#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b8y h LYS 2 N 0.00 0.43 -0.18 1.57 -0.00 -2.04 -2.48 116.57 113.87 2b8y h LYS 2 Ca 0.00 -0.03 -0.09 0.00 -0.00 0.00 0.00 60.65 60.53 2b8y h LYS 2 Cb 0.00 -0.10 -0.06 0.00 -0.00 0.00 0.00 32.23 32.08 2b8y h LYS 2 CO 0.00 0.28 -0.28 0.00 -0.00 0.00 0.00 179.45 179.46 2b8y s ASP 4 N -2.87 4.84 0.01 0.00 2.15 -0.94 -4.91 116.67 114.95 2b8y s ASP 4 Ca 0.41 2.36 0.04 0.00 0.43 0.00 0.00 52.55 55.79 2b8y s ASP 4 Cb 0.39 -2.59 0.18 0.00 -0.30 0.00 0.00 42.92 40.60 2b8y s ASP 4 CO -0.03 -1.83 1.13 2.30 -0.17 0.00 0.00 175.17 176.57 2b8y n ILE 5 N -2.04 1.73 -0.21 4.11 -6.64 -1.26 -1.38 119.36 113.67 2b8y n ILE 5 Ca 0.13 0.44 0.25 0.00 -1.77 0.00 0.00 62.75 61.81 2b8y n ILE 5 Cb 0.50 -1.38 0.64 0.00 -1.44 0.00 0.00 39.64 37.96 2b8y n ILE 5 CO 0.00 0.00 0.00 0.74 -1.77 0.00 0.00 176.55 175.52 2b8y h THR 6 N 0.00 0.58 -0.65 7.28 2.02 -1.94 0.61 112.91 120.81 2b8y h THR 6 Ca 0.00 -0.05 0.01 0.00 0.77 0.00 0.00 66.41 67.13 2b8y h THR 6 Cb 0.06 0.42 -0.03 0.00 -1.74 0.00 0.00 68.15 66.86 2b8y h THR 6 CO 0.00 0.03 0.43 -0.07 0.37 0.00 0.00 175.52 176.28 2b8y h LEU 7 N 0.15 0.75 -0.55 2.58 3.38 -1.59 0.20 115.31 120.24 2b8y h LEU 7 Ca 0.45 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.32 2b8y h LEU 7 Cb 1.54 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 42.08 2b8y h LEU 7 CO -0.08 0.54 0.01 -0.61 0.09 0.00 0.00 178.44 178.39 2b8y h GLN 8 N 0.89 0.96 -0.94 1.13 5.75 -1.10 -1.56 115.11 120.22 2b8y h GLN 8 Ca 0.24 -0.30 0.06 0.00 -0.15 0.00 0.00 58.65 58.49 2b8y h GLN 8 Cb -0.10 -0.09 -0.06 0.00 1.07 0.00 0.00 27.48 28.30 2b8y h GLN 8 CO -0.05 0.96 0.60 0.93 -2.65 0.00 0.00 178.83 178.62 2b8y h GLU 9 N 0.84 1.08 -0.42 1.69 4.39 -0.83 0.33 114.58 121.66 2b8y h GLU 9 Ca 0.16 -0.07 -0.08 0.00 0.34 0.00 0.00 59.36 59.71 2b8y h GLU 9 Cb 0.53 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 2b8y h GLU 9 CO 0.03 0.72 -0.06 0.82 -1.16 0.00 0.00 179.01 179.35 2b8y h ILE 10 N 1.12 1.27 -0.71 3.13 2.04 -0.75 -2.09 117.51 121.52 2b8y h ILE 10 Ca 0.40 -1.14 -0.05 0.00 1.00 0.00 0.00 64.86 65.07 2b8y h ILE 10 Cb 0.12 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 2b8y h ILE 10 CO -0.16 0.38 0.24 0.40 0.00 0.00 0.00 178.15 179.01 2b8y h ILE 11 N 0.61 1.26 -0.18 -0.67 2.04 -0.90 -0.91 117.51 118.75 2b8y h ILE 11 Ca 0.11 -0.87 0.02 0.00 1.00 0.00 0.00 64.86 65.13 2b8y h ILE 11 Cb 0.58 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 2b8y h ILE 11 CO 0.03 0.34 0.04 0.11 0.00 0.00 0.00 178.15 178.67 2b8y h LYS 12 N 1.04 0.11 -0.55 2.37 1.57 -0.86 0.14 116.57 120.39 2b8y h LYS 12 Ca 0.23 -0.01 0.08 0.00 -1.87 0.00 0.00 60.65 59.08 2b8y h LYS 12 Cb 0.28 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.51 2b8y h LYS 12 CO -0.01 0.07 0.21 -0.44 -0.57 0.00 0.00 179.45 178.71 2b8y h ASP 13 N 0.11 0.23 -0.48 0.86 3.32 -1.08 -2.61 116.42 116.77 2b8y h ASP 13 Ca 0.08 0.06 -0.13 0.00 0.02 0.00 0.00 57.03 57.07 2b8y h ASP 13 Cb 0.07 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2b8y h ASP 13 CO -0.11 0.15 -0.19 -0.07 -1.72 0.00 0.00 179.24 177.31 2b8y h LEU 14 N 0.40 1.00 -0.81 1.55 3.38 -0.58 -1.46 115.31 118.78 2b8y h LEU 14 Ca 0.27 -0.36 0.08 0.00 0.09 0.00 0.00 57.88 57.96 2b8y h LEU 14 Cb 0.29 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.70 2b8y h LEU 14 CO -0.26 1.15 0.47 0.78 0.09 0.00 0.00 178.44 180.68 2b8y h ASN 15 N 0.86 0.70 -0.23 -0.43 2.35 -0.51 -0.06 115.58 118.26 2b8y h ASN 15 Ca 0.12 0.04 -0.12 0.00 -0.55 0.00 0.00 56.30 55.79 2b8y h ASN 15 Cb 0.76 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 39.02 2b8y h ASN 15 CO 0.06 0.42 -0.31 0.28 -1.65 0.00 0.00 177.43 176.23 2b8y h SER 16 N 0.82 0.67 -0.44 5.81 0.02 -1.23 -3.24 113.55 115.96 2b8y h SER 16 Ca 0.38 -0.50 -0.05 0.00 -0.84 0.00 0.00 61.79 60.78 2b8y h SER 16 Cb 0.29 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 2b8y h SER 16 CO -0.22 1.04 0.12 -0.07 -1.14 0.00 0.00 176.83 176.57 2b8y h LEU 17 N 0.31 0.71 0.00 5.07 3.38 -0.94 -2.92 115.31 120.93 2b8y h LEU 17 Ca 0.03 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2b8y h LEU 17 Cb 0.88 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2b8y h LEU 17 CO 0.07 0.70 0.00 0.35 0.09 0.00 0.00 178.44 179.65 2b8y n THR 18 N -4.29 0.00 0.33 