#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hji s ALA 2 N 0.00 -0.89 -0.05 -0.43 0.00 -1.26 -4.88 121.76 114.24 2hji s ALA 2 Ca 0.00 0.11 -0.00 0.00 0.00 0.00 0.00 51.96 52.06 2hji s ALA 2 Cb 0.00 0.46 0.03 0.00 0.00 0.00 0.00 23.12 23.60 2hji s ALA 2 CO 0.00 -0.51 -0.02 -1.17 0.00 0.00 0.00 175.76 174.06 2hji s LEU 3 N -2.30 0.98 -0.03 0.00 2.96 -1.23 -3.70 118.68 115.36 2hji s LEU 3 Ca -0.02 -0.09 0.03 0.00 -0.22 0.00 0.00 54.13 53.82 2hji s LEU 3 Cb 0.00 -0.41 0.00 0.00 0.50 0.00 0.00 46.19 46.28 2hji s LEU 3 CO -0.06 -0.12 -0.11 -0.89 -1.32 0.00 0.00 176.35 173.85 2hji s THR 4 N 1.40 0.91 -0.12 3.68 2.01 -0.91 -2.92 115.64 119.69 2hji s THR 4 Ca -0.04 -0.43 -0.04 0.00 0.31 0.00 0.00 61.69 61.49 2hji s THR 4 Cb -0.13 -0.80 0.06 0.00 0.01 0.00 0.00 72.50 71.64 2hji s THR 4 CO -0.03 0.28 0.13 -0.63 -0.69 0.00 0.00 174.62 173.68 2hji s ILE 5 N 0.12 -0.19 0.41 1.82 1.01 -1.13 -0.84 121.20 122.40 2hji s ILE 5 Ca -0.02 0.13 0.08 0.00 0.00 0.00 0.00 60.65 60.83 2hji s ILE 5 Cb -0.09 -0.42 -0.03 0.00 0.01 0.00 0.00 42.46 41.93 2hji s ILE 5 CO 0.01 -0.04 0.29 0.72 0.00 0.00 0.00 174.94 175.91 2hji s PHE 6 N 2.23 2.67 0.49 3.97 -0.71 -1.24 -3.89 117.98 121.50 2hji s PHE 6 Ca 0.04 -0.52 -0.14 0.00 -1.04 0.00 0.00 56.93 55.27 2hji s PHE 6 Cb -0.14 -2.06 -0.07 0.00 -1.21 0.00 0.00 43.02 39.54 2hji s PHE 6 CO -0.07 0.03 0.92 -1.54 -1.34 0.00 0.00 175.22 173.22 2hji s SER 7 N -4.02 6.56 0.65 1.98 1.04 -1.20 -3.39 113.70 115.32 2hji s SER 7 Ca 0.45 1.42 0.42 0.00 0.48 0.00 0.00 55.95 58.72 2hji s SER 7 Cb -0.00 -2.45 2.27 0.00 0.10 0.00 0.00 66.02 65.94 2hji s SER 7 CO 0.25 -0.55 2.32 1.62 0.98 0.00 0.00 173.24 177.87 2hji h VAL 8 N 0.87 0.05 0.01 5.02 3.04 0.10 -2.13 116.25 123.21 2hji h VAL 8 Ca -0.47 -0.07 -0.33 0.00 -1.01 0.00 0.00 66.70 64.82 2hji h VAL 8 Cb 1.19 1.07 -0.05 0.00 -2.01 0.00 0.00 31.29 31.48 2hji h VAL 8 CO 0.62 0.00 -1.99 0.29 -1.01 0.00 0.00 177.57 175.48 2hji n LYS 9 N -3.14 0.66 -3.80 4.17 5.02 -1.26 -4.63 118.16 115.18 2hji n LYS 9 Ca -0.03 0.19 -0.31 0.00 -2.02 0.00 0.00 58.31 56.14 2hji n LYS 9 Cb 0.10 -1.69 -0.10 0.00 -0.02 0.00 0.00 35.03 33.33 2hji n LYS 9 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2hji s ASP 10 N -6.03 5.30 0.04 4.39 -1.08 -0.80 -4.88 116.67 113.61 2hji s ASP 10 Ca -0.10 -3.81 0.27 0.00 -0.52 0.00 0.00 52.55 48.39 2hji s ASP 10 Cb 0.07 -1.75 0.87 0.00 -1.46 0.00 0.00 42.92 40.65 2hji s ASP 10 CO 0.81 -0.12 1.69 -0.81 0.52 0.00 0.00 175.17 177.26 2hji n PRO 11 N 2.11 0.07 0.02 4.34 -0.04 -1.21 -3.22 135.00 137.07 2hji n PRO 11 Ca 0.20 0.04 -0.02 0.00 -0.04 0.00 0.00 63.50 63.68 2hji n PRO 11 Cb 0.36 -1.56 -0.10 0.00 -0.04 0.00 0.00 33.50 32.16 2hji n PRO 11 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2hji n GLN 12 N -1.68 0.63 -3.75 0.54 7.27 -1.26 -4.70 117.38 114.43 2hji n GLN 12 Ca 0.06 0.23 -0.30 0.00 0.07 0.00 0.00 57.00 57.06 2hji n GLN 12 Cb 0.36 -1.79 -0.14 0.00 2.41 0.00 0.00 30.24 31.08 2hji n GLN 12 CO 0.00 0.00 0.00 1.21 0.07 0.00 0.00 177.06 178.34 2hji s ASN 13 N -5.81 3.95 0.25 1.69 3.84 -1.25 -5.11 114.94 112.50 2hji s ASN 13 Ca -0.04 -2.10 -0.30 0.00 0.21 0.00 0.00 52.86 50.64 2hji s ASN 13 Cb 0.09 -1.01 -0.09 0.00 -0.55 0.00 0.00 41.25 39.68 2hji s ASN 13 CO 0.82 -0.35 1.15 -0.44 -2.79 0.00 0.00 177.10 175.49 2hji s SER 14 N 1.03 7.16 -0.25 -4.21 0.01 -1.26 -4.77 113.70 111.41 2hji s SER 14 Ca 0.13 2.30 0.04 0.00 1.31 0.00 0.00 55.95 59.73 2hji s SER 14 Cb -0.20 -2.62 0.45 0.00 0.21 0.00 0.00 66.02 63.85 2hji s SER 14 CO -0.13 -0.26 1.52 0.18 0.41 0.00 0.00 173.24 174.96 2hji n LEU 15 N 1.61 5.06 -3.15 2.44 4.77 -1.26 -4.73 117.00 121.74 2hji n LEU 15 Ca 0.01 -2.65 0.04 0.00 -0.03 0.00 0.00 56.01 53.38 2hji n LEU 15 Cb 0.44 -0.69 -0.01 0.00 -2.33 0.00 0.00 43.42 40.83 2hji n LEU 15 CO 0.55 0.76 0.24 0.86 -1.33 0.00 0.00 177.39 178.47 2hji s TRP 16 N -2.10 -1.43 -0.07 -1.77 -0.00 -1.25 -5.08 118.94 107.24 2hji s TRP 16 Ca 0.36 1.30 -0.00 0.00 -0.00 0.00 0.00 56.10 57.76 2hji s TRP 16 Cb 0.30 0.42 0.03 0.00 -0.00 0.00 0.00 33.47 34.21 2hji s TRP 16 CO 0.08 -0.80 -0.02 -1.58 -0.00 0.00 0.00 176.95 174.63 2hji s HIS 17 N 2.87 0.78 -0.26 5.86 5.65 -1.26 -2.84 115.29 126.09 2hji s HIS 17 Ca 0.15 -0.24 -0.18 0.00 0.25 0.00 0.00 55.06 55.04 2hji s HIS 17 Cb -0.12 -0.80 0.07 0.00 -1.18 0.00 0.00 32.58 30.55 2hji s HIS 17 CO -0.21 -0.30 0.66 0.45 -0.65 0.00 0.00 174.74 174.69 2hji s SER 18 N 1.60 -0.82 -0.36 9.88 0.15 -1.15 -5.07 113.70 117.93 2hji s SER 18 Ca -0.00 1.41 0.00 0.00 0.70 0.00 0.00 55.95 58.06 2hji s SER 18 Cb -0.13 1.34 0.12 0.00 -1.71 0.00 0.00 66.02 65.64 2hji s SER 18 CO -0.04 -0.23 0.16 0.28 1.20 0.00 0.00 173.24 174.61 2hji s THR 19 N 1.13 1.00 0.03 6.45 -1.32 -1.26 -3.52 115.64 118.14 2hji s THR 19 Ca -0.06 -1.86 0.01 0.00 -1.21 0.00 0.00 61.69 58.57 2hji s THR 19 Cb -0.05 -1.73 -0.02 0.00 -1.51 0.00 0.00 72.50 69.18 2hji s THR 19 CO -0.11 -0.79 -0.05 0.20 -2.21 0.00 0.00 174.62 171.66 2hji s ASN 20 N 1.10 0.53 0.10 8.08 -0.87 -1.26 -4.98 114.94 117.64 2hji s ASN 20 Ca 0.13 -0.55 -0.29 0.00 -1.57 0.00 0.00 52.86 50.59 2hji s ASN 20 Cb -0.21 0.07 -0.11 0.00 -0.02 0.00 0.00 41.25 40.99 2hji s ASN 20 CO -0.13 -0.27 1.63 0.00 -2.57 0.00 0.00 177.10 