#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1llp s THR 2 N 0.00 2.69 0.86 0.00 2.01 -1.26 -0.51 115.64 119.43 1llp s THR 2 Ca 0.00 -0.72 -0.13 0.00 0.31 0.00 0.00 61.69 61.15 1llp s THR 2 Cb 0.00 -2.18 0.11 0.00 0.01 0.00 0.00 72.50 70.44 1llp s THR 2 CO 0.00 0.48 1.18 0.00 -0.69 0.00 0.00 174.62 175.60 1llp h ALA 4 N -1.25 2.02 -0.00 0.00 0.00 -1.93 -1.66 119.26 116.44 1llp h ALA 4 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1llp h ALA 4 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1llp h ALA 4 CO 0.62 -0.06 -0.00 0.27 0.00 0.00 0.00 179.25 180.07 1llp n ASN 5 N -4.49 0.06 0.00 0.00 0.23 -1.26 -4.90 115.26 104.90 1llp n ASN 5 Ca -0.02 -0.94 0.00 0.00 -0.53 0.00 0.00 54.58 53.09 1llp n ASN 5 Cb 0.14 -0.03 0.00 0.00 -2.08 0.00 0.00 39.78 37.81 1llp n ASN 5 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1llp n GLY 6 N 1.04 1.14 3.84 4.83 0.00 -0.62 -5.05 105.19 110.36 1llp n GLY 6 Ca 0.23 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 1llp n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1llp s LYS 7 N -0.51 4.06 -0.02 1.61 1.02 -1.26 -4.79 119.74 119.86 1llp s LYS 7 Ca 0.00 0.83 0.01 0.00 0.02 0.00 0.00 55.97 56.82 1llp s LYS 7 Cb 0.00 -2.33 -0.04 0.00 -0.52 0.00 0.00 37.83 34.95 1llp s LYS 7 CO 0.00 0.06 0.01 0.95 -0.92 0.00 0.00 175.35 175.45 1llp s THR 8 N -2.11 4.25 0.11 2.17 -4.23 -1.26 0.47 115.64 115.05 1llp s THR 8 Ca 0.57 -0.51 0.02 0.00 -1.18 0.00 0.00 61.69 60.60 1llp s THR 8 Cb -0.10 -2.88 -0.04 0.00 1.34 0.00 0.00 72.50 70.82 1llp s THR 8 CO 0.17 0.42 -0.08 0.68 -0.54 0.00 0.00 174.62 175.28 1llp s VAL 9 N -1.06 0.80 0.18 2.29 -7.23 0.33 -4.95 120.40 110.77 1llp s VAL 9 Ca 0.19 -1.91 -0.07 0.00 -1.81 0.00 0.00 61.98 58.38 1llp s VAL 9 Cb -0.12 -1.65 -0.02 0.00 0.56 0.00 0.00 36.38 35.15 1llp s VAL 9 CO 0.09 -0.81 1.53 1.23 -0.31 0.00 0.00 175.10 176.83 1llp h GLY 10 N 3.03 0.84 -6.33 2.32 0.00 -1.90 0.37 103.07 101.39 1llp h GLY 10 Ca -0.36 -0.85 -0.52 0.00 0.00 0.00 0.00 47.33 45.60 1llp h GLY 10 CO 0.63 0.77 -0.81 -0.35 0.00 0.00 0.00 176.54 176.78 1llp s ASP 11 N -6.85 1.99 0.65 0.19 -1.08 -1.26 -4.36 116.67 105.95 1llp s ASP 11 Ca -0.09 -0.30 0.34 0.00 -0.52 0.00 0.00 52.55 51.98 1llp s ASP 11 Cb 0.12 -0.83 1.88 0.00 -1.46 0.00 0.00 42.92 42.63 1llp s ASP 11 CO 0.86 -0.06 2.09 0.00 0.52 0.00 0.00 175.17 178.57 1llp h ALA 12 N 7.69 1.34 0.00 3.66 0.00 -1.92 0.18 119.26 130.20 1llp h ALA 12 Ca -0.31 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 1llp h ALA 12 Cb 1.15 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1llp h ALA 12 CO 0.44 -0.24 -0.02 0.66 0.00 0.00 0.00 179.25 180.08 1llp h SER 13 N 0.00 0.00 1.35 0.00 4.64 -1.99 -2.69 113.55 114.87 1llp h SER 13 Ca 0.02 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.32 1llp h SER 13 Cb 0.46 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1llp h SER 13 CO -0.00 0.02 -0.08 0.00 -0.87 0.00 0.00 176.83 175.90 1llp h ALA 16 N 1.67 1.65 0.00 0.00 0.00 -1.81 -2.08 119.26 118.69 1llp h ALA 16 Ca 0.56 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.47 1llp h ALA 16 Cb 0.97 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1llp h ALA 16 CO -0.45 -0.13 0.00 -1.49 0.00 0.00 0.00 179.25 177.18 1llp h TRP 17 N 0.00 0.00 -0.55 0.00 4.06 -1.44 -2.65 115.95 115.37 1llp h TRP 17 Ca 0.04 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 60.93 1llp h TRP 17 Cb 0.22 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.36 1llp h TRP 17 CO 0.00 0.00 0.11 0.74 -3.56 0.00 0.00 178.44 175.73 1llp h PHE 18 N 0.00 0.89 -0.20 0.49 0.04 -1.51 0.18 116.94 116.82 1llp h PHE 18 Ca 0.00 -0.09 -0.12 0.00 2.80 0.00 0.00 57.97 60.55 1llp h PHE 18 Cb 0.51 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.39 1llp h PHE 18 CO 0.00 0.76 -0.40 -0.44 -0.60 0.00 0.00 178.31 177.62 1llp h ASP 19 N 0.82 0.50 -0.39 2.17 3.32 -1.65 -0.42 116.42 120.76 1llp h ASP 19 Ca 0.18 -0.22 -0.08 0.00 0.02 0.00 0.00 57.03 56.92 1llp h ASP 19 Cb 0.33 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1llp h ASP 19 CO 0.00 0.85 -0.08 0.58 -1.72 0.00 0.00 179.24 178.87 1llp h VAL 20 N 0.39 1.27 0.19 -1.35 2.07 -1.42 -2.31 116.25 115.09 1llp h VAL 20 Ca 0.03 -1.16 0.01 0.00 0.82 0.00 0.00 66.70 66.40 1llp h VAL 20 Cb 0.88 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.84 1llp h VAL 20 CO 0.07 0.39 -0.27 0.25 0.02 0.00 0.00 177.57 178.04 1llp h LEU 21 N 0.56 -0.74 -0.88 2.57 5.85 -0.31 -1.09 115.31 121.28 1llp h LEU 21 Ca 0.10 0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.96 1llp h LEU 21 Cb 0.60 0.27 -0.06 0.00 0.37 0.00 0.00 40.66 41.84 1llp h LEU 21 CO 0.04 -0.37 0.55 0.44 -0.34 0.00 0.00 178.44 178.75 1llp h ASP 22 N -0.52 0.86 0.25 1.25 3.32 -1.09 -0.64 116.42 119.85 1llp h ASP 22 Ca 0.01 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 1llp h ASP 22 Cb 0.51 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.90 1llp h ASP 22 CO -0.11 0.55 -0.12 -0.78 -1.72 0.00 0.00 179.24 177.06 1llp h ASP 23 N 0.99 -0.28 0.00 6.45 3.58 -0.97 -2.96 116.42 123.23 1llp h ASP 23 Ca 0.38 -0.12 -0.11 0.00 0.42 0.00 0.00 57.03 57.61 1llp h ASP 23 Cb 0.18 0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.29 1llp h ASP 23 CO -0.18 -0.05 -0.33 0.16 -2.88 0.00 0.00 179.24 175.97 1llp h ILE 24 N -0.51 1.28 -0.54 2.25 3.07 -1.03 0.23 117.51 122.26 1llp h ILE 24 Ca -0.03 -1.41 0.00 0.00 1.55 0.00 0.00 64.86 64.97 1llp h ILE 24 Cb 0.38 1.47 -0.03 0.00 -0.27 0.00 0.00 36.82 38.38 1llp h ILE 24 CO 0.06 0.44 0.35 1.56 -1.05 0.00 0.00 178.15 179.51 1llp h GLN 25 N 0.40 0.72 0.08 0.16 1.08 -1.15 0.48 115.11 116.87 1llp h GLN 25 Ca 0.05 -0.05 -0.15 0.00 -1.45 0.00 0.00 58.65 57.05 1llp h GLN 25 Cb 0.77 -0.16 0.02 0.00 -0.05 0.00 0.00 27.48 28.06 1llp h GLN 25 CO 0.06 0.49 -0.63 0.00 -0.95 0.00 0.00 178.83 177.80 1llp h ALA 26 N 1.19 -0.03 -0.00 3.87 0.00 -1.36 0.29 119.26 123.22 1llp h ALA 26 Ca 0.20 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1llp h ALA 26 Cb -0.07 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1llp h ALA 26 CO -0.04 0.31 -0.80 0.09 0.00 0.00 0.00 179.25 178.81 1llp n ASN 27 N -4.23 1.21 -0.01 0.00 3.02 0.80 -3.72 115.26 112.33 1llp n ASN 27 Ca -0.12 -1.06 -0.02 0.00 -0.03 0.00 0.00 54.58 53.35 1llp n ASN 27 Cb 0.72 0.77 -0.01 0.00 -0.61 0.00 0.00 39.78 40.65 1llp n ASN 27 CO 0.00 0.00 0.00 0.80 -2.62 0.00 0.00 177.26 175.44 1llp n MET 28 N -1.10 0.05 -0.63 3.52 1.56 -0.02 -4.80 117.12 115.70 1llp n MET 28 Ca 0.06 0.02 0.06 0.00 -0.27 0.00 0.00 57.70 57.56 1llp n MET 28 Cb 0.37 -0.79 0.30 0.00 2.15 0.00 0.00 33.22 35.24 1llp n MET 28 CO 0.00 0.00 0.00 1.19 -0.73 0.00 0.00 175.97 176.43 1llp n PHE 29 N -2.84 1.47 -3.97 1.12 3.72 -0.17 -4.78 117.46 112.00 1llp n PHE 29 Ca -0.04 -0.52 -0.29 0.00 -0.05 0.00 0.00 57.45 56.55 1llp n PHE 29 Cb 0.53 -0.36 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 1llp n PHE 29 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1llp n HIS 30 N 0.56 -1.92 -1.55 1.38 8.25 -1.22 -1.14 115.22 119.57 1llp n HIS 30 Ca 0.21 0.83 0.00 0.00 -0.26 0.00 0.00 57.72 58.49 1llp n HIS 30 Cb 0.90 -3.71 0.00 0.00 1.12 0.00 0.00 29.99 28.30 1llp n HIS 30 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1llp n GLY 31 N -1.68 0.89 1.37 -1.41 0.00 0.92 -4.35 105.19 100.94 1llp n GLY 31 Ca -0.10 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1llp n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1llp n GLY 32 N -0.76 0.84 3.94 -0.02 0.00 -0.64 -4.95 105.19 103.60 1llp n GLY 32 Ca 0.00 -0.63 -0.24 0.00 0.00 0.00 0.00 46.02 45.15 1llp n GLY 32 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1llp s GLN 33 N -2.83 3.37 -0.98 1.61 -0.21 -0.30 -4.79 119.66 115.53 1llp s GLN 33 Ca 0.00 -0.37 -0.01 0.00 0.02 0.00 0.00 55.36 55.00 1llp s GLN 33 Cb 0.00 -2.63 0.31 0.00 1.00 0.00 0.00 33.01 31.69 1llp s GLN 33 CO 0.00 0.02 1.53 0.00 -2.12 0.00 0.00 175.29 174.72 1llp n GLY 35 N 0.51 5.37 0.18 0.00 0.00 -1.26 -4.51 105.19 105.47 1llp n GLY 35 Ca 0.36 -1.99 -0.05 0.00 0.00 0.00 0.00 46.02 44.34 1llp n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llp h ALA 36 N 0.30 0.22 -0.87 4.61 0.00 -1.93 -1.40 119.26 120.18 1llp h ALA 36 Ca 0.00 0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1llp h ALA 36 Cb 0.00 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1llp h ALA 36 CO 0.00 -0.47 0.44 0.93 0.00 0.00 0.00 179.25 180.15 1llp h GLU 37 N -0.03 1.24 -0.14 0.00 3.07 -1.93 0.15 114.58 116.94 1llp h GLU 37 Ca 0.18 -0.17 -0.02 0.00 -0.50 0.00 0.00 59.36 58.86 1llp h GLU 37 Cb 0.30 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 27.98 1llp h GLU 37 CO -0.40 0.94 0.03 0.00 -1.40 0.00 0.00 179.01 178.18 1llp h ALA 38 N 1.24 0.19 -0.58 3.43 0.00 -1.72 -1.73 119.26 120.09 1llp h ALA 38 Ca 0.30 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.09 1llp h ALA 38 Cb 0.09 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1llp h ALA 38 CO -0.04 -0.16 0.35 0.45 0.00 0.00 0.00 179.25 179.85 1llp h HIS 39 N 0.02 0.65 -0.75 0.00 3.86 -0.85 -1.93 115.15 116.15 1llp h HIS 39 Ca 0.04 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.29 1llp h HIS 39 Cb 0.29 -0.21 -0.04 0.00 1.06 0.00 0.00 27.41 28.51 1llp h HIS 39 CO 0.01 0.37 0.49 0.93 0.86 0.00 0.00 177.93 180.59 1llp h GLU 40 N 0.69 0.96 -0.67 2.45 5.08 -0.62 -2.10 114.58 120.36 1llp h GLU 40 Ca 0.24 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.48 1llp h GLU 40 Cb 0.03 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.04 1llp h GLU 40 CO -0.11 0.63 0.19 0.77 -1.00 0.00 0.00 179.01 179.49 1llp h SER 41 N 0.98 0.99 -0.40 1.42 0.02 -0.93 -1.42 113.55 114.22 1llp h SER 41 Ca 0.29 -0.22 -0.05 0.00 -0.84 0.00 0.00 61.79 60.96 1llp h SER 41 Cb -0.07 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.20 1llp h SER 41 CO -0.08 0.95 0.04 0.40 -1.14 0.00 0.00 176.83 177.01 1llp h ILE 42 N 0.98 1.25 -0.66 3.27 2.04 -1.14 -2.78 117.51 120.48 1llp h ILE 42 Ca 0.21 -0.92 0.02 0.00 1.00 0.00 0.00 64.86 65.17 1llp h ILE 42 Cb 0.33 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.44 1llp h ILE 42 CO -0.00 0.32 0.42 -0.09 0.00 0.00 0.00 178.15 178.79 1llp h ARG 43 N 0.53 0.81 -0.81 2.37 2.43 -1.16 -2.65 114.38 115.89 1llp h ARG 43 Ca 0.12 -0.05 0.06 0.00 -0.81 0.00 0.00 59.98 59.30 1llp h ARG 43 Cb 0.41 -0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 29.73 1llp h ARG 43 CO 0.01 0.53 0.53 1.25 -1.51 0.00 0.00 179.97 180.78 1llp h LEU 44 N 0.83 0.78 -0.34 3.80 5.85 -0.99 -1.28 115.31 123.95 1llp h LEU 44 Ca 0.26 0.00 0.07 0.00 0.84 0.00 0.00 57.88 59.05 1llp h LEU 44 Cb -0.01 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 40.79 1llp h LEU 44 CO -0.09 0.50 -0.06 0.58 -0.34 0.00 0.00 178.44 179.03 1llp h VAL 45 N 0.89 0.68 -0.35 1.05 2.07 -1.27 -0.85 116.25 118.48 1llp h VAL 45 Ca 0.35 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.83 1llp h VAL 45 Cb 0.22 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 1llp h VAL 45 CO -0.12 0.01 0.12 0.15 0.02 0.00 0.00 177.57 177.75 1llp h PHE 46 N 0.03 0.55 0.00 1.57 3.57 -1.30 -1.38 116.94 119.98 1llp h PHE 46 Ca 0.17 -0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.54 1llp h PHE 46 Cb 0.25 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 1llp h PHE 46 CO -0.29 0.52 -0.37 0.45 -2.23 0.00 0.00 178.31 176.40 1llp h HIS 47 N 0.41 0.00 0.09 0.41 3.86 -1.18 -1.69 115.15 117.05 1llp h HIS 47 Ca 0.11 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.32 1llp h HIS 47 Cb 0.22 