#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g63 n TYR 2 N 0.00 0.00 0.00 2.03 4.02 -0.28 -4.79 117.16 118.14 1g63 n TYR 2 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1g63 n TYR 2 Cb 0.00 -0.20 0.00 0.00 -0.02 0.00 0.00 39.34 39.12 1g63 n TYR 2 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1g63 n GLY 3 N 1.38 2.39 3.71 2.72 0.00 -1.26 -4.90 105.19 109.22 1g63 n GLY 3 Ca 0.11 -2.12 -0.43 0.00 0.00 0.00 0.00 46.02 43.57 1g63 n GLY 3 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1g63 n LYS 4 N -0.54 2.61 -5.04 1.61 5.02 -1.26 -3.28 118.16 117.28 1g63 n LYS 4 Ca 0.00 0.94 -0.29 0.00 -2.02 0.00 0.00 58.31 56.94 1g63 n LYS 4 Cb 0.00 -2.76 -0.16 0.00 -0.02 0.00 0.00 35.03 32.08 1g63 n LYS 4 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1g63 s LEU 5 N 1.04 1.99 -0.11 -0.35 0.20 -0.05 -0.97 118.68 120.41 1g63 s LEU 5 Ca 0.76 -0.43 0.00 0.00 0.69 0.00 0.00 54.13 55.15 1g63 s LEU 5 Cb -0.55 -1.17 -0.02 0.00 -0.43 0.00 0.00 46.19 44.02 1g63 s LEU 5 CO 0.34 0.20 -0.11 -0.22 -0.29 0.00 0.00 176.35 176.27 1g63 s LEU 6 N -0.05 2.86 -0.21 -0.68 2.96 -0.17 -0.86 118.68 122.53 1g63 s LEU 6 Ca -0.04 -0.24 -0.06 0.00 -0.22 0.00 0.00 54.13 53.57 1g63 s LEU 6 Cb -0.13 -1.64 -0.03 0.00 0.50 0.00 0.00 46.19 44.89 1g63 s LEU 6 CO 0.03 0.22 0.04 -0.63 -1.32 0.00 0.00 176.35 174.69 1g63 s ILE 7 N 0.03 4.35 -0.43 6.68 1.01 0.00 -0.65 121.20 132.19 1g63 s ILE 7 Ca -0.03 -0.18 -0.09 0.00 0.00 0.00 0.00 60.65 60.35 1g63 s ILE 7 Cb -0.14 -2.98 0.09 0.00 0.01 0.00 0.00 42.46 39.44 1g63 s ILE 7 CO 0.04 0.41 0.27 0.00 0.00 0.00 0.00 174.94 175.66 1g63 s ALA 9 N 1.39 3.64 0.42 0.00 0.00 -0.22 -1.37 121.76 125.60 1g63 s ALA 9 Ca 0.04 -0.35 0.07 0.00 0.00 0.00 0.00 51.96 51.72 1g63 s ALA 9 Cb -0.24 -2.38 -0.06 0.00 0.00 0.00 0.00 23.12 20.44 1g63 s ALA 9 CO 0.01 0.27 0.14 0.95 0.00 0.00 0.00 175.76 177.13 1g63 s THR 10 N -0.21 2.21 -0.38 0.00 -4.23 -1.06 -1.46 115.64 110.51 1g63 s THR 10 Ca 0.20 -1.77 -0.03 0.00 -1.18 0.00 0.00 61.69 58.92 1g63 s THR 10 Cb -0.14 -2.98 -0.04 0.00 1.34 0.00 0.00 72.50 70.68 1g63 s THR 10 CO 0.08 0.00 1.56 0.00 -0.54 0.00 0.00 174.62 175.72 1g63 n ALA 11 N -1.18 2.90 -2.81 3.99 0.00 -1.26 -4.66 120.51 117.48 1g63 n ALA 11 Ca -0.02 -0.95 -0.33 0.00 0.00 0.00 0.00 53.44 52.14 1g63 n ALA 11 Cb 0.65 -2.65 -0.06 0.00 0.00 0.00 0.00 19.45 17.38 1g63 n ALA 11 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1g63 s SER 12 N 3.83 5.80 0.45 0.00 0.15 -1.26 -4.93 113.70 117.74 1g63 s SER 12 Ca 0.21 0.17 0.20 0.00 0.70 0.00 0.00 55.95 57.23 1g63 s SER 12 Cb 0.06 -1.69 1.16 0.00 -1.71 0.00 0.00 66.02 63.84 1g63 s SER 12 CO -0.01 0.26 1.89 -0.29 1.20 0.00 0.00 173.24 176.28 1g63 h ILE 13 N 3.05 0.69 0.00 6.45 6.09 -1.92 -0.18 117.51 131.70 1g63 h ILE 13 Ca -0.49 -0.11 0.00 0.00 -1.37 0.00 0.00 64.86 62.89 1g63 h ILE 13 Cb 1.18 0.35 0.00 0.00 0.47 0.00 0.00 36.82 38.82 1g63 h ILE 13 CO 0.64 0.06 0.00 0.59 -3.07 0.00 0.00 178.15 176.37 1g63 n ASN 14 N -4.46 0.00 0.22 2.19 4.13 -1.26 -2.89 115.26 113.19 1g63 n ASN 14 Ca 0.17 -0.74 0.15 0.00 1.68 0.00 0.00 54.58 55.85 1g63 n ASN 14 Cb 0.69 0.00 0.69 0.00 -1.54 0.00 0.00 39.78 39.61 1g63 n ASN 14 CO 0.00 0.00 0.00 1.62 0.28 0.00 0.00 177.26 179.16 1g63 h VAL 15 N 0.00 0.00 0.00 2.41 3.04 -1.29 -1.50 116.25 118.91 1g63 h VAL 15 Ca 0.00 -0.26 0.00 0.00 -1.01 0.00 0.00 66.70 65.43 1g63 h VAL 15 Cb 0.00 1.09 0.00 0.00 -2.01 0.00 0.00 31.29 30.37 1g63 h VAL 15 CO 0.00 0.00 0.00 2.30 -1.01 0.00 0.00 177.57 178.86 1g63 n ILE 16 N -2.67 0.89 -0.17 3.17 -5.35 -1.14 -2.23 119.36 111.86 1g63 n ILE 16 Ca 0.00 0.22 0.05 0.00 -0.27 0.00 0.00 62.75 62.75 1g63 n ILE 16 Cb 0.20 -1.05 0.13 0.00 -1.74 0.00 0.00 39.64 37.18 1g63 n ILE 16 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1g63 n ASN 17 N -1.86 2.78 0.27 7.28 5.03 -0.57 -4.66 115.26 123.53 1g63 n ASN 17 Ca 0.03 -2.03 0.14 0.00 0.87 0.00 0.00 54.58 53.59 1g63 n ASN 17 Cb 0.21 -0.20 0.83 0.00 -1.02 0.00 0.00 39.78 39.60 1g63 n ASN 17 CO 0.00 0.00 0.00 -0.29 -1.83 0.00 0.00 177.26 175.14 1g63 h ILE 18 N 1.64 0.63 -0.27 2.41 6.09 -1.49 -2.08 117.51 124.44 1g63 h ILE 18 Ca 0.00 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.48 1g63 h ILE 18 Cb 0.71 0.97 -0.01 0.00 0.47 0.00 0.00 36.82 38.95 1g63 h ILE 18 CO 0.01 0.00 0.13 -0.55 -3.07 0.00 0.00 178.15 174.66 1g63 h ASN 19 N 0.00 0.33 -0.64 2.19 -1.07 -1.83 -2.35 115.58 112.21 1g63 h ASN 19 Ca 0.02 -0.02 -0.04 0.00 0.07 0.00 0.00 56.30 56.33 1g63 h ASN 19 Cb 0.10 -0.08 -0.03 0.00 -2.07 0.00 0.00 38.32 36.24 1g63 h ASN 19 CO -0.00 0.29 0.25 0.45 0.07 0.00 0.00 177.43 178.48 1g63 h HIS 20 N 0.37 0.98 -0.71 4.14 3.86 -1.75 -2.79 115.15 119.26 1g63 h HIS 20 Ca 0.10 -0.08 -0.07 0.00 -1.16 0.00 0.00 60.37 59.16 1g63 h HIS 20 Cb 0.05 -0.29 -0.03 0.00 1.06 0.00 0.00 27.41 28.20 1g63 h HIS 20 CO 0.00 0.78 0.17 1.88 0.86 0.00 0.00 177.93 181.62 1g63 h TYR 21 N 0.90 1.20 0.67 2.45 -1.99 -1.56 -2.91 116.97 115.73 1g63 h TYR 21 Ca 0.21 -0.14 -0.03 0.00 2.00 0.00 0.00 58.73 60.77 1g63 h TYR 21 Cb 0.22 -0.34 -0.01 0.00 2.00 0.00 0.00 36.73 38.60 1g63 h TYR 21 CO 0.01 0.97 -0.49 0.82 -0.00 0.00 0.00 178.16 179.47 1g63 h ILE 22 N 1.08 0.00 -0.84 -2.88 2.04 -1.23 0.23 117.51 115.92 1g63 h ILE 22 Ca 0.22 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.18 1g63 h ILE 22 Cb 0.38 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.40 1g63 h ILE 22 CO 0.00 0.00 0.54 1.62 0.00 0.00 0.00 178.15 180.32 1g63 h VAL 23 N -1.12 0.96 -0.06 1.67 3.04 -1.57 0.83 116.25 120.01 1g63 h VAL 23 Ca -0.09 -0.27 -0.01 0.00 -1.01 0.00 0.00 66.70 65.32 1g63 h VAL 23 Cb 0.92 0.09 -0.00 0.00 -2.01 0.00 0.00 31.29 30.29 1g63 h VAL 23 CO 0.04 0.15 -0.01 -0.08 -1.01 0.00 0.00 177.57 176.65 1g63 h GLU 24 N 0.80 0.10 0.00 4.17 4.57 -1.28 -3.10 114.58 119.84 1g63 h GLU 24 Ca 0.39 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.50 1g63 h GLU 24 Cb 0.43 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.01 1g63 h GLU 24 CO -0.16 0.43 -0.13 -0.07 -1.18 0.00 0.00 179.01 177.90 1g63 h LEU 25 N -0.23 0.00 -1.04 1.64 3.38 0.08 -2.88 115.31 116.25 1g63 h LEU 25 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1g63 h LEU 25 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1g63 h LEU 25 CO 0.00 0.13 0.00 0.29 0.09 0.00 0.00 178.44 178.96 1g63 n LYS 26 N -3.37 0.12 0.05 1.13 4.76 0.23 -1.58 118.16 119.51 1g63 n LYS 26 Ca -0.00 0.57 0.12 0.00 -2.87 0.00 0.00 58.31 56.12 1g63 n LYS 26 Cb 0.33 -1.86 0.16 0.00 -1.84 0.00 0.00 35.03 31.82 1g63 n LYS 26 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1g63 n GLN 27 N -2.12 0.28 -0.00 1.97 6.02 -1.09 -4.28 117.38 118.17 1g63 n GLN 27 Ca -0.00 0.07 0.03 0.00 -0.01 0.00 0.00 57.00 57.09 1g63 n GLN 27 Cb 0.07 -1.67 -0.05 0.00 1.02 0.00 0.00 30.24 29.61 1g63 n GLN 27 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1g63 n HIS 28 N -2.07 0.00 -5.13 1.08 8.25 -0.61 -4.91 115.22 111.83 1g63 n HIS 28 Ca 0.03 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.20 1g63 n HIS 28 Cb 0.43 -0.12 -0.16 0.00 1.12 0.00 0.00 29.99 31.27 1g63 n HIS 28 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1g63 s PHE 29 N -2.27 2.14 0.30 4.41 0.40 -0.96 -1.13 117.98 120.87 1g63 s PHE 29 Ca -0.01 -0.54 0.02 0.00 -0.60 0.00 0.00 56.93 55.80 1g63 s PHE 29 Cb 0.05 -1.40 0.74 0.00 0.51 0.00 0.00 43.02 42.92 1g63 s PHE 29 CO 0.28 -0.13 1.59 -0.44 0.70 0.00 0.00 175.22 177.22 1g63 h ASP 30 N 5.89 -0.35 -5.02 1.36 3.45 -1.86 -3.41 116.42 116.49 1g63 h ASP 30 Ca -0.36 0.26 -0.14 0.00 0.43 0.00 0.00 57.03 57.22 1g63 h ASP 30 Cb 1.16 0.43 -0.20 0.00 -0.56 0.00 0.00 39.33 40.16 1g63 h ASP 30 CO 0.47 -0.31 -0.56 -1.61 -1.57 0.00 0.00 179.24 175.66 1g63 s GLU 31 N -5.98 0.48 -0.23 3.56 2.02 -1.26 -4.95 118.70 112.33 1g63 s GLU 31 Ca -0.13 -0.59 -0.04 0.00 0.02 0.00 0.00 54.97 54.24 1g63 s GLU 31 Cb 0.28 0.19 0.08 0.00 0.10 0.00 0.00 34.13 34.78 1g63 s GLU 31 CO 0.77 -0.11 0.09 0.54 0.02 0.00 0.00 175.26 176.58 1g63 s VAL 32 N -1.85 0.18 0.37 2.63 0.11 -1.25 -0.88 120.40 119.71 1g63 s VAL 32 Ca -0.11 -0.59 0.08 0.00 -2.93 0.00 0.00 61.98 58.42 1g63 s VAL 32 Cb -0.06 -0.94 -0.02 0.00 -1.53 0.00 0.00 36.38 33.83 1g63 s VAL 32 CO -0.01 -0.45 0.35 0.20 -3.33 0.00 0.00 175.10 171.86 1g63 s ASN 33 N 2.00 5.24 0.03 3.54 0.02 -0.04 -2.48 114.94 123.25 1g63 s ASN 33 Ca 0.04 -0.58 -0.00 0.00 -1.02 0.00 0.00 52.86 51.31 1g63 s ASN 33 Cb -0.16 -0.80 -0.02 0.00 0.02 0.00 0.00 41.25 40.28 1g63 s ASN 33 CO -0.19 -0.50 -0.03 -0.51 0.02 0.00 0.00 177.10 175.88 1g63 s ILE 34 N -2.37 0.16 -0.05 0.60 2.07 -0.54 -0.82 121.20 120.25 1g63 s ILE 34 Ca 0.45 -1.10 -0.02 0.00 -1.41 0.00 0.00 60.65 58.56 1g63 s ILE 34 Cb -0.05 -0.54 0.03 0.00 0.13 0.00 0.00 42.46 42.03 1g63 s ILE 34 CO 0.28 -0.59 0.11 -0.22 -1.91 0.00 0.00 174.94 172.60 1g63 s LEU 35 N -1.77 0.90 0.24 8.50 0.20 0.03 -1.35 118.68 125.43 1g63 s LEU 35 Ca -0.11 0.22 0.08 0.00 0.69 0.00 0.00 54.13 55.01 1g63 s LEU 35 Cb -0.06 0.25 -0.04 0.00 -0.43 0.00 0.00 46.19 45.90 1g63 s LEU 35 CO -0.03 -0.13 0.07 -0.36 -0.29 0.00 0.00 176.35 175.61 1g63 s PHE 36 N 1.04 2.88 0.32 5.38 0.40 -1.26 -1.06 117.98 125.68 1g63 s PHE 36 Ca -0.08 -0.16 -0.14 0.00 -0.60 0.00 0.00 56.93 55.95 1g63 s PHE 36 Cb -0.11 -1.30 -0.08 0.00 0.51 0.00 0.00 43.02 42.03 1g63 s PHE 36 CO -0.05 0.57 0.71 -1.54 0.70 0.00 0.00 175.22 175.62 1g63 s SER 37 N -3.62 6.72 0.27 1.36 1.04 -0.54 -4.63 113.70 114.30 1g63 s SER 37 Ca 0.31 1.21 -0.01 0.00 0.48 0.00 0.00 55.95 57.95 1g63 s SER 37 Cb -0.07 -2.35 0.59 0.00 0.10 0.00 0.00 66.02 64.29 1g63 s SER 37 CO 0.22 -0.21 1.70 -0.65 0.98 0.00 0.00 173.24 175.28 1g63 h PRO 38 N 2.18 0.38 0.00 4.02 0.11 -2.00 -1.52 132.00 135.17 1g63 h PRO 38 Ca -0.48 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.54 1g63 h PRO 38 Cb 1.18 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1g63 h PRO 38 CO 0.66 0.25 -0.33 0.77 -0.21 0.00 0.00 178.00 179.14 1g63 h SER 39 N 0.39 0.00 0.55 -2.05 0.02 -1.97 -2.71 113.55 107.77 1g63 h SER 39 Ca 0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.43 1g63 h SER 39 Cb 0.85 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.39 1g63 h SER 39 CO -0.49 0.33 0.00 0.77 -1.14 0.00 0.00 176.83 176.29 1g63 h SER 40 N 0.00 0.00 0.40 3.07 4.64 -1.58 -2.08 113.55 118.00 1g63 h SER 40 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1g63 h SER 40 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 1g63 h SER 40 CO 0.04 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.29 1g63 n LYS 41 N -2.62 0.19 0.00 4.77 5.02 -1.02 -1.71 118.16 122.78 1g63 n LYS 41 Ca 0.00 0.14 0.13 0.00 -2.02 0.00 0.00 58.31 56.56 1g63 n LYS 41 Cb 0.19 -1.50 0.43 0.00 -0.02 0.00 0.00 35.03 34.13 1g63 n LYS 41 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1g63 n ASN 42 N -1.34 1.04 -0.07 4.39 5.03 -0.78 -4.05 115.26 119.48 1g63 n ASN 42 Ca 0.07 -0.96 -0.07 0.00 0.87 0.00 0.00 54.58 54.50 1g63 n ASN 42 Cb 0.16 0.09 -0.10 0.00 -1.02 0.00 0.00 39.78 