0.22 -2.24 -0.06 -1.87 114.28 106.37 2b8y n THR 18 Ca 0.04 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.94 2b8y n THR 18 Cb 0.22 -0.51 0.27 0.00 -2.10 0.00 0.00 70.33 68.21 2b8y n THR 18 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2b8y h GLU 19 N 0.00 0.00 -6.44 -0.78 5.08 -1.58 -3.46 114.58 107.41 2b8y h GLU 19 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 2b8y h GLU 19 Cb 0.05 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 2b8y h GLU 19 CO 0.00 0.00 0.34 -0.65 -1.00 0.00 0.00 179.01 177.70 2b8y s GLN 20 N -3.21 4.59 -0.32 2.33 -0.21 -0.78 -5.01 119.66 117.05 2b8y s GLN 20 Ca 0.08 1.39 -0.02 0.00 0.02 0.00 0.00 55.36 56.83 2b8y s GLN 20 Cb 0.07 -3.43 0.12 0.00 1.00 0.00 0.00 33.01 30.77 2b8y s GLN 20 CO 0.64 0.05 0.18 0.21 -2.12 0.00 0.00 175.29 174.25 2b8y s LYS 21 N 0.64 0.38 0.36 2.91 2.20 -1.26 -4.93 119.74 120.04 2b8y s LYS 21 Ca 0.49 -0.93 0.05 0.00 -0.36 0.00 0.00 55.97 55.22 2b8y s LYS 21 Cb -0.22 -1.21 -0.03 0.00 -1.51 0.00 0.00 37.83 34.87 2b8y s LYS 21 CO 0.28 -1.12 0.18 0.95 -0.36 0.00 0.00 175.35 175.28 2b8y s THR 22 N 1.57 0.35 0.29 3.43 -4.23 -1.26 -4.98 115.64 110.81 2b8y s THR 22 Ca 0.14 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.66 2b8y s THR 22 Cb -0.19 -2.43 0.28 0.00 1.34 0.00 0.00 72.50 71.50 2b8y s THR 22 CO -0.17 0.00 1.86 0.25 -0.54 0.00 0.00 174.62 176.02 2b8y h LEU 23 N 1.99 0.93 -0.50 4.79 5.85 -1.98 -2.34 115.31 124.05 2b8y h LEU 23 Ca -0.32 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 2b8y h LEU 23 Cb 1.26 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 42.11 2b8y h LEU 23 CO 0.49 0.52 0.12 0.00 -0.34 0.00 0.00 178.44 179.24 2b8y n THR 25 N -4.45 0.47 0.92 0.00 -2.24 -0.92 -1.59 114.28 106.48 2b8y n THR 25 Ca 0.01 0.08 0.13 0.00 -2.27 0.00 0.00 64.05 62.00 2b8y n THR 25 Cb 0.23 -0.73 0.40 0.00 -2.10 0.00 0.00 70.33 68.12 2b8y n THR 25 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2b8y n GLU 26 N -1.62 0.05 -1.44 -0.78 -0.58 -0.99 -1.46 120.64 113.82 2b8y n GLU 26 Ca 0.05 0.03 -0.31 0.00 -0.42 0.00 0.00 57.16 56.51 2b8y n GLU 26 Cb 0.28 -1.55 0.07 0.00 -0.57 0.00 0.00 31.44 29.68 2b8y n GLU 26 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2b8y s LEU 27 N -3.26 3.01 0.27 -4.62 1.43 -0.62 -4.63 118.68 110.26 2b8y s LEU 27 Ca 0.12 1.66 0.07 0.00 -1.03 0.00 0.00 54.13 54.94 2b8y s LEU 27 Cb 0.17 -4.43 -0.03 0.00 0.03 0.00 0.00 46.19 41.93 2b8y s LEU 27 CO 0.63 -1.75 0.24 0.42 0.23 0.00 0.00 176.35 176.11 2b8y s THR 28 N -3.00 4.33 0.16 5.49 -4.23 -1.26 -0.46 115.64 116.67 2b8y s THR 28 Ca 0.60 -1.35 0.05 0.00 -1.18 0.00 0.00 61.69 59.81 2b8y s THR 28 Cb -0.15 -3.40 -0.04 0.00 1.34 0.00 0.00 72.50 70.24 2b8y s THR 28 CO 0.55 -0.31 -0.11 0.68 -0.54 0.00 0.00 174.62 174.89 2b8y s VAL 29 N -2.16 1.32 0.20 2.29 -7.23 0.91 -4.80 120.40 110.94 2b8y s VAL 29 Ca 0.35 -2.10 -0.31 0.00 -1.81 0.00 0.00 61.98 58.11 2b8y s VAL 29 Cb -0.08 -1.90 -0.10 0.00 0.56 0.00 0.00 36.38 34.86 2b8y s VAL 29 CO 0.26 -0.70 1.47 -0.89 -0.31 0.00 0.00 175.10 174.93 2b8y s THR 30 N -3.23 2.75 -0.97 5.32 2.01 -1.26 -1.05 115.64 119.20 2b8y s THR 30 Ca 0.18 0.58 -0.20 0.00 0.31 0.00 0.00 61.69 62.56 2b8y s THR 30 Cb 0.02 -3.37 0.10 0.00 0.01 0.00 0.00 72.50 69.25 2b8y s THR 30 CO 0.02 0.07 1.27 -0.62 -0.69 0.00 0.00 174.62 174.67 2b8y s ASP 31 N 0.73 6.58 0.62 3.53 2.15 0.10 -4.80 116.67 125.58 2b8y s ASP 31 Ca 0.64 -1.81 0.39 0.00 0.43 0.00 0.00 52.55 52.19 2b8y s ASP 31 Cb -0.42 -2.47 2.05 0.00 -0.30 0.00 0.00 42.92 41.78 2b8y s ASP 31 CO 0.37 -1.24 2.25 0.16 -0.17 0.00 0.00 175.17 176.54 2b8y h ILE 32 N 6.22 0.14 -0.40 4.11 3.07 -1.91 -2.11 117.51 126.63 2b8y h ILE 32 Ca 0.18 -0.16 0.00 0.00 1.55 0.00 0.00 64.86 66.43 2b8y h ILE 32 Cb 1.02 1.14 0.00 0.00 -0.27 0.00 0.00 36.82 38.70 2b8y h ILE 32 CO 1.24 0.02 0.00 0.49 -1.05 0.00 0.00 178.15 178.85 2b8y n PHE 33 N -3.25 0.64 1.32 0.16 3.72 -1.26 -3.43 117.46 115.36 2b8y n PHE 33 Ca -0.02 -0.29 0.13 0.00 -0.05 0.00 0.00 57.45 57.22 2b8y n PHE 33 Cb 0.14 -0.05 0.42 0.00 -0.94 0.00 0.00 39.48 39.05 2b8y n PHE 33 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2b8y n ALA 34 N 0.64 2.91 -1.49 4.37 0.00 -0.79 -4.92 120.51 121.23 2b8y n ALA 34 Ca 0.14 -0.42 -0.35 0.00 0.00 0.00 0.00 53.44 52.81 2b8y n ALA 34 Cb 0.41 -1.14 0.07 0.00 0.00 0.00 0.00 19.45 18.80 2b8y n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b8y s ALA 35 N -2.33 2.27 -1.85 0.00 0.00 -1.22 -4.92 121.76 113.71 2b8y s ALA 35 Ca 0.29 0.91 0.24 0.00 0.00 0.00 0.00 51.96 53.39 2b8y s ALA 35 Cb 0.20 -3.46 1.37 0.00 0.00 0.00 0.00 23.12 21.22 2b8y s ALA 35 CO 0.46 -1.64 1.79 0.43 0.00 0.00 0.00 175.76 176.80 2b8y n SER 36 N -2.37 0.00 0.00 0.00 7.64 -1.26 -4.88 113.62 112.75 2b8y n SER 36 Ca 0.13 -0.56 0.00 0.00 1.01 0.00 0.00 58.87 59.45 2b8y n SER 36 Cb 0.50 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 2b8y n SER 36 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2b8y n LYS 37 N -1.08 0.00 -2.73 1.43 4.81 -1.26 -5.09 118.16 114.24 2b8y n LYS 37 Ca 0.16 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.30 2b8y n LYS 37 Cb 0.11 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.14 2b8y n LYS 37 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 2b8y n ASN 38 N 0.00 5.14 -3.81 3.14 0.23 -1.26 -5.01 115.26 113.69 2b8y n ASN 38 Ca 0.00 -3.71 -0.10 0.00 -0.53 0.00 0.00 54.58 50.24 2b8y n ASN 38 Cb 0.00 -0.65 -0.07 0.00 -2.08 0.00 0.00 39.78 36.97 2b8y n ASN 38 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 2b8y s THR 39 N -4.74 0.11 0.98 5.53 -4.23 -1.26 -5.14 115.64 106.88 2b8y s THR 39 Ca 0.48 -0.89 -0.12 0.00 -1.18 0.00 0.00 61.69 59.98 2b8y s THR 39 Cb 0.30 -1.06 0.18 0.00 1.34 0.00 0.00 72.50 73.27 2b8y s THR 39 CO -0.17 -0.49 1.08 0.28 -0.54 0.00 0.00 174.62 174.79 2b8y s THR 40 N -3.01 2.35 0.17 3.99 -1.32 -1.26 -4.80 115.64 111.76 2b8y s THR 40 Ca -0.02 0.11 -0.15 0.00 -1.21 0.00 0.00 61.69 60.43 2b8y s THR 40 Cb 0.01 -2.41 0.05 0.00 -1.51 0.00 0.00 72.50 68.63 2b8y s THR 40 CO -0.06 -0.15 1.82 -0.08 -2.21 0.00 0.00 174.62 173.94 2b8y h GLU 41 N -1.91 0.59 -0.67 7.08 4.81 -2.01 -0.11 114.58 122.36 2b8y h GLU 41 Ca -0.52 -0.04 0.05 0.00 -0.13 0.00 0.00 59.36 58.72 2b8y h GLU 41 Cb 1.30 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 30.49 2b8y h GLU 41 CO 0.52 0.39 0.39 0.87 -0.73 0.00 0.00 179.01 180.45 2b8y h LYS 42 N 0.61 0.71 -0.41 1.92 1.57 -1.87 -1.63 116.57 117.48 2b8y h LYS 42 Ca 0.18 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.83 2b8y h LYS 42 Cb -0.04 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.09 2b8y h LYS 42 CO -0.06 0.47 -0.12 1.49 -0.57 0.00 0.00 179.45 180.66 2b8y h GLU 43 N 0.73 0.74 -0.46 3.15 4.81 -1.76 -1.89 114.58 119.90 2b8y h GLU 43 Ca 0.29 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 2b8y h GLU 43 Cb 0.13 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 2b8y h GLU 43 CO -0.15 0.83 0.25 1.15 -0.73 0.00 0.00 179.01 180.35 2b8y h THR 44 N 0.67 1.17 -0.76 0.32 2.02 -0.45 -0.88 112.91 114.99 2b8y h THR 44 Ca 0.11 -0.43 -0.02 0.00 0.77 0.00 0.00 66.41 66.84 2b8y h THR 44 Cb 0.58 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 2b8y h THR 44 CO 0.04 0.18 0.39 -0.26 0.37 0.00 0.00 175.52 176.23 2b8y h PHE 45 N 0.60 1.06 -0.42 3.16 0.04 -1.09 -1.66 116.94 118.64 2b8y h PHE 45 Ca 0.16 -0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.84 2b8y h PHE 45 Cb 0.06 -0.34 -0.02 0.00 2.20 0.00 0.00 35.95 37.86 2b8y h PHE 45 CO -0.02 0.76 0.04 0.00 -0.60 0.00 0.00 178.31 178.49 2b8y h ARG 47 N 0.55 0.26 -0.37 0.00 3.08 -0.94 -0.34 114.38 116.62 2b8y h ARG 47 Ca 0.12 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.11 2b8y h ARG 47 Cb 0.42 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 2b8y h ARG 47 CO 0.01 0.17 0.03 0.00 -1.07 0.00 0.00 179.97 179.11 2b8y h ALA 48 N 1.14 0.50 -0.24 0.04 0.00 -1.15 -2.22 119.26 117.33 2b8y h ALA 48 Ca 0.11 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 2b8y h ALA 48 Cb 0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2b8y h ALA 48 CO -0.08 0.24 0.03 0.00 0.00 0.00 0.00 179.25 179.44 2b8y h ALA 49 N 0.89 1.61 -0.04 0.00 0.00 -0.90 -2.06 119.26 118.76 2b8y h ALA 49 Ca 0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2b8y h ALA 49 Cb 0.42 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 2b8y h ALA 49 CO 0.01 0.29 -0.05 1.15 0.00 0.00 0.00 179.25 180.66 2b8y h THR 50 N 0.34 1.39 -0.51 0.00 2.02 -0.58 -1.99 112.91 113.60 2b8y h THR 50 Ca 0.08 -1.25 -0.08 0.00 0.77 0.00 0.00 66.41 65.94 2b8y h THR 50 Cb 0.18 2.14 -0.02 0.00 -1.74 