#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 -3.54 1.43 -0.00 -1.26 -4.61 115.22 107.24 1mp1 n HIS 25 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.64 1mp1 n HIS 25 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 29.96 1mp1 n HIS 25 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1mp1 s MET 26 N 0.00 0.65 -0.07 -0.41 0.00 -1.26 -5.06 119.30 113.15 1mp1 s MET 26 Ca 0.00 -0.11 -0.08 0.00 0.00 0.00 0.00 55.69 55.50 1mp1 s MET 26 Cb 0.00 0.30 0.02 0.00 0.00 0.00 0.00 34.83 35.15 1mp1 s MET 26 CO 0.00 -0.26 0.22 1.14 0.00 0.00 0.00 175.02 176.12 1mp1 s GLN 27 N -2.27 0.31 0.02 3.16 0.00 -1.26 -4.77 119.66 114.85 1mp1 s GLN 27 Ca 0.03 0.21 -0.01 0.00 -0.00 0.00 0.00 55.36 55.59 1mp1 s GLN 27 Cb -0.01 0.15 0.00 0.00 0.00 0.00 0.00 33.01 33.15 1mp1 s GLN 27 CO -0.05 -0.05 0.06 1.47 0.00 0.00 0.00 175.29 176.73 1mp1 n LEU 28 N 2.70 0.00 -4.91 2.60 -0.00 -1.26 -5.12 117.00 111.01 1mp1 n LEU 28 Ca -0.14 -0.12 -0.28 0.00 -0.00 0.00 0.00 56.01 55.47 1mp1 n LEU 28 Cb 0.58 0.20 -0.03 0.00 -0.00 0.00 0.00 43.42 44.17 1mp1 n LEU 28 CO 0.19 -0.04 0.17 -0.75 -0.00 0.00 0.00 177.39 176.96 1mp1 s LYS 29 N -2.00 3.61 0.41 1.47 2.20 -1.26 -4.92 119.74 119.24 1mp1 s LYS 29 Ca 0.01 -0.07 0.05 0.00 -0.36 0.00 0.00 55.97 55.60 1mp1 s LYS 29 Cb -0.00 -2.69 -0.06 0.00 -1.51 0.00 0.00 37.83 33.58 1mp1 s LYS 29 CO 0.00 0.25 0.03 -0.59 -0.36 0.00 0.00 175.35 174.69 1mp1 s PHE 30 N -2.04 2.18 0.00 4.03 -0.71 -1.26 -4.90 117.98 115.28 1mp1 s PHE 30 Ca 0.43 -0.86 0.00 0.00 -1.04 0.00 0.00 56.93 55.46 1mp1 s PHE 30 Cb -0.11 -1.56 0.00 0.00 -1.21 0.00 0.00 43.02 40.14 1mp1 s PHE 30 CO 0.30 0.23 0.00 0.00 -1.34 0.00 0.00 175.22 174.40 1mp1 n ALA 31 N -0.95 0.00 -0.07 1.99 0.00 -1.26 -5.02 120.51 115.20 1mp1 n ALA 31 Ca -0.07 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.28 1mp1 n ALA 31 Cb 0.67 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.05 1mp1 n ALA 31 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1mp1 n GLU 32 N -1.33 0.72 0.26 0.00 0.28 -1.26 -4.39 120.64 114.92 1mp1 n GLU 32 Ca 0.00 0.07 0.16 0.00 -0.16 0.00 0.00 57.16 57.23 1mp1 n GLU 32 Cb 0.00 -1.29 0.86 0.00 1.43 0.00 0.00 31.44 32.44 1mp1 n GLU 32 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1mp1 n LEU 34 N -2.68 0.20 -1.62 0.00 4.77 -1.26 -1.63 117.00 114.78 1mp1 n LEU 34 Ca -0.02 0.56 -0.06 0.00 -0.03 0.00 0.00 56.01 56.46 1mp1 n LEU 34 Cb 0.14 -0.54 0.19 0.00 -2.33 0.00 0.00 43.42 40.88 1mp1 n LEU 34 CO 0.14 -0.42 0.85 -0.62 -1.33 0.00 0.00 177.39 176.01 1mp1 n GLU 35 N -1.73 2.68 0.00 3.23 1.02 0.22 -3.82 120.64 122.24 1mp1 n GLU 35 Ca 0.02 -2.04 0.12 0.00 -0.02 0.00 0.00 57.16 55.24 1mp1 n GLU 35 Cb 0.14 -1.89 0.13 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 -0.10 0.84 -1.04 3.49 4.76 -0.64 -5.06 118.16 120.40 1mp1 n LYS 36 Ca 0.29 -0.63 0.13 0.00 -2.87 0.00 0.00 58.31 55.24 1mp1 n LYS 36 Cb 1.09 -1.49 -0.04 0.00 -1.84 0.00 0.00 35.03 32.75 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 -0.53 -2.02 -0.49 1.97 4.01 -1.25 -5.03 118.16 114.81 1mp1 n LYS 37 Ca 0.09 1.41 0.00 0.00 -0.51 0.00 0.00 58.31 59.30 1mp1 n LYS 37 Cb 0.40 -2.51 0.00 0.00 -0.51 0.00 0.00 35.03 32.41 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 -3.23 0.00 -2.99 -0.18 0.24 -1.26 -4.85 118.33 106.05 1mp1 n VAL 38 Ca -0.01 0.00 0.03 0.00 -2.04 0.00 0.00 64.34 62.32 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 0.68 -0.69 0.57 -1.34 -1.08 -1.26 -4.87 116.67 108.68 1mp1 s ASP 39 Ca 0.00 -0.18 0.30 0.00 -0.52 0.00 0.00 52.55 52.15 1mp1 s ASP 39 Cb 0.00 1.09 1.74 0.00 -1.46 0.00 0.00 42.92 44.29 1mp1 s ASP 39 CO 0.00 -0.10 2.20 0.24 0.52 0.00 0.00 175.17 178.04 1mp1 h MET 40 N 6.48 0.00 0.00 4.34 2.86 -1.65 0.27 114.93 127.24 1mp1 h MET 40 Ca -0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1mp1 h MET 40 Cb 1.20 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.86 1mp1 h MET 40 CO -0.03 0.04 0.00 0.45 1.06 0.00 0.00 176.91 178.43 1mp1 n SER 41 N -3.74 0.00 -0.02 1.22 2.88 -1.26 -3.11 113.62 109.60 1mp1 n SER 41 Ca -0.03 0.20 -0.02 0.00 -1.33 0.00 0.00 58.87 57.69 1mp1 n SER 41 Cb 0.13 -0.36 -0.02 0.00 -0.75 0.00 0.00 64.21 63.21 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 -1.36 0.66 -4.14 -1.46 4.76 0.48 -5.04 118.16 112.06 1mp1 n LYS 42 Ca 0.07 0.02 -0.29 0.00 -2.87 0.00 0.00 58.31 55.23 1mp1 n LYS 42 Cb 0.17 -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 -2.07 3.99 -0.13 -0.18 0.11 0.65 -3.99 120.40 118.78 1mp1 s VAL 43 Ca -0.04 -1.07 -0.21 0.00 -2.93 0.00 0.00 61.98 57.73 1mp1 s VAL 43 Cb 0.01 -2.93 -0.03 0.00 -1.53 0.00 0.00 36.38 31.90 1mp1 s VAL 43 CO 0.08 0.07 0.63 0.20 -3.33 0.00 0.00 175.10 172.75 1mp1 s ASN 44 N -2.46 6.82 0.02 3.54 -0.87 0.12 -4.30 114.94 117.81 1mp1 s ASN 44 Ca 0.26 0.99 0.16 0.00 -1.57 0.00 0.00 52.86 52.70 1mp1 s ASN 44 Cb -0.11 -2.37 -0.17 0.00 -0.02 0.00 0.00 41.25 38.59 1mp1 s ASN 44 CO 0.19 -0.16 0.74 0.00 -2.57 0.00 0.00 177.10 175.30 1mp1 n LEU 45 N 4.25 0.78 -0.28 0.60 -0.00 -1.26 -3.99 117.00 117.10 1mp1 n LEU 45 Ca -0.02 0.35 0.04 0.00 -0.00 0.00 0.00 56.01 56.37 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 0.45 0.20 1.25 -0.33 -0.00 0.00 0.00 177.39 178.96 1mp1 h GLU 46 N 0.00 0.98 0.00 1.47 5.08 -1.94 0.54 114.58 120.71 1mp1 h GLU 46 Ca -0.20 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1mp1 h GLU 46 Cb 1.68 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.71 1mp1 h GLU 46 CO 0.05 0.65 0.00 1.33 -1.00 0.00 0.00 179.01 180.04 1mp1 n VAL 47 N -4.47 0.83 0.42 3.13 0.24 -1.26 -0.84 118.33 116.37 1mp1 n VAL 47 Ca 0.13 0.21 0.04 0.00 -2.04 0.00 0.00 64.34 62.68 1mp1 n VAL 47 Cb 0.17 -0.99 -0.02 0.00 -1.47 0.00 0.00 33.84 31.53 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 -1.36 0.00 -0.08 1.34 2.08 0.17 -4.41 119.36 117.10 1mp1 n ILE 48 Ca 0.05 -0.36 -0.08 0.00 0.56 0.00 0.00 62.75 62.92 1mp1 n ILE 48 Cb 0.12 1.07 -0.00 0.00 -0.75 0.00 0.00 39.64 40.07 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 0.66 0.28 0.00 0.38 1.63 0.99 1.67 116.57 122.18 1mp1 h LYS 49 Ca 0.00 -0.02 -0.12 0.00 -0.85 0.00 0.00 60.65 59.66 1mp1 h LYS 49 Cb 0.28 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.83 1mp1 h LYS 49 CO 0.00 0.18 -0.59 -1.00 -3.45 0.00 0.00 179.45 174.60 1mp1 h PRO 50 N 0.29 0.00 -0.07 1.90 0.13 -1.80 0.32 132.00 132.77 1mp1 h PRO 50 Ca 0.13 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.12 1mp1 h PRO 50 Cb 0.06 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.20 1mp1 h PRO 50 CO -0.10 0.59 -0.47 2.35 -0.23 0.00 0.00 178.00 180.13 1mp1 h TRP 51 N 0.00 0.61 0.11 1.56 7.01 -1.58 0.87 115.95 124.53 1mp1 h TRP 51 Ca -0.01 -0.28 -0.01 0.00 2.11 0.00 0.00 58.89 60.71 1mp1 h TRP 51 Cb 1.20 -0.09 0.00 0.00 -2.10 0.00 0.00 29.16 28.17 1mp1 h TRP 51 CO 0.00 1.06 -0.05 0.82 -2.79 0.00 0.00 178.44 177.48 1mp1 h ILE 52 N -0.01 1.11 -0.95 2.65 2.04 0.25 0.37 117.51 122.96 1mp1 h ILE 52 Ca -0.04 -1.07 0.07 0.00 1.00 0.00 0.00 64.86 64.82 1mp1 h ILE 52 Cb 1.14 1.76 -0.06 0.00 -0.74 0.00 0.00 36.82 38.91 1mp1 h ILE 52 CO 0.10 0.25 0.62 0.74 0.00 0.00 0.00 178.15 179.85 1mp1 h THR 53 N -0.66 1.07 -0.12 -0.27 2.02 -0.44 0.99 112.91 115.50 1mp1 h THR 53 Ca -0.01 -0.38 -0.19 0.00 0.77 0.00 0.00 66.41 66.60 1mp1 h THR 