#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mp1 n HIS 25 N 0.00 0.00 -4.26 1.43 -0.00 -1.26 -4.55 115.22 106.58 1mp1 n HIS 25 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.72 57.58 1mp1 n HIS 25 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 29.94 1mp1 n HIS 25 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.34 175.01 1mp1 n MET 26 N 0.00 0.54 -3.20 -0.41 2.00 -1.26 -5.06 117.12 109.73 1mp1 n MET 26 Ca 0.00 -2.13 0.04 0.00 0.00 0.00 0.00 57.70 55.61 1mp1 n MET 26 Cb 0.00 1.37 -0.03 0.00 0.00 0.00 0.00 33.22 34.55 1mp1 n MET 26 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 175.97 177.11 1mp1 s GLN 27 N -2.93 0.09 0.07 0.03 1.03 -1.26 -4.94 119.66 111.75 1mp1 s GLN 27 Ca 0.17 0.20 -0.05 0.00 0.04 0.00 0.00 55.36 55.73 1mp1 s GLN 27 Cb 0.01 0.12 0.02 0.00 0.03 0.00 0.00 33.01 33.19 1mp1 s GLN 27 CO 0.12 -0.05 0.23 1.47 -2.54 0.00 0.00 175.29 174.52 1mp1 n LEU 28 N 4.89 0.00 -4.88 2.60 -0.00 -1.26 -5.14 117.00 113.21 1mp1 n LEU 28 Ca -0.07 -0.47 -0.30 0.00 -0.00 0.00 0.00 56.01 55.16 1mp1 n LEU 28 Cb 0.55 0.79 -0.04 0.00 -0.00 0.00 0.00 43.42 44.72 1mp1 n LEU 28 CO -0.07 -0.16 0.37 -0.75 -0.00 0.00 0.00 177.39 176.78 1mp1 s LYS 29 N -2.02 3.77 0.03 1.47 2.20 -1.26 -4.93 119.74 119.00 1mp1 s LYS 29 Ca 0.05 0.37 0.00 0.00 -0.36 0.00 0.00 55.97 56.03 1mp1 s LYS 29 Cb -0.01 -2.47 -0.00 0.00 -1.51 0.00 0.00 37.83 33.84 1mp1 s LYS 29 CO 0.02 0.06 0.00 1.97 -0.36 0.00 0.00 175.35 177.04 1mp1 n PHE 30 N -1.07 0.06 -0.96 4.03 1.16 -1.26 -4.93 117.46 114.49 1mp1 n PHE 30 Ca 0.01 -0.15 0.00 0.00 -1.87 0.00 0.00 57.45 55.45 1mp1 n PHE 30 Cb 0.54 -0.02 0.00 0.00 -1.61 0.00 0.00 39.48 38.39 1mp1 n PHE 30 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1mp1 n ALA 31 N -2.90 0.00 -0.07 1.98 0.00 -1.26 -5.04 120.51 113.21 1mp1 n ALA 31 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.33 1mp1 n ALA 31 Cb 0.04 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.42 1mp1 n ALA 31 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1mp1 n GLU 32 N -0.97 0.46 0.33 0.00 1.02 -1.26 -4.39 120.64 115.83 1mp1 n GLU 32 Ca 0.00 0.08 0.18 0.00 -0.02 0.00 0.00 57.16 57.40 1mp1 n GLU 32 Cb 0.00 -1.30 0.96 0.00 -0.02 0.00 0.00 31.44 31.08 1mp1 n GLU 32 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1mp1 n LEU 34 N -2.93 0.21 -1.62 0.00 4.77 -1.26 -1.24 117.00 114.92 1mp1 n LEU 34 Ca -0.02 0.57 -0.03 0.00 -0.03 0.00 0.00 56.01 56.50 1mp1 n LEU 34 Cb 0.25 -0.56 0.23 0.00 -2.33 0.00 0.00 43.42 41.01 1mp1 n LEU 34 CO 0.16 -0.48 0.82 -0.62 -1.33 0.00 0.00 177.39 175.94 1mp1 n GLU 35 N -1.75 3.11 0.00 3.23 1.02 0.29 -3.87 120.64 122.67 1mp1 n GLU 35 Ca 0.02 -2.19 0.12 0.00 -0.02 0.00 0.00 57.16 55.09 1mp1 n GLU 35 Cb 0.11 -1.97 0.24 0.00 -0.02 0.00 0.00 31.44 29.80 1mp1 n GLU 35 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1mp1 n LYS 36 N 0.06 0.78 -1.09 3.49 4.76 -0.37 -5.06 118.16 120.72 1mp1 n LYS 36 Ca 0.28 -0.53 0.13 0.00 -2.87 0.00 0.00 58.31 55.31 1mp1 n LYS 36 Cb 1.07 -1.49 -0.04 0.00 -1.84 0.00 0.00 35.03 32.73 1mp1 n LYS 36 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1mp1 n LYS 37 N -0.64 -2.09 0.00 1.97 4.01 -1.25 -5.04 118.16 115.12 1mp1 n LYS 37 Ca 0.10 1.50 0.00 0.00 -0.51 0.00 0.00 58.31 59.40 1mp1 n LYS 37 Cb 0.38 -2.62 0.00 0.00 -0.51 0.00 0.00 35.03 32.28 1mp1 n LYS 37 CO 0.00 0.00 0.00 1.33 -1.11 0.00 0.00 177.40 177.62 1mp1 n VAL 38 N -3.39 0.00 -3.07 -0.18 0.24 -1.26 -4.85 118.33 105.82 1mp1 n VAL 38 Ca -0.01 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.33 1mp1 n VAL 38 Cb 0.62 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.99 1mp1 n VAL 38 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1mp1 s ASP 39 N 1.67 -0.33 0.54 -1.34 -1.08 -1.26 -4.89 116.67 109.98 1mp1 s ASP 39 Ca 0.00 -0.00 0.29 0.00 -0.52 0.00 0.00 52.55 52.32 1mp1 s ASP 39 Cb 0.00 1.05 1.57 0.00 -1.46 0.00 0.00 42.92 44.08 1mp1 s ASP 39 CO 0.00 -0.06 2.12 0.24 0.52 0.00 0.00 175.17 177.99 1mp1 h MET 40 N 6.84 0.00 0.00 4.34 2.86 -1.73 0.17 114.93 127.40 1mp1 h MET 40 Ca -0.09 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1mp1 h MET 40 Cb 1.