38.90 1g63 n ASN 42 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1g63 n PHE 43 N -0.55 0.00 -4.05 3.10 3.01 -0.69 -5.06 117.46 113.22 1g63 n PHE 43 Ca 0.14 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.50 1g63 n PHE 43 Cb 0.34 -0.64 -0.07 0.00 -0.01 0.00 0.00 39.48 39.10 1g63 n PHE 43 CO 0.00 0.00 0.00 0.96 1.01 0.00 0.00 176.76 178.73 1g63 s ILE 44 N -2.31 0.02 -0.58 4.37 -4.36 -1.19 -4.90 121.20 112.25 1g63 s ILE 44 Ca -0.08 -1.59 -0.20 0.00 -0.26 0.00 0.00 60.65 58.53 1g63 s ILE 44 Cb 0.04 -2.17 0.08 0.00 1.25 0.00 0.00 42.46 41.66 1g63 s ILE 44 CO 0.52 -0.10 0.75 0.21 0.24 0.00 0.00 174.94 176.55 1g63 s ASN 45 N -3.04 6.20 0.56 4.36 3.84 -1.26 -4.64 114.94 120.96 1g63 s ASN 45 Ca 0.26 -1.16 0.28 0.00 0.21 0.00 0.00 52.86 52.45 1g63 s ASN 45 Cb 0.03 -2.33 1.67 0.00 -0.55 0.00 0.00 41.25 40.07 1g63 s ASN 45 CO 0.07 -1.13 2.19 0.71 -2.79 0.00 0.00 177.10 176.16 1g63 h THR 46 N 5.92 0.57 0.00 -5.21 1.35 -1.93 -2.63 112.91 110.98 1g63 h THR 46 Ca -0.29 -0.18 -0.02 0.00 -0.55 0.00 0.00 66.41 65.38 1g63 h THR 46 Cb 1.09 1.11 -0.00 0.00 -1.73 0.00 0.00 68.15 68.61 1g63 h THR 46 CO 1.08 0.04 -0.09 0.44 -0.25 0.00 0.00 175.52 176.74 1g63 h ASP 47 N 0.00 0.00 -0.40 5.36 3.32 -2.02 -2.07 116.42 120.60 1g63 h ASP 47 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1g63 h ASP 47 Cb 0.11 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 1g63 h ASP 47 CO 0.01 0.09 0.26 0.58 -1.72 0.00 0.00 179.24 178.46 1g63 h VAL 48 N 0.00 1.10 0.00 -1.35 2.07 -1.90 -1.41 116.25 114.77 1g63 h VAL 48 Ca -0.00 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1g63 h VAL 48 Cb 0.19 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1g63 h VAL 48 CO 0.01 0.10 0.00 -0.07 0.02 0.00 0.00 177.57 177.63 1g63 h LEU 49 N 0.55 0.00 -2.30 2.57 -0.00 -1.56 -0.13 115.31 114.44 1g63 h LEU 49 Ca 0.15 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 58.02 1g63 h LEU 49 Cb -0.06 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.60 1g63 h LEU 49 CO -0.03 0.00 -0.04 0.11 -0.00 0.00 0.00 178.44 178.48 1g63 h LYS 50 N 0.00 0.00 0.00 1.13 1.57 -1.41 0.14 116.57 118.00 1g63 h LYS 50 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1g63 h LYS 50 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1g63 h LYS 50 CO 0.00 0.04 0.00 -0.07 -0.57 0.00 0.00 179.45 178.85 1g63 h LEU 51 N 0.00 0.00 0.00 2.94 3.38 -1.20 -3.36 115.31 117.07 1g63 h LEU 51 Ca -0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1g63 h LEU 51 Cb 0.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1g63 h LEU 51 CO 0.00 0.00 -1.28 0.49 0.09 0.00 0.00 178.44 177.74 1g63 n PHE 52 N -2.38 0.00 -2.76 1.13 3.01 -0.56 -5.05 117.46 110.85 1g63 n PHE 52 Ca 0.05 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.22 1g63 n PHE 52 Cb 0.42 -0.20 -0.02 0.00 -0.01 0.00 0.00 39.48 39.68 1g63 n PHE 52 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1g63 h ASP 54 N 0.86 0.92 -4.30 0.00 3.32 -1.80 -3.45 116.42 111.97 1g63 h ASP 54 Ca -0.47 -0.59 -0.14 0.00 0.02 0.00 0.00 57.03 55.85 1g63 h ASP 54 Cb 1.19 -0.27 -0.23 0.00 0.22 0.00 0.00 39.33 40.24 1g63 h ASP 54 CO 0.63 1.39 -0.35 0.20 -1.72 0.00 0.00 179.24 179.39 1g63 s ASN 55 N -7.09 -0.24 -0.17 6.45 -0.87 -1.26 -5.05 114.94 106.71 1g63 s ASN 55 Ca -0.10 0.36 0.01 0.00 -1.57 0.00 0.00 52.86 51.56 1g63 s ASN 55 Cb 0.09 0.48 0.01 0.00 -0.02 0.00 0.00 41.25 41.81 1g63 s ASN 55 CO 0.90 -0.23 -0.20 -0.22 -2.57 0.00 0.00 177.10 174.78 1g63 s LEU 56 N -0.45 2.18 -0.38 0.60 2.96 -1.26 -1.47 118.68 120.86 1g63 s LEU 56 Ca -0.06 -0.62 -0.19 0.00 -0.22 0.00 0.00 54.13 53.05 1g63 s LEU 56 Cb -0.04 -1.49 0.01 0.00 0.50 0.00 0.00 46.19 45.18 1g63 s LEU 56 CO 0.02 0.03 0.53 -0.31 -1.32 0.00 0.00 176.35 175.29 1g63 s TYR 57 N 1.13 3.15 -0.30 5.38 1.51 -0.46 -5.00 117.35 122.78 1g63 s TYR 57 Ca 0.01 0.02 -0.01 0.00 -1.01 0.00 0.00 57.07 56.09 1g63 s TYR 57 Cb -0.14 -3.02 0.05 0.00 -0.11 0.00 0.00 41.96 38.75 1g63 s TYR 57 CO -0.09 -0.64 -0.02 0.34 -1.11 0.00 0.00 175.55 174.03 1g63 s ASP 58 N 1.83 4.82 0.22 2.29 3.68 -1.26 -4.37 116.67 123.88 1g63 s ASP 58 Ca 0.18 -1.31 0.24 0.00 2.13 0.00 0.00 52.55 53.79 1g63 s ASP 58 Cb -0.15 -1.69 0.92 0.00 -1.45 0.00 0.00 42.92 40.55 1g63 s ASP 58 CO 0.15 -0.25 1.72 -1.84 0.13 0.00 0.00 175.17 175.07 1g63 n GLU 59 N 4.59 0.20 0.05 4.34 0.28 -1.26 -1.55 120.64 127.28 1g63 n GLU 59 Ca -0.13 0.35 -0.22 0.00 -0.16 0.00 0.00 57.16 57.00 1g63 n GLU 59 Cb 0.43 -1.82 -0.15 0.00 1.43 0.00 0.00 31.44 31.33 1g63 n GLU 59 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 1g63 h ILE 60 N 0.00 1.23 -0.38 3.84 2.04 -1.97 -2.41 117.51 119.86 1g63 h ILE 60 Ca 0.00 -2.51 -0.09 0.00 1.00 0.00 0.00 64.86 63.26 1g63 h ILE 60 Cb 0.46 2.94 -0.02 0.00 -0.74 0.00 0.00 36.82 39.47 1g63 h ILE 60 CO 0.00 0.74 -0.14 0.50 0.00 0.00 0.00 178.15 179.25 1g63 h LYS 61 N -0.22 0.69 -2.77 2.37 3.64 -1.97 -3.38 116.57 114.93 1g63 h LYS 61 Ca -0.24 -0.23 -0.57 0.00 -1.27 0.00 0.00 60.65 58.34 1g63 h LYS 61 Cb 1.82 -0.06 -0.39 0.00 -0.41 0.00 0.00 32.23 33.19 1g63 h LYS 61 CO 0.14 0.80 -0.81 0.34 -2.27 0.00 0.00 179.45 177.65 1g63 s ASP 62 N -6.73 3.30 0.28 4.20 3.68 -0.60 -5.00 116.67 115.81 1g63 s ASP 62 Ca -0.09 -1.92 0.23 0.00 2.13 0.00 0.00 52.55 52.91 1g63 s ASP 62 Cb 0.14 -0.49 1.05 0.00 -1.45 0.00 0.00 42.92 42.17 1g63 s ASP 62 CO 0.81 -0.35 1.69 -2.65 0.13 0.00 0.00 175.17 174.80 1g63 n PRO 63 N 4.42 0.17 -1.24 4.34 -0.02 -0.91 -3.20 135.00 138.58 1g63 n PRO 63 Ca 0.05 