#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 -3.63 1.43 -0.00 -1.26 -4.59 115.22 107.16 1mp1 n HIS 25 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.65 1mp1 n HIS 25 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 29.99 29.92 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 0.34 -0.02 -0.41 0.00 -1.26 -5.00 119.30 112.95 1mp1 s MET 26 Ca 0.00 0.34 0.05 0.00 0.00 0.00 0.00 55.69 56.08 1mp1 s MET 26 Cb 0.00 0.17 -0.01 0.00 0.00 0.00 0.00 34.83 34.98 1mp1 s MET 26 CO 0.00 -0.05 -0.16 -0.65 0.00 0.00 0.00 175.02 174.16 1mp1 s GLN 27 N -0.06 1.33 0.00 3.16 -1.52 -1.26 -4.71 119.66 116.59 1mp1 s GLN 27 Ca 0.04 -0.56 0.00 0.00 -1.95 0.00 0.00 55.36 52.89 1mp1 s GLN 27 Cb -0.04 -1.27 0.00 0.00 -0.22 0.00 0.00 33.01 31.48 1mp1 s GLN 27 CO -0.09 0.33 0.00 1.47 -0.25 0.00 0.00 175.29 176.75 1mp1 n LEU 28 N 2.75 0.00 -4.88 2.90 -0.00 -1.26 -5.12 117.00 111.39 1mp1 n LEU 28 Ca -0.15 0.00 -0.25 0.00 -0.00 0.00 0.00 56.01 55.61 1mp1 n LEU 28 Cb 0.54 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.92 1mp1 n LEU 28 CO 0.24 0.00 -0.14 -0.75 -0.00 0.00 0.00 177.39 176.74 1mp1 s LYS 29 N -1.85 3.16 0.03 1.47 2.20 -1.26 -4.92 119.74 118.57 1mp1 s LYS 29 Ca 0.00 -0.80 0.00 0.00 -0.36 0.00 0.00 55.97 54.81 1mp1 s LYS 29 Cb 0.00 -2.77 -0.00 0.00 -1.51 0.00 0.00 37.83 33.55 1mp1 s LYS 29 CO 0.00 0.47 0.00 1.97 -0.36 0.00 0.00 175.35 177.43 1mp1 n PHE 30 N -0.71 0.07 -0.86 4.03 1.16 -1.26 -4.88 117.46 115.01 1mp1 n PHE 30 Ca -0.08 -0.16 0.00 0.00 -1.87 0.00 0.00 57.45 55.34 1mp1 n PHE 30 Cb 0.55 -0.02 0.00 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 -2.90 0.00 -0.10 1.98 0.00 -1.26 -5.05 120.51 113.19 1mp1 n ALA 31 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.24 1mp1 n ALA 31 Cb 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.41 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 -0.99 0.43 0.12 0.00 0.28 -1.26 -4.38 120.64 114.84 1mp1 n GLU 32 Ca 0.00 0.16 0.19 0.00 -0.16 0.00 0.00 57.16 57.34 1mp1 n GLU 32 Cb 0.00 -1.26 0.62 0.00 1.43 0.00 0.00 31.44 32.23 1mp1 n GLU 32 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1mp1 h LEU 34 N 0.00 0.00 -3.30 0.00 3.38 -1.88 0.11 115.31 113.61 1mp1 h LEU 34 Ca 0.19 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.83 1mp1 h LEU 34 Cb 1.46 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 42.05 1mp1 h LEU 34 CO -0.00 0.00 0.41 -0.62 0.09 0.00 0.00 178.44 178.32 1mp1 n GLU 35 N -2.74 1.79 0.00 1.13 1.02 0.44 -3.75 120.64 118.53 1mp1 n GLU 35 Ca -0.02 -1.69 0.08 0.00 -0.02 0.00 0.00 57.16 55.50 1mp1 n GLU 35 Cb 0.24 -1.66 -0.01 0.00 -0.02 0.00 0.00 31.44 29.99 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 1.69 -1.10 3.49 4.76 0.37 -5.09 118.16 122.17 1mp1 n LYS 36 Ca 0.33 -0.76 0.13 0.00 -2.87 0.00 0.00 58.31 55.14 1mp1 n LYS 36 Cb 0.87 -1.27 -0.04 0.00 -1.84 0.00 0.00 35.03 32.74 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 -0.20 -2.08 -0.00 1.97 4.01 -1.25 -5.04 118.16 115.58 1mp1 n LYS 37 Ca 0.06 1.50 0.00 0.00 -0.51 0.00 0.00 58.31 59.37 1mp1 n LYS 37 Cb 0.33 -2.61 0.00 0.00 -0.51 0.00 0.00 35.03 32.24 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 -3.41 0.00 -3.06 -0.18 0.24 -1.26 -4.84 118.33 105.82 1mp1 n VAL 38 Ca -0.02 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.33 1mp1 n VAL 38 Cb 0.62 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.99 1mp1 n VAL 38 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1mp1 s ASP 39 N 1.67 -0.20 0.56 -1.34 -1.08 -1.26 -4.90 116.67 110.13 1mp1 s ASP 39 Ca 0.00 -0.00 0.33 0.00 -0.52 0.00 0.00 52.55 52.35 1mp1 s ASP 39 Cb 0.00 0.94 1.68 0.00 -1.46 0.00 0.00 42.92 44.07 1mp1 s ASP 39 CO 0.00 -0.03 2.13 0.24 0.52 0.00 0.00 175.17 178.03 1mp1 h MET 40 N 6.71 0.00 0.00 4.34 2.86 -1.70 0.95 114.93 128.09 1mp1 h MET 40 Ca -0.09 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1mp1 h MET 40 Cb 1.