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.85 1mp1 h MET 40 CO -0.10 0.09 0.00 0.45 1.06 0.00 0.00 176.91 178.40 1mp1 n SER 41 N -3.62 0.00 -0.02 1.22 2.88 -1.26 -3.10 113.62 109.72 1mp1 n SER 41 Ca -0.02 0.15 -0.02 0.00 -1.33 0.00 0.00 58.87 57.65 1mp1 n SER 41 Cb 0.20 -0.34 -0.02 0.00 -0.75 0.00 0.00 64.21 63.31 1mp1 n SER 41 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1mp1 n LYS 42 N -1.34 0.52 -4.17 -1.46 4.76 -0.03 -5.04 118.16 111.40 1mp1 n LYS 42 Ca 0.08 0.02 -0.28 0.00 -2.87 0.00 0.00 58.31 55.25 1mp1 n LYS 42 Cb 0.16 -1.07 -0.08 0.00 -1.84 0.00 0.00 35.03 32.21 1mp1 n LYS 42 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1mp1 s VAL 43 N -2.06 3.83 -0.13 -0.18 0.11 0.39 -3.96 120.40 118.39 1mp1 s VAL 43 Ca -0.04 -1.21 -0.20 0.00 -2.93 0.00 0.00 61.98 57.60 1mp1 s VAL 43 Cb 0.01 -2.87 -0.04 0.00 -1.53 0.00 0.00 36.38 31.96 1mp1 s VAL 43 CO 0.08 0.01 0.58 0.20 -3.33 0.00 0.00 175.10 172.65 1mp1 s ASN 44 N -2.60 6.77 0.02 3.54 0.01 0.12 -4.30 114.94 118.50 1mp1 s ASN 44 Ca 0.26 0.92 0.16 0.00 -0.71 0.00 0.00 52.86 53.49 1mp1 s ASN 44 Cb -0.11 -2.34 -0.17 0.00 0.41 0.00 0.00 41.25 39.05 1mp1 s ASN 44 CO 0.18 -0.12 0.76 0.00 -1.51 0.00 0.00 177.10 176.42 1mp1 n LEU 45 N 4.13 0.85 -0.26 0.60 -0.00 -1.26 -3.96 117.00 117.09 1mp1 n LEU 45 Ca -0.04 0.38 0.03 0.00 -0.00 0.00 0.00 56.01 56.39 1mp1 n LEU 45 Cb 0.51 0.11 0.25 0.00 -0.00 0.00 0.00 43.42 44.29 1mp1 n LEU 45 CO 0.44 0.22 1.24 -0.33 -0.00 0.00 0.00 177.39 178.97 1mp1 h GLU 46 N 0.00 0.97 0.00 1.47 4.39 -1.93 0.51 114.58 119.99 1mp1 h GLU 46 Ca -0.21 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.44 1mp1 h GLU 46 Cb 1.72 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 30.16 1mp1 h GLU 46 CO 0.06 0.64 0.00 1.33 -1.16 0.00 0.00 179.01 179.87 1mp1 n VAL 47 N -4.46 0.77 0.41 3.13 0.24 -1.25 -0.88 118.33 116.28 1mp1 n VAL 47 Ca 0.12 0.19 0.04 0.00 -2.04 0.00 0.00 64.34 62.65 1mp1 n VAL 47 Cb 0.15 -0.97 -0.01 0.00 -1.47 0.00 0.00 33.84 31.54 1mp1 n VAL 47 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1mp1 n ILE 48 N -1.35 0.00 -0.07 1.34 2.08 0.16 -4.41 119.36 117.11 1mp1 n ILE 48 Ca 0.05 -0.37 -0.08 0.00 0.56 0.00 0.00 62.75 62.91 1mp1 n ILE 48 Cb 0.12 1.08 -0.01 0.00 -0.75 0.00 0.00 39.64 40.08 1mp1 n ILE 48 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 1mp1 h LYS 49 N 0.74 0.27 0.00 0.38 1.63 0.92 1.51 116.57 122.02 1mp1 h LYS 49 Ca 0.00 -0.02 -0.12 0.00 -0.85 0.00 0.00 60.65 59.67 1mp1 h LYS 49 Cb 0.28 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.84 1mp1 h LYS 49 CO 0.00 0.18 -0.55 -1.00 -3.45 0.00 0.00 179.45 174.63 1mp1 h PRO 50 N 0.28 0.00 -0.06 1.90 0.13 -1.80 0.30 132.00 132.75 1mp1 h PRO 50 Ca 0.11 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.11 1mp1 h PRO 50 Cb 0.03 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.17 1mp1 h PRO 50 CO -0.08 0.55 -0.47 2.35 -0.23 0.00 0.00 178.00 180.13 1mp1 h TRP 51 N 0.00 0.59 0.09 1.56 7.01 -1.60 0.12 115.95 123.72 1mp1 h TRP 51 Ca -0.01 -0.28 -0.00 0.00 2.11 0.00 0.00 58.89 60.71 1mp1 h TRP 51 Cb 1.17 -0.08 0.00 0.00 -2.10 0.00 0.00 29.16 28.15 1mp1 h TRP 51 CO 0.00 1.05 -0.04 0.82 -2.79 0.00 0.00 178.44 177.48 1mp1 h ILE 52 N -0.04 1.15 -1.00 2.65 2.04 0.21 0.43 117.51 122.95 1mp1 h ILE 52 Ca -0.04 -1.08 0.05 0.00 1.00 0.00 0.00 64.86 64.80 1mp1 h ILE 52 Cb 1.14 1.83 -0.06 0.00 -0.74 0.00 0.00 36.82 38.98 1mp1 