53 Cb 0.52 -0.12 -0.00 0.00 -1.74 0.00 0.00 68.15 66.81 1mp1 h THR 53 CO 0.02 0.20 -0.71 0.50 0.37 0.00 0.00 175.52 175.90 1mp1 h LYS 54 N 1.09 0.56 0.06 6.66 3.64 -0.79 0.40 116.57 128.20 1mp1 h LYS 54 Ca 0.41 -0.44 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1mp1 h LYS 54 Cb 0.20 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1mp1 h LYS 54 CO -0.16 1.06 -0.03 0.00 -2.27 0.00 0.00 179.45 178.05 1mp1 h ARG 55 N 0.39 -0.08 -0.71 1.90 2.47 0.12 0.29 114.38 118.76 1mp1 h ARG 55 Ca -0.03 0.01 -0.03 0.00 -1.26 0.00 0.00 59.98 58.66 1mp1 h ARG 55 Cb 1.30 0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 29.61 1mp1 h ARG 55 CO 0.13 0.32 0.33 -0.39 0.56 0.00 0.00 179.97 180.92 1mp1 h VAL 56 N -0.49 1.24 -0.49 2.04 -1.51 0.91 0.69 116.25 118.64 1mp1 h VAL 56 Ca -0.01 -0.69 -0.04 0.00 -1.23 0.00 0.00 66.70 64.73 1mp1 h VAL 56 Cb 0.43 0.38 -0.02 0.00 -2.13 0.00 0.00 31.29 29.95 1mp1 h VAL 56 CO 0.01 0.28 0.13 0.74 -1.23 0.00 0.00 177.57 177.51 1mp1 h THR 57 N 1.00 1.23 0.00 7.19 2.02 -0.87 -2.49 112.91 120.99 1mp1 h THR 57 Ca 0.24 -0.81 -0.11 0.00 0.77 0.00 0.00 66.41 66.50 1mp1 h THR 57 Cb 0.14 0.84 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 1mp1 h THR 57 CO -0.03 0.29 -0.52 -0.33 0.37 0.00 0.00 175.52 175.30 1mp1 h GLU 58 N 0.66 0.00 -0.39 6.66 5.08 -0.02 2.89 114.58 129.46 1mp1 h GLU 58 Ca 0.15 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.56 1mp1 h GLU 58 Cb 0.31 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 1mp1 h GLU 58 CO -0.00 0.52 0.13 0.82 -1.00 0.00 0.00 179.01 179.48 1mp1 h ILE 59 N 0.00 0.87 0.01 3.13 2.04 0.82 -3.28 117.51 121.11 1mp1 h ILE 59 Ca -0.01 -0.10 -0.42 0.00 1.00 0.00 0.00 64.86 65.34 1mp1 h ILE 59 Cb 1.00 0.56 -0.06 0.00 -0.74 0.00 0.00 36.82 37.58 1mp1 h ILE 59 CO 0.07 0.05 -2.41 0.00 0.00 0.00 0.00 178.15 175.86 1mp1 n LEU 60 N -5.02 2.36 0.00 1.44 -0.00 -1.08 -5.02 117.00 109.68 1mp1 n LEU 60 Ca 0.02 0.16 0.00 0.00 -0.00 0.00 0.00 56.01 56.20 1mp1 n LEU 60 Cb 0.15 -0.88 0.00 0.00 -0.00 0.00 0.00 43.42 42.69 1mp1 n LEU 60 CO 0.26 0.70 0.00 0.61 -0.00 0.00 0.00 177.39 178.97 1mp1 n GLY 61 N 1.67 1.06 3.21 1.47 0.00 0.96 -5.10 105.19 108.45 1mp1 n GLY 61 Ca -0.49 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.37 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 -1.37 1.22 -0.38 1.61 -0.12 -0.49 -4.84 117.98 113.61 1mp1 s PHE 62 Ca 0.00 -0.61 -0.28 0.00 -0.05 0.00 0.00 56.93 55.99 1mp1 s PHE 62 Cb 0.00 -0.65 -0.02 0.00 -0.63 0.00 0.00 43.02 41.72 1mp1 s PHE 62 CO 0.00 0.07 1.82 -2.00 -0.05 0.00 0.00 175.22 175.06 1mp1 s GLU 63 N -2.73 3.19 0.00 1.99 -6.30 -1.26 -4.15 118.70 109.44 1mp1 s GLU 63 Ca 0.07 1.29 0.00 0.00 -2.50 0.00 0.00 54.97 53.83 1mp1 s GLU 63 Cb -0.04 -4.24 0.00 0.00 0.00 0.00 0.00 34.13 29.86 1mp1 s GLU 63 CO 0.01 -2.03 0.00 -3.47 0.02 0.00 0.00 175.26 169.79 1mp1 n ASP 64 N 10.82 0.00 0.00 -1.70 -0.08 -1.26 -5.04 116.55 119.29 1mp1 n ASP 64 Ca 0.23 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.51 1mp1 n ASP 64 Cb 0.48 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.94 1mp1 n ASP 64 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1mp1 n ASP 65 N 0.00 0.00 -0.11 1.67 9.92 -1.26 -4.86 116.55 121.92 1mp1 n ASP 65 Ca 0.00 0.00 -0.10 0.00 -0.53 0.00 0.00 54.79 54.16 1mp1 n ASP 65 Cb 0.00 0.22 -0.02 0.00 -0.64 0.00 0.00 41.12 40.68 1mp1 n ASP 65 CO 0.00 0.00 0.00 1.62 0.13 0.00 0.00 177.20 178.95 1mp1 h VAL 66 N 0.00 1.20 -0.26 2.53 3.04 -1.98 0.80 116.25 121.58 1mp1 h VAL 66 Ca 0.00 -0.65 -0.17 0.00 -1.01 0.00 0.00 66.70 64.87 1mp1 h VAL 66 Cb 0.00 1.01 0.00 0.00 -2.01 0.00 0.00 31.29 30.29 1mp1 h