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.85 1mp1 h MET 40 CO -0.13 0.06 0.00 0.45 1.06 0.00 0.00 176.91 178.36 1mp1 n SER 41 N -3.42 0.00 -0.02 1.22 2.88 -1.26 -3.18 113.62 109.84 1mp1 n SER 41 Ca -0.02 0.12 -0.03 0.00 -1.33 0.00 0.00 58.87 57.62 1mp1 n SER 41 Cb 0.21 -0.34 -0.02 0.00 -0.75 0.00 0.00 64.21 63.30 1mp1 n SER 41 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1mp1 n LYS 42 N -1.34 0.74 -4.18 -1.46 4.76 -0.06 -5.04 118.16 111.58 1mp1 n LYS 42 Ca 0.08 0.02 -0.27 0.00 -2.87 0.00 0.00 58.31 55.27 1mp1 n LYS 42 Cb 0.18 -1.09 -0.07 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 -2.09 3.87 -0.20 -0.18 0.11 0.13 -4.06 120.40 117.98 1mp1 s VAL 43 Ca -0.05 -1.30 -0.18 0.00 -2.93 0.00 0.00 61.98 57.52 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 0.11 -0.07 0.51 0.20 -3.33 0.00 0.00 175.10 172.52 1mp1 s ASN 44 N -2.84 6.56 0.11 3.54 -0.87 0.17 -4.36 114.94 117.25 1mp1 s ASN 44 Ca 0.27 0.67 0.18 0.00 -1.57 0.00 0.00 52.86 52.42 1mp1 s ASN 44 Cb -0.10 -2.29 -0.08 0.00 -0.02 0.00 0.00 41.25 38.76 1mp1 s ASN 44 CO 0.19 -0.17 0.93 0.17 -2.57 0.00 0.00 177.10 175.65 1mp1 h LEU 45 N 7.87 0.00 -1.09 0.60 -0.00 -1.85 -3.34 115.31 117.50 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 1.16 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 41.76 1mp1 h LEU 45 CO 0.74 0.43 0.62 -0.33 -0.00 0.00 0.00 178.44 179.89 1mp1 h GLU 46 N 0.00 1.13 0.00 0.17 4.39 -1.94 0.45 114.58 118.79 1mp1 h GLU 46 Ca -0.11 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.52 1mp1 h GLU 46 Cb 1.43 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 1mp1 h GLU 46 CO 0.04 0.75 0.00 1.33 -1.16 0.00 0.00 179.01 179.96 1mp1 n VAL 47 N -4.45 0.83 0.60 3.13 0.24 -1.25 -0.94 118.33 116.49 1mp1 n VAL 47 Ca 0.13 0.21 0.06 0.00 -2.04 0.00 0.00 64.34 62.70 1mp1 n VAL 47 Cb 0.12 -0.98 -0.06 0.00 -1.47 0.00 0.00 33.84 31.45 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 -1.39 0.00 -0.15 1.34 2.08 0.14 -4.37 119.36 117.01 1mp1 n ILE 48 Ca 0.05 -0.23 -0.03 0.00 0.56 0.00 0.00 62.75 63.10 1mp1 n ILE 48 Cb 0.13 1.03 0.06 0.00 -0.75 0.00 0.00 39.64 40.11 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 0.27 0.31 0.00 0.38 1.63 0.87 2.18 116.57 122.21 1mp1 h LYS 49 Ca 0.00 -0.02 -0.13 0.00 -0.85 0.00 0.00 60.65 59.65 1mp1 h LYS 49 Cb 0.33 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.87 1mp1 h LYS 49 CO 0.00 0.20 -0.62 -1.00 -3.45 0.00 0.00 179.45 174.59 1mp1 h PRO 50 N 0.32 0.00 -0.07 1.90 0.13 -1.79 0.66 132.00 133.15 1mp1 h PRO 50 Ca 0.23 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.18 1mp1 h PRO 50 Cb 0.25 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.39 1mp1 h PRO 50 CO -0.25 0.62 -0.64 2.35 -0.23 0.00 0.00 178.00 179.84 1mp1 h TRP 51 N 0.00 0.78 0.06 1.56 7.01 -1.41 0.32 115.95 124.26 1mp1 h TRP 51 Ca -0.01 -0.37 -0.00 0.00 2.11 0.00 0.00 58.89 60.62 1mp1 h TRP 51 Cb 1.23 -0.11 0.00 0.00 -2.10 0.00 0.00 29.16 28.18 1mp1 h TRP 51 CO 0.00 1.18 -0.03 0.82 -2.79 0.00 0.00 178.44 177.62 1mp1 h ILE 52 N 0.15 1.25 -0.84 2.65 2.04 0.36 0.20 117.51 123.33 1mp1 h ILE 52 Ca -0.06 -1.47 0.08 0.00 1.00 0.00 0.00 64.86 64.41 1mp1 h ILE 52 Cb 1.30 2.16 -0.06 0.00 -0.74 0.00 0.00 36.82 39.49 1mp1 h ILE 52 CO 0.13 0.35 0.54 0.74 0.00 0.00 0.00 178.15 179.91 1mp1 h THR 53 N -0.79 0.99 -0.04 -0.27 2.02 