#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 -1.36 -2.81 1.43 -0.00 -1.99 -3.38 115.15 107.05 1mp1 h HIS 25 Ca 0.00 0.10 -0.30 0.00 -0.00 0.00 0.00 60.37 60.17 1mp1 h HIS 25 Cb 0.00 0.70 -0.36 0.00 -0.00 0.00 0.00 27.41 27.76 1mp1 h HIS 25 CO 0.00 -0.41 -0.62 0.00 -0.00 0.00 0.00 177.93 176.90 1mp1 s MET 26 N -5.80 0.12 0.42 2.45 0.00 -1.26 -5.14 119.30 110.09 1mp1 s MET 26 Ca -0.14 0.40 -0.19 0.00 0.00 0.00 0.00 55.69 55.76 1mp1 s MET 26 Cb 0.15 -0.74 -0.10 0.00 0.00 0.00 0.00 34.83 34.14 1mp1 s MET 26 CO 0.67 -0.48 0.92 -1.14 0.00 0.00 0.00 175.02 174.99 1mp1 s GLN 27 N 2.32 4.14 0.00 3.16 0.74 -1.26 -4.58 119.66 124.18 1mp1 s GLN 27 Ca 0.04 1.01 0.00 0.00 0.05 0.00 0.00 55.36 56.46 1mp1 s GLN 27 Cb -0.14 -2.22 0.00 0.00 1.10 0.00 0.00 33.01 31.75 1mp1 s GLN 27 CO -0.09 -0.04 0.00 1.47 -0.55 0.00 0.00 175.29 176.08 1mp1 n LEU 28 N -0.75 0.00 -4.81 3.68 -0.00 -1.26 -5.12 117.00 108.74 1mp1 n LEU 28 Ca 0.06 0.00 -0.33 0.00 -0.00 0.00 0.00 56.01 55.74 1mp1 n LEU 28 Cb 0.54 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.89 1mp1 n LEU 28 CO 0.39 0.00 -0.23 -0.75 -0.00 0.00 0.00 177.39 176.81 1mp1 s LYS 29 N -1.52 3.16 0.04 1.47 2.20 -1.26 -5.00 119.74 118.83 1mp1 s LYS 29 Ca 0.00 -0.45 0.00 0.00 -0.36 0.00 0.00 55.97 55.16 1mp1 s LYS 29 Cb 0.00 -2.92 -0.00 0.00 -1.51 0.00 0.00 37.83 33.40 1mp1 s LYS 29 CO 0.00 0.65 0.00 1.97 -0.36 0.00 0.00 175.35 177.61 1mp1 n PHE 30 N 1.08 0.07 -1.88 4.03 1.16 -1.26 -4.96 117.46 115.71 1mp1 n PHE 30 Ca -0.12 -0.20 -0.04 0.00 -1.87 0.00 0.00 57.45 55.21 1mp1 n PHE 30 Cb 0.53 -0.02 0.03 0.00 -1.61 0.00 0.00 39.48 38.40 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 -2.86 -0.08 -0.08 1.98 0.00 -1.26 -5.04 120.51 113.17 1mp1 n ALA 31 Ca -0.02 -0.32 -0.09 0.00 0.00 0.00 0.00 53.44 53.01 1mp1 n ALA 31 Cb 0.05 0.03 -0.10 0.00 0.00 0.00 0.00 19.45 19.43 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 -1.38 1.21 0.32 0.00 1.02 -1.26 -4.33 120.64 116.23 1mp1 n GLU 32 Ca 0.03 0.04 0.18 0.00 -0.02 0.00 0.00 57.16 57.39 1mp1 n GLU 32 Cb 0.10 -1.35 0.98 0.00 -0.02 0.00 0.00 31.44 31.15 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 -2.91 0.07 -1.59 0.00 4.77 -1.26 -1.26 117.00 114.82 1mp1 n LEU 34 Ca -0.02 0.52 0.03 0.00 -0.03 0.00 0.00 56.01 56.50 1mp1 n LEU 34 Cb 0.22 -0.52 0.28 0.00 -2.33 0.00 0.00 43.42 41.07 1mp1 n LEU 34 CO 0.16 -0.37 0.76 -0.62 -1.33 0.00 0.00 177.39 175.99 1mp1 n GLU 35 N -1.58 3.70 0.00 3.23 1.02 0.27 -3.90 120.64 123.37 1mp1 n GLU 35 Ca 0.02 -2.34 0.12 0.00 -0.02 0.00 0.00 57.16 54.94 1mp1 n GLU 35 Cb 0.12 -2.06 0.30 0.00 -0.02 0.00 0.00 31.44 29.79 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 0.33 0.43 -1.15 3.49 4.76 -0.39 -5.05 118.16 120.58 1mp1 n LYS 36 Ca 0.23 -0.25 0.13 0.00 -2.87 0.00 0.00 58.31 55.56 1mp1 n LYS 36 Cb 1.01 -1.49 -0.05 0.00 -1.84 0.00 0.00 35.03 32.66 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 -1.07 -2.21 0.00 1.97 4.01 -1.25 -5.04 118.16 114.57 1mp1 n LYS 37 Ca 0.09 1.61 0.00 0.00 -0.51 0.00 0.00 58.31 59.50 1mp1 n LYS 37 Cb 0.34 -2.77 0.00 0.00 -0.51 0.00 0.00 35.03 32.10 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 -3.54 0.00 -2.92 -0.18 0.24 -1.26 -4.85 118.33 105.82 1mp1 n VAL 38 Ca -0.02 0.00 0.03 0.00 -2.04 0.00 0.00 64.34 62.31 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 1.59 -0.33 0.57 -1.34 -1.08 -1.26 -4.88 116.67 109.94 1mp1 s ASP 39 Ca 0.00 -0.08 0.27 0.00 -0.52 0.00 0.00 52.55 52.22 1mp1 s ASP 39 Cb 0.00 0.73 1.69 0.00 -1.46 0.00 0.00 42.92 43.89 1mp1 s ASP 39 CO 0.00 -0.05 2.21 0.24 