175.76 2hji h ALA 21 N 4.51 -0.57 -0.21 0.60 0.00 -1.99 0.13 119.26 121.73 2hji h ALA 21 Ca -0.34 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.41 2hji h ALA 21 Cb 1.20 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 2hji h ALA 21 CO 0.42 -0.86 -0.23 1.49 0.00 0.00 0.00 179.25 180.07 2hji h GLU 22 N -0.58 0.39 -0.13 0.00 4.81 -1.98 -1.69 114.58 115.40 2hji h GLU 22 Ca 0.00 -0.13 -0.05 0.00 -0.13 0.00 0.00 59.36 59.05 2hji h GLU 22 Cb 0.55 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.90 2hji h GLU 22 CO -0.09 0.60 -0.12 0.93 -0.73 0.00 0.00 179.01 179.59 2hji h GLU 23 N 0.35 0.31 -0.52 1.92 4.39 -1.86 -1.08 114.58 118.09 2hji h GLU 23 Ca 0.06 -0.16 -0.06 0.00 0.34 0.00 0.00 59.36 59.54 2hji h GLU 23 Cb 0.60 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.23 2hji h GLU 23 CO 0.04 0.71 0.08 0.82 -1.16 0.00 0.00 179.01 179.50 2hji h ILE 24 N -0.08 1.23 -0.40 3.13 2.04 -0.69 -2.17 117.51 120.57 2hji h ILE 24 Ca 0.02 -0.88 -0.10 0.00 1.00 0.00 0.00 64.86 64.90 2hji h ILE 24 Cb 0.65 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 2hji h ILE 24 CO 0.03 0.32 -0.15 1.56 0.00 0.00 0.00 178.15 179.91 2hji h GLN 25 N 0.78 0.81 -0.42 2.37 4.20 -1.23 -1.43 115.11 120.19 2hji h GLN 25 Ca 0.16 -0.34 -0.05 0.00 0.06 0.00 0.00 58.65 58.49 2hji h GLN 25 Cb 0.35 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 2hji h GLN 25 CO 0.01 0.96 0.08 1.96 -0.67 0.00 0.00 178.83 181.17 2hji h GLN 26 N 0.62 0.68 -0.14 1.46 4.20 -0.92 0.42 115.11 121.43 2hji h GLN 26 Ca 0.09 -0.18 -0.10 0.00 0.06 0.00 0.00 58.65 58.53 2hji h GLN 26 Cb 0.70 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.40 2hji h GLN 26 CO 0.05 0.71 -0.29 1.96 -0.67 0.00 0.00 178.83 180.59 2hji h GLN 27 N 0.54 0.45 -0.17 1.46 1.08 -1.40 -1.46 115.11 115.61 2hji h GLN 27 Ca 0.13 -0.29 -0.08 0.00 -1.45 0.00 0.00 58.65 56.96 2hji h GLN 27 Cb 0.35 0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.82 2hji h GLN 27 CO 0.01 0.89 -0.19 -0.07 -0.95 0.00 0.00 178.83 178.52 2hji h LEU 28 N 0.06 0.46 -0.77 1.46 3.38 -1.27 -3.16 115.31 115.46 2hji h LEU 28 Ca 0.00 -0.49 -0.07 0.00 0.09 0.00 0.00 57.88 57.41 2hji h LEU 28 Cb 0.88 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.47 2hji h LEU 28 CO 0.06 0.86 0.10 0.78 0.09 0.00 0.00 178.44 180.34 2hji h ASN 29 N 0.07 0.98 0.00 -0.43 -0.26 -0.95 -1.52 115.58 113.48 2hji h ASN 29 Ca 0.02 -0.23 0.00 0.00 -0.56 0.00 0.00 56.30 55.54 2hji h ASN 29 Cb 0.74 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 37.74 2hji h ASN 29 CO 0.05 0.98 0.13 0.00 -1.06 0.00 0.00 177.43 177.53 2hji n ALA 30 N -2.47 0.86 0.80 -0.83 0.00 -0.55 0.11 120.51 118.44 2hji n ALA 30 Ca 0.04 0.17 0.12 0.00 0.00 0.00 0.00 53.44 53.77 2hji n ALA 30 Cb 0.28 -1.09 0.13 0.00 0.00 0.00 0.00 19.45 18.77 2hji n ALA 30 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2hji n LYS 31 N -2.18 2.33 -0.98 0.00 4.76 -0.59 -4.93 118.16 116.57 2hji n LYS 31 Ca -0.01 -2.01 0.00 0.00 -2.87 0.00 0.00 58.31 53.42 2hji n LYS 31 Cb 0.16 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 31.88 2hji n LYS 31 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2hji n GLY 32 N 1.37 0.63 3.50 0.72 0.00 0.31 -5.00 105.19 106.72 2hji n GLY 32 Ca 0.15 -0.76 -0.32 0.00 0.00 0.00 0.00 46.02 45.09 2hji n GLY 32 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2hji s VAL 33 N -2.00 3.17 0.17 1.61 -7.23 -1.10 -4.77 120.40 110.25 2hji s VAL 33 Ca 0.00 -0.78 -0.22 0.00 -1.81 0.00 0.00 61.98 59.17 2hji s VAL 33 Cb 0.00 -2.28 -0.08 0.00 0.56 0.00 0.00 36.38 34.58 2hji s VAL 33 CO 0.00 0.53 0.73 -0.60 -0.31 0.00 0.00 175.10 175.44 2hji s ARG 34 N -0.94 4.40 -0.19 4.82 6.06 -1.25 -3.51 118.95 128.33 2hji s ARG 34 Ca 0.13 1.00 -0.08 0.00 -2.50 0.00 0.00 55.73 54.28 2hji s ARG 34 Cb -0.11 -3.12 0.08 0.00 0.06 0.00 0.00 34.95 31.86 2hji s ARG 34 CO 0.02 0.52 0.42 0.12 -2.50 0.00 0.00 175.30 173.88 2hji s PHE 35 N -1.27 -0.74 0.19 5.12 2.19 -1.26 -3.11 117.98 119.10 2hji s PHE 35 Ca 0.37 1.46 -0.07 0.00 0.33 0.00 0.00 56.93 59.01 2hji s PHE 35 Cb -0.20 0.29 -0.02 0.00 -1.31 0.00 0.00 43.02 41.78 2hji s PHE 35 CO 0.23 -0.44 0.27 -1.21 1.83 0.00 0.00 175.22 175.90 2hji s GLU 36 N 2.27 1.23 -0.23 10.12 2.02 -1.20 -4.87 118.70 128.04 2hji s GLU 36 Ca -0.04 -1.31 -0.07 0.00 0.02 0.00 0.00 54.97 53.57 2hji s GLU 36 Cb -0.11 0.36 -0.03 0.00 0.10 0.00 0.00 34.13 34.45 2hji s GLU 36 CO -0.13 -0.45 0.07 1.03 0.02 0.00 0.00 175.26 175.80 2hji s ARG 37 N -4.02 3.75 0.00 1.61 0.52 -1.26 -1.60 118.95 117.95 2hji s ARG 37 Ca 0.23 -0.44 -0.00 0.00 -0.52 0.00 0.00 55.73 55.00 2hji s ARG 37 Cb 0.04 -3.29 -0.04 0.00 0.52 0.00 0.00 34.95 32.18 2hji s ARG 37 CO 0.05 -0.05 0.09 -1.58 0.02 0.00 0.00 175.30 173.83 2hji s TRP 38 N 1.23 3.30 -0.28 -0.53 0.52 -0.72 -4.99 118.94 117.46 2hji s TRP 38 Ca 0.05 0.21 -0.15 0.00 0.02 0.00 0.00 56.10 56.22 2hji s TRP 38 Cb -0.14 -1.73 -0.03 0.00 -1.15 0.00 0.00 33.47 30.41 2hji s TRP 38 CO 0.03 0.55 0.37 -0.65 0.02 0.00 0.00 176.95 177.27 2hji s GLN 39 N -1.81 3.96 -1.26 4.98 -1.52 -1.26 -4.30 119.66 118.45 2hji s GLN 39 Ca 0.24 -0.03 -0.09 0.00 -1.95 0.00 0.00 55.36 53.53 2hji s GLN 39 Cb -0.12 -3.67 0.18 0.00 -0.22 0.00 0.00 33.01 29.17 2hji s GLN 39 CO 0.15 -0.31 1.86 0.00 -0.25 0.00 0.00 175.29 176.74 2hji n ALA 40 N 5.34 5.40 1.12 6.09 0.00 -1.26 -4.60 120.51 132.59 2hji n ALA 40 Ca -0.09 -4.36 0.12 0.00 0.00 0.00 0.00 53.44 49.12 2hji n ALA 40 Cb 0.51 -2.92 0.18 0.00 0.00 0.00 0.00 19.45 17.22 2hji n ALA 40 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2hji n ASP 41 N 3.57 2.33 -4.69 0.00 8.00 -1.26 -4.89 116.55 119.61 2hji n ASP 41 Ca 0.39 -1.70 -0.38 0.00 0.71 0.00 0.00 54.79 53.81 2hji n ASP 41 Cb 0.36 0.12 -0.07 0.00 -0.02 0.00 0.00 41.12 41.51 2hji n ASP 41 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2hji s ARG 42 N -2.15 4.23 -0.19 -1.24 0.52 -1.26 -5.05 118.95 113.80 2hji s ARG 42 Ca 0.27 0.30 -0.16 0.00 -0.52 0.00 0.00 55.73 55.63 2hji s ARG 42 Cb 0.20 -3.50 -0.04 0.00 0.52 0.00 0.00 34.95 32.12 2hji s ARG 42 CO 0.39 0.02 0.39 0.34 0.02 0.00 0.00 175.30 176.46 2hji s ASP 43 N 0.89 6.45 0.00 0.23 2.15 -1.26 -4.94 116.67 120.19 2hji s ASP 43 Ca 0.22 0.53 0.22 0.00 0.43 0.00 0.00 52.55 53.95 2hji s ASP 43 Cb -0.15 -2.23 0.54 0.00 -0.30 0.00 0.00 42.92 40.78 2hji s ASP 43 CO 0.08 -0.06 1.47 0.18 -0.17 0.00 0.00 175.17 176.68 2hji n LEU 44 N 4.35 3.55 0.00 -1.34 7.99 -1.26 -5.05 117.00 125.24 2hji n LEU 44 Ca -0.09 -1.65 0.00 0.00 -0.01 0.00 0.00 56.01 54.26 2hji n LEU 44 Cb 0.51 -0.35 0.00 0.00 -0.11 0.00 0.00 43.42 43.47 2hji n LEU 44 CO 0.40 0.83 0.00 0.61 -1.51 0.00 0.00 177.39 177.72 2hji n GLY 45 N 1.55 0.43 0.09 -0.72 0.00 -1.26 -4.88 105.19 100.41 2hji n GLY 45 Ca 0.21 -1.95 -0.13 0.00 0.00 0.00 0.00 46.02 44.16 2hji n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hji n ALA 46 N -1.00 0.72 -2.69 4.61 0.00 -1.26 -4.88 120.51 116.02 2hji n ALA 46 Ca 0.00 -0.62 -0.37 0.00 0.00 0.00 0.00 53.44 52.45 2hji n ALA 46 Cb 0.00 -0.09 -0.08 0.00 0.00 0.00 0.00 19.45 19.28 2hji n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hji s ALA 47 N -2.66 3.60 0.05 0.00 0.00 -1.26 -5.06 121.76 116.43 2hji s ALA 47 Ca -0.24 -0.66 -0.30 0.00 0.00 0.00 0.00 51.96 50.75 2hji s ALA 47 Cb 0.05 -2.41 -0.04 0.00 0.00 0.00 0.00 23.12 20.72 2hji s ALA 47 CO 0.39 -0.12 1.00 -1.25 0.00 0.00 0.00 175.76 175.78 2hji s PRO 48 N 0.92 4.59 0.41 0.00 0.04 -1.26 -5.04 135.00 134.66 2hji s PRO 48 Ca 0.13 1.48 0.02 0.00 0.04 0.00 0.00 61.00 62.67 2hji s PRO 48 Cb -0.13 -3.41 0.02 0.00 0.04 0.00 0.00 34.50 31.01 2hji s PRO 48 CO 0.04 0.02 0.15 2.41 0.04 0.00 0.00 177.00 179.66 2hji n THR 49 N 3.47 0.00 -0.06 1.26 -1.04 -1.26 -4.97 114.28 111.68 2hji n THR 49 Ca 0.05 -1.81 -0.11 0.00 -2.04 0.00 0.00 64.05 60.14 2hji n THR 49 Cb 0.50 0.14 -0.10 0.00 -1.82 0.00 0.00 70.33 69.05 2hji n THR 49 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2hji h ALA 50 N 0.96 -0.01 -0.80 2.41 0.00 -1.97 -2.39 119.26 117.46 2hji h ALA 50 Ca -0.30 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.23 2hji h ALA 50 Cb 1.00 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 2hji h ALA 50 CO 0.49 -0.03 0.48 0.93 0.00 0.00 0.00 179.25 181.13 2hji h GLU 51 N -0.97 1.09 0.62 0.00 5.08 -1.98 -1.38 114.58 117.05 2hji h GLU 51 Ca -0.00 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 2hji h GLU 51 Cb 0.75 -0.23 0.01 0.00 0.50 0.00 0.00 28.75 29.78 2hji h GLU 51 CO 0.00 0.77 -0.30 0.00 -1.00 0.00 0.00 179.01 178.48 2hji h THR 52 N 1.10 0.00 -1.38 1.13 1.03 -1.98 -1.40 112.91 111.40 2hji h THR 52 Ca 0.29 -0.35 0.40 0.00 -0.01 0.00 0.00 66.41 66.74 2hji h THR 52 Cb -0.04 0.00 -0.06 0.00 -1.07 0.00 0.00 68.15 66.98 2hji h THR 52 CO -0.05 0.00 0.99 0.58 -0.01 0.00 0.00 175.52 177.02 2hji h VAL 53 N -1.19 0.30 0.13 0.00 2.07 -1.36 0.02 116.25 116.23 2hji h VAL 53 Ca -0.09 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 2hji h VAL 53 Cb 0.64 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 2hji h VAL 53 CO 0.14 0.00 -0.06 0.40 0.02 0.00 0.00 177.57 178.07 2hji h ILE 54 N 0.03 0.89 -0.54 4.57 1.08 -0.95 -2.85 117.51 119.74 2hji h ILE 54 Ca 0.67 -1.23 -0.06 0.00 -0.39 0.00 0.00 64.86 63.85 2hji h ILE 54 Cb 2.62 1.53 -0.02 0.00 -3.07 0.00 0.00 36.82 37.88 2hji h ILE 54 CO -0.04 0.24 0.11 0.00 -0.69 0.00 0.00 178.15 177.76 2hji h ALA 55 N -0.30 0.72 0.58 1.87 0.00 0.05 -0.37 119.26 121.80 2hji h ALA 55 Ca -0.02 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 2hji h ALA 55 Cb 0.54 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.12 2hji h ALA 55 CO 0.03 0.45 -0.28 0.00 0.00 0.00 0.00 179.25 179.45 2hji h ALA 56 N 1.00 -0.77 0.00 0.00 0.00 -1.22 -2.73 119.26 115.54 2hji h ALA 56 Ca 0.17 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2hji h ALA 56 Cb 0.38 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2hji h ALA 56 CO 0.01 -0.74 0.00 0.66 0.00 0.00 0.00 179.25 179.17 2hji n TYR 57 N -5.30 0.00 -0.08 0.00 4.01 -1.07 -3.62 117.16 111.10 2hji n TYR 57 Ca -0.10 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.56 2hji n TYR 57 Cb 0.32 -0.01 -0.00 0.00 -0.31 0.00 0.00 39.34 39.34 2hji n TYR 57 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 2hji h GLN 58 N 0.02 0.23 -0.30 -0.72 5.75 -0.73 0.52 115.11 119.88 2hji h GLN 58 Ca 0.00 -0.01 0.09 0.00 -0.15 0.00 0.00 58.65 58.57 2hji h GLN 58 Cb 0.03 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.51 2hji h GLN 58 CO 0.00 0.15 0.32 