0.23 0.99 112.91 116.05 1mp1 h THR 53 Ca -0.01 -0.29 -0.24 0.00 0.77 0.00 0.00 66.41 66.65 1mp1 h THR 53 Cb 0.63 0.07 0.02 0.00 -1.74 0.00 0.00 68.15 67.13 1mp1 h THR 53 CO 0.01 0.15 -0.90 0.50 0.37 0.00 0.00 175.52 175.66 1mp1 h LYS 54 N 0.84 0.67 0.06 6.66 3.64 -0.95 -1.22 116.57 126.28 1mp1 h LYS 54 Ca 0.38 -0.68 -0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1mp1 h LYS 54 Cb 0.35 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1mp1 h LYS 54 CO -0.15 1.27 -0.03 0.00 -2.27 0.00 0.00 179.45 178.27 1mp1 h ARG 55 N 0.34 -0.08 -0.90 1.90 2.47 0.66 0.99 114.38 119.75 1mp1 h ARG 55 Ca -0.10 0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.62 1mp1 h ARG 55 Cb 1.56 0.02 -0.04 0.00 -1.65 0.00 0.00 29.97 29.85 1mp1 h ARG 55 CO 0.18 0.14 0.55 -0.39 0.56 0.00 0.00 179.97 181.01 1mp1 h VAL 56 N -0.30 1.25 -0.37 2.04 -1.51 0.89 1.29 116.25 119.53 1mp1 h VAL 56 Ca -0.01 -0.54 -0.13 0.00 -1.23 0.00 0.00 66.70 64.79 1mp1 h VAL 56 Cb 0.26 -0.02 -0.01 0.00 -2.13 0.00 0.00 31.29 29.39 1mp1 h VAL 56 CO 0.01 0.26 -0.28 0.74 -1.23 0.00 0.00 177.57 177.08 1mp1 h THR 57 N 1.24 1.28 0.00 7.19 2.02 -1.01 -2.92 112.91 120.71 1mp1 h THR 57 Ca 0.32 -1.44 -0.12 0.00 0.77 0.00 0.00 66.41 65.95 1mp1 h THR 57 Cb -0.06 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 1mp1 h THR 57 CO -0.06 0.48 -0.58 -0.33 0.37 0.00 0.00 175.52 175.40 1mp1 h GLU 58 N 0.65 0.00 -0.41 6.66 5.08 0.16 2.99 114.58 129.70 1mp1 h GLU 58 Ca 0.07 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.48 1mp1 h GLU 58 Cb 0.85 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.06 1mp1 h GLU 58 CO 0.07 0.58 0.15 0.82 -1.00 0.00 0.00 179.01 179.63 1mp1 h ILE 59 N 0.00 0.89 0.00 3.13 2.04 0.18 -3.29 117.51 120.46 1mp1 h ILE 59 Ca -0.01 -0.11 -0.44 0.00 1.00 0.00 0.00 64.86 65.30 1mp1 h ILE 59 Cb 1.10 0.54 -0.07 0.00 -0.74 0.00 0.00 36.82 37.65 1mp1 h ILE 59 CO 0.07 0.06 -2.53 0.00 0.00 0.00 0.00 178.15 175.76 1mp1 n LEU 60 N -5.00 2.29 0.00 1.44 -0.00 -1.15 -4.99 117.00 109.59 1mp1 n LEU 60 Ca 0.02 0.18 0.00 0.00 -0.00 0.00 0.00 56.01 56.22 1mp1 n LEU 60 Cb 0.14 -0.85 0.00 0.00 -0.00 0.00 0.00 43.42 42.72 1mp1 n LEU 60 CO 0.27 0.70 0.00 0.61 -0.00 0.00 0.00 177.39 178.96 1mp1 n GLY 61 N 1.59 1.19 3.28 1.47 0.00 0.99 -5.10 105.19 108.60 1mp1 n GLY 61 Ca -0.52 0.00 -0.21 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 -1.21 1.61 -0.31 1.61 -0.12 -0.62 -4.82 117.98 114.12 1mp1 s PHE 62 Ca 0.00 -0.49 -0.28 0.00 -0.05 0.00 0.00 56.93 56.11 1mp1 s PHE 62 Cb 0.00 -0.84 -0.02 0.00 -0.63 0.00 0.00 43.02 41.53 1mp1 s PHE 62 CO 0.00 0.21 1.84 -2.00 -0.05 0.00 0.00 175.22 175.22 1mp1 s GLU 63 N -2.46 3.34 0.03 1.99 2.12 -1.26 -4.15 118.70 118.30 1mp1 s GLU 63 Ca 0.10 1.51 -0.00 0.00 0.36 0.00 0.00 54.97 56.93 1mp1 s GLU 63 Cb -0.07 -4.21 0.01 0.00 0.26 0.00 0.00 34.13 30.12 1mp1 s GLU 63 CO 0.04 -1.85 0.03 -0.25 -0.54 0.00 0.00 175.26 172.69 1mp1 n ASP 64 N 10.33 -0.33 0.07 -1.70 8.00 -1.26 -5.04 116.55 126.62 1mp1 n ASP 64 Ca 0.23 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.88 1mp1 n ASP 64 Cb 0.46 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.54 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 -3.03 -0.91 -0.25 -2.24 9.92 -1.26 -4.75 116.55 114.03 1mp1 n ASP 65 Ca 0.00 0.25 -0.07 0.00 -0.53 0.00 0.00 54.79 54.44 1mp1 n ASP 65 Cb 0.01 1.08 0.04 0.00 -0.64 0.00 0.00 41.12 41.62 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 1.26 -0.15 2.53 3.04 -1.98 0.82 116.25 121.77 1mp1 h VAL 66 Ca 0.00 -0.90 -0.11 0.00 -1.01 0.00 0.00 66.70 64.69 1mp1 h VAL 66 Cb 0.00 0.53 0.00 0.00 -2.01 0.00 0.00 31.29 29.81 1mp1 h