VAL 66 CO 0.00 0.22 -0.52 -0.37 -1.01 0.00 0.00 177.57 175.89 1mp1 h VAL 67 N 0.38 1.29 -0.00 1.51 -1.51 -1.92 -1.80 116.25 114.19 1mp1 h VAL 67 Ca 0.11 -1.71 -0.00 0.00 -1.23 0.00 0.00 66.70 63.86 1mp1 h VAL 67 Cb 0.24 1.72 -0.00 0.00 -2.13 0.00 0.00 31.29 31.11 1mp1 h VAL 67 CO -0.00 0.55 0.00 0.40 -1.23 0.00 0.00 177.57 177.29 1mp1 h ILE 68 N 0.56 1.07 -0.83 7.19 2.04 -1.84 -1.63 117.51 124.07 1mp1 h ILE 68 Ca 0.01 -0.20 0.07 0.00 1.00 0.00 0.00 64.86 65.73 1mp1 h ILE 68 Cb 1.13 1.20 -0.06 0.00 -0.74 0.00 0.00 36.82 38.35 1mp1 h ILE 68 CO 0.12 0.05 0.50 -0.33 0.00 0.00 0.00 178.15 178.49 1mp1 h GLU 69 N -0.08 0.87 -0.43 2.37 5.08 0.63 0.76 114.58 123.77 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 0.09 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.10 1mp1 h GLU 69 CO -0.00 0.58 0.20 0.74 -1.00 0.00 0.00 179.01 179.53 1mp1 h PHE 70 N 0.90 0.38 -0.17 4.33 0.04 -0.93 2.43 116.94 123.91 1mp1 h PHE 70 Ca 0.37 0.02 -0.12 0.00 2.80 0.00 0.00 57.97 61.04 1mp1 h PHE 70 Cb 0.22 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 38.27 1mp1 h PHE 70 CO -0.04 0.19 -0.37 0.82 -0.60 0.00 0.00 178.31 178.31 1mp1 h ILE 71 N 0.41 1.34 -0.05 -0.55 2.04 -0.46 0.67 117.51 120.92 1mp1 h ILE 71 Ca 0.19 -1.62 -0.00 0.00 1.00 0.00 0.00 64.86 64.43 1mp1 h ILE 71 Cb 0.11 1.94 -0.00 0.00 -0.74 0.00 0.00 36.82 38.13 1mp1 h ILE 71 CO -0.14 0.49 0.01 0.15 0.00 0.00 0.00 178.15 178.66 1mp1 h PHE 72 N 0.20 0.08 -0.79 1.37 3.04 0.93 1.50 116.94 123.27 1mp1 h PHE 72 Ca 0.00 -0.01 -0.04 0.00 3.98 0.00 0.00 57.97 61.90 1mp1 h PHE 72 Cb 0.97 -0.02 -0.04 0.00 2.56 0.00 0.00 35.95 39.42 1mp1 h PHE 72 CO 0.10 0.28 0.33 -0.91 -2.02 0.00 0.00 178.31 176.08 1mp1 h ASN 73 N -0.14 1.09 -0.23 0.41 2.35 0.41 0.57 115.58 120.04 1mp1 h ASN 73 Ca 0.02 -0.17 -0.20 0.00 -0.55 0.00 0.00 56.30 55.40 1mp1 h ASN 73 Cb 0.24 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.33 1mp1 h ASN 73 CO 0.00 0.96 -0.63 1.56 -1.65 0.00 0.00 177.43 177.67 1mp1 h GLN 74 N 1.15 0.84 0.00 0.81 7.50 -0.68 -2.64 115.11 122.09 1mp1 h GLN 74 Ca 0.27 -0.58 0.00 0.00 0.50 0.00 0.00 58.65 58.83 1mp1 h GLN 74 Cb 0.20 0.09 0.00 0.00 0.05 0.00 0.00 27.48 27.82 1mp1 h GLN 74 CO -0.02 1.21 0.00 1.28 -1.50 0.00 0.00 178.83 179.80 1mp1 n LEU 75 N -3.98 0.00 -0.02 1.46 4.77 0.51 -2.67 117.00 117.07 1mp1 n LEU 75 Ca -0.05 0.24 0.15 0.00 -0.03 0.00 0.00 56.01 56.32 1mp1 n LEU 75 Cb 0.67 -0.24 0.80 0.00 -2.33 0.00 0.00 43.42 42.32 1mp1 n LEU 75 CO 0.51 -0.01 1.03 -0.62 -1.33 0.00 0.00 177.39 176.97 1mp1 n GLU 76 N -1.24 0.66 -1.54 3.23 1.02 0.20 -4.81 120.64 118.15 1mp1 n GLU 76 Ca 0.15 -0.05 -0.03 0.00 -0.02 0.00 0.00 57.16 57.21 1mp1 n GLU 76 Cb 0.21 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.13 1mp1 n GLU 76 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 1mp1 n VAL 77 N -1.13 0.00 0.02 2.62 0.24 -1.09 -5.04 118.33 113.94 1mp1 n VAL 77 Ca 0.17 -0.27 0.10 0.00 -2.04 0.00 0.00 64.34 62.31 1mp1 n VAL 77 Cb 0.21 -0.67 -0.13 0.00 -1.47 0.00 0.00 33.84 31.78 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 -0.90 0.65 -3.46 7.34 4.01 -1.26 -4.46 118.16 120.08 1mp1 n LYS 78 Ca 0.01 -0.10 -0.27 0.00 -0.51 0.00 0.00 58.31 57.43 1mp1 n LYS 78 Cb 0.08 -1.60 -0.12 0.00 -0.51 0.00 0.00 35.03 32.88 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 -4.79 2.80 0.60 4.39 0.01 -1.26 -2.32 114.94 114.37 1mp1 s ASN 79 Ca -0.06 -1.95 -0.15 0.00 -0.71 0.00 0.00 52.86 49.99 1mp1 s ASN 79 Cb 0.12 -0.25 -0.03 0.00 0.41 0.00 0.00 41.25 41.50 1mp1 s ASN 79 CO 0.88 -0.32 1.05 -2.16 -1.51 0.00 0.00 177.10 175.03 1mp1 s PRO 80 N 1.30 3.32 -0.45 -0.60 0.04 -1.26 -5.02 