#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mp1 h HIS 25 N 0.00 0.35 -0.54 7.33 -0.00 -2.00 -3.40 115.15 116.90 1mp1 h HIS 25 Ca 0.00 0.01 0.18 0.00 -0.00 0.00 0.00 60.37 60.56 1mp1 h HIS 25 Cb 0.00 -0.11 -0.21 0.00 -0.00 0.00 0.00 27.41 27.09 1mp1 h HIS 25 CO 0.00 0.17 -0.02 0.00 -0.00 0.00 0.00 177.93 178.08 1mp1 s MET 26 N -5.33 0.30 0.45 2.45 0.00 -1.26 -5.03 119.30 110.88 1mp1 s MET 26 Ca -0.07 0.49 -0.12 0.00 0.00 0.00 0.00 55.69 55.99 1mp1 s MET 26 Cb 0.19 0.27 -0.07 0.00 0.00 0.00 0.00 34.83 35.22 1mp1 s MET 26 CO 0.74 -0.37 0.85 -1.14 0.00 0.00 0.00 175.02 175.09 1mp1 s GLN 27 N 2.92 3.82 0.06 3.16 2.00 -1.26 -4.67 119.66 125.69 1mp1 s GLN 27 Ca 0.09 0.63 -0.07 0.00 -2.00 0.00 0.00 55.36 54.00 1mp1 s GLN 27 Cb -0.10 -2.30 0.03 0.00 0.80 0.00 0.00 33.01 31.43 1mp1 s GLN 27 CO -0.16 -0.13 0.35 1.47 -0.50 0.00 0.00 175.29 176.32 1mp1 n LEU 28 N -1.45 0.00 -4.89 3.68 -0.00 -1.26 -5.13 117.00 107.96 1mp1 n LEU 28 Ca 0.04 -0.49 -0.30 0.00 -0.00 0.00 0.00 56.01 55.25 1mp1 n LEU 28 Cb 0.54 0.95 -0.04 0.00 -0.00 0.00 0.00 43.42 44.87 1mp1 n LEU 28 CO 0.48 -0.16 0.22 -0.75 -0.00 0.00 0.00 177.39 177.17 1mp1 s LYS 29 N -2.02 3.72 0.30 1.47 2.20 -1.26 -5.05 119.74 119.11 1mp1 s LYS 29 Ca 0.08 0.16 0.09 0.00 -0.36 0.00 0.00 55.97 55.94 1mp1 s LYS 29 Cb -0.01 -2.64 -0.04 0.00 -1.51 0.00 0.00 37.83 33.63 1mp1 s LYS 29 CO 0.02 0.26 0.09 -0.06 -0.36 0.00 0.00 175.35 175.30 1mp1 s PHE 30 N -1.95 2.75 0.08 4.03 0.08 -1.26 -5.00 117.98 116.71 1mp1 s PHE 30 Ca 0.46 -0.29 -0.01 0.00 0.12 0.00 0.00 56.93 57.21 1mp1 s PHE 30 Cb -0.11 -1.44 0.02 0.00 -0.57 0.00 0.00 43.02 40.92 1mp1 s PHE 30 CO 0.26 0.47 0.08 0.00 -0.10 0.00 0.00 175.22 175.93 1mp1 n ALA 31 N -1.06 -0.20 -0.10 5.36 0.00 -1.26 -5.00 120.51 118.25 1mp1 n ALA 31 Ca -0.05 -0.12 -0.09 0.00 0.00 0.00 0.00 53.44 53.18 1mp1 n ALA 31 Cb 0.60 -0.01 -0.16 0.00 0.00 0.00 0.00 19.45 19.88 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 -1.56 0.69 0.24 0.00 1.02 -1.26 -4.17 120.64 115.60 1mp1 n GLU 32 Ca 0.01 -0.01 0.09 0.00 -0.02 0.00 0.00 57.16 57.23 1mp1 n GLU 32 Cb 0.04 -1.52 0.61 0.00 -0.02 0.00 0.00 31.44 30.54 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 -3.88 0.49 -1.67 0.00 4.77 -1.26 -0.89 117.00 114.56 1mp1 n LEU 34 Ca -0.02 0.70 -0.09 0.00 -0.03 0.00 0.00 56.01 56.57 1mp1 n LEU 34 Cb 0.27 -0.73 0.16 0.00 -2.33 0.00 0.00 43.42 40.79 1mp1 n LEU 34 CO 0.33 -0.79 0.89 -0.62 -1.33 0.00 0.00 177.39 175.87 1mp1 n GLU 35 N -2.13 2.38 -0.00 3.23 1.02 0.00 -3.73 120.64 121.41 1mp1 n GLU 35 Ca -0.00 -1.97 0.09 0.00 -0.02 0.00 0.00 57.16 55.25 1mp1 n GLU 35 Cb 0.07 -1.84 -0.11 0.00 -0.02 0.00 0.00 31.44 29.54 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 -0.24 0.48 -1.12 3.49 4.76 -0.07 -5.08 118.16 120.38 1mp1 n LYS 36 Ca 0.32 -0.01 0.14 0.00 -2.87 0.00 0.00 58.31 55.89 1mp1 n LYS 36 Cb 1.13 -1.43 -0.04 0.00 -1.84 0.00 0.00 35.03 32.84 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 -1.51 -2.19 0.00 1.97 4.01 -1.24 -5.04 118.16 114.16 1mp1 n LYS 37 Ca 0.03 1.55 0.00 0.00 -0.51 0.00 0.00 58.31 59.38 1mp1 n LYS 37 Cb 0.32 -2.71 0.00 0.00 -0.51 0.00 0.00 35.03 32.12 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 -3.45 0.00 -2.86 -0.18 0.24 -1.26 -4.85 118.33 105.98 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 0.63 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.00 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 1.66 -0.25 0.59 -1.34 -1.08 -1.26 -4.93 116.67 110.06 1mp1 s ASP 39 Ca 0.00 -0.08 0.30 0.00 -0.52 0.00 0.00 52.55 52.25 1mp1 s ASP 39 Cb 0.00 0.56 1.82 0.00 -1.46 0.00 0.00 42.92 43.84 1mp1 s ASP 39 CO 0.00 -0.03 2.25 0.24 0.52 0.00 0.00 175.17 178.15 1mp1 h MET 40 N 5.86 0.00 0.00 4.34 2.86 -1.73 0.33 114.93 126.58 1mp1 h MET 40 Ca -0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1mp1 h MET 40 Cb 1.