h ILE 52 CO 0.10 0.26 0.65 0.74 0.00 0.00 0.00 178.15 179.89 1mp1 h THR 53 N -0.63 1.12 -0.07 -0.27 2.02 -0.48 1.36 112.91 115.96 1mp1 h THR 53 Ca -0.01 -0.42 -0.18 0.00 0.77 0.00 0.00 66.41 66.57 1mp1 h THR 53 Cb 0.51 -0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 66.72 1mp1 h THR 53 CO 0.02 0.22 -0.72 0.50 0.37 0.00 0.00 175.52 175.91 1mp1 h LYS 54 N 1.21 0.35 0.01 6.66 3.64 -0.73 0.03 116.57 127.73 1mp1 h LYS 54 Ca 0.42 -0.29 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1mp1 h LYS 54 Cb 0.11 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1mp1 h LYS 54 CO -0.15 0.93 -0.00 0.00 -2.27 0.00 0.00 179.45 177.96 1mp1 h ARG 55 N 0.24 -0.01 -0.81 1.90 2.47 0.13 0.27 114.38 118.58 1mp1 h ARG 55 Ca -0.03 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.67 1mp1 h ARG 55 Cb 1.29 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.58 1mp1 h ARG 55 CO 0.12 0.58 0.40 -0.39 0.56 0.00 0.00 179.97 181.24 1mp1 h VAL 56 N -0.60 1.25 -0.44 2.04 -1.51 0.17 0.87 116.25 118.03 1mp1 h VAL 56 Ca -0.00 -0.69 -0.14 0.00 -1.23 0.00 0.00 66.70 64.64 1mp1 h VAL 56 Cb 0.59 0.22 -0.01 0.00 -2.13 0.00 0.00 31.29 29.95 1mp1 h VAL 56 CO 0.00 0.30 -0.28 0.74 -1.23 0.00 0.00 177.57 177.09 1mp1 h THR 57 N 1.14 1.27 0.00 7.19 2.02 -1.00 -2.86 112.91 120.68 1mp1 h THR 57 Ca 0.28 -1.45 -0.13 0.00 0.77 0.00 0.00 66.41 65.88 1mp1 h THR 57 Cb 0.10 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 1mp1 h THR 57 CO -0.04 0.49 -0.62 -0.33 0.37 0.00 0.00 175.52 175.39 1mp1 h GLU 58 N 0.81 0.00 -0.39 6.66 5.08 0.06 3.13 114.58 129.92 1mp1 h GLU 58 Ca 0.09 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.49 1mp1 h GLU 58 Cb 0.86 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.07 1mp1 h GLU 58 CO 0.08 0.62 0.15 0.82 -1.00 0.00 0.00 179.01 179.68 1mp1 h ILE 59 N 0.00 0.90 0.00 3.13 2.04 0.98 -3.29 117.51 121.27 1mp1 h ILE 59 Ca -0.01 -0.11 -0.43 0.00 1.00 0.00 0.00 64.86 65.32 1mp1 h ILE 59 Cb 1.15 0.56 -0.07 0.00 -0.74 0.00 0.00 36.82 37.72 1mp1 h ILE 59 CO 0.08 0.06 -2.48 0.00 0.00 0.00 0.00 178.15 175.80 1mp1 n LEU 60 N -5.00 2.34 0.00 1.44 -0.00 -1.15 -5.00 117.00 109.63 1mp1 n LEU 60 Ca 0.02 0.17 0.00 0.00 -0.00 0.00 0.00 56.01 56.20 1mp1 n LEU 60 Cb 0.14 -0.86 0.00 0.00 -0.00 0.00 0.00 43.42 42.70 1mp1 n LEU 60 CO 0.27 0.71 0.00 0.61 -0.00 0.00 0.00 177.39 178.98 1mp1 n GLY 61 N 1.63 1.14 3.25 1.47 0.00 1.03 -5.10 105.19 108.61 1mp1 n GLY 61 Ca -0.51 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.32 1mp1 n GLY 61 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1mp1 s PHE 62 N -1.38 1.48 -0.36 1.61 -0.12 -0.54 -4.83 117.98 113.83 1mp1 s PHE 62 Ca 0.00 -0.51 -0.28 0.00 -0.05 0.00 0.00 56.93 56.08 1mp1 s PHE 62 Cb 0.00 -0.78 -0.02 0.00 -0.63 0.00 0.00 43.02 41.60 1mp1 s PHE 62 CO 0.00 0.16 1.77 -2.00 -0.05 0.00 0.00 175.22 175.11 1mp1 s GLU 63 N -2.46 3.29 0.00 1.99 2.12 -1.26 -4.14 118.70 118.24 1mp1 s GLU 63 Ca 0.08 1.32 0.00 0.00 0.36 0.00 0.00 54.97 56.73 1mp1 s GLU 63 Cb -0.06 -4.20 0.00 0.00 0.26 0.00 0.00 34.13 30.13 1mp1 s GLU 63 CO 0.04 -1.91 0.00 -0.25 -0.54 0.00 0.00 175.26 172.60 1mp1 n ASP 64 N 10.38 0.00 0.07 -1.70 9.92 -1.26 -5.04 116.55 128.92 1mp1 n ASP 64 Ca 0.22 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.48 1mp1 n ASP 64 Cb 0.47 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.95 1mp1 n ASP 64 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1mp1 n ASP 65 N 0.00 -1.26 -0.24 -2.24 2.03 -1.26 -4.86 116.55 108.71 1mp1 n ASP 65 Ca 0.00 0.46 -0.07 0.00 0.52 0.00 0.00 54.79 55.70 1mp1 n ASP 65 Cb 0.00 1.42 0.07 0.00 -0.72 0.00 0.00 41.12 41.89 1mp1 n ASP 65 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 1mp1 h VAL 66 N 0.00 1.26 -0.14 5.18 3.04 -1.98 0.68 116.25 124.29 1mp1 h VAL 66 Ca 