#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 0.05 1.43 -0.00 -1.26 -5.02 115.22 110.42 1mp1 n HIS 25 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1mp1 n HIS 25 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 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 0.00 -1.00 1.57 2.00 -1.26 -5.02 117.12 113.41 1mp1 n MET 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 1mp1 n MET 26 Cb 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 33.22 32.97 1mp1 n MET 26 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 1mp1 n GLN 27 N -3.15 -1.51 -2.19 0.03 6.02 -1.26 -5.12 117.38 110.20 1mp1 n GLN 27 Ca 0.00 1.44 -0.01 0.00 -0.01 0.00 0.00 57.00 58.42 1mp1 n GLN 27 Cb 0.00 -1.24 0.01 0.00 1.02 0.00 0.00 30.24 30.03 1mp1 n GLN 27 CO 0.00 0.00 0.00 1.47 -1.01 0.00 0.00 177.06 177.52 1mp1 n LEU 28 N 0.52 0.00 -4.82 1.08 -0.00 -1.26 -5.12 117.00 107.39 1mp1 n LEU 28 Ca 0.00 -0.49 -0.34 0.00 -0.00 0.00 0.00 56.01 55.19 1mp1 n LEU 28 Cb 0.00 0.91 -0.07 0.00 -0.00 0.00 0.00 43.42 44.27 1mp1 n LEU 28 CO 0.00 -0.16 0.57 -0.75 -0.00 0.00 0.00 177.39 177.05 1mp1 s LYS 29 N -2.02 4.22 0.00 1.47 2.20 -1.26 -5.03 119.74 119.33 1mp1 s LYS 29 Ca 0.07 1.01 0.00 0.00 -0.36 0.00 0.00 55.97 56.69 1mp1 s LYS 29 Cb -0.01 -2.39 0.00 0.00 -1.51 0.00 0.00 37.83 33.92 1mp1 s LYS 29 CO 0.02 0.10 0.00 1.19 -0.36 0.00 0.00 175.35 176.30 1mp1 n PHE 30 N -0.28 -0.24 -2.27 4.03 3.72 -1.26 -4.99 117.46 116.17 1mp1 n PHE 30 Ca 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 1mp1 n PHE 30 Cb 0.53 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.07 1mp1 n PHE 30 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1mp1 n ALA 31 N -3.00 0.00 0.07 4.37 0.00 -1.26 -5.06 120.51 115.64 1mp1 n ALA 31 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1mp1 n ALA 31 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 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 0.00 0.93 0.08 0.00 -0.00 -1.26 -4.42 120.64 115.98 1mp1 n GLU 32 Ca 0.00 -0.07 0.11 0.00 -0.00 0.00 0.00 57.16 57.20 1mp1 n GLU 32 Cb 0.00 -1.18 0.01 0.00 -0.00 0.00 0.00 31.44 30.27 1mp1 n GLU 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1mp1 n LEU 34 N -2.52 0.24 0.00 0.00 4.77 -1.26 -0.88 117.00 117.35 1mp1 n LEU 34 Ca 0.00 0.59 0.08 0.00 -0.03 0.00 0.00 56.01 56.65 1mp1 n LEU 34 Cb 0.53 -0.59 0.50 0.00 -2.33 0.00 0.00 43.42 41.54 1mp1 n LEU 34 CO 0.40 -0.54 0.82 -0.62 -1.33 0.00 0.00 177.39 176.11 1mp1 n GLU 35 N -1.80 0.98 -3.35 3.23 1.02 -1.24 -4.46 120.64 115.02 1mp1 n GLU 35 Ca 0.01 0.00 -0.46 0.00 -0.02 0.00 0.00 57.16 56.69 1mp1 n GLU 35 Cb 0.10 -1.27 -0.02 0.00 -0.02 0.00 0.00 31.44 30.22 1mp1 n GLU 35 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1mp1 s LYS 36 N -2.00 3.60 0.97 3.49 1.02 -0.06 -5.05 119.74 121.71 1mp1 s LYS 36 Ca 0.25 -2.55 -0.17 0.00 0.02 0.00 0.00 55.97 53.53 1mp1 s LYS 36 Cb 0.12 -4.40 0.05 0.00 -0.52 0.00 0.00 37.83 33.08 1mp1 s LYS 36 CO 0.20 -1.28 -0.24 1.63 -0.92 0.00 0.00 175.35 174.74 1mp1 n LYS 37 N 3.81 -1.30 0.00 1.68 4.01 -1.26 -4.97 118.16 120.13 1mp1 n LYS 37 Ca 0.15 -0.38 0.00 0.00 -0.51 0.00 0.00 58.31 57.57 1mp1 n LYS 37 Cb 0.46 -1.37 0.00 0.00 -0.51 0.00 0.00 35.03 33.61 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 -4.04 0.00 -3.01 -0.18 0.24 -1.26 -4.88 118.33 105.20 1mp1 n VAL 38 Ca 0.02 0.00 0.04 0.00 -2.04 0.00 0.00 64.34 62.36 1mp1 n VAL 38 Cb 0.48 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.85 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 1.10 -0.35 0.59 -1.34 -1.08 -1.26 -4.90 116.67 109.42 1mp1 s ASP 39 Ca 0.00 -0.04 0.31 0.00 -0.52 0.00 0.00 52.55 52.30 1mp1 s ASP 39 Cb 