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.88 1mp1 h MET 40 CO -0.10 0.01 0.00 0.45 1.06 0.00 0.00 176.91 178.33 1mp1 n SER 41 N -3.82 0.00 -0.02 1.22 2.88 -1.26 -3.12 113.62 109.50 1mp1 n SER 41 Ca -0.03 0.21 -0.02 0.00 -1.33 0.00 0.00 58.87 57.70 1mp1 n SER 41 Cb 0.09 -0.37 -0.02 0.00 -0.75 0.00 0.00 64.21 63.16 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 -1.37 0.78 -4.15 -1.46 4.76 0.81 -5.04 118.16 112.50 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 3.90 -0.13 -0.18 0.11 0.74 -4.02 120.40 118.76 1mp1 s VAL 43 Ca -0.04 -1.09 -0.20 0.00 -2.93 0.00 0.00 61.98 57.72 1mp1 s VAL 43 Cb 0.01 -2.87 -0.04 0.00 -1.53 0.00 0.00 36.38 31.95 1mp1 s VAL 43 CO 0.09 0.08 0.56 0.20 -3.33 0.00 0.00 175.10 172.70 1mp1 s ASN 44 N -2.40 6.74 0.12 3.54 0.01 0.27 -4.30 114.94 118.93 1mp1 s ASN 44 Ca 0.26 0.89 0.21 0.00 -0.71 0.00 0.00 52.86 53.51 1mp1 s ASN 44 Cb -0.11 -2.33 -0.10 0.00 0.41 0.00 0.00 41.25 39.12 1mp1 s ASN 44 CO 0.18 -0.09 0.86 0.00 -1.51 0.00 0.00 177.10 176.54 1mp1 n LEU 45 N 4.03 0.64 -0.32 0.60 -0.00 -1.26 -4.03 117.00 116.65 1mp1 n LEU 45 Ca -0.05 0.25 -0.01 0.00 -0.00 0.00 0.00 56.01 56.20 1mp1 n LEU 45 Cb 0.51 -0.01 0.15 0.00 -0.00 0.00 0.00 43.42 44.07 1mp1 n LEU 45 CO 0.44 -0.08 1.26 -0.33 -0.00 0.00 0.00 177.39 178.68 1mp1 h GLU 46 N 0.00 1.20 0.00 1.47 5.08 -1.93 0.25 114.58 120.65 1mp1 h GLU 46 Ca -0.04 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1mp1 h GLU 46 Cb 1.12 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 30.10 1mp1 h GLU 46 CO 0.01 0.81 0.00 1.33 -1.00 0.00 0.00 179.01 180.15 1mp1 n VAL 47 N -4.39 0.68 0.07 3.13 0.24 -1.26 -0.86 118.33 115.94 1mp1 n VAL 47 Ca 0.10 0.17 0.05 0.00 -2.04 0.00 0.00 64.34 62.62 1mp1 n VAL 47 Cb 0.03 -0.92 0.09 0.00 -1.47 0.00 0.00 33.84 31.57 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 -1.33 0.60 -0.05 1.34 2.08 0.80 -4.45 119.36 118.34 1mp1 n ILE 48 Ca 0.06 -0.80 -0.13 0.00 0.56 0.00 0.00 62.75 62.44 1mp1 n ILE 48 Cb 0.13 0.78 -0.07 0.00 -0.75 0.00 0.00 39.64 39.72 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 1.75 0.36 0.00 0.38 1.79 -0.06 0.14 116.57 120.93 1mp1 h LYS 49 Ca 0.00 -0.20 -0.13 0.00 -2.18 0.00 0.00 60.65 58.14 1mp1 h LYS 49 Cb 0.57 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.22 1mp1 h LYS 49 CO 0.00 0.76 -0.62 -1.00 -1.08 0.00 0.00 179.45 177.51 1mp1 h PRO 50 N -0.03 0.00 -0.06 3.15 0.13 -1.80 -0.50 132.00 132.90 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 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1mp1 h PRO 50 CO 0.04 0.62 -0.16 2.35 -0.23 0.00 0.00 178.00 180.63 1mp1 h TRP 51 N 0.00 0.26 0.06 1.56 7.01 -1.76 0.23 115.95 123.31 1mp1 h TRP 51 Ca -0.01 -0.10 -0.00 0.00 2.11 0.00 0.00 58.89 60.89 1mp1 h TRP 51 Cb 1.23 -0.05 0.00 0.00 -2.10 0.00 0.00 29.16 28.24 1mp1 h TRP 51 CO 0.00 0.77 -0.03 0.82 -2.79 0.00 0.00 178.44 177.21 1mp1 h ILE 52 N -0.32 1.03 -0.83 2.65 5.03 -0.70 0.91 117.51 125.29 1mp1 h ILE 52 Ca -0.00 -0.32 0.00 0.00 -0.12 0.00 0.00 64.86 64.42 1mp1 h ILE 52 Cb 0.77 1.24 -0.04 0.00 -3.03 0.00 0.00 36.82 35.76 1mp1 h ILE 52 CO 0.03 0.08 0.52 0.74 -0.68 0.00 0.00 178.15 178.84 1mp1 h THR 53 N -0.22 1.22 -0.17 -0.27 2.02 -1.13 1.00 112.91 115.36 1mp1 h THR 53 Ca -0.01 -0.46 -0.17 0.00 0.77 0.00 0.00 66.41 66.55 