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.69 1llp h HIS 47 CO 0.00 0.37 -0.04 0.22 0.86 0.00 0.00 177.93 179.34 1llp h ASP 48 N 0.00 -0.10 -0.39 2.45 3.58 -1.05 -3.40 116.42 117.51 1llp h ASP 48 Ca -0.00 -0.49 -0.11 0.00 0.42 0.00 0.00 57.03 56.84 1llp h ASP 48 Cb 0.71 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.78 1llp h ASP 48 CO 0.05 0.53 -0.20 0.28 -2.88 0.00 0.00 179.24 177.02 1llp h SER 49 N -0.83 0.85 0.82 2.28 0.02 -1.05 -3.24 113.55 112.40 1llp h SER 49 Ca -0.01 -0.41 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1llp h SER 49 Cb 0.59 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1llp h SER 49 CO 0.02 1.07 0.00 0.00 -1.14 0.00 0.00 176.83 176.78 1llp n ILE 50 N -4.24 0.75 -2.49 3.27 0.13 -0.65 -3.86 119.36 112.26 1llp n ILE 50 Ca -0.02 0.12 -0.43 0.00 -1.10 0.00 0.00 62.75 61.33 1llp n ILE 50 Cb 0.43 -0.95 0.00 0.00 -0.84 0.00 0.00 39.64 38.28 1llp n ILE 50 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1llp n ALA 51 N -1.67 4.18 -3.40 1.51 0.00 -1.22 -4.82 120.51 115.10 1llp n ALA 51 Ca 0.04 -4.00 -0.12 0.00 0.00 0.00 0.00 53.44 49.35 1llp n ALA 51 Cb 0.26 -3.39 -0.10 0.00 0.00 0.00 0.00 19.45 16.21 1llp n ALA 51 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1llp s ILE 52 N 2.97 -0.01 -0.33 0.00 2.07 -1.24 -2.24 121.20 122.42 1llp s ILE 52 Ca 0.48 0.02 0.03 0.00 -1.41 0.00 0.00 60.65 59.78 1llp s ILE 52 Cb 0.05 -0.57 0.16 0.00 0.13 0.00 0.00 42.46 42.22 1llp s ILE 52 CO 0.02 0.01 0.40 -0.55 -1.91 0.00 0.00 174.94 172.92 1llp s SER 53 N 0.51 0.68 0.35 4.50 0.15 -0.43 -4.18 113.70 115.27 1llp s SER 53 Ca -0.02 -0.95 0.08 0.00 0.70 0.00 0.00 55.95 55.76 1llp s SER 53 Cb -0.04 0.90 0.80 0.00 -1.71 0.00 0.00 66.02 65.96 1llp s SER 53 CO -0.03 -0.30 1.87 -0.65 1.20 0.00 0.00 173.24 175.33 1llp h PRO 54 N 7.62 0.69 -0.52 5.44 0.11 -1.88 -1.26 132.00 142.21 1llp h PRO 54 Ca -0.02 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 66.10 1llp h PRO 54 Cb 1.09 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 32.00 1llp h PRO 54 CO 0.23 0.46 0.24 0.00 -0.21 0.00 0.00 178.00 178.72 1llp h ALA 55 N 1.59 0.66 -0.29 -0.75 0.00 -1.94 0.92 119.26 119.45 1llp h ALA 55 Ca 0.44 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.31 1llp h ALA 55 Cb 0.67 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1llp h ALA 55 CO -0.20 -0.12 -0.12 1.98 0.00 0.00 0.00 179.25 180.79 1llp h MET 56 N 0.47 0.59 -0.33 0.00 -1.53 -1.57 -2.75 114.93 109.81 1llp h MET 56 Ca 0.23 -0.25 0.06 0.00 -3.44 0.00 0.00 59.70 56.30 1llp h MET 56 Cb 0.18 -0.02 -0.06 0.00 -0.55 0.00 0.00 31.60 31.15 1llp h MET 56 CO -0.19 0.82 -0.03 0.93 0.14 0.00 0.00 176.91 178.59 1llp h GLU 57 N 0.35 0.06 -0.07 0.39 4.39 -0.85 0.36 114.58 119.21 1llp h GLU 57 Ca 0.07 -0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.78 1llp h GLU 57 Cb 0.63 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.26 1llp h GLU 57 CO 0.04 0.04 0.07 0.00 -1.16 0.00 0.00 179.01 178.00 1llp h ALA 58 N 1.30 1.73 -0.18 3.43 0.00 -0.68 0.43 119.26 125.30 1llp h ALA 58 Ca 0.16 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1llp h ALA 58 Cb 0.23 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1llp h ALA 58 CO -0.29 -0.11 0.00 1.63 0.00 0.00 0.00 179.25 180.48 1llp n LYS 59 N -3.99 2.07 -1.63 0.00 5.02 0.07 -4.88 118.16 114.82 1llp n LYS 59 Ca -0.01 -0.93 -0.16 0.00 -2.02 0.00 0.00 58.31 55.19 1llp n LYS 59 Cb 0.17 -1.64 -0.06 0.00 -0.02 0.00 0.00 35.03 33.49 1llp n LYS 59 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1llp n GLY 60 N 0.31 1.22 3.52 0.72 0.00 0.15 -5.03 105.19 106.08 1llp n GLY 60 Ca 0.08 -0.26 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 1llp n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1llp s LYS 61 N -3.64 1.93 0.15 1.61 1.02 -0.89 -5.00 119.74 114.93 1llp s LYS 61 Ca 0.00 -1.11 -0.31 0.00 0.02 0.00 0.00 55.97 54.57 1llp s LYS 61 Cb 0.00 -2.19 -0.10 0.00 -0.52 0.00 0.00 37.83 35.02 1llp s LYS 61 CO 0.00 0.50 1.64 0.12 -0.92 0.00 0.00 175.35 176.69 1llp s PHE 62 N -1.15 2.83 -1.61 3.18 5.36 -1.26 -2.38 117.98 122.95 1llp s PHE 62 Ca 0.19 0.45 0.17 0.00 -0.96 0.00 0.00 56.93 56.78 1llp s PHE 62 Cb -0.11 -4.01 0.44 0.00 -0.34 0.00 0.00 43.02 39.01 1llp s PHE 62 CO 0.11 -3.83 1.36 0.41 -1.46 0.00 0.00 175.22 171.80 1llp n GLY 63 N 3.89 2.27 0.00 13.12 0.00 -1.26 -4.73 105.19 118.48 1llp n GLY 63 Ca 0.15 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1llp n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1llp n GLY 64 N 1.12 1.98 1.13 -0.02 0.00 -1.26 -1.32 105.19 106.81 1llp n GLY 64 Ca 0.17 -1.72 0.10 0.00 0.00 0.00 0.00 46.02 44.58 1llp n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1llp n GLY 65 N 1.85 1.84 7.00 -0.02 0.00 -1.23 -4.39 105.19 110.24 1llp n GLY 65 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1llp n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1llp n GLY 66 N 1.48 1.63 3.24 -0.02 0.00 -0.95 -4.28 105.19 106.29 1llp n GLY 66 Ca 0.20 -0.57 -0.40 0.00 0.00 0.00 0.00 46.02 45.25 1llp n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llp n ALA 67 N 9.52 3.76 -0.39 4.61 0.00 0.16 -4.12 120.51 134.04 1llp n ALA 67 Ca 0.00 -3.60 0.00 0.00 0.00 0.00 0.00 53.44 49.84 1llp n ALA 67 Cb 0.00 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 15.88 1llp n ALA 67 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1llp n ASP 68 N 8.71 0.98 -0.02 0.00 5.75 -1.26 -4.87 116.55 125.83 1llp n ASP 68 Ca 0.49 -1.37 -0.00 0.00 -0.01 0.00 0.00 54.79 53.90 1llp n ASP 68 Cb 0.43 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.52 1llp n ASP 68 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1llp n GLY 69 N -0.18 0.44 0.36 6.12 0.00 -1.26 -1.61 105.19 109.05 1llp n GLY 69 Ca 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 46.02 45.92 1llp n GLY 69 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1llp h SER 70 N 0.00 0.97 0.31 1.61 4.64 -1.90 -1.69 113.55 117.49 1llp h SER 70 Ca -0.01 -0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 61.27 1llp h SER 70 Cb 0.16 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 62.00 1llp h SER 70 CO 0.01 0.72 -0.03 -0.29 -0.87 0.00 0.00 176.83 176.37 1llp h ILE 71 N 1.14 0.21 0.01 0.95 2.10 -1.90 0.97 117.51 120.99 1llp h ILE 71 Ca 0.30 -0.25 -0.25 0.00 1.08 0.00 0.00 64.86 65.74 1llp h ILE 71 Cb -0.10 1.20 -0.03 0.00 -1.09 0.00 0.00 36.82 36.80 1llp h ILE 71 CO -0.06 0.03 -1.35 0.80 -1.08 0.00 0.00 178.15 176.49 1llp n MET 72 N -3.32 0.58 -0.16 2.19 1.56 -0.71 -3.10 117.12 114.15 1llp n MET 72 Ca -0.02 0.55 -0.11 0.00 -0.27 0.00 0.00 57.70 57.85 1llp n MET 72 Cb 0.17 -1.74 0.00 0.00 2.15 0.00 0.00 33.22 33.80 1llp n MET 72 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 1llp h ILE 73 N -0.91 1.27 -1.35 1.12 2.04 -1.28 -3.20 117.51 115.19 1llp h ILE 73 Ca -0.36 -1.37 -0.63 0.00 1.00 0.00 0.00 64.86 63.50 1llp h ILE 73 Cb 1.37 1.09 -0.37 0.00 -0.74 0.00 0.00 36.82 38.17 1llp h ILE 73 CO -0.19 0.47 -0.11 0.49 0.00 0.00 0.00 178.15 178.81 1llp n PHE 74 N -4.11 3.12 0.08 1.37 3.72 0.33 -4.82 117.46 117.15 1llp n PHE 74 Ca 0.00 -2.70 0.00 0.00 -0.05 0.00 0.00 57.45 54.71 1llp n PHE 74 Cb 0.45 -0.60 0.31 0.00 -0.94 0.00 0.00 39.48 38.70 1llp n PHE 74 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 1llp h ASP 75 N 2.48 0.30 -0.69 4.37 2.03 -1.54 -0.34 116.42 123.03 1llp h ASP 75 Ca 0.42 -0.08 0.03 0.00 -0.73 0.00 0.00 57.03 56.67 1llp h ASP 75 Cb 0.87 -0.08 -0.04 0.00 -0.83 0.00 0.00 39.33 39.25 1llp h ASP 75 CO 1.07 0.51 0.45 0.74 -1.03 0.00 0.00 179.24 180.98 1llp h THR 76 N 0.29 1.12 0.00 1.15 2.02 -1.88 0.13 112.91 115.75 1llp h THR 76 Ca 0.05 -0.29 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 1llp h THR 76 Cb 0.50 0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 67.10 1llp h THR 76 CO 0.03 0.16 -0.09 0.40 0.37 0.00 0.00 175.52 176.38 1llp h ILE 77 N 0.86 0.51 -0.69 3.11 2.04 -1.86 -3.37 117.51 118.10 1llp h ILE 77 Ca 0.27 -1.40 -0.07 0.00 1.00 0.00 0.00 64.86 64.65 1llp h ILE 77 Cb 0.01 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 1llp h ILE 77 CO -0.07 0.17 0.16 -0.33 0.00 0.00 0.00 178.15 178.08 1llp h GLU 78 N -1.00 1.12 0.00 2.37 5.08 -0.97 -2.91 114.58 118.27 1llp h GLU 78 Ca -0.01 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1llp h GLU 78 Cb 0.36 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1llp h GLU 78 CO -0.01 1.00 0.00 0.25 -1.00 0.00 0.00 179.01 179.25 1llp n THR 79 N -4.24 0.45 0.71 1.13 -2.24 0.44 -2.14 114.28 108.40 1llp n THR 79 Ca 0.05 0.11 0.13 0.00 -2.27 0.00 0.00 64.05 62.07 1llp n THR 79 Cb 0.27 -0.76 0.34 0.00 -2.10 0.00 0.00 70.33 68.08 1llp n THR 79 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1llp n ALA 80 N -1.38 2.66 -1.92 6.98 0.00 -1.10 -4.49 120.51 121.26 1llp n ALA 80 Ca 0.08 -0.15 -0.41 0.00 0.00 0.00 0.00 53.44 52.95 1llp n ALA 80 Cb 0.20 -1.32 -0.03 0.00 0.00 0.00 0.00 19.45 18.30 1llp n ALA 80 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1llp s PHE 81 N -3.09 3.21 0.28 0.00 0.08 -0.91 -4.94 117.98 112.61 1llp s PHE 81 Ca 0.10 1.28 0.02 0.00 0.12 0.00 0.00 56.93 58.45 1llp s PHE 81 Cb 0.14 -3.62 0.65 0.00 -0.57 0.00 0.00 43.02 39.63 1llp s PHE 81 CO 0.64 -1.85 1.75 1.25 -0.10 0.00 0.00 175.22 176.91 1llp h HIS 82 N 4.79 0.83 0.00 0.36 2.76 -1.89 -0.46 115.15 121.54 1llp h HIS 82 Ca -0.46 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 57.75 1llp h HIS 82 Cb 1.22 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 29.95 1llp h HIS 82 CO 0.60 0.14 0.00 -1.35 -1.30 0.00 0.00 177.93 176.02 1llp h PRO 83 N 0.61 0.00 -0.64 5.26 0.11 -1.90 -2.11 132.00 133.33 1llp h PRO 83 Ca 0.52 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.63 1llp h PRO 83 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1llp h PRO 83 CO -0.41 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.47 1llp n ASN 84 N -2.95 4.73 -4.68 -2.05 3.02 -0.18 -4.99 115.26 108.15 1llp n ASN 84 Ca -0.01 -2.57 -0.43 0.00 -0.03 0.00 0.00 54.58 51.54 1llp n ASN 84 Cb 0.16 -0.60 -0.01 0.00 -0.61 0.00 0.00 39.78 38.72 1llp n ASN 84 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1llp n ILE 85 N 0.84 1.85 0.00 2.41 3.06 -0.80 -1.56 119.36 125.16 1llp n ILE 85 Ca 0.24 -0.46 0.00 0.00 -2.50 0.00 0.00 62.75 60.03 1llp n ILE 85 Cb 0.93 -1.50 0.00 0.00 0.54 0.00 0.00 39.64 39.61 1llp n ILE 85 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1llp n GLY 86 N 1.02 2.47 0.04 4.50 0.00 -1.26 -4.88 105.19 107.07 1llp n GLY 86 Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.22 1llp n GLY 86 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1llp n LEU 87 N 0.00 0.35 -0.32 0.99 4.77 -0.60 -3.13 117.00 119.06 1llp n LEU 87 Ca 0.00 0.48 -0.01 0.00 -0.03 0.00 0.00 56.01 56.45 1llp n LEU 87 Cb 0.00 -0.40 0.12 0.00 -2.33 0.00 0.00 43.42 40.81 1llp n LEU 87 CO 0.00 -0.06 1.22 -2.24 -1.33 0.00 0.00 177.39 174.99 1llp h ASP 88 N 0.00 0.94 0.30 -1.43 2.03 -1.83 0.02 116.42 116.45 1llp h ASP 88 Ca 0.00 -0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 56.18 1llp h ASP 88 Cb 0.60 -0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 38.88 1llp h ASP 88 CO 0.00 0.64 -0.48 -0.33 -1.03 0.00 0.00 179.24 178.04 1llp h GLU 89 N 1.09 0.21 -0.26 4.15 5.08 -1.95 -0.95 114.58 121.95 1llp h GLU 89 Ca 0.36 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.53 1llp h GLU 89 Cb 0.04 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1llp h GLU 89 CO -0.13 0.64 -0.15 0.28 -1.00 0.00 0.00 179.01 178.65 1llp h