#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 -0.31 -4.78 117.16 118.12 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 1.37 2.41 3.70 2.72 0.00 -1.26 -4.90 105.19 109.22 1g63 n GLY 3 Ca 0.11 -2.11 -0.43 0.00 0.00 0.00 0.00 46.02 43.59 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 -0.47 2.61 -5.12 1.61 5.02 -1.26 -3.29 118.16 117.26 1g63 n LYS 4 Ca 0.00 0.94 -0.30 0.00 -2.02 0.00 0.00 58.31 56.93 1g63 n LYS 4 Cb 0.00 -2.78 -0.16 0.00 -0.02 0.00 0.00 35.03 32.07 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 1.31 2.02 -0.12 -0.35 0.20 0.09 -0.94 118.68 120.89 1g63 s LEU 5 Ca 0.77 -0.48 -0.01 0.00 0.69 0.00 0.00 54.13 55.11 1g63 s LEU 5 Cb -0.55 -1.26 -0.02 0.00 -0.43 0.00 0.00 46.19 43.93 1g63 s LEU 5 CO 0.34 0.19 -0.09 -0.22 -0.29 0.00 0.00 176.35 176.29 1g63 s LEU 6 N 0.04 3.00 -0.21 -0.68 2.96 -0.04 -0.98 118.68 122.77 1g63 s LEU 6 Ca -0.08 -0.19 -0.07 0.00 -0.22 0.00 0.00 54.13 53.58 1g63 s LEU 6 Cb -0.14 -1.68 -0.03 0.00 0.50 0.00 0.00 46.19 44.83 1g63 s LEU 6 CO 0.04 0.22 0.05 -0.63 -1.32 0.00 0.00 176.35 174.71 1g63 s ILE 7 N 0.05 4.42 -0.42 6.68 1.01 0.01 -0.57 121.20 132.39 1g63 s ILE 7 Ca -0.02 -0.15 -0.09 0.00 0.00 0.00 0.00 60.65 60.39 1g63 s ILE 7 Cb -0.14 -3.02 0.08 0.00 0.01 0.00 0.00 42.46 39.39 1g63 s ILE 7 CO 0.04 0.40 0.25 0.00 0.00 0.00 0.00 174.94 175.63 1g63 s ALA 9 N 1.41 3.68 0.43 0.00 0.00 -0.30 -1.20 121.76 125.78 1g63 s ALA 9 Ca 0.03 -0.40 0.06 0.00 0.00 0.00 0.00 51.96 51.66 1g63 s ALA 9 Cb -0.23 -2.32 -0.05 0.00 0.00 0.00 0.00 23.12 20.52 1g63 s ALA 9 CO 0.02 0.32 0.14 0.95 0.00 0.00 0.00 175.76 177.19 1g63 s THR 10 N -0.33 2.07 -0.37 0.00 -4.23 -1.05 -1.59 115.64 110.14 1g63 s THR 10 Ca 0.19 -1.78 -0.03 0.00 -1.18 0.00 0.00 61.69 58.89 1g63 s THR 10 Cb -0.14 -2.86 -0.04 0.00 1.34 0.00 0.00 72.50 70.80 1g63 s THR 10 CO 0.07 0.00 1.57 0.00 -0.54 0.00 0.00 174.62 175.73 1g63 n ALA 11 N -1.21 2.95 -2.81 3.99 0.00 -1.26 -4.67 120.51 117.49 1g63 n ALA 11 Ca -0.04 -0.95 -0.32 0.00 0.00 0.00 0.00 53.44 52.13 1g63 n ALA 11 Cb 0.65 -2.64 -0.06 0.00 0.00 0.00 0.00 19.45 17.40 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 3.74 5.80 0.45 0.00 0.15 -1.26 -4.93 113.70 117.65 1g63 s SER 12 Ca 0.21 0.15 0.20 0.00 0.70 0.00 0.00 55.95 57.21 1g63 s SER 12 Cb 0.07 -1.68 1.17 0.00 -1.71 0.00 0.00 66.02 63.86 1g63 s SER 12 CO -0.01 0.24 1.91 -0.29 1.20 0.00 0.00 173.24 176.28 1g63 h ILE 13 N 2.91 0.72 0.00 6.45 6.09 -1.92 -0.46 117.51 131.30 1g63 h ILE 13 Ca -0.48 -0.10 0.00 0.00 -1.37 0.00 0.00 64.86 62.91 1g63 h ILE 13 Cb 1.18 0.40 0.00 0.00 0.47 0.00 0.00 36.82 38.86 1g63 h ILE 13 CO 0.65 0.05 0.00 0.59 -3.07 0.00 0.00 178.15 176.38 1g63 n ASN 14 N -4.45 0.00 0.20 2.19 4.13 -1.26 -2.86 115.26 113.21 1g63 n ASN 14 Ca 0.16 -0.73 0.15 0.00 1.68 0.00 0.00 54.58 55.83 1g63 n ASN 14 Cb 0.64 -0.00 0.66 0.00 -1.54 0.00 0.00 39.78 39.54 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 -1.34 -1.13 116.25 119.23 1g63 h VAL 15 Ca 0.00 -0.23 0.00 0.00 -1.01 0.00 0.00 66.70 65.46 1g63 h VAL 15 Cb 0.00 1.02 0.00 0.00 -2.01 0.00 0.00 31.29 30.30 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 -2.58 0.83 -0.20 3.17 -5.35 -1.14 -2.25 119.36 111.85 1g63 n ILE 16 Ca 0.00 0.19 0.05 0.00 -0.27 0.00 0.00 62.75 62.72 1g63 n ILE 16 Cb 0.19 -1.02 0.14 0.00 -1.74 0.00 0.00 39.64 37.21 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 -1.90 2.83 0.27 7.28 5.03 -0.43 -4.67 115.26 123.67 1g63 n ASN 17 Ca 0.03 -2.06 0.14 0.00 0.87 0.00 0.00 54.58 53.57 1g63 n ASN 17 Cb 0.23 -0.21 0.84 0.00 -1.02 0.00 0.00 39.78 39.61 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 1.71 0.63 -0.23 2.41 6.09 -1.48 -2.09 117.51 124.54 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 0.73 0.96 -0.01 0.00 0.47 0.00 0.00 36.82 38.98 1g63 h ILE 18 CO 0.01 0.00 0.11 -0.55 -3.07 0.00 0.00 178.15 174.66 1g63 h ASN 19 N 0.00 0.28 -0.63 2.19 -1.07 -1.83 -2.33 115.58 112.19 1g63 h ASN 19 Ca 0.02 -0.02 -0.06 0.00 0.07 0.00 0.00 56.30 56.32 1g63 h ASN 19 Cb 0.11 -0.07 -0.03 0.00 -2.07 0.00 0.00 38.32 36.27 1g63 h ASN 19 CO -0.00 0.24 0.18 0.45 0.07 0.00 0.00 177.43 178.37 1g63 h HIS 20 N 0.32 1.04 -0.64 4.14 3.86 -1.75 -2.80 115.15 119.32 1g63 h HIS 20 Ca 0.08 -0.11 -0.08 0.00 -1.16 0.00 0.00 60.37 59.10 1g63 h HIS 20 Cb 0.03 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.18 1g63 h HIS 20 CO 0.00 0.86 0.10 1.88 0.86 0.00 0.00 177.93 181.63 1g63 h TYR 21 N 0.92 1.14 0.57 2.45 -1.99 -1.55 -2.96 116.97 115.54 1g63 h TYR 21 Ca 0.20 -0.16 -0.02 0.00 2.00 0.00 0.00 58.73 60.75 1g63 h TYR 21 Cb 0.32 -0.31 -0.02 0.00 2.00 0.00 0.00 36.73 38.72 1g63 h TYR 21 CO 0.02 0.96 -0.50 0.82 -0.00 0.00 0.00 178.16 179.47 1g63 h ILE 22 N 0.98 0.00 -0.81 -2.88 2.04 -1.23 0.20 117.51 115.82 1g63 h ILE 22 Ca 0.19 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.15 1g63 h ILE 22 Cb 0.44 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.47 1g63 h ILE 22 CO 0.01 0.00 0.53 1.62 0.00 0.00 0.00 178.15 180.31 1g63 h VAL 23 N -1.05 0.95 -0.01 1.67 3.04 -1.58 0.61 116.25 119.88 1g63 h VAL 23 Ca -0.07 -0.26 -0.00 0.00 -1.01 0.00 0.00 66.70 65.36 1g63 h VAL 23 Cb 0.89 0.14 -0.00 0.00 -2.01 0.00 0.00 31.29 30.31 1g63 h VAL 23 CO -0.02 0.14 -0.00 -0.08 -1.01 0.00 0.00 177.57 176.59 1g63 h GLU 24 N 0.74 0.02 0.00 4.17 4.57 -1.30 -3.13 114.58 119.66 1g63 h GLU 24 Ca 0.37 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.52 1g63 h GLU 24 Cb 0.45 -0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.04 1g63 h GLU 24 CO -0.15 0.39 -0.13 -0.07 -1.18 0.00 0.00 179.01 177.88 1g63 h LEU 25 N -0.35 0.00 -1.24 1.64 3.38 -0.03 -2.82 115.31 115.88 