#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uru n ASN 27 N 0.00 0.00 -1.04 2.61 0.23 -1.26 -5.09 115.26 110.71 1uru n ASN 27 Ca 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 54.58 54.04 1uru n ASN 27 Cb 0.00 0.00 0.21 0.00 -2.08 0.00 0.00 39.78 37.91 1uru n ASN 27 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1uru n LEU 28 N 0.00 3.93 0.00 -4.53 4.77 -1.26 -4.87 117.00 115.04 1uru n LEU 28 Ca 0.00 -3.63 0.00 0.00 -0.03 0.00 0.00 56.01 52.35 1uru n LEU 28 Cb 0.00 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 40.48 1uru n LEU 28 CO 0.00 1.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.82 1uru n GLY 29 N -1.04 1.90 3.52 -0.72 0.00 -1.26 -5.06 105.19 102.53 1uru n GLY 29 Ca 0.30 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1uru n GLY 29 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1uru n LYS 30 N 0.00 0.94 0.00 1.61 4.76 -1.26 -4.81 118.16 119.40 1uru n LYS 30 Ca 0.00 0.11 0.06 0.00 -2.87 0.00 0.00 58.31 55.61 1uru n LYS 30 Cb 0.00 -2.85 0.32 0.00 -1.84 0.00 0.00 35.03 30.66 1uru n LYS 30 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 1uru n VAL 31 N 7.73 0.56 -0.11 -0.18 0.24 -1.26 -2.49 118.33 122.82 1uru n VAL 31 Ca 0.43 0.14 0.09 0.00 -2.04 0.00 0.00 64.34 62.96 1uru n VAL 31 Cb 0.37 -0.94 0.29 0.00 -1.47 0.00 0.00 33.84 32.09 1uru n VAL 31 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1uru n ASP 32 N -1.24 3.69 -4.77 -1.34 3.85 -1.26 -4.99 116.55 110.48 1uru n ASP 32 Ca 0.06 -2.17 -0.35 0.00 -0.71 0.00 0.00 54.79 51.63 1uru n ASP 32 Cb 0.09 -0.47 0.01 0.00 -1.35 0.00 0.00 41.12 39.40 1uru n ASP 32 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 1uru s ARG 33 N -1.45 3.28 0.83 0.11 0.52 -1.04 -5.05 118.95 116.15 1uru s ARG 33 Ca 0.43 1.59 -0.12 0.00 -0.52 0.00 0.00 55.73 57.10 1uru s ARG 33 Cb 0.25 -2.00 0.10 0.00 0.52 0.00 0.00 34.95 33.82 1uru s ARG 33 CO 0.25 -0.90 1.20 0.95 0.02 0.00 0.00 175.30 176.81 1uru s THR 34 N -1.83 2.02 0.24 0.02 -4.23 -1.26 -4.90 115.64 105.69 1uru s THR 34 Ca 0.72 -0.03 -0.05 0.00 -1.18 0.00 0.00 61.69 61.15 1uru s THR 34 Cb -0.24 -3.00 0.16 0.00 1.34 0.00 0.00 72.50 70.77 1uru s THR 34 CO 0.29 0.00 1.79 0.00 -0.54 0.00 0.00 174.62 176.16 1uru h ALA 35 N -1.14 1.10 -0.55 3.99 0.00 -1.99 -2.26 119.26 118.41 1uru h ALA 35 Ca -0.45 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.19 1uru h ALA 35 Cb 1.31 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1uru h ALA 35 CO 0.59 0.63 0.07 -0.44 0.00 0.00 0.00 179.25 180.10 1uru h ASP 36 N 1.04 0.86 -0.12 0.00 3.32 -1.99 -1.36 116.42 118.17 1uru h ASP 36 Ca 0.24 -0.19 -0.15 0.00 0.02 0.00 0.00 57.03 56.95 1uru h ASP 36 Cb 0.25 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1uru h ASP 36 CO -0.01 0.88 -0.44 -0.33 -1.72 0.00 0.00 179.24 177.61 1uru h GLU 37 N 0.85 0.66 -0.95 3.56 5.08 -1.90 -1.28 114.58 120.60 1uru h GLU 37 Ca 0.17 -0.36 0.01 0.00 -1.00 0.00 0.00 59.36 58.18 1uru h GLU 37 Cb 0.41 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.63 1uru h GLU 37 CO 0.01 0.97 0.62 0.82 -1.00 0.00 0.00 179.01 180.44 1uru h ILE 38 N 0.54 1.24 -0.46 3.13 2.04 -1.23 -2.15 117.51 120.62 1uru h ILE 38 Ca 0.04 -0.45 -0.05 0.00 1.00 0.00 0.00 64.86 65.40 1uru h ILE 38 Cb 0.98 -0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 1uru h ILE 38 CO 0.09 0.24 0.09 0.15 0.00 0.00 0.00 178.15 178.72 1uru h PHE 39 N 1.28 0.79 -0.75 1.37 3.57 -0.76 -2.13 116.94 120.31 1uru h PHE 39 Ca 0.35 -0.10 0.04 0.00 3.53 0.00 0.00 57.97 61.78 1uru h PHE 39 Cb -0.14 -0.22 -0.05 0.00 2.79 0.00 0.00 35.95 38.33 1uru h PHE 39 CO -0.00 0.73 0.47 -0.44 -2.23 0.00 0.00 178.31 176.83 1uru h ASP 40 N 0.62 0.76 -0.65 0.41 3.32 -1.02 -0.79 116.42 119.06 1uru h ASP 40 Ca 0.14 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.14 1uru h ASP 40 Cb 0.35 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 1uru h ASP 40 CO 0.01 0.51 0.22 0.44 -1.72 0.00 0.00 179.24 178.70 1uru h ASP 41 N 0.90 0.96 -0.63 6.45 3.32 -1.13 -1.58 116.42 124.72 1uru h ASP 41 Ca 0.31 -0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1uru h ASP 41 Cb 0.05 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.32 1uru h ASP 41 CO -0.13 0.89 0.35 0.45 -1.72 0.00 0.00 179.24 179.08 1uru h HIS 42 N 1.00 0.87 -0.63 4.55 3.86 -0.66 -2.35 115.15 121.80 1uru h HIS 42 Ca 0.22 -0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.37 1uru h HIS 42 Cb 0.27 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.43 1uru h HIS 42 CO 0.02 0.61 0.21 -0.07 0.86 0.00 0.00 177.93 179.56 1uru h LEU 43 N 0.90 0.90 -0.83 2.43 3.38 -0.40 -2.20 115.31 119.49 1uru h LEU 43 Ca 0.23 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 1uru h LEU 43 Cb 0.03 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1uru h LEU 43 CO -0.04 0.86 0.04 0.78 0.09 0.00 0.00 178.44 180.17 1uru h ASN 44 N 0.89 0.88 0.32 -0.43 4.21 -0.91 -1.04 115.58 119.50 1uru h ASN 44 Ca 0.20 -0.21 -0.09 0.00 1.21 0.00 0.00 56.30 57.41 1uru h ASN 44 Cb 0.27 -0.23 -0.01 0.00 -1.12 0.00 0.00 38.32 37.23 1uru h ASN 44 CO -0.01 0.92 -0.38 0.78 -1.29 0.00 0.00 177.43 177.45 1uru h ASN 45 N 0.85 0.09 0.10 5.81 2.35 -1.36 -2.14 115.58 121.29 1uru h ASN 45 Ca 0.17 -0.03 -0.21 0.00 -0.55 0.00 0.00 56.30 55.67 1uru h ASN 45 Cb 0.45 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.80 1uru h ASN 45 CO 0.02 0.47 -1.04 0.15 -1.65 0.00 0.00 177.43 175.37 1uru h PHE 46 N 0.08 0.39 -0.76 1.19 3.57 -0.89 -1.19 116.94 119.34 1uru h PHE 46 Ca 0.01 -0.29 0.14 0.00 3.53 0.00 0.00 57.97 61.36 1uru h PHE 46 Cb 0.71 -0.02 -0.09 0.00 2.79 0.00 0.00 35.95 39.34 1uru h PHE 46 CO 0.00 1.40 0.30 -0.91 -2.23 0.00 0.00 178.31 176.88 1uru h ASN 47 N -0.46 0.29 0.09 0.41 2.35 -1.25 0.25 115.58 117.26 1uru h ASN 47 Ca -0.22 0.11 -0.16 0.00 -0.55 0.00 0.00 56.30 55.48 1uru h ASN 47 Cb 1.60 0.08 -0.01 0.00 0.05 0.00 0.00 38.32 40.05 1uru h ASN 47 CO 0.06 0.11 -0.56 0.03 -1.65 0.00 0.00 177.43 175.42 1uru h ARG 48 N 0.45 0.49 -0.39 0.81 3.08 -1.41 -0.96 114.38 116.45 1uru h ARG 48 Ca 0.41 -0.31 -0.09 0.00 0.07 0.00 0.00 59.98 60.07 1uru h ARG 48 Cb 0.63 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 1uru h ARG 48 CO -0.40 0.92 -0.09 0.37 -1.07 0.00 0.00 179.97 179.70 1uru h GLN 49 N 0.38 0.75 -0.37 0.04 4.15 -0.60 -2.21 115.11 117.24 1uru h GLN 49 Ca 0.01 -0.28 -0.12 0.00 0.77 0.00 0.00 58.65 59.02 1uru h GLN 49 Cb 1.09 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.72 1uru h GLN 49 CO 0.10 0.89 -0.26 0.37 -1.93 0.00 0.00 178.83 178.00 1uru h GLN 50 N 0.57 0.77 -0.18 1.69 4.15 -0.46 -1.94 115.11 119.69 1uru h GLN 50 Ca 0.10 -0.32 -0.10 0.00 0.77 0.00 0.00 58.65 59.09 1uru h GLN 50 Cb 0.60 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.25 1uru h GLN 50 CO 0.04 0.94 -0.33 0.00 -1.93 0.00 0.00 178.83 177.55 1uru h ALA 51 N 1.05 1.09 0.01 3.38 0.00 -1.13 -2.26 119.26 121.41 1uru h ALA 51 Ca 0.09 -0.38 -0.23 0.00 0.00 0.00 0.00 54.91 54.39 1uru h ALA 51 Cb 0.77 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1uru h ALA 51 CO 0.06 0.57 -0.96 0.77 0.00 0.00 0.00 179.25 179.69 1uru h SER 52 N 0.33 0.50 0.34 0.00 0.02 -1.23 -2.63 113.55 110.89 1uru h SER 52 Ca 0.04 -0.41 -0.21 0.00 -0.84 0.00 0.00 61.79 60.37 1uru h SER 52 Cb 0.74 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 63.13 1uru h SER 52 CO 0.06 1.22 -0.89 0.00 -1.14 0.00 0.00 176.83 176.08 1uru h ALA 53 N 0.74 0.43 -0.61 3.77 0.00 -1.32 -2.16 119.26 120.12 1uru h ALA 53 Ca -0.08 -0.69 -0.10 0.00 0.00 0.00 0.00 54.91 54.05 