0.00 0.94 1.82 0.00 -1.46 0.00 0.00 42.92 44.22 1mp1 s ASP 39 CO 0.00 -0.06 2.24 0.24 0.52 0.00 0.00 175.17 178.11 1mp1 h MET 40 N 6.57 0.00 0.00 4.34 2.86 -1.75 0.30 114.93 127.25 1mp1 h MET 40 Ca -0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 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 -0.09 0.02 0.00 0.45 1.06 0.00 0.00 176.91 178.35 1mp1 n SER 41 N -3.73 0.00 -0.02 1.22 2.88 -1.26 -3.15 113.62 109.56 1mp1 n SER 41 Ca -0.03 0.22 -0.02 0.00 -1.33 0.00 0.00 58.87 57.70 1mp1 n SER 41 Cb 0.11 -0.38 -0.02 0.00 -0.75 0.00 0.00 64.21 63.17 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 -1.38 0.89 -4.14 -1.46 4.76 0.63 -5.04 118.16 112.43 1mp1 n LYS 42 Ca 0.07 0.02 -0.29 0.00 -2.87 0.00 0.00 58.31 55.24 1mp1 n LYS 42 Cb 0.18 -1.08 -0.08 0.00 -1.84 0.00 0.00 35.03 32.22 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 -2.08 3.97 -0.20 -0.18 0.11 0.71 -3.91 120.40 118.82 1mp1 s VAL 43 Ca -0.04 -1.10 -0.18 0.00 -2.93 0.00 0.00 61.98 57.72 1mp1 s VAL 43 Cb 0.01 -2.92 -0.03 0.00 -1.53 0.00 0.00 36.38 31.91 1mp1 s VAL 43 CO 0.10 0.05 0.52 0.20 -3.33 0.00 0.00 175.10 172.64 1mp1 s ASN 44 N -2.51 6.56 0.14 3.54 -0.87 0.22 -4.32 114.94 117.69 1mp1 s ASN 44 Ca 0.26 0.68 0.19 0.00 -1.57 0.00 0.00 52.86 52.42 1mp1 s ASN 44 Cb -0.11 -2.29 -0.06 0.00 -0.02 0.00 0.00 41.25 38.76 1mp1 s ASN 44 CO 0.19 -0.18 0.96 0.17 -2.57 0.00 0.00 177.10 175.67 1mp1 h LEU 45 N 7.94 0.00 -1.11 0.60 -0.00 -1.85 -3.34 115.31 117.55 1mp1 h LEU 45 Ca -0.34 0.00 0.02 0.00 -0.00 0.00 0.00 57.88 57.56 1mp1 h LEU 45 Cb 1.15 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 41.77 1mp1 h LEU 45 CO 0.74 0.34 0.60 -0.33 -0.00 0.00 0.00 178.44 179.80 1mp1 h GLU 46 N 0.00 1.17 0.00 0.17 5.08 -1.93 0.31 114.58 119.37 1mp1 h GLU 46 Ca -0.09 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1mp1 h GLU 46 Cb 1.34 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1mp1 h GLU 46 CO 0.03 0.77 0.00 1.33 -1.00 0.00 0.00 179.01 180.14 1mp1 n VAL 47 N -4.41 0.74 0.08 3.13 0.24 -1.25 -0.87 118.33 115.98 1mp1 n VAL 47 Ca 0.11 0.18 0.05 0.00 -2.04 0.00 0.00 64.34 62.65 1mp1 n VAL 47 Cb 0.04 -0.94 0.11 0.00 -1.47 0.00 0.00 33.84 31.58 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 0.60 -0.05 1.34 2.08 0.99 -4.43 119.36 118.53 1mp1 n ILE 48 Ca 0.06 -0.80 -0.13 0.00 0.56 0.00 0.00 62.75 62.43 1mp1 n ILE 48 Cb 0.14 0.79 -0.08 0.00 -0.75 0.00 0.00 39.64 39.74 1mp1 n ILE 48 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 1mp1 h LYS 49 N 1.99 0.34 0.00 0.38 1.79 -0.10 0.88 116.57 121.86 1mp1 h LYS 49 Ca 0.00 -0.20 -0.14 0.00 -2.18 0.00 0.00 60.65 58.13 1mp1 h LYS 49 Cb 0.61 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.25 1mp1 h LYS 49 CO 0.00 0.77 -0.66 -1.00 -1.08 0.00 0.00 179.45 177.47 1mp1 h PRO 50 N -0.05 0.00 -0.08 3.15 0.13 -1.80 -0.32 132.00 133.03 1mp1 h PRO 50 Ca 0.02 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.10 1mp1 h PRO 50 Cb 0.72 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.85 1mp1 h PRO 50 CO 0.04 0.66 -0.13 2.35 -0.23 0.00 0.00 178.00 180.69 1mp1 h TRP 51 N 0.00 0.29 0.12 1.56 7.01 -1.76 0.28 115.95 123.45 1mp1 h TRP 51 Ca -0.01 -0.10 -0.01 0.00 2.11 0.00 0.00 58.89 60.89 1mp1 h TRP 51 Cb 1.26 -0.05 0.00 0.00 -2.10 0.00 0.00 29.16 28.27 1mp1 h TRP 51 CO 0.00 0.72 -0.06 0.82 -2.79 0.00 0.00 178.44 177.14 1mp1 h ILE 52 N -0.23 0.99 -0.93 2.65 5.03 -0.81 0.80 117.51 125.01 1mp1 h ILE 52 Ca 0.01 -0.41 0.03 0.00 -0.12 0.00 0.00 64.86 64.36 1mp1 h ILE 52 Cb 0.70 1.25 -0.05 0.00 -3.03 0.00 0.00 36.82 35.69 1mp1 h ILE 52 CO 0.03 0.10 0.61 0.74 -0.68 0.00 0.00 178.15 178.95 1mp1 h THR 53 N -0.35 1.18 -0.19 -0.27 