1g63 h LEU 25 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 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 0.00 178.44 178.95 1g63 n LYS 26 N -3.40 0.14 0.04 1.13 4.76 0.15 -1.53 118.16 119.46 1g63 n LYS 26 Ca -0.01 0.59 0.12 0.00 -2.87 0.00 0.00 58.31 56.15 1g63 n LYS 26 Cb 0.31 -1.92 0.17 0.00 -1.84 0.00 0.00 35.03 31.75 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 -2.21 0.23 -0.00 1.97 6.02 -1.06 -4.28 117.38 118.04 1g63 n GLN 27 Ca -0.01 0.06 0.03 0.00 -0.01 0.00 0.00 57.00 57.07 1g63 n GLN 27 Cb 0.07 -1.64 -0.04 0.00 1.02 0.00 0.00 30.24 29.65 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 -1.97 0.00 -5.16 1.08 8.25 -0.58 -4.91 115.22 111.94 1g63 n HIS 28 Ca 0.04 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.20 1g63 n HIS 28 Cb 0.42 -0.11 -0.16 0.00 1.12 0.00 0.00 29.99 31.26 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 -2.24 2.15 0.29 4.41 0.40 -0.94 -1.16 117.98 120.90 1g63 s PHE 29 Ca -0.01 -0.50 0.01 0.00 -0.60 0.00 0.00 56.93 55.83 1g63 s PHE 29 Cb 0.04 -1.40 0.70 0.00 0.51 0.00 0.00 43.02 42.88 1g63 s PHE 29 CO 0.25 -0.10 1.61 -0.44 0.70 0.00 0.00 175.22 177.24 1g63 h ASP 30 N 5.78 -0.28 -5.02 1.36 3.45 -1.86 -3.41 116.42 116.44 1g63 h ASP 30 Ca -0.38 0.24 -0.15 0.00 0.43 0.00 0.00 57.03 57.17 1g63 h ASP 30 Cb 1.15 0.39 -0.20 0.00 -0.56 0.00 0.00 39.33 40.10 1g63 h ASP 30 CO 0.47 -0.26 -0.58 -1.61 -1.57 0.00 0.00 179.24 175.69 1g63 s GLU 31 N -5.99 0.45 -0.22 3.56 2.02 -1.26 -4.95 118.70 112.31 1g63 s GLU 31 Ca -0.13 -0.60 -0.04 0.00 0.02 0.00 0.00 54.97 54.23 1g63 s GLU 31 Cb 0.27 0.18 0.07 0.00 0.10 0.00 0.00 34.13 34.75 1g63 s GLU 31 CO 0.77 -0.10 0.09 0.54 0.02 0.00 0.00 175.26 176.58 1g63 s VAL 32 N -1.82 0.13 0.38 2.63 0.11 -1.25 -0.73 120.40 119.85 1g63 s VAL 32 Ca -0.12 -0.51 0.08 0.00 -2.93 0.00 0.00 61.98 58.50 1g63 s VAL 32 Cb -0.06 -0.87 -0.02 0.00 -1.53 0.00 0.00 36.38 33.89 1g63 s VAL 32 CO -0.01 -0.42 0.34 0.20 -3.33 0.00 0.00 175.10 171.88 1g63 s ASN 33 N 2.03 5.15 0.02 3.54 0.02 -0.15 -2.45 114.94 123.11 1g63 s ASN 33 Ca 0.04 -0.63 0.00 0.00 -1.02 0.00 0.00 52.86 51.24 1g63 s ASN 33 Cb -0.16 -0.74 -0.02 0.00 0.02 0.00 0.00 41.25 40.34 1g63 s ASN 33 CO -0.18 -0.52 -0.03 -0.51 0.02 0.00 0.00 177.10 175.88 1g63 s ILE 34 N -2.40 0.13 -0.04 0.60 2.07 -0.57 -0.81 121.20 120.18 1g63 s ILE 34 Ca 0.45 -0.96 -0.01 0.00 -1.41 0.00 0.00 60.65 58.71 1g63 s ILE 34 Cb -0.04 -0.34 0.03 0.00 0.13 0.00 0.00 42.46 42.24 1g63 s ILE 34 CO 0.27 -0.52 0.07 -0.22 -1.91 0.00 0.00 174.94 172.63 1g63 s LEU 35 N -1.54 0.91 0.22 8.50 0.20 0.02 -1.35 118.68 125.63 1g63 s LEU 35 Ca -0.15 0.13 0.07 0.00 0.69 0.00 0.00 54.13 54.88 1g63 s LEU 35 Cb -0.09 0.07 -0.04 0.00 -0.43 0.00 0.00 46.19 45.70 1g63 s LEU 35 CO -0.01 -0.14 0.09 -0.36 -0.29 0.00 0.00 176.35 175.64 1g63 s PHE 36 N 1.17 2.96 0.29 5.38 0.40 -1.26 -1.15 117.98 125.76 1g63 s PHE 36 Ca -0.08 -0.13 -0.16 0.00 -0.60 0.00 0.00 56.93 55.96 1g63 s PHE 36 Cb -0.13 -1.37 -0.09 0.00 0.51 0.00 0.00 43.02 41.95 1g63 s PHE 36 CO -0.04 0.54 0.72 -1.54 0.70 0.00 0.00 175.22 175.60 1g63 s SER 37 N -3.46 6.83 0.26 1.36 1.04 -0.62 -4.65 113.70 114.46 1g63 s SER 37 Ca 0.31 1.28 -0.03 0.00 0.48 0.00 0.00 55.95 57.99 1g63 s SER 37 Cb -0.08 -2.37 0.54 0.00 0.10 0.00 0.00 66.02 64.20 1g63 s SER 37 CO 0.22 -0.14 1.66 -0.65 0.98 0.00 0.00 173.24 175.31 1g63 h PRO 38 N 2.57 0.20 0.00 4.02 0.11 -2.00 -1.13 132.00 135.78 1g63 h PRO 38 Ca -0.48 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.57 1g63 h PRO 38 Cb 1.18 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1g63 h PRO 38 CO 0.66 0.13 -0.24 0.77 -0.21 0.00 0.00 178.00 179.11 1g63 h SER 39 N 0.21 0.00 0.61 -2.05 0.02 -1.97 -2.61 113.55 107.76 1g63 h SER 39 Ca 0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.41 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 -0.60 0.24 0.00 0.77 -1.14 0.00 0.00 176.83 176.10 1g63 h SER 40 N 0.00 0.00 0.39 3.07 4.64 -1.51 -2.19 113.55 117.96 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 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1g63 h SER 40 CO 0.03 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.28 1g63 n LYS 41 N -2.56 0.18 0.00 4.77 5.02 -0.98 -1.67 118.16 122.92 1g63 n LYS 41 Ca 0.01 0.15 0.13 0.00 -2.02 0.00 0.00 58.31 56.57 1g63 n LYS 41 Cb 0.20 -1.50 0.42 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 0.93 -0.07 4.39 5.03 -0.82 -4.05 115.26 119.32 1g63 n ASN 42 Ca 0.07 -0.84 -0.07 0.00 0.87 0.00 0.00 54.58 54.61 1g63 n ASN 42 Cb 0.15 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 -0.70 0.00 -4.05 3.10 3.01 -0.67 -5.06 117.46 113.09 1g63 n PHE 43 Ca 0.13 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.49 1g63 n PHE 43 Cb 0.34 -0.67 -0.07 0.00 -0.01 0.00 0.00 39.48 39.06 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 -2.33 0.02 -0.58 4.37 -4.36 -1.20 -4.90 121.20 112.23 1g63 s ILE 44 Ca -0.09 -1.60 -0.20 0.00 -0.26 0.00 0.00 60.65 58.50 1g63 s ILE 44 Cb 0.04 -2.18 0.08 0.00 1.25 0.00 0.00 42.46 41.65 1g63 s ILE 44 CO 0.54 -0.11 0.75 0.21 0.24 0.00 0.00 174.94 176.57 1g63 s ASN 45 N -3.05 6.20 0.55 4.36 3.84 -1.26 -4.64 114.94 120.94 1g63 s ASN 45 Ca 0.26 -1.13 0.24 0.00 0.21 0.00 0.00 52.86 52.43 1g63 s ASN 45 Cb 0.03 -2.33 1.53 0.00 -0.55 0.00 0.00 41.25 39.93 1g63 s ASN 45 CO 0.07 -1.13 2.18 0.71 -2.79 0.00 0.00 177.10 176.13 1g63 h THR 46 N 5.93 0.74 0.00 -5.21 1.35 -1.93 -2.65 112.91 111.13 1g63 h THR 46 Ca -0.29 -0.12 -0.01 0.00 -0.55 0.00 0.00 66.41 65.45 1g63 h THR 46 Cb 1.08 1.07 -0.00 0.00 -1.73 0.00 0.00 68.15 68.58 1g63 h THR 46 CO 1.08 0.03 -0.02 0.44 -0.25 0.00 0.00 175.52 