#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b91 h LYS 2 N 0.00 0.00 -0.19 1.57 -0.00 -2.04 -2.86 116.57 113.05 2b91 h LYS 2 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 60.65 60.56 2b91 h LYS 2 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 32.23 32.17 2b91 h LYS 2 CO 0.00 0.19 -0.27 0.00 -0.00 0.00 0.00 179.45 179.37 2b91 s ASP 4 N -2.86 5.48 0.16 0.00 -1.08 -1.08 -4.92 116.67 112.37 2b91 s ASP 4 Ca 0.41 2.00 0.11 0.00 -0.52 0.00 0.00 52.55 54.55 2b91 s ASP 4 Cb 0.39 -2.55 0.60 0.00 -1.46 0.00 0.00 42.92 39.90 2b91 s ASP 4 CO -0.03 -1.38 1.34 2.30 0.52 0.00 0.00 175.17 177.92 2b91 n ILE 5 N -1.97 1.50 -0.17 4.11 -6.64 -1.26 -1.49 119.36 113.44 2b91 n ILE 5 Ca 0.10 0.62 0.29 0.00 -1.77 0.00 0.00 62.75 61.99 2b91 n ILE 5 Cb 0.52 -1.61 0.73 0.00 -1.44 0.00 0.00 39.64 37.83 2b91 n ILE 5 CO 0.00 0.00 0.00 0.74 -1.77 0.00 0.00 176.55 175.52 2b91 h THR 6 N 0.00 0.51 -0.69 7.28 2.02 -1.94 0.15 112.91 120.24 2b91 h THR 6 Ca 0.00 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.11 2b91 h THR 6 Cb 0.00 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 66.92 2b91 h THR 6 CO 0.00 0.00 0.15 -0.07 0.37 0.00 0.00 175.52 175.97 2b91 h LEU 7 N 0.00 1.06 -0.46 2.58 3.38 -1.63 -0.87 115.31 119.38 2b91 h LEU 7 Ca 0.42 -0.24 -0.13 0.00 0.09 0.00 0.00 57.88 58.02 2b91 h LEU 7 Cb 1.75 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 42.20 2b91 h LEU 7 CO -0.00 1.03 -0.23 -0.61 0.09 0.00 0.00 178.44 178.72 2b91 h GLN 8 N 1.04 0.96 -0.85 1.13 5.75 -0.96 -1.35 115.11 120.84 2b91 h GLN 8 Ca 0.21 -0.42 0.06 0.00 -0.15 0.00 0.00 58.65 58.35 2b91 h GLN 8 Cb 0.40 -0.03 -0.06 0.00 1.07 0.00 0.00 27.48 28.86 2b91 h GLN 8 CO 0.01 1.09 0.52 0.93 -2.65 0.00 0.00 178.83 178.73 2b91 h GLU 9 N 0.80 0.92 -0.19 1.69 4.39 -1.06 0.16 114.58 121.30 2b91 h GLU 9 Ca 0.10 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.73 2b91 h GLU 9 Cb 0.81 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 29.24 2b91 h GLU 9 CO 0.07 0.61 0.05 0.82 -1.16 0.00 0.00 179.01 179.39 2b91 h ILE 10 N 0.95 1.20 -0.38 3.13 2.04 -1.07 -2.50 117.51 120.88 2b91 h ILE 10 Ca 0.37 -0.65 -0.03 0.00 1.00 0.00 0.00 64.86 65.55 2b91 h ILE 10 Cb 0.18 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 2b91 h ILE 10 CO -0.18 0.20 0.10 0.40 0.00 0.00 0.00 178.15 178.68 2b91 h ILE 11 N 0.11 1.22 -0.68 -0.67 2.04 -0.88 0.36 117.51 119.00 2b91 h ILE 11 Ca 0.06 -0.74 0.09 0.00 1.00 0.00 0.00 64.86 65.27 2b91 h ILE 11 Cb 0.27 0.99 -0.07 0.00 -0.74 0.00 0.00 36.82 37.26 2b91 h ILE 11 CO 0.00 0.26 0.32 0.50 0.00 0.00 0.00 178.15 179.23 2b91 h LYS 12 N 0.47 0.54 -0.36 2.37 3.64 -0.74 0.19 116.57 122.67 2b91 h LYS 12 Ca 0.12 -0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 59.32 2b91 h LYS 12 Cb 0.29 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2b91 h LYS 12 CO -0.00 0.36 -0.36 1.15 -2.27 0.00 0.00 179.45 178.32 2b91 h THR 13 N 0.55 1.28 -0.54 1.00 2.02 -0.97 -2.48 112.91 113.78 2b91 h THR 13 Ca 0.34 -1.53 -0.08 0.00 0.77 0.00 0.00 66.41 65.91 2b91 h THR 13 Cb 0.37 1.43 -0.02 0.00 -1.74 0.00 0.00 68.15 68.19 2b91 h THR 13 CO -0.28 0.51 0.02 -0.07 0.37 0.00 0.00 175.52 176.08 2b91 h LEU 14 N 0.68 0.86 -1.28 2.58 3.38 -0.45 0.01 115.31 121.10 2b91 h LEU 14 Ca 0.06 -0.21 0.03 0.00 0.09 0.00 0.00 57.88 57.85 2b91 h LEU 14 Cb 0.95 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.43 2b91 h LEU 14 CO 0.09 0.91 0.50 0.78 0.09 0.00 0.00 178.44 180.81 2b91 h ASN 15 N 0.83 0.81 0.16 -0.43 2.35 -0.46 -0.10 115.58 118.74 2b91 h ASN 15 Ca 0.16 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.89 2b91 h ASN 15 Cb 0.46 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.65 2b91 h ASN 15 CO 0.02 0.56 -0.08 -1.28 -1.65 0.00 0.00 177.43 175.00 2b91 h SER 16 N 0.94 -0.18 -0.90 5.81 0.87 -1.00 -3.32 113.55 115.77 2b91 h SER 16 Ca 0.30 -0.32 0.23 0.00 -1.23 0.00 0.00 61.79 60.77 2b91 h SER 16 Cb 0.04 0.05 -0.16 0.00 -0.44 0.00 0.00 62.40 61.89 2b91 h SER 16 CO -0.09 0.39 0.02 -0.07 -0.53 0.00 0.00 176.83 176.55 2b91 h LEU 17 N -0.92 -0.41 0.00 2.23 3.38 -0.79 -0.75 115.31 118.04 2b91 h LEU 17 Ca -0.02 0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2b91 h LEU 17 Cb 0.49 0.42 0.00 0.00 0.09 0.00 0.00 40.66 41.66 2b91 h LEU 17 CO 0.04 -0.27 0.00 0.35 