1uru h ALA 53 Cb 1.60 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.34 1uru h ALA 53 CO 0.16 0.81 0.00 -0.91 0.00 0.00 0.00 179.25 179.32 1uru h ASN 54 N 0.23 1.04 -0.61 0.00 -0.26 -1.47 -1.37 115.58 113.15 1uru h ASN 54 Ca -0.06 -0.29 -0.10 0.00 -0.56 0.00 0.00 56.30 55.29 1uru h ASN 54 Cb 1.51 -0.28 -0.02 0.00 -1.06 0.00 0.00 38.32 38.46 1uru h ASN 54 CO 0.15 1.09 0.01 -0.09 -1.06 0.00 0.00 177.43 177.53 1uru h ARG 55 N 0.97 1.08 -0.47 0.81 2.43 -1.49 -0.87 114.38 116.84 1uru h ARG 55 Ca 0.17 -0.34 -0.11 0.00 -0.81 0.00 0.00 59.98 58.89 1uru h ARG 55 Cb 0.55 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1uru h ARG 55 CO 0.03 1.04 -0.15 1.25 -1.51 0.00 0.00 179.97 180.64 1uru h LEU 56 N 0.98 0.93 -0.40 3.80 5.85 -1.11 -1.46 115.31 123.91 1uru h LEU 56 Ca 0.18 -0.37 -0.06 0.00 0.84 0.00 0.00 57.88 58.47 1uru h LEU 56 Cb 0.55 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1uru h LEU 56 CO 0.03 1.10 0.03 -0.61 -0.34 0.00 0.00 178.44 178.65 1uru h GLN 57 N 0.77 0.68 0.37 1.25 4.15 -1.20 -0.57 115.11 120.55 1uru h GLN 57 Ca 0.11 -0.20 -0.01 0.00 0.77 0.00 0.00 58.65 59.32 1uru h GLN 57 Cb 0.70 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.30 1uru h GLN 57 CO 0.05 0.75 -0.40 -0.22 -1.93 0.00 0.00 178.83 177.09 1uru h LYS 58 N 0.52 -0.74 -0.78 1.69 3.64 -1.03 -0.86 116.57 119.01 1uru h LYS 58 Ca 0.12 0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.58 1uru h LYS 58 Cb 0.42 0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 32.37 1uru h LYS 58 CO 0.01 -0.50 0.51 0.93 -2.27 0.00 0.00 179.45 178.14 1uru h GLU 59 N -0.77 0.95 -0.16 1.90 4.39 -1.23 -0.97 114.58 118.69 1uru h GLU 59 Ca -0.05 -0.06 -0.16 0.00 0.34 0.00 0.00 59.36 59.44 1uru h GLU 59 Cb 0.68 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1uru h GLU 59 CO -0.06 0.63 -0.56 0.35 -1.16 0.00 0.00 179.01 178.20 1uru h PHE 60 N 0.98 0.62 -0.15 4.33 3.57 -1.02 -0.02 116.94 125.25 1uru h PHE 60 Ca 0.31 -0.22 -0.09 0.00 3.53 0.00 0.00 57.97 61.49 1uru h PHE 60 Cb 0.01 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.62 1uru h PHE 60 CO -0.00 0.94 -0.32 -0.91 -2.23 0.00 0.00 178.31 175.79 1uru h ASN 61 N 0.37 0.31 -0.51 0.41 -0.26 -0.39 -0.87 115.58 114.64 1uru h ASN 61 Ca 0.00 -0.11 -0.12 0.00 -0.56 0.00 0.00 56.30 55.51 1uru h ASN 61 Cb 1.10 -0.08 -0.02 0.00 -1.06 0.00 0.00 38.32 38.26 1uru h ASN 61 CO 0.10 0.62 -0.16 -1.13 -1.06 0.00 0.00 177.43 175.80 1uru h ASN 62 N 0.26 1.03 -0.58 5.81 -1.24 -0.81 -3.00 115.58 117.06 1uru h ASN 62 Ca 0.03 -0.37 -0.03 0.00 0.71 0.00 0.00 56.30 56.64 1uru h ASN 62 Cb 0.71 -0.28 -0.03 0.00 0.73 0.00 0.00 38.32 39.45 1uru h ASN 62 CO 0.05 1.17 0.25 0.22 -1.29 0.00 0.00 177.43 177.83 1uru h TYR 63 N 0.88 0.86 0.28 0.67 3.20 -0.57 -2.01 116.97 120.28 1uru h TYR 63 Ca 0.13 -0.06 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 1uru h TYR 63 Cb 0.74 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.75 1uru h TYR 63 CO 0.05 0.68 -0.14 0.82 -1.64 0.00 0.00 178.16 177.93 1uru h ILE 64 N 0.79 0.75 0.00 1.81 1.08 -1.11 0.64 117.51 121.46 1uru h ILE 64 Ca 0.19 -0.19 -0.05 0.00 -0.39 0.00 0.00 64.86 64.42 1uru h ILE 64 Cb 0.17 0.85 -0.01 0.00 -3.07 0.00 0.00 36.82 34.76 1uru h ILE 64 CO -0.02 0.04 -0.25 0.08 -0.69 0.00 0.00 178.15 177.31 1uru h ARG 65 N -0.48 0.00 -0.22 2.37 0.11 -1.53 0.16 114.38 114.80 1uru h ARG 65 Ca -0.04 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 59.93 1uru h ARG 65 Cb 0.36 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.43 1uru h ARG 65 CO 0.06 0.25 -0.34 0.00 0.10 0.00 0.00 179.97 180.05 1uru h VAL 67 N 0.40 0.87 -0.48 0.00 2.07 -0.09 -2.33 116.25 116.69 1uru h VAL 67 Ca 0.05 -0.70 0.09 0.00 0.82 0.00 0.00 66.70 66.96 1uru h VAL 67 Cb 0.78 1.27 -0.10 0.00 -1.52 0.00 0.00 31.29 31.72 1uru h VAL 67 CO 0.06 0.15 -0.27 0.03 0.02 0.00 0.00 177.57 177.56 1uru h ARG 68 N -0.65 -0.16 -0.30 1.57 3.08 -0.66 0.14 114.38 117.40 1uru h ARG 68 Ca -0.03 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1uru h ARG 68 Cb 0.46 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.53 1uru h ARG 68 CO 0.05 -0.11 0.16 0.00 -1.07 0.00 0.00 179.97 179.00 1uru h ALA 69 N 1.04 1.71 -0.35 0.04 0.00 -1.29 -1.70 119.26 118.72 1uru h ALA 69 Ca 0.21 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 1uru h ALA 69 Cb 0.51 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1uru h ALA 69 CO -0.58 0.24 -0.24 0.00 0.00 0.00 0.00 179.25 178.68 1uru h ALA 70 N 1.76 0.50 -0.20 0.00 0.00 -0.39 -1.66 119.26 119.27 1uru h ALA 70 Ca 0.11 -0.38 0.05 0.00 0.00 0.00 0.00 54.91 54.69 1uru h ALA 70 Cb 0.02 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 1uru h ALA 70 CO -0.02 0.48 -0.21 0.37 0.00 0.00 0.00 179.25 179.88 1uru h GLN 71 N 0.56 -0.22 -0.77 0.00 4.15 -0.37 0.41 115.11 118.87 1uru h GLN 71 Ca 0.07 0.02 0.08 0.00 0.77 0.00 0.00 58.65 59.58 1uru h GLN 71 Cb 0.80 0.05 -0.06 0.00 0.21 0.00 0.00 27.48 28.48 1uru h GLN 71 CO 0.07 -0.15 0.45 0.00 -1.93 0.00 0.00 178.83 177.26 1uru h ALA 72 N 0.83 1.07 0.00 3.38 0.00 -1.23 -2.13 119.26 121.17 1uru h ALA 72 Ca 0.12 0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.85 1uru h ALA 72 Cb 0.41 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1uru h ALA 72 CO -0.33 0.11 -0.88 0.00 0.00 0.00 0.00 179.25 178.15 1uru h ALA 73 N 1.41 0.51 0.00 0.00 0.00 -0.84 -2.54 119.26 117.80 1uru h ALA 73 Ca 0.36 -0.73 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 1uru h ALA 73 Cb 0.26 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1uru h ALA 73 CO -0.21 0.92 -0.29 1.03 0.00 0.00 0.00 179.25 180.69 1uru h SER 74 N 0.11 0.00 0.04 0.00 0.87 -0.61 -1.92 113.55 112.03 1uru h SER 74 Ca -0.04 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.51 1uru h SER 74 Cb 1.51 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.47 1uru h SER 74 CO 0.13 0.29 -0.02 0.50 -0.53 0.00 0.00 176.83 177.21 1uru h LYS 75 N 0.00 -0.05 0.00 2.24 3.11 -1.24 -3.23 116.57 117.41 1uru h LYS 75 Ca -0.00 0.00 -0.03 0.00 -2.81 0.00 0.00 60.65 57.81 1uru h LYS 75 Cb 0.60 0.01 -0.00 0.00 -1.00 0.00 0.00 32.23 31.83 1uru h LYS 75 CO 0.04 0.59 -0.15 1.79 -2.81 0.00 0.00 179.45 178.90 1uru h THR 76 N -0.93 0.72 0.00 1.00 1.35 -1.43 -0.30 112.91 113.32 1uru h THR 76 Ca -0.00 -0.63 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 1uru h THR 76 Cb 0.66 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 1uru h THR 76 CO 0.01 0.15 0.00 -0.11 -0.25 0.00 0.00 175.52 175.32 1uru n LEU 77 N -3.78 1.92 0.00 3.87 7.94 -0.73 -2.69 117.00 123.54 1uru n LEU 77 Ca -0.02 -0.96 0.00 0.00 -1.11 0.00 0.00 56.01 53.92 1uru n LEU 77 Cb 0.26 -0.43 0.00 0.00 0.53 0.00 0.00 43.42 43.78 1uru n LEU 77 CO 0.32 0.35 0.00 0.47 -1.11 0.00 0.00 177.39 177.42 1uru n ASP 79 N 0.37 0.00 -0.03 1.96 8.00 -0.12 -1.63 116.55 125.09 1uru n ASP 79 Ca 0.00 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.35 1uru n ASP 79 Cb 0.35 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.36 1uru n ASP 79 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1uru h SER 80 N 0.00 0.37 -0.85 -2.24 0.02 -1.76 -2.09 113.55 107.00 1uru h SER 80 Ca 0.00 -0.62 -0.00 0.00 -0.84 0.00 0.00 61.79 60.33 1uru h SER 80 Cb 0.00 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.39 1uru h SER 80 CO 0.00 0.93 0.52 0.58 -1.14 0.00 0.00 176.83 177.72 1uru h VAL 81 N -0.16 1.24 -0.62 2.27 2.07 -1.62 -0.99 116.25 118.43 1uru h VAL 81 Ca -0.01 -0.51 -0.08 0.00 0.82 0.00 0.00 66.70 66.93 1uru h VAL 81 Cb 0.90 