0.00 -0.95 -0.13 0.00 -1.01 0.00 0.00 66.70 64.60 1mp1 h VAL 66 Cb 0.00 0.53 0.00 0.00 -2.01 0.00 0.00 31.29 29.81 1mp1 h VAL 66 CO 0.00 0.37 -0.44 -0.37 -1.01 0.00 0.00 177.57 176.12 1mp1 h VAL 67 N 1.06 1.35 -0.01 1.51 -1.51 -1.92 -1.49 116.25 115.24 1mp1 h VAL 67 Ca 0.22 -1.72 -0.00 0.00 -1.23 0.00 0.00 66.70 63.97 1mp1 h VAL 67 Cb 0.36 2.06 -0.00 0.00 -2.13 0.00 0.00 31.29 31.58 1mp1 h VAL 67 CO 0.00 0.52 0.01 0.40 -1.23 0.00 0.00 177.57 177.27 1mp1 h ILE 68 N 0.17 1.08 -0.84 7.19 2.04 -1.83 -1.62 117.51 123.70 1mp1 h ILE 68 Ca -0.02 -0.24 0.07 0.00 1.00 0.00 0.00 64.86 65.67 1mp1 h ILE 68 Cb 1.06 1.22 -0.06 0.00 -0.74 0.00 0.00 36.82 38.30 1mp1 h ILE 68 CO 0.09 0.06 0.51 -0.33 0.00 0.00 0.00 178.15 178.49 1mp1 h GLU 69 N -0.08 0.90 -0.43 2.37 5.08 0.33 0.77 114.58 123.52 1mp1 h GLU 69 Ca 0.00 -0.05 0.04 0.00 -1.00 0.00 0.00 59.36 58.35 1mp1 h GLU 69 Cb 0.10 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 1mp1 h GLU 69 CO -0.00 0.59 0.21 0.74 -1.00 0.00 0.00 179.01 179.55 1mp1 h PHE 70 N 0.92 0.38 -0.16 4.33 0.04 -0.89 2.17 116.94 123.74 1mp1 h PHE 70 Ca 0.37 0.02 -0.11 0.00 2.80 0.00 0.00 57.97 61.05 1mp1 h PHE 70 Cb 0.20 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 38.24 1mp1 h PHE 70 CO -0.04 0.19 -0.34 0.82 -0.60 0.00 0.00 178.31 178.34 1mp1 h ILE 71 N 0.42 1.35 -0.10 -0.55 2.04 -0.48 0.13 117.51 120.32 1mp1 h ILE 71 Ca 0.18 -1.60 -0.01 0.00 1.00 0.00 0.00 64.86 64.44 1mp1 h ILE 71 Cb 0.10 1.97 -0.00 0.00 -0.74 0.00 0.00 36.82 38.14 1mp1 h ILE 71 CO -0.14 0.48 0.04 0.15 0.00 0.00 0.00 178.15 178.69 1mp1 h PHE 72 N 0.15 0.16 -0.69 1.37 3.04 0.92 1.62 116.94 123.51 1mp1 h PHE 72 Ca 0.00 -0.01 -0.07 0.00 3.98 0.00 0.00 57.97 61.86 1mp1 h PHE 72 Cb 0.94 -0.05 -0.03 0.00 2.56 0.00 0.00 35.95 39.38 1mp1 h PHE 72 CO 0.10 0.29 0.14 -0.91 -2.02 0.00 0.00 178.31 175.91 1mp1 h ASN 73 N -0.01 1.08 -0.19 0.41 2.35 0.35 0.24 115.58 119.81 1mp1 h ASN 73 Ca 0.03 -0.24 -0.19 0.00 -0.55 0.00 0.00 56.30 55.35 1mp1 h ASN 73 Cb 0.20 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.28 1mp1 h ASN 73 CO -0.00 1.05 -0.58 1.56 -1.65 0.00 0.00 177.43 177.80 1mp1 h GLN 74 N 1.06 0.79 0.00 0.81 7.50 -0.52 -2.53 115.11 122.23 1mp1 h GLN 74 Ca 0.21 -0.52 0.00 0.00 0.50 0.00 0.00 58.65 58.84 1mp1 h GLN 74 Cb 0.41 0.07 0.00 0.00 0.05 0.00 0.00 27.48 28.01 1mp1 h GLN 74 CO 0.01 1.15 0.00 1.28 -1.50 0.00 0.00 178.83 179.77 1mp1 n LEU 75 N -3.98 0.00 -0.14 1.46 4.77 0.55 -2.56 117.00 117.09 1mp1 n LEU 75 Ca -0.04 0.18 0.14 0.00 -0.03 0.00 0.00 56.01 56.25 1mp1 n LEU 75 Cb 0.64 -0.18 0.60 0.00 -2.33 0.00 0.00 43.42 42.15 1mp1 n LEU 75 CO 0.50 -0.01 0.86 -0.62 -1.33 0.00 0.00 177.39 176.79 1mp1 n GLU 76 N -1.18 0.77 -1.27 3.23 -0.58 0.81 -4.83 120.64 117.60 1mp1 n GLU 76 Ca 0.17 -0.29 -0.01 0.00 -0.42 0.00 0.00 57.16 56.61 1mp1 n GLU 76 Cb 0.18 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.56 1mp1 n GLU 76 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1mp1 n VAL 77 N -0.87 0.00 0.02 2.62 0.24 -1.06 -5.04 118.33 114.25 1mp1 n VAL 77 Ca 0.15 -0.08 0.11 0.00 -2.04 0.00 0.00 64.34 62.47 1mp1 n VAL 77 Cb 0.28 -0.79 -0.16 0.00 -1.47 0.00 0.00 33.84 31.69 1mp1 n VAL 77 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1mp1 n LYS 78 N -0.86 0.63 -3.42 7.34 4.01 -1.26 -4.43 118.16 120.16 1mp1 n LYS 78 Ca 0.00 -0.19 -0.23 0.00 -0.51 0.00 0.00 58.31 57.39 1mp1 n LYS 78 Cb 0.02 -1.50 -0.10 0.00 -0.51 0.00 0.00 35.03 32.94 1mp1 n LYS 78 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 1mp1 s ASN 79 N -4.40 2.14 0.61 4.39 0.01 -1.26 -3.18 114.94 113.25 1mp1 s ASN 79 Ca -0.07 -1.68 -0.15 0.00 -0.71 0.00 0.00 52.86 50.25 1mp1 s ASN 79 Cb 0.14 0.11 -0.03 0.00 0.41 0.00 0.00 41.25 41.87 1mp1 s ASN 79 CO 0.88 -0.31 1.05 -2.16 -1.51 0.00 