121.81 1bvh n ASN 108 Ca 0.40 -0.93 -0.34 0.00 1.68 0.00 0.00 54.58 55.39 1bvh n ASN 108 Cb 0.43 -3.85 0.11 0.00 -1.54 0.00 0.00 39.78 34.93 1bvh n ASN 108 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1bvh n ARG 110 N -1.90 1.80 -2.08 0.00 1.74 -1.22 -4.85 116.66 110.15 1bvh n ARG 110 Ca 0.10 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.87 1bvh n ARG 110 Cb 0.51 -0.90 -0.04 0.00 -1.02 0.00 0.00 32.46 31.01 1bvh n ARG 110 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1bvh s ALA 111 N -1.67 1.85 -0.55 7.54 0.00 0.11 -3.97 121.76 125.08 1bvh s ALA 111 Ca 0.00 -1.36 -0.28 0.00 0.00 0.00 0.00 51.96 50.32 1bvh s ALA 111 Cb 0.00 -4.49 -0.10 0.00 0.00 0.00 0.00 23.12 18.53 1bvh s ALA 111 CO 0.00 -4.52 2.44 1.63 0.00 0.00 0.00 175.76 175.31 1bvh n LYS 112 N 8.94 0.93 -0.83 0.00 5.02 -0.70 -4.28 118.16 127.24 1bvh n LYS 112 Ca 0.35 0.06 -0.31 0.00 -2.02 0.00 0.00 58.31 56.39 1bvh n LYS 112 Cb 0.48 -3.00 0.15 0.00 -0.02 0.00 0.00 35.03 32.64 1bvh n LYS 112 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1bvh s ILE 113 N 10.99 2.35 -1.55 -0.18 -1.09 -1.24 -1.43 121.20 129.06 1bvh s ILE 113 Ca 1.06 0.11 0.00 0.00 -2.23 0.00 0.00 60.65 59.60 1bvh s ILE 113 Cb -0.44 -2.25 0.00 0.00 -1.58 0.00 0.00 42.46 38.20 1bvh s ILE 113 CO 0.33 -0.15 0.00 -0.62 -1.23 0.00 0.00 174.94 173.27 1bvh n GLU 114 N -4.08 -1.22 -3.84 2.79 1.02 0.16 -4.83 120.64 110.64 1bvh n GLU 114 Ca 0.11 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.15 1bvh n GLU 114 Cb 0.52 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.86 1bvh n GLU 114 CO 0.00 0.00 0.00 -0.48 1.18 0.00 0.00 177.13 177.83 1bvh s LEU 115 N 0.00 1.35 0.24 -4.62 2.34 -1.26 -1.08 118.68 115.64 1bvh s LEU 115 Ca 0.00 -0.47 -0.06 0.00 0.06 0.00 0.00 54.13 53.66 1bvh s LEU 115 Cb 0.00 1.02 0.27 0.00 -0.56 0.00 0.00 46.19 46.92 1bvh s LEU 115 CO 0.00 -0.63 1.90 0.25 -1.06 0.00 0.00 176.35 176.81 1bvh h LEU 116 N 3.16 1.02 -1.90 1.48 5.85 -1.84 -0.91 115.31 122.16 1bvh h LEU 116 Ca -0.33 -0.01 0.28 0.00 0.84 0.00 0.00 57.88 58.66 1bvh h LEU 116 Cb 1.20 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.95 1bvh h LEU 116 CO 0.51 0.71 0.78 1.23 -0.34 0.00 0.00 178.44 181.33 1bvh h GLY 117 N 1.19 0.00 0.08 3.75 0.00 -1.85 0.35 103.07 106.59 1bvh h GLY 117 Ca 0.36 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.79 1bvh h GLY 117 CO -0.11 0.00 -0.04 0.23 0.00 0.00 0.00 176.54 176.62 1bvh h SER 118 N 0.00 -0.31 0.00 0.19 0.87 -1.44 -3.38 113.55 109.48 1bvh h SER 118 Ca 0.46 0.13 0.00 0.00 -1.23 0.00 0.00 61.79 61.16 1bvh h SER 118 Cb 2.01 0.25 0.00 0.00 -0.44 0.00 0.00 62.40 64.22 1bvh h SER 118 CO -0.00 -0.11 0.00 -1.22 -0.53 0.00 0.00 176.83 174.96 1bvh n TYR 119 N -5.28 0.00 -2.54 2.24 4.01 0.11 -5.01 117.16 110.68 1bvh n TYR 119 Ca 0.06 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.77 1bvh n TYR 119 Cb 0.28 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.32 1bvh n TYR 119 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1bvh n ASP 120 N 0.00 -5.55 -3.16 7.72 2.03 -1.22 -4.72 116.55 111.66 1bvh n ASP 120 Ca 0.00 -0.15 -0.06 0.00 0.52 0.00 0.00 54.79 55.09 1bvh n ASP 120 Cb 0.00 -3.72 0.06 0.00 -0.72 0.00 0.00 41.12 36.75 1bvh n ASP 120 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 1bvh n PRO 121 N -1.79 -0.94 0.00 -0.67 -0.02 -1.26 -3.96 135.00 126.37 1bvh n PRO 121 Ca -0.01 -0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.16 1bvh n PRO 121 Cb 0.52 -0.55 0.00 0.00 -0.02 0.00 0.00 33.50 33.45 1bvh n PRO 121 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1bvh n GLN 122 N -1.52 0.00 -4.01 -0.52 6.02 -1.26 -4.46 117.38 111.63 1bvh n GLN 122 Ca 0.03 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.70 1bvh n GLN 122 Cb 0.13 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.33 1bvh n GLN 122 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 1bvh s LYS 123 N 0.00 3.16 -0.28 -1.09 -2.85 -1.25 -5.08 119.74 112.35 1bvh s LYS 123 Ca 0.00 -0.52 -0.14 0.00 -1.00 0.00 0.00 55.97 54.32 1bvh s LYS 123 Cb 0.00 -2.90 -0.04 0.00 -2.06 0.00 0.00 37.83 32.83 1bvh s LYS 123 CO 0.00 0.61 0.31 -0.65 0.10 0.00 0.00 175.35 175.72 1bvh s GLN 124 N -2.20 3.98 0.00 1.78 -1.52 -1.26 -4.75 119.66 115.70 1bvh s GLN 124 Ca 0.29 -0.10 0.00 0.00 -1.95 0.00 0.00 55.36 53.60 1bvh s GLN 124 Cb -0.12 -3.66 0.00 0.00 -0.22 0.00 0.00 33.01 29.00 1bvh s GLN 124 CO 0.21 -0.25 0.00 -0.11 -0.25 0.00 0.00 175.29 174.89 1bvh n LEU 125 N 5.24 0.00 0.00 2.90 7.94 -1.26 -5.06 117.00 126.75 1bvh n LEU 125 Ca -0.10 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.80 1bvh n LEU 125 Cb 0.51 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.46 1bvh n LEU 125 CO 0.36 0.00 0.11 -0.38 -1.11 0.00 0.00 177.39 176.36 1bvh n ILE 126 N 0.00 0.00 0.00 1.96 2.08 -1.26 -4.71 119.36 117.43 1bvh n ILE 126 Ca 0.00 -0.30 0.00 0.00 0.56 0.00 0.00 62.75 63.01 1bvh n ILE 126 Cb 0.00 1.28 0.00 0.00 -0.75 0.00 0.00 39.64 40.17 1bvh n ILE 126 CO 0.00 0.00 0.00 -0.38 0.56 0.00 0.00 176.55 176.73 1bvh n ILE 127 N -0.18 0.00 -3.64 1.39 5.41 -1.26 -4.60 119.36 116.48 1bvh n ILE 127 Ca 0.00 0.00 -0.21 0.00 1.00 0.00 0.00 62.75 63.54 1bvh n ILE 127 Cb 0.07 0.00 0.01 0.00 -0.71 0.00 0.00 39.64 39.00 1bvh n ILE 127 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1bvh n GLU 128 N 0.00 -1.38 -3.77 0.38 1.02 -1.26 -4.92 120.64 110.71 1bvh n GLU 128 Ca 0.00 0.85 -0.36 0.00 -0.02 0.00 0.00 57.16 57.63 1bvh n GLU 128 Cb 0.00 -3.24 -0.13 0.00 -0.02 0.00 0.00 31.44 28.06 1bvh n GLU 128 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1bvh s ASP 129 N -3.07 5.06 1.19 1.62 1.01 -1.26 -4.91 116.67 116.32 1bvh s ASP 129 Ca 0.07 -0.27 -0.19 0.00 0.71 0.00 0.00 52.55 52.87 1bvh s ASP 129 Cb -0.03 -1.90 0.28 0.00 1.01 0.00 0.00 42.92 42.28 1bvh s ASP 129 CO 0.87 -0.05 1.12 -2.16 0.21 0.00 0.00 175.17 175.16 1bvh s PRO 130 N 1.59 -1.16 0.00 8.23 0.04 -1.26 -4.88 135.00 137.56 1bvh s PRO 130 Ca 0.06 -0.11 0.22 0.00 0.04 0.00 0.00 61.00 61.21 1bvh s PRO 130 Cb -0.15 -1.61 1.29 0.00 0.04 0.00 0.00 34.50 34.07 1bvh s PRO 130 CO 0.03 -3.66 1.72 0.66 0.04 0.00 0.00 177.00 175.78 1bvh n TYR 131 N -4.71 0.00 -2.72 0.56 4.01 -1.26 -4.21 117.16 108.83 1bvh n TYR 131 Ca 0.14 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.44 1bvh n TYR 131 Cb 0.60 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.56 1bvh n TYR 131 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1bvh n TYR 132 N -1.07 3.69 0.00 -0.72 4.01 -1.26 -5.00 117.16 116.81 1bvh n TYR 132 Ca 0.15 -3.04 0.00 0.00 -0.16 0.00 0.00 57.90 54.85 1bvh n TYR 132 Cb 0.10 -1.90 0.00 0.00 -0.31 0.00 0.00 39.34 37.23 1bvh n TYR 132 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1bvh n GLY 133 N 2.97 -2.97 0.07 2.72 0.00 -1.26 -4.94 105.19 101.78 1bvh n GLY 133 Ca 0.35 -1.