VAL 66 CO 0.00 0.35 -0.32 -0.37 -1.01 0.00 0.00 177.57 176.22 1mp1 h VAL 67 N 1.01 1.36 -0.15 1.51 -1.51 -1.91 -1.84 116.25 114.72 1mp1 h VAL 67 Ca 0.22 -1.58 -0.00 0.00 -1.23 0.00 0.00 66.70 64.10 1mp1 h VAL 67 Cb 0.31 2.00 -0.01 0.00 -2.13 0.00 0.00 31.29 31.47 1mp1 h VAL 67 CO -0.01 0.47 0.08 0.40 -1.23 0.00 0.00 177.57 177.29 1mp1 h ILE 68 N 0.10 1.11 -0.77 7.19 2.04 -1.80 -2.05 117.51 123.32 1mp1 h ILE 68 Ca 0.00 -0.30 0.09 0.00 1.00 0.00 0.00 64.86 65.65 1mp1 h ILE 68 Cb 0.92 1.02 -0.07 0.00 -0.74 0.00 0.00 36.82 37.95 1mp1 h ILE 68 CO 0.07 0.10 0.42 -0.33 0.00 0.00 0.00 178.15 178.41 1mp1 h GLU 69 N 0.14 0.71 -0.40 2.37 5.08 0.66 1.14 114.58 124.27 1mp1 h GLU 69 Ca 0.05 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.41 1mp1 h GLU 69 Cb 0.09 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.14 1mp1 h GLU 69 CO -0.01 0.47 0.16 0.74 -1.00 0.00 0.00 179.01 179.37 1mp1 h PHE 70 N 0.73 0.29 -0.10 4.33 0.04 -0.90 2.07 116.94 123.39 1mp1 h PHE 70 Ca 0.37 0.02 -0.10 0.00 2.80 0.00 0.00 57.97 61.06 1mp1 h PHE 70 Cb 0.33 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.41 1mp1 h PHE 70 CO -0.08 0.13 -0.32 0.82 -0.60 0.00 0.00 178.31 178.26 1mp1 h ILE 71 N 0.34 1.39 -0.12 -0.55 2.04 -0.61 0.69 117.51 120.68 1mp1 h ILE 71 Ca 0.18 -1.66 -0.00 0.00 1.00 0.00 0.00 64.86 64.38 1mp1 h ILE 71 Cb 0.14 2.18 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 1mp1 h ILE 71 CO -0.17 0.49 0.07 0.15 0.00 0.00 0.00 178.15 178.69 1mp1 h PHE 72 N -0.04 0.17 -0.39 1.37 3.04 0.17 1.71 116.94 122.96 1mp1 h PHE 72 Ca -0.01 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.90 1mp1 h PHE 72 Cb 0.95 -0.05 -0.02 0.00 2.56 0.00 0.00 35.95 39.39 1mp1 h PHE 72 CO 0.12 0.18 0.10 -0.91 -2.02 0.00 0.00 178.31 175.77 1mp1 h ASN 73 N 0.11 0.59 -0.49 0.41 2.35 0.33 0.60 115.58 119.48 1mp1 h ASN 73 Ca 0.04 -0.23 -0.11 0.00 -0.55 0.00 0.00 56.30 55.46 1mp1 h ASN 73 Cb 0.06 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 1mp1 h ASN 73 CO -0.01 0.66 -0.10 1.56 -1.65 0.00 0.00 177.43 177.90 1mp1 h GLN 74 N 0.48 0.97 0.00 0.81 7.50 -0.62 -1.82 115.11 122.43 1mp1 h GLN 74 Ca 0.12 -0.34 0.00 0.00 0.50 0.00 0.00 58.65 58.93 1mp1 h GLN 74 Cb 0.31 -0.07 0.00 0.00 0.05 0.00 0.00 27.48 27.77 1mp1 h GLN 74 CO 0.00 1.01 0.00 1.28 -1.50 0.00 0.00 178.83 179.62 1mp1 n LEU 75 N -4.15 0.00 -0.01 1.46 4.77 0.58 -2.69 117.00 116.96 1mp1 n LEU 75 Ca 0.02 0.43 0.15 0.00 -0.03 0.00 0.00 56.01 56.58 1mp1 n LEU 75 Cb 0.39 -0.43 0.77 0.00 -2.33 0.00 0.00 43.42 41.82 1mp1 n LEU 75 CO 0.45 -0.01 1.02 -0.62 -1.33 0.00 0.00 177.39 176.90 1mp1 n GLU 76 N -1.43 0.50 -1.77 3.23 -0.58 0.21 -4.81 120.64 115.99 1mp1 n GLU 76 Ca 0.09 -0.01 -0.07 0.00 -0.42 0.00 0.00 57.16 56.75 1mp1 n GLU 76 Cb 0.30 -1.50 0.02 0.00 -0.57 0.00 0.00 31.44 29.69 1mp1 n GLU 76 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1mp1 n VAL 77 N -1.24 0.00 0.01 2.62 0.24 -1.10 -5.04 118.33 113.82 1mp1 n VAL 77 Ca 0.15 -0.62 0.08 0.00 -2.04 0.00 0.00 64.34 61.91 1mp1 n VAL 77 Cb 0.23 -0.72 -0.13 0.00 -1.47 0.00 0.00 33.84 31.75 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 -1.27 0.65 -3.48 7.34 4.01 -1.26 -4.43 118.16 119.72 1mp1 n LYS 78 Ca 0.04 -0.08 -0.28 0.00 -0.51 0.00 0.00 58.31 57.48 1mp1 n LYS 78 Cb 0.19 -1.60 -0.13 0.00 -0.51 0.00 0.00 35.03 32.98 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 -4.88 2.97 0.65 4.39 0.02 -1.26 -2.62 114.94 114.20 1mp1 s ASN 79 Ca -0.06 -1.79 -0.13 0.00 -1.02 0.00 0.00 52.86 49.86 1mp1 s ASN 79 Cb 0.12 -0.27 -0.01 0.00 0.02 0.00 0.00 41.25 41.10 1mp1 s ASN 79 CO 0.87 -0.35 1.06 -2.16 0.02 0.00 0.00 177.10 