#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 -4.79 117.16 118.11 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 -0.19 0.00 0.00 -0.02 0.00 0.00 39.34 39.13 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 2.38 3.71 2.72 0.00 -1.26 -4.90 105.19 109.21 1g63 n GLY 3 Ca 0.11 -2.12 -0.43 0.00 0.00 0.00 0.00 46.02 43.58 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 2.65 -5.00 1.61 5.02 -1.26 -3.29 118.16 117.35 1g63 n LYS 4 Ca 0.00 0.96 -0.28 0.00 -2.02 0.00 0.00 58.31 56.96 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 0.98 1.96 -0.12 -0.35 0.20 0.02 -0.96 118.68 120.41 1g63 s LEU 5 Ca 0.75 -0.43 -0.01 0.00 0.69 0.00 0.00 54.13 55.13 1g63 s LEU 5 Cb -0.54 -1.14 -0.02 0.00 -0.43 0.00 0.00 46.19 44.06 1g63 s LEU 5 CO 0.35 0.17 -0.09 -0.22 -0.29 0.00 0.00 176.35 176.27 1g63 s LEU 6 N 0.08 2.99 -0.21 -0.68 2.96 -0.15 -0.95 118.68 122.73 1g63 s LEU 6 Ca -0.07 -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 44.84 1g63 s LEU 6 CO 0.04 0.22 0.05 -0.63 -1.32 0.00 0.00 176.35 174.70 1g63 s ILE 7 N 0.06 4.42 -0.42 6.68 1.01 -0.00 -0.53 121.20 132.41 1g63 s ILE 7 Ca -0.03 -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 39.40 1g63 s ILE 7 CO 0.04 0.41 0.26 0.00 0.00 0.00 0.00 174.94 175.64 1g63 s ALA 9 N 1.39 3.65 0.43 0.00 0.00 -0.21 -1.35 121.76 125.67 1g63 s ALA 9 Ca 0.03 -0.35 0.07 0.00 0.00 0.00 0.00 51.96 51.71 1g63 s ALA 9 Cb -0.23 -2.38 -0.05 0.00 0.00 0.00 0.00 23.12 20.46 1g63 s ALA 9 CO 0.01 0.28 0.14 0.95 0.00 0.00 0.00 175.76 177.14 1g63 s THR 10 N -0.24 2.12 -0.44 0.00 -4.23 -1.06 -1.45 115.64 110.34 1g63 s THR 10 Ca 0.20 -1.78 -0.03 0.00 -1.18 0.00 0.00 61.69 58.90 1g63 s THR 10 Cb -0.14 -2.90 -0.03 0.00 1.34 0.00 0.00 72.50 70.76 1g63 s THR 10 CO 0.08 0.00 1.58 0.00 -0.54 0.00 0.00 174.62 175.74 1g63 n ALA 11 N -1.20 2.95 -2.78 3.99 0.00 -1.26 -4.66 120.51 117.54 1g63 n ALA 11 Ca -0.03 -1.01 -0.33 0.00 0.00 0.00 0.00 53.44 52.07 1g63 n ALA 11 Cb 0.65 -2.71 -0.07 0.00 0.00 0.00 0.00 19.45 17.33 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 3.98 5.67 0.45 0.00 0.15 -1.26 -4.93 113.70 117.75 1g63 s SER 12 Ca 0.21 0.14 0.20 0.00 0.70 0.00 0.00 55.95 57.19 1g63 s SER 12 Cb 0.06 -1.62 1.16 0.00 -1.71 0.00 0.00 66.02 63.91 1g63 s SER 12 CO -0.02 0.26 1.89 -0.29 1.20 0.00 0.00 173.24 176.29 1g63 h ILE 13 N 3.16 0.70 0.00 6.45 6.09 -1.92 -0.07 117.51 131.92 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 0.36 0.00 0.00 0.47 0.00 0.00 36.82 38.83 1g63 h ILE 13 CO 0.63 0.06 0.00 0.59 -3.07 0.00 0.00 178.15 176.35 1g63 n ASN 14 N -4.46 0.00 0.21 2.19 4.13 -1.26 -2.90 115.26 113.17 1g63 n ASN 14 Ca 0.17 -0.75 0.15 0.00 1.68 0.00 0.00 54.58 55.82 1g63 n ASN 14 Cb 0.68 0.00 0.66 0.00 -1.54 0.00 0.00 39.78 39.58 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 -1.27 -1.68 116.25 118.75 1g63 h VAL 15 Ca 0.00 -0.28 0.00 0.00 -1.01 0.00 0.00 66.70 65.41 1g63 h VAL 15 Cb 0.00 1.11 0.00 0.00 -2.01 0.00 0.00 31.29 30.39 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 -2.65 0.88 -0.13 3.17 -5.35 -1.14 -2.11 119.36 112.02 1g63 n ILE 16 Ca 0.01 0.22 0.05 0.00 -0.27 0.00 0.00 62.75 62.75 1g63 n ILE 16 Cb 0.21 -1.06 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 -1.91 2.78 0.23 7.28 5.03 -0.63 -4.67 115.26 123.37 1g63 n ASN 17 Ca 0.03 -1.97 0.14 0.00 0.87 0.00 0.00 54.58 53.65 1g63 n ASN 17 Cb 0.21 -0.20 0.79 0.00 -1.02 0.00 0.00 39.78 39.56 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 1.81 0.67 -0.31 2.41 6.09 -1.47 -1.95 117.51 124.76 1g63 h ILE 18 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1g63 h ILE 18 Cb 0.69 0.92 -0.02 0.00 0.47 0.00 0.00 36.82 38.89 1g63 h ILE 18 CO 0.00 0.00 0.21 -0.55 -3.07 0.00 0.00 178.15 174.74 1g63 h ASN 19 N 0.00 0.36 -0.69 2.19 -1.07 -1.83 -2.22 115.58 112.32 1g63 h ASN 19 Ca 0.05 -0.01 -0.04 0.00 0.07 0.00 0.00 56.30 56.37 1g63 h ASN 19 Cb 0.25 -0.09 -0.03 0.00 -2.07 0.00 0.00 38.32 36.38 1g63 h ASN 19 CO -0.00 0.26 0.26 0.45 0.07 0.00 0.00 177.43 178.47 1g63 h HIS 20 N 0.43 1.07 -0.62 4.14 3.86 -1.72 -2.77 115.15 119.52 1g63 h HIS 20 Ca 0.12 -0.09 -0.08 0.00 -1.16 0.00 0.00 60.37 59.15 1g63 h HIS 20 Cb -0.05 -0.32 -0.02 0.00 1.06 0.00 0.00 27.41 28.08 1g63 h HIS 20 CO -0.00 0.84 0.06 1.88 0.86 0.00 0.00 177.93 181.57 1g63 h TYR 21 N 0.99 1.14 0.58 2.45 -1.99 -1.53 -2.92 116.97 115.69 1g63 h TYR 21 Ca 0.23 -0.17 -0.02 0.00 2.00 0.00 0.00 58.73 60.76 1g63 h TYR 21 Cb 0.23 -0.31 -0.02 0.00 2.00 0.00 0.00 36.73 38.64 1g63 h TYR 21 CO 0.02 0.98 -0.49 0.82 -0.00 0.00 0.00 178.16 179.48 1g63 h ILE 22 N 0.97 0.00 -0.74 -2.88 2.04 -1.21 0.18 117.51 115.86 1g63 h ILE 22 Ca 0.18 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.14 1g63 h ILE 22 Cb 0.49 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.52 1g63 h ILE 22 CO 0.02 0.00 0.49 1.62 0.00 0.00 0.00 178.15 180.28 1g63 h VAL 23 N -1.05 0.95 -0.06 1.67 3.04 -1.56 0.53 116.25 119.76 1g63 h VAL 23 Ca -0.08 -0.23 -0.02 0.00 -1.01 0.00 0.00 66.70 65.37 1g63 h VAL 23 Cb 0.89 0.23 -0.00 0.00 -2.01 0.00 0.00 31.29 30.39 1g63 h VAL 23 CO -0.01 0.12 -0.04 -0.08 -1.01 0.00 0.00 177.57 176.55 1g63 h GLU 24 N 0.66 0.13 0.00 4.17 4.57 -1.28 -3.16 114.58 119.67 1g63 h GLU 24 Ca 