0.09 0.00 0.00 178.44 178.65 2b91 n THR 18 N -5.42 0.46 0.65 0.22 -2.24 -0.07 -1.81 114.28 106.07 2b91 n THR 18 Ca 0.19 0.11 0.10 0.00 -2.27 0.00 0.00 64.05 62.19 2b91 n THR 18 Cb 0.63 -0.77 0.12 0.00 -2.10 0.00 0.00 70.33 68.21 2b91 n THR 18 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2b91 n GLU 19 N -1.37 1.99 -3.81 -0.78 -0.58 -0.30 -4.91 120.64 110.87 2b91 n GLU 19 Ca 0.08 -1.85 -0.35 0.00 -0.42 0.00 0.00 57.16 54.62 2b91 n GLU 19 Cb 0.20 -1.41 -0.09 0.00 -0.57 0.00 0.00 31.44 29.57 2b91 n GLU 19 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2b91 s GLN 20 N -1.59 4.10 -0.08 3.49 -0.21 -0.75 -5.08 119.66 119.55 2b91 s GLN 20 Ca 0.27 -0.27 0.05 0.00 0.02 0.00 0.00 55.36 55.43 2b91 s GLN 20 Cb 0.18 -3.36 -0.01 0.00 1.00 0.00 0.00 33.01 30.82 2b91 s GLN 20 CO 0.26 0.26 -0.24 0.21 -2.12 0.00 0.00 175.29 173.66 2b91 s LYS 21 N 0.45 2.72 0.08 2.91 2.20 -1.26 -5.00 119.74 121.84 2b91 s LYS 21 Ca 0.06 -0.88 0.01 0.00 -0.36 0.00 0.00 55.97 54.80 2b91 s LYS 21 Cb -0.12 -2.19 -0.00 0.00 -1.51 0.00 0.00 37.83 34.01 2b91 s LYS 21 CO -0.01 0.29 0.03 0.25 -0.36 0.00 0.00 175.35 175.55 2b91 n THR 22 N 3.21 0.00 0.40 3.43 -2.24 -1.26 -5.00 114.28 112.82 2b91 n THR 22 Ca -0.18 -0.45 0.13 0.00 -2.27 0.00 0.00 64.05 61.27 2b91 n THR 22 Cb 0.52 0.17 0.51 0.00 -2.10 0.00 0.00 70.33 69.43 2b91 n THR 22 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2b91 h LEU 23 N 0.00 0.00 -2.19 3.22 3.38 -1.88 -3.34 115.31 114.51 2b91 h LEU 23 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2b91 h LEU 23 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2b91 h LEU 23 CO 0.09 0.00 -0.19 0.00 0.09 0.00 0.00 178.44 178.44 2b91 n THR 25 N -0.44 0.52 1.06 0.00 -2.24 -1.25 -2.21 114.28 109.71 2b91 n THR 25 Ca 0.04 0.13 0.12 0.00 -2.27 0.00 0.00 64.05 62.07 2b91 n THR 25 Cb 0.57 -0.77 0.16 0.00 -2.10 0.00 0.00 70.33 68.19 2b91 n THR 25 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2b91 n GLU 26 N -1.47 0.40 -1.59 -0.78 -0.58 -1.26 -1.15 120.64 114.21 2b91 n GLU 26 Ca 0.06 -0.28 -0.33 0.00 -0.42 0.00 0.00 57.16 56.19 2b91 n GLU 26 Cb 0.23 -1.49 0.07 0.00 -0.57 0.00 0.00 31.44 29.68 2b91 n GLU 26 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2b91 s LEU 27 N -2.79 3.31 0.21 -4.62 1.43 -0.94 -4.55 118.68 110.73 2b91 s LEU 27 Ca 0.15 2.07 0.05 0.00 -1.03 0.00 0.00 54.13 55.36 2b91 s LEU 27 Cb 0.18 -4.56 -0.03 0.00 0.03 0.00 0.00 46.19 41.81 2b91 s LEU 27 CO 0.67 -1.88 0.31 0.42 0.23 0.00 0.00 176.35 176.11 2b91 s THR 28 N -2.33 5.13 0.16 5.49 -4.23 -1.26 -1.14 115.64 117.45 2b91 s THR 28 Ca 0.68 -0.97 0.09 0.00 -1.18 0.00 0.00 61.69 60.30 2b91 s THR 28 Cb -0.22 -3.74 -0.04 0.00 1.34 0.00 0.00 72.50 69.84 2b91 s THR 28 CO 0.44 -0.26 -0.19 0.68 -0.54 0.00 0.00 174.62 174.76 2b91 s VAL 29 N -1.93 1.83 0.17 2.29 -7.23 0.21 -4.80 120.40 110.94 2b91 s VAL 29 Ca 0.34 -1.87 -0.33 0.00 -1.81 0.00 0.00 61.98 58.31 2b91 s VAL 29 Cb -0.09 -1.82 -0.13 0.00 0.56 0.00 0.00 36.38 34.90 2b91 s VAL 29 CO 0.28 -0.27 1.69 0.41 -0.31 0.00 0.00 175.10 176.89 2b91 n THR 30 N 0.39 0.06 -2.61 5.32 -1.04 -1.26 -1.26 114.28 113.89 2b91 n THR 30 Ca -0.14 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.05 61.44 2b91 n THR 30 Cb 0.57 -1.82 -0.01 0.00 -1.82 0.00 0.00 70.33 67.24 2b91 n THR 30 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2b91 s ASP 31 N 1.34 6.71 0.59 8.00 2.15 0.16 -4.79 116.67 130.82 2b91 s ASP 31 Ca 0.78 -2.06 0.28 0.00 0.43 0.00 0.00 52.55 51.99 2b91 s ASP 31 Cb -0.58 -2.56 1.61 0.00 -0.30 0.00 0.00 42.92 41.09 2b91 s ASP 31 CO 0.36 -1.28 2.06 0.16 -0.17 0.00 0.00 175.17 176.30 2b91 h ILE 32 N 6.03 0.47 -0.23 4.11 3.07 -1.90 -2.01 117.51 127.06 2b91 h ILE 32 Ca 0.33 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.74 2b91 h ILE 32 Cb 0.93 0.80 0.00 0.00 -0.27 0.00 0.00 36.82 38.28 2b91 h ILE 32 CO 1.42 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 179.01 2b91 n PHE 33 N -3.82 0.76 0.62 0.16 3.72 -1.26 -3.50 117.46 114.14 2b91 n PHE 33 Ca 0.03 -0.27 0.11 0.00 -0.05 0.00 0.00 57.45 57.27 2b91 n PHE 33 Cb 0.39 -0.24 0.14 0.00 -0.94 0.00 0.00 39.48 38.83 2b91 n PHE 33 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2b91 n ALA 34 N 0.25 2.44 -1.39 4.37 0.00 -0.76 -4.94 120.51 120.47 2b91 n ALA 34 Ca 0.11 -0.81 -0.33 0.00 0.00 0.00 0.00 53.44 52.41 2b91 n ALA 34 Cb 0.58 -0.76 0.07 0.00 0.00 0.00 0.00 19.45 19.34 2b91 n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b91 s ALA 35 N -1.62 2.32 -0.04 0.00 0.00 -1.23 -4.93 121.76 116.25 2b91 s ALA 35 Ca 0.30 0.55 -0.02 0.00 0.00 0.00 0.00 51.96 52.78 2b91 s ALA 35 Cb 0.19 -3.34 -0.07 0.00 0.00 0.00 0.00 23.12 19.90 2b91 s ALA 35 CO 0.28 -1.55 2.59 -1.13 0.00 0.00 0.00 175.76 175.95 2b91 n SER 36 N -2.78 5.44 -1.69 0.00 3.41 -1.26 -4.88 113.62 111.87 2b91 n SER 36 Ca 0.11 -2.52 -0.13 0.00 -0.26 0.00 0.00 58.87 56.07 2b91 n SER 36 Cb 0.52 -1.23 0.01 0.00 -0.26 0.00 0.00 64.21 63.25 2b91 n SER 36 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2b91 n LYS 37 N 1.73 -2.01 -2.24 4.33 4.01 -1.26 -4.95 118.16 117.77 2b91 n LYS 37 Ca 0.19 0.58 -0.33 0.00 -0.51 0.00 0.00 58.31 58.24 2b91 n LYS 37 Cb 0.65 -4.75 0.02 0.00 -0.51 0.00 0.00 35.03 30.44 2b91 n LYS 37 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 2b91 n ASN 38 N -0.63 6.06 -3.85 4.39 6.94 -1.26 -4.99 115.26 121.92 2b91 n ASN 38 Ca -0.11 -3.77 -0.12 0.00 -0.02 0.00 0.00 54.58 50.56 2b91 n ASN 38 Cb 0.59 -0.76 -0.10 0.00 -2.36 0.00 0.00 39.78 37.15 2b91 n ASN 38 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2b91 s THR 39 N -5.27 0.06 1.01 5.53 -4.23 -1.26 -5.15 115.64 106.32 2b91 s THR 39 Ca 0.50 -0.52 -0.11 0.00 -1.18 0.00 0.00 61.69 60.37 2b91 s THR 39 Cb 0.41 -0.41 0.20 0.00 1.34 0.00 0.00 72.50 74.04 2b91 s THR 39 CO -0.29 -0.29 1.10 0.42 -0.54 0.00 0.00 174.62 175.02 2b91 s THR 40 N -1.05 2.09 0.21 3.99 -4.23 -1.26 -4.76 115.64 110.62 2b91 s THR 40 Ca -0.11 0.03 -0.10 0.00 -1.18 0.00 0.00 61.69 60.33 2b91 s THR 40 Cb -0.06 -2.08 0.14 0.00 1.34 0.00 0.00 72.50 71.83 2b91 s THR 40 CO 0.01 -0.04 1.83 -0.08 -0.54 0.00 0.00 174.62 175.81 2b91 h GLU 41 N -2.14 0.76 -0.46 3.99 4.81 -2.01 -1.33 114.58 118.20 2b91 h GLU 41 Ca -0.50 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 58.62 2b91 h GLU 41 Cb 1.29 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.48 2b91 h GLU 41 CO 0.45 0.50 0.03 0.87 -0.73 0.00 0.00 179.01 180.14 2b91 h LYS 42 N 0.78 0.73 -0.47 1.92 1.57 -1.90 -0.76 116.57 118.45 2b91 h LYS 42 Ca 0.28 -0.18 -0.11 0.00 -1.87 0.00 0.00 60.65 58.77 2b91 h LYS 42 Cb 0.07 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 2b91 h LYS 42 CO -0.13 0.73 -0.16 1.49 -0.57 0.00 0.00 179.45 180.81 2b91 h GLU 43 N 0.70 0.90 -0.30 3.15 4.81 -1.77 -0.33 114.58 121.73 2b91 h GLU 43 Ca 0.14 -0.34 -0.03 0.00 -0.13 0.00 0.00 59.36 59.00 2b91 h GLU 43 Cb 0.38 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 2b91 h GLU 43 CO 0.01 0.99 0.06 1.15 -0.73 0.00 0.00 179.01 180.49 2b91 h THR 44 N 0.80 1.23 -0.61 0.32 2.02 -0.67 -0.47 112.91 115.52 2b91 h THR 44 Ca 0.12 -0.78 -0.02 0.00 0.77 0.00 0.00 66.41 66.50 2b91 h THR 44 Cb 0.69 1.17 -0.03 0.00 -1.74 0.00 0.00 68.15 68.24 2b91 h THR 44 CO 0.05 0.26 0.29 -0.26 0.37 0.00 0.00 175.52 176.23 2b91 h PHE 45 N 0.32 0.88 -0.66 3.16 0.04 -1.05 -0.80 116.94 118.84 2b91 h PHE 45 Ca 0.09 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.82 2b91 h PHE 45 Cb 0.33 -0.27 -0.03 0.00 2.20 0.00 0.00 35.95 38.17 2b91 h PHE 45 CO 0.02 0.67 0.42 0.00 -0.60 0.00 0.00 178.31 178.82 2b91 h ARG 47 N 0.89 0.65 -0.40 0.00 3.08 -0.79 0.12 114.38 117.94 2b91 h ARG 47 Ca 0.24 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 2b91 h ARG 47 Cb -0.07 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 2b91 h ARG 47 CO -0.05 0.73 0.22 0.00 -1.07 0.00 0.00 179.97 179.80 2b91 h ALA 48 N 0.89 0.52 -0.18 0.04 0.00 -0.97 -2.15 119.26 117.41 2b91 h ALA 48 Ca 0.11 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2b91 h ALA 48 Cb 0.42 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2b91 h ALA 48 CO 0.01 0.05 -0.05 0.00 0.00 0.00 0.00 179.25 179.25 2b91 h ALA 49 N 1.07 1.58 -0.12 0.00 0.00 -0.78 -1.76 119.26 119.26 2b91 h ALA 49 Ca 0.14 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2b91 h ALA 49 Cb 0.06 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2b91 h ALA 49 CO -0.02 0.30 -0.04 1.15 0.00 0.00 0.00 179.25 180.64 2b91 h THR 50 N 0.26 1.31 -0.03 0.00 2.02 -0.53 -1.84 112.91 114.10 2b91 h THR 50 Ca 0.06 -1.03 -0.14 0.00 0.77 0.00 0.00 66.41 66.07 2b91 h THR 