176.80 1g63 h ASP 47 N 0.00 0.00 -0.32 5.36 3.32 -2.02 -1.75 116.42 121.01 1g63 h ASP 47 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1g63 h ASP 47 Cb 0.07 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 1g63 h ASP 47 CO 0.00 0.02 0.17 0.58 -1.72 0.00 0.00 179.24 178.30 1g63 h VAL 48 N 0.00 1.13 0.00 -1.35 2.07 -1.90 -1.54 116.25 114.66 1g63 h VAL 48 Ca -0.00 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.16 1g63 h VAL 48 Cb 0.06 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1g63 h VAL 48 CO 0.00 0.15 0.00 -0.07 0.02 0.00 0.00 177.57 177.67 1g63 h LEU 49 N 0.50 0.00 -2.28 2.57 -0.00 -1.50 -0.41 115.31 114.19 1g63 h LEU 49 Ca 0.13 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 58.00 1g63 h LEU 49 Cb 0.06 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.72 1g63 h LEU 49 CO -0.02 0.00 -0.01 0.11 -0.00 0.00 0.00 178.44 178.52 1g63 h LYS 50 N 0.00 0.00 0.00 1.13 1.57 -1.43 0.13 116.57 117.97 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 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1g63 h LYS 50 CO 0.00 0.01 -0.09 1.28 -0.57 0.00 0.00 179.45 180.08 1g63 n LEU 51 N -3.14 0.73 -0.02 2.94 4.77 -0.16 -4.17 117.00 117.95 1g63 n LEU 51 Ca -0.01 0.52 -0.02 0.00 -0.03 0.00 0.00 56.01 56.46 1g63 n LEU 51 Cb 0.18 -0.31 -0.02 0.00 -2.33 0.00 0.00 43.42 40.94 1g63 n LEU 51 CO 0.24 -0.15 -0.61 0.49 -1.33 0.00 0.00 177.39 176.03 1g63 n PHE 52 N -2.17 0.00 -2.80 -1.77 3.01 -0.64 -5.05 117.46 108.03 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 -0.14 -0.02 0.00 -0.01 0.00 0.00 39.48 39.73 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 0.90 0.92 -4.22 0.00 3.32 -1.80 -3.45 116.42 112.10 1g63 h ASP 54 Ca -0.47 -0.61 -0.15 0.00 0.02 0.00 0.00 57.03 55.81 1g63 h ASP 54 Cb 1.19 -0.27 -0.24 0.00 0.22 0.00 0.00 39.33 40.23 1g63 h ASP 54 CO 0.63 1.38 -0.41 0.20 -1.72 0.00 0.00 179.24 179.32 1g63 s ASN 55 N -7.04 -0.20 -0.19 6.45 -0.87 -1.26 -5.05 114.94 106.79 1g63 s ASN 55 Ca -0.11 0.31 0.00 0.00 -1.57 0.00 0.00 52.86 51.49 1g63 s ASN 55 Cb 0.08 0.42 0.01 0.00 -0.02 0.00 0.00 41.25 41.75 1g63 s ASN 55 CO 0.90 -0.20 -0.17 -0.22 -2.57 0.00 0.00 177.10 174.84 1g63 s LEU 56 N -0.37 2.30 -0.37 0.60 2.96 -1.26 -1.51 118.68 121.02 1g63 s LEU 56 Ca -0.05 -0.59 -0.20 0.00 -0.22 0.00 0.00 54.13 53.08 1g63 s LEU 56 Cb -0.03 -1.53 0.01 0.00 0.50 0.00 0.00 46.19 45.13 1g63 s LEU 56 CO 0.01 0.00 0.60 -0.31 -1.32 0.00 0.00 176.35 175.33 1g63 s TYR 57 N 1.29 3.14 -0.29 5.38 1.51 -0.46 -5.00 117.35 122.92 1g63 s TYR 57 Ca 0.04 0.19 0.00 0.00 -1.01 0.00 0.00 57.07 56.30 1g63 s TYR 57 Cb -0.13 -3.11 0.06 0.00 -0.11 0.00 0.00 41.96 38.66 1g63 s TYR 57 CO -0.10 -0.65 -0.03 0.34 -1.11 0.00 0.00 175.55 174.00 1g63 s ASP 58 N 1.83 4.75 0.25 2.29 3.68 -1.26 -4.36 116.67 123.85 1g63 s ASP 58 Ca 0.22 -1.39 0.24 0.00 2.13 0.00 0.00 52.55 53.75 1g63 s ASP 58 Cb -0.15 -1.66 0.95 0.00 -1.45 0.00 0.00 42.92 40.62 1g63 s ASP 58 CO 0.15 -0.26 1.72 -1.84 0.13 0.00 0.00 175.17 175.08 1g63 n GLU 59 N 4.54 0.21 0.05 4.34 0.28 -1.26 -1.52 120.64 127.27 1g63 n GLU 59 Ca -0.12 0.38 -0.22 0.00 -0.16 0.00 0.00 57.16 57.05 1g63 n GLU 59 Cb 0.43 -1.86 -0.15 0.00 1.43 0.00 0.00 31.44 31.29 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 1.21 -0.34 3.84 2.04 -1.96 -2.39 117.51 119.91 1g63 h ILE 60 Ca 0.00 -2.50 -0.09 0.00 1.00 0.00 0.00 64.86 63.27 1g63 h ILE 60 Cb 0.43 2.93 -0.02 0.00 -0.74 0.00 0.00 36.82 39.43 1g63 h ILE 60 CO 0.00 0.74 -0.16 0.50 0.00 0.00 0.00 178.15 179.23 1g63 h LYS 61 N -0.21 0.61 -2.70 2.37 3.64 -1.96 -3.38 116.57 114.95 1g63 h LYS 61 Ca -0.25 -0.21 -0.57 0.00 -1.27 0.00 0.00 60.65 58.35 1g63 h LYS 61 Cb 1.83 -0.05 -0.39 0.00 -0.41 0.00 0.00 32.23 33.20 1g63 h LYS 61 CO 0.14 0.75 -0.82 0.34 -2.27 0.00 0.00 179.45 177.59 1g63 s ASP 62 N -6.75 3.21 0.23 4.20 3.68 -0.58 -5.00 116.67 115.65 1g63 s ASP 62 Ca -0.08 -1.92 0.20 0.00 2.13 0.00 0.00 52.55 52.88 1g63 s ASP 62 Cb 0.14 -0.43 0.91 0.00 -1.45 0.00 0.00 42.92 42.09 1g63 s ASP 62 CO 0.80 -0.35 1.60 -2.65 0.13 0.00 0.00 175.17 174.70 1g63 n PRO 63 N 4.41 0.14 -1.19 4.34 -0.02 -0.90 -3.15 135.00 138.62 1g63 n PRO 63 Ca 0.06 0.48 -0.16 0.00 -2.02 0.00 0.00 63.50 61.87 1g63 n PRO 63 Cb 0.39 -1.82 0.14 0.00 -0.02 0.00 0.00 33.50 32.18 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 -2.09 5.19 -4.76 2.45 7.99 -1.26 -5.03 117.00 119.49 1g63 n LEU 64 Ca 0.01 -4.05 -0.41 0.00 -0.01 0.00 0.00 56.01 51.55 1g63 n LEU 64 Cb 0.14 -0.66 -0.02 0.00 -0.11 0.00 0.00 43.42 42.77 1g63 n LEU 64 CO 0.14 1.45 1.10 -0.22 -1.51 0.00 0.00 177.39 178.35 1g63 s LEU 65 N -3.43 4.38 -0.75 2.23 2.96 -1.19 -4.93 118.68 117.95 1g63 s LEU 65 Ca 0.51 2.76 -0.25 0.00 -0.22 0.00 0.00 54.13 56.93 1g63 s LEU 65 Cb 0.43 -3.64 0.05 0.00 0.50 0.00 0.00 46.19 43.53 1g63 s LEU 65 CO 0.01 -0.72 1.20 0.21 -1.32 0.00 0.00 176.35 175.73 1g63 s ASN 66 N 0.12 6.21 0.48 3.68 3.84 -1.26 -4.89 114.94 123.12 1g63 s ASN 66 Ca 0.57 -0.75 0.15 0.00 0.21 0.00 0.00 52.86 53.04 1g63 s ASN 66 Cb -0.43 -2.51 1.13 0.00 -0.55 0.00 0.00 41.25 38.89 1g63 s ASN 66 CO 0.49 -1.67 2.06 1.12 -2.79 0.00 0.00 177.10 176.31 1g63 h HIS 67 N 9.83 0.00 -0.24 0.43 2.07 -1.97 -2.01 115.15 123.26 1g63 h HIS 67 Ca -0.23 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.26 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 1.10 0.10 0.03 0.82 -3.07 0.00 0.00 177.93 176.91 1g63 h ILE 68 N 0.00 1.23 -0.73 6.12 2.04 -1.96 -1.63 117.51 122.59 1g63 h ILE 68 Ca -0.00 -0.79 -0.05 0.00 1.00 0.00 0.00 64.86 65.01 1g63 h ILE 68 Cb 0.19 1.29 -0.03 0.00 -0.74 0.00 0.00 36.82 37.53 1g63 h ILE 68 CO 0.01 0.25 0.24 0.78 0.00 0.00 0.00 