0.51 -0.18 0.00 -2.02 0.00 0.00 63.50 61.86 1g63 n PRO 63 Cb 0.39 -1.91 0.13 0.00 -0.02 0.00 0.00 33.50 32.09 1g63 n PRO 63 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1g63 n LEU 64 N -2.25 5.44 -4.76 2.45 7.99 -1.26 -5.03 117.00 119.58 1g63 n LEU 64 Ca 0.01 -4.08 -0.41 0.00 -0.01 0.00 0.00 56.01 51.52 1g63 n LEU 64 Cb 0.16 -0.68 -0.02 0.00 -0.11 0.00 0.00 43.42 42.77 1g63 n LEU 64 CO 0.16 1.46 1.10 -0.22 -1.51 0.00 0.00 177.39 178.38 1g63 s LEU 65 N -3.46 4.38 -0.75 2.23 2.96 -1.19 -4.93 118.68 117.91 1g63 s LEU 65 Ca 0.52 2.77 -0.25 0.00 -0.22 0.00 0.00 54.13 56.96 1g63 s LEU 65 Cb 0.44 -3.64 0.05 0.00 0.50 0.00 0.00 46.19 43.54 1g63 s LEU 65 CO 0.02 -0.72 1.18 0.21 -1.32 0.00 0.00 176.35 175.72 1g63 s ASN 66 N 0.12 6.22 0.48 3.68 3.84 -1.26 -4.89 114.94 123.13 1g63 s ASN 66 Ca 0.57 -0.81 0.16 0.00 0.21 0.00 0.00 52.86 52.99 1g63 s ASN 66 Cb -0.43 -2.51 1.13 0.00 -0.55 0.00 0.00 41.25 38.90 1g63 s ASN 66 CO 0.49 -1.64 2.05 1.12 -2.79 0.00 0.00 177.10 176.34 1g63 h HIS 67 N 9.80 0.00 -0.26 0.43 2.07 -1.97 -1.95 115.15 123.27 1g63 h HIS 67 Ca -0.21 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.27 1g63 h HIS 67 Cb 1.05 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.02 1g63 h HIS 67 CO 1.09 0.12 0.02 0.82 -3.07 0.00 0.00 177.93 176.91 1g63 h ILE 68 N 0.00 1.24 -0.67 6.12 2.04 -1.96 -1.68 117.51 122.61 1g63 h ILE 68 Ca -0.00 -0.85 -0.06 0.00 1.00 0.00 0.00 64.86 64.94 1g63 h ILE 68 Cb 0.21 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.56 1g63 h ILE 68 CO 0.02 0.27 0.16 0.78 0.00 0.00 0.00 178.15 179.38 1g63 h ASN 69 N 0.24 1.00 -0.65 1.72 -0.26 -1.88 -1.21 115.58 114.53 1g63 h ASN 69 Ca 0.08 -0.20 0.03 0.00 -0.56 0.00 0.00 56.30 55.65 1g63 h ASN 69 Cb 0.38 -0.26 -0.04 0.00 -1.06 0.00 0.00 38.32 37.33 1g63 h ASN 69 CO 0.01 0.96 0.40 0.40 -1.06 0.00 0.00 177.43 178.14 1g63 h ILE 70 N 1.01 1.06 -0.37 2.81 2.04 -1.14 0.07 117.51 122.99 1g63 h ILE 70 Ca 0.21 -0.27 -0.09 0.00 1.00 0.00 0.00 64.86 65.72 1g63 h ILE 70 Cb 0.35 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1g63 h ILE 70 CO 0.00 0.14 -0.12 0.58 0.00 0.00 0.00 178.15 178.75 1g63 h VAL 71 N 0.77 1.28 0.00 1.67 2.07 -0.88 -2.97 116.25 118.20 1g63 h VAL 71 Ca 0.27 -1.21 -0.06 0.00 0.82 0.00 0.00 66.70 66.52 1g63 h VAL 71 Cb 0.05 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 1g63 h VAL 71 CO -0.12 0.40 -0.28 -0.33 0.02 0.00 0.00 177.57 177.26 1g63 h GLU 72 N 0.54 0.00 0.00 1.57 5.08 -0.92 -2.72 114.58 118.13 1g63 h GLU 72 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1g63 h GLU 72 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1g63 h GLU 72 CO 0.04 0.28 0.00 -1.71 -1.00 0.00 0.00 179.01 176.62 1g63 n ASN 73 N -3.76 0.00 -4.21 1.42 4.05 -0.01 -4.81 115.26 107.94 1g63 n ASN 73 Ca -0.01 -0.13 -0.22 0.00 0.45 0.00 0.00 54.58 54.66 1g63 n ASN 73 Cb 0.38 -0.26 -0.13 0.00 1.23 0.00 0.00 39.78 41.00 1g63 n ASN 73 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 177.26 173.21 1g63 s HIS 74 N -2.52 1.51 -0.12 1.20 3.76 -1.03 -4.71 115.29 113.37 1g63 s HIS 74 Ca 0.25 -0.39 0.17 0.00 -0.15 0.00 0.00 55.06 54.94 1g63 s HIS 74 Cb 0.17 -0.87 -0.21 0.00 1.11 0.00 0.00 32.58 32.78 1g63 s HIS 74 CO 0.38 0.09 0.52 0.39 -0.85 0.00 0.00 174.74 175.26 1g63 n GLU 75 N 1.59 0.65 -4.39 1.40 1.02 -0.15 -4.92 120.64 115.85 1g63 n GLU 75 Ca -0.19 0.11 -0.19 0.00 -0.02 0.00 0.00 57.16 56.87 1g63 n GLU 75 Cb 0.54 -1.68 -0.15 0.00 -0.02 0.00 0.00 31.44 30.13 1g63 n GLU 75 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1g63 s TYR 76 N -2.81 0.87 -0.17 -0.32 1.51 -1.15 -4.85 117.35 110.41 1g63 s TYR 76 Ca -0.06 -0.18 -0.01 0.00 -1.01 0.00 0.00 57.07 55.82 1g63 s TYR 76 Cb 0.08 -0.58 0.05 0.00 -0.11 0.00 0.00 41.96 41.40 1g63 s TYR 76 CO 0.83 -0.04 -0.04 0.42 -1.11 0.00 0.00 175.55 175.62 1g63 s ILE 77 N -0.12 1.05 -0.09 2.71 1.01 -0.36 -1.00 121.20 124.41 1g63 s ILE 77 Ca 0.02 -0.65 -0.01 0.00 0.00 0.00 0.00 60.65 60.01 1g63 s ILE 77 Cb -0.05 -1.28 -0.03 0.00 0.01 0.00 0.00 42.46 41.11 1g63 s ILE 77 CO -0.00 0.07 -0.04 -0.76 0.00 0.00 0.00 174.94 174.20 1g63 s LEU 78 N 1.65 3.33 -0.46 2.97 1.02 0.18 -0.42 118.68 126.95 1g63 s LEU 78 Ca -0.00 0.02 -0.08 0.00 0.02 0.00 0.00 54.13 54.09 1g63 s LEU 78 Cb -0.16 -1.75 0.11 0.00 0.02 0.00 0.00 46.19 44.42 1g63 s LEU 78 CO -0.07 0.34 0.31 0.54 0.02 0.00 0.00 176.35 177.49 1g63 s VAL 79 N -0.66 4.06 -0.12 -1.59 0.11 -0.14 0.10 120.40 122.15 1g63 s VAL 79 Ca 0.10 -1.79 -0.04 0.00 -2.93 0.00 0.00 61.98 57.32 1g63 s VAL 79 Cb -0.12 -3.67 0.06 0.00 -1.53 0.00 0.00 36.38 31.13 1g63 s VAL 79 CO 0.02 -0.73 0.18 -0.22 -3.33 0.00 0.00 175.10 171.02 1g63 s LEU 80 N 1.33 -0.07 0.57 2.54 2.96 -0.47 -1.93 118.68 123.60 1g63 s LEU 80 Ca 0.06 0.14 -0.15 0.00 -0.22 0.00 0.00 54.13 53.96 1g63 s LEU 80 Cb -0.25 0.30 -0.05 0.00 0.50 0.00 0.00 46.19 46.68 1g63 s LEU 80 CO -0.01 -0.27 1.02 -2.84 -1.32 0.00 0.00 176.35 172.92 1g63 s PRO 81 N 2.30 3.65 -0.26 0.98 0.02 -1.26 -4.10 135.00 136.33 1g63 s PRO 81 Ca 0.04 0.97 -0.06 0.00 0.02 0.00 0.00 61.00 61.97 1g63 s PRO 81 Cb -0.13 -2.09 -0.01 0.00 0.02 0.00 0.00 34.50 32.29 1g63 s PRO 81 CO -0.08 -0.53 0.05 0.00 -0.33 0.00 0.00 177.00 176.12 1g63 s ALA 82 N -2.73 3.06 0.60 -1.55 0.00 -0.48 -2.57 121.76 118.09 1g63 s ALA 82 Ca 0.59 -1.25 -0.13 0.00 0.00 0.00 0.00 51.96 51.17 1g63 s ALA 82 Cb -0.12 -2.03 -0.05 0.00 0.00 0.00 0.00 23.12 20.92 1g63 s ALA 82 CO 0.39 -0.63 1.02 -1.54 0.00 0.00 0.00 175.76 175.00 1g63 s SER 83 