1mp1 h THR 53 Cb 0.19 0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 66.63 1mp1 h THR 53 CO 0.01 0.23 -0.59 0.50 0.37 0.00 0.00 175.52 176.04 1mp1 h LYS 54 N 1.13 0.54 -0.01 6.66 3.64 -0.20 0.25 116.57 128.59 1mp1 h LYS 54 Ca 0.30 -0.36 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1mp1 h LYS 54 Cb -0.08 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1mp1 h LYS 54 CO -0.06 0.98 -0.01 0.00 -2.27 0.00 0.00 179.45 178.08 1mp1 h ARG 55 N 0.41 0.02 -0.55 1.90 2.47 0.18 0.17 114.38 118.98 1mp1 h ARG 55 Ca -0.00 -0.01 -0.04 0.00 -1.26 0.00 0.00 59.98 58.66 1mp1 h ARG 55 Cb 1.14 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.44 1mp1 h ARG 55 CO 0.11 0.60 0.18 -0.39 0.56 0.00 0.00 179.97 181.03 1mp1 h VAL 56 N -0.56 1.23 -0.65 2.04 -1.51 0.97 0.71 116.25 118.48 1mp1 h VAL 56 Ca 0.00 -0.78 -0.07 0.00 -1.23 0.00 0.00 66.70 64.62 1mp1 h VAL 56 Cb 0.60 0.71 -0.03 0.00 -2.13 0.00 0.00 31.29 30.44 1mp1 h VAL 56 CO 0.00 0.29 0.13 0.74 -1.23 0.00 0.00 177.57 177.50 1mp1 h THR 57 N 0.76 1.26 0.00 7.19 2.02 -0.53 -2.49 112.91 121.11 1mp1 h THR 57 Ca 0.18 -0.98 -0.13 0.00 0.77 0.00 0.00 66.41 66.24 1mp1 h THR 57 Cb 0.27 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 1mp1 h THR 57 CO -0.01 0.37 -0.64 -0.33 0.37 0.00 0.00 175.52 175.28 1mp1 h GLU 58 N 0.97 0.00 -0.37 6.66 5.08 -0.31 3.30 114.58 129.91 1mp1 h GLU 58 Ca 0.20 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.60 1mp1 h GLU 58 Cb 0.40 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.61 1mp1 h GLU 58 CO 0.01 0.64 0.15 0.82 -1.00 0.00 0.00 179.01 179.62 1mp1 h ILE 59 N 0.00 0.92 0.00 3.13 2.04 0.86 -3.30 117.51 121.16 1mp1 h ILE 59 Ca -0.01 -0.11 -0.44 0.00 1.00 0.00 0.00 64.86 65.31 1mp1 h ILE 59 Cb 1.17 0.58 -0.07 0.00 -0.74 0.00 0.00 36.82 37.76 1mp1 h ILE 59 CO 0.08 0.06 -2.50 0.00 0.00 0.00 0.00 178.15 175.79 1mp1 n LEU 60 N -4.99 2.26 0.00 1.44 -0.00 -1.06 -5.02 117.00 109.63 1mp1 n LEU 60 Ca 0.01 0.20 0.00 0.00 -0.00 0.00 0.00 56.01 56.23 1mp1 n LEU 60 Cb 0.12 -0.85 0.00 0.00 -0.00 0.00 0.00 43.42 42.69 1mp1 n LEU 60 CO 0.28 0.68 0.00 0.61 -0.00 0.00 0.00 177.39 178.96 1mp1 n GLY 61 N 1.56 1.16 3.26 1.47 0.00 1.09 -5.10 105.19 108.62 1mp1 n GLY 61 Ca -0.52 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.29 1.49 -0.34 1.61 -0.12 -0.61 -4.83 117.98 113.89 1mp1 s PHE 62 Ca 0.00 -0.53 -0.29 0.00 -0.05 0.00 0.00 56.93 56.07 1mp1 s PHE 62 Cb 0.00 -0.78 -0.01 0.00 -0.63 0.00 0.00 43.02 41.61 1mp1 s PHE 62 CO 0.00 0.18 1.54 -2.00 -0.05 0.00 0.00 175.22 174.89 1mp1 s GLU 63 N -2.59 3.58 0.00 1.99 2.12 -1.26 -4.11 118.70 118.43 1mp1 s GLU 63 Ca 0.09 1.24 0.00 0.00 0.36 0.00 0.00 54.97 56.66 1mp1 s GLU 63 Cb -0.06 -4.06 0.00 0.00 0.26 0.00 0.00 34.13 30.28 1mp1 s GLU 63 CO 0.04 -1.55 0.00 -0.25 -0.54 0.00 0.00 175.26 172.96 1mp1 n ASP 64 N 9.03 0.00 0.04 -1.70 8.00 -1.26 -5.05 116.55 125.60 1mp1 n ASP 64 Ca 0.18 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.68 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 -0.64 -0.15 -2.24 8.00 -1.26 -4.85 116.55 115.41 1mp1 n ASP 65 Ca 0.00 0.19 -0.09 0.00 0.71 0.00 0.00 54.79 55.60 1mp1 n ASP 65 Cb 0.00 0.85 -0.00 0.00 -0.02 0.00 0.00 41.12 41.95 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 1.24 -0.29 2.53 3.04 -1.98 0.66 116.25 121.45 1mp1 h VAL 66 Ca 0.00 -0.83 -0.15 0.00 -1.01 0.00 0.00 66.70 64.72 1mp1 h VAL 66 Cb 0.00 0.94 -0.00 0.00 -2.01 0.00 0.00 31.29 30.22 1mp1 h VAL 66 CO 0.00 0.29 -0.39 -0.37 -1.01 0.00 0.00 177.57 176.09 1mp1 h VAL 67 N 0.57 1.29 -0.32 1.51 -1.51 -1.92 -0.64 116.25 115.23 