0.52 0.00 0.00 175.17 178.10 1mp1 h MET 40 N 6.13 0.00 0.00 4.34 2.86 -1.71 0.38 114.93 126.93 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 1.21 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.87 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 -3.91 0.00 -0.02 1.22 2.88 -1.26 -3.13 113.62 109.39 1mp1 n SER 41 Ca -0.03 0.16 -0.02 0.00 -1.33 0.00 0.00 58.87 57.64 1mp1 n SER 41 Cb 0.11 -0.35 -0.02 0.00 -0.75 0.00 0.00 64.21 63.20 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 -1.35 0.71 -4.14 -1.46 4.76 0.72 -5.04 118.16 112.36 1mp1 n LYS 42 Ca 0.08 0.02 -0.29 0.00 -2.87 0.00 0.00 58.31 55.25 1mp1 n LYS 42 Cb 0.17 -1.08 -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 -2.08 3.98 -0.17 -0.18 0.11 0.98 -4.03 120.40 119.01 1mp1 s VAL 43 Ca -0.05 -1.11 -0.21 0.00 -2.93 0.00 0.00 61.98 57.69 1mp1 s VAL 43 Cb 0.01 -2.94 -0.03 0.00 -1.53 0.00 0.00 36.38 31.90 1mp1 s VAL 43 CO 0.09 0.04 0.61 0.20 -3.33 0.00 0.00 175.10 172.72 1mp1 s ASN 44 N -2.54 6.71 0.07 3.54 -0.87 0.13 -4.32 114.94 117.67 1mp1 s ASN 44 Ca 0.27 0.86 0.17 0.00 -1.57 0.00 0.00 52.86 52.59 1mp1 s ASN 44 Cb -0.11 -2.35 -0.12 0.00 -0.02 0.00 0.00 41.25 38.65 1mp1 s ASN 44 CO 0.19 -0.22 0.86 0.17 -2.57 0.00 0.00 177.10 175.53 1mp1 h LEU 45 N 7.83 0.00 -1.24 0.60 -0.00 -1.84 -3.34 115.31 117.32 1mp1 h LEU 45 Ca -0.34 0.00 0.04 0.00 -0.00 0.00 0.00 57.88 57.58 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 0.77 0.56 0.53 -0.33 -0.00 0.00 0.00 178.44 179.96 1mp1 h GLU 46 N 0.00 0.95 0.00 0.17 4.39 -1.94 0.50 114.58 118.65 1mp1 h GLU 46 Ca -0.15 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.49 1mp1 h GLU 46 Cb 1.56 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 30.00 1mp1 h GLU 46 CO 0.05 0.63 0.00 1.33 -1.16 0.00 0.00 179.01 179.85 1mp1 n VAL 47 N -4.45 0.64 0.39 3.13 0.24 -1.25 -1.07 118.33 115.95 1mp1 n VAL 47 Ca 0.11 0.16 0.04 0.00 -2.04 0.00 0.00 64.34 62.61 1mp1 n VAL 47 Cb 0.13 -0.91 -0.02 0.00 -1.47 0.00 0.00 33.84 31.56 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 -1.32 0.00 -0.07 1.34 2.08 0.15 -4.41 119.36 117.13 1mp1 n ILE 48 Ca 0.07 -0.36 -0.08 0.00 0.56 0.00 0.00 62.75 62.94 1mp1 n ILE 48 Cb 0.13 1.05 -0.01 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 0.52 0.19 0.00 0.38 1.63 0.70 1.51 116.57 121.49 1mp1 h LYS 49 Ca 0.00 -0.01 -0.12 0.00 -0.85 0.00 0.00 60.65 59.67 1mp1 h LYS 49 Cb 0.25 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.82 1mp1 h LYS 49 CO 0.00 0.13 -0.57 -1.00 -3.45 0.00 0.00 179.45 174.56 1mp1 h PRO 50 N 0.20 0.00 -0.12 1.90 0.13 -1.81 0.41 132.00 132.71 1mp1 h PRO 50 Ca 0.13 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.11 1mp1 h PRO 50 Cb 0.11 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.24 1mp1 h PRO 50 CO -0.14 0.57 -0.51 2.35 -0.23 0.00 0.00 178.00 180.04 1mp1 h TRP 51 N 0.00 0.74 0.07 1.56 7.01 -1.56 0.14 115.95 123.92 1mp1 h TRP 51 Ca -0.01 -0.32 -0.00 0.00 2.11 0.00 0.00 58.89 60.67 1mp1 h TRP 51 Cb 1.18 -0.12 0.00 0.00 -2.10 0.00 0.00 29.16 28.13 1mp1 h TRP 51 CO 0.00 1.10 -0.04 0.82 -2.79 0.00 0.00 178.44 177.53 1mp1 h ILE 52 N 0.18 1.21 -0.97 2.65 2.04 0.22 0.22 117.51 123.05 1mp1 h ILE 52 Ca -0.03 -1.34 0.07 0.00 1.00 0.00 0.00 64.86 64.56 1mp1 h ILE 52 Cb 1.14 2.03 -0.07 0.00 -0.74 0.00 0.00 36.82 39.18 1mp1 h ILE 52 CO 0.11 0.31 0.62 0.74 0.00 0.00 0.00 178.15 179.93 1mp1 h THR 53 N -0.75 1.04 -0.22 -0.27 2.02 -0.26 0.59 112.91 115.07 1mp1 h THR 53 Ca -0.01 -0.37 -0.20 0.00 0.77 0.00 0.00 66.41 66.60 1mp1 h THR 53 Cb 0.59 -0.14 0.00 0.00 -1.74 0.00 0.00 