0.00 177.10 175.05 1mp1 s PRO 80 N 1.47 3.30 -1.08 -0.60 0.04 -1.26 -4.99 135.00 131.89 1mp1 s PRO 80 Ca 0.16 1.13 -0.10 0.00 0.04 0.00 0.00 61.00 62.23 1mp1 s PRO 80 Cb -0.18 -2.03 0.26 0.00 0.04 0.00 0.00 34.50 32.59 1mp1 s PRO 80 CO -0.09 -0.82 1.09 0.34 0.04 0.00 0.00 177.00 177.56 1mp1 s ASP 81 N -3.01 7.23 0.58 6.66 2.15 -1.26 -4.85 116.67 124.16 1mp1 s ASP 81 Ca 0.62 -3.42 0.38 0.00 0.43 0.00 0.00 52.55 50.57 1mp1 s ASP 81 Cb -0.15 -2.23 1.39 0.00 -0.30 0.00 0.00 42.92 41.63 1mp1 s ASP 81 CO 0.40 -0.37 1.52 0.77 -0.17 0.00 0.00 175.17 177.32 1mp1 h SER 82 N 6.87 0.00 -0.07 -0.34 4.64 -1.94 1.59 113.55 124.30 1mp1 h SER 82 Ca 0.18 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.49 1mp1 h SER 82 Cb 0.90 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1mp1 h SER 82 CO 0.99 0.00 0.02 0.11 -0.87 0.00 0.00 176.83 177.09 1mp1 h LYS 83 N 0.00 0.11 -0.43 4.77 1.79 -1.89 -0.34 116.57 120.59 1mp1 h LYS 83 Ca 0.67 -0.02 -0.08 0.00 -2.18 0.00 0.00 60.65 59.03 1mp1 h LYS 83 Cb 3.09 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 33.71 1mp1 h LYS 83 CO -0.01 0.27 -0.08 0.52 -1.08 0.00 0.00 179.45 179.08 1mp1 h MET 84 N -0.06 0.75 0.31 3.15 2.86 0.19 0.87 114.93 122.99 1mp1 h MET 84 Ca 0.02 -0.23 -0.02 0.00 -2.06 0.00 0.00 59.70 57.42 1mp1 h MET 84 Cb 0.20 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.79 1mp1 h MET 84 CO -0.00 0.81 -0.15 1.98 1.06 0.00 0.00 176.91 180.61 1mp1 h MET 85 N 0.69 -0.40 -0.23 1.72 -1.53 -1.06 0.72 114.93 114.84 1mp1 h MET 85 Ca 0.12 0.03 -0.08 0.00 -3.44 0.00 0.00 59.70 56.33 1mp1 h MET 85 Cb 0.54 0.09 -0.01 0.00 -0.55 0.00 0.00 31.60 31.66 1mp1 h MET 85 CO 0.03 -0.21 -0.22 0.37 0.14 0.00 0.00 176.91 177.03 1mp1 h GLN 86 N -0.51 0.41 -0.41 0.39 4.15 -1.00 0.57 115.11 118.72 1mp1 h GLN 86 Ca -0.04 -0.14 -0.15 0.00 0.77 0.00 0.00 58.65 59.09 1mp1 h GLN 86 Cb 0.38 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.03 1mp1 h GLN 86 CO 0.07 0.61 -0.34 0.82 -1.93 0.00 0.00 178.83 178.06 1mp1 h ILE 87 N 0.37 1.27 -0.12 2.39 2.04 -0.58 -0.14 117.51 122.74 1mp1 h ILE 87 Ca 0.06 -1.52 -0.17 0.00 1.00 0.00 0.00 64.86 64.24 1mp1 h ILE 87 Cb 0.59 1.31 0.01 0.00 -0.74 0.00 0.00 36.82 37.99 1mp1 h ILE 87 CO 0.04 0.51 -0.57 0.78 0.00 0.00 0.00 178.15 178.91 1mp1 h ASN 88 N 0.79 0.71 -0.56 1.72 2.35 0.85 -3.03 115.58 118.41 1mp1 h ASN 88 Ca 0.07 -0.64 0.03 0.00 -0.55 0.00 0.00 56.30 55.22 1mp1 h ASN 88 Cb 0.94 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 39.06 1mp1 h ASN 88 CO 0.09 1.23 0.33 -0.07 -1.65 0.00 0.00 177.43 177.36 1mp1 h LEU 89 N 0.24 0.52 -2.72 1.61 3.38 0.21 1.00 115.31 119.55 1mp1 h LEU 89 Ca -0.04 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1mp1 h LEU 89 Cb 1.21 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 1mp1 h LEU 89 CO 0.12 0.36 0.04 0.74 0.09 0.00 0.00 178.44 179.79 1mp1 h THR 90 N 0.65 0.20 0.00 0.22 2.02 -1.00 1.95 112.91 116.94 1mp1 h THR 90 Ca 0.23 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.35 1mp1 h THR 90 Cb 0.06 0.97 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 1mp1 h THR 90 CO -0.12 0.00 -0.31 1.23 0.37 0.00 0.00 175.52 176.70 1mp1 h GLY 91 N 0.00 0.00 0.00 2.16 0.00 -0.67 -3.35 103.07 101.21 1mp1 h GLY 91 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.20 1mp1 h GLY 91 CO -0.00 0.00 -1.50 0.69 0.00 0.00 0.00 176.54 175.73 1mp1 n PHE 92 N -3.51 0.00 -0.21 5.60 3.01 0.49 -5.04 117.46 117.80 1mp1 n PHE 92 Ca -0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1mp1 n PHE 92 Cb 0.46 -0.33 0.00 0.00 -0.01 0.00 0.00 39.48 39.60 1mp1 n PHE 92 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1mp1 n LEU 93 N -3.05 0.00 -0.25 4.37 4.77 0.63 -4.92 117.00 118.55 1mp1 n LEU 93 Ca -0.17 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 