1mp1 h VAL 67 Ca 0.14 -1.58 -0.01 0.00 -1.23 0.00 0.00 66.70 64.01 1mp1 h VAL 67 Cb 0.33 1.61 -0.01 0.00 -2.13 0.00 0.00 31.29 31.08 1mp1 h VAL 67 CO 0.00 0.51 0.15 0.40 -1.23 0.00 0.00 177.57 177.40 1mp1 h ILE 68 N 0.54 1.17 -0.85 7.19 2.04 -1.84 -1.82 117.51 123.94 1mp1 h ILE 68 Ca 0.03 -0.49 -0.02 0.00 1.00 0.00 0.00 64.86 65.38 1mp1 h ILE 68 Cb 0.99 0.90 -0.04 0.00 -0.74 0.00 0.00 36.82 37.92 1mp1 h ILE 68 CO 0.09 0.18 0.44 -0.33 0.00 0.00 0.00 178.15 178.53 1mp1 h GLU 69 N 0.38 1.20 -0.47 2.37 5.08 0.39 0.24 114.58 123.77 1mp1 h GLU 69 Ca 0.11 -0.16 0.05 0.00 -1.00 0.00 0.00 59.36 58.36 1mp1 h GLU 69 Cb 0.14 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 1mp1 h GLU 69 CO -0.01 0.90 0.22 0.74 -1.00 0.00 0.00 179.01 179.86 1mp1 h PHE 70 N 1.19 0.40 -0.13 4.33 0.04 -0.71 2.14 116.94 124.20 1mp1 h PHE 70 Ca 0.29 0.02 -0.07 0.00 2.80 0.00 0.00 57.97 61.01 1mp1 h PHE 70 Cb 0.07 -0.11 -0.00 0.00 2.20 0.00 0.00 35.95 38.11 1mp1 h PHE 70 CO 0.01 0.19 -0.20 0.82 -0.60 0.00 0.00 178.31 178.53 1mp1 h ILE 71 N 0.44 1.37 -0.09 -0.55 2.04 -0.96 0.33 117.51 120.07 1mp1 h ILE 71 Ca 0.21 -1.43 -0.00 0.00 1.00 0.00 0.00 64.86 64.63 1mp1 h ILE 71 Cb 0.14 1.98 -0.00 0.00 -0.74 0.00 0.00 36.82 38.20 1mp1 h ILE 71 CO -0.17 0.42 0.04 -0.26 0.00 0.00 0.00 178.15 178.19 1mp1 h PHE 72 N -0.02 0.14 -0.78 1.37 -1.00 -0.13 1.51 116.94 118.02 1mp1 h PHE 72 Ca 0.01 -0.01 -0.03 0.00 2.81 0.00 0.00 57.97 60.75 1mp1 h PHE 72 Cb 0.77 -0.04 -0.04 0.00 3.61 0.00 0.00 35.95 40.25 1mp1 h PHE 72 CO 0.10 0.21 0.36 -0.91 -1.61 0.00 0.00 178.31 176.46 1mp1 h ASN 73 N 0.02 1.03 -0.04 2.17 2.35 0.35 0.41 115.58 121.86 1mp1 h ASN 73 Ca 0.03 -0.13 -0.20 0.00 -0.55 0.00 0.00 56.30 55.45 1mp1 h ASN 73 Cb 0.13 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.24 1mp1 h ASN 73 CO -0.00 0.88 -0.72 1.56 -1.65 0.00 0.00 177.43 177.49 1mp1 h GLN 74 N 1.12 0.69 0.00 0.81 7.50 -0.59 -2.67 115.11 121.96 1mp1 h GLN 74 Ca 0.27 -0.53 0.00 0.00 0.50 0.00 0.00 58.65 58.89 1mp1 h GLN 74 Cb 0.13 0.10 0.00 0.00 0.05 0.00 0.00 27.48 27.76 1mp1 h GLN 74 CO -0.03 1.15 0.00 1.28 -1.50 0.00 0.00 178.83 179.73 1mp1 n LEU 75 N -3.92 0.00 -0.10 1.46 4.77 0.51 -2.68 117.00 117.05 1mp1 n LEU 75 Ca -0.06 0.14 0.14 0.00 -0.03 0.00 0.00 56.01 56.20 1mp1 n LEU 75 Cb 0.71 -0.14 0.62 0.00 -2.33 0.00 0.00 43.42 42.29 1mp1 n LEU 75 CO 0.51 -0.00 0.88 -0.62 -1.33 0.00 0.00 177.39 176.83 1mp1 n GLU 76 N -1.14 0.64 -1.98 3.23 1.02 0.14 -4.82 120.64 117.74 1mp1 n GLU 76 Ca 0.19 -0.20 -0.09 0.00 -0.02 0.00 0.00 57.16 57.04 1mp1 n GLU 76 Cb 0.17 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.12 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 -1.01 0.00 0.12 2.62 0.24 -1.09 -5.04 118.33 114.17 1mp1 n VAL 77 Ca 0.14 -0.88 0.10 0.00 -2.04 0.00 0.00 64.34 61.67 1mp1 n VAL 77 Cb 0.27 -0.71 -0.15 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 -1.49 0.59 -3.46 7.34 4.01 -1.26 -4.40 118.16 119.49 1mp1 n LYS 78 Ca 0.06 -0.16 -0.28 0.00 -0.51 0.00 0.00 58.31 57.42 1mp1 n LYS 78 Cb 0.27 -1.48 -0.11 0.00 -0.51 0.00 0.00 35.03 33.19 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 -4.18 2.33 0.54 4.39 0.02 -1.26 -3.26 114.94 113.52 1mp1 s ASN 79 Ca -0.06 -2.71 -0.18 0.00 -1.02 0.00 0.00 52.86 48.89 1mp1 s ASN 79 Cb 0.13 -0.51 -0.06 0.00 0.02 0.00 0.00 41.25 40.83 1mp1 s ASN 79 CO 0.85 -0.23 1.04 -2.16 0.02 0.00 0.00 177.10 176.62 1mp1 s PRO 80 N 0.43 3.60 -0.74 -0.60 0.04 -1.26 -5.01 135.00 131.46 1mp1 s PRO 80 Ca 0.25 1.26 -0.10 0.00 0.04 0.00 0.00 61.00 62.45 1mp1 s PRO 80 Cb -0.09 -2.07 0.19 0.00 0.04 0.00 