176.53 1mp1 s PRO 80 N 1.49 3.13 -0.89 -0.60 0.04 -1.26 -5.00 135.00 131.91 1mp1 s PRO 80 Ca 0.15 1.05 -0.08 0.00 0.04 0.00 0.00 61.00 62.15 1mp1 s PRO 80 Cb -0.20 -2.01 0.23 0.00 0.04 0.00 0.00 34.50 32.56 1mp1 s PRO 80 CO -0.13 -0.95 0.82 0.34 0.04 0.00 0.00 177.00 177.12 1mp1 s ASP 81 N -3.37 6.54 0.64 6.66 2.15 -1.26 -4.87 116.67 123.15 1mp1 s ASP 81 Ca 0.60 -3.19 0.25 0.00 0.43 0.00 0.00 52.55 50.64 1mp1 s ASP 81 Cb -0.15 -2.09 1.30 0.00 -0.30 0.00 0.00 42.92 41.68 1mp1 s ASP 81 CO 0.47 -0.38 1.73 -1.28 -0.17 0.00 0.00 175.17 175.54 1mp1 h SER 82 N 6.98 0.00 0.12 -0.34 0.87 -1.95 0.34 113.55 119.57 1mp1 h SER 82 Ca 0.12 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.67 1mp1 h SER 82 Cb 0.93 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.89 1mp1 h SER 82 CO 0.84 0.00 -0.06 0.11 -0.53 0.00 0.00 176.83 177.20 1mp1 h LYS 83 N 0.00 -0.15 0.00 2.24 1.79 -1.89 -2.12 116.57 116.44 1mp1 h LYS 83 Ca 0.09 0.01 -0.11 0.00 -2.18 0.00 0.00 60.65 58.46 1mp1 h LYS 83 Cb 1.17 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.83 1mp1 h LYS 83 CO -0.00 0.11 -0.53 0.52 -1.08 0.00 0.00 179.45 178.47 1mp1 h MET 84 N -0.41 0.00 0.22 3.15 2.86 -0.81 -1.91 114.93 118.03 1mp1 h MET 84 Ca -0.02 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1mp1 h MET 84 Cb 0.33 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 1mp1 h MET 84 CO 0.03 0.53 -0.14 1.98 1.06 0.00 0.00 176.91 180.36 1mp1 h MET 85 N 0.00 -0.34 -0.11 1.72 -1.53 -0.99 1.52 114.93 115.19 1mp1 h MET 85 Ca -0.01 0.02 -0.14 0.00 -3.44 0.00 0.00 59.70 56.14 1mp1 h MET 85 Cb 0.96 0.08 -0.01 0.00 -0.55 0.00 0.00 31.60 32.08 1mp1 h MET 85 CO 0.07 -0.23 -0.52 0.37 0.14 0.00 0.00 176.91 176.74 1mp1 h GLN 86 N -0.36 0.31 -0.36 0.39 4.15 -1.38 0.43 115.11 118.30 1mp1 h GLN 86 Ca -0.02 -0.19 -0.15 0.00 0.77 0.00 0.00 58.65 59.07 1mp1 h GLN 86 Cb 0.30 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 1mp1 h GLN 86 CO 0.01 0.76 -0.37 0.82 -1.93 0.00 0.00 178.83 178.13 1mp1 h ILE 87 N 0.25 1.28 -0.11 2.39 2.04 -1.00 -0.22 117.51 122.14 1mp1 h ILE 87 Ca 0.01 -1.54 -0.18 0.00 1.00 0.00 0.00 64.86 64.15 1mp1 h ILE 87 Cb 1.00 1.44 0.01 0.00 -0.74 0.00 0.00 36.82 38.53 1mp1 h ILE 87 CO 0.08 0.51 -0.64 0.78 0.00 0.00 0.00 178.15 178.88 1mp1 h ASN 88 N 0.68 0.75 -0.51 1.72 2.35 0.23 -3.03 115.58 117.76 1mp1 h ASN 88 Ca 0.06 -0.65 0.03 0.00 -0.55 0.00 0.00 56.30 55.19 1mp1 h ASN 88 Cb 0.96 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 39.07 1mp1 h ASN 88 CO 0.09 1.28 0.29 -0.07 -1.65 0.00 0.00 177.43 177.37 1mp1 h LEU 89 N 0.27 0.44 -2.02 1.61 3.38 -0.10 -0.04 115.31 118.86 1mp1 h LEU 89 Ca -0.05 0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.03 1mp1 h LEU 89 Cb 1.29 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 1mp1 h LEU 89 CO 0.13 0.31 0.24 0.74 0.09 0.00 0.00 178.44 179.95 1mp1 h THR 90 N 0.56 0.80 0.00 0.22 2.02 -1.03 1.55 112.91 117.04 1mp1 h THR 90 Ca 0.22 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.40 1mp1 h THR 90 Cb 0.07 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 1mp1 h THR 90 CO -0.12 0.00 0.00 1.23 0.37 0.00 0.00 175.52 177.00 1mp1 h GLY 91 N 0.00 0.00 0.00 2.16 0.00 -0.87 -3.26 103.07 101.10 1mp1 h GLY 91 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 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 -2.55 0.00 -0.26 5.60 3.01 0.11 -5.07 117.46 118.29 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 0.11 0.04 0.00 0.00 -0.01 0.00 0.00 39.48 39.62 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 -2.68 0.00 0.00 4.37 4.77 0.49 -4.93 117.00 119.02 1mp1 n LEU 93 Ca 0.00 