50 Cb 0.27 1.74 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 2b91 h THR 50 CO 0.01 0.29 -0.62 -0.37 0.37 0.00 0.00 175.52 175.21 2b91 h VAL 51 N -0.10 1.42 -0.48 3.16 -1.51 -1.07 -1.86 116.25 115.81 2b91 h VAL 51 Ca 0.03 -2.07 -0.12 0.00 -1.23 0.00 0.00 66.70 63.30 2b91 h VAL 51 Cb 0.48 2.09 -0.02 0.00 -2.13 0.00 0.00 31.29 31.72 2b91 h VAL 51 CO 0.01 0.60 -0.17 -0.07 -1.23 0.00 0.00 177.57 176.71 2b91 h LEU 52 N 0.08 0.96 -0.43 4.19 3.38 -1.35 -1.54 115.31 120.61 2b91 h LEU 52 Ca -0.01 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.60 2b91 h LEU 52 Cb 1.11 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 2b91 h LEU 52 CO 0.09 1.11 0.18 -0.09 0.09 0.00 0.00 178.44 179.81 2b91 h ARG 53 N 0.83 0.63 -0.36 1.13 2.43 -1.11 -0.72 114.38 117.21 2b91 h ARG 53 Ca 0.12 -0.11 0.08 0.00 -0.81 0.00 0.00 59.98 59.25 2b91 h ARG 53 Cb 0.73 -0.10 -0.08 0.00 -0.42 0.00 0.00 29.97 30.10 2b91 h ARG 53 CO 0.06 0.57 -0.15 1.96 -1.51 0.00 0.00 179.97 180.90 2b91 h GLN 54 N 0.54 -0.08 0.71 0.20 4.20 -1.23 -1.12 115.11 118.33 2b91 h GLN 54 Ca 0.14 0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.83 2b91 h GLN 54 Cb 0.17 0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.97 2b91 h GLN 54 CO -0.01 -0.05 -0.37 0.35 -0.67 0.00 0.00 178.83 178.08 2b91 h PHE 55 N -0.08 -0.97 -0.09 2.96 3.04 -0.78 -1.30 116.94 119.72 2b91 h PHE 55 Ca 0.18 -0.02 -0.05 0.00 3.98 0.00 0.00 57.97 62.06 2b91 h PHE 55 Cb 0.35 0.33 -0.01 0.00 2.56 0.00 0.00 35.95 39.18 2b91 h PHE 55 CO -0.37 -0.58 -0.17 0.10 -2.02 0.00 0.00 178.31 175.26 2b91 h TYR 56 N -0.99 0.15 -0.55 0.41 -0.00 -1.13 -1.09 116.97 113.76 2b91 h TYR 56 Ca -0.09 -0.02 -0.07 0.00 0.00 0.00 0.00 58.73 58.55 2b91 h TYR 56 Cb 0.78 -0.04 -0.02 0.00 0.00 0.00 0.00 36.73 37.44 2b91 h TYR 56 CO -0.05 0.32 0.07 0.77 -0.00 0.00 0.00 178.16 179.27 2b91 h SER 57 N 0.14 0.89 0.86 0.10 0.02 -1.08 -1.28 113.55 113.21 2b91 h SER 57 Ca 0.03 -0.27 -0.19 0.00 -0.84 0.00 0.00 61.79 60.52 2b91 h SER 57 Cb 0.39 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.67 2b91 h SER 57 CO 0.03 0.94 -0.88 0.45 -1.14 0.00 0.00 176.83 176.22 2b91 h HIS 58 N 0.81 0.02 -0.01 3.45 3.86 -0.86 -3.37 115.15 119.05 2b91 h HIS 58 Ca 0.16 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.36 2b91 h HIS 58 Cb 0.44 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.91 2b91 h HIS 58 CO 0.03 0.88 -0.25 0.72 0.86 0.00 0.00 177.93 180.18 2b91 n HIS 59 N -3.51 0.00 -0.37 2.45 8.25 -0.45 -4.32 115.22 117.28 2b91 n HIS 59 Ca -0.01 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.48 2b91 n HIS 59 Cb 0.84 0.00 0.18 0.00 1.12 0.00 0.00 29.99 32.12 2b91 n HIS 59 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2b91 h GLU 60 N 0.80 1.12 -0.15 -0.41 4.81 -1.40 -2.60 114.58 116.75 2b91 h GLU 60 Ca 0.00 -0.07 -0.07 0.00 -0.13 0.00 0.00 59.36 59.09 2b91 h GLU 60 Cb 0.29 -0.25 -0.04 0.00 0.63 0.00 0.00 28.75 29.38 2b91 h GLU 60 CO 0.00 0.74 -0.32 1.63 -0.73 0.00 0.00 179.01 180.33 2b91 n LYS 61 N -4.52 1.69 -2.75 1.92 5.02 -1.26 -4.87 118.16 113.40 2b91 n LYS 61 Ca 0.16 -3.25 -0.42 0.00 -2.02 0.00 0.00 58.31 52.77 2b91 n LYS 61 Cb 0.20 -1.70 -0.03 0.00 -0.02 0.00 0.00 35.03 33.48 2b91 n LYS 61 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2b91 s ASP 62 N -2.95 7.15 0.55 4.39 -1.08 -0.98 -4.94 116.67 118.81 2b91 s ASP 62 Ca 0.41 1.41 0.27 0.00 -0.52 0.00 0.00 52.55 54.12 2b91 s ASP 62 Cb 0.38 -2.52 1.45 0.00 -1.46 0.00 0.00 42.92 40.77 2b91 s ASP 62 CO -0.04 -0.45 1.97 0.74 0.52 0.00 0.00 175.17 177.91 2b91 h THR 63 N 5.15 0.62 0.00 1.71 2.02 -1.95 0.40 112.91 120.86 2b91 h THR 63 Ca -0.30 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 66.86 2b91 h THR 63 Cb 1.14 0.69 -0.00 0.00 -1.74 0.00 0.00 68.15 68.23 2b91 h THR 63 CO 0.86 0.00 -0.09 0.03 0.37 0.00 0.00 175.52 176.69 2b91 h ARG 64 N 0.00 0.00 0.00 6.66 3.08 -1.95 -3.34 114.38 118.83 2b91 h ARG 64 Ca 0.27 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.29 2b91 h ARG 64 Cb 1.13 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.18 2b91 h ARG 64 CO -0.00 0.09 -1.56 0.00 -1.07 0.00 0.00 179.97 177.42 2b91 h LEU 66 N 0.00 0.44 0.00 0.00 3.38 -1.45 -3.44 115.31 114.24 2b91 h LEU 66 Ca -0.04 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2b91 