2.02 -1.09 1.36 112.91 115.57 1mp1 h THR 53 Ca -0.02 -0.41 -0.17 0.00 0.77 0.00 0.00 66.41 66.59 1mp1 h THR 53 Cb 0.29 -0.12 -0.00 0.00 -1.74 0.00 0.00 68.15 66.57 1mp1 h THR 53 CO 0.03 0.22 -0.57 0.50 0.37 0.00 0.00 175.52 176.07 1mp1 h LYS 54 N 1.20 0.59 0.01 6.66 3.64 -0.17 0.26 116.57 128.75 1mp1 h LYS 54 Ca 0.36 -0.38 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1mp1 h LYS 54 Cb -0.04 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1mp1 h LYS 54 CO -0.10 0.99 -0.00 0.00 -2.27 0.00 0.00 179.45 178.07 1mp1 h ARG 55 N 0.45 -0.01 -0.61 1.90 2.47 0.18 0.16 114.38 118.92 1mp1 h ARG 55 Ca 0.00 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.69 1mp1 h ARG 55 Cb 1.12 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 29.42 1mp1 h ARG 55 CO 0.11 0.59 0.25 -0.39 0.56 0.00 0.00 179.97 181.09 1mp1 h VAL 56 N -0.61 1.23 -0.61 2.04 -1.51 0.17 0.78 116.25 117.74 1mp1 h VAL 56 Ca -0.00 -0.69 -0.08 0.00 -1.23 0.00 0.00 66.70 64.69 1mp1 h VAL 56 Cb 0.60 0.55 -0.02 0.00 -2.13 0.00 0.00 31.29 30.29 1mp1 h VAL 56 CO 0.00 0.27 0.06 0.74 -1.23 0.00 0.00 177.57 177.41 1mp1 h THR 57 N 0.84 1.26 0.00 7.19 2.02 -0.51 -2.59 112.91 121.12 1mp1 h THR 57 Ca 0.20 -1.07 -0.13 0.00 0.77 0.00 0.00 66.41 66.18 1mp1 h THR 57 Cb 0.19 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 1mp1 h THR 57 CO -0.02 0.39 -0.64 -0.33 0.37 0.00 0.00 175.52 175.30 1mp1 h GLU 58 N 0.94 0.00 -0.33 6.66 5.08 -0.27 3.67 114.58 130.33 1mp1 h GLU 58 Ca 0.18 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.57 1mp1 h GLU 58 Cb 0.49 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 1mp1 h GLU 58 CO 0.02 0.64 0.13 0.82 -1.00 0.00 0.00 179.01 179.61 1mp1 h ILE 59 N 0.00 0.93 0.00 3.13 2.04 0.97 -3.31 117.51 121.26 1mp1 h ILE 59 Ca -0.01 -0.10 -0.44 0.00 1.00 0.00 0.00 64.86 65.32 1mp1 h ILE 59 Cb 1.16 0.62 -0.07 0.00 -0.74 0.00 0.00 36.82 37.79 1mp1 h ILE 59 CO 0.08 0.05 -2.52 0.00 0.00 0.00 0.00 178.15 175.77 1mp1 n LEU 60 N -5.00 2.23 0.00 1.44 -0.00 -1.07 -5.02 117.00 109.57 1mp1 n LEU 60 Ca 0.00 0.20 0.00 0.00 -0.00 0.00 0.00 56.01 56.22 1mp1 n LEU 60 Cb 0.11 -0.83 0.00 0.00 -0.00 0.00 0.00 43.42 42.70 1mp1 n LEU 60 CO 0.28 0.67 0.00 0.61 -0.00 0.00 0.00 177.39 178.96 1mp1 n GLY 61 N 1.56 1.17 3.27 1.47 0.00 1.21 -5.09 105.19 108.77 1mp1 n GLY 61 Ca -0.52 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.22 1.57 -0.37 1.61 -0.12 -0.67 -4.82 117.98 113.95 1mp1 s PHE 62 Ca 0.00 -0.51 -0.29 0.00 -0.05 0.00 0.00 56.93 56.09 1mp1 s PHE 62 Cb 0.00 -0.81 0.00 0.00 -0.63 0.00 0.00 43.02 41.58 1mp1 s PHE 62 CO 0.00 0.20 1.46 -2.00 -0.05 0.00 0.00 175.22 174.84 1mp1 s GLU 63 N -2.57 3.61 0.00 1.99 2.12 -1.26 -4.09 118.70 118.50 1mp1 s GLU 63 Ca 0.10 1.10 0.00 0.00 0.36 0.00 0.00 54.97 56.53 1mp1 s GLU 63 Cb -0.06 -4.03 0.00 0.00 0.26 0.00 0.00 34.13 30.30 1mp1 s GLU 63 CO 0.04 -1.52 0.00 -0.25 -0.54 0.00 0.00 175.26 172.99 1mp1 n ASP 64 N 8.82 0.00 0.06 -1.70 8.00 -1.26 -5.05 116.55 125.42 1mp1 n ASP 64 Ca 0.17 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.67 1mp1 n ASP 64 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.57 1mp1 n ASP 64 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1mp1 n ASP 65 N 0.00 -1.11 -0.21 -2.24 8.00 -1.26 -4.85 116.55 114.88 1mp1 n ASP 65 Ca 0.00 0.31 -0.08 0.00 0.71 0.00 0.00 54.79 55.74 1mp1 n ASP 65 Cb 0.00 1.28 0.03 0.00 -0.02 0.00 0.00 41.12 42.41 1mp1 n ASP 65 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 1mp1 h VAL 66 N 0.00 1.23 -0.22 2.53 3.04 -1.98 0.79 116.25 121.65 1mp1 h VAL 66 Ca 0.00 -0.75 -0.12 0.00 -1.01 0.00 0.00 66.70 64.82 1mp1 h VAL 66 Cb 0.00 0.60 -0.00 0.00 -2.01 0.00 0.00 31.29 