VAL 90 N 0.17 1.30 -0.52 3.13 2.07 -1.52 -1.80 116.25 119.09 1llp h VAL 90 Ca 0.01 -1.26 -0.03 0.00 0.82 0.00 0.00 66.70 66.24 1llp h VAL 90 Cb 0.91 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 32.22 1llp h VAL 90 CO 0.07 0.39 0.20 0.58 0.02 0.00 0.00 177.57 178.84 1llp h VAL 91 N 0.28 1.22 -0.58 2.57 2.07 -0.91 -1.58 116.25 119.31 1llp h VAL 91 Ca 0.05 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 1llp h VAL 91 Cb 0.67 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 1llp h VAL 91 CO 0.04 0.26 0.36 0.00 0.02 0.00 0.00 177.57 178.25 1llp h ALA 92 N 1.05 1.53 -0.38 1.67 0.00 -1.07 1.00 119.26 123.05 1llp h ALA 92 Ca 0.17 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1llp h ALA 92 Cb 0.21 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1llp h ALA 92 CO -0.01 0.41 -0.03 1.98 0.00 0.00 0.00 179.25 181.60 1llp h MET 93 N 0.80 0.70 0.17 0.00 -1.53 -0.94 -3.34 114.93 110.80 1llp h MET 93 Ca 0.21 -0.24 -0.30 0.00 -3.44 0.00 0.00 59.70 55.93 1llp h MET 93 Cb -0.04 -0.06 0.02 0.00 -0.55 0.00 0.00 31.60 30.97 1llp h MET 93 CO -0.04 0.81 -1.36 1.96 0.14 0.00 0.00 176.91 178.42 1llp h GLN 94 N 0.51 0.37 -0.82 0.39 4.20 -0.71 -3.40 115.11 115.65 1llp h GLN 94 Ca 0.11 -0.63 0.20 0.00 0.06 0.00 0.00 58.65 58.38 1llp h GLN 94 Cb 0.51 0.23 -0.13 0.00 0.30 0.00 0.00 27.48 28.40 1llp h GLN 94 CO 0.03 1.30 0.23 -0.22 -0.67 0.00 0.00 178.83 179.49 1llp h LYS 95 N 0.10 0.26 -0.41 1.46 3.64 -0.94 -1.52 116.57 119.17 1llp h LYS 95 Ca -0.19 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.17 1llp h LYS 95 Cb 2.05 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 33.79 1llp h LYS 95 CO 0.23 0.17 0.22 -1.35 -2.27 0.00 0.00 179.45 176.45 1llp h PRO 96 N 0.26 0.55 -0.30 1.90 0.11 -1.78 -1.63 132.00 131.12 1llp h PRO 96 Ca 0.49 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.48 1llp h PRO 96 Cb 0.91 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.89 1llp h PRO 96 CO -0.58 0.41 -0.12 0.74 -0.21 0.00 0.00 178.00 178.25 1llp h PHE 97 N 0.56 0.53 -0.04 0.65 0.04 -1.53 0.17 116.94 117.32 1llp h PHE 97 Ca 0.15 -0.08 -0.00 0.00 2.80 0.00 0.00 57.97 60.83 1llp h PHE 97 Cb 0.02 -0.14 -0.00 0.00 2.20 0.00 0.00 35.95 38.02 1llp h PHE 97 CO 0.00 0.60 0.01 0.28 -0.60 0.00 0.00 178.31 178.60 1llp h VAL 98 N 0.46 1.22 -0.09 -0.55 2.07 -1.25 -1.90 116.25 116.21 1llp h VAL 98 Ca 0.09 -0.65 0.01 0.00 0.82 0.00 0.00 66.70 66.96 1llp h VAL 98 Cb 0.48 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 1llp h VAL 98 CO 0.03 0.17 0.04 -0.61 0.02 0.00 0.00 177.57 177.22 1llp h GLN 99 N -0.20 0.09 -0.95 1.57 5.75 -1.37 0.06 115.11 120.07 1llp h GLN 99 Ca 0.01 -0.01 0.01 0.00 -0.15 0.00 0.00 58.65 58.52 1llp h GLN 99 Cb 0.28 -0.02 -0.05 0.00 1.07 0.00 0.00 27.48 28.76 1llp h GLN 99 CO 0.00 0.06 0.63 -0.22 -2.65 0.00 0.00 178.83 176.65 1llp h LYS 100 N 0.09 1.23 0.00 1.69 3.64 -0.92 -3.04 116.57 119.27 1llp h LYS 100 Ca 0.04 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1llp h LYS 100 Cb 0.01 -0.28 0.00 0.00 -0.41 0.00 0.00 32.23 31.55 1llp h LYS 100 CO -0.03 0.82 -0.66 0.72 -2.27 0.00 0.00 179.45 178.03 1llp n HIS 101 N -4.40 0.02 -3.29 1.91 8.25 -0.72 -4.98 115.22 112.01 1llp n HIS 101 Ca 0.11 0.01 -0.21 0.00 -0.26 0.00 0.00 57.72 57.37 1llp n HIS 101 Cb 0.03 -0.20 0.06 0.00 1.12 0.00 0.00 29.99 31.00 1llp n HIS 101 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1llp n GLY 102 N 1.49 -0.37 3.85 -1.41 0.00 -0.00 -5.02 105.19 103.72 1llp n GLY 102 Ca 0.05 0.11 -0.21 0.00 0.00 0.00 0.00 46.02 45.96 1llp n GLY 102 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1llp s VAL 103 N -3.23 3.15 0.47 1.61 -7.23 -1.20 -5.08 120.40 108.89 1llp s VAL 103 Ca 0.44 -1.40 -0.19 0.00 -1.81 0.00 0.00 61.98 59.01 1llp s VAL 103 Cb -0.19 -3.10 -0.09 0.00 0.56 0.00 0.00 36.38 33.56 1llp s VAL 103 CO 0.54 -0.11 0.98 0.42 -0.31 0.00 0.00 175.10 176.62 1llp s THR 104 N -2.38 4.27 0.23 5.32 -4.23 -1.26 -4.80 115.64 112.79 1llp s THR 104 Ca 0.43 1.31 -0.07 0.00 -1.18 0.00 0.00 61.69 62.18 1llp s THR 104 Cb -0.04 -3.59 0.21 0.00 1.34 0.00 0.00 72.50 70.42 1llp s THR 104 CO 0.27 -0.41 1.89 -0.65 -0.54 0.00 0.00 174.62 175.18 1llp h PRO 105 N 1.50 1.10 -0.46 3.99 0.11 -1.88 -1.11 132.00 135.25 1llp h PRO 105 Ca -0.48 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 65.52 1llp h PRO 105 Cb 1.19 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 32.03 1llp h PRO 105 CO 0.60 0.73 0.14 0.78 -0.21 0.00 0.00 178.00 180.05 1llp h GLY 106 N 1.14 0.77 1.33 -0.55 0.00 -1.83 -0.98 103.07 102.95 1llp h GLY 106 Ca 0.34 -0.46 -0.08 0.00 0.00 0.00 0.00 47.33 47.14 1llp h GLY 106 CO -0.10 0.43 -0.01 -0.55 0.00 0.00 0.00 176.54 176.31 1llp h ASP 107 N 0.61 0.79 -0.32 0.19 3.32 -1.72 -2.53 116.42 116.76 1llp h ASP 107 Ca 0.15 -0.20 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 1llp h ASP 107 Cb 0.27 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1llp h ASP 107 CO -0.00 0.86 0.05 0.15 -1.72 0.00 0.00 179.24 178.58 1llp h PHE 108 N 0.76 0.56 -0.30 4.55 3.57 -0.92 -0.71 116.94 124.45 1llp h PHE 108 Ca 0.14 -0.08 0.06 0.00 3.53 0.00 0.00 57.97 61.62 1llp h PHE 108 Cb 0.47 -0.16 -0.05 0.00 2.79 0.00 0.00 35.95 39.01 1llp h PHE 108 CO 0.03 0.61 -0.04 0.82 -2.23 0.00 0.00 178.31 177.49 1llp h ILE 109 N 0.36 0.73 -0.91 1.41 2.04 -1.05 0.36 117.51 120.45 1llp h ILE 109 Ca 0.10 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.95 1llp h ILE 109 Cb 0.34 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 1llp h ILE 109 CO 0.01 0.01 0.58 0.00 0.00 0.00 0.00 178.15 178.75 1llp h ALA 110 N 1.28 1.16 0.20 1.87 0.00 -1.33 -1.78 119.26 120.65 1llp h ALA 110 Ca 0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1llp h ALA 110 Cb 0.21 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1llp h ALA 110 CO -0.28 0.58 -0.09 0.35 0.00 0.00 0.00 179.25 179.81 1llp h PHE 111 N 1.24 -0.24 -0.74 0.00 3.57 -0.43 -2.31 116.94 118.04 1llp h PHE 111 Ca 0.33 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.86 1llp h PHE 111 Cb -0.11 0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.67 1llp h PHE 111 CO -0.00 0.09 0.48 0.00 -2.23 0.00 0.00 178.31 176.65 1llp h ALA 112 N 0.11 1.57 -0.52 2.41 0.00 -0.26 0.80 119.26 123.37 1llp h ALA 112 Ca -0.03 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 1llp h ALA 112 Cb 0.44 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1llp h ALA 112 CO 0.04 0.36 -0.13 0.78 0.00 0.00 0.00 179.25 180.30 1llp h GLY 113 N 0.90 1.08 0.92 0.00 0.00 -1.28 0.63 103.07 105.31 1llp h GLY 113 Ca 0.29 -0.89 -0.09 0.00 0.00 0.00 0.00 47.33 46.64 1llp h GLY 113 CO -0.08 0.81 -0.19 0.00 0.00 0.00 0.00 176.54 177.08 1llp h ALA 114 N 0.95 0.40 -0.41 3.60 0.00 -0.81 -2.17 119.26 120.83 1llp h ALA 114 Ca 0.13 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 1llp h ALA 114 Cb 0.70 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1llp h ALA 114 CO 0.05 0.33 -0.02 0.28 0.00 0.00 0.00 179.25 179.90 1llp h VAL 115 N 0.37 1.26 -0.28 0.00 2.07 -0.81 -1.72 116.25 117.14 1llp h VAL 115 Ca 0.06 -1.05 0.06 0.00 0.82 0.00 0.00 66.70 66.59 1llp h VAL 115 Cb 0.73 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 31.57 1llp h VAL 115 CO 0.05 0.35 -0.10 0.00 0.02 0.00 0.00 177.57 177.90 1llp h ALA 116 N 0.88 0.14 -0.82 1.67 0.00 -0.83 -2.15 119.26 118.15 1llp h ALA 116 Ca 0.11 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1llp h ALA 116 Cb 0.50 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 1llp h ALA 116 CO 0.02 -0.49 0.44 -0.07 0.00 0.00 0.00 179.25 179.15 1llp h LEU 117 N -0.04 1.04 -2.40 0.00 3.38 -1.23 -2.09 115.31 113.96 1llp h LEU 117 Ca 0.14 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1llp h LEU 117 Cb 0.25 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1llp h LEU 117 CO -0.31 0.85 -0.01 0.77 0.09 0.00 0.00 178.44 179.83 1llp h SER 118 N 1.15 0.00 0.98 -0.43 4.64 -0.71 -0.89 113.55 118.30 1llp h SER 118 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 1llp h SER 118 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1llp h SER 118 CO -0.04 0.01 -0.13 0.59 -0.87 0.00 0.00 176.83 176.38 1llp n ASN 119 N -3.91 0.27 -4.51 4.97 5.03 -0.79 -4.25 115.26 112.07 1llp n ASN 119 Ca -0.03 0.36 -0.43 0.00 0.87 0.00 0.00 54.58 55.35 1llp n ASN 119 Cb 0.09 -0.38 -0.08 0.00 -1.02 0.00 0.00 39.78 38.39 1llp n ASN 119 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1llp n PRO 121 N 5.83 1.04 0.00 0.00 -0.02 -1.25 -1.49 135.00 139.11 1llp n PRO 121 Ca -0.05 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 1llp n PRO 121 Cb 0.48 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1llp n PRO 121 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1llp n GLY 122 N 1.77 0.94 3.74 -1.23 0.00 0.18 -0.56 105.19 110.02 1llp n GLY 122 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 1llp n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llp s ALA 123 N -2.30 2.14 0.96 4.61 0.00 -0.56 -4.81 121.76 121.80 1llp s ALA 123 Ca 0.00 0.61 -0.12 0.00 0.00 0.00 0.00 51.96 52.45 1llp s ALA 123 Cb 0.00 -3.38 0.17 0.00 0.00 0.00 0.00 23.12 19.90 1llp s ALA 123 CO 0.00 -1.83 1.09 -2.14 0.00 0.00 0.00 175.76 172.88 1llp s PRO 124 N -4.28 0.75 -0.52 0.00 0.02 -1.26 -4.76 135.00 124.94 1llp s PRO 124 Ca 0.68 0.83 -0.28 0.00 0.02 0.00 0.00 61.00 62.25 1llp s PRO 124 Cb -0.23 -1.75 -0.00 0.00 0.02 0.00 0.00 34.50 32.54 1llp s PRO 124 CO 0.48 -2.59 1.61 -1.14 -0.33 0.00 0.00 177.00 175.03 1llp s GLN 125 N -4.84 3.14 0.27 5.54 2.00 -1.26 -4.75 119.66 119.75 1llp s GLN 125 Ca 0.65 0.71 -0.29 0.00 -2.00 0.00 0.00 55.36 54.43 1llp s GLN 125 Cb -0.20 -4.21 -0.09 0.00 0.80 0.00 0.00 33.01 29.32 1llp s GLN 125 CO 0.58 -2.12 0.96 -1.64 -0.50 0.00 0.00 175.29 172.58 1llp s MET 126 N 5.92 4.75 0.45 1.67 -1.94 -1.26 -5.00 119.30 123.90 1llp s MET 126 Ca 0.62 1.49 -0.05 0.00 -1.71 0.00 0.00 55.69 56.05 1llp s MET 126 Cb -0.14 -3.14 -0.04 0.00 2.01 0.00 0.00 34.83 33.53 1llp s MET 126 CO 0.26 0.41 0.74 -0.80 -0.01 0.00 0.00 175.02 175.62 1llp s ASN 127 N -1.25 6.28 -0.21 3.03 0.01 -1.26 -4.82 114.94 116.72 1llp s ASN 127 Ca 0.44 0.86 -0.05 0.00 -0.71 0.00 0.00 52.86 53.40 1llp s ASN 127 Cb -0.25 -2.22 0.11 0.00 0.41 0.00 0.00 41.25 39.30 1llp s ASN 127 CO 0.31 -0.52 0.38 0.12 -1.51 0.00 0.00 177.10 175.88 1llp s PHE 128 N -2.64 -0.76 -0.00 2.20 5.36 -1.26 -4.85 117.98 116.03 1llp s PHE 128 Ca 0.46 1.11 0.05 0.00 -0.96 0.00 0.00 56.93 57.59 1llp s PHE 128 Cb -0.10 0.12 -0.03 0.00 -0.34 0.00 0.00 43.02 42.67 1llp s PHE 128 CO 0.43 -0.58 -0.15 -0.06 -1.46 0.00 0.00 175.22 173.39 1llp s PHE 129 N 2.55 2.65 0.37 10.12 0.40 -1.26 0.29 117.98 133.11 1llp s PHE 129 Ca 0.06 -0.19 0.08 0.00 -0.60 0.00 0.00 56.93 56.27 1llp s PHE 129 Cb -0.14 -1.55 -0.02 0.00 0.51 0.00 0.00 43.02 41.82 1llp s PHE 129 CO -0.14 0.23 0.36 0.95 0.70 0.00 0.00 175.22 177.32 1llp s THR 130 N -0.85 3.22 0.00 0.64 -4.23 0.66 -4.88 115.64 110.19 1llp s THR 130 Ca 0.14 -1.31 0.00 0.00 -1.18 0.00 0.00 61.69 59.34 1llp s THR 130 Cb -0.11 -3.12 0.00 0.00 1.34 0.00 0.00 72.50 70.61 1llp s THR 130 CO 0.04 -0.10 0.00 0.61 -0.54 0.00 0.00 174.62 174.63 1llp n GLY 131 N -1.49 0.14 3.64 3.99 0.00 -1.26 -2.04 105.19 108.18 1llp n GLY 131 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1llp n GLY 131 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1llp s ARG 132 N 0.00 4.08 0.70 1.61 0.52 -1.26 -4.97 118.95 119.63 1llp s ARG 132 Ca 0.00 1.12 -0.13 0.00 -0.52 0.00 0.00 55.73 56.20 1llp s ARG 132 Cb 0.00 -3.74 0.02 0.00 0.52 0.00 0.00 34.95 31.75 1llp s ARG 132 CO 0.00 -0.89 1.10 0.15 0.02 0.00 0.00 175.30 175.68 1llp s LYS 133 N 3.64 2.63 0.30 3.54 1.02 -1.26 -4.51 119.74 125.10 1llp s LYS 133 Ca 0.46 1.27 -0.29 0.00 0.02 0.00 0.00 55.97 57.43 1llp s LYS 133 Cb -0.13 -1.94 -0.13 0.00 -0.52 0.00 0.00 37.83 35.12 1llp s LYS 133 CO 0.15 -1.36 1.30 -2.30 -0.92 0.00 0.00 175.35 172.21 1llp n PRO 134 N -2.84 2.00 -1.63 -1.68 -0.02 -1.26 -4.81 135.00 124.75 1llp n PRO 134 Ca 0.10 0.70 -0.42 0.00 -2.02 0.00 0.00 63.50 61.86 1llp n PRO 134 Cb 0.52 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1llp n PRO 134 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1llp n ALA 135 N 0.88 0.44 0.12 3.55 0.00 -0.64 -4.94 120.51 119.92 1llp n ALA 135 Ca 0.08 0.30 -0.22 0.00 0.00 0.00 0.00 53.44 53.59 1llp n ALA 135 Cb 0.34 -2.12 -0.14 0.00 0.00 0.00 0.00 19.45 17.53 1llp n ALA 135 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1llp h THR 136 N 1.91 1.31 -3.46 0.00 1.35 -1.90 -3.48 112.91 108.63 1llp h THR 136 Ca -0.44 -2.62 -0.05 0.00 -0.55 0.00 0.00 66.41 62.75 1llp h THR 136 Cb 1.32 2.85 -0.12 0.00 -1.73 0.00 0.00 68.15 70.47 1llp h THR 136 CO 0.59 0.79 -0.10 -1.10 -0.25 0.00 0.00 175.52 175.45 1llp s GLN 137 N -2.81 1.17 0.55 4.72 -0.21 -1.26 -5.15 119.66 116.66 1llp s GLN 137 Ca -0.09 -0.84 -0.20 0.00 0.02 0.00 0.00 55.36 54.25 1llp s GLN 137 Cb 0.05 0.46 -0.05 0.00 1.00 0.00 0.00 33.01 34.48 1llp s GLN 137 CO 0.93 -0.46 1.22 -1.25 -2.12 0.00 0.00 175.29 173.61 1llp s PRO 138 N -3.85 3.23 0.62 2.91 0.04 -1.26 -4.76 135.00 131.94 1llp s PRO 138 Ca 0.07 1.88 -0.15 0.00 0.04 0.00 0.00 61.00 62.84 1llp s PRO 138 Cb 0.01 -2.12 -0.02 0.00 0.04 0.00 0.00 34.50 32.41 1llp s PRO 138 CO -0.07 -1.01 1.08 0.00 0.04 0.00 0.00 177.00 177.04 1llp s ALA 139 N -1.53 2.62 0.86 8.56 0.00 -1.26 -4.79 121.76 126.22 1llp s ALA 139 Ca 0.72 0.48 -0.12 0.00 0.00 0.00 0.00 51.96 53.04 1llp s ALA 139 Cb -0.31 -3.27 0.11 0.00 0.00 0.00 0.00 23.12 19.64 1llp s ALA 139 CO 0.36 -1.02 1.13 -1.25 0.00 0.00 0.00 175.76 174.98 1llp s PRO 140 N -4.06 1.55 0.89 0.00 0.04 -1.26 -4.87 135.00 127.28 1llp s PRO 140 Ca 0.65 0.38 -0.13 0.00 0.04 0.00 0.00 61.00 61.94 1llp s PRO 140 Cb -0.18 -1.88 0.15 0.00 0.04 0.00 0.00 34.50 32.63 1llp s PRO 140 CO 0.39 -1.94 1.24 0.34 0.04 0.00 0.00 177.00 177.07 1llp s ASP 141 N -4.06 3.68 0.00 6.66 2.15 -1.26 -4.38 116.67 119.46 1llp s ASP 141 Ca 0.63 0.36 0.00 0.00 0.43 0.00 0.00 52.55 53.96 1llp s ASP 141 Cb -0.14 -0.58 0.00 0.00 -0.30 0.00 0.00 42.92 41.90 1llp s ASP 141 CO 0.53 -2.38 0.00 0.61 -0.17 0.00 0.00 175.17 173.76 1llp n GLY 142 N -3.52 0.46 0.00 2.66 0.00 -1.26 -4.92 105.19 98.61 1llp n GLY 142 Ca 0.13 -0.55 0.05 0.00 0.00 0.00 0.00 46.02 45.65 1llp n GLY 142 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1llp n LEU 143 N 0.00 0.06 -4.59 0.99 4.77 -1.26 -4.95 117.00 112.02 1llp n LEU 143 Ca 0.00 -0.06 -0.36 0.00 -0.03 0.00 0.00 56.01 55.56 1llp n LEU 143 Cb 0.00 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 40.98 1llp n LEU 143 CO 0.00 0.01 -0.22 -0.69 -1.33 0.00 0.00 177.39 175.16 1llp s VAL 144 N -2.61 4.93 0.61 4.08 1.01 -1.26 -4.66 120.40 122.51 1llp s VAL 144 Ca -0.03 0.03 -0.19 0.00 0.00 0.00 0.00 61.98 61.79 1llp s VAL 144 Cb 0.07 -3.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.13 1llp s VAL 144 CO 0.42 0.36 1.31 -2.84 0.00 0.00 0.00 175.10 174.35 1llp s PRO 145 N 1.11 2.75 0.11 2.72 0.02 -1.26 -4.77 135.00 135.68 1llp s PRO 145 Ca 0.06 2.10 0.03 0.00 0.02 0.00 0.00 61.00 63.20 1llp s PRO 145 Cb -0.14 -1.97 -0.04 0.00 0.02 0.00 0.00 34.50 32.37 1llp s PRO 145 CO 0.04 -1.45 0.17 -1.21 -0.33 0.00 0.00 177.00 174.23 1llp s GLU 146 N -3.24 3.17 0.00 5.54 0.41 -1.26 -4.90 118.70 118.42 1llp s GLU 146 Ca 0.79 -0.64 0.14 0.00 -0.41 0.00 0.00 54.97 54.85 1llp s GLU 146 Cb -0.38 -2.85 0.63 0.00 -1.78 0.00 0.00 34.13 29.75 1llp s GLU 146 CO 0.41 0.55 1.44 -0.35 -0.49 0.00 0.00 175.26 176.82 1llp n PRO 147 N 0.00 0.05 -0.14 0.39 -0.04 -1.26 -2.01 135.00 131.99 1llp n PRO 147 Ca -0.07 0.23 0.09 0.00 -0.04 0.00 0.00 63.50 63.71 1llp n PRO 147 Cb 0.53 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.65 1llp n PRO 147 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1llp n PHE 148 N -1.45 0.36 -1.63 0.54 1.16 -1.26 -2.36 117.46 112.82 1llp n PHE 148 Ca 0.04 -0.24 -0.31 0.00 -1.87 0.00 0.00 57.45 55.07 1llp n PHE 148 Cb 0.15 -0.01 0.04 0.00 -1.61 0.00 0.00 39.48 38.06 1llp n PHE 148 CO 0.00 0.00 0.00 -1.01 -1.87 0.00 0.00 176.76 173.88 1llp s HIS 149 N -1.28 3.21 0.61 2.97 3.76 -0.85 -5.00 115.29 118.71 1llp s HIS 149 Ca 0.29 1.40 -0.08 0.00 -0.15 0.00 0.00 55.06 56.52 1llp s HIS 149 Cb 0.17 -2.85 -0.00 0.00 1.11 0.00 0.00 32.58 31.01 1llp s HIS 149 CO 0.24 -1.13 0.95 0.95 -0.85 0.00 0.00 174.74 174.91 1llp s THR 150 N -3.07 3.92 0.21 1.30 -4.23 -1.26 -4.65 115.64 107.86 1llp s THR 150 Ca 0.57 0.27 -0.10 0.00 -1.18 0.00 0.00 61.69 61.26 1llp s THR 150 Cb -0.13 -3.57 0.16 0.00 1.34 0.00 0.00 72.50 70.30 1llp s THR 150 CO 0.55 -0.65 1.87 0.58 -0.54 0.00 0.00 174.62 176.43 1llp h VAL 151 N -0.27 1.16 -0.94 2.29 2.07 -1.96 -1.63 116.25 116.99 1llp h VAL 151 Ca -0.45 -0.34 0.01 0.00 0.82 0.00 0.00 66.70 66.73 1llp h VAL 151 Cb 1.24 0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 1llp h VAL 151 CO 0.62 0.18 0.62 0.44 0.02 0.00 0.00 177.57 179.45 1llp h ASP 152 N 1.00 1.07 -0.44 0.57 3.32 -2.00 -0.96 116.42 118.99 1llp h ASP 152 Ca 0.29 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.27 1llp h ASP 152 Cb -0.07 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.20 1llp h ASP 152 CO -0.08 0.78 0.09 1.56 -1.72 0.00 0.00 179.24 179.86 1llp h GLN 153 N 1.27 0.72 -0.52 3.56 4.20 -1.79 -1.50 115.11 121.05 1llp h GLN 153 Ca 0.34 -0.19 -0.05 0.00 0.06 0.00 0.00 58.65 58.82 1llp h GLN 153 Cb -0.15 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.52 1llp h GLN 153 CO -0.08 0.74 0.15 0.82 -0.67 0.00 0.00 178.83 179.79 1llp h ILE 154 N 0.59 1.24 -0.27 2.54 1.08 -0.90 0.16 117.51 121.95 1llp h ILE 154 Ca 0.14 -0.82 -0.01 0.00 -0.39 0.00 0.00 64.86 63.78 1llp h ILE 154 Cb 0.36 0.78 -0.01 0.00 -3.07 0.00 0.00 36.82 34.87 1llp h ILE 154 CO 0.01 0.30 0.12 0.40 -0.69 0.00 0.00 178.15 178.29 1llp h ILE 155 N 0.72 1.15 -0.75 -0.67 2.04 -1.13 -2.07 117.51 116.81 1llp h ILE 155 Ca 0.17 -0.44 0.05 0.00 1.00 0.00 0.00 64.86 65.64 1llp h ILE 155 Cb 0.30 0.95 -0.05 0.00 -0.74 0.00 0.00 36.82 37.28 1llp h ILE 155 CO -0.00 0.15 0.45 0.00 0.00 0.00 0.00 178.15 178.75 1llp h ALA 156 N 0.98 1.00 -0.10 1.87 0.00 -1.10 -0.84 119.26 121.08 1llp h ALA 156 Ca 0.09 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1llp h ALA 156 Cb 0.13 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1llp h ALA 156 CO -0.01 0.18 0.05 -0.09 0.00 0.00 0.00 179.25 179.38 1llp h ARG 157 N 0.84 0.11 0.00 0.00 9.65 -0.63 -0.53 114.38 123.82 1llp h ARG 157 Ca 0.32 -0.01 -0.11 0.00 -1.10 0.00 0.00 59.98 59.09 1llp h ARG 157 Cb 0.13 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.67 1llp h ARG 157 CO -0.16 0.07 -0.52 -0.39 2.80 0.00 0.00 179.97 181.78 1llp h VAL 158 N 0.11 1.03 -0.29 0.20 -1.51 -1.16 -0.72 116.25 113.90 1llp h VAL 158 Ca 0.04 -2.04 -0.01 0.00 -1.23 0.00 0.00 66.70 63.46 1llp h VAL 158 Cb 0.01 2.22 -0.01 0.00 -2.13 0.00 0.00 31.29 31.38 1llp h VAL 158 CO -0.03 0.50 0.14 0.78 -1.23 0.00 0.00 177.57 177.73 1llp h ASN 159 N 0.00 0.39 0.56 4.19 -0.26 -0.92 -2.37 115.58 117.17 1llp h ASN 159 Ca -0.01 -0.13 -0.03 0.00 -0.56 0.00 0.00 56.30 55.58 1llp h ASN 159 Cb 1.18 -0.10 0.01 0.00 -1.06 0.00 0.00 38.32 38.35 1llp h ASN 159 CO 0.07 0.41 -0.27 -0.78 -1.06 0.00 0.00 177.43 175.80 1llp h ASP 160 N 0.34 -0.64 -0.31 5.81 3.58 -0.92 0.48 116.42 124.76 1llp h ASP 160 Ca 0.10 -0.03 0.07 0.00 0.42 0.00 0.00 57.03 57.59 1llp h ASP 160 Cb 0.13 0.16 -0.08 0.00 1.72 0.00 0.00 39.33 41.27 1llp h ASP 160 CO -0.01 -0.35 -0.22 0.00 -2.88 0.00 0.00 179.24 175.78 1llp h ALA 161 N -0.57 -0.03 0.00 -0.78 0.00 -1.12 -3.36 119.26 113.39 1llp h ALA 161 Ca -0.08 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1llp h ALA 161 Cb 0.63 0.49 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1llp h ALA 161 CO 0.13 -0.62 -0.40 0.41 0.00 0.00 0.00 179.25 178.76 1llp n GLY 162 N -1.37 0.04 3.34 0.00 0.00 -0.93 -4.81 105.19 101.46 1llp n GLY 162 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1llp n GLY 162 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1llp n GLU 163 N 0.00 -4.40 -2.74 1.61 1.02 0.16 -4.96 120.64 111.33 1llp n GLU 163 Ca 0.00 0.65 -0.38 0.00 -0.02 0.00 0.00 57.16 57.41 1llp n GLU 163 Cb 0.66 -5.46 -0.06 0.00 -0.02 0.00 0.00 31.44 26.56 1llp n GLU 163 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1llp s PHE 164 N -3.09 3.74 0.67 -0.32 0.08 -0.96 -4.93 117.98 113.17 1llp s PHE 164 Ca 0.42 1.81 -0.02 0.00 0.12 0.00 0.00 56.93 59.25 1llp s PHE 164 Cb -0.21 -2.97 0.08 0.00 -0.57 0.00 0.00 43.02 39.35 1llp s PHE 164 CO 0.51 0.18 0.93 0.16 -0.10 0.00 0.00 175.22 176.91 1llp s ASP 165 N -1.45 4.73 0.53 1.36 1.47 -1.26 -3.57 116.67 118.48 1llp s ASP 165 Ca 0.48 -0.02 0.28 0.00 1.18 0.00 0.00 52.55 54.47 1llp s ASP 165 Cb -0.22 -0.59 1.48 0.00 -0.34 0.00 0.00 42.92 43.25 1llp s ASP 165 CO 0.27 -1.58 2.07 1.05 0.68 0.00 0.00 175.17 177.66 1llp h GLU 166 N -0.38 0.00 -0.13 2.11 4.11 -1.97 -2.09 114.58 116.23 1llp h GLU 166 Ca -0.41 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 58.95 1llp h GLU 166 Cb 1.29 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 1llp h GLU 166 CO 0.49 0.11 -0.22 -0.07 0.07 0.00 0.00 179.01 179.39 1llp h LEU 167 N 0.00 0.42 -1.89 3.06 3.38 -1.94 -3.10 115.31 115.24 1llp h LEU 167 Ca -0.00 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 57.43 1llp h LEU 167 Cb 0.34 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1llp h LEU 167 CO 0.01 0.88 0.08 -0.33 0.09 0.00 0.00 178.44 179.18 1llp h GLU 168 N -0.03 0.15 -0.22 1.13 5.08 -1.84 -0.90 114.58 117.95 1llp h GLU 168 Ca 0.01 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1llp h GLU 168 Cb 0.80 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 1llp h GLU 168 CO 0.05 0.10 0.08 1.25 -1.00 0.00 0.00 179.01 179.50 1llp h LEU 169 N 0.16 0.11 -0.55 1.33 5.85 -1.32 -0.47 115.31 120.41 1llp h LEU 169 Ca 0.05 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1llp h LEU 169 Cb -0.00 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 1llp h LEU 169 CO -0.01 0.09 0.31 0.58 -0.34 0.00 0.00 178.44 179.07 1llp h VAL 170 N 0.19 1.18 -0.36 1.05 2.07 -1.15 -2.68 116.25 116.56 1llp h VAL 170 Ca 0.09 -0.46 0.04 0.00 0.82 0.00 0.00 66.70 67.19 1llp h VAL 170 Cb 0.05 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 1llp h VAL 170 CO -0.08 0.20 0.13 -0.50 0.02 0.00 0.00 177.57 177.33 1llp h TRP 171 N 0.74 0.23 0.00 1.57 6.55 -0.82 -1.97 115.95 122.25 1llp h TRP 171 Ca 0.20 0.02 -0.02 0.00 0.95 0.00 0.00 58.89 60.03 1llp h TRP 171 Cb 0.04 -0.05 -0.00 0.00 -0.86 0.00 0.00 29.16 28.29 1llp h TRP 171 CO -0.01 0.10 -0.09 0.00 -1.05 0.00 0.00 178.44 177.38 1llp h MET 172 N 0.28 0.00 0.00 0.49 -0.00 -0.88 -1.49 114.93 113.33 1llp h MET 172 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.86 1llp h MET 172 Cb 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.73 1llp h MET 172 CO -0.16 0.09 0.00 1.28 -0.00 0.00 0.00 176.91 178.13 1llp n LEU 173 N -3.37 0.00 0.22 -0.10 4.77 -0.74 -2.64 117.00 115.13 1llp n LEU 173 Ca -0.01 0.26 0.17 0.00 -0.03 0.00 0.00 56.01 56.40 1llp