h LEU 66 Cb 0.70 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.34 2b91 h LEU 66 CO 0.00 0.50 0.00 0.61 0.09 0.00 0.00 178.44 179.64 2b91 n GLY 67 N -0.96 2.37 0.13 0.83 0.00 -1.26 -3.87 105.19 102.43 2b91 n GLY 67 Ca 0.01 -1.67 -0.22 0.00 0.00 0.00 0.00 46.02 44.15 2b91 n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b91 h ALA 68 N 0.00 0.29 -1.72 4.61 0.00 -1.93 -3.44 119.26 117.07 2b91 h ALA 68 Ca 0.00 -1.22 -0.43 0.00 0.00 0.00 0.00 54.91 53.25 2b91 h ALA 68 Cb 0.00 0.62 0.02 0.00 0.00 0.00 0.00 17.79 18.43 2b91 h ALA 68 CO 0.00 0.96 -0.23 0.95 0.00 0.00 0.00 179.25 180.93 2b91 s THR 69 N -2.48 3.48 0.18 0.00 -4.23 -1.26 -4.94 115.64 106.39 2b91 s THR 69 Ca -0.23 -0.88 -0.13 0.00 -1.18 0.00 0.00 61.69 59.28 2b91 s THR 69 Cb 0.05 -3.22 0.09 0.00 1.34 0.00 0.00 72.50 70.76 2b91 s THR 69 CO 0.73 -0.10 1.82 0.00 -0.54 0.00 0.00 174.62 176.52 2b91 h ALA 70 N 0.61 0.71 -0.80 3.99 0.00 -1.99 -1.39 119.26 120.40 2b91 h ALA 70 Ca -0.43 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 2b91 h ALA 70 Cb 1.27 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.87 2b91 h ALA 70 CO 0.51 0.03 0.41 0.37 0.00 0.00 0.00 179.25 180.57 2b91 h GLN 71 N 0.64 1.12 -0.35 0.00 4.15 -1.99 0.67 115.11 119.35 2b91 h GLN 71 Ca 0.23 -0.14 -0.12 0.00 0.77 0.00 0.00 58.65 59.39 2b91 h GLN 71 Cb 0.04 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.51 2b91 h GLN 71 CO -0.11 0.84 -0.23 1.96 -1.93 0.00 0.00 178.83 179.36 2b91 h GLN 72 N 1.12 0.78 -0.20 1.69 4.20 -1.85 -1.25 115.11 119.60 2b91 h GLN 72 Ca 0.28 -0.37 -0.03 0.00 0.06 0.00 0.00 58.65 58.60 2b91 h GLN 72 Cb 0.06 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 2b91 h GLN 72 CO -0.04 0.99 0.01 0.35 -0.67 0.00 0.00 178.83 179.47 2b91 h PHE 73 N 0.56 0.36 -0.47 2.96 3.57 -1.02 -1.36 116.94 121.54 2b91 h PHE 73 Ca 0.07 -0.06 0.09 0.00 3.53 0.00 0.00 57.97 61.60 2b91 h PHE 73 Cb 0.79 -0.10 -0.07 0.00 2.79 0.00 0.00 35.95 39.36 2b91 h PHE 73 CO 0.06 0.51 0.04 1.25 -2.23 0.00 0.00 178.31 177.94 2b91 h HIS 74 N 0.11 0.04 -0.43 0.41 2.76 -0.82 -0.97 115.15 116.24 2b91 h HIS 74 Ca 0.06 0.03 -0.07 0.00 -2.20 0.00 0.00 60.37 58.19 2b91 h HIS 74 Cb 0.36 0.05 -0.02 0.00 1.55 0.00 0.00 27.41 29.35 2b91 h HIS 74 CO 0.03 -0.07 -0.03 0.00 -1.30 0.00 0.00 177.93 176.56 2b91 h ARG 75 N 0.15 0.72 -0.05 5.26 3.08 -1.08 0.41 114.38 122.87 2b91 h ARG 75 Ca 0.24 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2b91 h ARG 75 Cb 0.34 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 2b91 h ARG 75 CO -0.36 0.75 0.03 1.25 -1.07 0.00 0.00 179.97 180.57 2b91 h HIS 76 N 0.67 0.06 -0.45 3.04 2.76 -0.82 -0.87 115.15 119.54 2b91 h HIS 76 Ca 0.13 0.00 -0.11 0.00 -2.20 0.00 0.00 60.37 58.19 2b91 h HIS 76 Cb 0.45 -0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.38 2b91 h HIS 76 CO 0.02 0.05 -0.16 0.87 -1.30 0.00 0.00 177.93 177.42 2b91 h LYS 77 N 0.05 0.86 -0.49 5.26 1.57 -0.81 -0.90 116.57 122.10 2b91 h LYS 77 Ca 0.02 -0.32 -0.04 0.00 -1.87 0.00 0.00 60.65 58.44 2b91 h LYS 77 Cb 0.01 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 2b91 h LYS 77 CO -0.00 0.95 0.16 0.37 -0.57 0.00 0.00 179.45 180.36 2b91 h GLN 78 N 0.76 0.77 -0.22 3.15 4.15 -0.88 -0.73 115.11 122.10 2b91 h GLN 78 Ca 0.12 -0.16 -0.00 0.00 0.77 0.00 0.00 58.65 59.37 2b91 h GLN 78 Cb 0.68 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.25 2b91 h GLN 78 CO 0.05 0.72 0.12 1.25 -1.93 0.00 0.00 178.83 179.04 2b91 h LEU 79 N 0.67 0.27 -0.56 -2.39 5.85 -0.88 -1.30 115.31 116.97 2b91 h LEU 79 Ca 0.16 -0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.83 2b91 h LEU 79 Cb 0.27 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 2b91 h LEU 79 CO -0.01 0.28 0.31 0.40 -0.34 0.00 0.00 178.44 179.09 2b91 h ILE 80 N 0.25 1.01 -0.43 4.05 1.08 -1.08 -0.65 117.51 121.74 2b91 h ILE 80 Ca 0.08 -0.21 0.04 0.00 -0.39 0.00 0.00 64.86 64.38 2b91 h ILE 80 Cb 0.07 0.35 -0.04 0.00 -3.07 0.00 0.00 36.82 34.12 2b91 h ILE 80 CO -0.01 0.11 0.19 -0.09 -0.69 0.00 0.00 178.15 177.66 2b91 h ARG 81 N 0.61 0.38 -0.23 2.37 2.43 -0.96 -1.10 114.38 117.88 2b91 h ARG 81 Ca 0.24 -0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 59.22 2b91 h ARG 81 Cb 0.09 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 2b91 h ARG 81 CO -0.13 