55.93 1mp1 n LEU 93 Cb 0.65 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.94 1mp1 n LEU 93 CO 0.05 -0.91 0.45 0.59 -1.33 0.00 0.00 177.39 176.25 1mp1 n ASN 94 N -2.00 1.21 0.00 -1.43 3.02 -1.26 -4.81 115.26 109.99 1mp1 n ASN 94 Ca 0.00 -0.97 0.00 0.00 -0.03 0.00 0.00 54.58 53.58 1mp1 n ASN 94 Cb 0.00 0.34 0.00 0.00 -0.61 0.00 0.00 39.78 39.51 1mp1 n ASN 94 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mp1 n GLY 95 N 1.40 2.90 0.16 7.41 0.00 -1.26 -4.73 105.19 111.07 1mp1 n GLY 95 Ca 0.09 -0.75 -0.01 0.00 0.00 0.00 0.00 46.02 45.36 1mp1 n GLY 95 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mp1 h LYS 96 N 0.00 0.07 -0.05 1.61 1.79 -1.96 -2.50 116.57 115.53 1mp1 h LYS 96 Ca 0.00 -0.04 -0.10 0.00 -2.18 0.00 0.00 60.65 58.33 1mp1 h LYS 96 Cb 0.00 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 1mp1 h LYS 96 CO 0.00 0.58 -0.43 -0.91 -1.08 0.00 0.00 179.45 177.60 1mp1 h ASN 97 N 0.06 0.12 -0.46 0.86 4.21 -1.96 -1.81 115.58 116.60 1mp1 h ASN 97 Ca -0.00 -0.05 -0.03 0.00 1.21 0.00 0.00 56.30 57.42 1mp1 h ASN 97 Cb 0.94 -0.03 -0.02 0.00 -1.12 0.00 0.00 38.32 38.08 1mp1 h ASN 97 CO 0.07 0.54 0.16 0.00 -1.29 0.00 0.00 177.43 176.91 1mp1 h ALA 98 N 1.46 0.60 -0.61 -0.83 0.00 -1.79 1.27 119.26 119.37 1mp1 h ALA 98 Ca 0.01 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 1mp1 h ALA 98 Cb 0.81 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1mp1 h ALA 98 CO 0.06 0.24 0.01 0.00 0.00 0.00 0.00 179.25 179.56 1mp1 h ARG 99 N 0.61 1.06 -0.13 0.00 3.08 -1.35 0.99 114.38 118.63 1mp1 h ARG 99 Ca 0.15 -0.33 -0.21 0.00 0.07 0.00 0.00 59.98 59.66 1mp1 h ARG 99 Cb 0.24 -0.10 0.01 0.00 0.08 0.00 0.00 29.97 30.20 1mp1 h ARG 99 CO -0.01 1.03 -0.76 1.49 -1.07 0.00 0.00 179.97 180.65 1mp1 h GLU 100 N 0.97 0.67 -0.01 0.04 4.22 -1.00 -1.99 114.58 117.48 1mp1 h GLU 100 Ca 0.17 -0.55 -0.00 0.00 0.08 0.00 0.00 59.36 59.06 1mp1 h GLU 100 Cb 0.55 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.91 1mp1 h GLU 100 CO 0.03 1.17 0.00 0.35 -2.18 0.00 0.00 179.01 178.38 1mp1 h PHE 101 N 0.46 0.01 0.00 0.92 3.04 0.18 -2.82 116.94 118.73 1mp1 h PHE 101 Ca -0.05 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.87 1mp1 h PHE 101 Cb 1.38 -0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.88 1mp1 h PHE 101 CO 0.07 0.26 -0.18 0.52 -2.02 0.00 0.00 178.31 176.97 1mp1 h MET 102 N -0.24 0.00 -0.45 1.11 2.86 -0.86 -0.61 114.93 116.74 1mp1 h MET 102 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1mp1 h MET 102 Cb 0.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.92 1mp1 h MET 102 CO 0.00 0.18 0.00 0.41 1.06 0.00 0.00 176.91 178.56 1mp1 n GLY 103 N -0.99 0.32 0.00 8.32 0.00 -0.75 -0.59 105.19 111.49 1mp1 n GLY 103 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1mp1 n GLY 103 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1mp1 n GLU 104 N -0.14 2.11 -0.08 1.61 1.02 -0.34 -4.63 120.64 120.19 1mp1 n GLU 104 Ca 0.03 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.99 1mp1 n GLU 104 Cb 0.18 -0.77 -0.13 0.00 -0.02 0.00 0.00 31.44 30.70 1mp1 n GLU 104 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1mp1 n LEU 105 N -1.30 2.30 -0.22 -4.62 -0.00 -0.57 -2.89 117.00 109.70 1mp1 n LEU 105 Ca 0.00 0.02 -0.06 0.00 -0.00 0.00 0.00 56.01 55.97 1mp1 n LEU 105 Cb 0.27 -0.69 0.04 0.00 -0.00 0.00 0.00 43.42 43.03 1mp1 n LEU 105 CO 0.00 0.81 1.10 -0.25 -0.00 0.00 0.00 177.39 179.05 1mp1 h TRP 106 N 0.02 0.81 0.00 1.96 2.91 -1.07 -1.80 115.95 118.77 1mp1 h TRP 106 Ca -0.51 -0.00 -0.12 0.00 1.13 0.00 0.00 58.89 59.39 1mp1 h TRP 106 Cb 2.00 -0.27 -0.02 0.00 -0.51 0.00 0.00 29.16 30.36 1mp1 h TRP 106 CO 0.04 0.55 -0.57 -1.00 -1.03 0.00 0.00 178.44 176.43 1mp1 h PRO 107 N 0.83 0.00 -0.72 2.65 0.13 -1.74 -2.89 132.00 