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1uru h VAL 81 CO 0.06 0.24 0.09 0.00 0.02 0.00 0.00 177.57 177.98 1uru h GLU 83 N 0.96 0.44 0.00 0.00 4.22 -0.60 -3.24 114.58 116.36 1uru h GLU 83 Ca 0.19 -0.10 0.00 0.00 0.08 0.00 0.00 59.36 59.53 1uru h GLU 83 Cb 0.43 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1uru h GLU 83 CO 0.01 0.52 -0.10 0.97 -2.18 0.00 0.00 179.01 178.23 1uru h ILE 84 N 0.28 0.00 -3.37 2.32 2.10 -1.17 -3.42 117.51 114.25 1uru h ILE 84 Ca 0.09 -0.58 -0.58 0.00 1.08 0.00 0.00 64.86 64.87 1uru h ILE 84 Cb 0.28 1.52 -0.08 0.00 -1.09 0.00 0.00 36.82 37.45 1uru h ILE 84 CO 0.00 0.00 0.04 -0.47 -1.08 0.00 0.00 178.15 176.64 1uru s TYR 85 N -3.13 3.48 0.14 2.19 5.04 -0.83 -5.05 117.35 119.19 1uru s TYR 85 Ca 0.09 1.02 -0.05 0.00 -2.44 0.00 0.00 57.07 55.69 1uru s TYR 85 Cb 0.11 -2.73 -0.06 0.00 0.35 0.00 0.00 41.96 39.63 1uru s TYR 85 CO 0.63 0.01 0.39 -1.21 -1.34 0.00 0.00 175.55 174.03 1uru s GLU 86 N 1.17 3.64 0.26 4.97 2.02 -1.26 -4.86 118.70 124.64 1uru s GLU 86 Ca 0.31 -0.05 -0.01 0.00 0.02 0.00 0.00 54.97 55.24 1uru s GLU 86 Cb -0.16 -2.84 0.54 0.00 0.10 0.00 0.00 34.13 31.76 1uru s GLU 86 CO 0.13 0.46 1.76 -1.35 0.02 0.00 0.00 175.26 176.28 1uru h PRO 87 N 2.86 0.60 0.00 0.39 0.11 -1.93 -2.31 132.00 131.72 1uru h PRO 87 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1uru h PRO 87 Cb 1.17 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1uru h PRO 87 CO 0.72 0.39 0.00 0.00 -0.21 0.00 0.00 178.00 178.90 1uru n GLN 88 N -4.88 0.20 -2.17 1.05 0.00 -1.26 -4.70 117.38 105.62 1uru n GLN 88 Ca 0.17 0.35 -0.32 0.00 0.00 0.00 0.00 57.00 57.19 1uru n GLN 88 Cb 0.44 -1.83 -0.01 0.00 0.00 0.00 0.00 30.24 28.84 1uru n GLN 88 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.06 175.48 1uru s TRP 89 N -3.24 3.22 0.59 2.61 0.51 -0.87 -5.03 118.94 116.73 1uru s TRP 89 Ca 0.06 1.48 -0.18 0.00 -2.12 0.00 0.00 56.10 55.35 1uru s TRP 89 Cb 0.10 -2.90 -0.04 0.00 -0.81 0.00 0.00 33.47 29.83 1uru s TRP 89 CO 0.45 -0.78 1.11 -1.54 -0.51 0.00 0.00 176.95 175.68 1uru s SER 90 N -2.99 5.53 0.00 2.95 1.04 -1.26 -3.32 113.70 115.64 1uru s SER 90 Ca 0.61 2.08 0.00 0.00 0.48 0.00 0.00 55.95 59.12 1uru s SER 90 Cb -0.13 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.42 1uru s SER 90 CO 0.36 -1.35 0.00 0.61 0.98 0.00 0.00 173.24 173.84 1uru n GLY 91 N -0.18 0.69 0.18 7.32 0.00 -1.26 -4.76 105.19 107.18 1uru n GLY 91 Ca 0.11 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 1uru n GLY 91 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1uru h TYR 92 N 0.00 0.62 -0.12 1.61 3.20 -1.83 0.09 116.97 120.54 1uru h TYR 92 Ca 0.00 -0.14 -0.19 0.00 3.14 0.00 0.00 58.73 61.54 1uru h TYR 92 Cb 0.05 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.17 1uru h TYR 92 CO 0.03 0.76 -0.72 -0.44 -1.64 0.00 0.00 178.16 176.15 1uru h ASP 93 N 0.31 0.65 -0.57 -2.11 3.32 -1.89 -2.03 116.42 114.10 1uru h ASP 93 Ca 0.07 -0.41 0.09 0.00 0.02 0.00 0.00 57.03 56.80 1uru h ASP 93 Cb 0.56 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.88 1uru h ASP 93 CO 0.03 1.17 0.38 0.00 -1.72 0.00 0.00 179.24 179.10 1uru h ALA 94 N 0.82 2.01 -0.00 3.45 0.00 -1.95 -1.11 119.26 122.48 1uru h ALA 94 Ca -0.03 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1uru h ALA 94 Cb 1.31 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1uru h ALA 94 CO 0.13 -0.13 -0.01 1.25 0.00 0.00 0.00 179.25 180.50 1uru h LEU 95 N 0.40 0.01 -0.81 0.00 5.85 -0.38 -1.69 115.31 118.69 1uru h LEU 95 Ca 0.26 -0.68 0.19 0.00 0.84 0.00 0.00 57.88 58.48 1uru h LEU 95 Cb 0.50 -0.00 -0.12 0.00 0.37 0.00 0.00 40.66 41.41 1uru h LEU 95 CO -0.07 0.69 0.27 1.56 -0.34 0.00 0.00 178.44 180.55 1uru h GLN 96 N -0.67 0.32 -0.12 1.25 1.08 -1.15 -1.30 115.11 114.52 1uru h GLN 96 Ca -0.00 -0.02 -0.04 0.00 -1.45 0.00 0.00 58.65 57.14 1uru h GLN 96 Cb 0.69 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 28.05 1uru h GLN 96 CO 0.00 0.21 -0.09 0.00 -0.95 0.00 0.00 178.83 178.01 1uru h ALA 97 N 1.66 0.17 0.00 3.87 0.00 -1.06 -2.00 119.26 121.90 1uru h ALA 97 Ca 0.48 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 1uru h ALA 97 Cb 0.87 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1uru h ALA 97 CO -0.53 -0.01 -0.22 0.37 0.00 0.00 0.00 179.25 178.86 1uru h GLN 98 N -0.10 0.00 -0.13 0.00 5.75 -1.04 -1.67 115.11 117.92 1uru h GLN 98 Ca 0.02 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.47 1uru h GLN 98 Cb 0.58 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.13 1uru h GLN 98 CO 0.02 0.22 -0.12 1.15 -2.65 0.00 0.00 178.83 177.45 1uru h THR 99 N 0.00 1.35 -0.80 2.39 2.02 -1.13 -2.93 112.91 113.81 1uru h THR 99 Ca -0.00 -1.27 -0.01 0.00 0.77 0.00 0.00 66.41 65.90 1uru h THR 99 Cb 0.86 1.90 -0.04 0.00 -1.74 0.00 0.00 68.15 69.13 1uru h THR 99 CO 0.03 0.37 0.46 1.23 0.37 0.00 0.00 175.52 177.97 1uru h GLY 100 N -0.07 1.17 0.27 2.16 0.00 -0.98 -2.10 103.07 103.52 1uru h GLY 100 Ca 0.02 -0.51 0.16 0.00 0.00 0.00 0.00 47.33 47.00 1uru h GLY 100 CO 0.03 0.49 0.59 0.00 0.00 0.00 0.00 176.54 177.65 1uru h ALA 101 N 1.24 1.56 -0.48 3.60 0.00 -1.35 -1.87 119.26 121.96 1uru h ALA 101 Ca 0.28 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.17 1uru h ALA 101 Cb -0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1uru h ALA 101 CO -0.05 0.05 -0.00 1.03 0.00 0.00 0.00 179.25 180.28 1uru h SER 102 N 0.83 0.84 -0.88 0.00 0.87 -1.20 -2.67 113.55 111.34 1uru h SER 102 Ca 0.53 -0.31 0.13 0.00 -1.23 0.00 0.00 61.79 60.91 1uru h SER 102 Cb 0.71 -0.22 -0.07 0.00 -0.44 0.00 0.00 62.40 62.38 1uru h SER 102 CO -0.34 0.94 0.57 -0.33 -0.53 0.00 0.00 176.83 177.14 1uru h GLU 103 N 0.71 0.71 0.05 2.24 5.08 -0.81 -1.66 114.58 120.88 1uru h GLU 103 Ca 0.14 -0.04 -0.28 0.00 -1.00 0.00 0.00 59.36 58.18 1uru h GLU 103 Cb 0.51 -0.16 0.02 0.00 0.50 0.00 0.00 28.75 29.63 1uru h GLU 103 CO 0.03 0.47 -1.12 0.77 -1.00 0.00 0.00 179.01 178.16 1uru h SER 104 N 0.73 0.87 -0.53 1.42 0.02 -1.37 -2.49 113.55 112.20 1uru h SER 104 Ca 0.43 -0.74 -0.02 0.00 -0.84 0.00 0.00 61.79 60.62 1uru h SER 104 Cb 0.63 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 1uru h SER 104 CO -0.19 1.54 0.26 -0.07 -1.14 0.00 0.00 176.83 177.23 1uru h LEU 105 N 0.34 0.68 -1.64 5.07 3.38 -1.13 -0.61 115.31 121.41 1uru h LEU 105 Ca -0.15 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 1uru h LEU 105 Cb 1.77 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 42.33 1uru h LEU 105 CO 0.21 0.61 0.17 -0.50 0.09 0.00 0.00 178.44 179.03 1uru h TRP 106 N 0.70 0.40 0.05 1.13 4.06 -1.33 -1.32 115.95 119.64 1uru h TRP 106 Ca 0.18 0.00 -0.24 0.00 2.06 0.00 0.00 58.89 60.89 1uru h TRP 106 Cb 0.11 -0.13 0.00 0.00 -1.00 0.00 0.00 29.16 28.13 1uru h TRP 106 CO -0.01 0.28 -1.06 0.00 -3.56 0.00 0.00 178.44 174.09 1uru h ALA 107 N 1.77 0.28 0.70 1.49 0.00 -0.88 -2.00 119.26 120.62 1uru h ALA 107 Ca 0.11 -0.79 -0.03 0.00 0.00 0.00 0.00 54.91 54.20 1uru h ALA 107 Cb 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1uru h ALA 107 CO -0.02 0.91 -0.37 -0.44 0.00 0.00 0.00 179.25 179.32 1uru h ASP 108 N 0.14 -0.91 -0.78 0.00 3.32 -0.80 -1.68 116.42 115.71 1uru h ASP 108 Ca -0.09 0.04 0.11 0.00 0.02 0.00 0.00 57.03 57.10 1uru h ASP 108 Cb 1.73 0.25 -0.12 0.00 0.22 0.00 0.00 39.33 41.41 1uru h ASP 108 CO 0.17 -0.61 -0.46 0.15 -1.72 0.00 0.00 179.24 176.78 1uru h PHE 109 N -0.99 -1.37 0.00 4.55 3.57 -1.29 0.50 116.94 121.91 1uru h PHE 109 Ca -0.09 0.10 -0.07 0.00 3.53 0.00 0.00 57.97 61.44 1uru h PHE 109 Cb 0.78 0.71 -0.01 0.00 