n LEU 173 Cb 0.27 -0.26 0.83 0.00 -2.33 0.00 0.00 43.42 41.93 1llp n LEU 173 CO 0.29 -0.11 1.14 0.28 -1.33 0.00 0.00 177.39 177.66 1llp h SER 174 N 0.00 0.00 0.03 -1.43 0.02 -1.25 -0.76 113.55 110.17 1llp h SER 174 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1llp h SER 174 Cb 0.15 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 1llp h SER 174 CO 0.00 0.00 -0.00 0.00 -1.14 0.00 0.00 176.83 175.69 1llp h ALA 175 N 1.81 1.16 0.00 3.77 0.00 -1.73 0.82 119.26 125.09 1llp h ALA 175 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1llp h ALA 175 Cb 0.40 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1llp h ALA 175 CO -0.00 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.97 1llp n HIS 176 N -3.32 0.00 0.48 0.00 -0.00 -0.29 -2.04 115.22 110.05 1llp n HIS 176 Ca -0.03 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.82 1llp n HIS 176 Cb 0.08 -0.23 0.46 0.00 -0.00 0.00 0.00 29.99 30.30 1llp n HIS 176 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1llp h SER 177 N 0.00 0.00 -2.07 0.41 0.87 -1.03 -3.31 113.55 108.43 1llp h SER 177 Ca 0.00 0.00 -0.56 0.00 -1.23 0.00 0.00 61.79 60.00 1llp h SER 177 Cb 0.11 0.00 -0.40 0.00 -0.44 0.00 0.00 62.40 61.67 1llp h SER 177 CO 0.00 0.00 -0.97 1.33 -0.53 0.00 0.00 176.83 176.66 1llp n VAL 178 N -2.31 0.41 -3.48 2.23 0.24 -0.86 -4.18 118.33 110.38 1llp n VAL 178 Ca 0.03 -4.53 -0.13 0.00 -2.04 0.00 0.00 64.34 57.67 1llp n VAL 178 Cb 0.32 -1.62 -0.03 0.00 -1.47 0.00 0.00 33.84 31.03 1llp n VAL 178 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1llp s ALA 179 N -1.91 -1.71 0.15 2.33 0.00 -1.25 -4.64 121.76 114.73 1llp s ALA 179 Ca 0.38 0.91 -0.02 0.00 0.00 0.00 0.00 51.96 53.24 1llp s ALA 179 Cb 0.21 0.42 -0.04 0.00 0.00 0.00 0.00 23.12 23.71 1llp s ALA 179 CO -0.08 -0.60 0.09 0.00 0.00 0.00 0.00 175.76 175.17 1llp s ALA 180 N -2.67 0.83 -0.19 0.00 0.00 -1.26 -1.70 121.76 116.77 1llp s ALA 180 Ca -0.02 -1.45 0.01 0.00 0.00 0.00 0.00 51.96 50.49 1llp s ALA 180 Cb -0.01 0.96 0.02 0.00 0.00 0.00 0.00 23.12 24.10 1llp s ALA 180 CO -0.04 -0.52 -0.19 0.08 0.00 0.00 0.00 175.76 175.09 1llp s VAL 181 N -4.06 2.12 -0.08 0.00 1.01 0.25 -4.89 120.40 114.74 1llp s VAL 181 Ca 0.26 -0.99 0.20 0.00 0.00 0.00 0.00 61.98 61.46 1llp s VAL 181 Cb 0.07 -1.92 -0.30 0.00 0.00 0.00 0.00 36.38 34.23 1llp s VAL 181 CO 0.03 0.49 0.34 0.59 0.00 0.00 0.00 175.10 176.55 1llp n ASN 182 N 4.61 0.12 -0.00 3.32 3.02 -1.26 -1.22 115.26 123.84 1llp n ASN 182 Ca -0.20 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.35 1llp n ASN 182 Cb 0.49 1.65 0.00 0.00 -0.61 0.00 0.00 39.78 41.31 1llp n ASN 182 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1llp n ASP 183 N -2.40 1.21 -0.02 6.41 8.00 -1.26 -4.46 116.55 124.03 1llp n ASP 183 Ca -0.13 -1.21 -0.20 0.00 0.71 0.00 0.00 54.79 53.96 1llp n ASP 183 Cb 0.75 -0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.72 1llp n ASP 183 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1llp h VAL 184 N 0.02 1.26 -3.64 2.53 2.07 -1.90 -3.43 116.25 113.17 1llp h VAL 184 Ca 0.00 -2.38 -0.67 0.00 0.82 0.00 0.00 66.70 64.47 1llp h VAL 184 Cb 0.11 2.86 -0.18 0.00 -1.52 0.00 0.00 31.29 32.56 1llp h VAL 184 CO 0.00 0.62 -0.30 -0.62 0.02 0.00 0.00 177.57 177.29 1llp s ASP 185 N -6.82 6.16 0.07 0.57 -1.08 -1.26 -4.77 116.67 109.54 1llp s ASP 185 Ca -0.20 -0.37 0.15 0.00 -0.52 0.00 0.00 52.55 51.62 1llp s ASP 185 Cb 0.02 -2.19 0.65 0.00 -1.46 0.00 0.00 42.92 39.95 1llp s ASP 185 CO 0.73 -0.37 1.48 -0.81 0.52 0.00 0.00 175.17 176.72 1llp n PRO 186 N 5.37 0.05 0.03 4.34 -0.04 -1.26 -2.69 135.00 140.80 1llp n PRO 186 Ca -0.09 0.33 0.11 0.00 -0.04 0.00 0.00 63.50 63.81 1llp n PRO 186 Cb 0.49 -1.60 0.02 0.00 -0.04 0.00 0.00 33.50 32.37 1llp n PRO 186 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1llp n THR 187 N -1.69 0.18 -3.71 0.52 -2.24 -1.26 -4.94 114.28 101.14 1llp n THR 187 Ca 0.03 -0.25 -0.13 0.00 -2.27 0.00 0.00 64.05 61.42 1llp n THR 187 Cb 0.16 0.19 -0.09 0.00 -2.10 0.00 0.00 70.33 68.49 1llp n THR 187 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1llp s VAL 188 N -3.20 0.01 -0.11 2.28 0.11 -1.10 -5.06 120.40 113.32 1llp s VAL 188 Ca 0.03 -0.04 -0.02 0.00 -2.93 0.00 0.00 61.98 59.02 1llp s VAL 188 Cb 0.14 -0.65 -0.03 0.00 -1.53 0.00 0.00 36.38 34.32 1llp s VAL 188 CO 0.80 -0.02 -0.04 -1.10 -3.33 0.00 0.00 175.10 171.41 1llp s GLN 189 N 0.04 3.19 0.00 1.54 -0.21 -1.26 -4.54 119.66 118.42 1llp s GLN 189 Ca -0.02 -0.50 0.00 0.00 0.02 0.00 0.00 55.36 54.86 1llp s GLN 189 Cb -0.03 -2.77 0.00 0.00 1.00 0.00 0.00 33.01 31.21 1llp s GLN 189 CO 0.01 0.50 0.00 0.41 -2.12 0.00 0.00 175.29 174.09 1llp n GLY 190 N 2.75 1.46 3.67 3.09 0.00 -0.36 -4.57 105.19 111.22 1llp n GLY 190 Ca -0.18 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 1llp n GLY 190 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1llp s LEU 191 N 0.00 4.22 0.71 0.99 1.43 -0.85 -0.79 118.68 124.39 1llp s LEU 191 Ca 0.00 1.77 -0.13 0.00 -1.03 0.00 0.00 54.13 54.74 1llp s LEU 191 Cb 0.00 -3.54 0.02 0.00 0.03 0.00 0.00 46.19 42.70 1llp s LEU 191 CO 0.00 -0.72 1.10 -2.84 0.23 0.00 0.00 176.35 174.11 1llp s PRO 192 N 3.16 2.57 0.28 1.29 0.02 -1.25 -0.58 135.00 140.50 1llp s PRO 192 Ca 0.56 1.28 0.19 0.00 0.02 0.00 0.00 61.00 63.05 1llp s PRO 192 Cb -0.23 -1.93 0.11 0.00 0.02 0.00 0.00 34.50 32.46 1llp s PRO 192 CO 0.18 -1.41 1.34 0.74 -0.33 0.00 0.00 177.00 177.51 1llp h PHE 193 N -0.49 0.00 -4.60 6.54 0.04 -1.55 -1.79 116.94 115.09 1llp h PHE 193 Ca -0.45 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.06 1llp h PHE 193 Cb 1.24 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 39.24 1llp h PHE 193 CO 0.56 0.28 -0.61 0.16 -0.60 0.00 0.00 178.31 178.10 1llp s ASP 194 N -6.11 0.24 0.00 2.17 1.47 -1.26 -4.80 116.67 108.38 1llp s ASP 194 Ca 0.03 -1.41 0.26 0.00 1.18 0.00 0.00 52.55 52.61 1llp s ASP 194 Cb 0.07 0.39 1.38 0.00 -0.34 0.00 0.00 42.92 44.42 1llp s ASP 194 CO 0.74 -0.85 1.88 -1.54 0.68 0.00 0.00 175.17 176.08 1llp n SER 195 N -0.35 0.00 -3.16 2.11 3.41 -1.26 -3.92 113.62 110.46 1llp n SER 195 Ca 0.02 -0.29 -0.24 0.00 -0.26 0.00 0.00 58.87 58.10 1llp n SER 195 Cb 0.66 -0.21 -0.05 0.00 -0.26 0.00 0.00 64.21 64.35 1llp n SER 195 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1llp n THR 196 N -1.21 1.39 0.25 6.66 -2.24 -1.26 -4.95 114.28 112.92 1llp n THR 196 Ca 0.14 -4.97 0.11 0.00 -2.27 0.00 0.00 64.05 57.07 1llp n THR 196 Cb 0.17 -1.34 0.53 0.00 -2.10 0.00 0.00 70.33 67.59 1llp n THR 196 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1llp n PRO 197 N 0.42 0.15 -0.11 -0.78 -0.04 -1.25 -0.97 135.00 132.42 1llp n PRO 197 Ca 0.27 0.55 0.12 0.00 -0.04 0.00 0.00 63.50 64.40 1llp n PRO 197 Cb 0.49 -1.91 0.23 0.00 -0.04 0.00 0.00 33.50 32.27 1llp n PRO 197 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1llp n GLY 198 N -0.81 1.20 2.92 0.55 0.00 -1.26 -4.06 105.19 103.73 1llp n GLY 198 Ca -0.00 -0.66 -0.23 0.00 0.00 0.00 0.00 46.02 45.13 1llp n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1llp s ILE 199 N -1.70 0.78 -0.82 -0.61 -1.09 -0.14 -3.88 121.20 113.73 1llp s ILE 199 Ca 0.35 -0.23 -0.26 0.00 -2.23 0.00 0.00 60.65 58.28 1llp s ILE 199 Cb 0.21 -0.79 0.04 0.00 -1.58 0.00 0.00 42.46 40.34 1llp s ILE 199 CO 0.30 0.29 1.32 0.12 -1.23 0.00 0.00 174.94 175.75 1llp s PHE 200 N 1.10 2.37 0.03 3.97 5.36 0.27 -4.60 117.98 126.48 1llp s PHE 200 Ca -0.08 -0.30 0.00 0.00 -0.96 0.00 0.00 56.93 55.60 1llp s PHE 200 Cb -0.14 -4.64 -0.00 0.00 -0.34 0.00 0.00 43.02 37.90 1llp s PHE 200 CO -0.01 -2.03 0.03 -0.40 -1.46 0.00 0.00 175.22 171.36 1llp n ASP 201 N 9.18 -0.09 -1.58 6.13 5.68 -1.26 -4.41 116.55 130.20 1llp n ASP 201 Ca 0.12 -1.21 0.08 0.00 -0.50 0.00 0.00 54.79 53.28 1llp n ASP 201 Cb 0.50 0.19 0.34 0.00 -1.14 0.00 0.00 41.12 41.01 1llp n ASP 201 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1llp n SER 202 N -2.64 4.70 -0.04 -1.12 7.64 -1.26 -4.39 113.62 116.51 1llp n SER 202 Ca 0.01 -2.54 0.03 0.00 1.01 0.00 0.00 58.87 57.37 1llp n SER 202 Cb 0.06 -0.59 0.37 0.00 -1.01 0.00 0.00 64.21 63.04 1llp n SER 202 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1llp h GLN 203 N 3.76 0.63 -0.81 1.43 1.08 -1.93 -1.30 115.11 117.97 1llp h GLN 203 Ca 0.00 -0.05 0.10 0.00 -1.45 0.00 0.00 58.65 57.24 1llp h GLN 203 Cb 1.51 -0.13 -0.07 0.00 -0.05 0.00 0.00 27.48 28.73 1llp h GLN 203 CO 0.29 0.45 0.46 0.35 -0.95 0.00 0.00 178.83 179.42 1llp h PHE 204 N 0.64 0.83 -0.11 2.96 3.57 -1.87 0.63 116.94 123.59 1llp h PHE 204 Ca 0.17 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.57 1llp h PHE 204 Cb -0.01 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.46 1llp h PHE 204 CO 0.00 0.33 -0.50 0.74 -2.23 0.00 0.00 178.31 176.65 1llp h PHE 205 N 0.77 0.37 0.17 0.41 0.04 -1.59 -2.48 116.94 114.62 1llp h PHE 205 Ca 0.40 -0.12 -0.01 0.00 2.80 0.00 0.00 57.97 61.04 1llp h PHE 205 Cb 0.37 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.45 1llp h PHE 205 CO -0.07 0.74 -0.08 0.28 -0.60 0.00 0.00 178.31 178.59 1llp h VAL 206 N 0.24 0.87 -0.00 -0.55 2.07 -0.78 -3.33 116.25 114.76 1llp h VAL 206 Ca 0.01 -1.09 -0.10 0.00 0.82 0.00 0.00 66.70 66.34 1llp h VAL 206 Cb 0.97 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.16 1llp h VAL 206 CO 0.08 0.22 -0.46 -0.33 0.02 0.00 0.00 177.57 177.10 1llp h GLU 207 N -0.83 0.01 0.00 1.57 5.08 -0.92 -1.54 114.58 117.95 1llp h GLU 207 Ca -0.02 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1llp h GLU 207 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1llp h GLU 207 CO 0.04 0.47 0.00 0.25 -1.00 0.00 0.00 179.01 178.77 1llp n THR 208 N -3.99 0.72 0.39 1.13 -2.24 -0.94 -2.84 114.28 106.52 1llp n THR 208 Ca -0.02 0.07 0.12 0.00 -2.27 0.00 0.00 64.05 61.95 1llp n THR 208 Cb 0.48 -0.93 0.20 0.00 -2.10 0.00 0.00 70.33 67.98 1llp n THR 208 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1llp h GLN 209 N 0.00 0.00 -7.05 -0.78 5.75 -1.38 -3.46 115.11 108.18 1llp h GLN 209 Ca 0.00 0.00 -0.52 0.00 -0.15 0.00 0.00 58.65 57.98 1llp h GLN 209 Cb 0.47 0.00 0.09 0.00 1.07 0.00 0.00 27.48 29.11 1llp h GLN 209 CO 0.00 0.00 0.48 -0.06 -2.65 0.00 0.00 178.83 176.60 1llp s PHE 210 N -3.20 2.62 0.32 3.99 0.08 -1.13 -0.99 117.98 119.67 1llp s PHE 210 Ca 0.06 1.51 -0.29 0.00 0.12 0.00 0.00 56.93 58.33 1llp s PHE 210 Cb 0.10 -3.43 -0.12 0.00 -0.57 0.00 0.00 43.02 39.00 1llp s PHE 210 CO 0.69 -1.87 1.54 -2.13 -0.10 0.00 0.00 175.22 173.34 1llp n ARG 211 N -1.05 2.65 -2.69 0.44 0.63 0.59 -4.69 116.66 112.54 1llp n ARG 211 Ca 0.10 0.94 -0.42 0.00 -0.92 0.00 0.00 57.85 57.55 1llp n ARG 211 Cb 0.49 -2.69 -0.03 0.00 0.45 0.00 0.00 32.46 30.68 1llp n ARG 211 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1llp s GLY 212 N 0.25 2.58 0.00 5.14 0.00 -1.26 -3.95 107.32 110.07 1llp s GLY 212 Ca 0.60 0.45 0.00 0.00 0.00 0.00 0.00 44.72 45.77 1llp s GLY 212 CO 0.54 1.83 0.00 -1.30 0.00 0.00 0.00 173.10 174.17 1llp n THR 213 N 4.28 0.00 -4.00 0.90 -2.24 0.57 -4.85 114.28 108.95 1llp n THR 213 Ca 0.08 -0.23 -0.10 0.00 -2.27 0.00 0.00 64.05 61.53 1llp n THR 213 Cb 0.50 0.82 -0.06 0.00 -2.10 0.00 0.00 70.33 69.49 1llp n THR 213 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1llp s LEU 214 N -1.37 0.52 -0.16 3.22 0.05 -0.70 -4.98 118.68 115.26 1llp s LEU 214 Ca 0.00 -0.94 -0.07 0.00 0.05 0.00 0.00 54.13 53.17 1llp s LEU 214 Cb 0.00 1.52 -0.04 0.00 -2.05 0.00 0.00 46.19 45.62 1llp s LEU 214 CO 0.00 -1.05 0.06 -0.36 -0.55 0.00 0.00 176.35 174.45 1llp s PHE 215 N -4.01 3.27 