178.15 179.43 1g63 h ASN 69 N 0.20 1.04 -0.60 1.72 -0.26 -1.89 -1.04 115.58 114.75 1g63 h ASN 69 Ca 0.07 -0.19 0.03 0.00 -0.56 0.00 0.00 56.30 55.66 1g63 h ASN 69 Cb 0.34 -0.27 -0.04 0.00 -1.06 0.00 0.00 38.32 37.29 1g63 h ASN 69 CO 0.01 0.96 0.36 0.40 -1.06 0.00 0.00 177.43 178.09 1g63 h ILE 70 N 1.07 1.04 -0.45 2.81 2.04 -1.16 0.32 117.51 123.20 1g63 h ILE 70 Ca 0.24 -0.24 -0.09 0.00 1.00 0.00 0.00 64.86 65.77 1g63 h ILE 70 Cb 0.28 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1g63 h ILE 70 CO -0.01 0.13 -0.06 0.58 0.00 0.00 0.00 178.15 178.79 1g63 h VAL 71 N 0.69 1.27 0.00 1.67 2.07 -0.85 -2.95 116.25 118.15 1g63 h VAL 71 Ca 0.25 -1.15 -0.06 0.00 0.82 0.00 0.00 66.70 66.56 1g63 h VAL 71 Cb 0.06 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1g63 h VAL 71 CO -0.12 0.39 -0.28 -0.33 0.02 0.00 0.00 177.57 177.25 1g63 h GLU 72 N 0.67 0.00 0.00 1.57 5.08 -0.82 -2.71 114.58 118.37 1g63 h GLU 72 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1g63 h GLU 72 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1g63 h GLU 72 CO 0.03 0.28 0.00 -1.71 -1.00 0.00 0.00 179.01 176.61 1g63 n ASN 73 N -3.71 0.00 -4.18 1.42 4.05 0.07 -4.81 115.26 108.09 1g63 n ASN 73 Ca -0.01 -0.21 -0.21 0.00 0.45 0.00 0.00 54.58 54.60 1g63 n ASN 73 Cb 0.39 -0.24 -0.13 0.00 1.23 0.00 0.00 39.78 41.03 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 -2.47 1.38 -0.11 1.20 3.76 -1.02 -4.70 115.29 113.31 1g63 s HIS 74 Ca 0.27 -0.39 0.16 0.00 -0.15 0.00 0.00 55.06 54.96 1g63 s HIS 74 Cb 0.18 -0.80 -0.22 0.00 1.11 0.00 0.00 32.58 32.85 1g63 s HIS 74 CO 0.38 0.07 0.50 0.39 -0.85 0.00 0.00 174.74 175.23 1g63 n GLU 75 N 1.66 0.65 -4.46 1.40 1.02 -0.11 -4.91 120.64 115.89 1g63 n GLU 75 Ca -0.19 0.14 -0.20 0.00 -0.02 0.00 0.00 57.16 56.89 1g63 n GLU 75 Cb 0.54 -1.69 -0.15 0.00 -0.02 0.00 0.00 31.44 30.12 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 -2.71 1.01 -0.19 -0.32 1.51 -1.15 -4.85 117.35 110.65 1g63 s TYR 76 Ca -0.06 -0.22 -0.00 0.00 -1.01 0.00 0.00 57.07 55.77 1g63 s TYR 76 Cb 0.08 -0.68 0.05 0.00 -0.11 0.00 0.00 41.96 41.30 1g63 s TYR 76 CO 0.83 -0.06 -0.05 0.42 -1.11 0.00 0.00 175.55 175.58 1g63 s ILE 77 N -0.06 1.22 -0.09 2.71 1.01 -0.34 -0.86 121.20 124.80 1g63 s ILE 77 Ca 0.01 -0.83 -0.01 0.00 0.00 0.00 0.00 60.65 59.81 1g63 s ILE 77 Cb -0.06 -1.45 -0.03 0.00 0.01 0.00 0.00 42.46 40.92 1g63 s ILE 77 CO 0.00 0.03 -0.02 -0.76 0.00 0.00 0.00 174.94 174.18 1g63 s LEU 78 N 1.56 3.42 -0.45 2.97 1.02 0.26 -0.41 118.68 127.05 1g63 s LEU 78 Ca -0.02 0.06 -0.08 0.00 0.02 0.00 0.00 54.13 54.12 1g63 s LEU 78 Cb -0.17 -1.78 0.11 0.00 0.02 0.00 0.00 46.19 44.38 1g63 s LEU 78 CO -0.07 0.35 0.30 0.54 0.02 0.00 0.00 176.35 177.49 1g63 s VAL 79 N -0.72 4.00 -0.12 -1.59 0.11 -0.14 0.11 120.40 122.04 1g63 s VAL 79 Ca 0.11 -1.80 -0.04 0.00 -2.93 0.00 0.00 61.98 57.33 1g63 s VAL 79 Cb -0.11 -3.63 0.06 0.00 -1.53 0.00 0.00 36.38 31.17 1g63 s VAL 79 CO 0.02 -0.72 0.18 -0.22 -3.33 0.00 0.00 175.10 171.03 1g63 s LEU 80 N 1.32 -0.06 0.57 2.54 2.96 -0.34 -2.01 118.68 123.65 1g63 s LEU 80 Ca 0.06 0.13 -0.15 0.00 -0.22 0.00 0.00 54.13 53.95 1g63 s LEU 80 Cb -0.25 0.28 -0.06 0.00 0.50 0.00 0.00 46.19 46.67 1g63 s LEU 80 CO -0.01 -0.27 1.01 -2.84 -1.32 0.00 0.00 176.35 172.92 1g63 s PRO 81 N 2.30 3.69 -0.24 0.98 0.02 -1.26 -4.11 135.00 136.37 1g63 s PRO 81 Ca 0.04 0.95 -0.05 0.00 0.02 0.00 0.00 61.00 61.96 1g63 s PRO 81 Cb -0.13 -2.09 -0.01 0.00 0.02 0.00 0.00 34.50 32.28 1g63 s PRO 81 CO -0.08 -0.49 0.02 0.00 -0.33 0.00 0.00 177.00 176.11 1g63 s ALA 82 N -2.75 2.98 0.60 -1.55 0.00 -0.39 -2.54 121.76 118.11 1g63 s ALA 82 Ca 0.59 -1.21 -0.12 0.00 0.00 0.00 0.00 51.96 51.22 1g63 s ALA 82 Cb -0.12 -1.91 -0.05 0.00 0.00 0.00 0.00 23.12 21.05 1g63 s ALA 82 CO 0.39 -0.54 1.02 -1.54 0.00 0.00 0.00 175.76 175.09 1g63 s SER 83 N 1.53 6.29 0.19 0.00 1.04 -1.26 -1.25 113.70 120.24 1g63 s SER 83 Ca 0.05 1.43 -0.12 0.00 0.48 0.00 0.00 55.95 57.80 1g63 s SER 83 Cb -0.15 -2.47 0.13 0.00 0.10 0.00 0.00 66.02 63.62 1g63 s SER 83 CO 0.00 -0.82 1.86 0.00 0.98 0.00 0.00 173.24 175.25 1g63 h ALA 84 N -0.12 0.82 -0.15 5.32 0.00 -1.98 -1.59 119.26 121.56 1g63 h ALA 84 Ca -0.44 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.47 1g63 h ALA 84 Cb 1.19 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.68 1g63 h ALA 84 CO 0.62 0.22 -0.16 -0.97 0.00 0.00 0.00 179.25 178.96 1g63 h ASN 85 N 0.85 -0.50 -0.40 0.00 -0.73 -1.98 -0.69 115.58 112.13 1g63 h ASN 85 Ca 0.24 0.09 -0.12 0.00 1.87 0.00 0.00 56.30 58.39 1g63 h ASN 85 Cb -0.07 0.24 -0.02 0.00 0.27 0.00 0.00 38.32 38.75 1g63 h ASN 85 CO -0.06 -0.21 -0.18 0.74 -0.37 0.00 0.00 177.43 177.35 1g63 h THR 86 N -0.19 1.27 -0.06 -3.57 2.02 -1.90 -1.12 112.91 109.36 1g63 h THR 86 Ca 0.10 -1.32 0.02 0.00 0.77 0.00 0.00 66.41 65.99 1g63 h THR 86 Cb 0.34 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 1g63 h THR 86 CO -0.26 0.45 -0.08 0.40 0.37 0.00 0.00 175.52 176.40 1g63 h ILE 87 N 0.78 0.77 -0.14 3.11 2.04 -0.97 0.52 117.51 123.62 1g63 h ILE 87 Ca 0.11 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.92 1g63 h ILE 87 Cb 0.72 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 1g63 h ILE 87 CO 0.06 0.00 -0.13 0.78 0.00 0.00 0.00 178.15 178.85 1g63 h ASN 88 N -0.12 0.20 -0.09 1.72 -0.26 -0.96 -0.90 115.58 115.18 1g63 h ASN 88 Ca 0.05 -0.04 -0.03 0.00 -0.56 0.00 0.00 56.30 55.72 1g63 h ASN 88 Cb 0.19 -0.05 -0.00 0.00 -1.06 0.00 0.00 38.32 37.39 1g63 h ASN 88 CO -0.13 0.36 -0.07 0.11 -1.06 0.00 0.00 177.43 176.64 1g63 h LYS 89 N 0.21 0.21 -0.56 0.81 1.57 -0.56 -2.59 116.57 115.66 1g63 h LYS 89 Ca 0.04 -0.10 