68.15 66.86 1mp1 h THR 53 CO 0.02 0.20 -0.65 0.50 0.37 0.00 0.00 175.52 175.96 1mp1 h LYS 54 N 1.09 0.79 -0.01 6.66 3.64 -0.74 -0.72 116.57 127.29 1mp1 h LYS 54 Ca 0.43 -0.56 -0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1mp1 h LYS 54 Cb 0.23 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.14 1mp1 h LYS 54 CO -0.19 1.19 0.00 0.00 -2.27 0.00 0.00 179.45 178.18 1mp1 h ARG 55 N 0.58 0.01 -0.41 1.90 2.47 0.68 0.38 114.38 119.99 1mp1 h ARG 55 Ca -0.01 -0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.70 1mp1 h ARG 55 Cb 1.26 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.56 1mp1 h ARG 55 CO 0.14 0.15 0.23 -0.39 0.56 0.00 0.00 179.97 180.65 1mp1 h VAL 56 N -0.13 1.15 -0.82 2.04 -1.51 0.12 0.71 116.25 117.81 1mp1 h VAL 56 Ca 0.00 -0.39 0.01 0.00 -1.23 0.00 0.00 66.70 65.09 1mp1 h VAL 56 Cb 0.14 0.66 -0.04 0.00 -2.13 0.00 0.00 31.29 29.92 1mp1 h VAL 56 CO -0.00 0.16 0.53 0.74 -1.23 0.00 0.00 177.57 177.77 1mp1 h THR 57 N 0.53 1.22 0.00 7.19 2.02 -0.94 -1.65 112.91 121.28 1mp1 h THR 57 Ca 0.15 -0.41 -0.13 0.00 0.77 0.00 0.00 66.41 66.78 1mp1 h THR 57 Cb 0.05 0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.46 1mp1 h THR 57 CO -0.02 0.21 -0.63 -0.33 0.37 0.00 0.00 175.52 175.12 1mp1 h GLU 58 N 1.11 0.00 -0.35 6.66 5.08 0.25 3.48 114.58 130.82 1mp1 h GLU 58 Ca 0.30 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.70 1mp1 h GLU 58 Cb -0.11 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.10 1mp1 h GLU 58 CO -0.06 0.63 0.11 0.82 -1.00 0.00 0.00 179.01 179.51 1mp1 h ILE 59 N 0.00 0.89 0.00 3.13 2.04 0.14 -3.31 117.51 120.40 1mp1 h ILE 59 Ca -0.01 -0.09 -0.43 0.00 1.00 0.00 0.00 64.86 65.33 1mp1 h ILE 59 Cb 1.15 0.61 -0.07 0.00 -0.74 0.00 0.00 36.82 37.78 1mp1 h ILE 59 CO 0.08 0.05 -2.49 0.00 0.00 0.00 0.00 178.15 175.79 1mp1 n LEU 60 N -5.03 2.21 0.00 1.44 -0.00 -0.97 -5.01 117.00 109.64 1mp1 n LEU 60 Ca 0.01 0.20 0.00 0.00 -0.00 0.00 0.00 56.01 56.22 1mp1 n LEU 60 Cb 0.13 -0.82 0.00 0.00 -0.00 0.00 0.00 43.42 42.73 1mp1 n LEU 60 CO 0.27 0.67 0.00 0.61 -0.00 0.00 0.00 177.39 178.94 1mp1 n GLY 61 N 1.59 1.04 3.23 1.47 0.00 1.15 -5.09 105.19 108.56 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 -1.18 1.40 -0.33 1.61 -0.12 -0.58 -4.83 117.98 113.95 1mp1 s PHE 62 Ca 0.00 -0.50 -0.29 0.00 -0.05 0.00 0.00 56.93 56.09 1mp1 s PHE 62 Cb 0.00 -0.75 -0.01 0.00 -0.63 0.00 0.00 43.02 41.63 1mp1 s PHE 62 CO 0.00 0.13 1.70 -2.00 -0.05 0.00 0.00 175.22 175.00 1mp1 s GLU 63 N -2.26 3.44 0.00 1.99 2.12 -1.26 -4.08 118.70 118.65 1mp1 s GLU 63 Ca 0.05 1.37 0.00 0.00 0.36 0.00 0.00 54.97 56.75 1mp1 s GLU 63 Cb -0.07 -4.14 0.00 0.00 0.26 0.00 0.00 34.13 30.17 1mp1 s GLU 63 CO 0.03 -1.73 0.00 -0.25 -0.54 0.00 0.00 175.26 172.77 1mp1 n ASP 64 N 9.76 0.00 0.00 -1.70 9.92 -1.26 -5.04 116.55 128.23 1mp1 n ASP 64 Ca 0.21 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.47 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 0.47 0.13 0.00 0.00 177.20 177.80 1mp1 n ASP 65 N 0.00 0.00 -0.05 -2.24 8.00 -1.26 -4.87 116.55 116.13 1mp1 n ASP 65 Ca 0.00 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.34 1mp1 n ASP 65 Cb 0.00 0.12 -0.06 0.00 -0.02 0.00 0.00 41.12 41.16 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 1.28 -0.20 2.53 3.04 -1.98 0.50 116.25 121.42 1mp1 h VAL 66 Ca 0.00 -1.85 -0.13 0.00 -1.01 0.00 0.00 66.70 63.71 1mp1 h VAL 66 Cb 0.00 1.83 0.00 0.00 -2.01 0.00 0.00 31.29 31.11 1mp1 h VAL 66 CO 0.00 0.59 -0.37 -0.37 -1.01 0.00 0.00 177.57 176.41 1mp1 h VAL 67 N 0.58 1.33 -0.01 1.51 -1.51 -1.92 -1.88 116.25 114.34 