0.00 34.50 32.57 1mp1 s PRO 80 CO -0.10 -0.59 0.64 0.34 0.04 0.00 0.00 177.00 177.33 1mp1 s ASP 81 N -2.43 6.20 0.62 6.66 2.15 -1.26 -4.87 116.67 123.74 1mp1 s ASP 81 Ca 0.65 -2.69 0.24 0.00 0.43 0.00 0.00 52.55 51.18 1mp1 s ASP 81 Cb -0.16 -2.09 1.12 0.00 -0.30 0.00 0.00 42.92 41.50 1mp1 s ASP 81 CO 0.28 -0.52 1.59 0.77 -0.17 0.00 0.00 175.17 177.13 1mp1 h SER 82 N 7.59 0.00 -0.04 -0.34 4.64 -1.95 0.81 113.55 124.26 1mp1 h SER 82 Ca 0.04 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.35 1mp1 h SER 82 Cb 1.01 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.10 1mp1 h SER 82 CO 0.75 0.00 -0.02 0.11 -0.87 0.00 0.00 176.83 176.81 1mp1 h LYS 83 N 0.00 0.09 -0.03 4.77 1.79 -1.90 -1.73 116.57 119.56 1mp1 h LYS 83 Ca 0.21 -0.04 -0.12 0.00 -2.18 0.00 0.00 60.65 58.52 1mp1 h LYS 83 Cb 1.67 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 32.30 1mp1 h LYS 83 CO -0.00 0.47 -0.52 0.52 -1.08 0.00 0.00 179.45 178.84 1mp1 h MET 84 N -0.29 0.08 0.28 3.15 2.86 0.14 0.04 114.93 121.19 1mp1 h MET 84 Ca 0.01 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 1mp1 h MET 84 Cb 0.44 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1mp1 h MET 84 CO 0.01 0.58 -0.13 1.98 1.06 0.00 0.00 176.91 180.40 1mp1 h MET 85 N 0.06 -0.36 -0.08 1.72 -1.53 -0.94 0.50 114.93 114.29 1mp1 h MET 85 Ca -0.00 0.02 -0.14 0.00 -3.44 0.00 0.00 59.70 56.14 1mp1 h MET 85 Cb 0.94 0.08 -0.01 0.00 -0.55 0.00 0.00 31.60 32.06 1mp1 h MET 85 CO 0.07 -0.14 -0.57 0.37 0.14 0.00 0.00 176.91 176.78 1mp1 h GLN 86 N -0.53 0.25 -0.79 0.39 4.15 -1.31 -1.38 115.11 115.90 1mp1 h GLN 86 Ca -0.04 -0.17 -0.02 0.00 0.77 0.00 0.00 58.65 59.19 1mp1 h GLN 86 Cb 0.39 0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.07 1mp1 h GLN 86 CO 0.06 0.76 0.39 0.82 -1.93 0.00 0.00 178.83 178.93 1mp1 h ILE 87 N 0.19 1.24 -0.10 2.39 2.04 -0.85 0.38 117.51 122.80 1mp1 h ILE 87 Ca -0.00 -0.66 -0.18 0.00 1.00 0.00 0.00 64.86 65.02 1mp1 h ILE 87 Cb 1.06 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 1mp1 h ILE 87 CO 0.09 0.28 -0.68 0.78 0.00 0.00 0.00 178.15 178.62 1mp1 h ASN 88 N 1.10 0.51 -0.48 1.72 2.35 -0.73 -3.09 115.58 116.96 1mp1 h ASN 88 Ca 0.27 -0.32 -0.06 0.00 -0.55 0.00 0.00 56.30 55.65 1mp1 h ASN 88 Cb 0.09 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 1mp1 h ASN 88 CO -0.04 1.04 0.06 -0.07 -1.65 0.00 0.00 177.43 176.78 1mp1 h LEU 89 N 0.31 0.78 -2.34 1.61 3.38 -0.57 -1.92 115.31 116.56 1mp1 h LEU 89 Ca -0.02 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.71 1mp1 h LEU 89 Cb 1.24 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 1mp1 h LEU 89 CO 0.12 0.85 0.18 0.74 0.09 0.00 0.00 178.44 180.42 1mp1 h THR 90 N 0.67 0.32 0.00 0.22 2.02 -0.18 1.50 112.91 117.45 1mp1 h THR 90 Ca 0.14 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.32 1mp1 h THR 90 Cb 0.42 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 1mp1 h THR 90 CO 0.01 0.00 0.00 1.23 0.37 0.00 0.00 175.52 177.13 1mp1 h GLY 91 N 0.00 0.00 0.00 2.16 0.00 -1.29 -3.35 103.07 100.59 1mp1 h GLY 91 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1mp1 h GLY 91 CO -0.00 0.00 -0.87 0.69 0.00 0.00 0.00 176.54 176.36 1mp1 n PHE 92 N -2.37 0.00 -0.07 5.60 3.01 0.16 -5.07 117.46 118.71 1mp1 n PHE 92 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.48 1mp1 n PHE 92 Cb 0.27 0.06 0.00 0.00 -0.01 0.00 0.00 39.48 39.79 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 -2.86 0.00 -0.07 4.37 4.77 0.46 -4.91 117.00 118.75 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 0.44 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.67 