0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1g63 h LYS 89 Cb 0.37 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.64 1g63 h LYS 89 CO 0.02 0.61 0.33 0.82 -0.57 0.00 0.00 179.45 180.67 1g63 h ILE 90 N -0.19 1.05 -0.45 1.86 2.04 -0.62 0.73 117.51 121.93 1g63 h ILE 90 Ca 0.02 -0.23 0.07 0.00 1.00 0.00 0.00 64.86 65.72 1g63 h ILE 90 Cb 0.57 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 1g63 h ILE 90 CO 0.02 0.12 0.30 0.00 0.00 0.00 0.00 178.15 178.59 1g63 h ALA 91 N 1.26 1.99 -0.61 1.87 0.00 -1.13 -1.54 119.26 121.09 1g63 h ALA 91 Ca 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1g63 h ALA 91 Cb 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1g63 h ALA 91 CO -0.11 -0.08 0.00 0.09 0.00 0.00 0.00 179.25 179.15 1g63 n ASN 92 N -4.47 3.77 -0.23 0.00 4.13 -0.57 -4.95 115.26 112.93 1g63 n ASN 92 Ca 0.06 -2.00 -0.03 0.00 1.68 0.00 0.00 54.58 54.29 1g63 n ASN 92 Cb 0.28 -0.41 -0.01 0.00 -1.54 0.00 0.00 39.78 38.10 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 1.61 0.56 3.67 7.41 0.00 -0.29 -4.98 105.19 113.17 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 -1.86 4.53 -0.51 -0.61 1.01 0.09 -4.95 121.20 118.90 1g63 s ILE 94 Ca 0.00 1.84 0.06 0.00 0.00 0.00 0.00 60.65 62.55 1g63 s ILE 94 Cb 0.00 -4.18 0.23 0.00 0.01 0.00 0.00 42.46 38.52 1g63 s ILE 94 CO 0.00 -0.13 0.57 0.00 0.00 0.00 0.00 174.94 175.38 1g63 n ASP 96 N 1.47 2.56 -4.00 0.00 5.68 -1.26 -4.54 116.55 116.45 1g63 n ASP 96 Ca 0.25 -1.96 -0.10 0.00 -0.50 0.00 0.00 54.79 52.49 1g63 n ASP 96 Cb 0.46 -0.29 -0.07 0.00 -1.14 0.00 0.00 41.12 40.09 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 -1.13 0.02 0.13 -1.12 2.20 -1.26 -5.05 114.94 108.73 1g63 s ASN 97 Ca 0.33 -0.96 -0.20 0.00 -0.94 0.00 0.00 52.86 51.10 1g63 s ASN 97 Cb 0.18 0.47 -0.03 0.00 -2.00 0.00 0.00 41.25 39.86 1g63 s ASN 97 CO 0.24 -0.95 1.72 0.25 -2.94 0.00 0.00 177.10 175.42 1g63 h LEU 98 N 2.48 -0.07 -0.18 3.54 5.85 -1.92 -0.34 115.31 124.67 1g63 h LEU 98 Ca -0.31 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.50 1g63 h LEU 98 Cb 1.24 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 42.29 1g63 h LEU 98 CO 0.46 -0.01 -0.16 0.25 -0.34 0.00 0.00 178.44 178.63 1g63 h LEU 99 N 0.07 -0.52 -1.40 2.25 6.46 -1.94 0.19 115.31 120.42 1g63 h LEU 99 Ca 0.09 0.10 -0.06 0.00 -0.12 0.00 0.00 57.88 57.89 1g63 h LEU 99 Cb 0.11 0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 40.29 1g63 h LEU 99 CO -0.16 -0.21 -0.30 0.00 -0.62 0.00 0.00 178.44 177.16 1g63 h THR 100 N -0.18 1.10 -0.04 1.05 1.03 -1.88 -1.29 112.91 112.70 1g63 h THR 100 Ca 0.11 -1.06 -0.21 0.00 -0.01 0.00 0.00 66.41 65.25 1g63 h THR 100 Cb 0.35 1.59 -0.00 0.00 -1.07 0.00 0.00 68.15 69.01 1g63 h THR 100 CO -0.29 0.29 -0.84 0.74 -0.01 0.00 0.00 175.52 175.42 1g63 h THR 101 N 0.00 1.39 -0.52 0.00 2.02 0.03 -2.67 112.91 113.15 1g63 h THR 101 Ca -0.00 -2.30 -0.09 0.00 0.77 0.00 0.00 66.41 64.79 1g63 h THR 101 Cb 0.56 2.26 -0.02 0.00 -1.74 0.00 0.00 68.15 69.22 1g63 h THR 101 CO 0.04 0.69 -0.05 0.58 0.37 0.00 0.00 175.52 177.15 1g63 h VAL 102 N 0.26 1.26 -0.03 3.16 2.07 -0.14 -2.50 116.25 120.34 1g63 h VAL 102 Ca -0.06 -1.14 -0.09 0.00 0.82 0.00 0.00 66.70 66.23 1g63 h VAL 102 Cb 1.45 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 1g63 h VAL 102 CO 0.15 0.40 -0.42 0.00 0.02 0.00 0.00 177.57 177.71 1g63 h LEU 104 N 0.05 0.13 -0.94 0.00 5.85 -1.28 -2.88 115.31 116.24 1g63 h LEU 104 Ca 0.00 -0.53 -0.02 0.00 0.84 0.00 0.00 57.88 58.17 1g63 h LEU 104 Cb 0.77 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.72 1g63 h LEU 104 CO 0.06 0.63 0.47 0.74 -0.34 0.00 0.00 178.44 180.00 1g63 h THR 105 N -0.37 1.25 -0.91 1.05 2.02 -1.35 -3.18 112.91 111.42 1g63 h THR 105 Ca 0.00 -0.64 -0.62 0.00 0.77 0.00 0.00 66.41 65.92 1g63 h THR 105 Cb 0.61 0.08 -0.33 0.00 -1.74 0.00 0.00 68.15 66.77 1g63 h THR 105 CO 0.01 0.29 0.34 0.61 0.37 0.00 0.00 175.52 177.14 1g63 n GLY 106 N -1.13 5.97 0.34 2.16 0.00 -0.36 -4.72 105.19 107.45 1g63 n GLY 106 Ca 0.09 -2.35 0.17 0.00 0.00 0.00 0.00 46.02 43.93 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 2.00 0.00 0.00 1.61 -0.00 -1.49 -1.27 116.97 117.83 1g63 h TYR 107 Ca 0.53 0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 59.24 1g63 h TYR 107 Cb 1.11 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.84 1g63 h TYR 107 CO 1.26 0.00 -0.09 1.96 -0.00 0.00 0.00 178.16 181.29 1g63 h GLN 108 N 0.00 0.00 -0.28 0.10 4.20 -1.87 -3.12 115.11 114.14 1g63 h GLN 108 Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1g63 h GLN 108 Cb 0.63 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.41 1g63 h GLN 108 CO -0.00 0.09 0.00 1.63 -0.67 0.00 0.00 178.83 179.88 1g63 n LYS 109 N -3.18 2.84 -3.02 1.46 5.02 -0.50 -5.03 118.16 115.76 1g63 n LYS 109 Ca 0.01 -2.39 -0.40 0.00 -2.02 0.00 0.00 58.31 53.51 1g63 n LYS 109 Cb 0.43 -1.52 -0.05 0.00 -0.02 0.00 0.00 35.03 33.87 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 -1.88 4.42 -0.12 -0.35 2.96 -1.10 -1.19 118.68 121.42 1g63 s LEU 110 Ca 0.31 1.37 -0.01 0.00 -0.22 0.00 0.00 54.13 55.58 1g63 s LEU 110 Cb 0.22 -3.17 0.03 0.00 0.50 0.00 0.00 46.19 43.77 1g63 s LEU 110 CO 0.11 0.00 -0.05 -0.36 -1.32 0.00 0.00 176.35 174.73 1g63 s PHE 111 N 0.08 1.39 -0.19 5.38 0.40 0.45 -2.84 117.98 122.65 1g63 s PHE 111 Ca 0.38 -0.75 -0.07 0.00 -0.60 0.00 0.00 56.93 55.89 1g63 s PHE 111 Cb -0.20 -1.18 -0.04 0.00 0.51 0.00 0.00 43.02 42.12 1g63 s PHE 111 CO 0.21 -0.52 0.05 0.42 0.70 0.00 0.00 175.22 176.08 1g63 s ILE 112 N 1.74 4.55 -0.59 0.64 1.01 0.96 -0.97 121.20 128.53 1g63 s ILE 112 Ca 0.04 -0.12 0.01 0.00 0.00 0.00 0.00 60.65 60.58 1g63 s ILE 112 Cb -0.13 -3.05 