29.87 1mp1 h VAL 66 CO 0.00 0.29 -0.32 -0.37 -1.01 0.00 0.00 177.57 176.16 1mp1 h VAL 67 N 0.84 1.32 -0.32 1.51 -1.51 -1.92 -0.33 116.25 115.85 1mp1 h VAL 67 Ca 0.20 -1.52 -0.01 0.00 -1.23 0.00 0.00 66.70 64.14 1mp1 h VAL 67 Cb 0.23 1.78 -0.01 0.00 -2.13 0.00 0.00 31.29 31.15 1mp1 h VAL 67 CO -0.01 0.47 0.17 0.40 -1.23 0.00 0.00 177.57 177.37 1mp1 h ILE 68 N 0.29 1.14 -0.81 7.19 2.04 -1.82 -1.65 117.51 123.89 1mp1 h ILE 68 Ca 0.02 -0.39 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 1mp1 h ILE 68 Cb 0.90 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 37.76 1mp1 h ILE 68 CO 0.07 0.15 0.44 -0.33 0.00 0.00 0.00 178.15 178.48 1mp1 h GLU 69 N 0.39 1.13 -0.59 2.37 5.08 0.64 0.24 114.58 123.85 1mp1 h GLU 69 Ca 0.11 -0.14 0.05 0.00 -1.00 0.00 0.00 59.36 58.38 1mp1 h GLU 69 Cb 0.08 -0.22 -0.05 0.00 0.50 0.00 0.00 28.75 29.06 1mp1 h GLU 69 CO -0.02 0.84 0.32 0.74 -1.00 0.00 0.00 179.01 179.89 1mp1 h PHE 70 N 1.13 0.58 -0.09 4.33 0.04 -0.61 2.17 116.94 124.49 1mp1 h PHE 70 Ca 0.28 0.02 -0.06 0.00 2.80 0.00 0.00 57.97 61.02 1mp1 h PHE 70 Cb 0.04 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.01 1mp1 h PHE 70 CO 0.00 0.29 -0.17 0.82 -0.60 0.00 0.00 178.31 178.66 1mp1 h ILE 71 N 0.60 1.39 -0.06 -0.55 2.04 -0.89 0.04 117.51 120.09 1mp1 h ILE 71 Ca 0.26 -1.43 -0.00 0.00 1.00 0.00 0.00 64.86 64.68 1mp1 h ILE 71 Cb 0.14 2.10 -0.00 0.00 -0.74 0.00 0.00 36.82 38.32 1mp1 h ILE 71 CO -0.16 0.41 0.03 -0.26 0.00 0.00 0.00 178.15 178.17 1mp1 h PHE 72 N -0.17 0.09 -0.90 1.37 -1.00 -0.12 1.50 116.94 117.71 1mp1 h PHE 72 Ca 0.01 -0.01 -0.01 0.00 2.81 0.00 0.00 57.97 60.77 1mp1 h PHE 72 Cb 0.74 -0.03 -0.04 0.00 3.61 0.00 0.00 35.95 40.23 1mp1 h PHE 72 CO 0.11 0.19 0.54 -0.91 -1.61 0.00 0.00 178.31 176.62 1mp1 h ASN 73 N -0.04 1.09 -0.08 2.17 2.35 0.35 0.52 115.58 121.94 1mp1 h ASN 73 Ca 0.02 -0.07 -0.20 0.00 -0.55 0.00 0.00 56.30 55.50 1mp1 h ASN 73 Cb 0.13 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.23 1mp1 h ASN 73 CO -0.00 0.84 -0.67 1.56 -1.65 0.00 0.00 177.43 177.51 1mp1 h GLN 74 N 1.24 0.70 0.00 0.81 7.50 -0.68 -2.61 115.11 122.08 1mp1 h GLN 74 Ca 0.32 -0.52 0.00 0.00 0.50 0.00 0.00 58.65 58.96 1mp1 h GLN 74 Cb -0.04 0.09 0.00 0.00 0.05 0.00 0.00 27.48 27.58 1mp1 h GLN 74 CO -0.06 1.14 0.00 1.28 -1.50 0.00 0.00 178.83 179.69 1mp1 n LEU 75 N -3.94 0.00 -0.08 1.46 4.77 0.51 -2.63 117.00 117.10 1mp1 n LEU 75 Ca -0.05 0.10 0.13 0.00 -0.03 0.00 0.00 56.01 56.16 1mp1 n LEU 75 Cb 0.69 -0.10 0.50 0.00 -2.33 0.00 0.00 43.42 42.18 1mp1 n LEU 75 CO 0.50 -0.00 0.77 -0.62 -1.33 0.00 0.00 177.39 176.71 1mp1 n GLU 76 N -1.10 0.40 -1.34 3.23 1.02 0.18 -4.82 120.64 118.20 1mp1 n GLU 76 Ca 0.20 -0.16 -0.04 0.00 -0.02 0.00 0.00 57.16 57.14 1mp1 n GLU 76 Cb 0.15 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.09 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 -1.16 0.00 0.03 2.62 0.24 -1.08 -5.03 118.33 113.94 1mp1 n VAL 77 Ca 0.11 -0.40 0.10 0.00 -2.04 0.00 0.00 64.34 62.10 1mp1 n VAL 77 Cb 0.31 -0.98 -0.15 0.00 -1.47 0.00 0.00 33.84 31.55 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 -1.30 0.59 -3.47 7.34 4.01 -1.26 -4.40 118.16 119.67 1mp1 n LYS 78 Ca 0.04 -0.17 -0.28 0.00 -0.51 0.00 0.00 58.31 57.39 1mp1 n LYS 78 Cb 0.13 -1.46 -0.11 0.00 -0.51 0.00 0.00 35.03 33.08 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 -4.16 2.40 0.44 4.39 0.02 -1.26 -3.50 114.94 113.27 1mp1 s ASN 79 Ca -0.06 -2.67 -0.22 0.00 -1.02 0.00 0.00 52.86 48.88 1mp1 s ASN 79 Cb 0.12 -0.51 -0.09 0.00 0.02 0.00 0.00 41.25 40.80 1mp1 s ASN 79 CO 0.80 -0.24 1.05 -2.16 0.02 0.00 0.00 177.10 176.57 1mp1 s PRO 80 N 0.48 4.00 -0.95 -0.60 0.04 -1.26 -4.99 135.00 131.71 1mp1 s PRO 80 Ca 0.25 1.45 -0.12 0.00 0.04 0.00 0.00 61.00 62.62 1mp1 s PRO 80 Cb -0.11 -2.34 0.24 0.00 0.04 0.00 0.00 34.50 32.33 1mp1 s PRO 80 CO -0.09 -0.28 0.92 0.34 0.04 0.00 0.00 177.00 177.93 1mp1 s ASP 81 N -1.74 7.01 0.50 6.66 2.15 -1.26 -4.86 116.67 125.13 1mp1 s ASP 81 Ca 0.62 -3.08 0.42 0.00 0.43 0.00 0.00 52.55 50.94 1mp1 s ASP 81 Cb -0.20 -2.21 1.62 0.00 -0.30 0.00 0.00 42.92 41.83 1mp1 s ASP 81 CO 0.24 -0.45 1.55 -0.24 -0.17 0.00 0.00 175.17 176.10 1mp1 n SER 82 N 3.45 0.10 0.04 -0.34 2.88 -1.26 0.21 113.62 118.70 1mp1 n SER 82 Ca 0.18 1.17 -0.12 0.00 -1.33 0.00 0.00 58.87 58.78 1mp1 n SER 82 Cb 0.44 -0.58 -0.06 0.00 -0.75 0.00 0.00 64.21 63.26 1mp1 n SER 82 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1mp1 h LYS 83 N 0.00 -0.07 -0.05 -1.46 1.57 -1.89 0.04 116.57 114.71 1mp1 h LYS 83 Ca 0.91 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 59.61 1mp1 h LYS 83 Cb 3.33 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 35.65 1mp1 h LYS 83 CO -0.22 -0.04 -0.36 0.52 -0.57 0.00 0.00 179.45 178.78 1mp1 h MET 84 N -0.07 0.10 0.33 3.15 2.86 0.21 0.14 114.93 121.65 1mp1 h MET 84 Ca 0.02 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 1mp1 h MET 84 Cb 0.09 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.75 1mp1 h MET 84 CO -0.04 0.45 -0.16 1.98 1.06 0.00 0.00 176.91 180.19 1mp1 h MET 85 N 0.09 -0.43 -0.09 1.72 -1.53 -0.44 0.11 114.93 114.35 1mp1 h MET 85 Ca 0.01 0.03 -0.15 0.00 -3.44 0.00 0.00 59.70 56.15 1mp1 h MET 85 Cb 0.68 0.10 -0.01 0.00 -0.55 0.00 0.00 31.60 31.81 1mp1 h MET 85 CO 0.05 -0.19 -0.58 0.37 0.14 0.00 0.00 176.91 176.70 1mp1 h GLN 86 N -0.61 0.30 -0.77 0.39 4.15 -0.96 -1.63 115.11 115.99 1mp1 h GLN 86 Ca -0.05 -0.20 -0.04 0.00 0.77 0.00 0.00 58.65 59.14 1mp1 h GLN 86 Cb 0.44 0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.12 1mp1 h GLN 86 CO 0.08 0.80 0.33 0.82 -1.93 0.00 0.00 178.83 178.92 1mp1 h ILE 87 N 0.23 1.25 -0.20 2.39 2.04 -0.62 0.28 117.51 122.87 1mp1 h ILE 87 Ca -0.00 -0.76 -0.19 0.00 1.00 0.00 0.00 64.86 64.91 1mp1 h ILE 87 Cb 1.09 0.31 -0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1mp1 h ILE 87 CO 0.09 0.31 -0.62 0.78 0.00 0.00 0.00 178.15 178.72 1mp1 h ASN 88 N 1.11 0.80 -0.64 1.72 2.35 -0.59 -3.06 115.58 117.26 1mp1 h ASN 88 Ca 0.26 -0.46 -0.05 0.00 -0.55 0.00 0.00 56.30 55.50 1mp1 h ASN 88 Cb 0.18 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.29 1mp1 h ASN 88 CO -0.03 1.23 0.21 -0.07 -1.65 0.00 0.00 177.43 177.12 1mp1 h LEU 89 N 0.52 0.92 -2.59 1.61 3.38 -0.70 -1.36 115.31 117.09 1mp1 h LEU 89 Ca -0.01 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.77 1mp1 h LEU 89 Cb 1.21 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.72 1mp1 h LEU 89 CO 0.13 0.88 0.09 0.74 0.09 0.00 0.00 178.44 180.37 1mp1 h THR 90 N 0.91 0.18 0.00 0.22 2.02 -0.38 1.58 112.91 117.45 1mp1 h THR 90 Ca 0.21 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.39 1mp1 h THR 90 Cb 0.28 0.91 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1mp1 h THR 90 CO -0.01 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.49 1mp1 n GLY 91 N -1.21 -1.39 1.22 2.16 0.00 -0.51 -4.14 105.19 101.32 1mp1 n GLY 91 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1mp1 n GLY 91 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1mp1 n PHE 92 N -1.95 0.00 -0.05 1.61 3.01 0.14 -5.08 117.46 115.13 1mp1 n PHE 92 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.50 1mp1 n PHE 92 Cb 0.30 0.12 0.00 0.00 -0.01 0.00 0.00 39.48 39.88 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 -2.88 0.00 -0.10 4.37 4.77 0.49 -4.91 117.00 118.74 1mp1 n LEU 93 Ca 