0.39 3.48 0.08 -1.26 -0.77 117.98 119.15 1llp s PHE 215 Ca 0.22 0.13 0.16 0.00 0.12 0.00 0.00 56.93 57.56 1llp s PHE 215 Cb 0.01 -2.03 0.95 0.00 -0.57 0.00 0.00 43.02 41.38 1llp s PHE 215 CO 0.07 0.25 1.92 -1.00 -0.10 0.00 0.00 175.22 176.35 1llp h PRO 216 N 6.34 0.00 0.00 0.24 0.13 -1.87 -3.45 132.00 133.39 1llp h PRO 216 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1llp h PRO 216 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1llp h PRO 216 CO 0.67 0.26 0.00 0.41 -0.23 0.00 0.00 178.00 179.12 1llp n GLY 217 N -0.64 2.39 3.93 1.56 0.00 -1.26 -4.56 105.19 106.61 1llp n GLY 217 Ca -0.02 -0.26 -0.25 0.00 0.00 0.00 0.00 46.02 45.49 1llp n GLY 217 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1llp s SER 218 N 1.00 5.94 0.35 1.61 1.04 -1.26 -5.11 113.70 117.27 1llp s SER 218 Ca 0.00 0.55 0.04 0.00 0.48 0.00 0.00 55.95 57.03 1llp s SER 218 Cb 0.00 -1.81 0.04 0.00 0.10 0.00 0.00 66.02 64.35 1llp s SER 218 CO 0.00 -0.69 0.35 0.61 0.98 0.00 0.00 173.24 174.49 1llp n GLY 219 N -2.19 2.50 3.17 7.32 0.00 -1.26 -4.80 105.19 109.93 1llp n GLY 219 Ca 0.01 -2.23 -0.22 0.00 0.00 0.00 0.00 46.02 43.58 1llp n GLY 219 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1llp n GLY 220 N 0.76 -0.47 3.51 -0.02 0.00 -1.26 -5.01 105.19 102.69 1llp n GLY 220 Ca 0.03 0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 1llp n GLY 220 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1llp s ASN 221 N -2.94 5.01 0.23 1.61 0.01 -1.26 -5.07 114.94 112.52 1llp s ASN 221 Ca 0.40 -0.11 -0.32 0.00 -0.71 0.00 0.00 52.86 52.12 1llp s ASN 221 Cb -0.17 -1.84 -0.12 0.00 0.41 0.00 0.00 41.25 39.52 1llp s ASN 221 CO 0.49 0.12 1.65 1.67 -1.51 0.00 0.00 177.10 179.52 1llp n GLN 222 N 3.86 2.66 -0.10 -0.60 7.27 -1.26 -1.70 117.38 127.51 1llp n GLN 222 Ca -0.17 0.95 0.00 0.00 0.07 0.00 0.00 57.00 57.85 1llp n GLN 222 Cb 0.52 -2.76 0.00 0.00 2.41 0.00 0.00 30.24 30.41 1llp n GLN 222 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1llp n GLY 223 N 3.23 1.32 3.71 1.69 0.00 -1.26 -4.91 105.19 108.97 1llp n GLY 223 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 1llp n GLY 223 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1llp s GLU 224 N -0.51 3.02 0.41 1.61 2.12 -0.69 -0.63 118.70 124.03 1llp s GLU 224 Ca 0.00 -0.40 0.03 0.00 0.36 0.00 0.00 54.97 54.97 1llp s GLU 224 Cb 0.00 -2.83 -0.03 0.00 0.26 0.00 0.00 34.13 31.53 1llp s GLU 224 CO 0.00 0.70 0.09 0.14 -0.54 0.00 0.00 175.26 175.65 1llp s VAL 225 N -0.92 0.86 0.52 3.70 -7.23 -0.62 -4.76 120.40 111.95 1llp s VAL 225 Ca 0.14 -2.00 -0.19 0.00 -1.81 0.00 0.00 61.98 58.12 1llp s VAL 225 Cb -0.11 -2.43 -0.07 0.00 0.56 0.00 0.00 36.38 34.33 1llp s VAL 225 CO 0.03 0.00 1.08 -1.61 -0.31 0.00 0.00 175.10 174.29 1llp s GLU 226 N -3.78 3.55 0.36 4.82 2.02 -1.26 -4.16 118.70 120.25 1llp s GLU 226 Ca 0.24 1.44 0.03 0.00 0.02 0.00 0.00 54.97 56.70 1llp s GLU 226 Cb 0.04 -2.05 0.03 0.00 0.10 0.00 0.00 34.13 32.25 1llp s GLU 226 CO 0.13 -0.65 0.26 -1.13 0.02 0.00 0.00 175.26 173.89 1llp n SER 227 N -1.25 2.16 -0.55 -0.19 3.41 0.05 -4.46 113.62 112.79 1llp n SER 227 Ca 0.10 -2.24 0.05 0.00 -0.26 0.00 0.00 58.87 56.52 1llp n SER 227 Cb 0.52 -0.02 0.13 0.00 -0.26 0.00 0.00 64.21 64.58 1llp n SER 227 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1llp n GLY 228 N 0.66 2.80 2.83 5.00 0.00 -1.25 -0.32 105.19 114.91 1llp n GLY 228 Ca -0.02 -0.33 -0.15 0.00 0.00 0.00 0.00 46.02 45.53 1llp n GLY 228 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1llp s MET 229 N -1.00 0.13 0.34 1.61 -1.94 -1.26 -4.90 119.30 112.28 1llp s MET 229 Ca 0.20 0.07 -0.29 0.00 -1.71 0.00 0.00 55.69 53.96 1llp s MET 229 Cb 0.10 -0.28 -0.12 0.00 2.01 0.00 0.00 34.83 36.54 1llp s MET 229 CO 0.14 -0.09 1.41 0.00 -0.01 0.00 0.00 175.02 176.47 1llp n ALA 230 N 3.77 1.83 0.00 3.03 0.00 -1.26 -1.88 120.51 126.00 1llp n ALA 230 Ca -0.22 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1llp n ALA 230 Cb 0.53 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.64 1llp n ALA 230 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1llp n GLY 231 N 0.94 2.61 3.63 0.00 0.00 -1.26 -1.01 105.19 110.10 1llp n GLY 231 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 1llp n GLY 231 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1llp s GLU 232 N -0.24 3.97 0.19 1.61 2.12 -0.79 -3.85 118.70 121.73 1llp s GLU 232 Ca 0.00 -0.34 -0.02 0.00 0.36 0.00 0.00 54.97 54.97 1llp s GLU 232 Cb 0.00 -3.23 -0.05 0.00 0.26 0.00 0.00 34.13 31.12 1llp s GLU 232 CO 0.00 0.26 0.40 -1.50 -0.54 0.00 0.00 175.26 173.88 1llp s ILE 233 N 0.41 5.18 -0.03 -3.70 2.07 -0.67 -4.49 121.20 119.97 1llp s ILE 233 Ca 0.03 -0.23 0.03 0.00 -1.41 0.00 0.00 60.65 59.07 1llp s ILE 233 Cb -0.12 -3.71 0.00 0.00 0.13 0.00 0.00 42.46 38.76 1llp s ILE 233 CO 0.00 -0.13 -0.11 -0.60 -1.91 0.00 0.00 174.94 172.19 1llp s ARG 234 N -3.18 1.12 0.18 3.50 3.52 -1.26 -4.53 118.95 118.30 1llp s ARG 234 Ca 0.40 -0.36 0.05 0.00 -0.13 0.00 0.00 55.73 55.68 1llp s ARG 234 Cb -0.11 -1.02 -0.04 0.00 -1.56 0.00 0.00 34.95 32.22 1llp s ARG 234 CO 0.28 0.14 0.22 0.96 -0.81 0.00 0.00 175.30 176.09 1llp s ILE 235 N 0.16 4.83 0.23 4.11 -4.36 -1.26 -1.59 121.20 123.31 1llp s ILE 235 Ca -0.03 -1.00 -0.07 0.00 -0.26 0.00 0.00 60.65 59.29 1llp s ILE 235 Cb -0.09 -3.52 0.19 0.00 1.25 0.00 0.00 42.46 40.30 1llp s ILE 235 CO 0.01 -0.17 1.84 -0.61 0.24 0.00 0.00 174.94 176.25 1llp h GLN 236 N 2.03 0.87 -0.37 0.37 4.15 -0.89 -0.98 115.11 120.29 1llp h GLN 236 Ca -0.49 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 58.87 1llp h GLN 236 Cb 1.21 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 28.69 1llp h GLN 236 CO 0.64 0.57 0.19 1.79 -1.93 0.00 0.00 178.83 180.09 1llp h THR 237 N 0.89 1.16 -0.50 2.39 1.35 -1.73 0.35 112.91 116.81 1llp h THR 237 Ca 0.35 -0.43 -0.06 0.00 -0.55 0.00 0.00 66.41 65.72 1llp h THR 237 Cb 0.17 0.77 -0.02 0.00 -1.73 0.00 0.00 68.15 67.35 1llp h THR 237 CO -0.17 0.17 0.08 0.44 -0.25 0.00 0.00 175.52 175.79 1llp h ASP 238 N 0.46 0.80 -0.28 5.36 3.32 -1.82 0.24 116.42 124.50 1llp h ASP 238 Ca 0.13 -0.26 0.02 0.00 0.02 0.00 0.00 57.03 56.94 1llp h ASP 238 Cb 0.10 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 1llp h ASP 238 CO -0.02 0.85 0.14 -0.74 -1.72 0.00 0.00 179.24 177.75 1llp h HIS 239 N 0.71 0.26 -0.14 4.55 2.76 -0.98 -2.12 115.15 120.19 1llp h HIS 239 Ca 0.15 0.01 -0.19 0.00 -2.20 0.00 0.00 60.37 58.15 1llp h HIS 239 Cb 0.39 -0.08 -0.00 0.00 1.55 0.00 0.00 27.41 29.28 1llp h HIS 239 CO 0.03 0.14 -0.67 1.79 -1.30 0.00 0.00 177.93 177.92 1llp h THR 240 N 0.29 1.33 -0.27 6.26 1.35 -0.75 -2.97 112.91 118.15 1llp h THR 240 Ca 0.12 -1.96 -0.03 0.00 -0.55 0.00 0.00 66.41 63.98 1llp h THR 240 Cb 0.04 1.94 -0.02 0.00 -1.73 0.00 0.00 68.15 68.38 1llp h THR 240 CO -0.08 0.61 0.02 -0.07 -0.25 0.00 0.00 175.52 175.75 1llp h LEU 241 N 0.41 0.37 -1.05 3.87 3.38 -0.87 0.12 115.31 121.53 1llp h LEU 241 Ca -0.02 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1llp h LEU 241 Cb 1.25 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1llp h LEU 241 CO 0.13 0.42 0.00 0.00 0.09 0.00 0.00 178.44 179.07 1llp h ALA 242 N 1.64 1.00 0.00 1.53 0.00 -1.22 -3.26 119.26 118.95 1llp h ALA 242 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1llp h ALA 242 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1llp h ALA 242 CO 0.00 0.00 -0.59 0.54 0.00 0.00 0.00 179.25 179.21 1llp n ARG 243 N -2.75 3.55 -2.30 0.00 1.74 -0.62 -4.50 116.66 111.79 1llp n ARG 243 Ca 0.02 -0.02 -0.41 0.00 -0.77 0.00 0.00 57.85 56.67 1llp n ARG 243 Cb 0.30 -0.89 -0.03 0.00 -1.02 0.00 0.00 32.46 30.81 1llp n ARG 243 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1llp s ASP 244 N -1.92 6.99 0.59 0.55 -1.08 0.31 -4.82 116.67 117.30 1llp s ASP 244 Ca 0.01 2.32 0.32 0.00 -0.52 0.00 0.00 52.55 54.68 1llp s ASP 244 Cb 0.04 -2.61 1.87 0.00 -1.46 0.00 0.00 42.92 40.76 1llp s ASP 244 CO 0.25 -0.44 2.25 0.77 0.52 0.00 0.00 175.17 178.52 1llp h SER 245 N 5.22 0.00 -0.20 -0.34 4.64 -1.90 0.24 113.55 121.21 1llp h SER 245 Ca -0.45 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.73 1llp h SER 245 Cb 1.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1llp h SER 245 CO 0.75 0.02 -0.37 0.03 -0.87 0.00 0.00 176.83 176.39 1llp h ARG 246 N 0.00 0.73 0.00 4.77 3.08 -1.94 -3.38 114.38 117.64 1llp h ARG 246 Ca -0.00 -0.36 0.00 0.00 0.07 0.00 0.00 59.98 59.69 1llp h ARG 246 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 1llp h ARG 246 CO 0.00 0.98 -0.41 0.25 -1.07 0.00 0.00 179.97 179.72 1llp n THR 247 N -4.05 0.00 -0.18 2.04 -2.24 -0.76 -4.80 114.28 104.29 1llp n THR 247 Ca -0.02 -0.34 -0.01 0.00 -2.27 0.00 0.00 64.05 61.42 1llp n THR 247 Cb 0.51 0.89 0.08 0.00 -2.10 0.00 0.00 70.33 69.72 1llp n THR 247 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1llp h ALA 248 N 0.66 0.59 -0.31 6.98 0.00 -0.61 0.44 119.26 127.00 1llp h ALA 248 Ca 0.00 0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1llp h ALA 248 Cb 0.14 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1llp h ALA 248 CO 0.00 -0.34 -0.11 0.00 0.00 0.00 0.00 179.25 178.80 1llp h GLU 250 N 0.48 0.95 -0.08 0.00 4.57 -1.66 -0.64 114.58 118.19 1llp h GLU 250 Ca 0.09 -0.46 0.02 0.00 -1.18 0.00 0.00 59.36 57.83 1llp h GLU 250 Cb 0.48 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.05 1llp h GLU 250 CO 0.03 1.12 -0.05 2.35 -1.18 0.00 0.00 179.01 181.28 1llp h TRP 251 N 0.78 -0.13 0.00 0.92 2.91 -0.63 -2.52 115.95 117.28 1llp h TRP 251 Ca 0.08 0.01 -0.06 0.00 1.13 0.00 0.00 58.89 60.05 1llp h TRP 251 Cb 0.90 0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 29.61 1llp h TRP 251 CO 0.06 -0.08 -0.30 0.37 -1.03 0.00 0.00 178.44 177.45 1llp h GLN 252 N -0.06 0.00 0.00 2.65 4.15 -1.02 -3.12 115.11 117.72 1llp h GLN 252 Ca 0.05 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1llp h GLN 252 Cb 0.13 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.82 1llp h GLN 252 CO -0.11 0.30 0.09 0.66 -1.93 0.00 0.00 178.83 177.84 1llp h SER 253 N 0.00 0.00 1.17 -0.69 4.64 -0.65 -1.14 113.55 116.88 1llp h SER 253 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1llp h SER 253 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1llp h SER 253 CO 0.04 0.00 -0.43 -0.26 -0.87 0.00 0.00 176.83 175.31 1llp h PHE 254 N 0.00 0.00 -2.50 4.77 0.04 -1.64 -3.41 116.94 114.19 1llp h PHE 254 Ca 0.00 0.00 -0.53 0.00 2.80 0.00 0.00 57.97 60.24 1llp h PHE 254 Cb 0.18 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.34 1llp h PHE 254 CO 0.00 0.00 1.14 0.08 -0.60 0.00 0.00 178.31 178.93 1llp s VAL 255 N -3.18 3.03 -1.57 -0.55 1.01 -0.43 -1.68 120.40 117.02 1llp s VAL 255 Ca 0.07 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.28 1llp s VAL 255 Cb 0.12 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.34 1llp s VAL 255 CO 0.69 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.39 1llp n GLY 256 N 4.31 1.39 2.53 4.51 0.00 -1.26 -4.94 105.19 111.73 1llp n GLY 256 Ca 0.18 -0.31 -0.27 0.00 0.00 0.00 0.00 46.02 45.62 1llp n GLY 256 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1llp n ASN 257 N -0.47 0.56 -0.27 1.61 2.85 -0.68 -4.95 115.26 113.91 1llp n ASN 257 Ca -0.15 -2.63 -0.06 0.00 -0.11 0.00 0.00 54.58 51.63 1llp n ASN 257 Cb 0.51 -0.61 0.06 0.00 1.24 0.00 0.00 39.78 40.97 1llp n ASN 257 CO 0.00 0.00 0.00 -0.61 -2.11 0.00 0.00 177.26 174.54 1llp h GLN 258 N 5.51 1.09 -0.69 1.20 4.15 -1.92 -2.24 115.11 122.21 1llp h GLN 258 Ca 0.23 -0.18 -0.07 0.00 0.77 0.00 