N 1.55 6.24 0.21 0.00 1.04 -1.26 -1.22 113.70 120.25 1g63 s SER 83 Ca 0.05 1.50 -0.10 0.00 0.48 0.00 0.00 55.95 57.88 1g63 s SER 83 Cb -0.16 -2.49 0.20 0.00 0.10 0.00 0.00 66.02 63.67 1g63 s SER 83 CO 0.02 -0.86 1.84 0.00 0.98 0.00 0.00 173.24 175.22 1g63 h ALA 84 N 0.03 0.89 -0.07 5.32 0.00 -1.98 -1.67 119.26 121.78 1g63 h ALA 84 Ca -0.45 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.48 1g63 h ALA 84 Cb 1.19 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 1g63 h ALA 84 CO 0.61 0.16 -0.18 -0.97 0.00 0.00 0.00 179.25 178.88 1g63 h ASN 85 N 0.80 -0.53 -0.42 0.00 -0.73 -1.99 -0.58 115.58 112.14 1g63 h ASN 85 Ca 0.28 0.09 -0.10 0.00 1.87 0.00 0.00 56.30 58.43 1g63 h ASN 85 Cb 0.06 0.23 -0.02 0.00 0.27 0.00 0.00 38.32 38.87 1g63 h ASN 85 CO -0.12 -0.23 -0.12 0.74 -0.37 0.00 0.00 177.43 177.32 1g63 h THR 86 N -0.25 1.26 -0.10 -3.57 2.02 -1.91 -1.22 112.91 109.15 1g63 h THR 86 Ca 0.08 -1.23 0.02 0.00 0.77 0.00 0.00 66.41 66.04 1g63 h THR 86 Cb 0.36 1.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.78 1g63 h THR 86 CO -0.21 0.43 -0.02 0.40 0.37 0.00 0.00 175.52 176.48 1g63 h ILE 87 N 0.79 0.90 -0.22 3.11 2.04 -1.01 0.08 117.51 123.21 1g63 h ILE 87 Ca 0.13 -0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.92 1g63 h ILE 87 Cb 0.64 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 1g63 h ILE 87 CO 0.04 0.00 -0.14 0.78 0.00 0.00 0.00 178.15 178.83 1g63 h ASN 88 N 0.00 0.34 -0.16 1.72 -0.26 -0.92 -1.34 115.58 114.96 1g63 h ASN 88 Ca 0.05 -0.08 -0.04 0.00 -0.56 0.00 0.00 56.30 55.66 1g63 h ASN 88 Cb 0.07 -0.09 -0.00 0.00 -1.06 0.00 0.00 38.32 37.24 1g63 h ASN 88 CO -0.10 0.51 -0.07 0.11 -1.06 0.00 0.00 177.43 176.82 1g63 h LYS 89 N 0.33 0.34 -0.45 0.81 1.57 -0.71 -2.55 116.57 115.92 1g63 h LYS 89 Ca 0.06 -0.14 0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1g63 h LYS 89 Cb 0.45 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 1g63 h LYS 89 CO 0.03 0.64 0.28 0.82 -0.57 0.00 0.00 179.45 180.66 1g63 h ILE 90 N 0.02 1.09 -0.32 1.86 2.04 -0.75 0.17 117.51 121.61 1g63 h ILE 90 Ca 0.04 -0.20 0.06 0.00 1.00 0.00 0.00 64.86 65.76 1g63 h ILE 90 Cb 0.54 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 1g63 h ILE 90 CO 0.02 0.11 0.22 0.00 0.00 0.00 0.00 178.15 178.50 1g63 h ALA 91 N 1.18 2.08 -0.63 1.87 0.00 -1.21 -1.24 119.26 121.31 1g63 h ALA 91 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1g63 h ALA 91 Cb -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1g63 h ALA 91 CO -0.05 -0.15 0.00 0.09 0.00 0.00 0.00 179.25 179.14 1g63 n ASN 92 N -4.48 3.83 -0.27 0.00 4.13 -0.71 -4.94 115.26 112.83 1g63 n ASN 92 Ca 0.04 -2.00 -0.03 0.00 1.68 0.00 0.00 54.58 54.26 1g63 n ASN 92 Cb 0.27 -0.42 -0.01 0.00 -1.54 0.00 0.00 39.78 38.08 1g63 n ASN 92 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1g63 n GLY 93 N 1.63 0.59 3.66 7.41 0.00 -0.38 -4.97 105.19 113.13 1g63 n GLY 93 Ca 0.23 -0.24 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 1g63 n GLY 93 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1g63 s ILE 94 N -1.87 4.50 -0.54 -0.61 1.01 0.46 -4.95 121.20 119.19 1g63 s ILE 94 Ca 0.00 1.81 0.06 0.00 0.00 0.00 0.00 60.65 62.52 1g63 s ILE 94 Cb 0.00 -4.19 0.22 0.00 0.01 0.00 0.00 42.46 38.51 1g63 s ILE 94 CO 0.00 -0.18 0.58 0.00 0.00 0.00 0.00 174.94 175.33 1g63 n ASP 96 N 1.49 3.21 -3.93 0.00 5.68 -1.26 -4.57 116.55 117.17 1g63 n ASP 96 Ca 0.26 -2.10 -0.09 0.00 -0.50 0.00 0.00 54.79 52.35 1g63 n ASP 96 Cb 0.45 -0.41 -0.06 0.00 -1.14 0.00 0.00 41.12 39.95 1g63 n ASP 96 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1g63 s ASN 97 N -0.94 -0.05 0.14 -1.12 2.20 -1.26 -5.05 114.94 108.85 1g63 s ASN 97 Ca 0.38 -0.81 -0.18 0.00 -0.94 0.00 0.00 52.86 51.30 1g63 s ASN 97 Cb 0.21 0.50 0.02 0.00 -2.00 0.00 0.00 41.25 39.98 1g63 s ASN 97 CO 0.23 -0.99 1.73 0.25 -2.94 0.00 0.00 177.10 175.39 1g63 h LEU 98 N 2.40 0.02 -0.18 3.54 5.85 -1.92 -0.44 115.31 124.58 1g63 h LEU 98 Ca -0.30 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.51 1g63 h LEU 98 Cb 1.24 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.28 1g63 h LEU 98 CO 0.43 0.04 -0.14 0.25 -0.34 0.00 0.00 178.44 178.68 1g63 h LEU 99 N 0.16 -0.45 -1.38 2.25 6.46 -1.95 0.15 115.31 120.55 1g63 h LEU 99 Ca 0.13 0.09 -0.06 0.00 -0.12 0.00 0.00 57.88 57.92 1g63 h LEU 99 Cb 0.13 0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.28 1g63 h LEU 99 CO -0.17 -0.18 -0.29 0.00 -0.62 0.00 0.00 178.44 177.17 1g63 h THR 100 N -0.15 0.99 -0.00 1.05 1.03 -1.87 -1.24 112.91 112.71 1g63 h THR 100 Ca 0.11 -1.09 -0.21 0.00 -0.01 0.00 0.00 66.41 65.20 1g63 h THR 100 Cb 0.31 1.63 -0.00 0.00 -1.07 0.00 0.00 68.15 69.02 1g63 h THR 100 CO -0.27 0.29 -0.90 0.74 -0.01 0.00 0.00 175.52 175.37 1g63 h THR 101 N 0.00 1.44 -0.47 0.00 2.02 -0.08 -2.62 112.91 113.20 1g63 h THR 101 Ca -0.00 -2.49 -0.11 0.00 0.77 0.00 0.00 66.41 64.57 1g63 h THR 101 Cb 0.61 2.41 -0.02 0.00 -1.74 0.00 0.00 68.15 69.41 1g63 h THR 101 CO 0.04 0.74 -0.16 0.58 0.37 0.00 0.00 175.52 177.08 1g63 h VAL 102 N 0.18 1.27 -0.01 3.16 2.07 -0.21 -2.63 116.25 120.08 1g63 h VAL 102 Ca -0.06 -1.29 -0.09 0.00 0.82 0.00 0.00 66.70 66.08 1g63 h VAL 102 Cb 1.53 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 1g63 h VAL 102 CO 0.15 0.44 -0.42 0.00 0.02 0.00 0.00 177.57 177.77 1g63 h LEU 104 N 0.02 0.09 -0.92 0.00 5.85 -1.32 -2.94 115.31 116.10 1g63 h LEU 104 Ca -0.00 -0.53 -0.01 0.00 0.84 0.00 0.00 57.88 58.17 1g63 h LEU 104 Cb 0.74 