1mp1 n LEU 93 CO 0.00 -0.99 0.33 0.59 -1.33 0.00 0.00 177.39 175.99 1mp1 n ASN 94 N -1.75 0.83 0.00 -1.43 3.02 -1.26 -4.83 115.26 109.84 1mp1 n ASN 94 Ca 0.00 -0.65 0.00 0.00 -0.03 0.00 0.00 54.58 53.90 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 1.47 3.13 0.12 7.41 0.00 -1.26 -4.78 105.19 111.28 1mp1 n GLY 95 Ca 0.06 -0.90 -0.09 0.00 0.00 0.00 0.00 46.02 45.09 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 0.20 -0.03 1.61 6.56 -1.97 -2.90 116.57 120.04 1mp1 h LYS 96 Ca 0.00 -0.24 -0.12 0.00 -1.06 0.00 0.00 60.65 59.23 1mp1 h LYS 96 Cb 0.00 0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 31.72 1mp1 h LYS 96 CO 0.00 0.99 -0.55 -0.97 -2.06 0.00 0.00 179.45 176.86 1mp1 h ASN 97 N 0.11 0.11 -0.26 0.86 -0.73 -1.96 -0.82 115.58 112.90 1mp1 h ASN 97 Ca -0.05 -0.06 -0.03 0.00 1.87 0.00 0.00 56.30 58.03 1mp1 h ASN 97 Cb 1.56 -0.03 -0.01 0.00 0.27 0.00 0.00 38.32 40.11 1mp1 h ASN 97 CO 0.14 0.64 0.03 0.00 -0.37 0.00 0.00 177.43 177.87 1mp1 h ALA 98 N 1.37 0.34 -0.46 1.57 0.00 -1.87 1.57 119.26 121.77 1mp1 h ALA 98 Ca -0.00 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 1mp1 h ALA 98 Cb 0.99 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1mp1 h ALA 98 CO 0.08 0.04 -0.07 0.00 0.00 0.00 0.00 179.25 179.30 1mp1 h ARG 99 N 0.23 0.87 -0.14 0.00 3.08 -1.37 -2.07 114.38 114.98 1mp1 h ARG 99 Ca 0.08 -0.31 -0.17 0.00 0.07 0.00 0.00 59.98 59.64 1mp1 h ARG 99 Cb 0.35 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 1mp1 h ARG 99 CO 0.01 0.95 -0.64 0.93 -1.07 0.00 0.00 179.97 180.14 1mp1 h GLU 100 N 0.71 0.50 -0.48 0.04 4.39 -1.01 -2.89 114.58 115.85 1mp1 h GLU 100 Ca 0.12 -0.36 0.01 0.00 0.34 0.00 0.00 59.36 59.48 1mp1 h GLU 100 Cb 0.60 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.28 1mp1 h GLU 100 CO 0.04 0.98 0.30 0.35 -1.16 0.00 0.00 179.01 179.51 1mp1 h PHE 101 N 0.37 0.56 -0.26 4.33 3.04 0.24 -1.96 116.94 123.25 1mp1 h PHE 101 Ca -0.01 0.02 -0.05 0.00 3.98 0.00 0.00 57.97 61.90 1mp1 h PHE 101 Cb 1.20 -0.18 -0.02 0.00 2.56 0.00 0.00 35.95 39.51 1mp1 h PHE 101 CO 0.05 0.33 -0.05 0.52 -2.02 0.00 0.00 178.31 177.14 1mp1 h MET 102 N 0.60 0.41 -0.48 1.11 2.86 -1.36 -1.23 114.93 116.85 1mp1 h MET 102 Ca 0.18 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 1mp1 h MET 102 Cb -0.02 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.58 1mp1 h MET 102 CO -0.07 0.48 0.00 0.41 1.06 0.00 0.00 176.91 178.80 1mp1 n GLY 103 N -0.87 0.31 0.00 8.32 0.00 -0.75 0.29 105.19 112.49 1mp1 n GLY 103 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.20 1.51 -0.09 1.61 1.02 -0.53 -4.63 120.64 119.33 1mp1 n GLU 104 Ca 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 57.00 1mp1 n GLU 104 Cb 0.12 -0.80 -0.14 0.00 -0.02 0.00 0.00 31.44 30.59 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 -1.67 1.38 -0.24 -4.62 -0.00 -0.80 -3.12 117.00 107.92 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 0.30 -0.18 0.05 0.00 -0.00 0.00 0.00 43.42 43.59 1mp1 n LEU 105 CO 0.00 0.66 1.10 -0.25 -0.00 0.00 0.00 177.39 178.91 1mp1 h TRP 106 N 0.01 0.90 0.00 1.96 2.91 -0.39 -1.89 115.95 119.46 1mp1 h TRP 106 Ca -0.51 -0.01 -0.13 0.00 1.13 0.00 0.00 58.89 59.37 1mp1 h TRP 106 Cb 2.08 -0.29 -0.02 0.00 -0.51 0.00 0.00 29.16 30.42 1mp1 h TRP 106 CO 0.02 0.63 -0.61 -1.00 -1.03 0.00 0.00 178.44 176.44 1mp1 h PRO 107 N 0.92 0.00 -0.83 2.65 0.13 -1.74 -2.93 132.00 130.20 1mp1 h PRO 107 Ca 0.24 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.41 1mp1 h PRO 107 Cb 0.01 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.08 