0.15 0.00 0.01 0.00 0.00 42.46 39.43 1g63 s ILE 112 CO -0.08 0.44 0.38 -0.36 0.00 0.00 0.00 174.94 175.32 1g63 s PHE 113 N 0.59 3.33 0.39 3.97 0.40 -0.85 -1.02 117.98 124.79 1g63 s PHE 113 Ca 0.02 -2.98 -0.27 0.00 -0.60 0.00 0.00 56.93 53.11 1g63 s PHE 113 Cb -0.13 -3.00 -0.11 0.00 0.51 0.00 0.00 43.02 40.29 1g63 s PHE 113 CO 0.02 -0.77 1.30 -2.30 0.70 0.00 0.00 175.22 174.16 1g63 n PRO 114 N 3.17 2.07 -3.66 0.24 -0.02 -1.26 -1.26 135.00 134.28 1g63 n PRO 114 Ca 0.08 0.73 -0.09 0.00 -2.02 0.00 0.00 63.50 62.20 1g63 n PRO 114 Cb 0.35 -2.40 -0.10 0.00 -0.02 0.00 0.00 33.50 31.33 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 -0.42 -0.16 0.03 2.55 3.84 -0.38 -4.75 114.94 115.65 1g63 s ASN 115 Ca 0.58 0.93 -0.29 0.00 0.21 0.00 0.00 52.86 54.29 1g63 s ASN 115 Cb -0.52 1.25 0.10 0.00 -0.55 0.00 0.00 41.25 41.53 1g63 s ASN 115 CO 0.60 -0.23 1.20 0.00 -2.79 0.00 0.00 177.10 175.87 1g63 s MET 116 N 2.58 0.62 0.54 0.43 0.23 -1.26 -4.46 119.30 117.99 1g63 s MET 116 Ca -0.01 -0.35 -0.20 0.00 -1.03 0.00 0.00 55.69 54.10 1g63 s MET 116 Cb -0.12 0.21 -0.05 0.00 -1.53 0.00 0.00 34.83 33.34 1g63 s MET 116 CO -0.12 -0.28 1.18 1.21 -2.03 0.00 0.00 175.02 174.97 1g63 s ASN 117 N -3.00 5.62 0.36 -1.18 3.84 -1.26 -4.56 114.94 114.77 1g63 s ASN 117 Ca 0.14 2.32 0.12 0.00 0.21 0.00 0.00 52.86 55.64 1g63 s ASN 117 Cb 0.03 -2.60 0.90 0.00 -0.55 0.00 0.00 41.25 39.04 1g63 s ASN 117 CO -0.02 -1.29 1.83 -0.29 -2.79 0.00 0.00 177.10 174.53 1g63 h ILE 118 N 1.28 0.72 -0.42 -5.21 6.09 -1.93 -1.54 117.51 116.49 1g63 h ILE 118 Ca -0.50 -0.21 -0.06 0.00 -1.37 0.00 0.00 64.86 62.72 1g63 h ILE 118 Cb 1.27 0.07 -0.02 0.00 0.47 0.00 0.00 36.82 38.61 1g63 h ILE 118 CO 0.57 0.11 0.01 -0.09 -3.07 0.00 0.00 178.15 175.68 1g63 h ARG 119 N 0.60 0.67 -0.17 2.19 9.65 -1.96 -2.36 114.38 122.99 1g63 h ARG 119 Ca 0.51 -0.16 -0.13 0.00 -1.10 0.00 0.00 59.98 59.10 1g63 h ARG 119 Cb 1.00 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 29.48 1g63 h ARG 119 CO -0.26 0.68 -0.46 0.52 2.80 0.00 0.00 179.97 183.26 1g63 h MET 120 N 0.64 0.43 0.00 0.20 2.86 -1.65 -2.88 114.93 114.53 1g63 h MET 120 Ca 0.13 -0.24 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 1g63 h MET 120 Cb 0.39 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.06 1g63 h MET 120 CO 0.01 0.81 -0.04 2.35 1.06 0.00 0.00 176.91 181.10 1g63 h TRP 121 N 0.35 0.00 -0.01 -0.22 2.91 -1.10 -2.06 115.95 115.82 1g63 h TRP 121 Ca 0.02 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.04 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 0.03 0.04 0.00 0.41 -1.03 0.00 0.00 178.44 177.89 1g63 n GLY 122 N -1.28 -0.68 3.71 2.65 0.00 -1.09 -4.72 105.19 103.78 1g63 n GLY 122 Ca -0.03 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.90 6.52 0.20 1.61 3.84 -0.78 -4.90 114.94 119.52 1g63 s ASN 123 Ca 0.41 2.68 -0.11 0.00 0.21 0.00 0.00 52.86 56.06 1g63 s ASN 123 Cb 0.20 -2.59 0.19 0.00 -0.55 0.00 0.00 41.25 38.50 1g63 s ASN 123 CO 0.33 -0.89 1.82 -0.65 -2.79 0.00 0.00 177.10 174.91 1g63 h PRO 124 N 7.24 0.67 -0.29 0.43 0.11 -1.91 -1.61 132.00 136.64 1g63 h PRO 124 Ca -0.43 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.52 1g63 h PRO 124 Cb 1.20 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1g63 h PRO 124 CO 0.93 0.44 -0.30 0.74 -0.21 0.00 0.00 178.00 179.60 1g63 h PHE 125 N 0.69 0.70 0.29 0.65 -1.00 -1.99 -0.48 116.94 115.81 1g63 h PHE 125 Ca 0.27 -0.18 -0.01 0.00 2.81 0.00 0.00 57.97 60.86 1g63 h PHE 125 Cb 0.10 -0.16 0.00 0.00 3.61 0.00 0.00 35.95 39.50 1g63 h PHE 125 CO -0.07 0.85 -0.14 1.25 -1.61 0.00 0.00 178.31 178.59 1g63 h LEU 126 N 0.52 -0.33 -0.95 1.54 5.85 -1.84 -2.33 115.31 117.77 1g63 h LEU 126 Ca 0.06 -0.15 0.09 0.00 0.84 0.00 0.00 57.88 58.72 1g63 h LEU 126 Cb 0.79 0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.83 1g63 h LEU 126 CO 0.06 -0.03 0.60 1.56 -0.34 0.00 0.00 178.44 180.29 1g63 h GLN 127 N -0.65 1.00 -0.61 1.25 1.08 -1.22 0.56 115.11 116.52 1g63 h GLN 127 Ca -0.04 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.07 1g63 h GLN 127 Cb 0.46 -0.23 -0.03 0.00 -0.05 0.00 0.00 27.48 27.64 1g63 h GLN 127 CO 0.07 0.66 0.26 -0.22 -0.95 0.00 0.00 178.83 178.65 1g63 h LYS 128 N 1.03 0.88 -0.10 1.46 3.64 -1.04 -1.49 116.57 120.95 1g63 h LYS 128 Ca 0.44 -0.13 -0.17 0.00 -1.27 0.00 0.00 60.65 59.52 1g63 h LYS 128 Cb 0.29 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1g63 h LYS 128 CO -0.21 0.71 -0.65 -0.91 -2.27 0.00 0.00 179.45 176.12 1g63 h ASN 129 N 0.87 0.45 -0.56 4.20 -0.26 -0.52 -2.00 115.58 117.76 1g63 h ASN 129 Ca 0.21 -0.27 -0.08 0.00 -0.56 0.00 0.00 56.30 55.60 1g63 h ASN 129 Cb 0.14 -0.13 -0.02 0.00 -1.06 0.00 0.00 38.32 37.25 1g63 h ASN 129 CO -0.02 0.97 0.03 0.40 -1.06 0.00 0.00 177.43 177.75 1g63 h ILE 130 N 0.28 1.26 -0.28 2.81 2.04 -0.39 -0.21 117.51 123.03 1g63 h ILE 130 Ca -0.01 -1.08 -0.03 0.00 1.00 0.00 0.00 64.86 64.74 1g63 h ILE 130 Cb 1.19 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 1g63 h ILE 130 CO 0.11 0.39 0.05 0.44 0.00 0.00 0.00 178.15 179.14 1g63 h ASP 131 N 0.92 0.44 -0.77 1.72 3.45 -1.19 -1.62 116.42 119.36 1g63 h ASP 131 Ca 0.17 -0.25 0.08 0.00 0.43 0.00 0.00 57.03 57.46 1g63 h ASP 131 Cb 0.49 -0.12 -0.07 0.00 -0.56 0.00 0.00 39.33 39.08 1g63 h ASP 131 CO 0.02 0.58 0.43 0.25 -1.57 0.00 0.00 179.24 178.95 1g63 h LEU 132 N 0.28 0.62 -0.19 1.55 5.85 -0.95 0.04 115.31 122.50 1g63 h LEU 132 Ca 0.08 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1g63 h LEU 132 Cb 0.32 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1g63 h LEU 132 CO 0.00 0.37 0.06 -0.07 -0.34 0.00 0.00 178.44 178.46 1g63 h LEU 133 N 0.74 0.27 -0.60 