2.79 0.00 0.00 35.95 40.21 1uru h PHE 109 CO -0.06 -0.41 -0.34 0.00 -2.23 0.00 0.00 178.31 175.27 1uru h ALA 110 N 0.79 1.10 0.13 2.41 0.00 -1.34 -1.19 119.26 121.16 1uru h ALA 110 Ca 0.22 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1uru h ALA 110 Cb 0.54 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1uru h ALA 110 CO -0.82 0.43 -0.06 1.25 0.00 0.00 0.00 179.25 180.04 1uru h HIS 111 N 0.00 -0.16 -0.57 0.00 -0.00 -0.01 -2.70 115.15 111.71 1uru h HIS 111 Ca -0.00 -0.00 0.06 0.00 -0.00 0.00 0.00 60.37 60.42 1uru h HIS 111 Cb 0.78 0.05 -0.03 0.00 -0.00 0.00 0.00 27.41 28.21 1uru h HIS 111 CO 0.00 0.32 0.38 0.87 -0.00 0.00 0.00 177.93 179.50 1uru h LYS 112 N -0.79 0.53 0.07 5.26 1.57 0.06 -0.48 116.57 122.79 1uru h LYS 112 Ca -0.02 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1uru h LYS 112 Cb 0.55 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1uru h LYS 112 CO 0.03 0.35 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.16 1uru h LEU 113 N 0.55 -0.08 0.00 2.94 3.38 -1.25 -1.41 115.31 119.43 1uru h LEU 113 Ca 0.25 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1uru h LEU 113 Cb 0.27 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1uru h LEU 113 CO -0.07 0.49 0.00 0.61 0.09 0.00 0.00 178.44 179.56 1uru n GLY 114 N 0.50 -1.08 0.26 0.83 0.00 -1.02 -1.27 105.19 103.41 1uru n GLY 114 Ca -0.08 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1uru n GLY 114 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1uru n ASP 115 N -1.21 0.00 -0.29 1.61 4.64 -0.22 -4.46 116.55 116.63 1uru n ASP 115 Ca 0.15 0.00 -0.01 0.00 -1.38 0.00 0.00 54.79 53.55 1uru n ASP 115 Cb 0.18 0.00 0.12 0.00 -1.04 0.00 0.00 41.12 40.38 1uru n ASP 115 CO 0.00 0.00 0.00 1.56 -0.82 0.00 0.00 177.20 177.94 1uru h GLN 116 N 0.00 0.90 0.11 -0.67 7.50 -1.57 -2.60 115.11 118.78 1uru h GLN 116 Ca 0.00 -0.05 -0.28 0.00 0.50 0.00 0.00 58.65 58.82 1uru h GLN 116 Cb 0.00 -0.20 -0.00 0.00 0.05 0.00 0.00 27.48 27.32 1uru h GLN 116 CO 0.00 0.60 -1.43 0.28 -1.50 0.00 0.00 178.83 176.78 1uru h VAL 117 N 0.93 1.02 -0.06 -0.54 2.07 -1.32 -3.40 116.25 114.94 1uru h VAL 117 Ca 0.34 -2.39 -0.07 0.00 0.82 0.00 0.00 66.70 65.39 1uru h VAL 117 Cb 0.11 2.70 0.00 0.00 -1.52 0.00 0.00 31.29 32.58 1uru h VAL 117 CO -0.15 0.70 -0.24 0.25 0.02 0.00 0.00 177.57 178.15 1uru h LEU 118 N -0.30 0.31 -0.15 2.57 5.85 -1.21 -3.25 115.31 119.13 1uru h LEU 118 Ca -0.31 -0.64 -0.00 0.00 0.84 0.00 0.00 57.88 57.76 1uru h LEU 118 Cb 1.76 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.69 1uru h LEU 118 CO 0.05 0.90 0.08 0.40 -0.34 0.00 0.00 178.44 179.54 1uru h ILE 119 N -0.26 1.11 -0.74 4.05 5.03 -1.68 -0.07 117.51 124.95 1uru h ILE 119 Ca -0.01 -0.30 0.17 0.00 -0.12 0.00 0.00 64.86 64.59 1uru h ILE 119 Cb 0.89 1.04 -0.04 0.00 -3.03 0.00 0.00 36.82 35.67 1uru h ILE 119 CO 0.05 0.10 0.50 -0.65 -0.68 0.00 0.00 178.15 177.47 1uru h PRO 120 N 0.13 0.28 -0.32 2.37 0.11 -1.78 -0.13 132.00 132.65 1uru h PRO 120 Ca 0.05 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 65.98 1uru h PRO 120 Cb 0.09 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.13 1uru h PRO 120 CO -0.01 0.18 -0.46 1.25 -0.21 0.00 0.00 178.00 178.76 1uru h LEU 121 N 0.28 0.93 -0.73 2.35 5.85 -1.10 -1.15 115.31 121.75 1uru h LEU 121 Ca 0.36 -0.46 -0.13 0.00 0.84 0.00 0.00 57.88 58.49 1uru h LEU 121 Cb 1.00 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.76 1uru h LEU 121 CO -0.09 1.24 -0.55 0.78 -0.34 0.00 0.00 178.44 179.48 1uru h ASN 122 N 0.68 0.26 -0.10 1.25 2.35 -0.66 -0.95 115.58 118.42 1uru h ASN 122 Ca 0.04 -0.14 -0.15 0.00 -0.55 0.00 0.00 56.30 55.50 1uru h ASN 122 Cb 1.05 -0.08 0.01 0.00 0.05 0.00 0.00 38.32 39.35 1uru h ASN 122 CO 0.10 0.76 -0.52 0.74 -1.65 0.00 0.00 177.43 176.86 1uru h THR 123 N 0.18 1.36 -0.45 2.81 2.02 -0.90 -2.03 112.91 115.90 1uru h THR 123 Ca 0.00 -1.84 -0.14 0.00 0.77 0.00 0.00 66.41 65.20 1uru h THR 123 Cb 1.03 2.20 -0.01 0.00 -1.74 0.00 0.00 68.15 69.62 1uru h THR 123 CO 0.09 0.56 -0.26 0.22 0.37 0.00 0.00 175.52 176.49 1uru h TYR 124 N 0.14 1.10 -0.02 3.16 3.20 -1.22 -2.92 116.97 120.40 1uru h TYR 124 Ca -0.04 -0.28 -0.08 0.00 3.14 0.00 0.00 58.73 61.48 1uru h TYR 124 Cb 1.17 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 39.18 1uru h TYR 124 CO 0.11 1.09 -0.35 1.15 -1.64 0.00 0.00 178.16 178.53 1uru h THR 125 N 0.81 1.26 0.00 1.81 2.02 -1.20 -3.15 112.91 114.45 1uru h THR 125 Ca 0.10 -1.23 0.00 0.00 0.77 0.00 0.00 66.41 66.05 1uru h THR 125 Cb 0.83 1.63 0.00 0.00 -1.74 0.00 0.00 68.15 68.87 1uru h THR 125 CO 0.07 0.35 -0.03 1.23 0.37 0.00 0.00 175.52 177.52 1uru h GLY 126 N 1.07 0.00 2.00 2.16 0.00 -1.17 -3.15 103.07 103.98 1uru h GLY 126 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1uru h GLY 126 CO 0.05 0.00 0.00 0.06 0.00 0.00 0.00 176.54 176.65 1uru h GLN 127 N 0.00 0.00 -0.07 4.80 3.07 -1.50 -3.34 115.11 118.07 1uru h GLN 127 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 58.65 58.70 1uru h GLN 127 Cb 0.83 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.39 1uru h GLN 127 CO 0.00 0.00 -0.10 0.74 0.09 0.00 0.00 178.83 179.56 1uru h PHE 128 N 0.00 0.23 -0.61 0.06 -1.00 -1.72 -3.27 116.94 110.62 1uru h PHE 128 Ca 0.00 -0.08 0.10 0.00 2.81 0.00 0.00 57.97 60.81 1uru h PHE 128 Cb 0.62 -0.05 -0.04 0.00 3.61 0.00 0.00 35.95 40.09 1uru h PHE 128 CO 0.00 0.67 0.41 -1.00 -1.61 0.00 0.00 178.31 176.78 1uru h PRO 129 N -0.28 0.40 -1.12 1.51 0.13 -1.78 -0.22 132.00 130.64 1uru h PRO 129 Ca 0.01 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1uru h PRO 129 Cb 0.64 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.68 1uru h PRO 129 CO 0.02 0.26 0.00 -1.91 -0.23 0.00 0.00 178.00 176.14 1uru n GLU 130 N -4.47 0.89 0.00 0.86 2.13 -1.23 -1.70 120.64 117.12 1uru n GLU 130 Ca 0.10 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.92 1uru n GLU 130 Cb 0.39 -1.05 0.00 0.00 0.27 0.00 0.00 31.44 31.04 1uru n GLU 130 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1uru n LYS 132 N 0.56 0.00 -0.30 5.31 4.81 -0.10 -2.20 118.16 126.25 1uru n LYS 132 Ca 0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.41 1uru n LYS 132 Cb 0.45 0.00 0.09 0.00 0.02 0.00 0.00 35.03 35.58 1uru n LYS 132 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 1uru h LYS 133 N 0.00 1.04 -0.43 1.64 3.64 -1.58 -1.09 116.57 119.79 1uru h LYS 133 Ca 0.00 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.23 1uru h LYS 133 Cb 0.00 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.57 1uru h LYS 133 CO 0.00 0.69 -0.10 -0.22 -2.27 0.00 0.00 179.45 177.55 1uru h LYS 134 N 1.07 0.76 -0.46 1.90 3.64 -1.73 -1.70 116.57 120.04 1uru h LYS 134 Ca 0.31 -0.24 -0.10 0.00 -1.27 0.00 0.00 60.65 59.35 1uru h LYS 134 Cb -0.07 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1uru h LYS 134 CO -0.08 0.83 -0.09 0.28 -2.27 0.00 0.00 179.45 178.12 1uru h VAL 135 N 0.69 1.27 0.00 2.00 2.07 -1.71 -1.62 116.25 118.95 1uru h VAL 135 Ca 0.12 -1.21 -0.04 0.00 0.82 0.00 0.00 66.70 66.39 1uru h VAL 135 Cb 0.57 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 1uru h VAL 135 CO 0.03 0.41 -0.21 -0.33 0.02 0.00 0.00 177.57 177.50 1uru h GLU 136 N 0.73 0.00 -0.20 1.57 5.08 -1.12 -0.58 114.58 120.06 1uru h GLU 136 Ca 0.12 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.31 1uru h GLU 136 Cb 0.63 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.88 1uru h GLU 136 CO 0.04 0.21 -0.58 -0.22 -1.00 0.00 0.00 179.01 177.46 1uru h LYS 137 N 0.00 0.63 0.07 