0.00 0.00 68.15 68.71 2b8y h THR 50 CO 0.00 0.34 -0.00 -0.37 0.37 0.00 0.00 175.52 175.86 2b8y h VAL 51 N -0.37 1.25 -0.25 3.16 -1.51 -1.28 -1.42 116.25 115.83 2b8y h VAL 51 Ca 0.01 -1.05 -0.12 0.00 -1.23 0.00 0.00 66.70 64.31 2b8y h VAL 51 Cb 0.57 0.86 -0.01 0.00 -2.13 0.00 0.00 31.29 30.58 2b8y h VAL 51 CO 0.01 0.37 -0.34 -0.07 -1.23 0.00 0.00 177.57 176.31 2b8y h LEU 52 N 0.80 0.55 -0.59 4.19 3.38 -1.41 -0.72 115.31 121.51 2b8y h LEU 52 Ca 0.15 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 2b8y h LEU 52 Cb 0.48 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2b8y h LEU 52 CO 0.02 0.85 0.10 -0.09 0.09 0.00 0.00 178.44 179.42 2b8y h ARG 53 N 0.45 0.97 -0.37 1.13 2.43 -1.11 -1.00 114.38 116.88 2b8y h ARG 53 Ca 0.05 -0.26 0.07 0.00 -0.81 0.00 0.00 59.98 59.03 2b8y h ARG 53 Cb 0.81 -0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 30.19 2b8y h ARG 53 CO 0.07 0.92 0.01 1.96 -1.51 0.00 0.00 179.97 181.41 2b8y h GLN 54 N 0.87 0.11 0.52 0.20 4.20 -0.95 -1.55 115.11 118.51 2b8y h GLN 54 Ca 0.18 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.86 2b8y h GLN 54 Cb 0.41 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.17 2b8y h GLN 54 CO 0.01 0.07 -0.25 0.35 -0.67 0.00 0.00 178.83 178.34 2b8y h PHE 55 N 0.11 -0.64 -0.09 2.96 3.04 -0.73 -1.70 116.94 119.90 2b8y h PHE 55 Ca 0.18 -0.02 -0.10 0.00 3.98 0.00 0.00 57.97 62.02 2b8y h PHE 55 Cb 0.25 0.21 -0.01 0.00 2.56 0.00 0.00 35.95 38.96 2b8y h PHE 55 CO -0.25 -0.37 -0.38 0.10 -2.02 0.00 0.00 178.31 175.39 2b8y h TYR 56 N -0.74 0.21 -0.36 0.41 -0.00 -1.18 -0.43 116.97 114.88 2b8y h TYR 56 Ca -0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 58.73 58.59 2b8y h TYR 56 Cb 0.56 -0.05 -0.02 0.00 0.00 0.00 0.00 36.73 37.22 2b8y h TYR 56 CO -0.03 0.54 0.17 0.77 -0.00 0.00 0.00 178.16 179.62 2b8y h SER 57 N 0.16 0.47 1.19 0.10 0.02 -1.25 -1.03 113.55 113.21 2b8y h SER 57 Ca 0.02 -0.13 -0.10 0.00 -0.84 0.00 0.00 61.79 60.74 2b8y h SER 57 Cb 0.75 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 2b8y h SER 57 CO 0.06 0.47 -0.46 0.45 -1.14 0.00 0.00 176.83 176.20 2b8y h HIS 58 N 0.44 0.00 -0.01 3.45 3.86 -0.99 -3.37 115.15 118.54 2b8y h HIS 58 Ca 0.12 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 2b8y h HIS 58 Cb 0.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.59 2b8y h HIS 58 CO -0.01 0.46 -0.14 0.72 0.86 0.00 0.00 177.93 179.82 2b8y n HIS 59 N -3.35 0.00 -0.28 2.45 8.25 -0.20 -4.46 115.22 117.63 2b8y n HIS 59 Ca 0.01 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.53 2b8y n HIS 59 Cb 0.64 0.00 0.29 0.00 1.12 0.00 0.00 29.99 32.04 2b8y n HIS 59 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2b8y h GLU 60 N 0.99 0.88 -0.22 -0.41 4.81 -1.35 -2.73 114.58 116.56 2b8y h GLU 60 Ca 0.00 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.14 2b8y h GLU 60 Cb 0.28 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 2b8y h GLU 60 CO 0.00 0.58 -0.03 1.63 -0.73 0.00 0.00 179.01 180.47 2b8y n LYS 61 N -4.51 2.33 -2.44 1.92 5.02 -1.26 -4.88 118.16 114.34 2b8y n LYS 61 Ca 0.14 -2.86 -0.42 0.00 -2.02 0.00 0.00 58.31 53.15 2b8y n LYS 61 Cb 0.27 -1.76 -0.03 0.00 -0.02 0.00 0.00 35.03 33.49 2b8y n LYS 61 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2b8y s ASP 62 N -2.28 7.06 0.62 4.39 -1.08 -1.03 -4.94 116.67 119.41 2b8y s ASP 62 Ca 0.40 1.90 0.36 0.00 -0.52 0.00 0.00 52.55 54.69 2b8y s ASP 62 Cb 0.34 -2.57 2.07 0.00 -1.46 0.00 0.00 42.92 41.30 2b8y s ASP 62 CO 0.05 -0.54 2.31 0.71 0.52 0.00 0.00 175.17 178.22 2b8y h THR 63 N 4.81 0.32 0.00 1.71 1.35 -1.95 -0.57 112.91 118.58 2b8y h THR 63 Ca -0.37 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 2b8y h THR 63 Cb 1.18 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 2b8y h THR 63 CO 0.85 0.00 0.00 0.03 -0.25 0.00 0.00 175.52 176.15 2b8y h ARG 64 N 0.00 0.00 0.00 4.72 3.08 -1.96 -3.33 114.38 116.89 2b8y h ARG 64 Ca -0.00 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.76 2b8y h ARG 64 Cb 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.00 2b8y h ARG 64 CO 0.00 0.00 -2.09 0.00 -1.07 0.00 0.00 179.97 176.81 2b8y h LEU 66 N 0.00 0.00 0.00 0.00 3.38 -1.46 -3.44 115.31 113.79 2b8y h LEU 66 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2b8y h LEU 66 Cb 1.