2.25 3.38 -0.77 -3.03 115.31 117.56 1g63 h LEU 133 Ca 0.36 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1g63 h LEU 133 Cb 0.31 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1g63 h LEU 133 CO -0.23 0.41 0.33 0.11 0.09 0.00 0.00 178.44 179.14 1g63 h LYS 134 N 0.12 0.84 0.00 1.13 1.57 -0.80 -1.69 116.57 117.75 1g63 h LYS 134 Ca 0.06 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1g63 h LYS 134 Cb 0.24 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1g63 h LYS 134 CO -0.00 0.65 0.00 0.09 -0.57 0.00 0.00 179.45 179.62 1g63 n ASN 135 N -4.56 0.00 -0.99 0.86 5.03 -0.05 -2.68 115.26 112.87 1g63 n ASN 135 Ca 0.04 -1.18 0.05 0.00 0.87 0.00 0.00 54.58 54.36 1g63 n ASN 135 Cb 0.09 0.00 0.08 0.00 -1.02 0.00 0.00 39.78 38.93 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 -0.57 1.17 -0.76 6.41 3.02 -0.70 -5.00 115.26 118.83 1g63 n ASN 136 Ca 0.02 -2.64 -0.10 0.00 -0.03 0.00 0.00 54.58 51.83 1g63 n ASN 136 Cb 0.01 -0.36 -0.04 0.00 -0.61 0.00 0.00 39.78 38.77 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 -0.19 -4.19 -4.57 6.41 9.92 -1.09 -5.01 116.55 117.82 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 0.91 -2.57 -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 -2.37 5.12 -0.20 2.53 1.01 -0.79 -4.82 120.40 120.88 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 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.94 1g63 s VAL 138 CO 0.00 0.28 1.36 -0.54 0.00 0.00 0.00 175.10 176.20 1g63 s LYS 139 N 1.66 4.08 -0.26 2.72 3.01 -1.13 -3.88 119.74 125.95 1g63 s LYS 139 Ca 0.07 1.60 0.03 0.00 -1.01 0.00 0.00 55.97 56.65 1g63 s LYS 139 Cb -0.16 -3.85 0.06 0.00 -1.01 0.00 0.00 37.83 32.87 1g63 s LYS 139 CO 0.09 -0.91 -0.11 0.08 0.51 0.00 0.00 175.35 175.01 1g63 s VAL 140 N 4.02 2.12 0.48 3.17 1.01 -1.26 -0.03 120.40 129.91 1g63 s VAL 140 Ca 0.59 -1.59 -0.23 0.00 0.00 0.00 0.00 61.98 60.76 1g63 s VAL 140 Cb -0.22 -2.23 -0.07 0.00 0.00 0.00 0.00 36.38 33.86 1g63 s VAL 140 CO 0.20 -0.02 1.22 -0.47 0.00 0.00 0.00 175.10 176.03 1g63 s TYR 141 N 1.13 2.72 -0.40 5.22 6.14 -0.19 -4.97 117.35 127.00 1g63 s TYR 141 Ca -0.08 1.49 -0.25 0.00 0.64 0.00 0.00 57.07 58.87 1g63 s TYR 141 Cb -0.20 -3.49 0.02 0.00 0.42 0.00 0.00 41.96 38.71 1g63 s TYR 141 CO -0.05 -1.87 0.91 -1.12 0.64 0.00 0.00 175.55 174.06 1g63 s SER 142 N -1.26 6.61 -0.13 4.32 0.01 -1.26 -4.52 113.70 117.47 1g63 s SER 142 Ca 0.66 0.42 -0.40 0.00 1.31 0.00 0.00 55.95 57.94 1g63 s SER 142 Cb -0.32 -2.45 -0.17 0.00 0.21 0.00 0.00 66.02 63.29 1g63 s SER 142 CO 0.38 -0.91 1.50 -2.65 0.41 0.00 0.00 173.24 171.97 1g63 n PRO 143 N 6.86 0.89 -1.71 12.44 -0.02 -1.26 -4.90 135.00 147.30 1g63 n PRO 143 Ca 0.06 0.32 -0.36 0.00 -2.02 0.00 0.00 63.50 61.51 1g63 n PRO 143 Cb 0.48 -1.95 0.07 0.00 -0.02 0.00 0.00 33.50 32.08 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 1.90 4.64 0.01 2.55 1.11 -1.26 -4.89 116.67 120.74 1g63 s ASP 144 Ca 0.93 2.43 0.03 0.00 0.18 0.00 0.00 52.55 56.12 1g63 s ASP 144 Cb -1.10 -2.60 -0.01 0.00 1.07 0.00 0.00 42.92 40.28 1g63 s ASP 144 CO 0.59 -1.97 -0.08 -0.04 1.18 0.00 0.00 175.17 174.85 1g63 s MET 145 N -3.58 0.64 -0.02 8.23 -1.94 -1.26 -1.54 119.30 119.83 1g63 s MET 145 Ca 0.77 -0.41 -0.08 0.00 -1.71 0.00 0.00 55.69 54.27 1g63 s MET 145 Cb -0.32 -0.59 0.01 0.00 2.01 0.00 0.00 34.83 35.94 1g63 s MET 145 CO 0.40 0.15 0.17 1.21 -0.01 0.00 0.00 175.02 176.94 1g63 s ASN 146 N -0.52 -0.05 -0.01 3.03 2.47 -0.21 -4.94 114.94 114.71 1g63 s ASN 146 Ca 0.01 -0.04 -0.30 0.00 0.42 0.00 0.00 52.86 52.95 1g63 s ASN 146 Cb -0.05 0.26 -0.06 0.00 -1.45 0.00 0.00 41.25 39.95 1g63 s ASN 146 CO 0.00 -0.31 1.55 -0.75 -3.72 0.00 0.00 177.10 173.88 1g63 s LYS 147 N -1.03 4.22 -0.01 0.43 2.20 -1.26 -0.42 119.74 123.88 1g63 s LYS 147 Ca -0.11 2.13 -0.06 0.00 -0.36 0.00 0.00 55.97 57.57 1g63 s LYS 147 Cb -0.06 -3.73 0.00 0.00 -1.51 0.00 0.00 37.83 32.53 1g63 s LYS 147 CO 0.02 -0.72 0.12 0.45 -0.36 0.00 0.00 175.35 174.85 1g63 s SER 148 N 2.53 0.02 0.14 1.43 0.15 -0.13 -4.92 113.70 112.91 1g63 s SER 148 Ca 0.70 -0.14 -0.30 0.00 0.70 0.00 0.00 55.95 56.91 1g63 s SER 148 Cb -0.34 0.21 -0.07 0.00 -1.71 0.00 0.00 66.02 64.11 1g63 s SER 148 CO 0.29 -0.29 1.03 0.12 1.20 0.00 0.00 173.24 175.58 1g63 s PHE 149 N -1.08 3.70 -0.36 3.44 5.36 -1.26 -0.42 117.98 127.36 1g63 s PHE 149 Ca -0.12 1.69 -0.02 0.00 -0.96 0.00 0.00 56.93 57.52 1g63 s PHE 149 Cb -0.06 -3.16 0.08 0.00 -0.34 0.00 0.00 43.02 39.53 1g63 s PHE 149 CO 0.01 -0.20 0.11 -2.00 -1.46 0.00 0.00 175.22 171.67 1g63 s GLU 150 N -0.10 2.18 0.49 10.12 2.12 -0.06 -4.90 118.70 128.55 1g63 s GLU 150 Ca 0.49 -1.56 0.20 0.00 0.36 0.00 0.00 54.97 54.45 1g63 s GLU 150 Cb -0.26 -3.39 1.25 0.00 0.26 0.00 0.00 34.13 31.98 1g63 s GLU 150 CO 0.32 -0.86 2.01 0.82 -0.54 0.00 0.00 175.26 177.01 1g63 h ILE 151 N 6.41 0.82 0.12 -3.70 5.03 -1.95 0.38 117.51 124.62 1g63 h ILE 151 Ca -0.16 -0.05 0.00 0.00 -0.12 0.00 0.00 64.86 64.53 1g63 h ILE 151 Cb 1.05 0.66 -0.02 0.00 -3.03 0.00 0.00 36.82 35.48 1g63 h ILE 151 CO 0.61 0.03 -0.31 0.28 -0.68 0.00 0.00 178.15 178.08 1g63 h SER 152 N 0.15 -0.92 0.78 1.72 0.02 -1.93 -2.94 113.55 110.43 1g63 h SER 152 Ca 0.23 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.28 1g63 h SER 152 Cb 0.72 0.33 0.00 0.00 0.14 0.00 0.00 62.40 63.60 1g63 h SER 152 CO -0.03 -0.35 -0.36 -1.54 -1.14 0.00 0.00 176.83 173.41 1g63 n SER 153 N -4.23 0.44 -1.28 3.07 3.41 -1.09 -4.93 113.62 109.02 1g63 n SER 153 Ca -0.06 0.09 -0.13 0.00 -0.26 0.00 0.00 58.87 58.51 1g63 n SER 153 Cb 0.25 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.13 1g63 n SER 153 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1g63 