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.09 1mp1 n LEU 93 Cb 0.43 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.64 1mp1 n LEU 93 CO 0.00 -1.14 0.27 0.59 -1.33 0.00 0.00 177.39 175.79 1mp1 n ASN 94 N -2.74 0.68 0.00 -1.43 3.02 -1.26 -4.80 115.26 108.73 1mp1 n ASN 94 Ca 0.00 -0.51 0.00 0.00 -0.03 0.00 0.00 54.58 54.04 1mp1 n ASN 94 Cb 0.00 0.52 0.00 0.00 -0.61 0.00 0.00 39.78 39.69 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 1.50 3.16 0.17 7.41 0.00 -1.26 -4.81 105.19 111.36 1mp1 n GLY 95 Ca 0.05 -0.95 -0.17 0.00 0.00 0.00 0.00 46.02 44.95 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 0.51 -0.33 1.61 3.11 -1.98 -2.99 116.57 116.50 1mp1 h LYS 96 Ca 0.00 -0.59 -0.06 0.00 -2.81 0.00 0.00 60.65 57.19 1mp1 h LYS 96 Cb 0.00 0.18 -0.02 0.00 -1.00 0.00 0.00 32.23 31.39 1mp1 h LYS 96 CO 0.00 1.21 -0.07 -0.91 -2.81 0.00 0.00 179.45 176.88 1mp1 h ASN 97 N 0.27 0.51 -0.66 4.20 2.35 -1.96 -0.60 115.58 119.69 1mp1 h ASN 97 Ca -0.11 -0.12 -0.03 0.00 -0.55 0.00 0.00 56.30 55.49 1mp1 h ASN 97 Cb 1.69 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 39.89 1mp1 h ASN 97 CO 0.19 0.63 0.31 0.00 -1.65 0.00 0.00 177.43 176.91 1mp1 h ALA 98 N 1.43 0.86 -0.49 -0.83 0.00 -1.89 1.36 119.26 119.70 1mp1 h ALA 98 Ca 0.10 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 1mp1 h ALA 98 Cb 0.43 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1mp1 h ALA 98 CO 0.02 0.43 -0.20 0.00 0.00 0.00 0.00 179.25 179.50 1mp1 h ARG 99 N 0.92 0.98 -0.11 0.00 3.08 -1.27 -1.25 114.38 116.74 1mp1 h ARG 99 Ca 0.23 -0.41 -0.20 0.00 0.07 0.00 0.00 59.98 59.67 1mp1 h ARG 99 Cb 0.14 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1mp1 h ARG 99 CO -0.03 1.08 -0.75 0.93 -1.07 0.00 0.00 179.97 180.14 1mp1 h GLU 100 N 0.85 0.55 -0.03 0.04 4.39 -0.69 -1.88 114.58 117.81 1mp1 h GLU 100 Ca 0.11 -0.45 -0.00 0.00 0.34 0.00 0.00 59.36 59.36 1mp1 h GLU 100 Cb 0.77 0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 29.52 1mp1 h GLU 100 CO 0.06 1.08 0.01 0.35 -1.16 0.00 0.00 179.01 179.36 1mp1 h PHE 101 N 0.38 0.04 0.00 4.33 3.04 0.19 -2.22 116.94 122.70 1mp1 h PHE 101 Ca -0.04 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.91 1mp1 h PHE 101 Cb 1.35 -0.01 0.00 0.00 2.56 0.00 0.00 35.95 39.84 1mp1 h PHE 101 CO 0.06 0.15 0.00 0.52 -2.02 0.00 0.00 178.31 177.02 1mp1 h MET 102 N -0.08 0.00 -0.08 1.11 2.86 -1.27 -0.67 114.93 116.79 1mp1 h MET 102 Ca 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1mp1 h MET 102 Cb 0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 1mp1 h MET 102 CO -0.00 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.38 1mp1 n GLY 103 N 0.21 -0.15 0.00 8.32 0.00 -0.71 -1.73 105.19 111.13 1mp1 n GLY 103 Ca 0.02 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.05 3.23 -0.13 1.61 -0.58 -0.82 -4.62 120.64 119.28 1mp1 n GLU 104 Ca 0.17 0.00 -0.24 0.00 -0.42 0.00 0.00 57.16 56.68 1mp1 n GLU 104 Cb 0.27 -0.52 -0.11 0.00 -0.57 0.00 0.00 31.44 30.51 1mp1 n GLU 104 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 1mp1 n LEU 105 N -0.62 2.46 -0.29 -4.62 0.00 -0.32 -3.10 117.00 110.51 1mp1 n LEU 105 Ca 0.00 0.10 -0.02 0.00 0.00 0.00 0.00 56.01 56.09 1mp1 n LEU 105 Cb 0.00 -0.86 0.10 0.00 0.00 0.00 0.00 43.42 42.66 1mp1 n LEU 105 CO 0.00 0.76 1.19 -0.25 0.00 0.00 0.00 177.39 179.08 1mp1 h TRP 106 N -0.49 0.95 0.00 1.96 -0.00 -1.56 -0.95 115.95 115.86 1mp1 h TRP 106 Ca -0.64 0.03 -0.13 0.00 -0.00 0.00 0.00 58.89 58.15 1mp1 h TRP 106 Cb 1.75 -0.31 -0.02 0.00 -0.00 0.00 0.00 29.16 30.58 1mp1 h TRP 106 CO -0.03 0.54 -0.62 -1.00 -0.00 0.00 0.00 178.44 177.33 1mp1 h PRO 107 N 