1mp1 h VAL 67 Ca -0.02 -1.59 -0.00 0.00 -1.23 0.00 0.00 66.70 63.85 1mp1 h VAL 67 Cb 1.28 1.85 -0.00 0.00 -2.13 0.00 0.00 31.29 32.29 1mp1 h VAL 67 CO 0.14 0.49 0.01 0.40 -1.23 0.00 0.00 177.57 177.38 1mp1 h ILE 68 N 0.28 1.06 -0.86 7.19 2.04 -1.89 -1.92 117.51 123.42 1mp1 h ILE 68 Ca 0.01 -0.19 0.10 0.00 1.00 0.00 0.00 64.86 65.78 1mp1 h ILE 68 Cb 0.97 1.16 -0.08 0.00 -0.74 0.00 0.00 36.82 38.13 1mp1 h ILE 68 CO 0.08 0.05 0.50 -0.33 0.00 0.00 0.00 178.15 178.45 1mp1 h GLU 69 N -0.05 0.80 -0.39 2.37 5.08 -0.90 1.03 114.58 122.52 1mp1 h GLU 69 Ca 0.01 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1mp1 h GLU 69 Cb 0.08 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 1mp1 h GLU 69 CO -0.00 0.53 0.18 0.74 -1.00 0.00 0.00 179.01 179.46 1mp1 h PHE 70 N 0.83 0.32 -0.15 4.33 0.04 -0.89 2.16 116.94 123.58 1mp1 h PHE 70 Ca 0.42 0.02 -0.15 0.00 2.80 0.00 0.00 57.97 61.05 1mp1 h PHE 70 Cb 0.39 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.46 1mp1 h PHE 70 CO -0.05 0.16 -0.49 0.82 -0.60 0.00 0.00 178.31 178.14 1mp1 h ILE 71 N 0.36 1.34 -0.08 -0.55 2.04 -0.50 0.17 117.51 120.30 1mp1 h ILE 71 Ca 0.17 -1.76 -0.01 0.00 1.00 0.00 0.00 64.86 64.26 1mp1 h ILE 71 Cb 0.10 2.04 -0.00 0.00 -0.74 0.00 0.00 36.82 38.21 1mp1 h ILE 71 CO -0.14 0.54 0.03 0.15 0.00 0.00 0.00 178.15 178.73 1mp1 h PHE 72 N 0.25 0.13 -0.63 1.37 3.04 0.15 1.81 116.94 123.05 1mp1 h PHE 72 Ca -0.02 -0.01 -0.06 0.00 3.98 0.00 0.00 57.97 61.86 1mp1 h PHE 72 Cb 1.12 -0.04 -0.03 0.00 2.56 0.00 0.00 35.95 39.57 1mp1 h PHE 72 CO 0.10 0.27 0.14 -0.91 -2.02 0.00 0.00 178.31 175.89 1mp1 h ASN 73 N -0.05 0.94 0.03 0.41 2.35 0.35 0.33 115.58 119.93 1mp1 h ASN 73 Ca 0.03 -0.19 -0.21 0.00 -0.55 0.00 0.00 56.30 55.37 1mp1 h ASN 73 Cb 0.20 -0.25 0.01 0.00 0.05 0.00 0.00 38.32 38.33 1mp1 h ASN 73 CO -0.00 0.91 -0.79 1.56 -1.65 0.00 0.00 177.43 177.46 1mp1 h GLN 74 N 0.95 0.64 0.00 0.81 7.50 -0.71 -2.75 115.11 121.54 1mp1 h GLN 74 Ca 0.20 -0.54 0.00 0.00 0.50 0.00 0.00 58.65 58.81 1mp1 h GLN 74 Cb 0.35 0.12 0.00 0.00 0.05 0.00 0.00 27.48 28.00 1mp1 h GLN 74 CO 0.00 1.16 0.00 1.28 -1.50 0.00 0.00 178.83 179.77 1mp1 n LEU 75 N -3.89 0.00 -0.05 1.46 4.77 0.61 -2.71 117.00 117.20 1mp1 n LEU 75 Ca -0.07 0.17 0.14 0.00 -0.03 0.00 0.00 56.01 56.22 1mp1 n LEU 75 Cb 0.75 -0.17 0.61 0.00 -2.33 0.00 0.00 43.42 42.29 1mp1 n LEU 75 CO 0.51 -0.00 0.89 -0.62 -1.33 0.00 0.00 177.39 176.84 1mp1 n GLU 76 N -1.17 0.39 -1.47 3.23 1.02 0.11 -4.84 120.64 117.92 1mp1 n GLU 76 Ca 0.18 -0.09 -0.05 0.00 -0.02 0.00 0.00 57.16 57.18 1mp1 n GLU 76 Cb 0.18 -1.50 0.02 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 -1.22 0.00 0.06 2.62 0.24 -1.10 -5.03 118.33 113.89 1mp1 n VAL 77 Ca 0.12 -0.49 0.10 0.00 -2.04 0.00 0.00 64.34 62.03 1mp1 n VAL 77 Cb 0.29 -0.91 -0.16 0.00 -1.47 0.00 0.00 33.84 31.59 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 -1.35 0.61 -3.43 7.34 4.01 -1.26 -4.42 118.16 119.66 1mp1 n LYS 78 Ca 0.04 -0.17 -0.27 0.00 -0.51 0.00 0.00 58.31 57.40 1mp1 n LYS 78 Cb 0.16 -1.49 -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 -4.27 2.48 0.57 4.39 0.02 -1.26 -2.77 114.94 114.10 1mp1 s ASN 79 Ca -0.06 -2.23 -0.16 0.00 -1.02 0.00 0.00 52.86 49.38 1mp1 s ASN 79 Cb 0.13 -0.26 -0.05 0.00 0.02 0.00 0.00 41.25 41.10 1mp1 s ASN 79 CO 0.85 -0.28 1.05 -2.16 0.02 0.00 0.00 177.10 176.58 1mp1 s PRO 80 N 0.97 3.46 -0.86 -0.60 0.04 -1.26 -5.00 135.00 131.75 1mp1 s PRO 80 Ca 0.20 1.19 -0.09 0.00 0.04 0.00 0.00 61.00 62.35 1mp1 s PRO 80 Cb -0.18 -2.05 0.22 0.00 0.04 0.00 0.00 34.50 32.53 1mp1 s PRO 80 CO -0.02 -0.70 0.78 0.34 0.04 0.00 0.00 177.00 177.44 1mp1 s ASP 81 N -2.72 6.46 0.60 6.66 2.15 -1.26 -4.84 116.67 123.72 1mp1 s ASP 81 Ca 0.63 -3.08 0.29 0.00 0.43 0.00 0.00 52.55 50.83 1mp1 s ASP 81 Cb -0.15 -2.09 1.19 0.00 -0.30 0.00 0.00 42.92 41.56 1mp1 s ASP 81 CO 0.34 -0.41 1.54 0.77 -0.17 0.00 0.00 175.17 177.24 1mp1 h SER 82 N 7.12 0.00 -0.11 -0.34 4.64 -1.95 1.09 113.55 124.00 1mp1 h SER 82 Ca 0.11 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1mp1 h SER 82 Cb 0.95 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.04 1mp1 h SER 82 CO 0.81 0.00 0.05 0.11 -0.87 0.00 0.00 176.83 176.94 1mp1 h LYS 83 N 0.00 0.16 -0.15 4.77 1.79 -1.90 -0.10 116.57 121.15 1mp1 h LYS 83 Ca 0.43 -0.02 -0.13 0.00 -2.18 0.00 0.00 60.65 58.75 1mp1 h LYS 83 Cb 2.36 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 32.98 1mp1 h LYS 83 CO -0.00 0.22 -0.47 0.52 -1.08 0.00 0.00 179.45 178.64 1mp1 h MET 84 N 0.05 0.37 0.27 3.15 2.86 0.78 -0.35 114.93 122.06 1mp1 h MET 84 Ca 0.04 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.46 1mp1 h MET 84 Cb 0.12 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.79 1mp1 h MET 84 CO -0.00 0.76 -0.13 1.98 1.06 0.00 0.00 176.91 180.58 1mp1 h MET 85 N 0.30 -0.35 -0.20 1.72 -1.53 -0.99 0.49 114.93 114.37 1mp1 h MET 85 Ca 0.02 0.02 -0.11 0.00 -3.44 0.00 0.00 59.70 56.19 1mp1 h MET 85 Cb 0.94 0.08 -0.01 0.00 -0.55 0.00 0.00 31.60 32.05 1mp1 h MET 85 CO 0.08 -0.17 -0.37 0.37 0.14 0.00 0.00 176.91 176.96 1mp1 h GLN 86 N -0.46 0.43 -0.56 0.39 4.15 -1.02 0.41 115.11 118.45 1mp1 h GLN 86 Ca -0.04 -0.20 -0.09 0.00 0.77 0.00 0.00 58.65 59.09 1mp1 h GLN 86 Cb 0.34 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.01 1mp1 h GLN 86 CO 0.06 0.74 -0.01 0.82 -1.93 0.00 0.00 178.83 178.51 1mp1 h ILE 87 N 0.36 1.27 -0.07 2.39 2.04 -0.85 0.81 117.51 123.45 1mp1 h ILE 87 Ca 0.04 -1.13 -0.25 0.00 1.00 0.00 0.00 64.86 64.52 1mp1 h ILE 87 Cb 0.81 0.88 0.02 0.00 -0.74 0.00 0.00 36.82 37.79 1mp1 h ILE 87 CO 0.07 0.41 -0.92 0.78 0.00 0.00 0.00 178.15 178.48 1mp1 h ASN 88 N 0.87 0.93 -0.62 1.72 2.35 0.24 -3.17 115.58 117.91 1mp1 h ASN 88 Ca 0.16 -0.69 0.03 0.00 -0.55 0.00 0.00 56.30 55.24 1mp1 h ASN 88 Cb 0.55 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.60 1mp1 h ASN 88 CO 0.03 1.49 0.38 -0.07 -1.65 0.00 0.00 177.43 177.61 1mp1 h LEU 89 N 0.46 0.62 -2.49 1.61 3.38 -0.02 0.71 115.31 119.60 1mp1 h LEU 89 Ca -0.10 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.89 1mp1 h LEU 89 Cb 1.56 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 42.18 1mp1 h LEU 89 CO 0.19 0.44 0.13 0.74 0.09 0.00 0.00 178.44 180.02 1mp1 h THR 90 N 0.75 0.24 0.00 0.22 2.02 -0.83 1.53 112.91 116.84 1mp1 h THR 90 Ca 0.25 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.39 1mp1 h THR 90 Cb 0.01 0.89 -0.00 0.00 -1.74 0.00 0.00 68.15 67.30 1mp1 h THR 90 CO -0.10 0.00 -0.17 1.23 0.37 0.00 0.00 175.52 176.86 1mp1 h GLY 91 N 0.00 0.00 0.00 2.16 0.00 -0.83 -3.34 103.07 101.07 1mp1 h GLY 91 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.27 1mp1 h GLY 91 CO -0.00 0.00 -1.32 0.69 0.00 0.00 0.00 176.54 175.91 1mp1 n PHE 92 N -3.41 0.00 -0.16 5.60 3.01 0.91 -5.05 117.46 118.35 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 0.35 -0.21 0.00 0.00 -0.01 0.00 0.00 39.48 39.61 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 -2.89 0.00 0.04 4.37 4.77 0.49 -4.94 117.00 118.84 1mp1 n LEU 93 Ca -0.11 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 55.99 1mp1 n LEU 93 Cb 0.60 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.68 1mp1 