0.00 58.65 59.40 1llp h GLN 258 Cb 0.86 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 28.34 1llp h GLN 258 CO 0.48 0.87 0.15 0.66 -1.93 0.00 0.00 178.83 179.06 1llp h SER 259 N 1.06 1.07 -0.28 -0.69 4.64 -1.96 -1.09 113.55 116.30 1llp h SER 259 Ca 0.25 -0.24 -0.03 0.00 -0.47 0.00 0.00 61.79 61.30 1llp h SER 259 Cb 0.17 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 61.96 1llp h SER 259 CO -0.03 1.03 0.04 0.50 -0.87 0.00 0.00 176.83 177.51 1llp h LYS 260 N 1.05 0.46 0.02 4.77 3.64 -1.93 -0.52 116.57 124.07 1llp h LYS 260 Ca 0.22 -0.12 0.03 0.00 -1.27 0.00 0.00 60.65 59.50 1llp h LYS 260 Cb 0.39 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.12 1llp h LYS 260 CO 0.01 0.58 -0.19 1.25 -2.27 0.00 0.00 179.45 178.82 1llp h LEU 261 N 0.28 -0.56 -0.15 5.20 5.85 -1.18 -1.64 115.31 123.11 1llp h LEU 261 Ca 0.08 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 1llp h LEU 261 Cb 0.34 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1llp h LEU 261 CO 0.01 -0.26 -0.01 0.58 -0.34 0.00 0.00 178.44 178.42 1llp h VAL 262 N -0.32 1.26 -0.43 1.05 2.07 -1.11 -1.92 116.25 116.85 1llp h VAL 262 Ca 0.05 -0.87 -0.05 0.00 0.82 0.00 0.00 66.70 66.66 1llp h VAL 262 Cb 0.39 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 1llp h VAL 262 CO -0.17 0.26 0.07 0.44 0.02 0.00 0.00 177.57 178.19 1llp h ASP 263 N 0.00 0.68 -0.43 0.57 3.32 -1.05 -1.20 116.42 118.31 1llp h ASP 263 Ca 0.04 -0.26 -0.06 0.00 0.02 0.00 0.00 57.03 56.78 1llp h ASP 263 Cb 0.39 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 1llp h ASP 263 CO 0.01 0.76 0.04 0.44 -1.72 0.00 0.00 179.24 178.77 1llp h ASP 264 N 0.56 0.72 -0.33 6.45 3.32 -1.34 -2.83 116.42 122.97 1llp h ASP 264 Ca 0.13 -0.28 -0.12 0.00 0.02 0.00 0.00 57.03 56.78 1llp h ASP 264 Cb 0.37 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1llp h ASP 264 CO 0.01 0.82 -0.21 0.15 -1.72 0.00 0.00 179.24 178.28 1llp h PHE 265 N 0.59 0.93 -0.57 4.55 3.57 -1.28 -0.54 116.94 124.19 1llp h PHE 265 Ca 0.13 -0.21 0.07 0.00 3.53 0.00 0.00 57.97 61.49 1llp h PHE 265 Cb 0.43 -0.22 -0.06 0.00 2.79 0.00 0.00 35.95 38.89 1llp h PHE 265 CO 0.03 0.96 0.24 0.37 -2.23 0.00 0.00 178.31 177.68 1llp h GLN 266 N 0.71 0.44 0.68 1.11 4.15 -1.19 0.65 115.11 121.66 1llp h GLN 266 Ca 0.10 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.46 1llp h GLN 266 Cb 0.74 -0.10 0.01 0.00 0.21 0.00 0.00 27.48 28.34 1llp h GLN 266 CO 0.06 0.29 -0.33 0.35 -1.93 0.00 0.00 178.83 177.27 1llp h PHE 267 N 0.45 -0.84 -0.41 3.99 3.57 -1.23 -2.69 116.94 119.78 1llp h PHE 267 Ca 0.28 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.69 1llp h PHE 267 Cb 0.28 0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.28 1llp h PHE 267 CO -0.14 -0.49 -0.03 0.97 -2.23 0.00 0.00 178.31 176.39 1llp h ILE 268 N -1.04 1.23 -0.24 1.41 6.09 -0.94 -1.59 117.51 122.42 1llp h ILE 268 Ca -0.09 -0.97 -0.01 0.00 -1.37 0.00 0.00 64.86 62.43 1llp h ILE 268 Cb 0.73 0.95 -0.01 0.00 0.47 0.00 0.00 36.82 38.96 1llp h ILE 268 CO 0.15 0.33 0.13 0.15 -3.07 0.00 0.00 178.15 175.84 1llp h PHE 269 N 0.63 0.34 -0.51 2.19 3.57 -0.89 -0.56 116.94 121.71 1llp h PHE 269 Ca 0.12 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.65 1llp h PHE 269 Cb 0.44 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.03 1llp h PHE 269 CO 0.02 0.30 0.27 1.25 -2.23 0.00 0.00 178.31 177.92 1llp h LEU 270 N 0.27 0.39 -0.56 0.59 5.85 -1.18 -2.22 115.31 118.46 1llp h LEU 270 Ca 0.08 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.89 1llp h LEU 270 Cb 0.08 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.01 1llp h LEU 270 CO -0.01 0.27 0.27 0.00 -0.34 0.00 0.00 178.44 178.63 1llp h ALA 271 N 1.26 0.72 -0.45 1.25 0.00 -0.97 -2.04 119.26 119.03 1llp h ALA 271 Ca 0.22 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.20 1llp h ALA 271 Cb 0.11 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1llp h ALA 271 CO -0.14 -0.09 0.22 -0.07 0.00 0.00 0.00 179.25 179.18 1llp h LEU 272 N 0.52 0.32 -0.29 0.00 3.38 -0.65 -1.66 115.31 116.93 1llp h LEU 272 Ca 0.26 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1llp h LEU 272 Cb 0.20 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1llp h LEU 272 CO -0.19 0.23 0.00 0.35 0.09 0.00 0.00 178.44 178.92 1llp n THR 273 N -4.91 1.15 0.22 0.22 -2.24 -0.82 -2.10 114.28 105.79 1llp n THR 273 Ca 0.03 0.33 0.08 0.00 -2.27 0.00 0.00 64.05 62.22 1llp n THR 273 Cb 0.12 -1.19 0.14 0.00 -2.10 0.00 0.00 70.33 67.30 1llp n THR 273 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1llp n GLN 274 N -1.74 2.01 -1.78 -0.78 6.02 -0.64 -4.77 117.38 115.69 1llp n GLN 274 Ca 0.02 -1.87 -0.42 0.00 -0.01 0.00 0.00 57.00 54.72 1llp n GLN 274 Cb 0.14 -1.35 -0.02 0.00 1.02 0.00 0.00 30.24 30.03 1llp n GLN 274 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1llp s LEU 275 N -1.18 4.36 0.00 1.08 1.43 -0.89 -1.50 118.68 121.97 1llp s LEU 275 Ca 0.26 2.88 0.00 0.00 -1.03 0.00 0.00 54.13 56.24 1llp s LEU 275 Cb 0.15 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.76 1llp s LEU 275 CO 0.21 -0.92 0.00 0.61 0.23 0.00 0.00 176.35 176.48 1llp n GLY 276 N 3.01 0.53 3.51 -3.19 0.00 -1.26 -0.67 105.19 107.12 1llp n GLY 276 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 1llp n GLY 276 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1llp s GLN 277 N -0.17 1.74 -0.38 1.61 -1.52 -0.56 -4.91 119.66 115.47 1llp s GLN 277 Ca 0.00 -1.86 -0.11 0.00 -1.95 0.00 0.00 55.36 51.44 1llp s GLN 277 Cb 0.00 -1.69 0.03 0.00 -0.22 0.00 0.00 33.01 31.13 1llp s GLN 277 CO 0.00 0.21 0.21 0.34 -0.25 0.00 0.00 175.29 175.80 1llp s ASP 278 N -3.56 5.73 0.38 5.90 2.15 -1.26 -4.96 116.67 121.05 1llp s ASP 278 Ca 0.31 -1.04 0.16 0.00 0.43 0.00 0.00 52.55 52.41 1llp s ASP 278 Cb -0.00 -2.02 1.04 0.00 -0.30 0.00 0.00 42.92 41.63 1llp s ASP 278 CO 0.15 -0.40 1.79 -0.65 -0.17 0.00 0.00 175.17 175.89 1llp h PRO 279 N 8.44 0.45 0.00 4.34 0.11 -1.96 0.18 132.00 143.55 1llp h PRO 279 Ca -0.25 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.82 1llp h PRO 279 Cb 1.10 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 1llp h PRO 279 CO 0.68 0.30 -0.04 -0.91 -0.21 0.00 0.00 178.00 177.81 1llp h ASN 280 N 0.46 0.00 -0.46 -2.05 2.35 -2.02 -2.04 115.58 111.82 1llp h ASN 280 Ca 0.57 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.32 1llp h ASN 280 Cb 1.34 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.71 1llp h ASN 280 CO -0.29 0.04 0.00 0.00 -1.65 0.00 0.00 177.43 175.53 1llp n ALA 281 N -2.15 2.42 -2.87 -0.83 0.00 0.61 -4.96 120.51 112.73 1llp n ALA 281 Ca -0.01 -0.99 -0.24 0.00 0.00 0.00 0.00 53.44 52.20 1llp n ALA 281 Cb 0.21 -0.93 -0.04 0.00 0.00 0.00 0.00 19.45 18.69 1llp n ALA 281 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1llp s MET 282 N -1.40 3.13 -0.15 0.00 -1.94 -0.77 -4.87 119.30 113.30 1llp s MET 282 Ca 0.40 -0.85 -0.05 0.00 -1.71 0.00 0.00 55.69 53.47 1llp s MET 282 Cb 0.22 -2.73 -0.04 0.00 2.01 0.00 0.00 34.83 34.29 1llp s MET 282 CO 0.30 0.45 0.04 0.99 -0.01 0.00 0.00 175.02 176.79 1llp s THR 283 N -1.92 4.58 -0.35 2.05 2.01 -0.86 -4.92 115.64 116.23 1llp s THR 283 Ca 0.33 -0.12 -0.27 0.00 0.31 0.00 0.00 61.69 61.93 1llp s THR 283 Cb -0.09 -3.01 0.02 0.00 0.01 0.00 0.00 72.50 69.42 1llp s THR 283 CO 0.26 0.52 1.00 -0.62 -0.69 0.00 0.00 174.62 175.09 1llp s ASP 284 N -0.09 6.78 -0.18 3.53 2.15 -1.26 -0.25 116.67 127.36 1llp s ASP 284 Ca 0.06 0.78 0.14 0.00 0.43 0.00 0.00 52.55 53.96 1llp s ASP 284 Cb -0.12 -2.50 0.37 0.00 -0.30 0.00 0.00 42.92 40.37 1llp s ASP 284 CO 0.01 -0.89 1.20 0.00 -0.17 0.00 0.00 175.17 175.33 1llp h SER 286 N 0.60 0.00 0.26 0.00 0.02 -1.67 -1.72 113.55 111.04 1llp h SER 286 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1llp h SER 286 Cb 1.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.58 1llp h SER 286 CO 0.02 0.00 0.00 -0.90 -1.14 0.00 0.00 176.83 174.81 1llp n ASP 287 N -4.02 0.00 0.08 3.07 5.68 -1.26 -2.31 116.55 117.80 1llp n ASP 287 Ca -0.00 -0.15 -0.01 0.00 -0.50 0.00 0.00 54.79 54.13 1llp n ASP 287 Cb 0.21 -0.21 -0.05 0.00 -1.14 0.00 0.00 41.12 39.93 1llp n ASP 287 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 1llp h VAL 288 N 0.00 0.88 -3.14 2.12 2.07 -1.69 -3.47 116.25 113.02 1llp h VAL 288 Ca 0.00 -2.37 -0.53 0.00 0.82 0.00 0.00 66.70 64.62 1llp h VAL 288 Cb 0.13 2.36 0.01 0.00 -1.52 0.00 0.00 31.29 32.27 1llp h VAL 288 CO 0.00 0.50 0.63 -0.63 0.02 0.00 0.00 177.57 178.09 1llp s ILE 289 N -2.88 3.70 0.66 4.57 -1.09 -0.98 -4.97 121.20 120.20 1llp s ILE 289 Ca 0.01 1.23 -0.17 0.00 -2.23 0.00 0.00 60.65 59.49 1llp s ILE 289 Cb 0.08 -3.79 -0.02 0.00 -1.58 0.00 0.00 42.46 37.15 1llp s ILE 289 CO 0.78 0.11 0.97 -2.65 -1.23 0.00 0.00 174.94 172.92 1llp n PRO 290 N 3.80 0.73 -2.01 2.79 -0.02 -1.26 -4.93 135.00 134.10 1llp n PRO 290 Ca 0.10 0.30 -0.41 0.00 -2.02 0.00 0.00 63.50 61.46 1llp n PRO 290 Cb 0.45 -2.20 -0.02 0.00 -0.02 0.00 0.00 33.50 31.70 1llp n PRO 290 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1llp s LEU 291 N -2.56 4.39 0.55 2.45 1.43 -1.26 -4.82 118.68 118.86 1llp s LEU 291 Ca 0.76 2.73 -0.19 0.00 -1.03 0.00 0.00 54.13 56.39 1llp s LEU 291 Cb -0.38 -3.64 -0.05 0.00 0.03 0.00 0.00 46.19 42.15 1llp s LEU 291 CO 0.48 -0.68 1.14 -0.44 0.23 0.00 0.00 176.35 177.08 1llp s SER 292 N 0.03 5.66 0.12 2.29 0.01 -1.26 -4.97 113.70 115.58 1llp s SER 292 Ca 0.55 2.19 -0.08 0.00 1.31 0.00 0.00 55.95 59.92 1llp s SER 292 Cb -0.42 -2.58 -0.06 0.00 0.21 0.00 0.00 66.02 63.17 1llp s SER 292 CO 0.49 -1.26 0.42 -0.54 0.41 0.00 0.00 173.24 172.76 1llp s LYS 293 N -3.31 3.73 0.70 12.44 1.02 -1.26 -4.98 119.74 128.08 1llp s LYS 293 Ca 0.73 0.12 -0.11 0.00 0.02 0.00 0.00 55.97 56.73 1llp s LYS 293 Cb -0.24 -2.90 0.01 0.00 -0.52 0.00 0.00 37.83 34.18 1llp s LYS 293 CO 0.28 0.49 1.06 -1.25 -0.92 0.00 0.00 175.35 175.01 1llp s PRO 294 N -2.26 2.92 0.09 -1.68 0.04 -1.26 0.47 135.00 133.32 1llp s PRO 294 Ca 0.38 0.97 -0.31 0.00 0.04 0.00 0.00 61.00 62.07 1llp s PRO 294 Cb -0.13 -1.99 -0.07 0.00 0.04 0.00 0.00 34.50 32.36 1llp s PRO 294 CO 0.20 -1.11 1.27 0.42 0.04 0.00 0.00 177.00 177.82 1llp s ILE 295 N -3.03 3.73 0.73 0.56 1.01 -1.26 -4.33 121.20 118.61 1llp s ILE 295 Ca 0.58 1.26 -0.12 0.00 0.00 0.00 0.00 60.65 62.38 1llp s ILE 295 Cb -0.14 -3.81 0.03 0.00 0.01 0.00 0.00 42.46 38.56 1llp s ILE 295 CO 0.55 0.11 1.09 -2.16 0.00 0.00 0.00 174.94 174.52 1llp s PRO 296 N 0.94 2.50 0.85 2.79 0.04 -1.26 -4.87 135.00 135.99 1llp s PRO 296 Ca 0.60 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.82 1llp s PRO 296 Cb -0.32 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.29 1llp s PRO 296 CO 0.30 -1.45 0.00 0.41 0.04 0.00 0.00 177.00 176.30 1llp n GLY 297 N -1.19 -1.82 1.45 0.56 0.00 -1.26 -4.71 105.19 98.23 1llp n GLY 297 Ca 0.09 -1.65 0.02 0.00 0.00 0.00 0.00 46.02 44.48 1llp n GLY 297 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1llp n ASN 298 N 0.33 0.66 -3.66 1.61 6.94 -1.26 -5.09 115.26 114.79 1llp n ASN 298 Ca 0.00 -2.00 -0.30 0.00 -0.02 0.00 0.00 54.58 52.25 1llp n ASN 298 Cb 0.00 -0.20 0.24 0.00 -2.36 0.00 0.00 39.78 37.47 1llp n ASN 298 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1llp s GLY 299 N -1.87 1.65 0.63 4.83 0.00 -1.26 -5.00 107.32 106.29 1llp s GLY 299 Ca 0.28 -1.16 -0.16 0.00 0.00 0.00 0.00 44.72 43.69 1llp s GLY 299 CO -0.14 -0.23 1.10 2.56 0.00 0.00 0.00 173.10 176.39 1llp s PRO 300 N -5.63 3.01 0.11 2.90 0.04 -1.26 -4.96 135.00 129.21 1llp s PRO 300 Ca 0.73 1.37 -0.18 0.00 0.04 0.00 