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.26 1bvh n GLY 133 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1bvh h ASN 134 N 0.00 0.00 -0.46 1.61 -0.73 -1.95 -3.47 115.58 110.58 1bvh h ASN 134 Ca 0.00 -0.55 0.17 0.00 1.87 0.00 0.00 56.30 57.79 1bvh h ASN 134 Cb 0.00 0.00 -0.20 0.00 0.27 0.00 0.00 38.32 38.39 1bvh h ASN 134 CO 0.00 0.91 -0.08 -0.62 -0.37 0.00 0.00 177.43 177.27 1bvh s ASP 135 N -6.09 -0.73 -0.80 1.15 -1.08 -1.26 -4.92 116.67 102.95 1bvh s ASP 135 Ca -0.15 0.14 -0.00 0.00 -0.52 0.00 0.00 52.55 52.02 1bvh s ASP 135 Cb -0.00 1.48 0.00 0.00 -1.46 0.00 0.00 42.92 42.94 1bvh s ASP 135 CO 0.44 -0.13 0.01 0.00 0.52 0.00 0.00 175.17 176.01 1bvh n ALA 136 N 5.24 -0.84 -3.62 3.66 0.00 -1.26 -4.85 120.51 118.83 1bvh n ALA 136 Ca 0.06 0.07 -0.31 0.00 0.00 0.00 0.00 53.44 53.26 1bvh n ALA 136 Cb 0.56 -1.28 -0.08 0.00 0.00 0.00 0.00 19.45 18.65 1bvh n ALA 136 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1bvh n ASP 137 N -1.74 3.84 -0.01 0.00 8.00 -1.26 -4.79 116.55 120.59 1bvh n ASP 137 Ca -0.11 -3.28 0.10 0.00 0.71 0.00 0.00 54.79 52.22 1bvh n ASP 137 Cb 0.58 -0.85 -0.15 0.00 -0.02 0.00 0.00 41.12 40.68 1bvh n ASP 137 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1bvh n PHE 138 N 1.68 0.00 0.05 1.24 -1.74 -1.26 -4.25 117.46 113.18 1bvh n PHE 138 Ca 0.24 0.00 0.21 0.00 -0.56 0.00 0.00 57.45 57.34 1bvh n PHE 138 Cb 0.37 -0.33 0.74 0.00 1.52 0.00 0.00 39.48 41.78 1bvh n PHE 138 CO 0.00 0.00 0.00 1.49 -0.56 0.00 0.00 176.76 177.69 1bvh h GLU 139 N 0.00 0.00 0.18 3.97 4.81 -2.01 -1.55 114.58 119.98 1bvh h GLU 139 Ca 0.00 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1bvh h GLU 139 Cb 0.82 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.17 1bvh h GLU 139 CO 0.00 0.00 -0.26 1.15 -0.73 0.00 0.00 179.01 179.17 1bvh h THR 140 N 0.00 0.43 -0.73 0.32 2.02 -1.99 -2.42 112.91 110.54 1bvh h THR 140 Ca 0.22 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.51 1bvh h THR 140 Cb 1.05 0.43 -0.13 0.00 -1.74 0.00 0.00 68.15 67.77 1bvh h THR 140 CO -0.00 0.00 -0.39 0.58 0.37 0.00 0.00 175.52 176.08 1bvh h VAL 141 N -0.51 0.09 -0.72 3.16 2.07 -1.57 0.55 116.25 119.31 1bvh h VAL 141 Ca 0.01 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.69 1bvh h VAL 141 Cb 0.50 0.09 -0.11 0.00 -1.52 0.00 0.00 31.29 30.25 1bvh h VAL 141 CO -0.11 0.00 0.11 0.22 0.02 0.00 0.00 177.57 177.81 1bvh h TYR 142 N -0.12 0.15 0.50 1.57 3.20 -1.53 0.50 116.97 121.24 1bvh h TYR 142 Ca 0.25 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.15 1bvh h TYR 142 Cb 0.56 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.86 1bvh h TYR 142 CO -0.75 -0.14 -0.43 1.96 -1.64 0.00 0.00 178.16 177.17 1bvh h GLN 