0.25 -0.52 -0.44 -1.51 0.00 0.00 179.97 177.61 2b91 h ASP 82 N 0.39 0.73 -0.75 -3.80 3.32 -0.99 -1.49 116.42 113.83 2b91 h ASP 82 Ca 0.19 -0.38 -0.04 0.00 0.02 0.00 0.00 57.03 56.82 2b91 h ASP 82 Cb 0.13 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.43 2b91 h ASP 82 CO -0.15 1.12 0.32 -0.07 -1.72 0.00 0.00 179.24 178.74 2b91 h LEU 83 N 0.52 1.01 -0.49 1.55 3.38 -0.91 0.67 115.31 121.02 2b91 h LEU 83 Ca 0.02 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.74 2b91 h LEU 83 Cb 1.08 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 2b91 h LEU 83 CO 0.11 0.89 -0.03 0.11 0.09 0.00 0.00 178.44 179.61 2b91 h LYS 84 N 1.06 0.89 -0.70 1.13 1.57 -0.99 0.50 116.57 120.03 2b91 h LYS 84 Ca 0.25 -0.30 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 2b91 h LYS 84 Cb 0.18 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.38 2b91 h LYS 84 CO -0.03 0.94 0.36 0.00 -0.57 0.00 0.00 179.45 180.15 2b91 h ALA 85 N 0.92 0.90 -0.11 3.86 0.00 -1.08 0.11 119.26 123.87 2b91 h ALA 85 Ca 0.14 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2b91 h ALA 85 Cb 0.55 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2b91 h ALA 85 CO 0.03 0.45 0.04 1.25 0.00 0.00 0.00 179.25 181.02 2b91 h LEU 86 N 0.97 0.15 -0.40 0.00 5.85 -0.76 -2.50 115.31 118.62 2b91 h LEU 86 Ca 0.24 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.81 2b91 h LEU 86 Cb 0.08 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 2b91 h LEU 86 CO -0.03 0.27 0.25 -0.78 -0.34 0.00 0.00 178.44 177.81 2b91 h ASP 87 N 0.01 0.42 -0.71 1.25 3.58 -0.72 -0.82 116.42 119.43 2b91 h ASP 87 Ca 0.04 -0.00 0.07 0.00 0.42 0.00 0.00 57.03 57.55 2b91 h ASP 87 Cb 0.17 -0.09 -0.06 0.00 1.72 0.00 0.00 39.33 41.07 2b91 h ASP 87 CO -0.00 0.30 0.40 -0.09 -2.88 0.00 0.00 179.24 176.97 2b91 h ARG 88 N 0.51 0.70 -0.58 0.28 2.43 -0.69 -0.77 114.38 116.26 2b91 h ARG 88 Ca 0.16 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.21 2b91 h ARG 88 Cb -0.02 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.35 2b91 h ARG 88 CO -0.06 0.46 0.08 -0.91 -1.51 0.00 0.00 179.97 178.03 2b91 h ASN 89 N 0.72 0.94 -0.46 -3.80 2.35 -1.12 -2.23 115.58 111.99 2b91 h ASN 89 Ca 0.32 -0.27 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2b91 h ASN 89 Cb 0.22 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 2b91 h ASN 89 CO -0.20 0.97 0.27 -0.07 -1.65 0.00 0.00 177.43 176.75 2b91 h LEU 90 N 0.87 0.56 -1.07 1.61 3.38 -0.72 -1.25 115.31 118.70 2b91 h LEU 90 Ca 0.18 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 2b91 h LEU 90 Cb 0.44 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2b91 h LEU 90 CO 0.01 0.46 0.08 -0.50 0.09 0.00 0.00 178.44 178.58 2b91 h TRP 91 N 0.60 0.77 -0.84 1.13 -0.00 -1.15 0.21 115.95 116.67 2b91 h TRP 91 Ca 0.16 -0.08 -0.03 0.00 -0.00 0.00 0.00 58.89 58.95 2b91 h TRP 91 Cb 0.02 -0.22 -0.04 0.00 -0.00 0.00 0.00 29.16 28.92 2b91 h TRP 91 CO -0.03 0.68 0.42 0.78 -0.00 0.00 0.00 178.44 180.29 2b91 h GLY 92 N 0.93 1.29 1.06 1.49 0.00 -1.03 -2.57 103.07 104.24 2b91 h GLY 92 Ca 0.15 -0.63 -0.20 0.00 0.00 0.00 0.00 47.33 46.66 2b91 h GLY 92 CO 0.00 0.60 -0.70 -2.00 0.00 0.00 0.00 176.54 174.44 2b91 h LEU 93 N 1.20 0.81 -1.03 3.11 5.85 -0.60 -3.29 115.31 121.36 2b91 h LEU 93 Ca 0.29 -0.65 -0.00 0.00 0.84 0.00 0.00 57.88 58.36 2b91 h LEU 93 Cb 0.10 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.84 2b91 h LEU 93 CO -0.04 1.34 0.56 0.00 -0.34 0.00 0.00 178.44 179.96 2b91 h ALA 94 N 0.50 1.28 -5.69 1.25 0.00 -0.48 -3.47 119.26 112.64 2b91 h ALA 94 Ca -0.05 -0.09 -0.43 0.00 0.00 0.00 0.00 54.91 54.33 2b91 h ALA 94 Cb 1.34 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2b91 h ALA 94 CO 0.14 0.63 -0.67 0.41 0.00 0.00 0.00 179.25 179.77 2b91 n GLY 95 N -1.29 -0.50 3.64 0.00 0.00 -0.98 -4.76 105.19 101.30 2b91 n GLY 95 Ca 0.10 0.16 -0.05 0.00 0.00 0.00 0.00 46.02 46.23 2b91 n GLY 95 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2b91 s LEU 96 N -6.95 -0.65 0.00 0.99 2.96 -1.26 -5.04 118.68 108.73 2b91 s LEU 96 Ca 0.52 1.06 0.13 0.00 -0.22 0.00 0.00 54.13 55.62 2b91 s LEU 96 Cb -0.26 1.98 -0.05 0.00 0.50 0.00 0.00 46.19 48.37 2b91 s LEU 96 CO 0.64 -0.17 0.66 0.59 -1.32 0.00 0.00 176.35 176.76 2b91 n ASN 97 N 3.73 1.13 -4.20 3.68 4.13 -1.26 -4.73 115.26 