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.72 2b8y h LEU 66 CO 0.02 0.19 0.00 0.61 0.09 0.00 0.00 178.44 179.35 2b8y n GLY 67 N -0.82 1.65 0.13 0.83 0.00 -1.26 -3.77 105.19 101.94 2b8y n GLY 67 Ca -0.02 -1.62 -0.22 0.00 0.00 0.00 0.00 46.02 44.16 2b8y n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b8y h ALA 68 N 0.00 0.34 -1.80 4.61 0.00 -1.93 -3.43 119.26 117.05 2b8y h ALA 68 Ca 0.00 -1.30 -0.44 0.00 0.00 0.00 0.00 54.91 53.18 2b8y h ALA 68 Cb 0.00 0.69 0.04 0.00 0.00 0.00 0.00 17.79 18.53 2b8y h ALA 68 CO 0.00 1.04 -0.06 0.95 0.00 0.00 0.00 179.25 181.18 2b8y s THR 69 N -2.48 2.76 0.18 0.00 -4.23 -1.26 -4.94 115.64 105.67 2b8y s THR 69 Ca -0.24 -0.69 -0.13 0.00 -1.18 0.00 0.00 61.69 59.44 2b8y s THR 69 Cb 0.06 -3.02 0.09 0.00 1.34 0.00 0.00 72.50 70.97 2b8y s THR 69 CO 0.71 -0.01 1.83 0.00 -0.54 0.00 0.00 174.62 176.61 2b8y h ALA 70 N 0.15 0.75 -0.70 3.99 0.00 -1.98 -1.61 119.26 119.85 2b8y h ALA 70 Ca -0.42 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2b8y h ALA 70 Cb 1.29 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2b8y h ALA 70 CO 0.52 0.21 0.44 0.37 0.00 0.00 0.00 179.25 180.79 2b8y h GLN 71 N 0.80 0.93 -0.48 0.00 4.15 -1.99 0.66 115.11 119.18 2b8y h GLN 71 Ca 0.21 -0.07 -0.06 0.00 0.77 0.00 0.00 58.65 59.51 2b8y h GLN 71 Cb -0.05 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 27.42 2b8y h GLN 71 CO -0.04 0.64 0.08 1.96 -1.93 0.00 0.00 178.83 179.53 2b8y h GLN 72 N 0.95 0.80 -0.48 1.69 4.20 -1.87 -0.37 115.11 120.04 2b8y h GLN 72 Ca 0.25 -0.21 -0.07 0.00 0.06 0.00 0.00 58.65 58.68 2b8y h GLN 72 Cb -0.08 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.59 2b8y h GLN 72 CO -0.05 0.80 0.02 0.35 -0.67 0.00 0.00 178.83 179.28 2b8y h PHE 73 N 0.67 0.90 -0.48 2.96 3.57 -1.00 -0.69 116.94 122.87 2b8y h PHE 73 Ca 0.15 -0.15 0.04 0.00 3.53 0.00 0.00 57.97 61.54 2b8y h PHE 73 Cb 0.39 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 38.85 2b8y h PHE 73 CO 0.03 0.85 0.24 1.25 -2.23 0.00 0.00 178.31 178.45 2b8y h HIS 74 N 0.69 0.45 -0.27 0.41 2.76 -0.73 -0.73 115.15 117.72 2b8y h HIS 74 Ca 0.14 0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 58.24 2b8y h HIS 74 Cb 0.48 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 29.30 2b8y h HIS 74 CO 0.04 0.22 -0.20 0.00 -1.30 0.00 0.00 177.93 176.69 2b8y h ARG 75 N 0.48 0.50 -0.26 5.26 3.08 -0.75 -1.08 114.38 121.61 2b8y h ARG 75 Ca 0.21 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 60.06 2b8y h ARG 75 Cb 0.11 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 2b8y h ARG 75 CO -0.14 0.68 0.05 1.25 -1.07 0.00 0.00 179.97 180.73 2b8y h HIS 76 N 0.45 0.45 -0.79 3.04 2.76 -0.74 -0.26 115.15 120.06 2b8y h HIS 76 Ca 0.07 -0.06 -0.02 0.00 -2.20 0.00 0.00 60.37 58.16 2b8y h HIS 76 Cb 0.61 -0.12 -0.04 0.00 1.55 0.00 0.00 27.41 29.41 2b8y h HIS 76 CO 0.02 0.53 0.40 0.87 -1.30 0.00 0.00 177.93 178.46 2b8y h LYS 77 N 0.24 1.11 -0.61 5.26 1.57 -0.81 -1.24 116.57 122.10 2b8y h LYS 77 Ca 0.08 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2b8y h LYS 77 Cb 0.32 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 2b8y h LYS 77 CO 0.00 0.84 0.33 1.96 -0.57 0.00 0.00 179.45 182.02 2b8y h GLN 78 N 1.11 0.86 -0.19 3.15 4.20 -1.04 -0.99 115.11 122.21 2b8y h GLN 78 Ca 0.28 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.89 2b8y h GLN 78 Cb 0.07 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 2b8y h GLN 78 CO -0.04 0.65 0.13 1.25 -0.67 0.00 0.00 178.83 180.15 2b8y h LEU 79 N 0.83 0.22 -0.41 1.46 5.85 -0.34 -0.57 115.31 122.36 2b8y h LEU 79 Ca 0.22 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 2b8y h LEU 79 Cb 0.05 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2b8y h LEU 79 CO -0.03 0.16 0.15 0.40 -0.34 0.00 0.00 178.44 178.78 2b8y h ILE 80 N 0.26 1.20 -0.49 4.05 1.08 -1.11 0.68 117.51 123.18 2b8y h ILE 80 Ca 0.07 -0.63 0.05 0.00 -0.39 0.00 0.00 64.86 63.96 2b8y h ILE 80 Cb -0.03 0.86 -0.05 0.00 -3.07 0.00 0.00 36.82 34.53 2b8y h ILE 80 CO -0.02 0.23 0.22 0.03 -0.69 0.00 0.00 178.15 177.93 2b8y h ARG 81 N 0.51 0.43 -0.28 2.37 3.08 -1.04 0.01 114.38 119.46 2b8y h ARG 81 Ca 0.13 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 60.02 2b8y h ARG 81 Cb 0.21 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 2b8y h ARG 81 CO -0.01 