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 1g63 h LEU 104 CO 0.05 0.60 0.51 0.74 -0.34 0.00 0.00 178.44 180.01 1g63 h THR 105 N -0.42 1.26 -0.94 1.05 2.02 -1.36 -3.17 112.91 111.35 1g63 h THR 105 Ca 0.00 -0.63 -0.64 0.00 0.77 0.00 0.00 66.41 65.91 1g63 h THR 105 Cb 0.58 0.01 -0.33 0.00 -1.74 0.00 0.00 68.15 66.67 1g63 h THR 105 CO 0.01 0.29 0.40 0.61 0.37 0.00 0.00 175.52 177.20 1g63 n GLY 106 N -1.16 6.03 0.33 2.16 0.00 -0.30 -4.72 105.19 107.53 1g63 n GLY 106 Ca 0.10 -2.41 0.16 0.00 0.00 0.00 0.00 46.02 43.87 1g63 n GLY 106 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1g63 h TYR 107 N 2.06 0.00 0.00 1.61 -0.00 -1.49 -1.61 116.97 117.54 1g63 h TYR 107 Ca 0.54 0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 59.27 1g63 h TYR 107 Cb 1.01 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.74 1g63 h TYR 107 CO 1.27 0.00 -0.02 1.96 -0.00 0.00 0.00 178.16 181.37 1g63 h GLN 108 N 0.00 0.00 -0.25 0.10 4.20 -1.87 -3.11 115.11 114.18 1g63 h GLN 108 Ca 0.09 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1g63 h GLN 108 Cb 0.47 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1g63 h GLN 108 CO -0.00 0.02 0.00 1.63 -0.67 0.00 0.00 178.83 179.81 1g63 n LYS 109 N -3.11 2.78 -3.08 1.46 5.02 -0.62 -5.04 118.16 115.57 1g63 n LYS 109 Ca 0.02 -2.42 -0.39 0.00 -2.02 0.00 0.00 58.31 53.50 1g63 n LYS 109 Cb 0.41 -1.53 -0.05 0.00 -0.02 0.00 0.00 35.03 33.84 1g63 n LYS 109 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1g63 s LEU 110 N -2.00 4.42 -0.14 -0.35 2.96 -1.11 -1.22 118.68 121.24 1g63 s LEU 110 Ca 0.31 1.30 -0.01 0.00 -0.22 0.00 0.00 54.13 55.51 1g63 s LEU 110 Cb 0.23 -3.09 0.04 0.00 0.50 0.00 0.00 46.19 43.87 1g63 s LEU 110 CO 0.10 0.03 -0.04 -0.36 -1.32 0.00 0.00 176.35 174.76 1g63 s PHE 111 N 0.01 1.40 -0.20 5.38 0.40 0.44 -2.85 117.98 122.56 1g63 s PHE 111 Ca 0.35 -0.80 -0.08 0.00 -0.60 0.00 0.00 56.93 55.80 1g63 s PHE 111 Cb -0.19 -1.18 -0.04 0.00 0.51 0.00 0.00 43.02 42.12 1g63 s PHE 111 CO 0.20 -0.54 0.07 0.42 0.70 0.00 0.00 175.22 176.07 1g63 s ILE 112 N 1.73 4.75 -0.64 0.64 1.01 0.10 -0.96 121.20 127.83 1g63 s ILE 112 Ca 0.03 -0.04 0.01 0.00 0.00 0.00 0.00 60.65 60.64 1g63 s ILE 112 Cb -0.14 -3.16 0.16 0.00 0.01 0.00 0.00 42.46 39.33 1g63 s ILE 112 CO -0.07 0.43 0.43 -0.36 0.00 0.00 0.00 174.94 175.37 1g63 s PHE 113 N 0.64 3.41 0.34 3.97 0.40 -0.81 -0.92 117.98 125.00 1g63 s PHE 113 Ca 0.04 -2.99 -0.28 0.00 -0.60 0.00 0.00 56.93 53.09 1g63 s PHE 113 Cb -0.13 -3.02 -0.12 0.00 0.51 0.00 0.00 43.02 40.26 1g63 s PHE 113 CO 0.01 -0.75 1.24 -2.30 0.70 0.00 0.00 175.22 174.12 1g63 n PRO 114 N 3.00 1.98 -3.61 0.24 -0.02 -1.26 -1.38 135.00 133.94 1g63 n PRO 114 Ca 0.10 0.69 -0.10 0.00 -2.02 0.00 0.00 63.50 62.18 1g63 n PRO 114 Cb 0.35 -2.24 -0.10 0.00 -0.02 0.00 0.00 33.50 31.49 1g63 n PRO 114 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1g63 s ASN 115 N -0.37 -0.03 0.04 2.55 3.84 -0.36 -4.74 114.94 115.87 1g63 s ASN 115 Ca 0.56 0.78 -0.28 0.00 0.21 0.00 0.00 52.86 54.13 1g63 s ASN 115 Cb -0.59 1.17 0.10 0.00 -0.55 0.00 0.00 41.25 41.38 1g63 s ASN 115 CO 0.62 -0.24 1.15 0.00 -2.79 0.00 0.00 177.10 175.83 1g63 s MET 116 N 2.56 0.71 0.57 0.43 0.23 -1.26 -4.47 119.30 118.07 1g63 s MET 116 Ca 0.01 -0.39 -0.19 0.00 -1.03 0.00 0.00 55.69 54.09 1g63 s MET 116 Cb -0.13 0.24 -0.04 0.00 -1.53 0.00 0.00 34.83 33.38 1g63 s MET 116 CO -0.12 -0.32 1.20 1.21 -2.03 0.00 0.00 175.02 174.96 1g63 s ASN 117 N -2.93 5.36 0.36 -1.18 3.84 -1.26 -4.62 114.94 114.52 1g63 s ASN 117 Ca 0.13 2.38 0.10 0.00 0.21 0.00 0.00 52.86 55.68 1g63 s ASN 117 Cb 0.02 -2.60 0.86 0.00 -0.55 0.00 0.00 41.25 38.99 1g63 s ASN 117 CO -0.02 -1.48 1.86 -0.29 -2.79 0.00 0.00 177.10 174.38 1g63 h ILE 118 N 1.06 0.79 -0.32 -5.21 6.09 -1.93 -1.68 117.51 116.31 1g63 h ILE 118 Ca -0.50 -0.22 -0.07 0.00 -1.37 0.00 0.00 64.86 62.70 1g63 h ILE 118 Cb 1.29 0.10 -0.02 0.00 0.47 0.00 0.00 36.82 38.66 1g63 h ILE 118 CO 0.56 0.12 -0.08 -0.09 -3.07 0.00 0.00 178.15 175.58 1g63 h ARG 119 N 0.64 0.53 -0.23 2.19 2.43 -1.95 -2.45 114.38 115.54 1g63 h ARG 119 Ca 0.46 -0.14 -0.14 0.00 -0.81 0.00 0.00 59.98 59.35 1g63 h ARG 119 Cb 0.82 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.30 1g63 h ARG 119 CO -0.21 0.62 -0.43 0.52 -1.51 0.00 0.00 179.97 178.95 1g63 h MET 120 N 0.49 0.57 -0.02 0.20 2.86 -1.68 -2.92 114.93 114.44 1g63 h MET 120 Ca 0.10 -0.30 0.00 0.00 -2.06 0.00 0.00 59.70 57.44 1g63 h MET 120 Cb 0.45 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.12 1g63 h MET 120 CO 0.02 0.89 0.01 2.35 1.06 0.00 0.00 176.91 181.25 1g63 h TRP 121 N 0.47 0.00 -0.00 -0.22 2.91 -1.11 -1.85 115.95 116.14 1g63 h TRP 121 Ca 0.03 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.05 1g63 h TRP 121 Cb 0.94 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.59 1g63 h TRP 121 CO 0.04 0.00 -0.00 0.41 -1.03 0.00 0.00 178.44 177.86 1g63 n GLY 122 N -1.45 -0.82 3.70 2.65 0.00 -1.10 -4.72 105.19 103.46 1g63 n GLY 122 Ca -0.03 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 1g63 n GLY 122 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1g63 s ASN 123 N -2.03 6.48 0.21 1.61 3.84 -0.70 -4.90 114.94 119.46 1g63 s ASN 123 Ca 0.45 2.70 -0.09 0.00 0.21 0.00 0.00 52.86 56.13 1g63 s ASN 123 Cb 0.22 -2.58 0.25 0.00 -0.55 0.00 0.00 41.25 38.58 1g63 s ASN 123 CO 0.37 -0.93 1.81 -0.65 -2.79 0.00 0.00 177.10 174.91 1g63 h PRO 124 N 7.72 0.70 -0.30 0.43 0.11 -1.91 -1.50 132.00 137.26 1g63 h PRO 124 Ca -0.44 