1.12 -2.65 0.00 0.00 178.83 177.77 2hji h HIS 59 N 0.24 0.00 0.00 3.99 2.07 -1.76 0.36 115.15 120.05 2hji h HIS 59 Ca 0.13 0.00 -0.20 0.00 -2.85 0.00 0.00 60.37 57.45 2hji h HIS 59 Cb 0.10 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.05 2hji h HIS 59 CO -0.13 0.00 -0.93 0.00 -3.07 0.00 0.00 177.93 173.80 2hji h ALA 60 N 1.64 0.41 -0.46 6.11 0.00 -1.17 -3.26 119.26 122.53 2hji h ALA 60 Ca 0.14 -0.85 -0.03 0.00 0.00 0.00 0.00 54.91 54.18 2hji h ALA 60 Cb 0.78 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2hji h ALA 60 CO -0.00 1.16 0.17 0.82 0.00 0.00 0.00 179.25 181.40 2hji h ILE 61 N 0.00 1.18 -0.28 0.00 2.04 0.34 -2.37 117.51 118.42 2hji h ILE 61 Ca -0.01 -0.58 -0.07 0.00 1.00 0.00 0.00 64.86 65.19 2hji h ILE 61 Cb 1.70 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 38.42 2hji h ILE 61 CO 0.12 0.22 -0.13 -0.78 0.00 0.00 0.00 178.15 177.58 2hji h ASP 62 N 0.66 0.47 1.47 1.72 3.58 -1.57 -2.45 116.42 120.29 2hji h ASP 62 Ca 0.16 -0.12 0.00 0.00 0.42 0.00 0.00 57.03 57.48 2hji h ASP 62 Cb 0.16 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.09 2hji h ASP 62 CO -0.01 0.64 -0.03 1.17 -2.88 0.00 0.00 179.24 178.13 2hji n LYS 63 N -4.20 0.27 0.00 0.28 0.00 -0.95 -4.18 118.16 109.39 2hji n LYS 63 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 58.31 58.53 2hji n LYS 63 Cb 0.33 -1.81 0.00 0.00 0.00 0.00 0.00 35.03 33.55 2hji n LYS 63 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 2hji n LEU 64 N -2.28 0.00 -3.69 3.14 0.00 -0.92 -4.75 117.00 108.49 2hji n LEU 64 Ca 0.05 0.82 -0.14 0.00 0.00 0.00 0.00 56.01 56.74 2hji n LEU 64 Cb 0.43 -0.32 -0.14 0.00 0.00 0.00 0.00 43.42 43.40 2hji n LEU 64 CO 0.31 -0.32 -0.17 -0.69 0.00 0.00 0.00 177.39 176.52 2hji s VAL 65 N -2.27 -0.24 -0.51 1.96 1.01 -1.26 -5.10 120.40 113.99 2hji s VAL 65 Ca 0.00 0.26 -0.21 0.00 0.00 0.00 0.00 61.98 62.03 2hji s VAL 65 Cb 0.00 -0.37 0.05 0.00 0.00 0.00 0.00 36.38 36.06 2hji s VAL 65 CO 0.00 0.11 0.72 0.00 0.00 0.00 0.00 175.10 175.93 2hji s ALA 66 N 1.97 3.31 -0.28 5.51 0.00 -1.26 -4.96 121.76 126.05 2hji s ALA 66 Ca -0.02 -1.53 -0.22 0.00 0.00 0.00 0.00 51.96 50.18 2hji s ALA 66 Cb -0.12 -3.46 0.11 0.00 0.00 0.00 0.00 23.12 19.66 2hji s ALA 66 CO -0.08 -2.10 0.93 -2.00 0.00 0.00 0.00 175.76 172.52 2hji s GLU 67 N 3.05 0.56 0.07 0.00 2.12 -1.26 -5.14 118.70 118.09 2hji s GLU 67 Ca 0.20 0.75 0.00 0.00 0.36 0.00 0.00 54.97 56.28 2hji s GLU 67 Cb -0.17 0.23 0.00 0.00 0.26 0.00 0.00 34.13 34.45 2hji s GLU 67 CO 0.15 -0.08 0.00 1.63 -0.54 0.00 0.00 175.26 176.42 2hji n LYS 68 N 2.80 -0.55 -0.19 4.30 4.76 -1.26 -3.96 118.16 124.06 2hji n LYS 68 Ca -0.15 0.37 0.08 0.00 -2.87 0.00 0.00 58.31 55.74 2hji n LYS 68 Cb 0.56 -0.70 0.23 0.00 -1.84 0.00 0.00 35.03 33.28 2hji n LYS 68 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2hji n GLY 69 N -1.31 0.89 1.17 0.72 0.00 -1.26 -5.04 105.19 100.36 2hji n GLY 69 Ca 0.00 -0.47 0.12 0.00 0.00 0.00 0.00 46.02 45.68 2hji n GLY 69 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2hji n TYR 70 N 0.70 -2.69 0.00 1.61 4.02 -1.25 -4.82 117.16 114.72 2hji n TYR 70 Ca 0.15 1.47 0.00 0.00 -0.01 0.00 0.00 57.90 59.51 2hji n TYR 70 Cb 0.37 -2.45 0.00 0.00 -0.02 0.00 0.00 39.34 37.24 2hji n TYR 70 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 2hji n GLN 71 N -3.85 0.00 -3.80 -0.72 7.27 -0.76 -5.08 117.38 110.44 2hji n GLN 71 Ca -0.05 0.30 -0.04 0.00 0.07 0.00 0.00 57.00 57.28 2hji n GLN 71 Cb 0.53 -0.78 -0.00 0.00 2.41 0.00 0.00 30.24 32.41 2hji n GLN 71 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 2hji s SER 72 N -2.75 -0.10 0.04 1.69 0.01 -1.25 -5.07 113.70 106.26 2hji s SER 72 Ca 0.00 -0.56 0.01 0.00 1.31 0.00 0.00 55.95 56.71 2hji s SER 72 Cb 0.00 0.52 -0.02 0.00 0.21 0.00 0.00 66.02 66.73 2hji s SER 72 CO 0.00 -1.00 -0.06 -1.66 0.41 0.00 0.00 173.24 170.93 2hji s TRP 73 N -2.84 0.53 0.19 2.43 -2.14 -1.26 -3.68 118.94 112.16 2hji s TRP 73 Ca 0.16 -0.58 -0.04 0.00 2.66 0.00 0.00 56.10 58.30 2hji s TRP 73 Cb -0.02 -0.33 -0.03 0.00 -3.10 0.00 0.00 33.47 29.99 2hji s TRP 73 CO 0.04 -0.15 0.20 -0.51 -2.66 0.00 0.00 176.95 173.87 2hji s ASP 74 N -1.73 0.12 0.20 -2.66 1.01 -1.10 -4.97 116.67 107.54 2hji s ASP 74 Ca -0.09 -1.19 0.11 0.00 0.71 0.00 0.00 52.55 52.08 2hji s ASP 74 Cb -0.08 0.41 -0.04 0.00 1.01 0.00 0.00 42.92 44.22 2hji s ASP 74 CO -0.01 -0.88 -0.23 -0.69 0.21 0.00 0.00 175.17 173.57 2hji s VAL 75 N -4.08 2.42 -0.35 -1.27 1.01 -1.26 -1.52 120.40 115.35 2hji s VAL 75 Ca 0.30 -2.03 0.02 0.00 0.00 0.00 0.00 61.98 60.27 2hji s VAL 75 Cb 0.05 -2.17 0.10 0.00 0.00 0.00 0.00 36.38 34.37 2hji s VAL 75 CO 0.08 -0.13 0.09 -0.63 0.00 0.00 0.00 175.10 174.51 2hji s ILE 76 N -1.72 1.73 -0.08 2.22 1.01 -1.08 -4.96 121.20 118.33 2hji s ILE 76 Ca 0.22 -2.08 0.04 0.00 0.00 0.00 0.00 60.65 58.82 2hji s ILE 76 Cb -0.08 -2.28 -0.01 0.00 0.01 0.00 0.00 42.46 40.10 2hji s ILE 76 CO 0.10 -0.66 -0.21 -0.94 0.00 0.00 0.00 174.94 173.23 2hji s SER 77 N 1.04 3.36 -0.05 3.58 1.04 -1.26 -3.54 113.70 117.87 2hji s SER 77 Ca 0.11 -0.46 0.05 0.00 0.48 0.00 0.00 55.95 56.14 2hji s SER 77 Cb -0.19 -1.14 -0.01 0.00 0.10 0.00 0.00 66.02 64.78 2hji s SER 77 CO -0.13 0.22 -0.21 -1.48 0.98 0.00 0.00 173.24 172.62 