n LEU 93 CO 0.04 -1.11 -0.10 0.59 -1.33 0.00 0.00 177.39 175.47 1mp1 n ASN 94 N -2.38 0.59 0.00 -1.43 3.02 -1.26 -4.83 115.26 108.97 1mp1 n ASN 94 Ca 0.00 -0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1mp1 n ASN 94 Cb 0.00 0.86 0.00 0.00 -0.61 0.00 0.00 39.78 40.03 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 1.29 3.33 0.11 7.41 0.00 -1.26 -4.83 105.19 111.24 1mp1 n GLY 95 Ca 0.00 -0.92 -0.06 0.00 0.00 0.00 0.00 46.02 45.04 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 0.09 -0.10 1.61 6.56 -1.98 -3.01 116.57 119.74 1mp1 h LYS 96 Ca 0.00 -0.10 -0.08 0.00 -1.06 0.00 0.00 60.65 59.41 1mp1 h LYS 96 Cb 0.00 0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 31.68 1mp1 h LYS 96 CO 0.00 0.88 -0.28 -0.91 -2.06 0.00 0.00 179.45 177.08 1mp1 h ASN 97 N 0.05 0.19 -0.50 0.86 4.21 -1.96 -0.98 115.58 117.45 1mp1 h ASN 97 Ca -0.03 -0.06 -0.08 0.00 1.21 0.00 0.00 56.30 57.35 1mp1 h ASN 97 Cb 1.47 -0.05 -0.02 0.00 -1.12 0.00 0.00 38.32 38.60 1mp1 h ASN 97 CO 0.12 0.47 0.01 0.00 -1.29 0.00 0.00 177.43 176.74 1mp1 h ALA 98 N 1.54 0.99 -0.29 -0.83 0.00 -1.87 1.01 119.26 119.82 1mp1 h ALA 98 Ca 0.03 -0.28 -0.18 0.00 0.00 0.00 0.00 54.91 54.48 1mp1 h ALA 98 Cb 0.59 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1mp1 h ALA 98 CO 0.04 0.62 -0.51 0.00 0.00 0.00 0.00 179.25 179.40 1mp1 h ARG 99 N 0.85 0.86 -0.11 0.00 3.08 -1.37 -1.20 114.38 116.49 1mp1 h ARG 99 Ca 0.16 -0.54 -0.20 0.00 0.07 0.00 0.00 59.98 59.48 1mp1 h ARG 99 Cb 0.49 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.60 1mp1 h ARG 99 CO 0.02 1.17 -0.74 0.93 -1.07 0.00 0.00 179.97 180.29 1mp1 h GLU 100 N 0.64 0.55 -0.08 0.04 5.08 -0.92 -1.22 114.58 118.67 1mp1 h GLU 100 Ca 0.02 -0.45 -0.01 0.00 -1.00 0.00 0.00 59.36 57.93 1mp1 h GLU 100 Cb 1.12 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 1mp1 h GLU 100 CO 0.12 1.07 0.02 0.35 -1.00 0.00 0.00 179.01 179.56 1mp1 h PHE 101 N 0.38 0.13 -0.15 4.33 3.04 0.11 -2.76 116.94 122.02 1mp1 h PHE 101 Ca -0.04 -0.02 -0.09 0.00 3.98 0.00 0.00 57.97 61.80 1mp1 h PHE 101 Cb 1.33 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.79 1mp1 h PHE 101 CO 0.06 0.31 -0.32 0.52 -2.02 0.00 0.00 178.31 176.86 1mp1 h MET 102 N -0.09 0.29 -0.31 1.11 2.86 -1.26 -1.18 114.93 116.36 1mp1 h MET 102 Ca 0.02 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1mp1 h MET 102 Cb 0.25 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.90 1mp1 h MET 102 CO 0.00 0.59 0.00 0.41 1.06 0.00 0.00 176.91 178.97 1mp1 n GLY 103 N -0.36 -0.21 0.00 8.32 0.00 -0.46 -0.16 105.19 112.31 1mp1 n GLY 103 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.34 2.32 -0.08 1.61 1.02 -0.79 -4.62 120.64 119.76 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 0.08 -0.79 -0.14 0.00 -0.02 0.00 0.00 31.44 30.57 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 -1.36 1.89 -0.23 -4.62 -0.00 -0.51 -2.99 117.00 109.18 1mp1 n LEU 105 Ca 0.00 0.03 -0.06 0.00 -0.00 0.00 0.00 56.01 55.98 1mp1 n LEU 105 Cb 0.28 -0.46 0.04 0.00 -0.00 0.00 0.00 43.42 43.29 1mp1 n LEU 105 CO 0.00 0.74 1.09 -0.25 -0.00 0.00 0.00 177.39 178.97 1mp1 h TRP 106 N 0.01 0.85 0.00 1.96 2.91 -0.78 -1.88 115.95 119.03 1mp1 h TRP 106 Ca -0.51 -0.01 -0.12 0.00 1.13 0.00 0.00 58.89 59.38 1mp1 h TRP 106 Cb 2.03 -0.28 -0.02 0.00 -0.51 0.00 0.00 29.16 30.39 1mp1 h TRP 106 CO 0.03 0.59 -0.58 -1.00 -1.03 0.00 0.00 178.44 176.45 1mp1 h PRO 107 N 0.86 0.00 -0.70 2.65 0.13 -1.74 -2.89 132.00 130.32 1mp1 h PRO 107 Ca 0.23 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.39 1mp1 h PRO 107 Cb 0.01 