0.00 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.10 1mp1 n LEU 93 Cb 0.38 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.62 1mp1 n LEU 93 CO 0.00 -0.66 0.34 0.59 -1.33 0.00 0.00 177.39 176.32 1mp1 n ASN 94 N -0.85 0.91 0.00 -1.43 3.02 -1.26 -4.83 115.26 110.82 1mp1 n ASN 94 Ca 0.00 -0.72 0.00 0.00 -0.03 0.00 0.00 54.58 53.83 1mp1 n ASN 94 Cb 0.00 0.46 0.00 0.00 -0.61 0.00 0.00 39.78 39.63 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 1.46 3.00 0.21 7.41 0.00 -1.26 -4.76 105.19 111.25 1mp1 n GLY 95 Ca 0.07 -0.79 -0.04 0.00 0.00 0.00 0.00 46.02 45.25 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 0.37 -0.03 1.61 1.57 -1.97 -2.40 116.57 115.73 1mp1 h LYS 96 Ca 0.00 -0.18 -0.12 0.00 -1.87 0.00 0.00 60.65 58.48 1mp1 h LYS 96 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 1mp1 h LYS 96 CO 0.00 0.72 -0.55 -0.91 -0.57 0.00 0.00 179.45 178.15 1mp1 h ASN 97 N 0.31 0.08 -0.41 0.86 4.21 -1.96 -0.98 115.58 117.68 1mp1 h ASN 97 Ca 0.03 -0.04 -0.06 0.00 1.21 0.00 0.00 56.30 57.43 1mp1 h ASN 97 Cb 0.86 -0.02 -0.02 0.00 -1.12 0.00 0.00 38.32 38.02 1mp1 h ASN 97 CO 0.07 0.61 0.03 0.00 -1.29 0.00 0.00 177.43 176.85 1mp1 h ALA 98 N 1.39 0.55 -0.38 -0.83 0.00 -1.77 1.61 119.26 119.83 1mp1 h ALA 98 Ca -0.00 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.54 1mp1 h ALA 98 Cb 0.98 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1mp1 h ALA 98 CO 0.08 0.31 -0.23 0.00 0.00 0.00 0.00 179.25 179.40 1mp1 h ARG 99 N 0.55 0.82 -0.12 0.00 3.08 -1.26 -2.08 114.38 115.37 1mp1 h ARG 99 Ca 0.12 -0.38 -0.19 0.00 0.07 0.00 0.00 59.98 59.60 1mp1 h ARG 99 Cb 0.44 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 1mp1 h ARG 99 CO 0.02 1.01 -0.72 0.93 -1.07 0.00 0.00 179.97 180.14 1mp1 h GLU 100 N 0.62 0.54 -0.28 0.04 5.08 -1.03 -2.93 114.58 116.63 1mp1 h GLU 100 Ca 0.08 -0.43 0.01 0.00 -1.00 0.00 0.00 59.36 58.02 1mp1 h GLU 100 Cb 0.79 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 1mp1 h GLU 100 CO 0.06 1.05 0.16 0.35 -1.00 0.00 0.00 179.01 179.63 1mp1 h PHE 101 N 0.38 0.29 0.00 4.33 3.04 0.25 -1.65 116.94 123.58 1mp1 h PHE 101 Ca -0.03 0.01 -0.03 0.00 3.98 0.00 0.00 57.97 61.90 1mp1 h PHE 101 Cb 1.30 -0.09 -0.00 0.00 2.56 0.00 0.00 35.95 39.72 1mp1 h PHE 101 CO 0.06 0.17 -0.14 0.52 -2.02 0.00 0.00 178.31 176.90 1mp1 h MET 102 N 0.32 0.00 -0.44 1.11 2.86 -1.39 -0.76 114.93 116.63 1mp1 h MET 102 Ca 0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1mp1 h MET 102 Cb 0.01 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.67 1mp1 h MET 102 CO -0.06 0.14 0.00 0.41 1.06 0.00 0.00 176.91 178.46 1mp1 n GLY 103 N -0.98 0.11 0.00 8.32 0.00 -0.63 -0.04 105.19 111.97 1mp1 n GLY 103 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.28 1.59 -0.08 1.61 1.02 -0.35 -4.64 120.64 119.51 1mp1 n GLU 104 Ca 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 56.99 1mp1 n GLU 104 Cb 0.11 -0.76 -0.14 0.00 -0.02 0.00 0.00 31.44 30.63 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 -1.48 1.66 -0.26 -4.62 -0.00 -0.85 -3.10 117.00 108.35 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 -0.33 0.05 0.00 -0.00 0.00 0.00 43.42 43.41 1mp1 n LEU 105 CO 0.00 0.71 1.11 -0.25 -0.00 0.00 0.00 177.39 178.95 1mp1 h TRP 106 N 0.01 0.96 0.00 1.96 2.91 -0.69 -1.80 115.95 119.30 1mp1 h TRP 106 Ca -0.50 -0.02 -0.12 0.00 1.13 0.00 0.00 58.89 59.38 1mp1 h TRP 106 Cb 2.05 -0.31 -0.02 0.00 -0.51 0.00 0.00 29.16 30.38 1mp1 h TRP 106 CO 0.02 0.67 -0.55 -1.00 -1.03 0.00 0.00 178.44 176.55 1mp1 h PRO 107 N 0.97 0.00 -0.61 2.65 0.13 -1.74 -2.87 132.00 130.53 1mp1 h PRO 107 Ca 0.25 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.41 1mp1 