135.00 132.33 1mp1 s PRO 80 Ca 0.16 1.14 -0.15 0.00 0.04 0.00 0.00 61.00 62.19 1mp1 s PRO 80 Cb -0.21 -2.04 0.06 0.00 0.04 0.00 0.00 34.50 32.35 1mp1 s PRO 80 CO -0.06 -0.81 0.36 0.34 0.04 0.00 0.00 177.00 176.88 1mp1 s ASP 81 N -2.99 6.13 0.34 6.66 2.15 -1.26 -4.86 116.67 122.83 1mp1 s ASP 81 Ca 0.62 -1.19 0.05 0.00 0.43 0.00 0.00 52.55 52.46 1mp1 s ASP 81 Cb -0.15 -2.17 0.60 0.00 -0.30 0.00 0.00 42.92 40.90 1mp1 s ASP 81 CO 0.39 -0.58 1.86 0.77 -0.17 0.00 0.00 175.17 177.44 1mp1 h SER 82 N 8.71 0.45 -0.61 -0.34 4.64 -1.95 -0.70 113.55 123.75 1mp1 h SER 82 Ca -0.28 -0.09 0.01 0.00 -0.47 0.00 0.00 61.79 60.96 1mp1 h SER 82 Cb 1.11 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 63.05 1mp1 h SER 82 CO 0.83 0.56 0.39 0.11 -0.87 0.00 0.00 176.83 177.85 1mp1 h LYS 83 N 0.45 0.77 -0.18 4.77 6.56 -1.91 0.58 116.57 127.61 1mp1 h LYS 83 Ca 0.09 -0.05 -0.16 0.00 -1.06 0.00 0.00 60.65 59.48 1mp1 h LYS 83 Cb 0.38 -0.17 -0.01 0.00 -0.57 0.00 0.00 32.23 31.86 1mp1 h LYS 83 CO 0.02 0.51 -0.54 0.52 -2.06 0.00 0.00 179.45 177.89 1mp1 h MET 84 N 0.79 0.54 0.28 3.15 2.86 -1.85 -0.51 114.93 120.19 1mp1 h MET 84 Ca 0.23 -0.33 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 1mp1 h MET 84 Cb -0.05 0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.65 1mp1 h MET 84 CO -0.07 0.94 -0.14 1.98 1.06 0.00 0.00 176.91 180.68 1mp1 h MET 85 N 0.41 -0.37 -0.19 1.72 4.05 -0.48 0.73 114.93 120.81 1mp1 h MET 85 Ca 0.01 0.03 -0.10 0.00 -0.28 0.00 0.00 59.70 59.36 1mp1 h MET 85 Cb 1.08 0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.95 1mp1 h MET 85 CO 0.10 -0.18 -0.30 0.37 0.23 0.00 0.00 176.91 177.13 1mp1 h GLN 86 N -0.47 0.37 -0.39 0.39 4.15 -0.94 0.62 115.11 118.85 1mp1 h GLN 86 Ca -0.04 -0.15 -0.13 0.00 0.77 0.00 0.00 58.65 59.10 1mp1 h GLN 86 Cb 0.35 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.02 1mp1 h GLN 86 CO 0.06 0.64 -0.28 0.82 -1.93 0.00 0.00 178.83 178.14 1mp1 h ILE 87 N 0.32 1.28 -0.09 2.39 2.04 -0.85 0.75 117.51 123.35 1mp1 h ILE 87 Ca 0.04 -1.44 -0.14 0.00 1.00 0.00 0.00 64.86 64.32 1mp1 h ILE 87 Cb 0.70 1.35 0.01 0.00 -0.74 0.00 0.00 36.82 38.14 1mp1 h ILE 87 CO 0.05 0.48 -0.49 0.78 0.00 0.00 0.00 178.15 178.98 1mp1 h ASN 88 N 0.68 0.58 -0.46 1.72 2.35 0.77 -3.00 115.58 118.22 1mp1 h ASN 88 Ca 0.07 -0.66 0.04 0.00 -0.55 0.00 0.00 56.30 55.20 1mp1 h ASN 88 Cb 0.86 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 39.02 1mp1 h ASN 88 CO 0.08 1.14 0.24 -0.07 -1.65 0.00 0.00 177.43 177.17 1mp1 h LEU 89 N 0.06 0.35 -2.59 1.61 3.38 0.29 0.12 115.31 118.53 1mp1 h LEU 89 Ca -0.04 0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1mp1 h LEU 89 Cb 1.14 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.84 1mp1 h LEU 89 CO 0.10 0.25 0.09 0.74 0.09 0.00 0.00 178.44 179.70 1mp1 h THR 90 N 0.47 0.21 0.00 0.22 2.02 -0.85 1.63 112.91 116.61 1mp1 h THR 90 Ca 0.20 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.33 1mp1 h THR 90 Cb 0.10 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 1mp1 h THR 90 CO -0.13 0.00 -0.25 1.23 0.37 0.00 0.00 175.52 176.73 1mp1 h GLY 91 N 0.00 0.00 0.00 2.16 0.00 -0.61 -3.34 103.07 101.28 1mp1 h GLY 91 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.22 1mp1 h GLY 91 CO -0.00 0.00 -1.44 0.69 0.00 0.00 0.00 176.54 175.79 1mp1 n PHE 92 N -3.55 0.00 -0.24 5.60 3.01 0.63 -5.05 117.46 117.87 1mp1 n PHE 92 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 1mp1 n PHE 92 Cb 0.40 -0.29 0.00 0.00 -0.01 0.00 0.00 39.48 39.57 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 -2.95 0.00 0.00 4.37 4.77 0.52 -4.93 117.00 118.79 1mp1 n LEU 93 Ca -0.14 