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.09 1mp1 h PRO 107 CO -0.04 0.58 0.43 1.25 -0.23 0.00 0.00 178.00 179.98 1mp1 h LEU 108 N 0.00 0.69 -0.67 1.56 5.85 -1.26 -0.76 115.31 120.72 1mp1 h LEU 108 Ca -0.01 0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.58 1mp1 h LEU 108 Cb 1.19 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.07 1mp1 h LEU 108 CO 0.08 0.47 -0.60 -0.07 -0.34 0.00 0.00 178.44 177.97 1mp1 h LEU 109 N 0.82 0.25 -0.58 2.25 3.38 -1.38 -1.04 115.31 119.01 1mp1 h LEU 109 Ca 0.29 -0.14 0.09 0.00 0.09 0.00 0.00 57.88 58.20 1mp1 h LEU 109 Cb 0.06 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 40.67 1mp1 h LEU 109 CO -0.12 0.79 0.21 -0.07 0.09 0.00 0.00 178.44 179.34 1mp1 h LEU 110 N 0.16 0.21 -0.13 1.67 4.07 -0.95 1.64 115.31 121.98 1mp1 h LEU 110 Ca -0.01 0.07 -0.22 0.00 0.08 0.00 0.00 57.88 57.81 1mp1 h LEU 110 Cb 1.10 0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.88 1mp1 h LEU 110 CO 0.09 0.13 -0.99 -1.28 -1.08 0.00 0.00 178.44 175.32 1mp1 h SER 111 N 0.39 0.23 -0.21 -0.43 0.87 -1.23 -3.13 113.55 110.04 1mp1 h SER 111 Ca 0.29 -0.21 -0.03 0.00 -1.23 0.00 0.00 61.79 60.61 1mp1 h SER 111 Cb 0.34 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.22 1mp1 h SER 111 CO -0.29 1.08 0.00 0.00 -0.53 0.00 0.00 176.83 177.09 1mp1 h ALA 112 N 0.90 0.28 0.00 6.23 0.00 0.19 -1.92 119.26 124.94 1mp1 h ALA 112 Ca -0.06 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1mp1 h ALA 112 Cb 1.67 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1mp1 h ALA 112 CO 0.15 -0.00 0.00 -0.56 0.00 0.00 0.00 179.25 178.84 1mp1 h GLN 113 N 0.14 0.00 0.00 0.00 3.07 0.23 0.38 115.11 118.93 1mp1 h GLN 113 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.80 1mp1 h GLN 113 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.95 1mp1 h GLN 113 CO 0.01 0.00 -0.47 0.39 0.09 0.00 0.00 178.83 178.85 1mp1 n GLU 114 N -2.57 0.06 -0.11 0.06 -0.58 -0.75 -4.82 120.64 111.94 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 0.07 -1.54 0.00 0.00 -0.57 0.00 0.00 31.44 29.41 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 -1.62 0.00 -0.05 1.62 2.85 0.14 -5.06 115.26 113.14 1mp1 n ASN 115 Ca 0.05 -0.27 -0.07 0.00 -0.11 0.00 0.00 54.58 54.18 1mp1 n ASN 115 Cb 0.36 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 41.33 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 -0.44 0.58 0.89 -1.44 0.00 -1.26 -4.51 119.36 113.17 1mp1 n ILE 116 Ca 0.00 -0.21 0.06 0.00 0.00 0.00 0.00 62.75 62.60 1mp1 n ILE 116 Cb 0.00 -0.91 0.18 0.00 0.00 0.00 0.00 39.64 38.91 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 -2.84 2.45 -3.63 1.51 0.00 -1.26 -4.89 120.51 111.84 1mp1 n ALA 117 Ca -0.18 -0.62 -0.24 0.00 0.00 0.00 0.00 53.44 52.39 1mp1 n ALA 117 Cb 0.69 -0.98 0.07 0.00 0.00 0.00 0.00 19.45 19.22 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 1.08 -0.53 3.29 0.00 0.00 -1.25 -4.39 105.19 103.40 1mp1 n GLY 118 Ca 0.13 0.24 -0.31 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 -3.32 2.09 0.46 -0.61 1.09 -1.24 0.18 121.20 119.85 1mp1 s ILE 119 Ca 0.56 -1.07 -0.21 0.00 -1.10 0.00 0.00 60.65 58.83 1mp1 s ILE 119 Cb -0.25 -1.74 -0.09 0.00 -1.06 0.00 0.00 42.46 39.32 1mp1 s ILE 119 CO 0.74 0.58 1.04 -2.16 -0.10 0.00 0.00 174.94 175.04 1mp1 s PRO 120 N -0.38 3.89 0.45 2.79 0.04 -1.26 -4.25 135.00 136.28 1mp1 s PRO 120 Ca 0.03 1.40 0.30 0.00 0.04 0.00 0.00 61.00 62.77 1mp1 s PRO 120 Cb -0.12 -2.20 1.64 0.00 0.04 0.00 0.00 34.50 33.85 1mp1 s PRO 120 CO 0.01 -0.36 1.92 0.66 0.04 0.00 0.00 177.00 179.27 1mp1 h SER 121 N 1.79 