2hji s LEU 78 N 0.01 1.98 0.28 2.42 0.05 -1.26 -5.00 118.68 117.17 2hji s LEU 78 Ca -0.08 -0.42 0.01 0.00 0.05 0.00 0.00 54.13 53.70 2hji s LEU 78 Cb -0.15 -1.14 -0.04 0.00 -2.05 0.00 0.00 46.19 42.82 2hji s LEU 78 CO 0.05 0.20 0.46 -0.13 -0.55 0.00 0.00 176.35 176.37 2hji s ARG 79 N -0.08 3.49 0.24 1.48 1.81 -1.26 -3.79 118.95 120.84 2hji s ARG 79 Ca -0.03 -0.44 0.16 0.00 -1.72 0.00 0.00 55.73 53.71 2hji s ARG 79 Cb -0.12 -2.77 0.03 0.00 -0.45 0.00 0.00 34.95 31.64 2hji s ARG 79 CO 0.03 0.29 1.30 0.00 -0.68 0.00 0.00 175.30 176.24 2hji h ALA 80 N 1.23 0.68 -0.33 2.13 0.00 -1.89 -3.31 119.26 117.77 2hji h ALA 80 Ca -0.50 -0.49 -0.20 0.00 0.00 0.00 0.00 54.91 53.73 2hji h ALA 80 Cb 1.21 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.91 2hji h ALA 80 CO 0.63 0.62 0.25 -3.47 0.00 0.00 0.00 179.25 177.28 2hji n ASP 81 N -3.11 4.61 -3.86 0.00 2.03 -1.26 -4.79 116.55 110.16 2hji n ASP 81 Ca -0.01 -2.69 -0.24 0.00 0.52 0.00 0.00 54.79 52.38 2hji n ASP 81 Cb 0.74 -0.83 -0.17 0.00 -0.72 0.00 0.00 41.12 40.13 2hji n ASP 81 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2hji s ASN 82 N 0.48 1.75 0.31 1.67 6.03 -1.25 -5.02 114.94 118.91 2hji s ASN 82 Ca 0.20 -0.19 0.17 0.00 -1.03 0.00 0.00 52.86 52.00 2hji s ASN 82 Cb 0.16 -0.63 0.25 0.00 -3.03 0.00 0.00 41.25 38.00 2hji s ASN 82 CO 0.02 -0.13 1.53 1.55 -2.03 0.00 0.00 177.10 178.04 2hji h PRO 83 N 8.00 0.00 0.00 3.55 0.13 -1.92 -3.14 132.00 138.61 2hji h PRO 83 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2hji h PRO 83 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2hji h PRO 83 CO 0.37 0.45 0.00 0.94 -0.23 0.00 0.00 178.00 179.52 2hji n GLN 84 N -3.29 0.42 0.04 0.86 7.27 -1.26 -2.81 117.38 118.61 2hji n GLN 84 Ca 0.01 0.04 -0.08 0.00 0.07 0.00 0.00 57.00 57.04 2hji n GLN 84 Cb 0.67 -1.50 -0.13 0.00 2.41 0.00 0.00 30.24 31.69 2hji n GLN 84 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 2hji h LYS 85 N 0.00 0.03 -0.79 3.69 6.56 -1.90 -3.26 116.57 120.89 2hji h LYS 85 Ca 0.00 -0.05 0.07 0.00 -1.06 0.00 0.00 60.65 59.62 2hji h LYS 85 Cb 0.20 0.02 -0.05 0.00 -0.57 0.00 0.00 32.23 31.82 2hji h LYS 85 CO 0.00 0.86 0.52 0.93 -2.06 0.00 0.00 179.45 179.70 2hji h GLU 86 N 0.01 0.81 0.00 3.15 3.07 -1.70 0.75 114.58 120.67 2hji h GLU 86 Ca -0.12 -0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 58.66 2hji h GLU 86 Cb 1.87 -0.18 -0.00 0.00 -0.84 0.00 0.00 28.75 29.59 2hji h GLU 86 CO 0.12 0.54 -0.16 0.00 -1.40 0.00 0.00 179.01 178.10 2hji h ALA 87 N 1.58 1.26 0.00 3.43 0.00 -1.72 -1.61 119.26 122.19 2hji h ALA 87 Ca 0.35 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2hji h ALA 87 Cb 0.28 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2hji h ALA 87 CO -0.12 0.20 -0.08 -0.07 0.00 0.00 0.00 179.25 179.18 2hji h LEU 88 N 0.00 0.00 0.56 0.00 4.07 0.44 -3.13 115.31 117.25 2hji h LEU 88 Ca -0.00 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.94 2hji h LEU 88 Cb 0.43 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.15 2hji h LEU 88 CO 0.02 0.08 -0.50 -0.09 -1.08 0.00 0.00 178.44 176.87 2hji h ARG 89 N 0.00 -1.01 0.00 1.13 9.65 -0.93 -0.62 114.38 122.60 2hji h ARG 89 Ca -0.00 0.07 -0.01 0.00 -1.10 0.00 0.00 59.98 58.94 2hji h ARG 89 Cb 0.66 0.23 -0.00 0.00 -1.39 0.00 0.00 29.97 29.47 2hji h ARG 89 CO 0.01 -0.67 -0.05 0.93 2.80 0.00 0.00 179.97 182.99 2hji h GLU 90 N -1.04 0.00 -0.50 0.20 5.08 -1.73 0.19 114.58 116.78 2hji h GLU 90 Ca -0.07 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 2hji h GLU 90 Cb 0.89 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.12 2hji h GLU 90 CO -0.03 0.05 0.14 -0.22 -1.00 0.00 0.00 179.01 177.95 2hji h LYS 91 N 0.00 0.75 0.00 2.33 1.63 -1.13 -2.85 116.57 117.29 2hji h LYS 91 Ca -0.00 -0.13 0.00 0.00 -0.85 0.00 0.00 60.65 59.67 2hji h LYS 91 Cb 0.10 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.61 2hji h LYS 91 CO 0.01 0.66 -1.62 1.19 -3.45 0.00 0.00 179.45 176.23 2hji n PHE 92 N -4.31 0.00 1.05 1.91 3.72 -0.37 -4.35 117.46 115.11 2hji n PHE 92 Ca 0.04 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.49 2hji n PHE 92 Cb 0.20 -0.33 0.15 0.00 -0.94 0.00 0.00 39.48 38.56 2hji n PHE 92 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2hji n LEU 93 N -1.98 1.61 -4.98 4.37 7.99 0.57 -2.63 117.00 121.96 2hji n LEU 93 Ca -0.02 -0.80 -0.21 0.00 -0.01 0.00 0.00 56.01 54.97 2hji n LEU 93 Cb 0.45 -0.20 0.03 0.00 -0.11 0.00 0.00 43.42 43.59 2hji n LEU 93 CO 0.40 0.40 0.21 0.54 -1.51 0.00 0.00 177.39 177.42 2hji s ASN 94 N -1.03 5.03 -0.02 -1.43 4.22 -1.09 -4.82 114.94 115.80 2hji s ASN 94 Ca 0.21 -0.89 -0.30 0.00 -2.14 0.00 0.00 52.86 49.74 2hji s ASN 94 Cb 0.11 0.12 -0.05 0.00 1.28 0.00 0.00 41.25 42.71 2hji s ASN 94 CO 0.14 -1.13 1.44 -1.61 -2.04 0.00 0.00 177.10 173.90 2hji s GLU 95 N -4.47 4.26 -0.06 3.55 2.02 -1.26 -4.69 118.70 118.06 2hji s GLU 95 Ca 0.52 1.98 -0.01 0.00 0.02 0.00 0.00 54.97 57.48 2hji s GLU 95 Cb -0.05 -3.66 0.03 0.00 0.10 0.00 0.00 34.13 30.55 2hji s GLU 95 CO 0.32 -0.64 0.02 -1.58 0.02 0.00 0.00 175.26 173.40 2hji s HIS 96 N 2.79 0.45 0.09 1.61 5.65 -1.26 -5.07 115.29 119.54 2hji s HIS 96 Ca 0.65 -0.01 0.04 0.00 0.25 0.00 0.00 55.06 55.98 2hji s HIS 96 Cb -0.31 -0.67 -0.03 0.00 -1.18 