117.75 2b91 n ASN 97 Ca -0.18 -1.07 -0.39 0.00 1.68 0.00 0.00 54.58 54.62 2b91 n ASN 97 Cb 0.58 0.64 -0.10 0.00 -1.54 0.00 0.00 39.78 39.37 2b91 n ASN 97 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2b91 s SER 98 N -1.79 5.54 -0.32 6.41 1.04 -1.26 -5.00 113.70 118.32 2b91 s SER 98 Ca 0.09 -1.85 0.04 0.00 0.48 0.00 0.00 55.95 54.71 2b91 s SER 98 Cb 0.10 -1.95 0.17 0.00 0.10 0.00 0.00 66.02 64.45 2b91 s SER 98 CO 0.38 -0.61 0.48 0.00 0.98 0.00 0.00 173.24 174.48 2b91 n PRO 100 N 5.07 2.58 -4.11 0.00 -0.02 -1.26 -4.76 135.00 132.50 2b91 n PRO 100 Ca 0.05 0.91 -0.33 0.00 -2.02 0.00 0.00 63.50 62.11 2b91 n PRO 100 Cb 0.51 -2.64 -0.16 0.00 -0.02 0.00 0.00 33.50 31.19 2b91 n PRO 100 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2b91 s VAL 101 N -1.13 2.07 -1.06 -1.45 -7.23 -1.26 -5.01 120.40 105.32 2b91 s VAL 101 Ca 0.54 -1.07 0.10 0.00 -1.81 0.00 0.00 61.98 59.74 2b91 s VAL 101 Cb -0.48 -1.93 0.20 0.00 0.56 0.00 0.00 36.38 34.73 2b91 s VAL 101 CO 0.63 0.42 1.06 0.29 -0.31 0.00 0.00 175.10 177.19 2b91 n LYS 102 N 4.59 1.80 -2.07 4.82 5.02 -1.26 -5.03 118.16 126.03 2b91 n LYS 102 Ca -0.19 -1.62 -0.39 0.00 -2.02 0.00 0.00 58.31 54.08 2b91 n LYS 102 Cb 0.48 -1.23 -0.00 0.00 -0.02 0.00 0.00 35.03 34.26 2b91 n LYS 102 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2b91 s GLU 103 N -0.94 3.94 -0.14 1.97 8.01 -1.26 -4.94 118.70 125.34 2b91 s GLU 103 Ca 0.18 2.12 -0.21 0.00 0.01 0.00 0.00 54.97 57.06 2b91 s GLU 103 Cb 0.10 -2.72 -0.25 0.00 -4.31 0.00 0.00 34.13 26.95 2b91 s GLU 103 CO 0.14 -0.50 0.54 0.00 0.01 0.00 0.00 175.26 175.45 2b91 h ALA 104 N 2.62 0.13 -1.86 5.21 0.00 -1.96 -3.45 119.26 119.96 2b91 h ALA 104 Ca -0.50 -0.93 -0.64 0.00 0.00 0.00 0.00 54.91 52.84 2b91 h ALA 104 Cb 1.25 0.40 0.07 0.00 0.00 0.00 0.00 17.79 19.51 2b91 h ALA 104 CO 0.62 0.53 0.38 -1.71 0.00 0.00 0.00 179.25 179.07 2b91 n ASN 105 N -4.27 1.69 -4.61 0.00 5.15 -1.26 -4.81 115.26 107.16 2b91 n ASN 105 Ca -0.22 1.14 -0.34 0.00 -0.60 0.00 0.00 54.58 54.55 2b91 n ASN 105 Cb 0.72 -1.25 -0.10 0.00 -0.53 0.00 0.00 39.78 38.61 2b91 n ASN 105 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2b91 s GLN 106 N -0.19 3.51 0.28 1.20 -1.52 -1.26 -0.67 119.66 121.02 2b91 s GLN 106 Ca 0.74 -0.42 0.11 0.00 -1.95 0.00 0.00 55.36 53.84 2b91 s GLN 106 Cb -0.83 -2.96 -0.05 0.00 -0.22 0.00 0.00 33.01 28.95 2b91 s GLN 106 CO 0.50 0.42 -0.11 -1.54 -0.25 0.00 0.00 175.29 174.31 2b91 s SER 107 N -0.10 3.96 0.67 5.90 1.04 -0.39 -4.86 113.70 119.92 2b91 s SER 107 Ca 0.04 -0.90 -0.17 0.00 0.48 0.00 0.00 55.95 55.40 2b91 s SER 107 Cb -0.13 -0.50 0.00 0.00 0.10 0.00 0.00 66.02 65.49 2b91 s SER 107 CO 0.02 -0.00 1.28 0.42 0.98 0.00 0.00 173.24 175.93 2b91 s THR 108 N -2.45 2.05 0.26 2.02 -4.23 -1.26 -0.62 115.64 111.41 2b91 s THR 108 Ca 0.31 0.03 -0.02 0.00 -1.18 0.00 0.00 61.69 60.83 2b91 s THR 108 Cb -0.05 -2.93 0.24 0.00 1.34 0.00 0.00 72.50 71.10 2b91 s THR 108 CO 0.17 -0.01 1.80 0.25 -0.54 0.00 0.00 174.62 176.29 2b91 h LEU 109 N 0.36 0.69 -0.37 4.79 5.85 -0.89 -1.19 115.31 124.54 2b91 h LEU 109 Ca -0.50 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.31 2b91 h LEU 109 Cb 1.33 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 42.27 2b91 h LEU 109 CO 0.52 0.35 0.19 -0.08 -0.34 0.00 0.00 178.44 179.08 2b91 h GLU 110 N 0.78 0.37 -0.59 1.25 4.81 -1.42 -1.03 114.58 118.76 2b91 h GLU 110 Ca 0.44 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.55 2b91 h GLU 110 Cb 0.49 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 2b91 h GLU 110 CO -0.29 0.25 -0.02 -0.91 -0.73 0.00 0.00 179.01 177.30 2b91 h ASN 111 N 0.38 1.03 -0.32 1.04 -0.26 -1.73 -2.51 115.58 113.21 2b91 h ASN 111 Ca 0.15 -0.30 0.02 0.00 -0.56 0.00 0.00 56.30 55.62 2b91 h ASN 111 Cb 0.06 -0.28 -0.03 0.00 -1.06 0.00 0.00 38.32 37.01 2b91 h ASN 111 CO -0.10 1.09 0.15 0.15 -1.06 0.00 0.00 177.43 177.66 2b91 h PHE 112 N 0.95 0.28 -0.59 1.19 3.04 -0.81 -1.90 116.94 119.11 2b91 h PHE 112 Ca 0.16 0.01 -0.10 0.00 3.98 0.00 0.00 57.97 62.03 2b91 h PHE 112 Cb 0.58 -0.08 -0.02 0.00 2.56 0.00 0.00 35.95 38.99 2b91 h PHE 112 CO 0.04 0.15 -0.03 -0.07 -2.02 0.00 0.00 178.31 176.38 2b91 h LEU 113 N 0.32 1.04 -1.06 0.59 3.38 -1.13 -0.59 115.31 117.87 2b91 h LEU 113 Ca 0.13 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 