h PRO 107 Cb 0.02 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.11 1mp1 h PRO 107 CO -0.04 0.55 0.37 1.25 -0.23 0.00 0.00 178.00 179.91 1mp1 h LEU 108 N 0.00 0.61 -0.72 1.56 5.85 -1.28 -1.09 115.31 120.24 1mp1 h LEU 108 Ca -0.01 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.58 1mp1 h LEU 108 Cb 1.18 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.07 1mp1 h LEU 108 CO 0.07 0.42 -0.55 -0.07 -0.34 0.00 0.00 178.44 177.97 1mp1 h LEU 109 N 0.73 0.28 -0.57 2.25 3.38 -1.39 -0.52 115.31 119.48 1mp1 h LEU 109 Ca 0.25 -0.15 0.10 0.00 0.09 0.00 0.00 57.88 58.16 1mp1 h LEU 109 Cb 0.02 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 40.62 1mp1 h LEU 109 CO -0.10 0.78 0.15 -0.07 0.09 0.00 0.00 178.44 179.28 1mp1 h LEU 110 N 0.20 0.07 -0.00 1.67 4.07 -0.99 1.51 115.31 121.83 1mp1 h LEU 110 Ca 0.00 0.09 -0.24 0.00 0.08 0.00 0.00 57.88 57.81 1mp1 h LEU 110 Cb 1.03 0.11 -0.01 0.00 1.08 0.00 0.00 40.66 42.88 1mp1 h LEU 110 CO 0.09 0.05 -1.10 -1.28 -1.08 0.00 0.00 178.44 175.12 1mp1 h SER 111 N 0.30 0.30 -0.22 -0.43 0.87 -1.25 -3.21 113.55 109.90 1mp1 h SER 111 Ca 0.29 -0.30 -0.01 0.00 -1.23 0.00 0.00 61.79 60.54 1mp1 h SER 111 Cb 0.40 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 1mp1 h SER 111 CO -0.35 1.20 0.09 0.00 -0.53 0.00 0.00 176.83 177.24 1mp1 h ALA 112 N 0.77 0.29 0.00 6.23 0.00 0.29 -1.15 119.26 125.68 1mp1 h ALA 112 Ca -0.08 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1mp1 h ALA 112 Cb 1.81 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1mp1 h ALA 112 CO 0.17 -0.12 0.00 -0.56 0.00 0.00 0.00 179.25 178.74 1mp1 h GLN 113 N 0.20 0.00 0.00 0.00 3.07 0.20 0.45 115.11 119.03 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 0.18 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.74 1mp1 h GLN 113 CO -0.01 0.00 -0.54 0.39 0.09 0.00 0.00 178.83 178.76 1mp1 n GLU 114 N -2.39 0.13 -0.14 0.06 -0.58 -0.46 -4.80 120.64 112.46 1mp1 n GLU 114 Ca -0.01 0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 1mp1 n GLU 114 Cb 0.06 -1.58 0.00 0.00 -0.57 0.00 0.00 31.44 29.34 1mp1 n GLU 114 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1mp1 n ASN 115 N -1.78 0.00 -0.06 1.62 3.02 0.16 -5.05 115.26 113.16 1mp1 n ASN 115 Ca 0.05 -0.53 -0.10 0.00 -0.03 0.00 0.00 54.58 53.96 1mp1 n ASN 115 Cb 0.38 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.50 1mp1 n ASN 115 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mp1 n ILE 116 N -0.92 0.73 1.65 2.41 0.00 -1.26 -4.48 119.36 117.48 1mp1 n ILE 116 Ca 0.00 -0.25 0.13 0.00 0.00 0.00 0.00 62.75 62.63 1mp1 n ILE 116 Cb 0.00 -1.14 0.62 0.00 0.00 0.00 0.00 39.64 39.12 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 -3.07 2.60 -3.05 1.51 0.00 -1.26 -4.90 120.51 112.35 1mp1 n ALA 117 Ca -0.23 -0.35 -0.14 0.00 0.00 0.00 0.00 53.44 52.72 1mp1 n ALA 117 Cb 0.72 -1.27 0.04 0.00 0.00 0.00 0.00 19.45 18.95 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 1.07 0.07 3.39 0.00 0.00 -1.25 -4.33 105.19 104.14 1mp1 n GLY 118 Ca 0.19 -0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 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 -3.13 2.52 0.52 -0.61 1.09 -1.24 0.70 121.20 121.05 1mp1 s ILE 119 Ca 0.31 -0.93 -0.19 0.00 -1.10 0.00 0.00 60.65 58.74 1mp1 s ILE 119 Cb -0.14 -1.93 -0.07 0.00 -1.06 0.00 0.00 42.46 39.26 1mp1 s ILE 119 CO 0.38 0.58 1.04 -2.16 -0.10 0.00 0.00 174.94 174.69 1mp1 s PRO 120 N -0.65 3.65 0.46 2.79 0.04 -1.26 -4.21 135.00 135.82 1mp1 s PRO 120 Ca 0.10 1.29 0.32 0.00 0.04 0.00 0.00 61.00 62.75 1mp1 s PRO 120 Cb -0.10 -2.08 1.61 0.00 0.04 0.00 0.00 34.50 33.97 1mp1 s PRO 120 CO -0.00 -0.55 1.96 0.66 0.04 0.00 0.00 177.00 179.11 1mp1 h SER 121 N 1.16 0.00 -0.00 6.66 4.64 -1.86 -0.82 113.55 123.33 1mp1 h SER 121 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1mp1 h SER 121 Cb 1.