1mp1 h PRO 107 CO -0.04 0.61 0.53 1.25 -0.23 0.00 0.00 178.00 180.12 1mp1 h LEU 108 N 0.00 0.86 -0.60 1.56 5.85 -1.30 -0.69 115.31 120.99 1mp1 h LEU 108 Ca -0.01 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.56 1mp1 h LEU 108 Cb 1.22 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 1mp1 h LEU 108 CO 0.08 0.58 -0.61 -0.07 -0.34 0.00 0.00 178.44 178.08 1mp1 h LEU 109 N 1.01 0.36 -0.84 2.25 3.38 -1.37 -1.19 115.31 118.90 1mp1 h LEU 109 Ca 0.34 -0.20 0.11 0.00 0.09 0.00 0.00 57.88 58.22 1mp1 h LEU 109 Cb 0.06 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 40.63 1mp1 h LEU 109 CO -0.13 0.88 0.47 -0.07 0.09 0.00 0.00 178.44 179.68 1mp1 h LEU 110 N 0.23 0.65 0.15 1.67 4.07 -0.96 1.51 115.31 122.62 1mp1 h LEU 110 Ca -0.01 0.06 -0.31 0.00 0.08 0.00 0.00 57.88 57.71 1mp1 h LEU 110 Cb 1.13 -0.06 0.03 0.00 1.08 0.00 0.00 40.66 42.84 1mp1 h LEU 110 CO 0.10 0.34 -1.28 -1.28 -1.08 0.00 0.00 178.44 175.24 1mp1 h SER 111 N 0.75 0.88 -0.32 -0.43 0.87 -1.21 -3.14 113.55 110.95 1mp1 h SER 111 Ca 0.42 -0.84 -0.00 0.00 -1.23 0.00 0.00 61.79 60.14 1mp1 h SER 111 Cb 0.45 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 62.12 1mp1 h SER 111 CO -0.28 1.63 0.19 0.00 -0.53 0.00 0.00 176.83 177.84 1mp1 h ALA 112 N 0.26 0.41 0.00 6.23 0.00 -0.15 -0.26 119.26 125.74 1mp1 h ALA 112 Ca -0.20 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1mp1 h ALA 112 Cb 1.96 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.62 1mp1 h ALA 112 CO 0.25 -0.08 0.00 -0.56 0.00 0.00 0.00 179.25 178.85 1mp1 h GLN 113 N 0.41 0.00 0.00 0.00 3.07 0.20 0.50 115.11 119.30 1mp1 h GLN 113 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.86 1mp1 h GLN 113 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.58 1mp1 h GLN 113 CO -0.02 0.00 -0.43 0.39 0.09 0.00 0.00 178.83 178.86 1mp1 n GLU 114 N -2.72 0.07 -0.08 0.06 -0.58 -0.14 -4.81 120.64 112.44 1mp1 n GLU 114 Ca -0.02 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1mp1 n GLU 114 Cb 0.06 -1.54 0.00 0.00 -0.57 0.00 0.00 31.44 29.39 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 -1.64 0.00 -0.05 1.62 2.85 0.18 -5.06 115.26 113.15 1mp1 n ASN 115 Ca 0.05 -0.21 -0.09 0.00 -0.11 0.00 0.00 54.58 54.23 1mp1 n ASN 115 Cb 0.36 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.34 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 -0.34 0.59 1.61 -1.44 0.00 -1.26 -4.52 119.36 114.00 1mp1 n ILE 116 Ca 0.00 -0.19 0.13 0.00 0.00 0.00 0.00 62.75 62.68 1mp1 n ILE 116 Cb 0.00 -1.20 0.57 0.00 0.00 0.00 0.00 39.64 39.01 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 -3.10 2.59 -2.76 1.51 0.00 -1.26 -4.89 120.51 112.60 1mp1 n ALA 117 Ca -0.20 -0.36 -0.11 0.00 0.00 0.00 0.00 53.44 52.78 1mp1 n ALA 117 Cb 0.68 -1.24 0.02 0.00 0.00 0.00 0.00 19.45 18.91 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 1.06 0.17 3.35 0.00 0.00 -1.25 -4.32 105.19 104.19 1mp1 n GLY 118 Ca 0.18 -0.31 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.95 2.72 0.47 -0.61 1.09 -1.24 -0.56 121.20 120.11 1mp1 s ILE 119 Ca 0.19 -0.80 -0.21 0.00 -1.10 0.00 0.00 60.65 58.73 1mp1 s ILE 119 Cb -0.08 -2.09 -0.09 0.00 -1.06 0.00 0.00 42.46 39.14 1mp1 s ILE 119 CO 0.24 0.55 1.04 -2.16 -0.10 0.00 0.00 174.94 174.51 1mp1 s PRO 120 N 0.06 3.86 0.30 2.79 0.04 -1.26 -4.30 135.00 136.49 1mp1 s PRO 120 Ca -0.07 1.39 0.20 0.00 0.04 0.00 0.00 61.00 62.56 1mp1 s PRO 120 Cb -0.15 -2.17 1.10 0.00 0.04 0.00 0.00 34.50 33.32 1mp1 s PRO 120 CO 0.05 -0.38 1.62 -1.13 0.04 0.00 0.00 177.00 177.20 1mp1 n SER 121 N -0.81 0.53 0.17 6.66 3.41 -1.26 -1.18 