2.33 3.64 -0.93 -2.19 116.57 120.12 1uru h LYS 137 Ca -0.00 -0.42 -0.00 0.00 -1.27 0.00 0.00 60.65 58.96 1uru h LYS 137 Cb 0.50 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1uru h LYS 137 CO 0.03 1.03 -0.04 -0.09 -2.27 0.00 0.00 179.45 178.11 1uru h ARG 138 N 0.48 -0.10 -0.66 1.90 1.12 -0.42 -1.78 114.38 114.93 1uru h ARG 138 Ca 0.00 0.01 0.08 0.00 -1.11 0.00 0.00 59.98 58.96 1uru h ARG 138 Cb 1.15 0.02 -0.04 0.00 -0.01 0.00 0.00 29.97 31.09 1uru h ARG 138 CO 0.11 0.23 0.43 -0.91 -3.11 0.00 0.00 179.97 176.72 1uru h ASN 139 N -0.43 0.52 0.12 -3.80 2.35 -1.21 -1.20 115.58 111.94 1uru h ASN 139 Ca -0.01 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1uru h ASN 139 Cb 0.37 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1uru h ASN 139 CO 0.02 0.33 -0.06 -0.09 -1.65 0.00 0.00 177.43 175.97 1uru h ARG 140 N 0.59 -0.16 -0.26 0.81 2.43 -1.30 -2.94 114.38 113.55 1uru h ARG 140 Ca 0.29 0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.55 1uru h ARG 140 Cb 0.38 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1uru h ARG 140 CO -0.09 0.31 0.30 0.87 -1.51 0.00 0.00 179.97 179.85 1uru h LYS 141 N -0.75 0.00 0.02 0.20 1.79 -0.97 -2.45 116.57 114.41 1uru h LYS 141 Ca -0.02 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.45 1uru h LYS 141 Cb 0.54 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.19 1uru h LYS 141 CO 0.03 0.00 -0.01 1.25 -1.08 0.00 0.00 179.45 179.64 1uru h LEU 142 N 0.00 -0.02 -1.03 2.94 5.85 -1.14 -2.66 115.31 119.25 1uru h LEU 142 Ca 0.12 -0.71 0.00 0.00 0.84 0.00 0.00 57.88 58.13 1uru h LEU 142 Cb 0.73 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.76 1uru h LEU 142 CO -0.00 0.73 0.00 0.16 -0.34 0.00 0.00 178.44 178.99 1uru h ILE 143 N -0.80 0.00 0.17 4.05 3.07 -1.27 -0.98 117.51 121.75 1uru h ILE 143 Ca -0.00 -0.26 -0.31 0.00 1.55 0.00 0.00 64.86 65.84 1uru h ILE 143 Cb 0.73 1.04 0.03 0.00 -0.27 0.00 0.00 36.82 38.35 1uru h ILE 143 CO 0.00 0.00 -1.32 -0.78 -1.05 0.00 0.00 178.15 175.00 1uru h ASP 144 N 0.00 0.77 -0.06 2.16 -0.00 -1.52 -2.41 116.42 115.36 1uru h ASP 144 Ca 0.00 -0.77 -0.09 0.00 -0.00 0.00 0.00 57.03 56.18 1uru h ASP 144 Cb 0.35 -0.25 0.00 0.00 -0.00 0.00 0.00 39.33 39.44 1uru h ASP 144 CO 0.00 1.58 -0.30 0.22 -0.00 0.00 0.00 179.24 180.74 1uru h TYR 145 N 0.19 0.43 -0.14 0.28 3.20 -1.03 -2.24 116.97 117.66 1uru h TYR 145 Ca -0.20 -0.19 -0.07 0.00 3.14 0.00 0.00 58.73 61.41 1uru h TYR 145 Cb 2.01 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 40.20 1uru h TYR 145 CO 0.11 0.92 -0.23 -0.44 -1.64 0.00 0.00 178.16 176.88 1uru h ASP 146 N -0.19 0.24 0.67 -2.11 3.32 -1.36 -1.54 116.42 115.44 1uru h ASP 146 Ca -0.02 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.96 1uru h ASP 146 Cb 0.96 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.44 1uru h ASP 146 CO 0.06 0.48 0.00 0.61 -1.72 0.00 0.00 179.24 178.67 1uru n GLY 147 N -0.63 -1.25 0.02 2.75 0.00 -0.90 -2.09 105.19 103.08 1uru n GLY 147 Ca -0.01 0.10 0.06 0.00 0.00 0.00 0.00 46.02 46.17 1uru n GLY 147 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1uru n GLN 148 N -2.27 0.63 0.11 1.61 6.02 -0.86 -3.33 117.38 119.29 1uru n GLN 148 Ca 0.02 -0.12 -0.13 0.00 -0.01 0.00 0.00 57.00 56.75 1uru n GLN 148 Cb 0.21 -1.36 -0.08 0.00 1.02 0.00 0.00 30.24 30.03 1uru n GLN 148 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1uru h ARG 149 N 0.00 -0.26 0.07 -1.09 2.47 -1.06 0.14 114.38 114.66 1uru h ARG 149 Ca -0.05 0.02 0.01 0.00 -1.26 0.00 0.00 59.98 58.69 1uru h ARG 149 Cb 0.85 0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 29.21 1uru h ARG 149 CO 0.00 0.03 -0.32 1.25 0.56 0.00 0.00 179.97 181.50 1uru h HIS 150 N -0.56 -0.92 -1.01 3.04 2.76 -1.65 -0.21 115.15 116.61 1uru h HIS 150 Ca -0.03 0.02 0.25 0.00 -2.20 0.00 0.00 60.37 58.42 1uru h HIS 150 Cb 0.41 0.39 -0.09 0.00 1.55 0.00 0.00 27.41 29.68 1uru h HIS 150 CO 0.02 -0.36 0.65 1.03 -1.30 0.00 0.00 177.93 177.97 1uru h SER 151 N -0.45 0.44 0.77 3.26 0.87 -1.58 -1.67 113.55 115.19 1uru h SER 151 Ca -0.00 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 1uru h SER 151 Cb 0.45 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.41 1uru h SER 151 CO -0.17 0.11 -1.15 0.33 -0.53 0.00 0.00 176.83 175.42 1uru n PHE 152 N -4.59 0.72 0.07 2.24 7.35 0.03 -3.07 117.46 120.22 1uru n PHE 152 Ca 0.24 0.21 -0.12 0.00 -0.76 0.00 0.00 57.45 57.02 1uru n PHE 152 Cb 0.83 -0.82 -0.03 0.00 0.35 0.00 0.00 39.48 39.81 1uru n PHE 152 CO 0.00 0.00 0.00 1.96 -0.76 0.00 0.00 176.76 177.96 1uru h GLN 153 N 0.00 0.35 -0.76 -4.13 4.20 -0.09 -2.31 115.11 112.36 1uru h GLN 153 Ca 0.00 -0.37 -0.10 0.00 0.06 0.00 0.00 58.65 58.24 1uru h GLN 153 Cb 0.96 0.10 -0.06 0.00 0.30 0.00 0.00 27.48 28.78 1uru h GLN 153 CO 0.00 1.05 0.12 0.27 -0.67 0.00 0.00 178.83 179.61 1uru n ASN 154 N -3.73 4.37 -0.12 1.46 0.23 -0.97 -2.17 115.26 114.33 1uru n ASN 154 Ca -0.06 -2.84 -0.18 0.00 -0.53 0.00 0.00 54.58 50.97 1uru n ASN 154 Cb 0.82 -0.67 -0.10 0.00 -2.08 0.00 0.00 39.78 37.74 1uru n ASN 154 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 1uru n LEU 155 N 0.17 2.74 -0.30 -4.53 -0.00 -1.17 -4.12 117.00 109.80 1uru n LEU 155 Ca 0.27 -0.04 -0.02 0.00 -0.00 0.00 0.00 56.01 56.23 1uru n LEU 155 Cb 1.08 -0.80 0.11 0.00 -0.00 0.00 0.00 43.42 43.81 1uru n LEU 155 CO 0.30 0.82 1.19 1.56 -0.00 0.00 0.00 177.39 181.27 1uru h GLN 156 N -0.18 0.97 0.00 1.96 4.20 -1.41 -3.12 115.11 117.53 1uru h GLN 156 Ca -0.54 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.11 1uru h GLN 156 Cb 1.76 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 29.32 1uru h GLN 156 CO -0.14 0.64 0.00 0.00 -0.67 0.00 0.00 178.83 178.66 1uru n ALA 157 N -2.34 -0.11 -0.35 3.87 0.00 -0.92 -3.46 120.51 117.20 1uru n ALA 157 Ca 0.10 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.60 1uru n ALA 157 Cb 0.10 0.00 0.24 0.00 0.00 0.00 0.00 19.45 19.79 1uru n ALA 157 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1uru h ASN 158 N 0.00 0.93 0.00 0.00 2.35 -1.72 -3.32 115.58 113.82 1uru h ASN 158 Ca 0.00 0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.74 1uru h ASN 158 Cb 0.00 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 1uru h ASN 158 CO 0.00 0.54 -1.27 0.00 -1.65 0.00 0.00 177.43 175.04 1uru n ALA 159 N -2.37 2.05 -2.33 -0.83 0.00 -1.19 -5.01 120.51 110.83 1uru n ALA 159 Ca 0.17 -0.21 -0.43 0.00 0.00 0.00 0.00 53.44 52.98 1uru n ALA 159 Cb 0.29 -0.03 -0.02 0.00 0.00 0.00 0.00 19.45 19.69 1uru n ALA 159 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1uru s ASN 160 N -3.03 6.90 0.04 0.00 0.01 -1.19 -5.02 114.94 112.64 1uru s ASN 160 Ca -0.02 1.85 -0.10 0.00 -0.71 0.00 0.00 52.86 53.88 1uru s ASN 160 Cb 0.02 -2.54 -0.05 0.00 0.41 0.00 0.00 41.25 39.09 1uru s ASN 160 CO 0.20 -0.76 0.36 -1.59 -1.51 0.00 0.00 177.10 173.80 1uru s LYS 161 N 3.30 3.73 0.48 -0.60 -2.85 -1.26 -4.92 119.74 117.63 1uru s LYS 161 Ca 0.59 0.15 0.19 0.00 -1.00 0.00 0.00 55.97 55.90 1uru s LYS 161 Cb -0.25 -3.07 1.22 0.00 -2.06 0.00 0.00 37.83 33.67 1uru s LYS 161 CO 0.19 0.61 2.00 0.00 0.10 0.00 0.00 175.35 178.26 1uru h ARG 162 N 4.02 0.18 0.00 1.78 3.08 -1.98 -3.10 114.38 118.37 1uru h ARG 162 Ca -0.50 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 59.44 1uru h ARG 162 Cb 1.20 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.20 1uru h ARG 162 CO 0.65 0.12 -0.45 0.87 -1.07 0.00 0.00 179.97 180.09 1uru h LYS 163 N 0.19 0.00 -4.36 0.04 1.57 -2.02 -3.43 116.57 108.56 1uru h LYS 163 Ca 0.25 