0.28 -0.41 -0.44 -1.07 0.00 0.00 179.97 178.33 2b8y h ASP 82 N 0.44 0.73 -0.68 7.04 3.32 -0.92 -0.72 116.42 125.64 2b8y h ASP 82 Ca 0.22 -0.33 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 2b8y h ASP 82 Cb 0.16 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 2b8y h ASP 82 CO -0.18 1.04 0.35 -0.07 -1.72 0.00 0.00 179.24 178.67 2b8y h LEU 83 N 0.56 0.86 -0.71 1.55 3.38 -0.54 -0.22 115.31 120.20 2b8y h LEU 83 Ca 0.05 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.83 2b8y h LEU 83 Cb 0.94 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 2b8y h LEU 83 CO 0.09 0.73 0.13 0.11 0.09 0.00 0.00 178.44 179.58 2b8y h LYS 84 N 0.93 1.11 -0.33 1.13 1.57 -0.74 0.11 116.57 120.36 2b8y h LYS 84 Ca 0.24 -0.29 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 2b8y h LYS 84 Cb 0.07 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2b8y h LYS 84 CO -0.03 1.01 0.13 0.00 -0.57 0.00 0.00 179.45 179.98 2b8y h ARG 85 N 1.05 0.49 -0.49 3.15 3.08 -0.91 -0.11 114.38 120.62 2b8y h ARG 85 Ca 0.21 -0.09 -0.06 0.00 0.07 0.00 0.00 59.98 60.11 2b8y h ARG 85 Cb 0.42 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 2b8y h ARG 85 CO 0.01 0.49 0.08 1.25 -1.07 0.00 0.00 179.97 180.73 2b8y h LEU 86 N 0.38 0.78 -0.34 3.04 5.85 -0.90 -2.16 115.31 121.96 2b8y h LEU 86 Ca 0.11 -0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.57 2b8y h LEU 86 Cb 0.19 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 2b8y h LEU 86 CO -0.01 0.84 0.20 -0.78 -0.34 0.00 0.00 178.44 178.36 2b8y h ASP 87 N 0.69 0.40 -0.48 1.25 3.58 -0.60 0.14 116.42 121.40 2b8y h ASP 87 Ca 0.15 -0.05 0.09 0.00 0.42 0.00 0.00 57.03 57.65 2b8y h ASP 87 Cb 0.39 -0.10 -0.08 0.00 1.72 0.00 0.00 39.33 41.26 2b8y h ASP 87 CO 0.01 0.33 -0.05 -0.09 -2.88 0.00 0.00 179.24 176.55 2b8y h ARG 88 N 0.44 0.06 -0.64 0.28 2.43 -0.86 -0.73 114.38 115.36 2b8y h ARG 88 Ca 0.12 -0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.20 2b8y h ARG 88 Cb 0.00 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 2b8y h ARG 88 CO -0.02 0.04 0.05 -0.91 -1.51 0.00 0.00 179.97 177.61 2b8y h ASN 89 N 0.06 1.06 -0.70 -3.80 2.35 -1.02 -2.38 115.58 111.15 2b8y h ASN 89 Ca 0.24 -0.29 -0.05 0.00 -0.55 0.00 0.00 56.30 55.64 2b8y h ASN 89 Cb 0.36 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.41 2b8y h ASN 89 CO -0.44 1.08 0.23 -0.07 -1.65 0.00 0.00 177.43 176.58 2b8y h LEU 90 N 1.00 1.01 -0.90 1.61 3.38 -0.52 -2.35 115.31 118.55 2b8y h LEU 90 Ca 0.19 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2b8y h LEU 90 Cb 0.51 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 2b8y h LEU 90 CO 0.02 0.95 0.29 -0.50 0.09 0.00 0.00 178.44 179.29 2b8y h TRP 91 N 1.02 1.11 -0.68 1.13 4.06 -1.07 -0.18 115.95 121.34 2b8y h TRP 91 Ca 0.23 -0.08 0.03 0.00 2.06 0.00 0.00 58.89 61.13 2b8y h TRP 91 Cb 0.29 -0.33 -0.04 0.00 -1.00 0.00 0.00 29.16 28.08 2b8y h TRP 91 CO 0.02 0.85 0.45 0.78 -3.56 0.00 0.00 178.44 176.98 2b8y h GLY 92 N 1.11 0.93 1.81 1.49 0.00 -1.12 -2.37 103.07 104.94 2b8y h GLY 92 Ca 0.25 -0.33 -0.15 0.00 0.00 0.00 0.00 47.33 47.10 2b8y h GLY 92 CO -0.02 0.29 -0.83 1.41 0.00 0.00 0.00 176.54 177.39 2b8y h LEU 93 N 0.83 0.00 -0.01 3.11 4.07 -0.84 -3.36 115.31 119.12 2b8y h LEU 93 Ca 0.27 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.20 2b8y h LEU 93 Cb 0.03 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.78 2b8y h LEU 93 CO -0.07 0.68 -0.12 0.00 -1.08 0.00 0.00 178.44 177.85 2b8y h ALA 94 N 1.32 0.03 -4.30 1.53 0.00 -0.56 -3.45 119.26 113.83 2b8y h ALA 94 Ca -0.04 -0.40 -0.41 0.00 0.00 0.00 0.00 54.91 54.06 2b8y h ALA 94 Cb 1.55 0.00 0.05 0.00 0.00 0.00 0.00 17.79 19.39 2b8y h ALA 94 CO 0.08 -0.03 -0.60 0.41 0.00 0.00 0.00 179.25 179.11 2b8y n GLY 95 N 0.87 -0.52 3.63 0.00 0.00 -0.96 -4.77 105.19 103.42 2b8y n GLY 95 Ca -0.09 0.11 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 2b8y n GLY 95 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b8y s LEU 96 N -6.61 -0.57 -0.05 0.99 1.02 -1.26 -5.05 118.68 107.16 2b8y s LEU 96 Ca 0.27 1.05 0.13 0.00 0.02 0.00 0.00 54.13 55.59 2b8y s LEU 96 Cb -0.12 2.13 -0.19 0.00 0.02 0.00 0.00 46.19 48.03 2b8y s LEU 96 CO 0.33 -0.22 0.21 -3.20 0.02 0.00 0.00 176.35 173.49 2b8y n ASN 97 N 2.24 1.98 -4.44 2.29 5.15 -1.26 -4.81 115.26 116.40 