113.62 121.13 1mp1 n SER 121 Ca 0.09 0.74 0.15 0.00 -0.26 0.00 0.00 58.87 59.59 1mp1 n SER 121 Cb 0.52 -0.81 0.74 0.00 -0.26 0.00 0.00 64.21 64.40 1mp1 n SER 121 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mp1 h ALA 122 N 2.01 2.05 0.00 7.33 0.00 -1.93 -2.33 119.26 126.38 1mp1 h ALA 122 Ca 0.00 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.62 1mp1 h ALA 122 Cb 0.02 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 1mp1 h ALA 122 CO 0.00 -0.30 -2.04 1.19 0.00 0.00 0.00 179.25 178.10 1mp1 n PHE 123 N -4.18 0.00 -0.11 0.00 3.72 -0.33 -3.95 117.46 112.61 1mp1 n PHE 123 Ca 0.02 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.37 1mp1 n PHE 123 Cb 0.32 -0.70 -0.04 0.00 -0.94 0.00 0.00 39.48 38.12 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 -0.15 -0.86 0.00 4.37 3.38 -1.30 -3.19 115.31 117.56 1mp1 h LEU 124 Ca -0.42 0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1mp1 h LEU 124 Cb 1.58 0.36 0.00 0.00 0.09 0.00 0.00 40.66 42.70 1mp1 h LEU 124 CO -0.11 -0.14 0.00 1.21 0.09 0.00 0.00 178.44 179.48 1mp1 n GLU 125 N -3.90 0.00 -1.69 1.13 4.07 -0.89 -4.55 120.64 114.82 1mp1 n GLU 125 Ca -0.01 0.42 -0.43 0.00 -0.06 0.00 0.00 57.16 57.09 1mp1 n GLU 125 Cb 0.13 -1.28 -0.03 0.00 -0.06 0.00 0.00 31.44 30.20 1mp1 n GLU 125 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1mp1 s LEU 126 N -3.52 3.60 -0.23 4.31 1.43 -1.20 -4.84 118.68 118.23 1mp1 s LEU 126 Ca 0.00 1.91 -0.35 0.00 -1.03 0.00 0.00 54.13 54.66 1mp1 s LEU 126 Cb 0.00 -3.52 -0.12 0.00 0.03 0.00 0.00 46.19 42.59 1mp1 s LEU 126 CO 0.00 -1.78 2.00 2.29 0.23 0.00 0.00 176.35 179.09 1mp1 n LYS 127 N 8.51 1.57 -1.19 1.70 2.85 -1.25 -4.29 118.16 126.05 1mp1 n LYS 127 Ca 0.27 0.52 -0.33 0.00 -1.05 0.00 0.00 58.31 57.73 1mp1 n LYS 127 Cb 0.45 -2.53 0.11 0.00 -0.65 0.00 0.00 35.03 32.41 1mp1 n LYS 127 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 177.40 175.76 1mp1 s LYS 128 N 4.96 1.84 1.29 -1.58 -2.85 -1.26 -4.98 119.74 117.16 1mp1 s LYS 128 Ca 1.01 1.57 -0.17 0.00 -1.00 0.00 0.00 55.97 57.38 1mp1 s LYS 128 Cb -0.79 -1.82 0.33 0.00 -2.06 0.00 0.00 37.83 33.49 1mp1 s LYS 128 CO 0.52 -2.02 0.98 -2.00 0.10 0.00 0.00 175.35 172.93 1mp1 s GLU 129 N -4.32 -1.90 -0.92 1.78 2.12 -1.26 -4.96 118.70 109.25 1mp1 s GLU 129 Ca 0.69 0.52 -0.02 0.00 0.36 0.00 0.00 54.97 56.52 1mp1 s GLU 129 Cb -0.25 -1.46 0.23 0.00 0.26 0.00 0.00 34.13 32.91 1mp1 s GLU 129 CO 0.51 -4.29 0.81 -1.21 -0.54 0.00 0.00 175.26 170.54 1mp1 s GLU 130 N -4.71 3.37 0.47 4.30 2.02 -1.26 -5.02 118.70 117.86 1mp1 s GLU 130 Ca 0.69 -3.28 0.00 0.00 0.02 0.00 0.00 54.97 52.39 1mp1 s GLU 130 Cb -0.20 -4.01 0.00 0.00 0.10 0.00 0.00 34.13 30.02 1mp1 s GLU 130 CO 0.62 -1.26 0.00 -0.89 0.02 0.00 0.00 175.26 173.75 1mp1 n ILE 131 N 2.35 -0.46 -1.57 -1.63 2.08 -1.26 -4.98 119.36 113.89 1mp1 n ILE 131 Ca 0.22 0.63 0.02 0.00 0.56 0.00 0.00 62.75 64.17 1mp1 n ILE 131 Cb 0.37 -1.02 -0.01 0.00 -0.75 0.00 0.00 39.64 38.23 1mp1 n ILE 131 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 1mp1 n LYS 132 N -4.02 -4.08 -3.80 0.38 5.02 -1.26 -5.03 118.16 105.38 1mp1 n LYS 132 Ca -0.06 3.18 -0.13 0.00 -2.02 0.00 0.00 58.31 59.28 1mp1 n LYS 132 Cb 0.60 -4.02 -0.10 0.00 -0.02 0.00 0.00 35.03 31.49 1mp1 n LYS 132 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1mp1 s GLN 133 N -5.33 0.46 0.00 1.97 1.03 -1.26 -5.01 119.66 111.52 1mp1 s GLN 133 Ca 0.00 0.01 0.06 0.00 0.04 0.00 0.00 55.36 55.47 1mp1 s GLN 133 Cb 0.00 0.21 0.37 0.00 0.03 0.00 0.00 33.01 33.62 1mp1 s GLN 133 CO 0.00 -0.10 0.84 -2.13 -2.54 0.00 0.00 175.29 171.36