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 55.95 1mp1 n LEU 93 Cb 0.63 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.83 1mp1 n LEU 93 CO 0.05 -0.96 0.25 0.59 -1.33 0.00 0.00 177.39 175.99 1mp1 n ASN 94 N -2.22 0.67 0.00 -1.43 3.02 -1.26 -4.81 115.26 109.22 1mp1 n ASN 94 Ca 0.00 -0.49 0.00 0.00 -0.03 0.00 0.00 54.58 54.06 1mp1 n ASN 94 Cb 0.00 0.54 0.00 0.00 -0.61 0.00 0.00 39.78 39.71 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 1.49 3.18 0.13 7.41 0.00 -1.26 -4.79 105.19 111.34 1mp1 n GLY 95 Ca 0.05 -0.91 -0.09 0.00 0.00 0.00 0.00 46.02 45.07 1mp1 n GLY 95 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1mp1 h LYS 96 N 0.00 0.21 -0.22 1.61 3.64 -1.97 -3.07 116.57 116.77 1mp1 h LYS 96 Ca 0.00 -0.23 -0.09 0.00 -1.27 0.00 0.00 60.65 59.06 1mp1 h LYS 96 Cb 0.00 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1mp1 h LYS 96 CO 0.00 0.97 -0.24 -0.91 -2.27 0.00 0.00 179.45 176.99 1mp1 h ASN 97 N 0.11 0.42 -0.71 4.20 2.35 -1.96 -1.62 115.58 118.37 1mp1 h ASN 97 Ca -0.05 -0.14 -0.02 0.00 -0.55 0.00 0.00 56.30 55.54 1mp1 h ASN 97 Cb 1.52 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 39.75 1mp1 h ASN 97 CO 0.14 0.67 0.35 0.00 -1.65 0.00 0.00 177.43 176.94 1mp1 h ALA 98 N 1.37 0.92 -0.55 -0.83 0.00 -1.88 1.20 119.26 119.49 1mp1 h ALA 98 Ca 0.06 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1mp1 h ALA 98 Cb 0.63 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1mp1 h ALA 98 CO 0.05 0.48 -0.09 0.00 0.00 0.00 0.00 179.25 179.69 1mp1 h ARG 99 N 1.00 1.03 -0.18 0.00 3.08 -1.39 0.46 114.38 118.39 1mp1 h ARG 99 Ca 0.25 -0.37 -0.22 0.00 0.07 0.00 0.00 59.98 59.71 1mp1 h ARG 99 Cb 0.10 -0.07 0.01 0.00 0.08 0.00 0.00 29.97 30.09 1mp1 h ARG 99 CO -0.03 1.06 -0.74 0.93 -1.07 0.00 0.00 179.97 180.12 1mp1 h GLU 100 N 0.92 0.80 -0.00 0.04 5.08 -0.79 -1.73 114.58 118.90 1mp1 h GLU 100 Ca 0.15 -0.62 -0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1mp1 h GLU 100 Cb 0.65 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.02 1mp1 h GLU 100 CO 0.04 1.23 0.00 0.35 -1.00 0.00 0.00 179.01 179.64 1mp1 h PHE 101 N 0.56 0.00 -0.12 4.33 3.04 0.16 -2.75 116.94 122.16 1mp1 h PHE 101 Ca -0.04 -0.00 -0.05 0.00 3.98 0.00 0.00 57.97 61.86 1mp1 h PHE 101 Cb 1.36 -0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.86 1mp1 h PHE 101 CO 0.08 0.19 -0.15 0.52 -2.02 0.00 0.00 178.31 176.94 1mp1 h MET 102 N -0.18 0.19 -0.45 1.11 2.86 -0.96 -0.20 114.93 117.29 1mp1 h MET 102 Ca 0.00 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1mp1 h MET 102 Cb 0.19 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.82 1mp1 h MET 102 CO -0.00 0.34 0.00 0.41 1.06 0.00 0.00 176.91 178.72 1mp1 n GLY 103 N -0.89 0.34 0.00 8.32 0.00 -0.65 -0.60 105.19 111.71 1mp1 n GLY 103 Ca -0.01 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.13 1.81 -0.07 1.61 1.02 -0.43 -4.63 120.64 119.82 1mp1 n GLU 104 Ca 0.03 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 56.99 1mp1 n GLU 104 Cb 0.19 -0.76 -0.13 0.00 -0.02 0.00 0.00 31.44 30.72 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 -1.35 2.41 -0.23 -4.62 -0.00 -0.22 -2.84 117.00 110.15 1mp1 n LEU 105 Ca 0.00 0.04 -0.06 0.00 -0.00 0.00 0.00 56.01 55.99 1mp1 n LEU 105 Cb 0.26 -0.76 0.04 0.00 -0.00 0.00 0.00 43.42 42.96 1mp1 n LEU 105 CO 0.00 0.83 1.13 -0.25 -0.00 0.00 0.00 177.39 179.10 1mp1 h TRP 106 N 0.03 0.83 0.00 1.96 2.91 -1.06 -1.72 115.95 118.89 1mp1 h TRP 106 Ca -0.50 0.01 -0.13 0.00 1.13 0.00 0.00 58.89 59.40 1mp1 h TRP 106 Cb 1.99 -0.28 -0.02 0.00 -0.51 0.00 0.00 29.16 30.34 1mp1 h TRP 106 CO 0.04 0.54 -0.62 -1.00 -1.03 0.00 0.00 178.44 