0.34 -0.06 -0.03 0.00 -1.18 0.00 0.00 59.36 58.43 1g63 h GLU 24 Cb 0.44 -0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.02 1g63 h GLU 24 CO -0.12 0.53 -0.12 -0.07 -1.18 0.00 0.00 179.01 178.04 1g63 h LEU 25 N -0.27 0.00 -1.09 1.64 3.38 -0.04 -2.89 115.31 116.04 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 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1g63 h LEU 25 CO 0.01 0.12 0.00 0.29 0.09 0.00 0.00 178.44 178.95 1g63 n LYS 26 N -3.33 0.13 0.04 1.13 4.76 0.12 -1.58 118.16 119.43 1g63 n LYS 26 Ca -0.00 0.57 0.12 0.00 -2.87 0.00 0.00 58.31 56.13 1g63 n LYS 26 Cb 0.33 -1.88 0.16 0.00 -1.84 0.00 0.00 35.03 31.80 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 -2.14 0.25 -0.00 1.97 6.02 -1.09 -4.29 117.38 118.09 1g63 n GLN 27 Ca -0.00 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 -0.05 0.00 1.02 0.00 0.00 30.24 29.64 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 -1.99 0.00 -5.11 1.08 8.25 -0.62 -4.91 115.22 111.93 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 0.42 -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 -2.23 2.10 0.30 4.41 0.40 -0.95 -1.16 117.98 120.85 1g63 s PHE 29 Ca -0.01 -0.52 0.02 0.00 -0.60 0.00 0.00 56.93 55.81 1g63 s PHE 29 Cb 0.04 -1.37 0.73 0.00 0.51 0.00 0.00 43.02 42.93 1g63 s PHE 29 CO 0.26 -0.13 1.59 -0.44 0.70 0.00 0.00 175.22 177.21 1g63 h ASP 30 N 5.89 -0.36 -5.01 1.36 3.45 -1.86 -3.41 116.42 116.49 1g63 h ASP 30 Ca -0.36 0.26 -0.15 0.00 0.43 0.00 0.00 57.03 57.21 1g63 h ASP 30 Cb 1.16 0.43 -0.20 0.00 -0.56 0.00 0.00 39.33 40.15 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 -5.99 0.46 -0.23 3.56 2.02 -1.26 -4.95 118.70 112.31 1g63 s GLU 31 Ca -0.13 -0.54 -0.03 0.00 0.02 0.00 0.00 54.97 54.29 1g63 s GLU 31 Cb 0.28 0.18 0.08 0.00 0.10 0.00 0.00 34.13 34.77 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 -1.68 0.24 0.39 2.63 0.11 -1.25 -0.80 120.40 120.04 1g63 s VAL 32 Ca -0.13 -0.62 0.08 0.00 -2.93 0.00 0.00 61.98 58.37 1g63 s VAL 32 Cb -0.07 -0.98 -0.02 0.00 -1.53 0.00 0.00 36.38 33.78 1g63 s VAL 32 CO -0.00 -0.44 0.37 0.20 -3.33 0.00 0.00 175.10 171.90 1g63 s ASN 33 N 1.97 5.21 0.03 3.54 0.02 -0.12 -2.46 114.94 123.12 1g63 s ASN 33 Ca 0.04 -0.62 -0.01 0.00 -1.02 0.00 0.00 52.86 51.26 1g63 s ASN 33 Cb -0.17 -0.74 -0.02 0.00 0.02 0.00 0.00 41.25 40.35 1g63 s ASN 33 CO -0.18 -0.55 -0.01 -0.51 0.02 0.00 0.00 177.10 175.86 1g63 s ILE 34 N -2.40 0.13 -0.05 0.60 2.07 -0.53 -0.82 121.20 120.20 1g63 s ILE 34 Ca 0.46 -1.07 -0.02 0.00 -1.41 0.00 0.00 60.65 58.61 1g63 s ILE 34 Cb -0.05 -0.53 0.04 0.00 0.13 0.00 0.00 42.46 42.05 