n GLY 154 N 1.45 0.46 3.22 5.00 0.00 0.13 -5.00 105.19 110.45 1g63 n GLY 154 Ca 0.05 -0.38 -0.15 0.00 0.00 0.00 0.00 46.02 45.55 1g63 n GLY 154 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1g63 s ARG 155 N -4.02 0.97 -0.14 1.61 0.52 -1.11 -4.95 118.95 111.84 1g63 s ARG 155 Ca 0.00 -1.32 -0.26 0.00 -0.52 0.00 0.00 55.73 53.63 1g63 s ARG 155 Cb 0.00 -0.61 -0.02 0.00 0.52 0.00 0.00 34.95 34.84 1g63 s ARG 155 CO 0.00 0.09 0.88 0.71 0.02 0.00 0.00 175.30 176.99 1g63 s TYR 156 N -2.88 3.46 0.25 -0.53 1.51 -1.26 -0.88 117.35 117.03 1g63 s TYR 156 Ca 0.12 1.36 0.11 0.00 -1.01 0.00 0.00 57.07 57.65 1g63 s TYR 156 Cb -0.00 -3.05 -0.05 0.00 -0.11 0.00 0.00 41.96 38.75 1g63 s TYR 156 CO 0.00 -0.20 -0.20 0.21 -1.11 0.00 0.00 175.55 174.25 1g63 s LYS 157 N 1.97 1.59 -0.22 -0.62 2.47 0.44 -4.91 119.74 120.47 1g63 s LYS 157 Ca 0.41 -1.70 -0.23 0.00 -1.56 0.00 0.00 55.97 52.90 1g63 s LYS 157 Cb -0.17 -1.67 -0.01 0.00 -1.46 0.00 0.00 37.83 34.51 1g63 s LYS 157 CO 0.15 0.32 0.76 1.21 0.16 0.00 0.00 175.35 177.94 1g63 s ASN 158 N -3.33 6.79 0.08 1.43 3.04 -1.26 -0.96 114.94 120.73 1g63 s ASN 158 Ca 0.27 0.98 0.05 0.00 0.04 0.00 0.00 52.86 54.19 1g63 s ASN 158 Cb -0.05 -2.41 -0.04 0.00 -1.54 0.00 0.00 41.25 37.21 1g63 s ASN 158 CO 0.13 -0.41 0.00 0.20 -3.04 0.00 0.00 177.10 173.98 1g63 s ASN 159 N 1.28 5.05 0.12 -4.21 0.01 0.44 -4.85 114.94 112.78 1g63 s ASN 159 Ca 0.33 -0.16 -0.30 0.00 -0.71 0.00 0.00 52.86 52.02 1g63 s ASN 159 Cb -0.16 -1.22 -0.06 0.00 0.41 0.00 0.00 41.25 40.23 1g63 s ASN 159 CO 0.09 0.18 1.01 -0.63 -1.51 0.00 0.00 177.10 176.25 1g63 s ILE 160 N -1.30 4.35 0.28 0.60 1.01 -1.26 -1.05 121.20 123.83 1g63 s ILE 160 Ca 0.25 1.93 0.10 0.00 0.00 0.00 0.00 60.65 62.93 1g63 s ILE 160 Cb -0.12 -4.23 -0.05 0.00 0.01 0.00 0.00 42.46 38.07 1g63 s ILE 160 CO 0.18 0.29 -0.15 0.42 0.00 0.00 0.00 174.94 175.67 1g63 s THR 161 N 0.07 2.17 0.35 2.92 -4.23 -0.59 -4.89 115.64 111.44 1g63 s THR 161 Ca 0.48 -2.29 -0.27 0.00 -1.18 0.00 0.00 61.69 58.43 1g63 s THR 161 Cb -0.25 -2.33 -0.09 0.00 1.34 0.00 0.00 72.50 71.17 1g63 s THR 161 CO 0.31 -0.39 1.13 -0.04 -0.54 0.00 0.00 174.62 175.09 1g63 s MET 162 N -3.58 4.30 0.66 3.99 -1.94 -1.26 -3.97 119.30 117.49 1g63 s MET 162 Ca 0.29 1.80 -0.17 0.00 -1.71 0.00 0.00 55.69 55.89 1g63 s MET 162 Cb -0.02 -2.86 -0.07 0.00 2.01 0.00 0.00 34.83 33.90 1g63 s MET 162 CO 0.13 -0.09 0.42 -2.30 -0.01 0.00 0.00 175.02 173.17 1g63 n PRO 163 N 0.49 0.34 -3.49 2.03 -0.02 -1.26 -4.95 135.00 128.14 1g63 n PRO 163 Ca 0.02 0.15 -0.35 0.00 -2.02 0.00 0.00 63.50 61.30 1g63 n PRO 163 Cb 0.46 -1.68 -0.06 0.00 -0.02 0.00 0.00 33.50 32.20 1g63 n PRO 163 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1g63 s ASN 164 N -1.30 6.70 0.21 2.55 2.47 -1.26 -4.94 114.94 119.37 1g63 s ASN 164 Ca 0.65 0.89 -0.09 0.00 0.42 0.00 0.00 52.86 54.73 1g63 s ASN 164 Cb -0.39 -2.22 0.28 0.00 -1.45 0.00 0.00 41.25 37.47 1g63 s ASN 164 CO 0.58 0.14 1.75 0.40 -3.72 0.00 0.00 177.10 176.25 1g63 h ILE 165 N 2.79 0.79 -0.27 -5.21 1.08 -1.99 0.29 117.51 114.99 1g63 h ILE 165 Ca -0.49 -0.15 -0.01 0.00 -0.39 0.00 0.00 64.86 63.83 1g63 h ILE 165 Cb 1.19 0.32 -0.01 0.00 -3.07 0.00 0.00 36.82 35.25 1g63 h ILE 165 CO 0.66 0.08 0.14 -0.08 -0.69 0.00 0.00 178.15 178.26 1g63 h GLU 166 N 0.43 0.39 0.00 2.37 4.81 -1.99 -2.23 114.58 118.36 1g63 h GLU 166 Ca 0.31 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.48 1g63 h GLU 166 Cb 0.36 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 1g63 h GLU 166 CO -0.29 0.36 -0.03 -0.91 -0.73 0.00 0.00 179.01 177.40 1g63 h ASN 167 N 0.32 0.00 0.15 1.04 -0.26 -1.51 1.00 115.58 116.32 1g63 h ASN 167 Ca 0.09 0.00 -0.23 0.00 -0.56 0.00 0.00 56.30 55.60 1g63 h ASN 167 Cb 0.09 0.00 0.02 0.00 -1.06 0.00 0.00 38.32 37.37 1g63 h ASN 167 CO -0.01 0.03 -1.08 -0.37 -1.06 0.00 0.00 177.43 174.94 1g63 h VAL 168 N 0.00 1.35 -0.29 2.81 -1.51 -0.16 -2.67 116.25 115.78 1g63 h VAL 168 Ca -0.00 -2.53 -0.03 0.00 -1.23 0.00 0.00 66.70 62.91 1g63 h VAL 168 Cb 0.08 3.06 -0.01 0.00 -2.13 0.00 0.00 31.29 32.29 1g63 h VAL 168 CO 0.00 0.73 0.06 -0.07 -1.23 0.00 0.00 177.57 177.07 1g63 h LEU 169 N -0.27 0.45 -0.02 4.19 3.38 -1.12 -0.88 115.31 121.03 1g63 h LEU 169 Ca -0.20 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 57.54 1g63 h LEU 169 Cb 1.76 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.38 1g63 h LEU 169 CO 0.15 0.57 -0.05 0.78 0.09 0.00 0.00 178.44 179.98 1g63 h ASN 170 N 0.30 -0.14 -0.18 -0.43 -0.26 -0.93 0.19 115.58 114.13 1g63 h ASN 170 Ca 0.09 0.03 -0.03 0.00 -0.56 0.00 0.00 56.30 55.83 1g63 h ASN 170 Cb 0.30 0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 37.62 1g63 h ASN 170 CO 0.00 -0.07 0.05 0.15 -1.06 0.00 0.00 177.43 176.50 1g63 h PHE 171 N -0.08 0.37 0.01 1.19 3.57 -1.37 -0.21 116.94 120.42 1g63 h PHE 171 Ca 0.03 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 1g63 h PHE 171 Cb 0.11 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1g63 h PHE 171 CO -0.13 0.34 -0.00 0.28 -2.23 0.00 0.00 178.31 176.57 1g63 h VAL 172 N 0.36 1.28 -0.01 1.41 2.07 -0.73 -3.37 116.25 117.27 1g63 h VAL 172 Ca 0.09 -1.91 -0.15 0.00 0.82 0.00 0.00 66.70 65.54 1g63 h VAL 172 Cb 0.17 2.40 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 1g63 h VAL 172 CO -0.00 0.43 -0.69 -0.07 0.02 0.00 0.00 177.57 177.25 1g63 h LEU 173 N -0.98 0.05 -0.19 2.57 -0.00 -0.64 -3.51 115.31 112.61 1g63 h LEU 173 Ca -0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 57.88 57.85 1g63 h LEU 173 Cb 0.71 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.35 1g63 h LEU 173 CO 0.00 0.72 0.00 0.59 -0.00 0.00 0.00 178.44 179.76