143 N 0.20 -0.88 0.00 1.82 1.08 0.52 0.44 115.11 118.29 1bvh h GLN 143 Ca 0.40 0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.66 1bvh h GLN 143 Cb 0.70 0.20 0.00 0.00 -0.05 0.00 0.00 27.48 28.33 1bvh h GLN 143 CO -0.55 -0.59 0.00 1.04 -0.95 0.00 0.00 178.83 177.78 1bvh n GLN 144 N -5.53 0.11 0.06 1.46 6.02 -0.62 -1.84 117.38 117.04 1bvh n GLN 144 Ca -0.12 0.22 -0.05 0.00 -0.01 0.00 0.00 57.00 57.05 1bvh n GLN 144 Cb 0.42 -1.50 -0.09 0.00 1.02 0.00 0.00 30.24 30.09 1bvh n GLN 144 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1bvh h VAL 146 N 0.00 1.12 0.00 0.00 2.07 -0.60 -2.46 116.25 116.38 1bvh h VAL 146 Ca -0.08 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 66.84 1bvh h VAL 146 Cb 1.72 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 33.02 1bvh h VAL 146 CO 0.10 0.15 0.00 0.03 0.02 0.00 0.00 177.57 177.87 1bvh h ARG 147 N -0.34 0.00 -0.39 1.57 3.08 -1.68 -2.78 114.38 113.85 1bvh h ARG 147 Ca -0.01 0.00 0.11 0.00 0.07 0.00 0.00 59.98 60.15 1bvh h ARG 147 Cb 0.30 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 1bvh h ARG 147 CO 0.01 0.00 0.47 0.00 -1.07 0.00 0.00 179.97 179.38 1bvh h ARG 150 N 0.00 -0.42 -0.11 0.00 2.43 -1.17 0.27 114.38 115.37 1bvh h ARG 150 Ca -0.21 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.02 1bvh h ARG 150 Cb 1.43 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 31.07 1bvh h ARG 150 CO -0.00 -0.11 0.31 0.00 -1.51 0.00 0.00 179.97 178.65 1bvh h ALA 151 N -0.65 1.53 0.00 2.80 0.00 -1.20 0.15 119.26 121.88 1bvh h ALA 151 Ca -0.04 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.58 1bvh h ALA 151 Cb 0.50 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 1bvh h ALA 151 CO 0.07 -0.36 -1.69 0.34 0.00 0.00 0.00 179.25 177.61 1bvh n PHE 152 N -3.20 0.99 0.17 0.00 -0.00 -1.11 -3.85 117.46 110.45 1bvh n PHE 152 Ca 0.00 0.35 0.05 0.00 -0.00 0.00 0.00 57.45 57.86 1bvh n PHE 152 Cb 0.39 -1.17 0.22 0.00 -0.00 0.00 0.00 39.48 38.92 1bvh n PHE 152 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 1bvh h LEU 153 N 0.00 0.00 -0.72 -2.13 5.85 0.14 -1.95 115.31 116.51 1bvh h LEU 153 Ca -0.28 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.31 1bvh h LEU 153 Cb 1.97 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.99 1bvh h LEU 153 CO 0.08 0.40 -0.56 1.05 -0.34 0.00 0.00 178.44 179.07 1bvh h GLU 154 N 0.00 0.24 0.16 1.25 4.11 -1.40 0.84 114.58 119.76 1bvh h GLU 154 Ca -0.00 -0.15 -0.24 0.00 0.07 0.00 0.00 59.36 59.04 1bvh h GLU 154 Cb 1.09 0.02 0.02 0.00 0.50 0.00 0.00 28.75 30.37 1bvh h GLU 154 CO 0.05 0.73 -1.10 -0.22 0.07 0.00 0.00 179.01 178.54 1bvh h LYS 155 N 0.18 0.33 -0.76 1.06 3.11 -1.64 -3.30 116.57 115.55 1bvh h LYS 155 Ca -0.00 -0.56 -0.28 0.00 -2.81 0.00 0.00 60.65 57.00 1bvh h LYS 155 Cb 1.04 0.21 -0.16 0.00 -1.00 0.00 0.00 32.23 32.32 1bvh h LYS 155 CO 0.09 1.27 0.33 1.33 -2.81 0.00 0.00 179.45 179.66 1bvh n VAL 156 N -3.99 2.97 0.49 2.00 0.24 -0.74 -5.14 118.33 114.15 1bvh n VAL 156 Ca -0.17 -1.78 0.04 0.00 -2.04 0.00 0.00 64.34 60.39 1bvh n VAL 156 Cb 0.90 -0.38 0.23 0.00 -1.47 0.00 0.00 33.84 33.12 1bvh n VAL 156 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55