0.00 -0.02 6.66 4.64 -1.88 0.24 113.55 124.99 1mp1 h SER 121 Ca -0.49 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.83 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 0.60 0.00 0.01 0.00 -0.87 0.00 0.00 176.83 176.57 1mp1 h ALA 122 N 1.97 1.89 0.00 5.18 0.00 -1.95 -1.66 119.26 124.69 1mp1 h ALA 122 Ca 0.00 -0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.52 1mp1 h ALA 122 Cb 0.02 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.75 1mp1 h ALA 122 CO 0.00 -0.02 -2.46 1.19 0.00 0.00 0.00 179.25 177.96 1mp1 n PHE 123 N -4.34 0.02 0.01 0.00 3.72 0.04 -4.09 117.46 112.83 1mp1 n PHE 123 Ca -0.03 0.01 -0.01 0.00 -0.05 0.00 0.00 57.45 57.37 1mp1 n PHE 123 Cb 0.11 -1.00 -0.01 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 0.00 -0.11 -0.82 4.37 3.38 -1.18 0.25 115.31 121.20 1mp1 h LEU 124 Ca -0.57 0.01 0.16 0.00 0.09 0.00 0.00 57.88 57.57 1mp1 h LEU 124 Cb 1.95 0.04 -0.15 0.00 0.09 0.00 0.00 40.66 42.59 1mp1 h LEU 124 CO -0.07 -0.04 -0.22 -0.08 0.09 0.00 0.00 178.44 178.11 1mp1 h GLU 125 N -0.06 -0.01 0.00 1.13 4.57 -1.57 -2.64 114.58 115.99 1mp1 h GLU 125 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1mp1 h GLU 125 Cb 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.65 1mp1 h GLU 125 CO -0.01 -0.01 0.00 1.28 -1.18 0.00 0.00 179.01 179.09 1mp1 n LEU 126 N -5.53 0.00 -4.58 1.64 4.77 -0.97 -4.54 117.00 107.78 1mp1 n LEU 126 Ca 0.11 0.54 -0.53 0.00 -0.03 0.00 0.00 56.01 56.10 1mp1 n LEU 126 Cb 0.41 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 1mp1 n LEU 126 CO -0.04 -0.04 0.87 0.29 -1.33 0.00 0.00 177.39 177.14 1mp1 n LYS 127 N -0.80 0.99 -0.75 3.23 4.76 0.85 -4.72 118.16 121.72 1mp1 n LYS 127 Ca 0.00 0.36 -0.23 0.00 -2.87 0.00 0.00 58.31 55.57 1mp1 n LYS 127 Cb 0.00 -1.98 -0.02 0.00 -1.84 0.00 0.00 35.03 31.19 1mp1 n LYS 127 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1mp1 n LYS 128 N 2.49 2.06 -1.11 1.97 4.01 -1.26 -4.68 118.16 121.64 1mp1 n LYS 128 Ca 0.19 -1.47 -0.22 0.00 -0.51 0.00 0.00 58.31 56.31 1mp1 n LYS 128 Cb 0.17 -2.46 -0.12 0.00 -0.51 0.00 0.00 35.03 32.11 1mp1 n LYS 128 CO 0.00 0.00 0.00 -1.91 -1.11 0.00 0.00 177.40 174.38 1mp1 n GLU 129 N 4.29 2.61 -1.70 1.97 0.00 -1.26 -4.82 120.64 121.72 1mp1 n GLU 129 Ca 0.44 -1.43 0.00 0.00 0.00 0.00 0.00 57.16 56.17 1mp1 n GLU 129 Cb 0.14 -2.28 0.00 0.00 0.00 0.00 0.00 31.44 29.30 1mp1 n GLU 129 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1mp1 n GLU 130 N 2.86 -4.75 -3.26 5.31 4.07 -1.26 -4.90 120.64 118.71 1mp1 n GLU 130 Ca 0.56 3.43 -0.38 0.00 -0.06 0.00 0.00 57.16 60.70 1mp1 n GLU 130 Cb 0.68 -3.77 -0.06 0.00 -0.06 0.00 0.00 31.44 28.23 1mp1 n GLU 130 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 1mp1 s ILE 131 N -1.86 5.16 0.00 6.31 1.10 -1.26 -4.84 121.20 125.81 1mp1 s ILE 131 Ca 0.00 1.03 0.00 0.00 -0.51 0.00 0.00 60.65 61.17 1mp1 s ILE 131 Cb 0.00 -3.85 0.00 0.00 0.15 0.00 0.00 42.46 38.76 1mp1 s ILE 131 CO 0.00 0.30 0.00 0.29 -2.11 0.00 0.00 174.94 173.42 1mp1 n LYS 132 N 3.80 0.00 -3.49 3.50 4.76 -1.26 -5.16 118.16 120.31 1mp1 n LYS 132 Ca -0.06 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.28 1mp1 n LYS 132 Cb 0.51 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.68 1mp1 n LYS 132 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 1mp1 s GLN 133 N 0.00 0.92 0.00 1.97 -2.07 -1.26 -5.29 119.66 113.93 1mp1 s GLN 133 Ca 0.00 -0.25 0.00 0.00 -1.82 0.00 0.00 55.36 53.29 1mp1 s GLN 133 Cb 0.00 0.42 0.00 0.00 -1.09 0.00 0.00 33.01 32.34 1mp1 s GLN 133 CO 0.00 -0.38 0.00 -2.13 -1.32 0.00 0.00 175.29 171.46