176.37 1mp1 h PRO 107 N 0.88 0.00 -0.75 2.65 0.13 -1.74 -2.86 132.00 130.31 1mp1 h PRO 107 Ca 0.24 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.40 1mp1 h PRO 107 Cb -0.07 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.01 1mp1 h PRO 107 CO -0.05 0.62 0.47 1.25 -0.23 0.00 0.00 178.00 180.06 1mp1 h LEU 108 N 0.00 0.77 -0.63 1.56 5.85 -1.18 -0.81 115.31 120.86 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 1.23 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 1mp1 h LEU 108 CO 0.08 0.52 -0.62 -0.07 -0.34 0.00 0.00 178.44 178.02 1mp1 h LEU 109 N 0.91 0.28 -0.89 2.25 3.38 -1.34 -1.47 115.31 118.42 1mp1 h LEU 109 Ca 0.31 -0.16 0.11 0.00 0.09 0.00 0.00 57.88 58.23 1mp1 h LEU 109 Cb 0.04 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 40.63 1mp1 h LEU 109 CO -0.12 0.82 0.52 -0.07 0.09 0.00 0.00 178.44 179.68 1mp1 h LEU 110 N 0.18 0.74 0.11 1.67 4.07 -0.94 1.27 115.31 122.40 1mp1 h LEU 110 Ca -0.01 0.05 -0.23 0.00 0.08 0.00 0.00 57.88 57.77 1mp1 h LEU 110 Cb 1.13 -0.09 0.02 0.00 1.08 0.00 0.00 40.66 42.80 1mp1 h LEU 110 CO 0.10 0.40 -0.97 -1.28 -1.08 0.00 0.00 178.44 175.60 1mp1 h SER 111 N 0.84 0.66 -0.36 -0.43 0.87 -1.20 -3.12 113.55 110.82 1mp1 h SER 111 Ca 0.44 -0.86 0.02 0.00 -1.23 0.00 0.00 61.79 60.16 1mp1 h SER 111 Cb 0.45 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 62.17 1mp1 h SER 111 CO -0.27 1.46 0.19 0.00 -0.53 0.00 0.00 176.83 177.68 1mp1 h ALA 112 N 0.22 0.44 0.00 6.23 0.00 -0.37 0.10 119.26 125.88 1mp1 h ALA 112 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1mp1 h ALA 112 Cb 1.71 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.42 1mp1 h ALA 112 CO 0.19 -0.17 0.00 -0.56 0.00 0.00 0.00 179.25 178.70 1mp1 h GLN 113 N 0.39 0.00 0.00 0.00 3.07 0.15 0.45 115.11 119.17 1mp1 h GLN 113 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.89 1mp1 h GLN 113 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.60 1mp1 h GLN 113 CO -0.09 0.00 -0.52 0.39 0.09 0.00 0.00 178.83 178.70 1mp1 n GLU 114 N -3.03 0.14 -0.06 0.06 -0.58 0.29 -4.81 120.64 112.65 1mp1 n GLU 114 Ca -0.03 0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 1mp1 n GLU 114 Cb 0.07 -1.59 0.00 0.00 -0.57 0.00 0.00 31.44 29.35 1mp1 n GLU 114 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1mp1 n ASN 115 N -1.80 0.00 -0.04 1.62 2.85 0.16 -5.06 115.26 112.99 1mp1 n ASN 115 Ca 0.05 -0.22 -0.06 0.00 -0.11 0.00 0.00 54.58 54.23 1mp1 n ASN 115 Cb 0.39 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.37 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 -0.38 0.48 0.70 -1.44 0.00 -1.26 -4.52 119.36 112.93 1mp1 n ILE 116 Ca 0.00 -0.18 0.05 0.00 0.00 0.00 0.00 62.75 62.62 1mp1 n ILE 116 Cb 0.00 -0.85 0.17 0.00 0.00 0.00 0.00 39.64 38.96 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 -2.79 2.57 -3.72 1.51 0.00 -1.26 -4.89 120.51 111.93 1mp1 n ALA 117 Ca -0.15 -0.70 -0.26 0.00 0.00 0.00 0.00 53.44 52.34 1mp1 n ALA 117 Cb 0.66 -0.99 0.06 0.00 0.00 0.00 0.00 19.45 19.18 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 -0.50 3.25 0.00 0.00 -1.25 -4.45 105.19 103.19 1mp1 n GLY 118 Ca 0.13 0.22 -0.30 0.00 0.00 0.00 0.00 46.02 46.07 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 -3.34 1.87 0.44 -0.61 1.09 -1.24 0.16 121.20 119.58 1mp1 s ILE 119 Ca 0.54 -0.99 -0.22 0.00 -1.10 0.00 0.00 60.65 58.88 1mp1 s ILE 119 Cb -0.25 -1.57 -0.09 0.00 -1.06 0.00 0.00 42.46 39.49 1mp1 s ILE 119 CO 0.77 0.53 1.05 -2.16 -0.10 0.00 0.00 174.94 175.03 1mp1 s PRO 120 N -0.35 3.98 0.44 2.79 0.04 -1.26 -4.11 135.00 136.52 1mp1 s PRO 120 Ca 0.03 1.44 0.29 0.00 0.04 0.00 0.00 61.00 62.81 1mp1 