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 65.50 1g63 h PRO 124 Cb 1.21 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1g63 h PRO 124 CO 0.94 0.46 -0.34 0.74 -0.21 0.00 0.00 178.00 179.60 1g63 h PHE 125 N 0.72 0.76 0.20 0.65 -1.00 -1.98 -0.41 116.94 115.87 1g63 h PHE 125 Ca 0.31 -0.20 -0.01 0.00 2.81 0.00 0.00 57.97 60.87 1g63 h PHE 125 Cb 0.18 -0.17 0.00 0.00 3.61 0.00 0.00 35.95 39.57 1g63 h PHE 125 CO -0.07 0.90 -0.09 1.25 -1.61 0.00 0.00 178.31 178.69 1g63 h LEU 126 N 0.55 -0.22 -0.92 1.54 5.85 -1.84 -2.25 115.31 118.02 1g63 h LEU 126 Ca 0.06 -0.19 0.07 0.00 0.84 0.00 0.00 57.88 58.66 1g63 h LEU 126 Cb 0.84 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.87 1g63 h LEU 126 CO 0.07 0.07 0.58 1.56 -0.34 0.00 0.00 178.44 180.38 1g63 h GLN 127 N -0.53 1.01 -0.74 1.25 1.08 -1.19 0.37 115.11 116.37 1g63 h GLN 127 Ca -0.03 -0.06 -0.02 0.00 -1.45 0.00 0.00 58.65 57.09 1g63 h GLN 127 Cb 0.40 -0.23 -0.03 0.00 -0.05 0.00 0.00 27.48 27.56 1g63 h GLN 127 CO 0.04 0.67 0.37 -0.22 -0.95 0.00 0.00 178.83 178.74 1g63 h LYS 128 N 1.04 1.04 -0.14 1.46 3.64 -1.01 -1.56 116.57 121.04 1g63 h LYS 128 Ca 0.41 -0.14 -0.14 0.00 -1.27 0.00 0.00 60.65 59.51 1g63 h LYS 128 Cb 0.20 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 1g63 h LYS 128 CO -0.18 0.79 -0.53 -0.91 -2.27 0.00 0.00 179.45 176.35 1g63 h ASN 129 N 1.04 0.45 -0.62 4.20 -0.26 -0.56 -1.98 115.58 117.85 1g63 h ASN 129 Ca 0.26 -0.23 -0.08 0.00 -0.56 0.00 0.00 56.30 55.68 1g63 h ASN 129 Cb 0.09 -0.13 -0.02 0.00 -1.06 0.00 0.00 38.32 37.19 1g63 h ASN 129 CO -0.04 0.89 0.06 0.40 -1.06 0.00 0.00 177.43 177.69 1g63 h ILE 130 N 0.32 1.26 -0.40 2.81 2.04 -0.41 -0.07 117.51 123.06 1g63 h ILE 130 Ca 0.01 -1.08 -0.04 0.00 1.00 0.00 0.00 64.86 64.75 1g63 h ILE 130 Cb 1.03 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 1g63 h ILE 130 CO 0.09 0.40 0.08 0.44 0.00 0.00 0.00 178.15 179.16 1g63 h ASP 131 N 0.99 0.62 -0.87 1.72 3.45 -1.18 -1.61 116.42 119.54 1g63 h ASP 131 Ca 0.19 -0.25 0.04 0.00 0.43 0.00 0.00 57.03 57.45 1g63 h ASP 131 Cb 0.48 -0.16 -0.06 0.00 -0.56 0.00 0.00 39.33 39.03 1g63 h ASP 131 CO 0.02 0.71 0.56 0.25 -1.57 0.00 0.00 179.24 179.20 1g63 h LEU 132 N 0.50 0.91 -0.26 1.55 5.85 -0.92 -0.26 115.31 122.68 1g63 h LEU 132 Ca 0.12 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 1g63 h LEU 132 Cb 0.34 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1g63 h LEU 132 CO 0.00 0.61 0.04 -0.07 -0.34 0.00 0.00 178.44 178.68 1g63 h LEU 133 N 1.06 0.42 -0.58 2.25 3.38 -0.72 -3.09 115.31 118.03 1g63 h LEU 133 Ca 0.36 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 1g63 h LEU 133 Cb 0.07 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1g63 h LEU 133 CO -0.14 0.57 0.24 0.11 0.09 0.00 0.00 178.44 179.31 1g63 h LYS 134 N 0.25 0.87 0.00 1.13 1.57 -0.86 -1.86 116.57 117.66 1g63 h LYS 134 Ca 0.08 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1g63 h LYS 134 Cb 0.33 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1g63 h LYS 134 CO 0.00 0.74 0.00 0.09 -0.57 0.00 0.00 179.45 179.71 1g63 n ASN 135 N -4.49 0.00 -0.95 0.86 5.03 -0.15 -2.74 115.26 112.83 1g63 n ASN 135 Ca 0.03 -1.17 0.05 0.00 0.87 0.00 0.00 54.58 54.36 1g63 n ASN 135 Cb 0.16 0.00 0.08 0.00 -1.02 0.00 0.00 39.78 39.00 1g63 n ASN 135 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1g63 n ASN 136 N -0.59 1.18 -0.75 6.41 3.02 -0.78 -5.00 115.26 118.75 1g63 n ASN 136 Ca 0.03 -2.66 -0.10 0.00 -0.03 0.00 0.00 54.58 51.82 1g63 n ASN 136 Cb 0.01 -0.36 -0.04 0.00 -0.61 0.00 0.00 39.78 38.78 1g63 n ASN 136 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1g63 n ASP 137 N -0.24 -4.19 -4.56 6.41 9.92 -1.11 -5.01 116.55 117.77 1g63 n ASP 137 Ca 0.10 0.24 -0.38 0.00 -0.53 0.00 0.00 54.79 54.23 1g63 n ASP 137 Cb 0.90 -2.56 -0.11 0.00 -0.64 0.00 0.00 41.12 38.71 1g63 n ASP 137 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1g63 s VAL 138 N -2.36 5.10 -0.20 2.53 1.01 -0.77 -4.82 120.40 120.89 1g63 s VAL 138 Ca 0.00 0.10 -0.29 0.00 0.00 0.00 0.00 61.98 61.79 1g63 s VAL 138 Cb 0.00 -3.42 -0.01 0.00 0.00 0.00 0.00 36.38 32.94 1g63 s VAL 138 CO 0.00 0.27 1.36 -0.54 0.00 0.00 0.00 175.10 176.19 1g63 s LYS 139 N 1.69 4.07 -0.24 2.72 3.01 -1.13 -3.88 119.74 125.98 1g63 s LYS 139 Ca 0.07 1.58 0.02 0.00 -1.01 0.00 0.00 55.97 56.63 1g63 s LYS 139 Cb -0.16 -3.86 0.05 0.00 -1.01 0.00 0.00 37.83 32.85 1g63 s LYS 139 CO 0.09 -0.93 -0.13 0.08 0.51 0.00 0.00 175.35 174.97 1g63 s VAL 140 N 4.06 2.13 0.51 3.17 1.01 -1.26 0.02 120.40 130.03 1g63 s VAL 140 Ca 0.59 -1.43 -0.21 0.00 0.00 0.00 0.00 61.98 60.93 1g63 s VAL 140 Cb -0.22 -2.15 -0.06 0.00 0.00 0.00 0.00 36.38 33.95 1g63 s VAL 140 CO 0.21 0.13 1.16 -0.47 0.00 0.00 0.00 175.10 176.12 1g63 s TYR 141 N 1.16 2.73 -0.38 5.22 6.14 -0.10 -4.98 117.35 127.13 1g63 s TYR 141 Ca -0.05 1.53 -0.23 0.00 0.64 0.00 0.00 57.07 58.97 1g63 s TYR 141 Cb -0.18 -3.35 0.01 0.00 0.42 0.00 0.00 41.96 38.86 1g63 s TYR 141 CO -0.07 -1.63 0.75 -1.12 0.64 0.00 0.00 175.55 174.12 1g63 s SER 142 N -1.56 6.49 -0.43 4.32 0.01 -1.26 -4.53 113.70 116.73 1g63 s SER 142 Ca 0.69 0.20 -0.44 0.00 1.31 0.00 0.00 55.95 57.71 1g63 s SER 142 Cb -0.27 -2.38 -0.18 0.00 0.21 0.00 0.00 66.02 63.40 1g63 s SER 142 CO 0.31 -0.75 1.74 -2.65 0.41 0.00 0.00 173.24 172.31 1g63 n PRO 143 N 6.41 0.37 -1.89 12.44 -0.02 -1.26 -4.86 135.00 146.18 1g63 n PRO 143 Ca 0.02 0.13 -0.42 0.00 -2.02 0.00 0.00 63.50 61.21 1g63 n PRO 143 Cb 0.48 -1.71 -0.03 0.00 -0.02 0.00 0.00 