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.51 1uru h LYS 163 Cb 0.74 0.00 -0.35 0.00 0.08 0.00 0.00 32.23 32.69 1uru h LYS 163 CO -0.04 0.45 -0.81 -0.51 -0.57 0.00 0.00 179.45 177.97 1uru s ASP 164 N -6.43 2.01 -0.44 0.86 1.01 -1.17 -5.09 116.67 107.42 1uru s ASP 164 Ca 0.03 -0.30 -0.14 0.00 0.71 0.00 0.00 52.55 52.85 1uru s ASP 164 Cb 0.08 -0.84 0.06 0.00 1.01 0.00 0.00 42.92 43.23 1uru s ASP 164 CO 0.73 -0.06 0.32 -1.81 0.21 0.00 0.00 175.17 174.56 1uru s ASP 165 N 1.28 5.99 0.87 0.27 1.11 -1.26 -4.36 116.67 120.57 1uru s ASP 165 Ca -0.03 -1.22 -0.12 0.00 0.18 0.00 0.00 52.55 51.36 1uru s ASP 165 Cb -0.14 -2.12 0.08 0.00 1.07 0.00 0.00 42.92 41.81 1uru s ASP 165 CO -0.04 -0.55 0.93 0.52 1.18 0.00 0.00 175.17 177.22 1uru n VAL 166 N 5.11 0.85 0.39 -1.27 0.31 -1.26 -4.85 118.33 117.62 1uru n VAL 166 Ca -0.12 -0.15 0.03 0.00 -0.01 0.00 0.00 64.34 64.10 1uru n VAL 166 Cb 0.45 -0.95 0.19 0.00 -0.91 0.00 0.00 33.84 32.62 1uru n VAL 166 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1uru n LYS 167 N -2.98 0.17 -0.00 5.55 5.02 -1.26 -2.63 118.16 122.02 1uru n LYS 167 Ca 0.11 0.09 -0.17 0.00 -2.02 0.00 0.00 58.31 56.32 1uru n LYS 167 Cb 0.52 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.96 1uru n LYS 167 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1uru h LEU 168 N 0.00 0.88 -0.32 -0.35 3.38 -2.02 -3.00 115.31 113.88 1uru h LEU 168 Ca 0.00 -0.61 0.00 0.00 0.09 0.00 0.00 57.88 57.36 1uru h LEU 168 Cb 0.03 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.51 1uru h LEU 168 CO 0.00 1.40 0.00 0.35 0.09 0.00 0.00 178.44 180.28 1uru n THR 169 N -3.90 0.08 -1.36 0.22 -2.24 -1.08 -2.53 114.28 103.48 1uru n THR 169 Ca -0.08 -0.11 -0.23 0.00 -2.27 0.00 0.00 64.05 61.36 1uru n THR 169 Cb 0.77 -0.04 0.14 0.00 -2.10 0.00 0.00 70.33 69.11 1uru n THR 169 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1uru n LYS 170 N -0.38 2.38 -0.17 -0.78 5.02 -1.13 -2.71 118.16 120.39 1uru n LYS 170 Ca 0.10 -3.20 0.09 0.00 -2.02 0.00 0.00 58.31 53.28 1uru n LYS 170 Cb 0.11 -2.15 0.27 0.00 -0.02 0.00 0.00 35.03 33.24 1uru n LYS 170 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1uru n GLY 171 N -1.05 0.96 0.35 0.72 0.00 -1.05 -3.98 105.19 101.13 1uru n GLY 171 Ca 0.55 -0.52 0.12 0.00 0.00 0.00 0.00 46.02 46.17 1uru n GLY 171 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1uru h ARG 172 N 2.87 0.35 -0.02 1.61 2.43 -1.76 -2.09 114.38 117.77 1uru h ARG 172 Ca 0.00 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.06 1uru h ARG 172 Cb 0.64 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 1uru h ARG 172 CO 0.00 0.23 -0.38 0.93 -1.51 0.00 0.00 179.97 179.24 1uru h GLU 173 N 0.36 0.05 0.04 0.20 5.08 -1.84 -2.70 114.58 115.77 1uru h GLU 173 Ca 0.24 -0.02 -0.23 0.00 -1.00 0.00 0.00 59.36 58.36 1uru h GLU 173 Cb 0.49 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 1uru h GLU 173 CO -0.06 0.43 -1.01 0.37 -1.00 0.00 0.00 179.01 177.74 1uru h GLN 174 N 0.04 0.27 -0.60 2.33 4.15 -1.71 -2.89 115.11 116.71 1uru h GLN 174 Ca 0.00 -0.34 -0.05 0.00 0.77 0.00 0.00 58.65 59.03 1uru h GLN 174 Cb 0.70 0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.48 1uru h GLN 174 CO 0.05 1.08 0.18 1.25 -1.93 0.00 0.00 178.83 179.46 1uru h LEU 175 N 0.13 0.88 -0.75 -2.39 5.85 -1.30 -2.44 115.31 115.27 1uru h LEU 175 Ca -0.08 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.43 1uru h LEU 175 Cb 1.68 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.48 1uru h LEU 175 CO 0.16 0.85 0.00 -0.62 -0.34 0.00 0.00 178.44 178.50 1uru n GLU 176 N -4.40 0.19 -0.03 1.25 -0.58 -1.03 -1.88 120.64 114.17 1uru n GLU 176 Ca 0.03 0.44 -0.14 0.00 -0.42 0.00 0.00 57.16 57.07 1uru n GLU 176 Cb 0.21 -1.88 -0.11 0.00 -0.57 0.00 0.00 31.44 29.08 1uru n GLU 176 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1uru h GLU 177 N 0.00 0.10 0.00 3.49 4.39 -1.23 -2.24 114.58 119.10 1uru h GLU 177 Ca 0.00 -0.11 -0.04 0.00 0.34 0.00 0.00 59.36 59.56 1uru h GLU 177 Cb 0.34 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 1uru h GLU 177 CO 0.00 0.85 -0.17 0.00 -1.16 0.00 0.00 179.01 178.54 1uru h ALA 178 N 0.25 1.34 0.13 3.43 0.00 -1.09 0.00 119.26 123.33 1uru h ALA 178 Ca -0.02 -0.15 -0.35 0.00 0.00 0.00 0.00 54.91 54.39 1uru h ALA 178 Cb 0.90 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1uru h ALA 178 CO 0.03 0.21 -1.84 -0.09 0.00 0.00 0.00 179.25 177.56 1uru h ARG 179 N 0.00 0.29 -0.42 0.00 2.43 -1.48 -1.68 114.38 113.51 1uru h ARG 179 Ca -0.00 -0.49 -0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1uru h ARG 179 Cb 0.40 0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 30.11 1uru h ARG 179 CO 0.02 1.18 0.26 -0.09 -1.51 0.00 0.00 179.97 179.83 1uru h ARG 180 N 0.08 0.57 -0.40 0.20 9.65 -1.24 -1.24 114.38 122.00 1uru h ARG 180 Ca -0.37 -0.05 -0.12 0.00 -1.10 0.00 0.00 59.98 58.34 1uru h ARG 180 Cb 2.05 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 30.50 1uru h ARG 180 CO 0.13 0.41 -0.25 0.00 2.80 0.00 0.00 179.97 183.06 1uru h THR 181 N 0.56 1.27 -0.13 0.20 1.03 -1.09 -2.62 112.91 112.13 1uru h THR 181 Ca 0.15 -1.38 -0.09 0.00 -0.01 0.00 0.00 66.41 65.08 1uru h THR 181 Cb -0.01 1.23 0.00 0.00 -1.07 0.00 0.00 68.15 68.30 1uru h THR 181 CO -0.03 0.46 -0.28 0.22 -0.01 0.00 0.00 175.52 175.88 1uru h TYR 182 N 0.71 0.54 -0.29 0.00 3.20 -1.29 -3.21 116.97 116.63 1uru h TYR 182 Ca 0.09 -0.20 0.07 0.00 3.14 0.00 0.00 58.73 61.83 1uru h TYR 182 Cb 0.78 -0.10 -0.08 0.00 1.54 0.00 0.00 36.73 38.87 1uru h TYR 182 CO 0.04 0.90 -0.28 0.93 -1.64 0.00 0.00 178.16 178.12 1uru h GLU 183 N 0.02 -0.25 -0.67 1.82 5.08 -1.12 0.71 114.58 120.17 1uru h GLU 183 Ca 0.00 0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1uru h GLU 183 Cb 0.88 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.16 1uru h GLU 183 CO 0.06 -0.17 0.33 0.97 -1.00 0.00 0.00 179.01 179.20 1uru h ILE 184 N -0.26 1.22 0.43 3.13 6.09 -1.57 -1.47 117.51 125.08 1uru h ILE 184 Ca 0.15 -0.62 -0.02 0.00 -1.37 0.00 0.00 64.86 62.99 1uru h ILE 184 Cb 0.50 0.40 0.00 0.00 0.47 0.00 0.00 36.82 38.19 1uru h ILE 184 CO -0.44 0.26 -0.21 -0.07 -3.07 0.00 0.00 178.15 174.62 1uru h LEU 185 N 0.93 -0.49 -0.90 2.19 3.38 -1.44 -1.56 115.31 117.41 1uru h LEU 185 Ca 0.23 -0.10 0.20 0.00 0.09 0.00 0.00 57.88 58.30 1uru h LEU 185 Cb 0.11 0.13 -0.12 0.00 0.09 0.00 0.00 40.66 40.87 1uru h LEU 185 CO -0.03 -0.13 0.44 -1.13 0.09 0.00 0.00 178.44 177.68 1uru h ASN 186 N -0.89 0.45 -0.34 -0.43 -1.24 -0.84 -0.66 115.58 111.62 1uru h ASN 186 Ca -0.06 0.13 -0.10 0.00 0.71 0.00 0.00 56.30 56.99 1uru h ASN 186 Cb 0.56 0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.69 1uru h ASN 186 CO 0.10 0.08 -0.16 0.74 -1.29 0.00 0.00 177.43 176.90 1uru h THR 187 N 0.50 1.29 -0.79 -3.57 2.02 -1.21 -1.56 112.91 109.58 1uru h THR 187 Ca 0.55 -1.27 -0.04 0.00 0.77 0.00 0.00 66.41 66.42 1uru h THR 187 Cb 0.98 1.38 -0.04 0.00 -1.74 0.00 0.00 68.15 68.73 1uru h THR 187 CO -0.47 0.42 0.35 -0.33 0.37 0.00 0.00 175.52 175.85 1uru h GLU 188 N 0.49 1.16 0.00 6.66 5.08 -0.63 -2.72 114.58 124.63 1uru h GLU 188 Ca 0.08 -0.19 -0.13 0.00 -1.00 0.00 0.00 59.36 58.11 1uru h GLU 188 Cb 0.70 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1uru h GLU 188 CO 0.05 0.92 -0.64 -0.07 -1.00 0.00 0.00 179.01 178.26 1uru h LEU 189 N 1.14 0.00 -1.53 1.33 -0.00 -1.01 0.27 115.31 115.50 1uru h LEU 189 Ca 0.27 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 58.10 1uru h LEU 189 Cb 0.17 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.82 