2b8y n ASN 97 Ca -0.13 0.00 -0.43 0.00 -0.60 0.00 0.00 54.58 53.41 2b8y n ASN 97 Cb 0.56 1.35 -0.04 0.00 -0.53 0.00 0.00 39.78 41.12 2b8y n ASN 97 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2b8y s SER 98 N -3.83 6.29 -0.48 1.20 1.04 -1.26 -4.86 113.70 111.80 2b8y s SER 98 Ca -0.05 -1.31 0.06 0.00 0.48 0.00 0.00 55.95 55.13 2b8y s SER 98 Cb 0.07 -2.40 0.18 0.00 0.10 0.00 0.00 66.02 63.97 2b8y s SER 98 CO 0.53 -1.31 0.63 0.00 0.98 0.00 0.00 173.24 174.07 2b8y s PRO 100 N 0.82 4.17 -0.24 0.00 0.02 -1.26 -4.68 135.00 133.84 2b8y s PRO 100 Ca 0.29 2.49 -0.12 0.00 0.02 0.00 0.00 61.00 63.68 2b8y s PRO 100 Cb -0.00 -3.12 -0.05 0.00 0.02 0.00 0.00 34.50 31.34 2b8y s PRO 100 CO -0.08 -0.69 0.22 0.14 -0.33 0.00 0.00 177.00 176.27 2b8y s VAL 101 N 1.20 5.31 -0.89 3.83 -7.23 -1.26 -4.98 120.40 116.38 2b8y s VAL 101 Ca 0.73 0.31 0.13 0.00 -1.81 0.00 0.00 61.98 61.33 2b8y s VAL 101 Cb -0.47 -3.56 -0.07 0.00 0.56 0.00 0.00 36.38 32.84 2b8y s VAL 101 CO 0.32 0.31 0.64 0.29 -0.31 0.00 0.00 175.10 176.34 2b8y n LYS 102 N 4.42 2.39 -1.80 4.82 5.02 -1.26 -5.04 118.16 126.71 2b8y n LYS 102 Ca -0.13 -0.35 -0.40 0.00 -2.02 0.00 0.00 58.31 55.40 2b8y n LYS 102 Cb 0.52 -1.13 0.01 0.00 -0.02 0.00 0.00 35.03 34.40 2b8y n LYS 102 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2b8y s GLU 103 N -1.90 3.86 -0.15 1.97 8.01 -1.26 -4.95 118.70 124.28 2b8y s GLU 103 Ca 0.08 2.48 -0.26 0.00 0.01 0.00 0.00 54.97 57.28 2b8y s GLU 103 Cb 0.10 -2.79 -0.25 0.00 -4.31 0.00 0.00 34.13 26.89 2b8y s GLU 103 CO 0.42 -0.70 0.63 0.00 0.01 0.00 0.00 175.26 175.62 2b8y h ALA 104 N 2.61 0.07 -2.02 5.21 0.00 -1.96 -3.44 119.26 119.72 2b8y h ALA 104 Ca -0.51 -0.71 -0.62 0.00 0.00 0.00 0.00 54.91 53.07 2b8y h ALA 104 Cb 1.25 0.21 0.08 0.00 0.00 0.00 0.00 17.79 19.33 2b8y h ALA 104 CO 0.62 0.23 0.46 -1.71 0.00 0.00 0.00 179.25 178.85 2b8y n ASN 105 N -4.51 2.06 -4.55 0.00 4.05 -1.26 -4.83 115.26 106.23 2b8y n ASN 105 Ca -0.16 1.14 -0.34 0.00 0.45 0.00 0.00 54.58 55.66 2b8y n ASN 105 Cb 0.57 -1.32 -0.11 0.00 1.23 0.00 0.00 39.78 40.15 2b8y n ASN 105 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 177.26 173.11 2b8y s GLN 106 N -0.26 3.53 0.24 1.20 -1.52 -1.26 -0.72 119.66 120.87 2b8y s GLN 106 Ca 0.72 -0.49 0.09 0.00 -1.95 0.00 0.00 55.36 53.74 2b8y s GLN 106 Cb -0.76 -2.90 -0.04 0.00 -0.22 0.00 0.00 33.01 29.08 2b8y s GLN 106 CO 0.50 0.35 -0.03 -1.54 -0.25 0.00 0.00 175.29 174.32 2b8y s SER 107 N 0.08 4.46 0.69 5.90 1.04 -0.22 -4.88 113.70 120.77 2b8y s SER 107 Ca 0.00 -0.62 -0.17 0.00 0.48 0.00 0.00 55.95 55.65 2b8y s SER 107 Cb -0.13 -0.81 0.01 0.00 0.10 0.00 0.00 66.02 65.18 2b8y s SER 107 CO 0.02 0.03 1.15 0.35 0.98 0.00 0.00 173.24 175.78 2b8y n THR 108 N -0.60 3.73 -0.30 2.02 -2.24 -1.26 -0.06 114.28 115.56 2b8y n THR 108 Ca -0.08 -0.41 -0.00 0.00 -2.27 0.00 0.00 64.05 61.29 2b8y n THR 108 Cb 0.58 -1.29 0.12 0.00 -2.10 0.00 0.00 70.33 67.64 2b8y n THR 108 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2b8y h LEU 109 N 0.05 0.83 -0.25 3.22 5.85 -0.52 -1.73 115.31 122.77 2b8y h LEU 109 Ca -0.49 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.30 2b8y h LEU 109 Cb 1.33 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 42.13 2b8y h LEU 109 CO 0.50 0.55 -0.22 -0.08 -0.34 0.00 0.00 178.44 178.84 2b8y h GLU 110 N 0.97 -0.22 -0.29 1.25 4.81 -1.52 0.12 114.58 119.70 2b8y h GLU 110 Ca 0.35 0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.48 2b8y h GLU 110 Cb 0.11 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 2b8y h GLU 110 CO -0.15 -0.15 -0.31 -0.91 -0.73 0.00 0.00 179.01 176.76 2b8y h ASN 111 N -0.23 0.63 -0.35 1.04 2.35 -1.76 -1.99 115.58 115.28 2b8y h ASN 111 Ca 0.14 -0.25 -0.02 0.00 -0.55 0.00 0.00 56.30 55.62 2b8y h ASN 111 Cb 0.44 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.62 2b8y h ASN 111 CO -0.38 0.91 0.15 0.15 -1.65 0.00 0.00 177.43 176.61 2b8y h PHE 112 N 0.53 0.52 -0.77 1.19 3.04 -0.88 -1.61 116.94 118.96 2b8y h PHE 112 Ca 0.06 -0.03 -0.05 0.00 3.98 0.00 0.00 57.97 61.93 2b8y h PHE 112 Cb 0.80 -0.16 -0.03 0.00 2.56 0.00 0.00 35.95 39.12 2b8y h PHE 112 CO 0.03 0.47 0.30 -0.07 -2.02 0.00 0.00 178.31 177.02 2b8y h LEU 113 N 0.42 1.07 -1.00 0.59 3.38 -0.59 -1.12 115.31 118.06 2b8y h LEU 113 Ca 0.12 