0.98 0.00 -0.59 2.65 0.13 -1.77 -2.59 132.00 130.82 1mp1 h PRO 107 Ca 0.32 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.46 1mp1 h PRO 107 Cb 0.02 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.12 1mp1 h PRO 107 CO -0.12 0.62 0.38 1.25 -0.23 0.00 0.00 178.00 179.91 1mp1 h LEU 108 N 0.00 0.65 -0.56 1.56 5.85 -1.14 -1.51 115.31 120.16 1mp1 h LEU 108 Ca -0.01 -0.01 -0.16 0.00 0.84 0.00 0.00 57.88 58.54 1mp1 h LEU 108 Cb 1.23 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 1mp1 h LEU 108 CO 0.08 0.46 -0.64 -0.07 -0.34 0.00 0.00 178.44 177.93 1mp1 h LEU 109 N 0.77 0.36 -0.65 2.25 3.38 -1.29 -0.98 115.31 119.14 1mp1 h LEU 109 Ca 0.22 -0.21 0.10 0.00 0.09 0.00 0.00 57.88 58.07 1mp1 h LEU 109 Cb -0.06 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 40.52 1mp1 h LEU 109 CO -0.06 0.90 0.28 -0.07 0.09 0.00 0.00 178.44 179.58 1mp1 h LEU 110 N 0.22 0.31 -0.09 1.67 4.07 -0.91 1.44 115.31 122.04 1mp1 h LEU 110 Ca -0.01 0.07 -0.23 0.00 0.08 0.00 0.00 57.88 57.80 1mp1 h LEU 110 Cb 1.17 0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.94 1mp1 h LEU 110 CO 0.10 0.18 -1.02 -1.28 -1.08 0.00 0.00 178.44 175.34 1mp1 h SER 111 N 0.48 0.27 -0.24 -0.43 0.87 -1.21 -3.16 113.55 110.13 1mp1 h SER 111 Ca 0.33 -0.25 -0.03 0.00 -1.23 0.00 0.00 61.79 60.61 1mp1 h SER 111 Cb 0.39 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.26 1mp1 h SER 111 CO -0.30 1.13 0.04 0.00 -0.53 0.00 0.00 176.83 177.17 1mp1 h ALA 112 N 0.84 0.32 0.00 6.23 0.00 0.26 -1.64 119.26 125.27 1mp1 h ALA 112 Ca -0.07 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1mp1 h ALA 112 Cb 1.71 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.41 1mp1 h ALA 112 CO 0.16 -0.00 0.00 -0.56 0.00 0.00 0.00 179.25 178.85 1mp1 h GLN 113 N 0.20 0.00 0.00 0.00 3.07 0.19 0.34 115.11 118.91 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 0.33 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.89 1mp1 h GLN 113 CO 0.00 0.00 -0.59 0.39 0.09 0.00 0.00 178.83 178.72 1mp1 n GLU 114 N -2.32 0.11 -0.13 0.06 -0.58 -0.65 -4.80 120.64 112.32 1mp1 n GLU 114 Ca -0.01 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 1mp1 n GLU 114 Cb 0.08 -1.56 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 0.09 -0.48 0.00 0.00 177.13 176.74 1mp1 n ASN 115 N -1.71 0.00 -0.07 1.62 3.02 0.12 -5.06 115.26 113.19 1mp1 n ASN 115 Ca 0.05 -0.49 -0.12 0.00 -0.03 0.00 0.00 54.58 53.99 1mp1 n ASN 115 Cb 0.37 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.49 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 -0.84 0.77 1.59 2.41 0.00 -1.26 -4.49 119.36 117.54 1mp1 n ILE 116 Ca 0.00 -0.25 0.12 0.00 0.00 0.00 0.00 62.75 62.62 1mp1 n ILE 116 Cb 0.00 -1.32 0.53 0.00 0.00 0.00 0.00 39.64 38.85 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 -3.25 2.58 -3.16 1.51 0.00 -1.26 -4.89 120.51 112.03 1mp1 n ALA 117 Ca -0.26 -0.36 -0.15 0.00 0.00 0.00 0.00 53.44 52.68 1mp1 n ALA 117 Cb 0.72 -1.22 0.05 0.00 0.00 0.00 0.00 19.45 19.01 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 1.03 0.04 3.37 0.00 0.00 -1.25 -4.34 105.19 104.04 1mp1 n GLY 118 Ca 0.17 -0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.20 2.55 0.54 -0.61 1.09 -1.25 0.44 121.20 120.77 1mp1 s ILE 119 Ca 0.35 -0.90 -0.18 0.00 -1.10 0.00 0.00 60.65 58.82 1mp1 s ILE 119 Cb -0.15 -1.96 -0.06 0.00 -1.06 0.00 0.00 42.46 39.22 1mp1 s ILE 119 CO 0.44 0.58 1.04 -2.16 -0.10 0.00 0.00 174.94 174.74 1mp1 s PRO 120 N -0.44 3.57 0.43 2.79 0.04 -1.26 -4.26 135.00 135.87 1mp1 s PRO 120 Ca 0.05 1.24 0.30 0.00 0.04 0.00 0.00 61.00 62.63 1mp1 s PRO 120 Cb -0.12 -2.07 1.52 0.00 0.04 0.00 