2b91 h LEU 113 Cb 0.05 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 2b91 h LEU 113 CO -0.10 1.11 0.43 -0.33 0.09 0.00 0.00 178.44 179.64 2b91 h GLU 114 N 0.95 1.08 -0.37 1.13 4.39 -1.30 -0.32 114.58 120.15 2b91 h GLU 114 Ca 0.16 -0.12 -0.14 0.00 0.34 0.00 0.00 59.36 59.60 2b91 h GLU 114 Cb 0.59 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 2b91 h GLU 114 CO 0.04 0.79 -0.31 -0.09 -1.16 0.00 0.00 179.01 178.28 2b91 h ARG 115 N 1.09 0.86 -0.41 2.33 9.65 -0.67 -1.88 114.38 125.36 2b91 h ARG 115 Ca 0.28 -0.44 -0.09 0.00 -1.10 0.00 0.00 59.98 58.63 2b91 h ARG 115 Cb 0.02 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.59 2b91 h ARG 115 CO -0.05 1.08 -0.11 1.25 2.80 0.00 0.00 179.97 184.95 2b91 h LEU 116 N 0.67 0.72 -0.69 3.80 5.85 -0.99 -1.76 115.31 122.90 2b91 h LEU 116 Ca 0.07 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.60 2b91 h LEU 116 Cb 0.89 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.69 2b91 h LEU 116 CO 0.08 0.85 0.44 0.50 -0.34 0.00 0.00 178.44 179.98 2b91 h LYS 117 N 0.67 0.86 -0.28 1.25 3.64 -0.89 0.14 116.57 121.95 2b91 h LYS 117 Ca 0.12 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 2b91 h LYS 117 Cb 0.57 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 2b91 h LYS 117 CO 0.04 0.57 0.13 1.15 -2.27 0.00 0.00 179.45 179.07 2b91 h THR 118 N 0.88 1.15 -0.88 1.00 2.02 -0.71 0.38 112.91 116.77 2b91 h THR 118 Ca 0.27 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 67.00 2b91 h THR 118 Cb -0.03 0.93 -0.04 0.00 -1.74 0.00 0.00 68.15 67.27 2b91 h THR 118 CO -0.09 0.16 0.53 0.40 0.37 0.00 0.00 175.52 176.89 2b91 h ILE 119 N 0.32 1.24 -0.38 3.11 2.04 -1.07 -0.62 117.51 122.16 2b91 h ILE 119 Ca 0.10 -0.54 -0.11 0.00 1.00 0.00 0.00 64.86 65.30 2b91 h ILE 119 Cb 0.13 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.21 2b91 h ILE 119 CO -0.01 0.26 -0.20 0.24 0.00 0.00 0.00 178.15 178.43 2b91 h MET 120 N 1.21 0.81 -0.28 2.37 2.86 -0.70 -0.65 114.93 120.54 2b91 h MET 120 Ca 0.31 -0.36 -0.07 0.00 -2.06 0.00 0.00 59.70 57.52 2b91 h MET 120 Cb -0.04 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.58 2b91 h MET 120 CO -0.06 0.99 -0.13 0.00 1.06 0.00 0.00 176.91 178.78 2b91 h ARG 121 N 0.61 0.48 -0.31 1.72 3.08 -0.72 -1.13 114.38 118.11 2b91 h ARG 121 Ca 0.08 -0.14 -0.07 0.00 0.07 0.00 0.00 59.98 59.93 2b91 h ARG 121 Cb 0.76 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.75 2b91 h ARG 121 CO 0.06 0.60 -0.06 1.49 -1.07 0.00 0.00 179.97 180.99 2b91 h GLU 122 N 0.44 0.59 -0.62 0.04 4.57 -0.85 -0.50 114.58 118.25 2b91 h GLU 122 Ca 0.08 -0.22 0.07 0.00 -1.18 0.00 0.00 59.36 58.11 2b91 h GLU 122 Cb 0.49 -0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 28.98 2b91 h GLU 122 CO 0.03 0.77 0.31 0.87 -1.18 0.00 0.00 179.01 179.81 2b91 h LYS 123 N 0.37 0.55 -0.13 1.92 1.57 -0.83 -1.13 116.57 118.90 2b91 h LYS 123 Ca 0.08 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2b91 h LYS 123 Cb 0.54 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 2b91 h LYS 123 CO 0.03 0.37 0.09 -0.92 -0.57 0.00 0.00 179.45 178.44 2b91 h TYR 124 N 0.57 0.17 -0.99 -1.35 5.03 -0.96 -2.27 116.97 117.17 2b91 h TYR 124 Ca 0.29 0.00 0.12 0.00 2.58 0.00 0.00 58.73 61.72 2b91 h TYR 124 Cb 0.23 -0.06 -0.08 0.00 1.55 0.00 0.00 36.73 38.37 2b91 h TYR 124 CO -0.10 0.11 0.61 1.03 -1.32 0.00 0.00 178.16 178.49 2b91 h SER 125 N 0.18 0.90 1.28 -2.11 0.87 -0.80 -0.48 113.55 113.39 2b91 h SER 125 Ca 0.05 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 2b91 h SER 125 Cb -0.02 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 61.81 2b91 h SER 125 CO -0.01 0.48 0.00 0.11 -0.53 0.00 0.00 176.83 176.88 2b91 h LYS 126 N 0.97 0.00 0.01 2.24 1.79 -0.83 -2.97 116.57 117.79 2b91 h LYS 126 Ca 0.49 0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 58.72 2b91 h LYS 126 Cb 0.48 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.10 2b91 h LYS 126 CO -0.27 0.00 -1.18 0.00 -1.08 0.00 0.00 179.45 176.93 2b91 s SER 128 N -6.63 5.20 0.00 0.00 1.04 -0.91 -5.09 113.70 107.31 2b91 s SER 128 Ca -0.01 -0.59 0.11 0.00 0.48 0.00 0.00 55.95 55.94 2b91 s SER 128 Cb 0.09 -0.82 0.66 0.00 0.10 0.00 0.00 66.02 66.05 2b91 s SER 128 CO 0.83 -0.46 1.10 -1.54 0.98 0.00 0.00 173.24 174.14