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1mp1 h SER 121 CO 0.59 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.55 1mp1 h ALA 122 N 2.04 1.88 0.01 5.18 0.00 -1.94 -1.57 119.26 124.85 1mp1 h ALA 122 Ca 0.00 -0.00 -0.38 0.00 0.00 0.00 0.00 54.91 54.53 1mp1 h ALA 122 Cb 0.12 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 1mp1 h ALA 122 CO 0.00 -0.00 -2.41 1.19 0.00 0.00 0.00 179.25 178.03 1mp1 n PHE 123 N -4.36 0.13 0.03 0.00 3.72 -0.35 -3.87 117.46 112.76 1mp1 n PHE 123 Ca -0.03 0.03 -0.02 0.00 -0.05 0.00 0.00 57.45 57.38 1mp1 n PHE 123 Cb 0.09 -1.02 -0.01 0.00 -0.94 0.00 0.00 39.48 37.60 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 0.01 -0.19 0.00 4.37 3.38 -1.16 -3.19 115.31 118.53 1mp1 h LEU 124 Ca -0.56 0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.44 1mp1 h LEU 124 Cb 1.97 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 42.75 1mp1 h LEU 124 CO -0.05 -0.08 -0.32 -0.08 0.09 0.00 0.00 178.44 177.99 1mp1 h GLU 125 N -0.12 -0.40 0.00 1.13 4.57 -1.55 -3.42 114.58 114.79 1mp1 h GLU 125 Ca -0.01 0.03 -0.09 0.00 -1.18 0.00 0.00 59.36 58.11 1mp1 h GLU 125 Cb 0.11 0.09 0.05 0.00 -0.16 0.00 0.00 28.75 28.84 1mp1 h GLU 125 CO -0.02 -0.26 -0.03 1.28 -1.18 0.00 0.00 179.01 178.80 1mp1 n LEU 126 N -4.28 0.00 -4.72 1.64 4.77 -1.20 -4.95 117.00 108.25 1mp1 n LEU 126 Ca -0.04 -0.23 -0.39 0.00 -0.03 0.00 0.00 56.01 55.31 1mp1 n LEU 126 Cb 0.24 -0.25 -0.05 0.00 -2.33 0.00 0.00 43.42 41.03 1mp1 n LEU 126 CO 0.07 -1.72 0.29 -1.59 -1.33 0.00 0.00 177.39 173.11 1mp1 s LYS 127 N -3.54 4.39 0.25 3.23 -2.85 -1.26 -4.83 119.74 115.14 1mp1 s LYS 127 Ca 0.17 0.67 -0.30 0.00 -1.00 0.00 0.00 55.97 55.51 1mp1 s LYS 127 Cb -0.03 -3.44 -0.11 0.00 -2.06 0.00 0.00 37.83 32.19 1mp1 s LYS 127 CO 0.14 0.11 1.55 -1.59 0.10 0.00 0.00 175.35 175.65 1mp1 s LYS 128 N 0.72 4.19 0.28 1.78 -2.85 -1.25 -4.95 119.74 117.66 1mp1 s LYS 128 Ca 0.32 2.46 -0.29 0.00 -1.00 0.00 0.00 55.97 57.45 1mp1 s LYS 128 Cb -0.16 -3.07 -0.10 0.00 -2.06 0.00 0.00 37.83 32.44 1mp1 s LYS 128 CO 0.14 -0.56 1.16 -2.00 0.10 0.00 0.00 175.35 174.19 1mp1 s GLU 129 N -0.13 4.55 0.32 1.78 2.12 -1.26 -4.96 118.70 121.12 1mp1 s GLU 129 Ca 0.64 1.91 -0.29 0.00 0.36 0.00 0.00 54.97 57.59 1mp1 s GLU 129 Cb -0.45 -3.17 -0.12 0.00 0.26 0.00 0.00 34.13 30.66 1mp1 s GLU 129 CO 0.43 0.08 1.54 0.39 -0.54 0.00 0.00 175.26 177.16 1mp1 n GLU 130 N 1.25 2.63 -1.90 4.30 -0.58 -1.26 -4.90 120.64 120.17 1mp1 n GLU 130 Ca -0.00 0.93 -0.42 0.00 -0.42 0.00 0.00 57.16 57.25 1mp1 n GLU 130 Cb 0.44 -2.68 -0.02 0.00 -0.57 0.00 0.00 31.44 28.61 1mp1 n GLU 130 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1mp1 s ILE 131 N -0.40 2.44 0.60 -3.67 -1.09 -1.26 -4.99 121.20 112.82 1mp1 s ILE 131 Ca 0.61 0.35 -0.06 0.00 -2.23 0.00 0.00 60.65 59.31 1mp1 s ILE 131 Cb -0.50 -3.22 0.01 0.00 -1.58 0.00 0.00 42.46 37.17 1mp1 s ILE 131 CO 0.54 0.05 0.91 -0.75 -1.23 0.00 0.00 174.94 174.45 1mp1 s LYS 132 N 0.15 2.89 1.10 2.79 2.20 -1.26 -5.04 119.74 122.57 1mp1 s LYS 132 Ca 0.65 -0.02 -0.20 0.00 -0.36 0.00 0.00 55.97 56.04 1mp1 s LYS 132 Cb -0.45 -2.27 0.06 0.00 -1.51 0.00 0.00 37.83 33.67 1mp1 s LYS 132 CO 0.40 -0.72 -0.19 0.00 -0.36 0.00 0.00 175.35 174.47 1mp1 n GLN 133 N -2.60 -1.37 0.00 4.03 10.64 -1.26 -5.28 117.38 121.55 1mp1 n GLN 133 Ca 0.05 -0.38 0.02 0.00 -1.83 0.00 0.00 57.00 54.85 1mp1 n GLN 133 Cb 0.58 -1.61 0.02 0.00 -0.86 0.00 0.00 30.24 28.36 1mp1 n GLN 133 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77