0.00 34.50 33.87 1mp1 s PRO 120 CO 0.01 -0.61 1.90 0.66 0.04 0.00 0.00 177.00 179.01 1mp1 h SER 121 N 0.93 0.00 -0.01 6.66 4.64 -1.87 -0.78 113.55 123.13 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 0.58 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.55 1mp1 h ALA 122 N 2.04 1.93 0.00 5.18 0.00 -1.94 -1.16 119.26 125.31 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 0.10 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 1mp1 h ALA 122 CO 0.00 -0.01 -2.43 1.19 0.00 0.00 0.00 179.25 178.01 1mp1 n PHE 123 N -4.43 0.02 0.07 0.00 3.72 -0.34 -3.87 117.46 112.64 1mp1 n PHE 123 Ca -0.03 0.01 -0.04 0.00 -0.05 0.00 0.00 57.45 57.34 1mp1 n PHE 123 Cb 0.09 -1.00 -0.02 0.00 -0.94 0.00 0.00 39.48 37.61 1mp1 n PHE 123 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1mp1 h LEU 124 N 0.00 -0.25 0.04 4.37 3.38 -1.11 -3.30 115.31 118.44 1mp1 h LEU 124 Ca -0.56 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.43 1mp1 h LEU 124 Cb 2.06 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.88 1mp1 h LEU 124 CO -0.03 -0.14 -0.10 -0.08 0.09 0.00 0.00 178.44 178.17 1mp1 h GLU 125 N -0.22 -0.15 0.00 1.13 4.57 -1.47 -3.43 114.58 115.01 1mp1 h GLU 125 Ca -0.02 0.01 -0.19 0.00 -1.18 0.00 0.00 59.36 57.98 1mp1 h GLU 125 Cb 0.18 0.03 0.11 0.00 -0.16 0.00 0.00 28.75 28.92 1mp1 h GLU 125 CO 0.01 -0.10 -0.09 1.28 -1.18 0.00 0.00 179.01 178.92 1mp1 n LEU 126 N -3.01 0.00 0.00 1.64 4.77 -1.24 -5.01 117.00 114.15 1mp1 n LEU 126 Ca -0.02 -0.45 -0.21 0.00 -0.03 0.00 0.00 56.01 55.30 1mp1 n LEU 126 Cb 0.08 -0.58 0.13 0.00 -2.33 0.00 0.00 43.42 40.73 1mp1 n LEU 126 CO 0.04 -2.23 0.59 2.29 -1.33 0.00 0.00 177.39 176.74 1mp1 n LYS 127 N -3.21 -0.65 -3.82 3.23 0.00 -1.26 -4.82 118.16 107.63 1mp1 n LYS 127 Ca 0.07 -1.72 -0.05 0.00 -0.00 0.00 0.00 58.31 56.61 1mp1 n LYS 127 Cb 0.31 -0.87 0.00 0.00 -0.00 0.00 0.00 35.03 34.48 1mp1 n LYS 127 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 1mp1 s LYS 128 N -4.96 1.53 0.30 -1.58 -2.85 -1.26 -4.81 119.74 106.11 1mp1 s LYS 128 Ca 0.55 -0.92 -0.23 0.00 -1.00 0.00 0.00 55.97 54.37 1mp1 s LYS 128 Cb -0.02 0.47 -0.15 0.00 -2.06 0.00 0.00 37.83 36.07 1mp1 s LYS 128 CO 0.38 -0.71 0.25 -1.91 0.10 0.00 0.00 175.35 173.46 1mp1 n GLU 129 N -0.55 0.00 -1.82 1.78 2.13 -1.26 -4.66 120.64 116.25 1mp1 n GLU 129 Ca -0.05 0.00 -0.37 0.00 0.66 0.00 0.00 57.16 57.40 1mp1 n GLU 129 Cb 0.60 -0.95 -0.05 0.00 0.27 0.00 0.00 31.44 31.31 1mp1 n GLU 129 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1mp1 n GLU 130 N 1.14 1.92 -3.37 5.31 4.07 -1.26 -4.78 120.64 123.67 1mp1 n GLU 130 Ca 0.13 -2.41 -0.37 0.00 -0.06 0.00 0.00 57.16 54.45 1mp1 n GLU 130 Cb 0.32 -3.40 -0.04 0.00 -0.06 0.00 0.00 31.44 28.26 1mp1 n GLU 130 CO 0.00 0.00 0.00 -0.89 -0.06 0.00 0.00 177.13 176.18 1mp1 n ILE 131 N 6.78 3.79 -2.32 6.31 2.08 -1.26 -4.83 119.36 129.92 1mp1 n ILE 131 Ca 0.48 -5.42 -0.01 0.00 0.56 0.00 0.00 62.75 58.36 1mp1 n ILE 131 Cb 0.44 -2.26 -0.00 0.00 -0.75 0.00 0.00 39.64 37.07 1mp1 n ILE 131 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 1mp1 n LYS 132 N 1.75 -2.51 -1.43 0.38 4.81 -1.26 -4.81 118.16 115.10 1mp1 n LYS 132 Ca 0.25 2.14 -0.56 0.00 -0.87 0.00 0.00 58.31 59.27 1mp1 n LYS 132 Cb 0.37 -3.97 -0.08 0.00 0.02 0.00 0.00 35.03 31.37 1mp1 n LYS 132 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1mp1 n GLN 133 N 0.58 0.00 0.00 1.64 -0.00 -1.26 -5.21 117.38 113.12 1mp1 n GLN 133 Ca -0.04 0.00 0.02 0.00 -0.00 0.00 0.00 57.00 56.98 1mp1 n GLN 133 Cb 0.06 -1.42 0.10 0.00 -0.00 0.00 0.00 30.24 28.98 1mp1 n GLN 133 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93