33.50 32.22 1g63 n PRO 143 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1g63 s ASP 144 N 3.77 6.53 0.37 2.55 -0.00 -1.26 -4.85 116.67 123.79 1g63 s ASP 144 Ca 1.06 2.71 0.05 0.00 -0.00 0.00 0.00 52.55 56.37 1g63 s ASP 144 Cb -1.35 -2.60 -0.07 0.00 -0.00 0.00 0.00 42.92 38.89 1g63 s ASP 144 CO 0.74 -0.85 0.03 -0.04 -0.00 0.00 0.00 175.17 175.06 1g63 s MET 145 N 0.78 1.82 0.00 8.23 -1.94 -1.26 0.76 119.30 127.69 1g63 s MET 145 Ca 0.69 -2.03 0.00 0.00 -1.71 0.00 0.00 55.69 52.64 1g63 s MET 145 Cb -0.45 -1.26 0.00 0.00 2.01 0.00 0.00 34.83 35.13 1g63 s MET 145 CO 0.35 -0.13 0.00 0.27 -0.01 0.00 0.00 175.02 175.50 1g63 n ASN 146 N -0.85 0.00 -4.73 3.03 6.94 -1.26 -4.92 115.26 113.47 1g63 n ASN 146 Ca -0.04 0.00 -0.35 0.00 -0.02 0.00 0.00 54.58 54.17 1g63 n ASN 146 Cb 0.67 0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 38.00 1g63 n ASN 146 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1g63 s ASN 158 N 0.00 5.86 -0.27 0.53 3.04 -1.26 -4.71 114.94 118.12 1g63 s ASN 158 Ca 0.00 0.23 -0.23 0.00 0.04 0.00 0.00 52.86 52.90 1g63 s ASN 158 Cb 0.00 -1.91 0.08 0.00 -1.54 0.00 0.00 41.25 37.88 1g63 s ASN 158 CO 0.00 0.29 0.76 0.54 -3.04 0.00 0.00 177.10 175.64 1g63 s ASN 159 N -0.32 -0.75 0.40 -4.21 2.20 -1.26 -4.83 114.94 106.17 1g63 s ASN 159 Ca 0.09 1.38 -0.21 0.00 -0.94 0.00 0.00 52.86 53.18 1g63 s ASN 159 Cb -0.12 1.38 -0.11 0.00 -2.00 0.00 0.00 41.25 40.41 1g63 s ASN 159 CO 0.01 -0.23 0.93 0.27 -2.94 0.00 0.00 177.10 175.14 1g63 s ILE 160 N 0.61 4.38 0.27 0.54 -5.25 -1.26 -4.43 121.20 116.06 1g63 s ILE 160 Ca -0.02 1.50 0.03 0.00 -0.99 0.00 0.00 60.65 61.18 1g63 s ILE 160 Cb -0.05 -3.67 -0.06 0.00 2.95 0.00 0.00 42.46 41.64 1g63 s ILE 160 CO -0.04 -0.23 0.03 0.42 -1.79 0.00 0.00 174.94 173.33 1g63 s THR 161 N -2.07 1.05 0.65 8.37 -4.23 0.23 -4.91 115.64 114.72 1g63 s THR 161 Ca 0.59 -2.02 -0.18 0.00 -1.18 0.00 0.00 61.69 58.91 1g63 s THR 161 Cb -0.11 -2.56 -0.01 0.00 1.34 0.00 0.00 72.50 71.16 1g63 s THR 161 CO 0.15 -0.15 1.24 -0.04 -0.54 0.00 0.00 174.62 175.27 1g63 s MET 162 N -3.89 2.63 -0.05 3.99 -1.94 -1.26 -4.02 119.30 114.75 1g63 s MET 162 Ca 0.33 1.89 -0.30 0.00 -1.71 0.00 0.00 55.69 55.90 1g63 s MET 162 Cb 0.07 -1.88 -0.07 0.00 2.01 0.00 0.00 34.83 34.96 1g63 s MET 162 CO 0.12 -1.49 1.91 -2.14 -0.01 0.00 0.00 175.02 173.41 1g63 s PRO 163 N -3.49 3.96 0.33 2.03 0.02 -1.26 -4.89 135.00 131.69 1g63 s PRO 163 Ca 0.78 2.35 -0.29 0.00 0.02 0.00 0.00 61.00 63.86 1g63 s PRO 163 Cb -0.32 -4.15 -0.12 0.00 0.02 0.00 0.00 34.50 29.93 1g63 s PRO 163 CO 0.38 -1.15 1.42 -1.71 -0.33 0.00 0.00 177.00 175.61 1g63 n ASN 164 N 8.19 3.24 0.17 2.53 2.85 -1.26 -4.79 115.26 126.19 1g63 n ASN 164 Ca 0.21 1.19 0.06 0.00 -0.11 0.00 0.00 54.58 55.93 1g63 n ASN 164 Cb 0.42 -1.53 0.53 0.00 1.24 0.00 0.00 39.78 40.44 1g63 n ASN 164 CO 0.00 0.00 0.00 -0.29 -2.11 0.00 0.00 177.26 174.86 1g63 h ILE 165 N 2.87 1.07 0.00 -1.44 -0.00 -2.00 -0.82 117.51 117.18 1g63 h ILE 165 Ca -0.47 -0.23 -0.07 0.00 -0.00 0.00 0.00 64.86 64.09 1g63 h ILE 165 Cb 1.26 0.94 -0.01 0.00 -0.00 0.00 0.00 36.82 39.01 1g63 h ILE 165 CO 0.68 0.08 -0.32 1.05 -0.00 0.00 0.00 178.15 179.63 1g63 h GLU 166 N 0.17 0.00 0.01 2.19 4.11 -1.99 -2.62 114.58 116.45 1g63 h GLU 166 Ca 0.04 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 59.32 1g63 h GLU 166 Cb 0.07 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.34 1g63 h GLU 166 CO -0.00 0.32 -0.61 -0.91 0.07 0.00 0.00 179.01 177.88 1g63 h ASN 167 N 0.00 0.52 -0.49 3.06 -0.26 -1.54 -2.04 115.58 114.82 1g63 h ASN 167 Ca -0.00 -0.78 -0.02 0.00 -0.56 0.00 0.00 56.30 54.94 1g63 h ASN 167 Cb 1.03 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 38.11 1g63 h ASN 167 CO 0.04 1.23 0.24 1.62 -1.06 0.00 0.00 177.43 179.50 1g63 h VAL 168 N -0.14 1.19 -0.45 2.81 3.04 -1.35 0.38 116.25 121.73 1g63 h VAL 168 Ca -0.08 -0.53 0.07 0.00 -1.01 0.00 0.00 66.70 65.15 1g63 h VAL 168 Cb 1.33 0.63 -0.06 0.00 -2.01 0.00 0.00 31.29 31.19 1g63 h VAL 168 CO 0.12 0.21 0.12 0.25 -1.01 0.00 0.00 177.57 177.26 1g63 h LEU 169 N 0.65 0.08 -0.48 3.16 5.85 -1.52 -0.18 115.31 122.87 1g63 h LEU 169 Ca 0.17 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.92 1g63 h LEU 169 Cb 0.11 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1g63 h LEU 169 CO -0.02 0.07 0.17 0.78 -0.34 0.00 0.00 178.44 179.10 1g63 h ASN 170 N 0.27 0.68 -0.51 1.25 -0.26 -0.91 -1.36 115.58 114.74 1g63 h ASN 170 Ca 0.22 -0.19 -0.05 0.00 -0.56 0.00 0.00 56.30 55.72 1g63 h ASN 170 Cb 0.26 -0.18 -0.03 0.00 -1.06 0.00 0.00 38.32 37.31 1g63 h ASN 170 CO -0.26 0.69 0.16 0.15 -1.06 0.00 0.00 177.43 177.11 1g63 h PHE 171 N 0.64 0.86 0.02 1.19 3.57 -0.27 -1.70 116.94 121.24 1g63 h PHE 171 Ca 0.16 -0.07 -0.00 0.00 3.53 0.00 0.00 57.97 61.59 1g63 h PHE 171 Cb 0.24 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.72 1g63 h PHE 171 CO 0.01 0.71 -0.01 0.28 -2.23 0.00 0.00 178.31 177.07 1g63 h VAL 172 N 0.82 1.47 0.19 1.41 2.07 -0.95 -3.40 116.25 117.86 1g63 h VAL 172 Ca 0.18 -1.93 -0.01 0.00 0.82 0.00 0.00 66.70 65.76 1g63 h VAL 172 Cb 0.26 2.70 0.00 0.00 -1.52 0.00 0.00 31.29 32.73 1g63 h VAL 172 CO -0.01 0.47 -0.09 -0.07 0.02 0.00 0.00 177.57 177.89 1g63 h LEU 173 N -0.92 -0.22 0.00 2.57 -0.00 -1.32 -3.52 115.31 111.91 1g63 h LEU 173 Ca -0.00 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.89 1g63 h LEU 173 Cb 0.78 0.06 0.00 0.00 -0.00 0.00 0.00 40.66 41.50 1g63 h LEU 173 CO 0.00 0.07 0.00 -3.20 -0.00 0.00 0.00 178.44 175.32