s PRO 120 Cb -0.11 -2.32 1.59 0.00 0.04 0.00 0.00 34.50 33.70 1mp1 s PRO 120 CO 0.01 -0.29 1.90 0.66 0.04 0.00 0.00 177.00 179.32 1mp1 h SER 121 N 2.03 0.00 -0.12 6.66 4.64 -1.88 -0.15 113.55 124.74 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 0.08 0.00 -0.87 0.00 0.00 176.83 176.65 1mp1 h ALA 122 N 2.00 2.03 0.02 5.18 0.00 -1.95 -1.84 119.26 124.71 1mp1 h ALA 122 Ca 0.00 -0.01 -0.39 0.00 0.00 0.00 0.00 54.91 54.52 1mp1 h ALA 122 Cb 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 1mp1 h ALA 122 CO 0.00 -0.05 -2.38 1.19 0.00 0.00 0.00 179.25 178.01 1mp1 n PHE 123 N -4.51 0.24 -0.00 0.00 3.72 -0.10 -3.75 117.46 113.05 1mp1 n PHE 123 Ca -0.01 0.05 -0.04 0.00 -0.05 0.00 0.00 57.45 57.41 1mp1 n PHE 123 Cb 0.15 -1.03 -0.03 0.00 -0.94 0.00 0.00 39.48 37.64 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 -0.09 -0.44 0.23 4.37 3.38 -1.24 -2.85 115.31 118.67 1mp1 h LEU 124 Ca -0.56 0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.47 1mp1 h LEU 124 Cb 1.89 0.17 -0.04 0.00 0.09 0.00 0.00 40.66 42.77 1mp1 h LEU 124 CO -0.09 -0.12 -0.46 -0.08 0.09 0.00 0.00 178.44 177.77 1mp1 h GLU 125 N -0.15 -0.75 0.00 1.13 4.81 -1.59 -3.42 114.58 114.62 1mp1 h GLU 125 Ca 0.01 0.05 -0.20 0.00 -0.13 0.00 0.00 59.36 59.09 1mp1 h GLU 125 Cb 0.17 0.17 0.12 0.00 0.63 0.00 0.00 28.75 29.84 1mp1 h GLU 125 CO -0.11 -0.50 -0.09 1.28 -0.73 0.00 0.00 179.01 178.86 1mp1 n LEU 126 N -5.50 0.00 -4.40 1.64 4.77 -1.07 -5.04 117.00 107.39 1mp1 n LEU 126 Ca -0.09 -0.47 -0.23 0.00 -0.03 0.00 0.00 56.01 55.20 1mp1 n LEU 126 Cb 0.41 -0.75 -0.08 0.00 -2.33 0.00 0.00 43.42 40.67 1mp1 n LEU 126 CO 0.21 -2.44 -0.15 -1.59 -1.33 0.00 0.00 177.39 172.09 1mp1 s LYS 127 N -3.63 1.84 -0.28 3.23 0.00 -1.26 -4.90 119.74 114.74 1mp1 s LYS 127 Ca 0.36 -2.10 -0.22 0.00 0.00 0.00 0.00 55.97 54.01 1mp1 s LYS 127 Cb -0.06 -0.15 0.03 0.00 0.00 0.00 0.00 37.83 37.65 1mp1 s LYS 127 CO 0.30 -0.56 0.39 1.63 0.00 0.00 0.00 175.35 177.11 1mp1 n LYS 128 N -0.77 -1.41 -1.95 1.78 5.02 -1.26 -4.80 118.16 114.78 1mp1 n LYS 128 Ca 0.00 1.28 -0.41 0.00 -2.02 0.00 0.00 58.31 57.16 1mp1 n LYS 128 Cb 0.64 -1.97 -0.01 0.00 -0.02 0.00 0.00 35.03 33.67 1mp1 n LYS 128 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1mp1 s GLU 129 N -1.90 4.23 1.03 1.97 2.12 -1.26 -4.95 118.70 119.94 1mp1 s GLU 129 Ca 0.22 2.39 -0.20 0.00 0.36 0.00 0.00 54.97 57.75 1mp1 s GLU 129 Cb -0.03 -3.04 -0.05 0.00 0.26 0.00 0.00 34.13 31.28 1mp1 s GLU 129 CO 0.55 -0.40 -0.56 -1.91 -0.54 0.00 0.00 175.26 172.40 1mp1 n GLU 130 N 1.18 -0.58 -1.48 4.30 2.13 -1.26 -4.72 120.64 120.20 1mp1 n GLU 130 Ca 0.03 -0.16 -0.49 0.00 0.66 0.00 0.00 57.16 57.20 1mp1 n GLU 130 Cb 0.40 -1.38 -0.03 0.00 0.27 0.00 0.00 31.44 30.69 1mp1 n GLU 130 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 1mp1 n ILE 131 N -3.64 1.59 -3.64 6.31 2.08 -1.26 -4.96 119.36 115.84 1mp1 n ILE 131 Ca 0.00 -0.40 -0.03 0.00 0.56 0.00 0.00 62.75 62.89 1mp1 n ILE 131 Cb 0.64 -0.37 -0.05 0.00 -0.75 0.00 0.00 39.64 39.11 1mp1 n ILE 131 CO 0.00 0.00 0.00 -0.75 0.56 0.00 0.00 176.55 176.36 1mp1 s LYS 132 N -0.91 0.60 -0.17 0.38 2.36 -1.26 -4.85 119.74 115.89 1mp1 s LYS 132 Ca 0.67 1.35 -0.16 0.00 -2.55 0.00 0.00 55.97 55.27 1mp1 s LYS 132 Cb -0.90 0.62 -0.04 0.00 -1.05 0.00 0.00 37.83 36.46 1mp1 s LYS 132 CO 0.56 -0.18 0.42 -0.65 1.55 0.00 0.00 175.35 177.05 1mp1 s GLN 133 N 2.47 4.24 0.00 4.03 -0.21 -1.26 -5.21 119.66 123.72 1mp1 s GLN 133 Ca -0.07 0.28 0.19 0.00 0.02 0.00 0.00 55.36 55.78 1mp1 s GLN 133 Cb -0.09 -3.49 0.15 0.00 1.00 0.00 0.00 33.01 30.58 1mp1 s GLN 133 CO -0.19 0.05 1.11 0.54 -2.12 0.00 0.00 175.29 174.68