0.00 61.00 62.97 1llp s PRO 300 Cb -0.06 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 1llp s PRO 300 CO 0.55 -1.08 1.66 0.35 0.04 0.00 0.00 177.00 178.51 1llp h PHE 301 N 0.30 0.46 -3.81 0.56 3.57 -1.96 -3.43 116.94 112.63 1llp h PHE 301 Ca -0.47 -0.03 -0.68 0.00 3.53 0.00 0.00 57.97 60.31 1llp h PHE 301 Cb 1.24 -0.14 -0.20 0.00 2.79 0.00 0.00 35.95 39.64 1llp h PHE 301 CO 0.55 0.45 -0.83 -1.12 -2.23 0.00 0.00 178.31 175.13 1llp s SER 302 N -5.73 3.66 0.25 0.41 0.01 -1.26 -4.73 113.70 106.31 1llp s SER 302 Ca -0.13 -0.62 -0.21 0.00 1.31 0.00 0.00 55.95 56.29 1llp s SER 302 Cb 0.09 -0.42 0.03 0.00 0.21 0.00 0.00 66.02 65.92 1llp s SER 302 CO 0.73 0.18 0.70 0.72 0.41 0.00 0.00 173.24 175.99 1llp s PHE 303 N -1.10 -0.26 -0.16 2.43 -0.12 -1.26 -4.60 117.98 112.92 1llp s PHE 303 Ca 0.16 -0.15 -0.15 0.00 -0.05 0.00 0.00 56.93 56.73 1llp s PHE 303 Cb -0.10 0.68 -0.04 0.00 -0.63 0.00 0.00 43.02 42.92 1llp s PHE 303 CO 0.08 -1.16 0.36 -0.06 -0.05 0.00 0.00 175.22 174.40 1llp s PHE 304 N -3.88 3.45 0.85 3.49 0.08 0.72 -4.97 117.98 117.72 1llp s PHE 304 Ca 0.09 0.67 -0.12 0.00 0.12 0.00 0.00 56.93 57.70 1llp s PHE 304 Cb -0.05 -2.44 0.11 0.00 -0.57 0.00 0.00 43.02 40.07 1llp s PHE 304 CO 0.03 0.16 1.16 -2.14 -0.10 0.00 0.00 175.22 174.34 1llp s PRO 305 N 0.71 1.46 0.19 0.24 0.02 -1.26 -0.69 135.00 135.67 1llp s PRO 305 Ca 0.19 1.60 -0.32 0.00 0.02 0.00 0.00 61.00 62.49 1llp s PRO 305 Cb -0.14 -1.77 -0.15 0.00 0.02 0.00 0.00 34.50 32.46 1llp s PRO 305 CO 0.06 -2.31 1.22 -2.30 -0.33 0.00 0.00 177.00 173.34 1llp n PRO 306 N -3.71 1.39 -0.51 5.54 -0.02 -1.25 -1.44 135.00 135.00 1llp n PRO 306 Ca 0.12 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1llp n PRO 306 Cb 0.51 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 1llp n PRO 306 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1llp n GLY 307 N 2.04 0.99 3.46 -1.23 0.00 -1.25 -4.07 105.19 105.13 1llp n GLY 307 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 1llp n GLY 307 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1llp s LYS 308 N -0.38 1.64 0.31 1.61 -0.14 -0.52 -4.94 119.74 117.31 1llp s LYS 308 Ca 0.00 -1.48 -0.06 0.00 -1.36 0.00 0.00 55.97 53.07 1llp s LYS 308 Cb 0.00 -1.91 0.00 0.00 -1.68 0.00 0.00 37.83 34.24 1llp s LYS 308 CO 0.00 0.40 0.47 -1.54 -0.76 0.00 0.00 175.35 173.93 1llp s SER 309 N -2.74 0.49 0.57 2.83 1.04 -1.26 -4.71 113.70 109.92 1llp s SER 309 Ca 0.22 -1.29 0.27 0.00 0.48 0.00 0.00 55.95 55.64 1llp s SER 309 Cb -0.08 0.63 1.56 0.00 0.10 0.00 0.00 66.02 68.24 1llp s SER 309 CO 0.11 -1.25 2.06 -0.74 0.98 0.00 0.00 173.24 174.41 1llp h HIS 310 N 2.18 0.00 0.00 5.02 2.76 -1.96 0.10 115.15 123.26 1llp h HIS 310 Ca -0.28 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.89 1llp h HIS 310 Cb 1.24 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.20 1llp h HIS 310 CO 1.07 0.00 0.00 -1.13 -1.30 0.00 0.00 177.93 176.57 1llp n SER 311 N -3.94 0.00 0.04 3.26 3.41 -1.26 -2.52 113.62 112.60 1llp n SER 311 Ca 0.03 0.35 0.13 0.00 -0.26 0.00 0.00 58.87 59.13 1llp n SER 311 Cb 0.40 -0.44 0.43 0.00 -0.26 0.00 0.00 64.21 64.34 1llp n SER 311 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1llp n ASP 312 N -1.44 0.42 -4.73 4.04 8.00 0.36 -4.86 116.55 118.34 1llp n ASP 312 Ca 0.06 0.35 -0.41 0.00 0.71 0.00 0.00 54.79 55.50 1llp n ASP 312 Cb 0.22 -0.38 -0.04 0.00 -0.02 0.00 0.00 41.12 40.91 1llp n ASP 312 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1llp s ILE 313 N -3.05 3.89 -0.55 0.53 -1.09 -1.05 -0.30 121.20 119.58 1llp s ILE 313 Ca 0.11 1.53 -0.16 0.00 -2.23 0.00 0.00 60.65 59.90 1llp s ILE 313 Cb 0.16 -3.98 0.13 0.00 -1.58 0.00 0.00 42.46 37.19 1llp s ILE 313 CO 0.60 0.21 0.53 -1.61 -1.23 0.00 0.00 174.94 173.45 1llp s GLU 314 N 0.10 3.01 0.04 2.79 2.02 -0.16 -4.83 118.70 121.67 1llp s GLU 314 Ca 0.53 -1.69 -0.30 0.00 0.02 0.00 0.00 54.97 53.53 1llp s GLU 314 Cb -0.30 -4.30 -0.07 0.00 0.10 0.00 0.00 34.13 29.56 1llp s GLU 314 CO 0.33 -1.35 1.58 -1.14 0.02 0.00 0.00 175.26 174.70 1llp s GLN 315 N 1.69 4.22 0.00 1.61 2.00 -1.26 -4.88 119.66 123.03 1llp s GLN 315 Ca 0.04 2.21 0.00 0.00 -2.00 0.00 0.00 55.36 55.61 1llp s GLN 315 Cb -0.29 -3.62 0.00 0.00 0.80 0.00 0.00 33.01 29.90 1llp s GLN 315 CO 0.03 -0.70 0.00 0.00 -0.50 0.00 0.00 175.29 174.12 1llp n ALA 316 N 5.66 1.67 -2.42 1.58 0.00 -1.26 -4.97 120.51 120.76 1llp n ALA 316 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.16 1llp n ALA 316 Cb 0.42 0.13 -0.02 0.00 0.00 0.00 0.00 19.45 19.97 1llp n ALA 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1llp h ALA 318 N 9.99 1.16 0.00 0.00 0.00 -1.96 -3.31 119.26 125.13 1llp h ALA 318 Ca -0.26 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1llp h ALA 318 Cb 1.09 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1llp h ALA 318 CO 1.08 0.53 -0.56 0.39 0.00 0.00 0.00 179.25 180.70 1llp n GLU 319 N -4.17 0.19 -3.69 0.00 4.71 -1.26 -4.82 120.64 111.60 1llp n GLU 319 Ca 0.01 0.06 -0.13 0.00 -0.01 0.00 0.00 57.16 57.08 1llp n GLU 319 Cb 0.35 -1.62 -0.13 0.00 -1.01 0.00 0.00 31.44 29.02 1llp n GLU 319 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 1llp s THR 320 N -3.11 -0.25 0.48 2.62 2.01 -1.25 -5.15 115.64 110.99 1llp s THR 320 Ca 0.08 0.24 -0.21 0.00 0.31 0.00 0.00 61.69 62.11 1llp s THR 320 Cb 0.15 -0.39 -0.08 0.00 0.01 0.00 0.00 72.50 72.18 1llp s THR 320 CO 0.70 0.10 1.06 -2.16 -0.69 0.00 0.00 174.62 173.63 1llp s PRO 321 N 1.95 3.80 0.22 4.92 0.05 -1.26 -4.60 135.00 140.09 1llp s PRO 321 Ca -0.03 1.44 -0.32 0.00 0.05 0.00 0.00 61.00 62.15 1llp s PRO 321 Cb -0.11 -2.18 -0.12 0.00 0.05 0.00 0.00 34.50 32.14 1llp s PRO 321 CO -0.08 -0.44 1.66 0.34 0.05 0.00 0.00 177.00 178.53 1llp n PHE 322 N -0.83 2.67 -1.29 0.56 -0.00 -1.26 -4.91 117.46 112.40 1llp n PHE 322 Ca 0.09 0.14 -0.35 0.00 -0.00 0.00 0.00 57.45 57.32 1llp n PHE 322 Cb 0.52 -2.63 0.10 0.00 -0.00 0.00 0.00 39.48 37.46 1llp n PHE 322 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 1llp n PRO 323 N 3.44 0.41 -2.76 -7.13 -0.02 -1.26 -4.95 135.00 122.73 1llp n PRO 323 Ca 0.15 0.20 -0.43 0.00 -2.02 0.00 0.00 63.50 61.40 1llp n PRO 323 Cb 0.34 -2.24 -0.03 0.00 -0.02 0.00 0.00 33.50 31.55 1llp n PRO 323 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1llp s SER 324 N -1.73 6.56 0.28 2.55 0.01 -1.26 -5.02 113.70 115.08 1llp s SER 324 Ca 0.72 0.27 0.07 0.00 1.31 0.00 0.00 55.95 58.33 1llp s SER 324 Cb -0.33 -2.48 -0.03 0.00 0.21 0.00 0.00 66.02 63.39 1llp s SER 324 CO 0.51 -1.08 0.20 -0.76 0.41 0.00 0.00 173.24 172.52 1llp s LEU 325 N 3.90 3.67 0.57 2.44 1.43 -1.26 -5.11 118.68 124.32 1llp s LEU 325 Ca 0.40 -0.38 -0.15 0.00 -1.03 0.00 0.00 54.13 52.97 1llp s LEU 325 Cb -0.10 -2.22 -0.05 0.00 0.03 0.00 0.00 46.19 43.86 1llp s LEU 325 CO 0.27 -0.12 1.03 0.68 0.23 0.00 0.00 176.35 178.43 1llp s VAL 326 N -2.21 4.18 -0.19 -1.59 -7.23 -1.26 -4.74 120.40 107.36 1llp s VAL 326 Ca 0.35 0.99 -0.09 0.00 -1.81 0.00 0.00 61.98 61.42 1llp s VAL 326 Cb -0.07 -3.55 -0.05 0.00 0.56 0.00 0.00 36.38 33.27 1llp s VAL 326 CO 0.25 -0.65 0.12 -0.89 -0.31 0.00 0.00 175.10 173.62 1llp s THR 327 N -2.61 5.30 0.35 5.32 2.01 -1.26 -0.20 115.64 124.55 1llp s THR 327 Ca 0.61 0.15 -0.27 0.00 0.31 0.00 0.00 61.69 62.49 1llp s THR 327 Cb -0.13 -3.40 -0.09 0.00 0.01 0.00 0.00 72.50 68.89 1llp s THR 327 CO 0.37 0.46 1.17 -0.76 -0.69 0.00 0.00 174.62 175.17 1llp s LEU 328 N 0.21 4.34 0.62 4.42 1.43 0.14 -4.93 118.68 124.90 1llp s LEU 328 Ca 0.08 2.36 -0.16 0.00 -1.03 0.00 0.00 54.13 55.38 1llp s LEU 328 Cb -0.11 -3.85 -0.02 0.00 0.03 0.00 0.00 46.19 42.23 1llp s LEU 328 CO -0.01 -0.48 1.09 -2.16 0.23 0.00 0.00 176.35 175.02 1llp s PRO 329 N -1.97 3.08 0.00 1.29 0.04 -1.26 -3.76 135.00 132.41 1llp s PRO 329 Ca 0.52 1.37 0.00 0.00 0.04 0.00 0.00 61.00 62.93 1llp s PRO 329 Cb -0.32 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.23 1llp s PRO 329 CO 0.41 -1.03 0.00 0.41 0.04 0.00 0.00 177.00 176.83 1llp n GLY 330 N -0.54 1.04 3.91 0.56 0.00 -1.26 -4.79 105.19 104.10 1llp n GLY 330 Ca 0.10 -2.19 -0.28 0.00 0.00 0.00 0.00 46.02 43.65 1llp n GLY 330 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1llp s PRO 331 N -1.27 3.20 0.44 1.61 0.04 -1.26 -3.75 135.00 134.01 1llp s PRO 331 Ca 0.00 0.18 -0.25 0.00 0.04 0.00 0.00 61.00 60.97 1llp s PRO 331 Cb 0.00 -2.27 -0.09 0.00 0.04 0.00 0.00 34.50 32.19 1llp s PRO 331 CO 0.00 -0.55 1.36 0.00 0.04 0.00 0.00 177.00 177.86 1llp n ALA 332 N -2.53 1.72 -2.41 8.56 0.00 -1.26 -4.66 120.51 119.94 1llp n ALA 332 Ca 0.04 0.25 -0.28 0.00 0.00 0.00 0.00 53.44 53.45 1llp n ALA 332 Cb 0.56 -2.34 -0.15 0.00 0.00 0.00 0.00 19.45 17.52 1llp n ALA 332 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1llp s THR 333 N -1.20 1.78 0.03 0.00 -1.32 -1.26 -5.04 115.64 108.62 1llp s THR 333 Ca 0.62 -1.07 -0.30 0.00 -1.21 0.00 0.00 61.69 59.72 1llp s THR 333 Cb -0.47 -1.50 -0.04 0.00 -1.51 0.00 0.00 72.50 68.98 1llp s THR 333 CO 0.57 0.40 1.06 -0.55 -2.21 0.00 0.00 174.62 173.90 1llp s SER 334 N -0.78 7.27 0.01 8.08 0.15 -1.26 -4.72 113.70 122.44 1llp s SER 334 Ca 0.09 1.79 -0.30 0.00 0.70 0.00 0.00 55.95 58.23 1llp s SER 334 Cb -0.09 -2.57 -0.07 0.00 -1.71 0.00 0.00 66.02 61.58 1llp s SER 334 CO 0.00 -0.33 1.63 -0.69 1.20 0.00 0.00 173.24 175.06 1llp s VAL 335 N 1.00 3.33 0.27 4.45 1.01 -0.18 -4.94 120.40 125.34 1llp s VAL 335 Ca 0.54 0.63 -0.29 0.00 0.00 0.00 0.00 61.98 62.85 1llp s VAL 335 Cb -0.24 -3.40 -0.10 0.00 0.00 0.00 0.00 36.38 32.64 1llp s VAL 335 CO 0.29 -0.02 1.34 0.00 0.00 0.00 0.00 175.10 176.71 1llp s ALA 336 N 3.21 3.54 0.72 5.51 0.00 -1.26 -4.52 121.76 128.96 1llp s ALA 336 Ca 0.73 1.24 -0.11 0.00 0.00 0.00 0.00 51.96 53.82 1llp s ALA 336 Cb -0.36 -3.50 0.03 0.00 0.00 0.00 0.00 23.12 19.28 1llp s ALA 336 CO 0.31 -0.64 1.07 -0.98 0.00 0.00 0.00 175.76 175.52 1llp s ARG 337 N -0.96 2.69 -0.34 0.00 1.70 -1.26 -4.68 118.95 116.09 1llp s ARG 337 Ca 0.54 1.03 0.01 0.00 -0.47 0.00 0.00 55.73 56.83 1llp s ARG 337 Cb -0.39 -1.96 0.09 0.00 -0.57 0.00 0.00 34.95 32.12 1llp s ARG 337 CO 0.46 -1.30 0.06 0.42 -1.08 0.00 0.00 175.30 173.87 1llp s ILE 338 N -2.99 2.71 0.29 4.99 -1.09 0.03 -5.02 121.20 120.11 1llp s ILE 338 Ca 0.59 -1.96 -0.30 0.00 -2.23 0.00 0.00 60.65 56.75 1llp s ILE 338 Cb -0.15 -2.80 -0.12 0.00 -1.58 0.00 0.00 42.46 37.81 1llp s ILE 338 CO 0.55 -0.44 1.57 -2.65 -1.23 0.00 0.00 174.94 172.74 1llp n PRO 339 N 4.46 2.62 -0.88 2.79 -0.02 -1.26 -3.96 135.00 138.76 1llp n PRO 339 Ca -0.04 0.93 -0.30 0.00 -2.02 0.00 0.00 63.50 62.08 1llp n PRO 339 Cb 0.42 -2.70 0.18 0.00 -0.02 0.00 0.00 33.50 31.38 1llp n PRO 339 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1llp s PRO 340 N -0.53 0.49 0.09 0.52 0.05 -1.26 -4.70 135.00 129.66 1llp s PRO 340 Ca 0.64 0.99 -0.35 0.00 0.05 0.00 0.00 61.00 62.33 1llp s PRO 340 Cb -0.51 -1.71 -0.14 0.00 0.05 0.00 0.00 34.50 32.19 1llp s PRO 340 CO 0.49 -2.82 1.57 1.58 0.05 0.00 0.00 177.00 177.87 1llp n HIS 341 N -4.30 2.09 -2.96 0.56 -0.00 -1.26 -4.87 115.22 104.47 1llp n HIS 341 Ca 0.07 0.33 -0.43 0.00 -0.00 0.00 0.00 57.72 57.69 1llp n HIS 341 Cb 0.54 -2.51 -0.05 0.00 -0.00 0.00 0.00 29.99 27.98 1llp n HIS 341 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 176.34 174.75 1llp s LYS 342 N 1.35 3.19 0.00 1.57 0.00 -1.26 -5.12 119.74 119.47 1llp s LYS 342 Ca 0.83 -0.67 0.00 0.00 0.00 0.00 0.00 55.97 56.13 1llp s LYS 342 Cb -0.76 -4.12 0.00 0.00 0.00 0.00 0.00 37.83 32.94 1llp s LYS 342 CO 0.43 -1.48 0.23 0.00 0.00 0.00 0.00 175.35 174.53