1uru h LEU 189 CO -0.03 0.64 -0.23 0.45 -0.00 0.00 0.00 178.44 179.27 1uru h HIS 190 N 0.00 0.00 0.07 1.13 3.86 -0.97 -1.88 115.15 117.36 1uru h HIS 190 Ca -0.01 0.00 -0.36 0.00 -1.16 0.00 0.00 60.37 58.84 1uru h HIS 190 Cb 1.16 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.59 1uru h HIS 190 CO 0.00 0.23 -2.06 -0.25 0.86 0.00 0.00 177.93 176.72 1uru n ASP 191 N -3.81 2.05 -0.11 2.45 8.00 -1.14 -4.54 116.55 119.45 1uru n ASP 191 Ca -0.02 0.16 -0.14 0.00 0.71 0.00 0.00 54.79 55.51 1uru n ASP 191 Cb 0.33 -0.76 -0.02 0.00 -0.02 0.00 0.00 41.12 40.64 1uru n ASP 191 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1uru h GLU 192 N -0.16 0.92 0.60 -1.24 5.08 -0.38 -2.72 114.58 116.68 1uru h GLU 192 Ca -0.47 -0.51 -0.03 0.00 -1.00 0.00 0.00 59.36 57.35 1uru h GLU 192 Cb 1.88 0.03 0.01 0.00 0.50 0.00 0.00 28.75 31.16 1uru h GLU 192 CO -0.03 1.16 -0.29 -0.07 -1.00 0.00 0.00 179.01 178.79 1uru h LEU 193 N 0.74 -0.68 -1.41 1.33 3.38 -1.56 -1.70 115.31 115.41 1uru h LEU 193 Ca 0.05 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1uru h LEU 193 Cb 1.03 0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.93 1uru h LEU 193 CO 0.10 -0.38 0.30 1.55 0.09 0.00 0.00 178.44 180.11 1uru h PRO 194 N -0.96 0.70 -0.46 1.13 0.13 -1.79 -1.36 132.00 129.39 1uru h PRO 194 Ca -0.08 -0.06 0.08 0.00 -0.87 0.00 0.00 66.00 65.07 1uru h PRO 194 Cb 0.66 -0.15 -0.07 0.00 0.13 0.00 0.00 31.00 31.57 1uru h PRO 194 CO 0.13 0.50 0.05 0.00 -0.23 0.00 0.00 178.00 178.46 1uru h ALA 195 N 1.62 0.48 -0.44 -0.56 0.00 -1.39 -1.14 119.26 117.82 1uru h ALA 195 Ca 0.19 0.12 -0.12 0.00 0.00 0.00 0.00 54.91 55.10 1uru h ALA 195 Cb -0.01 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1uru h ALA 195 CO -0.03 -0.35 -0.19 1.25 0.00 0.00 0.00 179.25 179.93 1uru h LEU 196 N 0.17 0.88 -1.15 0.00 5.85 -0.77 -2.43 115.31 117.86 1uru h LEU 196 Ca 0.23 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 1uru h LEU 196 Cb 0.32 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1uru h LEU 196 CO -0.34 1.05 0.35 0.22 -0.34 0.00 0.00 178.44 179.38 1uru h TYR 197 N 0.76 0.93 -0.04 1.25 3.20 -0.96 -2.93 116.97 119.18 1uru h TYR 197 Ca 0.11 -0.02 -0.22 0.00 3.14 0.00 0.00 58.73 61.74 1uru h TYR 197 Cb 0.72 -0.30 0.01 0.00 1.54 0.00 0.00 36.73 38.70 1uru h TYR 197 CO 0.04 0.66 -0.88 -0.44 -1.64 0.00 0.00 178.16 175.89 1uru h ASP 198 N 0.95 0.66 -0.96 -2.11 3.32 -0.98 -2.77 116.42 114.53 1uru h ASP 198 Ca 0.24 -0.49 0.28 0.00 0.02 0.00 0.00 57.03 57.08 1uru h ASP 198 Cb 0.05 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.36 1uru h ASP 198 CO -0.04 1.27 0.86 0.77 -1.72 0.00 0.00 179.24 180.38 1uru h SER 199 N 0.32 0.00 -0.99 6.45 4.64 -1.25 -2.83 113.55 119.90 1uru h SER 199 Ca -0.07 0.00 0.22 0.00 -0.47 0.00 0.00 61.79 61.46 1uru h SER 199 Cb 1.51 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.50 1uru h SER 199 CO 0.16 0.00 0.62 0.08 -0.87 0.00 0.00 176.83 176.82 1uru h ARG 200 N 0.00 0.55 0.31 4.77 0.11 -1.48 -1.00 114.38 117.64 1uru h ARG 200 Ca 0.46 -0.03 -0.02 0.00 0.10 0.00 0.00 59.98 60.49 1uru h ARG 200 Cb 2.17 -0.12 0.00 0.00 1.11 0.00 0.00 29.97 33.13 1uru h ARG 200 CO -0.00 0.36 -0.15 0.82 0.10 0.00 0.00 179.97 181.10 1uru h ILE 201 N 0.56 0.46 -0.99 0.08 2.04 -1.73 -2.53 117.51 115.40 1uru h ILE 201 Ca 0.56 -0.79 0.07 0.00 1.00 0.00 0.00 64.86 65.70 1uru h ILE 201 Cb 1.15 0.74 -0.07 0.00 -0.74 0.00 0.00 36.82 37.90 1uru h ILE 201 CO -0.31 0.11 0.64 0.25 0.00 0.00 0.00 178.15 178.84 1uru h LEU 202 N -0.97 1.02 -0.13 1.44 5.85 -1.68 -0.79 115.31 120.04 1uru h LEU 202 Ca -0.04 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.71 1uru h LEU 202 Cb 0.50 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1uru h LEU 202 CO 0.07 0.64 -0.02 0.15 -0.34 0.00 0.00 178.44 178.94 1uru h PHE 203 N 1.15 -0.05 -0.20 1.25 3.57 -1.21 -2.26 116.94 119.19 1uru h PHE 203 Ca 0.43 0.01 -0.16 0.00 3.53 0.00 0.00 57.97 61.78 1uru h PHE 203 Cb 0.19 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 1uru h PHE 203 CO -0.00 -0.04 -0.53 -0.07 -2.23 0.00 0.00 178.31 175.43 1uru h LEU 204 N 0.02 0.66 -0.98 0.59 4.07 -0.89 -0.11 115.31 118.66 1uru h LEU 204 Ca 0.06 -0.35 -0.04 0.00 0.08 0.00 0.00 57.88 57.64 1uru h LEU 204 Cb 0.09 -0.19 -0.03 0.00 1.08 0.00 0.00 40.66 41.61 1uru h LEU 204 CO -0.12 1.07 0.28 -0.37 -1.08 0.00 0.00 178.44 178.22 1uru h VAL 205 N 0.46 1.24 -0.06 1.22 -1.51 -1.16 -0.91 116.25 115.54 1uru h VAL 205 Ca 0.01 -0.73 -0.20 0.00 -1.23 0.00 0.00 66.70 64.55 1uru h VAL 205 Cb 1.08 0.40 0.01 0.00 -2.13 0.00 0.00 31.29 30.66 1uru h VAL 205 CO 0.10 0.30 -0.73 0.71 -1.23 0.00 0.00 177.57 176.71 1uru h THR 206 N 1.00 1.34 0.08 7.19 1.35 -1.14 -2.10 112.91 120.64 1uru h THR 206 Ca 0.23 -2.04 -0.00 0.00 -0.55 0.00 0.00 66.41 64.05 1uru h THR 206 Cb 0.18 2.32 0.00 0.00 -1.73 0.00 0.00 68.15 68.92 1uru h THR 206 CO -0.02 0.62 -0.04 -1.13 -0.25 0.00 0.00 175.52 174.70 1uru h ASN 207 N 0.21 -0.10 -0.06 5.36 -1.24 -0.92 -2.49 115.58 116.36 1uru h ASN 207 Ca -0.08 -0.32 -0.01 0.00 0.71 0.00 0.00 56.30 56.60 1uru h ASN 207 Cb 1.40 0.02 -0.01 0.00 0.73 0.00 0.00 38.32 40.47 1uru h ASN 207 CO 0.15 0.28 0.01 -0.07 -1.29 0.00 0.00 177.43 176.51 1uru h LEU 208 N -0.49 0.13 -0.18 0.34 3.38 -1.28 -0.27 115.31 116.94 1uru h LEU 208 Ca -0.01 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1uru h LEU 208 Cb 0.41 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1uru h LEU 208 CO 0.02 0.15 0.04 -0.61 0.09 0.00 0.00 178.44 178.13 1uru h GLN 209 N 0.15 0.29 -0.18 1.13 -0.00 -1.19 0.28 115.11 115.59 1uru h GLN 209 Ca 0.04 -0.07 0.01 0.00 -0.00 0.00 0.00 58.65 58.63 1uru h GLN 209 Cb 0.08 -0.04 -0.01 0.00 0.00 0.00 0.00 27.48 27.51 1uru h GLN 209 CO -0.00 0.43 0.09 1.15 0.00 0.00 0.00 178.83 180.50 1uru h THR 210 N 0.10 1.00 -0.17 2.39 2.02 -1.16 -2.26 112.91 114.84 1uru h THR 210 Ca 0.06 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1uru h THR 210 Cb 0.27 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 1uru h THR 210 CO 0.00 0.03 0.08 0.25 0.37 0.00 0.00 175.52 176.26 1uru h LEU 211 N 0.19 0.22 -0.78 2.58 5.85 -0.80 -1.80 115.31 120.78 1uru h LEU 211 Ca 0.07 -0.12 -0.13 0.00 0.84 0.00 0.00 57.88 58.54 1uru h LEU 211 Cb 0.01 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 1uru h LEU 211 CO -0.05 0.28 -0.58 -0.26 -0.34 0.00 0.00 178.44 177.49 1uru h PHE 212 N 0.15 0.13 -0.11 1.25 0.05 -0.42 -1.75 116.94 116.25 1uru h PHE 212 Ca 0.06 -0.05 -0.16 0.00 3.82 0.00 0.00 57.97 61.64 1uru h PHE 212 Cb 0.11 -0.02 -0.01 0.00 2.00 0.00 0.00 35.95 38.03 1uru h PHE 212 CO -0.03 0.66 -0.61 0.00 -0.18 0.00 0.00 178.31 178.14 1uru h ALA 213 N 1.33 0.73 -0.24 2.45 0.00 -1.37 -0.54 119.26 121.62 1uru h ALA 213 Ca -0.00 -0.55 -0.06 0.00 0.00 0.00 0.00 54.91 54.30 1uru h ALA 213 Cb 1.04 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1uru h ALA 213 CO 0.08 0.72 -0.09 1.15 0.00 0.00 0.00 179.25 181.11 1uru h THR 214 N 0.29 1.29 -0.05 0.00 2.02 -0.95 -1.31 112.91 114.21 1uru h THR 214 Ca -0.01 -1.13 -0.00 0.00 0.77 0.00 0.00 66.41 66.04 1uru h THR 214 Cb 1.15 1.53 -0.00 0.00 -1.74 0.00 0.00 68.15 69.09 1uru h THR 214 CO 0.10 0.35 0.03 -0.33 0.37 0.00 0.00 175.52 176.05 1uru h GLU 215 N 0.22 0.07 -0.11 6.66 4.39 -1.32 -2.09 114.58 122.40 1uru h GLU 215 Ca 0.06 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.78 1uru h GLU 215 Cb 0.57 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.18 1uru h GLU 215 CO 0.03 0.11 -0.10 0.37 -1.16 0.00 0.00 179.01 178.26 1uru h GLN 216 N 0.01 -0.11 -0.06 2.33 5.75 -0.97 -0.76 115.11 121.30 1uru h GLN 216 Ca 0.02 0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.52 1uru h GLN 216 Cb 0.06 0.03 -0.00 0.00 1.07 0.00 0.00 27.48 28.63 1uru h GLN 216 CO -0.00 -0.08 0.02 0.28 -2.65 0.00 0.00 178.83 176.41 1uru h VAL 217 N -0.12 1.13 -0.58 2.39 2.07 -1.20 -1.22 116.25 118.72 1uru h VAL 217 Ca 0.08 -0.38 0.07 0.00 0.82 0.00 0.00 66.70 67.28 1uru h VAL 217 Cb 0.23 1.