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 2b8y h LEU 113 Cb 0.16 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 2b8y h LEU 113 CO -0.01 0.96 0.15 -0.33 0.09 0.00 0.00 178.44 179.30 2b8y h GLU 114 N 1.12 0.87 -0.38 1.13 4.39 -1.25 -0.80 114.58 119.66 2b8y h GLU 114 Ca 0.26 -0.18 -0.13 0.00 0.34 0.00 0.00 59.36 59.65 2b8y h GLU 114 Cb 0.23 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 2b8y h GLU 114 CO -0.02 0.78 -0.27 -0.09 -1.16 0.00 0.00 179.01 178.25 2b8y h ARG 115 N 0.84 0.85 -0.62 2.33 9.65 -1.05 -2.12 114.38 124.27 2b8y h ARG 115 Ca 0.19 -0.41 -0.05 0.00 -1.10 0.00 0.00 59.98 58.61 2b8y h ARG 115 Cb 0.29 -0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 28.84 2b8y h ARG 115 CO -0.00 1.05 0.20 1.25 2.80 0.00 0.00 179.97 185.27 2b8y h LEU 116 N 0.66 0.86 -0.53 3.80 5.85 -0.99 -1.67 115.31 123.29 2b8y h LEU 116 Ca 0.07 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 2b8y h LEU 116 Cb 0.84 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.63 2b8y h LEU 116 CO 0.07 0.80 0.27 0.50 -0.34 0.00 0.00 178.44 179.74 2b8y h LYS 117 N 0.90 0.76 -0.47 1.25 3.64 -0.99 0.69 116.57 122.35 2b8y h LYS 117 Ca 0.20 -0.11 0.05 0.00 -1.27 0.00 0.00 60.65 59.53 2b8y h LYS 117 Cb 0.25 -0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 31.88 2b8y h LYS 117 CO -0.01 0.61 0.20 1.15 -2.27 0.00 0.00 179.45 179.13 2b8y h THR 118 N 0.71 0.89 -0.60 1.00 2.02 -0.92 0.08 112.91 116.09 2b8y h THR 118 Ca 0.18 -0.13 -0.06 0.00 0.77 0.00 0.00 66.41 67.17 2b8y h THR 118 Cb 0.10 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 2b8y h THR 118 CO -0.02 0.07 0.14 0.40 0.37 0.00 0.00 175.52 176.48 2b8y h ILE 119 N 0.39 1.25 -0.41 3.11 2.04 -0.91 -1.57 117.51 121.41 2b8y h ILE 119 Ca 0.22 -0.92 -0.11 0.00 1.00 0.00 0.00 64.86 65.05 2b8y h ILE 119 Cb 0.19 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 2b8y h ILE 119 CO -0.19 0.34 -0.17 0.24 0.00 0.00 0.00 178.15 178.37 2b8y h MET 120 N 0.87 0.84 -0.56 2.37 2.86 -0.55 -1.46 114.93 119.30 2b8y h MET 120 Ca 0.19 -0.35 -0.01 0.00 -2.06 0.00 0.00 59.70 57.46 2b8y h MET 120 Cb 0.36 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.96 2b8y h MET 120 CO 0.00 0.99 0.30 0.00 1.06 0.00 0.00 176.91 179.26 2b8y h ARG 121 N 0.66 0.77 -0.33 1.72 3.08 -0.91 -1.18 114.38 118.19 2b8y h ARG 121 Ca 0.10 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 2b8y h ARG 121 Cb 0.72 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.60 2b8y h ARG 121 CO 0.05 0.57 0.13 1.49 -1.07 0.00 0.00 179.97 181.15 2b8y h GLU 122 N 0.78 0.49 -0.44 0.04 4.57 -0.98 0.00 114.58 119.04 2b8y h GLU 122 Ca 0.20 -0.09 0.02 0.00 -1.18 0.00 0.00 59.36 58.31 2b8y h GLU 122 Cb 0.03 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.51 2b8y h GLU 122 CO -0.03 0.49 0.26 0.87 -1.18 0.00 0.00 179.01 179.42 2b8y h LYS 123 N 0.39 0.50 -0.40 1.92 1.57 -0.85 -0.38 116.57 119.32 2b8y h LYS 123 Ca 0.11 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.90 2b8y h LYS 123 Cb 0.18 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.34 2b8y h LYS 123 CO -0.01 0.33 0.17 -0.92 -0.57 0.00 0.00 179.45 178.45 2b8y h TYR 124 N 0.52 0.31 -0.87 -1.35 5.03 -1.06 -2.14 116.97 117.41 2b8y h TYR 124 Ca 0.18 0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.54 2b8y h TYR 124 Cb 0.03 -0.08 -0.05 0.00 1.55 0.00 0.00 36.73 38.18 2b8y h TYR 124 CO -0.07 0.15 0.57 1.03 -1.32 0.00 0.00 178.16 178.51 2b8y h SER 125 N 0.36 0.93 1.03 -2.11 0.87 -0.56 -1.17 113.55 112.90 2b8y h SER 125 Ca 0.18 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 2b8y h SER 125 Cb 0.12 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 61.86 2b8y h SER 125 CO -0.15 0.65 0.00 0.11 -0.53 0.00 0.00 176.83 176.90 2b8y h LYS 126 N 1.09 0.00 0.00 2.24 1.79 -0.51 -2.96 116.57 118.21 2b8y h LYS 126 Ca 0.34 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.69 2b8y h LYS 126 Cb 0.01 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.64 2b8y h LYS 126 CO -0.10 0.00 -1.37 0.00 -1.08 0.00 0.00 179.45 176.90 2b8y s SER 128 N -5.62 4.96 0.00 0.00 1.04 -0.92 -5.09 113.70 108.08 2b8y s SER 128 Ca -0.03 -0.61 0.13 0.00 0.48 0.00 0.00 55.95 55.92 2b8y s SER 128 Cb 0.09 -0.89 0.78 0.00 0.10 0.00 0.00 66.02 66.10 2b8y s SER 128 CO 0.81 -0.26 1.21 -1.54 0.98 0.00 0.00 173.24 174.44