0.00 0.00 32.58 30.38 2hji s HIS 96 CO 0.26 -0.27 -0.10 0.99 -0.65 0.00 0.00 174.74 174.97 2hji s THR 97 N 1.99 0.90 0.18 0.89 2.01 -1.26 -4.01 115.64 116.34 2hji s THR 97 Ca 0.04 -1.60 0.01 0.00 0.31 0.00 0.00 61.69 60.46 2hji s THR 97 Cb -0.12 -1.31 -0.05 0.00 0.01 0.00 0.00 72.50 71.04 2hji s THR 97 CO -0.04 -0.55 0.03 -1.38 -0.69 0.00 0.00 174.62 171.99 2hji s HIS 98 N -2.37 1.19 -0.57 4.92 -3.43 -1.26 -5.03 115.29 108.73 2hji s HIS 98 Ca 0.04 -1.09 0.07 0.00 -0.80 0.00 0.00 55.06 53.29 2hji s HIS 98 Cb -0.03 -0.68 0.45 0.00 -1.43 0.00 0.00 32.58 30.89 2hji s HIS 98 CO -0.00 -0.29 1.20 0.41 -2.00 0.00 0.00 174.74 174.05 2hji n GLY 99 N -0.24 2.35 3.09 -1.38 0.00 -1.26 -3.23 105.19 104.51 2hji n GLY 99 Ca -0.05 -0.51 -0.13 0.00 0.00 0.00 0.00 46.02 45.33 2hji n GLY 99 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hji s GLU 100 N -1.96 0.24 -0.02 1.61 8.01 -1.26 -4.86 118.70 120.45 2hji s GLU 100 Ca 0.30 0.34 -0.30 0.00 0.01 0.00 0.00 54.97 55.32 2hji s GLU 100 Cb 0.23 0.07 -0.04 0.00 -4.31 0.00 0.00 34.13 30.08 2hji s GLU 100 CO 0.09 -0.06 1.29 0.16 0.01 0.00 0.00 175.26 176.75 2hji s ASP 101 N 0.34 6.96 0.10 -0.19 -4.77 -1.26 -4.54 116.67 113.30 2hji s ASP 101 Ca -0.02 1.96 0.04 0.00 -3.30 0.00 0.00 52.55 51.23 2hji s ASP 101 Cb -0.03 -2.56 -0.04 0.00 -1.09 0.00 0.00 42.92 39.20 2hji s ASP 101 CO -0.01 -0.63 0.07 -1.83 0.70 0.00 0.00 175.17 173.46 2hji s GLU 102 N 2.18 2.81 -0.08 2.11 4.04 -1.25 -4.69 118.70 123.83 2hji s GLU 102 Ca 0.60 -0.75 -0.00 0.00 0.04 0.00 0.00 54.97 54.85 2hji s GLU 102 Cb -0.28 -2.67 -0.03 0.00 0.02 0.00 0.00 34.13 31.16 2hji s GLU 102 CO 0.24 0.55 -0.04 0.08 -1.84 0.00 0.00 175.26 174.25 2hji s VAL 103 N -1.43 3.91 -0.19 1.83 1.01 -0.55 -3.76 120.40 121.22 2hji s VAL 103 Ca 0.29 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 61.86 2hji s VAL 103 Cb -0.12 -2.62 0.01 0.00 0.00 0.00 0.00 36.38 33.65 2hji s VAL 103 CO 0.21 0.60 -0.13 -0.13 0.00 0.00 0.00 175.10 175.65 2hji s ARG 104 N -0.77 3.18 -0.23 2.72 1.81 -1.06 -2.11 118.95 122.49 2hji s ARG 104 Ca 0.12 -0.74 -0.01 0.00 -1.72 0.00 0.00 55.73 53.38 2hji s ARG 104 Cb -0.11 -2.74 0.02 0.00 -0.45 0.00 0.00 34.95 31.67 2hji s ARG 104 CO 0.02 -0.16 -0.10 0.12 -0.68 0.00 0.00 175.30 174.50 2hji s PHE 105 N 1.26 2.98 -0.39 -0.53 5.36 -0.96 -3.44 117.98 122.26 2hji s PHE 105 Ca 0.03 -1.54 -0.21 0.00 -0.96 0.00 0.00 56.93 54.25 2hji s PHE 105 Cb -0.14 -2.02 0.01 0.00 -0.34 0.00 0.00 43.02 40.54 2hji s PHE 105 CO -0.07 -0.73 0.67 -0.06 -1.46 0.00 0.00 175.22 173.57 2hji s PHE 106 N 1.32 3.10 -0.05 10.12 0.40 -1.26 -1.76 117.98 129.86 2hji s PHE 106 Ca 0.02 0.22 0.22 0.00 -0.60 0.00 0.00 56.93 56.79 2hji s PHE 106 Cb -0.15 -3.29 -0.31 0.00 0.51 0.00 0.00 43.02 39.77 2hji s PHE 106 CO -0.07 -0.75 0.51 1.33 0.70 0.00 0.00 175.22 176.94 2hji n VAL 107 N 5.75 0.08 -3.69 -0.44 0.24 -1.19 0.25 118.33 119.34 2hji n VAL 107 Ca -0.01 -0.51 -0.15 0.00 -2.04 0.00 0.00 64.34 61.63 2hji n VAL 107 Cb 0.48 -0.04 -0.15 0.00 -1.47 0.00 0.00 33.84 32.67 2hji n VAL 107 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2hji s GLU 108 N -3.48 0.07 0.00 7.34 0.41 -1.26 -4.58 118.70 117.20 2hji s GLU 108 Ca -0.08 0.51 0.00 0.00 -0.41 0.00 0.00 54.97 55.00 2hji s GLU 108 Cb 0.13 -0.22 0.00 0.00 -1.78 0.00 0.00 34.13 32.27 2hji s GLU 108 CO 0.90 -0.25 0.00 0.41 -0.49 0.00 0.00 175.26 175.83 2hji n GLY 109 N 4.92 -0.53 3.11 -1.39 0.00 -1.26 0.58 105.19 110.62 2hji n GLY 109 Ca -0.13 -1.78 -0.15 0.00 0.00 0.00 0.00 46.02 43.96 2hji n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hji s ALA 110 N -1.14 0.84 0.01 4.61 0.00 -1.26 -4.58 121.76 120.23 2hji s ALA 110 Ca 0.00 -0.86 0.03 0.00 0.00 0.00 0.00 51.96 51.13 2hji s ALA 110 Cb 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.08 2hji s ALA 110 CO 0.00 0.07 -0.10 0.20 0.00 0.00 0.00 175.76 175.93 2hji s GLY 111 N -1.61 0.51 -0.45 0.00 0.00 -1.21 -4.83 107.32 99.73 2hji s GLY 111 Ca -0.06 -0.53 -0.24 0.00 0.00 0.00 0.00 44.72 43.89 2hji s GLY 111 CO 0.01 -0.50 0.85 -2.27 0.00 0.00 0.00 173.10 171.19 2hji s LEU 112 N -0.64 4.14 -0.17 0.66 1.98 0.16 -3.31 118.68 121.49 2hji s LEU 112 Ca 0.01 0.03 -0.09 0.00 -2.89 0.00 0.00 54.13 51.18 2hji s LEU 112 Cb -0.05 -3.07 -0.05 0.00 0.66 0.00 0.00 46.19 43.68 2hji s LEU 112 CO 0.00 -0.96 0.13 0.12 -1.89 0.00 0.00 176.35 173.76 2hji s PHE 113 N 3.47 3.48 -0.03 5.38 5.36 -1.23 -1.09 117.98 133.31 2hji s PHE 113 Ca 0.33 0.40 0.06 0.00 -0.96 0.00 0.00 56.93 56.77 2hji s PHE 113 Cb -0.11 -2.08 -0.02 0.00 -0.34 0.00 0.00 43.02 40.47 2hji s PHE 113 CO 0.24 0.46 -0.22 0.00 -1.46 0.00 0.00 175.22 174.23 2hji s LEU 115 N -0.60 1.68 -0.45 0.00 0.20 -1.10 -3.80 118.68 114.62 2hji s LEU 115 Ca 0.09 -0.41 -0.16 0.00 0.69 0.00 0.00 54.13 54.34 2hji s LEU 115 Cb -0.11 -1.05 0.04 0.00 -0.43 0.00 0.00 46.19 44.64 2hji s LEU 115 CO -0.00 0.01 0.42 -2.28 -0.29 0.00 0.00 176.35 174.20 2hji s HIS 116 N 1.02 3.19 -0.30 5.38 2.46 -1.25 -1.70 115.29 124.09 2hji s HIS 116 Ca -0.06 -0.61 0.02 0.00 0.47 0.00 0.00 55.06 54.87 2hji s HIS 116 Cb -0.15 -2.99 0.09 0.00 -0.13 0.00 0.00 32.58 29.40 2hji s HIS 116 CO -0.02 -0.75 0.02 0.42 -2.47 0.00 0.00 174.74 171.95 2hji s ILE 117 N 1.95 1.71 0.00 0.89 1.01 -1.04 -4.69 121.20 121.03 2hji s ILE 117 Ca 0.08 -1.75 0.00 0.00 0.00 0.00 0.00 60.65 58.98 2hji s ILE 117 Cb -0.20 -2.16 0.00 0.00 0.01 0.00 0.00 42.46 40.11 2hji s ILE 117 CO 0.10 -0.45 0.00 0.61 0.00 0.00 0.00 174.94 175.21 2hji n GLY 118 N 4.53 2.36 2.05 6.18 0.00 -1.26 -2.59 105.19 116.46 2hji n GLY 118 Ca -0.03 -0.34 -0.18 0.00 0.00 0.00 0.00 46.02 45.47 2hji n GLY 118 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2hji n ASP 119 N 5.38 3.82 -4.11 1.61 5.75 -1.26 -4.93 116.55 122.80 2hji n ASP 119 Ca 0.00 -3.55 -0.16 0.00 -0.01 0.00 0.00 54.79 51.07 2hji n ASP 119 Cb 0.00 -0.80 -0.12 0.00 -1.03 0.00 0.00 41.12 39.18 2hji n ASP 119 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2hji s GLU 120 N -3.23 0.67 -0.14 0.11 8.01 -1.07 0.87 118.70 123.92 2hji s GLU 120 Ca 0.55 -0.85 0.02 0.00 0.01 0.00 0.00 54.97 54.71 2hji s GLU 120 Cb 0.46 -0.55 0.01 0.00 -4.31 0.00 0.00 34.13 29.74 2hji s GLU 120 CO 0.10 0.11 -0.22 0.08 0.01 0.00 0.00 175.26 175.35 2hji s VAL 121 N -1.32 2.11 -0.01 2.63 1.01 -1.22 -2.48 120.40 121.12 2hji s VAL 121 Ca -0.06 -0.97 -0.19 0.00 0.00 0.00 0.00 61.98 60.76 2hji s VAL 121 Cb -0.10 -1.84 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 2hji s VAL 121 CO 0.01 0.55 0.56 -0.36 0.00 0.00 0.00 175.10 175.86 2hji s PHE 122 N 0.78 3.68 -0.30 5.22 0.40 -0.69 -3.60 117.98 123.47 2hji s PHE 122 Ca -0.08 1.15 0.02 0.00 -0.60 0.00 0.00 56.93 57.42 2hji s PHE 122 Cb -0.16 -2.55 0.09 0.00 0.51 0.00 0.00 43.02 40.91 2hji s PHE 122 CO -0.01 0.39 0.02 -1.14 0.70 0.00 0.00 175.22 175.18 2hji s GLN 123 N -0.30 1.41 -0.01 0.44 2.00 -0.02 -2.70 119.66 120.50 2hji s GLN 123 Ca 0.29 -1.43 0.03 0.00 -2.00 0.00 0.00 55.36 52.26 2hji s GLN 123 Cb -0.18 -2.75 -0.01 0.00 0.80 0.00 0.00 33.01 30.87 2hji s GLN 123 CO 0.16 -0.83 -0.10 0.54 -0.50 0.00 0.00 175.29 174.56 2hji s VAL 124 N 1.20 0.80 0.24 1.34 0.11 -1.23 -2.14 120.40 120.72 2hji s VAL 124 Ca 0.05 -0.46 -0.23 0.00 -2.93 0.00 0.00 61.98 58.41 2hji s VAL 124 Cb -0.19 -0.68 -0.09 0.00 -1.53 0.00 0.00 36.38 33.90 2hji s VAL 124 CO -0.11 0.21 0.80 -0.76 -3.33 0.00 0.00 175.10 171.91 2hji s LEU 125 N -0.28 4.40 -0.13 2.54 2.01 -1.24 -3.51 118.68 122.46 2hji s LEU 125 Ca 0.04 1.60 0.02 0.00 0.01 0.00 0.00 54.13 55.80 2hji s LEU 125 Cb -0.04 -3.65 0.00 0.00 0.01 0.00 0.00 46.19 42.51 2hji s LEU 125 CO -0.00 0.04 -0.21 0.00 1.01 0.00 0.00 176.35 177.19 2hji s GLU 127 N 0.69 1.60 0.00 0.00 2.02 -1.26 -3.35 118.70 118.41 2hji s GLU 127 Ca -0.10 -1.67 0.00 0.00 0.02 0.00 0.00 54.97 53.22 2hji s GLU 127 Cb -0.16 0.38 0.00 0.00 0.10 0.00 0.00 34.13 34.44 2hji s GLU 127 CO 0.01 -0.62 0.74 0.36 0.02 0.00 0.00 175.26 175.78 2hji n LYS 128 N -0.45 0.00 -0.04 1.61 2.85 0.69 -0.92 118.16 121.90 2hji n LYS 128 Ca 0.02 0.26 -0.05 0.00 -1.05 0.00 0.00 58.31 57.49 2hji n LYS 128 Cb 0.63 -1.69 -0.05 0.00 -0.65 0.00 0.00 35.03 33.28 2hji n LYS 128 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 177.40 176.38 2hji h ASN 129 N 0.00 -0.02 -1.39 -5.58 -0.73 -1.77 -3.37 115.58 102.72 2hji h ASN 129 Ca 0.00 -0.33 -0.46 0.00 1.87 0.00 0.00 56.30 57.38 2hji h ASN 129 Cb 0.38 0.01 -0.00 0.00 0.27 0.00 0.00 38.32 38.97 2hji h ASN 129 CO 0.00 0.64 -0.29 1.51 -0.37 0.00 0.00 177.43 178.91 2hji s ASP 130 N -5.74 5.35 -0.27 1.15 1.47 -0.09 -1.76 116.67 116.78 2hji s ASP 130 Ca -0.07 -0.61 -0.02 0.00 1.18 0.00 0.00 52.55 53.04 2hji s ASP 130 Cb -0.01 -0.51 0.12 0.00 -0.34 0.00 0.00 42.92 42.18 2hji s ASP 130 CO 0.25 -0.78 0.25 -0.22 0.68 0.00 0.00 175.17 175.35 2hji s LEU 131 N -4.29 -0.11 -0.06 2.11 0.20 -0.62 -4.14 118.68 111.77 2hji s LEU 131 Ca 0.52 -0.66 -0.04 0.00 0.69 0.00 0.00 54.13 54.64 2hji s LEU 131 Cb -0.07 0.37 -0.04 0.00 -0.43 0.00 0.00 46.19 46.03 2hji s LEU 131 CO 0.31 -0.38 0.13 -0.51 -0.29 0.00 0.00 176.35 175.61 2hji s ILE 132 N 2.32 5.19 -0.03 6.68 2.07 -1.22 -3.27 121.20 132.94 2hji s ILE 132 Ca 0.09 -0.09 -0.01 0.00 -1.41 0.00 0.00 60.65 59.23 2hji s ILE 132 Cb -0.15 -3.33 0.02 0.00 0.13 0.00 0.00 42.46 39.14 2hji s ILE 132 CO -0.28 0.47 0.05 -0.55 -1.91 0.00 0.00 174.94 172.73 2hji s SER 133 N -1.45 -0.00 0.29 4.50 0.15 -1.18 -2.57 113.70 113.44 2hji s SER 133 Ca 0.20 0.10 0.07 0.00 0.70 0.00 0.00 55.95 57.03 2hji s SER 133 Cb -0.12 0.03 -0.03 0.00 -1.71 0.00 0.00 66.02 64.19 2hji s SER 133 CO 0.11 -0.09 0.27 0.68 1.20 0.00 0.00 173.24 175.41 2hji s VAL 134 N 0.71 4.09 0.72 4.45 -7.23 -1.25 -3.95 120.40 117.94 2hji s VAL 134 Ca -0.06 -1.33 -0.08 0.00 -1.81 0.00 0.00 61.98 58.70 2hji s VAL 134 Cb -0.08 -3.34 0.06 0.00 0.56 0.00 0.00 36.38 33.58 2hji s VAL 134 CO -0.02 -0.26 1.05 -2.16 -0.31 0.00 0.00 175.10 173.40 2hji s PRO 135 N -3.94 2.20 1.11 4.82 0.05 -1.26 -3.81 135.00 134.16 2hji s PRO 135 Ca 0.37 -0.14 -0.15 0.00 0.05 0.00 0.00 61.00 61.14 2hji s PRO 135 Cb -0.07 -2.12 0.24 0.00 0.05 0.00 0.00 34.50 32.60 2hji s PRO 135 CO 0.26 -1.29 1.08 0.00 0.05 0.00 0.00 177.00 177.10 2hji s ALA 136 N -3.32 0.49 0.00 8.56 0.00 -1.26 -2.83 121.76 123.40 2hji s ALA 136 Ca 0.60 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.04 2hji s ALA 136 Cb -0.11 -3.06 0.00 0.00 0.00 0.00 0.00 23.12 19.95 2hji s ALA 136 CO 0.46 -3.33 0.00 0.72 0.00 0.00 0.00 175.76 173.61 2hji n HIS 137 N -4.55 0.00 -3.63 0.00 8.25 -1.20 -4.88 115.22 109.22 2hji n HIS 137 Ca 0.07 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.14 2hji n HIS 137 Cb 0.58 -1.28 -0.11 0.00 1.12 0.00 0.00 29.99 30.30 2hji n HIS 137 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2hji s THR 138 N -0.95 4.78 0.23 1.59 2.01 -1.13 -5.07 115.64 117.11 2hji s THR 138 Ca 0.00 -0.32 -0.30 0.00 0.31 0.00 0.00 61.69 61.38 2hji s THR 138 Cb 0.00 -3.42 -0.09 0.00 0.01 0.00 0.00 72.50 69.00 2hji s THR 138 CO 0.00 0.08 1.17 -2.16 -0.69 0.00 0.00 174.62 173.02 2hji s PRO 139 N 1.65 4.53 -0.02 4.92 0.04 -1.26 -4.84 135.00 140.02 2hji s PRO 139 Ca 0.05 1.88 -0.00 0.00 0.04 0.00 0.00 61.00 62.97 2hji s PRO 139 Cb -0.17 -3.21 0.03 0.00 0.04 0.00 0.00 34.50 31.20 2hji s PRO 139 CO 0.07 0.01 0.03 -3.38 0.04 0.00 0.00 177.00 173.77 2hji s HIS 140 N -0.55 0.03 0.12 0.56 -3.43 -1.26 -3.85 115.29 106.92 2hji s HIS 140 Ca 0.49 0.14 0.08 0.00 -0.80 0.00 0.00 55.06 54.98 2hji s HIS 140 Cb -0.33 -0.25 -0.04 0.00 -1.43 0.00 0.00 32.58 30.52 2hji s HIS 140 CO 0.40 -0.10 -0.14 1.67 -2.00 0.00 0.00 174.74 174.57 2hji s TRP 141 N 1.14 2.61 0.63 0.38 -2.14 -1.25 -4.26 118.94 116.05 2hji s TRP 141 Ca -0.08 -0.23 -0.03 0.00 2.66 0.00 0.00 56.10 58.42 2hji s TRP 141 Cb -0.13 -1.36 0.05 0.00 -3.10 0.00 0.00 33.47 28.93 2hji s TRP 141 CO -0.03 0.42 0.90 -0.06 -2.66 0.00 0.00 176.95 175.52 2hji s PHE 142 N -1.26 2.92 -0.29 1.66 0.08 -1.08 -3.33 117.98 116.69 2hji s PHE 142 Ca 0.20 0.27 -0.00 0.00 0.12 0.00 0.00 56.93 57.52 2hji s PHE 142 Cb -0.10 -2.97 0.18 0.00 -0.57 0.00 0.00 43.02 39.56 2hji s PHE 142 CO 0.12 -1.13 0.54 0.34 -0.10 0.00 0.00 175.22 174.99 2hji s ASP 143 N -4.46 -1.01 -0.16 1.36 2.15 -0.25 -4.56 116.67 109.73 2hji s ASP 143 Ca 0.58 0.57 0.06 0.00 0.43 0.00 0.00 52.55 54.20 2hji s ASP 143 Cb -0.11 1.88 -0.23 0.00 -0.30 0.00 0.00 42.92 44.17 2hji s ASP 143 CO 0.42 -0.28 0.20 0.23 -0.17 0.00 0.00 175.17 175.57 2hji n MET 144 N 5.41 0.68 0.00 4.34 2.81 -1.26 -0.67 117.12 128.44 2hji n MET 144 Ca -0.00 0.17 0.00 0.00 -1.81 0.00 0.00 57.70 56.06 2hji n MET 144 Cb 0.51 -1.63 0.00 0.00 -0.71 0.00 0.00 33.22 31.39 2hji n MET 144 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2hji n GLY 145 N 1.90 1.91 2.95 3.03 0.00 -1.26 -4.77 105.19 108.95 2hji n GLY 145 Ca -0.33 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.53 2hji n GLY 145 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2hji n SER 146 N 1.11 -0.84 -2.75 1.61 7.64 -1.26 -5.08 113.62 114.04 2hji n SER 146 Ca 0.00 -2.89 -0.35 0.00 1.01 0.00 0.00 58.87 56.64 2hji n SER 146 Cb 0.00 1.78 0.02 0.00 -1.01 0.00 0.00 64.21 65.01 2hji n SER 146 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 2hji n GLU 147 N -0.56 3.02 -1.81 1.43 0.28 -1.26 -5.04 120.64 116.69 2hji n GLU 147 Ca 0.05 -3.91 -0.30 0.00 -0.16 0.00 0.00 57.16 52.84 2hji n GLU 147 Cb 0.54 -2.26 0.05 0.00 1.43 0.00 0.00 31.44 31.20 2hji n GLU 147 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 2hji s PRO 148 N -3.87 2.76 -0.79 3.44 0.04 -1.26 -3.99 135.00 131.32 2hji s PRO 148 Ca 0.50 0.52 -0.26 0.00 0.04 0.00 0.00 61.00 61.81 2hji s PRO 148 Cb 0.42 -2.00 0.04 0.00 0.04 0.00 0.00 34.50 32.99 2hji s PRO 148 CO -0.33 -1.12 1.31 1.21 0.04 0.00 0.00 177.00 178.11 2hji s ASN 149 N -4.25 6.23 -0.16 6.66 2.47 -1.25 -4.68 114.94 119.96 2hji s ASN 149 Ca 0.58 -0.66 -0.06 0.00 0.42 0.00 0.00 52.86 53.15 2hji s ASN 149 Cb -0.12 -2.56 -0.04 0.00 -1.45 0.00 0.00 41.25 37.09 2hji s ASN 149 CO 0.52 -1.77 0.04 0.72 -3.72 0.00 0.00 177.10 172.90 2hji s PHE 150 N 5.55 3.23 -0.18 0.43 -0.71 -1.26 -4.42 117.98 120.62 2hji s PHE 150 Ca 0.37 0.07 -0.06 0.00 -1.04 0.00 0.00 56.93 56.27 2hji s PHE 150 Cb -0.07 -2.00 -0.03 0.00 -1.21 0.00 0.00 43.02 39.71 2hji s PHE 150 CO 0.10 0.22 0.02 0.99 -1.34 0.00 0.00 175.22 175.22 2hji s THR 151 N 0.05 4.42 0.08 -4.49 2.01 0.20 -4.07 115.64 113.83 2hji s THR 151 Ca 0.04 -0.17 0.03 0.00 0.31 0.00 0.00 61.69 61.90 2hji s THR 151 Cb -0.12 -2.98 -0.03 0.00 0.01 0.00 0.00 72.50 69.38 2hji s THR 151 CO 0.01 0.47 -0.08 0.00 -0.69 0.00 0.00 174.62 174.32 2hji s ALA 152 N 0.45 0.89 -0.13 7.40 0.00 -1.23 -3.15 121.76 125.99 2hji s ALA 152 Ca 0.01 -1.10 0.02 0.00 0.00 0.00 0.00 51.96 50.89 2hji s ALA 152 Cb -0.13 0.07 0.01 0.00 0.00 0.00 0.00 23.12 23.07 2hji s ALA 152 CO 0.01 -0.09 -0.19 0.42 0.00 0.00 0.00 175.76 175.92 2hji s ILE 153 N -2.44 1.81 -0.22 0.00 1.01 -0.72 -2.62 121.20 118.03 2hji s ILE 153 Ca 0.02 -0.83 -0.06 0.00 0.00 0.00 0.00 60.65 59.78 2hji s ILE 153 Cb -0.03 -1.62 -0.03 0.00 0.01 0.00 0.00 42.46 40.79 2hji s ILE 153 CO -0.01 0.50 0.02 -0.60 0.00 0.00 0.00 174.94 174.85 2hji s ARG 154 N 0.91 3.63 -0.05 2.79 3.52 -0.58 -2.26 118.95 126.91 2hji s ARG 154 Ca -0.06 -0.51 0.04 0.00 -0.13 0.00 0.00 55.73 55.07 2hji s ARG 154 Cb -0.15 -3.15 -0.00 0.00 -1.56 0.00 0.00 34.95 30.08 2hji s ARG 154 CO -0.02 -0.05 -0.18 0.42 -0.81 0.00 0.00 175.30 174.66 2hji s ILE 155 N 1.19 1.51 0.00 4.11 1.01 -0.90 -2.70 121.20 125.43 2hji s ILE 155 Ca 0.03 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 59.94 2hji s ILE 155 Cb -0.14 -1.30 0.00 0.00 0.01 0.00 0.00 42.46 41.02 2hji s ILE 155 CO 0.02 0.43 0.00 2.22 0.00 0.00 0.00 174.94 177.61