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.22 1uru h VAL 217 CO -0.18 0.11 0.26 0.15 0.02 0.00 0.00 177.57 177.93 1uru h PHE 218 N -0.05 0.47 -0.07 1.57 3.57 -1.15 -0.99 116.94 120.29 1uru h PHE 218 Ca 0.02 0.03 -0.19 0.00 3.53 0.00 0.00 57.97 61.36 1uru h PHE 218 Cb 0.15 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 38.76 1uru h PHE 218 CO -0.02 0.18 -0.74 0.45 -2.23 0.00 0.00 178.31 175.95 1uru h HIS 219 N 0.49 0.56 0.17 0.41 3.86 -0.95 -1.28 115.15 118.41 1uru h HIS 219 Ca 0.27 -0.25 -0.31 0.00 -1.16 0.00 0.00 60.37 58.92 1uru h HIS 219 Cb 0.26 -0.08 0.03 0.00 1.06 0.00 0.00 27.41 28.67 1uru h HIS 219 CO -0.13 1.01 -1.33 -0.97 0.86 0.00 0.00 177.93 177.37 1uru h ASN 220 N 0.28 0.79 0.02 2.45 -0.00 -1.02 -1.11 115.58 116.98 1uru h ASN 220 Ca -0.03 -0.79 -0.00 0.00 -0.00 0.00 0.00 56.30 55.48 1uru h ASN 220 Cb 1.32 -0.25 0.00 0.00 -0.00 0.00 0.00 38.32 39.39 1uru h ASN 220 CO 0.13 1.60 -0.01 -0.33 -0.00 0.00 0.00 177.43 178.82 1uru h GLU 221 N 0.20 -0.02 -0.74 6.67 4.39 -1.24 -2.47 114.58 121.36 1uru h GLU 221 Ca -0.20 0.00 0.20 0.00 0.34 0.00 0.00 59.36 59.70 1uru h GLU 221 Cb 2.02 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 30.64 1uru h GLU 221 CO 0.25 0.45 0.52 1.15 -1.16 0.00 0.00 179.01 180.22 1uru h THR 222 N -0.50 0.66 -0.05 1.13 2.02 -1.29 -1.56 112.91 113.32 1uru h THR 222 Ca -0.00 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 1uru h THR 222 Cb 0.48 0.58 -0.00 0.00 -1.74 0.00 0.00 68.15 67.47 1uru h THR 222 CO 0.00 0.01 -0.02 0.00 0.37 0.00 0.00 175.52 175.88 1uru h ALA 223 N 1.64 0.07 -0.97 6.16 0.00 -0.98 -2.40 119.26 122.78 1uru h ALA 223 Ca 0.36 -0.23 0.24 0.00 0.00 0.00 0.00 54.91 55.27 1uru h ALA 223 Cb 1.31 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 19.02 1uru h ALA 223 CO -0.03 -0.20 0.64 0.87 0.00 0.00 0.00 179.25 180.54 1uru h LYS 224 N -0.29 0.34 -0.10 0.00 1.57 -0.85 -1.68 116.57 115.56 1uru h LYS 224 Ca 0.01 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 1uru h LYS 224 Cb 0.45 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1uru h LYS 224 CO 0.01 0.22 -0.26 0.82 -0.57 0.00 0.00 179.45 179.67 1uru h ILE 225 N 0.35 1.40 0.00 1.86 2.04 -1.17 -2.77 117.51 119.21 1uru h ILE 225 Ca 0.51 -1.59 -0.07 0.00 1.00 0.00 0.00 64.86 64.72 1uru h ILE 225 Cb 1.39 2.17 -0.01 0.00 -0.74 0.00 0.00 36.82 39.63 1uru h ILE 225 CO -0.19 0.46 -0.33 1.88 0.00 0.00 0.00 178.15 179.97 1uru h TYR 226 N -0.10 0.00 0.00 1.37 -1.99 -0.89 -0.78 116.97 114.57 1uru h TYR 226 Ca -0.00 0.00 -0.15 0.00 2.00 0.00 0.00 58.73 60.57 1uru h TYR 226 Cb 0.87 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.58 1uru h TYR 226 CO 0.11 0.33 -0.73 0.66 -0.00 0.00 0.00 178.16 178.53 1uru h SER 227 N 0.00 0.00 -0.68 3.88 4.64 -1.36 0.30 113.55 120.33 1uru h SER 227 Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1uru h SER 227 Cb 0.66 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.72 1uru h SER 227 CO 0.04 0.73 0.41 -0.08 -0.87 0.00 0.00 176.83 177.07 1uru h GLU 228 N 0.00 0.91 -0.43 4.77 4.57 -1.14 -1.47 114.58 121.80 1uru h GLU 228 Ca -0.01 -0.08 -0.11 0.00 -1.18 0.00 0.00 59.36 57.98 1uru h GLU 228 Cb 1.55 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 29.94 1uru h GLU 228 CO 0.10 0.65 -0.16 -0.07 -1.18 0.00 0.00 179.01 178.34 1uru h LEU 229 N 0.92 0.89 -0.61 1.64 3.38 -0.89 -1.51 115.31 119.12 1uru h LEU 229 Ca 0.24 -0.39 0.09 0.00 0.09 0.00 0.00 57.88 57.92 1uru h LEU 229 Cb -0.04 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.40 1uru h LEU 229 CO -0.05 1.07 0.23 -0.08 0.09 0.00 0.00 178.44 179.71 1uru h GLU 230 N 0.69 0.40 0.29 1.13 4.81 -0.86 -2.30 114.58 118.75 1uru h GLU 230 Ca 0.10 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1uru h GLU 230 Cb 0.72 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.01 1uru h GLU 230 CO 0.05 0.26 -0.14 0.00 -0.73 0.00 0.00 179.01 178.46 1uru h ALA 231 N 1.42 -0.39 -0.94 2.92 0.00 -0.71 -1.85 119.26 119.71 1uru h ALA 231 Ca 0.31 -0.19 0.25 0.00 0.00 0.00 0.00 54.91 55.29 1uru h ALA 231 Cb 0.38 0.15 -0.17 0.00 0.00 0.00 0.00 17.79 18.16 1uru h ALA 231 CO -0.31 -0.54 0.06 0.82 0.00 0.00 0.00 179.25 179.29 1uru h ILE 232 N -0.76 0.11 0.00 0.00 2.04 -1.28 -0.46 117.51 117.16 1uru h ILE 232 Ca -0.04 -0.02 -0.09 0.00 1.00 0.00 0.00 64.86 65.71 1uru h ILE 232 Cb 0.50 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 1uru h ILE 232 CO 0.07 0.01 -0.44 0.58 0.00 0.00 0.00 178.15 178.37 1uru h VAL 233 N 0.05 0.88 -0.49 1.67 2.07 -1.10 -2.50 116.25 116.83 1uru h VAL 233 Ca 0.57 -1.83 -0.04 0.00 0.82 0.00 0.00 66.70 66.22 1uru h VAL 233 Cb 1.15 2.14 -0.02 0.00 -1.52 0.00 0.00 31.29 33.04 1uru h VAL 233 CO -0.84 0.43 0.16 0.44 0.02 0.00 0.00 177.57 177.77 1uru h ASP 234 N 0.00 0.71 -0.30 0.57 3.32 -0.26 -1.43 116.42 119.03 1uru h ASP 234 Ca -0.00 -0.20 -0.08 0.00 0.02 0.00 0.00 57.03 56.77 1uru h ASP 234 Cb 1.11 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.46 1uru h ASP 234 CO 0.06 0.72 -0.07 0.11 -1.72 0.00 0.00 179.24 178.33 1uru h LYS 235 N 0.66 0.69 -0.12 3.56 1.57 -1.17 0.30 116.57 122.06 1uru h LYS 235 Ca 0.16 -0.20 -0.15 0.00 -1.87 0.00 0.00 60.65 58.59 1uru h LYS 235 Cb 0.26 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1uru h LYS 235 CO -0.01 0.76 -0.56 1.25 -0.57 0.00 0.00 179.45 180.32 1uru h LEU 236 N 0.64 0.40 -0.90 2.94 5.85 -1.38 -2.15 115.31 120.72 1uru h LEU 236 Ca 0.12 -0.22 -0.11 0.00 0.84 0.00 0.00 57.88 58.51 1uru h LEU 236 Cb 0.51 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 1uru h LEU 236 CO 0.03 0.88 -0.36 0.00 -0.34 0.00 0.00 178.44 178.64 1uru h ALA 237 N 1.13 1.06 0.06 1.25 0.00 -0.73 -1.94 119.26 120.09 1uru h ALA 237 Ca 0.00 -0.40 -0.13 0.00 0.00 0.00 0.00 54.91 54.38 1uru h ALA 237 Cb 1.07 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.77 1uru h ALA 237 CO 0.09 0.59 -0.56 1.79 0.00 0.00 0.00 179.25 181.16 1uru h THR 238 N 0.31 1.53 0.71 0.00 1.35 -0.91 -3.15 112.91 112.74 1uru h THR 238 Ca 0.03 -2.28 -0.03 0.00 -0.55 0.00 0.00 66.41 63.58 1uru h THR 238 Cb 0.79 2.98 0.01 0.00 -1.73 0.00 0.00 68.15 70.19 1uru h THR 238 CO 0.06 0.64 -0.34 -0.08 -0.25 0.00 0.00 175.52 175.55 1uru h GLU 239 N -0.39 -0.92 0.00 4.72 4.81 -1.42 -2.85 114.58 118.53 1uru h GLU 239 Ca -0.09 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1uru h GLU 239 Cb 1.36 0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.95 1uru h GLU 239 CO 0.11 -0.58 0.00 -1.13 -0.73 0.00 0.00 179.01 176.67 1uru n SER 240 N -5.44 0.06 -0.04 1.04 3.41 -0.73 -2.99 113.62 108.92 1uru n SER 240 Ca -0.13 0.52 -0.14 0.00 -0.26 0.00 0.00 58.87 58.87 1uru n SER 240 Cb 0.39 -0.53 -0.14 0.00 -0.26 0.00 0.00 64.21 63.67 1uru n SER 240 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1uru n GLN 241 N -1.57 0.68 0.00 4.33 3.00 -1.09 -5.07 117.38 117.66 1uru n GLN 241 Ca 0.01 0.21 0.09 0.00 -0.01 0.00 0.00 57.00 57.29 1uru n GLN 241 Cb 0.04 -1.68 0.52 0.00 0.00 0.00 0.00 30.24 29.12 1uru n GLN 241 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.06 179.95