130.26 1mp1 h PRO 107 Ca 0.22 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.38 1mp1 h PRO 107 Cb -0.03 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.06 1mp1 h PRO 107 CO -0.04 0.57 0.45 1.25 -0.23 0.00 0.00 178.00 180.00 1mp1 h LEU 108 N 0.00 0.74 -0.65 1.56 5.85 -1.21 -0.88 115.31 120.71 1mp1 h LEU 108 Ca -0.01 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.57 1mp1 h LEU 108 Cb 1.18 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 1mp1 h LEU 108 CO 0.07 0.51 -0.60 -0.07 -0.34 0.00 0.00 178.44 178.01 1mp1 h LEU 109 N 0.88 0.28 -0.70 2.25 3.38 -1.36 -1.23 115.31 118.80 1mp1 h LEU 109 Ca 0.29 -0.16 0.10 0.00 0.09 0.00 0.00 57.88 58.21 1mp1 h LEU 109 Cb 0.03 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 40.63 1mp1 h LEU 109 CO -0.12 0.81 0.32 -0.07 0.09 0.00 0.00 178.44 179.48 1mp1 h LEU 110 N 0.18 0.38 -0.03 1.67 4.07 -0.97 1.35 115.31 121.96 1mp1 h LEU 110 Ca -0.01 0.07 -0.23 0.00 0.08 0.00 0.00 57.88 57.79 1mp1 h LEU 110 Cb 1.11 0.02 -0.01 0.00 1.08 0.00 0.00 40.66 42.85 1mp1 h LEU 110 CO 0.09 0.21 -1.07 0.28 -1.08 0.00 0.00 178.44 176.88 1mp1 h SER 111 N 0.53 0.28 -0.23 -0.43 0.02 -1.24 -3.19 113.55 109.29 1mp1 h SER 111 Ca 0.35 -0.27 -0.02 0.00 -0.84 0.00 0.00 61.79 61.01 1mp1 h SER 111 Cb 0.42 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1mp1 h SER 111 CO -0.30 1.16 0.05 0.00 -1.14 0.00 0.00 176.83 176.61 1mp1 h ALA 112 N 0.80 0.30 0.00 3.77 0.00 0.12 -1.51 119.26 122.74 1mp1 h ALA 112 Ca -0.08 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1mp1 h ALA 112 Cb 1.77 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.48 1mp1 h ALA 112 CO 0.16 -0.05 0.00 -0.56 0.00 0.00 0.00 179.25 178.81 1mp1 h GLN 113 N 0.19 0.00 -0.00 0.00 3.07 0.17 0.47 115.11 119.00 1mp1 h GLN 113 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.81 1mp1 h GLN 113 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.84 1mp1 h GLN 113 CO 0.00 0.00 -0.48 0.39 0.09 0.00 0.00 178.83 178.83 1mp1 n GLU 114 N -2.35 0.31 -0.08 0.06 1.02 -0.60 -4.80 120.64 114.20 1mp1 n GLU 114 Ca -0.01 -0.20 0.00 0.00 -0.02 0.00 0.00 57.16 56.93 1mp1 n GLU 114 Cb 0.06 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.98 1mp1 n GLU 114 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1mp1 n ASN 115 N -1.17 0.00 -0.05 1.62 2.85 0.17 -5.07 115.26 113.61 1mp1 n ASN 115 Ca 0.08 -0.19 -0.10 0.00 -0.11 0.00 0.00 54.58 54.26 1mp1 n ASN 115 Cb 0.34 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.32 1mp1 n ASN 115 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1mp1 n ILE 116 N -0.29 0.57 1.49 -1.44 0.00 -1.26 -4.54 119.36 113.90 1mp1 n ILE 116 Ca 0.00 -0.17 0.08 0.00 0.00 0.00 0.00 62.75 62.67 1mp1 n ILE 116 Cb 0.00 -1.40 0.36 0.00 0.00 0.00 0.00 39.64 38.60 1mp1 n ILE 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1mp1 n ALA 117 N -3.26 2.54 -3.23 1.51 0.00 -1.26 -4.89 120.51 111.92 1mp1 n ALA 117 Ca -0.20 -0.36 -0.16 0.00 0.00 0.00 0.00 53.44 52.72 1mp1 n ALA 117 Cb 0.66 -1.13 0.06 0.00 0.00 0.00 0.00 19.45 19.04 1mp1 n ALA 117 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mp1 n GLY 118 N 0.95 -0.13 3.27 0.00 0.00 -1.25 -4.36 105.19 103.67 1mp1 n GLY 118 Ca 0.13 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1mp1 n GLY 118 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mp1 s ILE 119 N -3.24 2.03 0.42 -0.61 1.09 -1.25 0.11 121.20 119.76 1mp1 s ILE 119 Ca 0.32 -1.07 -0.23 0.00 -1.10 0.00 0.00 60.65 58.57 1mp1 s ILE 119 Cb -0.14 -1.71 -0.09 0.00 -1.06 0.00 0.00 42.46 39.46 1mp1 s ILE 119 CO 0.53 0.57 1.05 -2.16 -0.10 0.00 0.00 174.94 174.82 1mp1 s PRO 120 N -0.27 4.07 0.45 2.79 0.04 -1.26 -4.29 135.00 136.52 1mp1 s PRO 120 Ca -0.00 1.48 0.29 0.00 0.04 0.00 0.00 61.00 62.81 1mp1 s PRO 120 Cb -0.13 -2.43 1.56 0.00 0.04 0.00 0.00 34.50 33.55 1mp1 s PRO 120 CO 0.02 -0.22 1.87 0.66 0.04 0.00 0.00 177.00 179.38 1mp1 h SER 121 N 2.26 0.00 -0.13 6.66 4.64 -1.88 0.40 113.55 125.50 1mp1 h SER 121 Ca -0.49 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 60.85 1mp1 h SER 121 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 1mp1 h SER 121 CO 0.61 0.00 0.09 0.00 -0.87 0.00 0.00 176.83 176.67 1mp1 h ALA 122 N 1.89 1.99 0.02 5.18 0.00 -1.94 -1.99 119.26 124.41 1mp1 h ALA 122 Ca 0.00 -0.01 -0.39 0.00 0.00 0.00 0.00 54.91 54.51 1mp1 h ALA 122 Cb 0.09 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 1mp1 h ALA 122 CO 0.00 -0.01 -2.40 1.19 0.00 0.00 0.00 179.25 178.03 1mp1 n PHE 123 N -4.51 0.21 -0.02 0.00 3.72 0.09 -3.90 117.46 113.05 1mp1 n PHE 123 Ca -0.00 0.05 -0.06 0.00 -0.05 0.00 0.00 57.45 57.38 1mp1 n PHE 123 Cb 0.14 -1.03 -0.04 0.00 -0.94 0.00 0.00 39.48 37.61 1mp1 n PHE 123 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1mp1 h LEU 124 N -0.04 -0.67 0.01 4.37 3.38 -1.24 -3.09 115.31 118.02 1mp1 h LEU 124 Ca -0.56 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1mp1 h LEU 124 Cb 1.90 0.26 -0.00 0.00 0.09 0.00 0.00 40.66 42.92 1mp1 h LEU 124 CO -0.08 -0.17 -0.02 -0.08 0.09 0.00 0.00 178.44 178.18 1mp1 h GLU 125 N -0.20 -0.03 0.00 1.13 4.57 -1.61 -3.43 114.58 115.00 1mp1 h GLU 125 Ca 0.02 0.00 -0.13 0.00 -1.18 0.00 0.00 59.36 58.07 1mp1 h GLU 125 Cb 0.25 0.01 0.07 0.00 -0.16 0.00 0.00 28.75 28.92 1mp1 h GLU 125 CO -0.18 -0.02 -0.04 1.28 -1.18 0.00 0.00 179.01 178.87 1mp1 n LEU 126 N -2.50 0.00 -4.62 1.64 4.77 -1.17 -4.99 117.00 110.13 1mp1 n LEU 126 Ca -0.00 -0.33 -0.35 0.00 -0.03 0.00 0.00 56.01 55.30 1mp1 n LEU 126 Cb 0.02 -0.34 -0.10 0.00 -2.33 0.00 0.00 43.42 40.67 1mp1 n LEU 126 CO 0.01 -1.83 -0.24 -0.54 -1.33 0.00 0.00 177.39 173.46 1mp1 s LYS 127 N -3.75 3.96 -0.14 3.23 3.01 -1.26 -4.79 119.74 120.00 1mp1 s LYS 127 Ca 0.23 -0.34 -0.29 0.00 -1.01 0.00 0.00 55.97 54.57 1mp1 s LYS 127 Cb -0.04 -3.31 -0.06 0.00 -1.01 0.00 0.00 37.83 33.42 1mp1 s LYS 127 CO 0.19 0.17 2.13 0.21 0.51 0.00 0.00 175.35 178.56 1mp1 s LYS 128 N 0.68 3.44 0.20 1.68 2.36 -1.26 -4.91 119.74 121.93 1mp1 s LYS 128 Ca 0.05 2.19 -0.30 0.00 -2.55 0.00 0.00 55.97 55.35 1mp1 s LYS 128 Cb -0.13 -4.31 -0.09 0.00 -1.05 0.00 0.00 37.83 32.25 1mp1 s LYS 128 CO 0.02 -1.76 1.38 -2.00 1.55 0.00 0.00 175.35 174.54 1mp1 s GLU 129 N 5.77 4.33 0.56 4.03 -6.30 -1.26 -4.71 118.70 121.12 1mp1 s GLU 129 Ca 0.96 2.15 0.00 0.00 -2.50 0.00 0.00 54.97 55.59 1mp1 s GLU 129 Cb -0.36 -3.17 0.00 0.00 0.00 0.00 0.00 34.13 30.60 1mp1 s GLU 129 CO 0.37 -0.36 0.00 -1.91 0.02 0.00 0.00 175.26 173.38 1mp1 n GLU 130 N 2.84 -3.97 -3.11 4.30 4.07 -1.26 -4.87 120.64 118.63 1mp1 n GLU 130 Ca 0.08 3.07 -0.38 0.00 -0.06 0.00 0.00 57.16 59.87 1mp1 n GLU 130 Cb 0.42 -3.80 -0.06 0.00 -0.06 0.00 0.00 31.44 27.94 1mp1 n GLU 130 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 1mp1 s ILE 131 N -5.17 4.55 0.10 6.31 1.09 -1.26 -4.98 121.20 121.85 1mp1 s ILE 131 Ca 0.00 1.38 -0.36 0.00 -1.10 0.00 0.00 60.65 60.57 1mp1 s ILE 131 Cb 0.00 -3.95 -0.17 0.00 -1.06 0.00 0.00 42.46 37.28 1mp1 s ILE 131 CO 0.00 0.39 1.26 2.29 -0.10 0.00 0.00 174.94 178.78 1mp1 n LYS 132 N 1.22 1.03 -4.24 2.79 -0.00 -1.26 -4.96 118.16 112.75 1mp1 n LYS 132 Ca -0.05 0.37 -0.13 0.00 -0.00 0.00 0.00 58.31 58.50 1mp1 n LYS 132 Cb 0.50 -1.96 -0.10 0.00 -0.00 0.00 0.00 35.03 33.47 1mp1 n LYS 132 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 1mp1 s GLN 133 N 0.22 1.16 0.00 -1.58 -2.07 -1.26 -5.28 119.66 110.84 1mp1 s GLN 133 Ca 0.82 -1.58 0.00 0.00 -1.82 0.00 0.00 55.36 52.78 1mp1 s GLN 133 Cb -0.96 -0.11 0.00 0.00 -1.09 0.00 0.00 33.01 30.85 1mp1 s GLN 133 CO 0.49 -0.22 0.00 -2.13 -1.32 0.00 0.00 175.29 172.11