1g63 s ILE 34 CO 0.28 -0.59 0.12 -0.22 -1.91 0.00 0.00 174.94 172.62 1g63 s LEU 35 N -1.75 0.77 0.21 8.50 0.20 0.07 -1.30 118.68 125.38 1g63 s LEU 35 Ca -0.11 0.23 0.07 0.00 0.69 0.00 0.00 54.13 55.01 1g63 s LEU 35 Cb -0.06 0.24 -0.04 0.00 -0.43 0.00 0.00 46.19 45.90 1g63 s LEU 35 CO -0.03 -0.15 0.10 -0.36 -0.29 0.00 0.00 176.35 175.62 1g63 s PHE 36 N 1.20 2.98 0.32 5.38 0.40 -1.26 -1.04 117.98 125.96 1g63 s PHE 36 Ca -0.09 -0.11 -0.16 0.00 -0.60 0.00 0.00 56.93 55.97 1g63 s PHE 36 Cb -0.12 -1.39 -0.09 0.00 0.51 0.00 0.00 43.02 41.93 1g63 s PHE 36 CO -0.05 0.54 0.75 -1.54 0.70 0.00 0.00 175.22 175.62 1g63 s SER 37 N -3.38 6.81 0.25 1.36 1.04 -0.53 -4.65 113.70 114.60 1g63 s SER 37 Ca 0.31 1.32 -0.04 0.00 0.48 0.00 0.00 55.95 58.02 1g63 s SER 37 Cb -0.09 -2.39 0.50 0.00 0.10 0.00 0.00 66.02 64.14 1g63 s SER 37 CO 0.22 -0.20 1.67 -0.65 0.98 0.00 0.00 173.24 175.27 1g63 h PRO 38 N 2.33 0.24 0.00 4.02 0.11 -2.00 -1.32 132.00 135.38 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 32.23 1g63 h PRO 38 CO 0.65 0.16 -0.23 0.77 -0.21 0.00 0.00 178.00 179.14 1g63 h SER 39 N 0.25 0.00 0.58 -2.05 0.02 -1.97 -2.62 113.55 107.76 1g63 h SER 39 Ca 0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.39 1g63 h SER 39 Cb 0.77 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.31 1g63 h SER 39 CO -0.55 0.23 0.00 0.77 -1.14 0.00 0.00 176.83 176.15 1g63 h SER 40 N 0.00 0.00 0.44 3.07 4.64 -1.54 -2.10 113.55 118.06 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 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 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 -2.68 0.10 0.00 4.77 5.02 -0.99 -1.53 118.16 122.86 1g63 n LYS 41 Ca 0.00 0.19 0.13 0.00 -2.02 0.00 0.00 58.31 56.61 1g63 n LYS 41 Cb 0.20 -1.50 0.47 0.00 -0.02 0.00 0.00 35.03 34.17 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 -1.41 0.83 -0.06 4.39 5.03 -0.79 -4.01 115.26 119.24 1g63 n ASN 42 Ca 0.06 -0.78 -0.06 0.00 0.87 0.00 0.00 54.58 54.66 1g63 n ASN 42 Cb 0.16 0.05 -0.11 0.00 -1.02 0.00 0.00 39.78 38.87 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 -0.75 0.00 -4.01 3.10 3.01 -0.58 -5.06 117.46 113.18 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 0.32 -0.65 -0.07 0.00 -0.01 0.00 0.00 39.48 39.08 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 -2.37 0.03 -0.57 4.37 -4.36 -1.19 -4.88 121.20 112.22 1g63 s ILE 44 Ca -0.07 -1.47 -0.20 0.00 -0.26 0.00 0.00 60.65 58.65 1g63 s ILE 44 Cb 0.04 -2.08 0.08 0.00 1.25 0.00 0.00 42.46 41.75 1g63 s ILE 44 CO 0.56 -0.12 0.76 0.21 0.24 0.00 0.00 174.94 176.58 1g63 s ASN 45 N -3.01 6.21 0.54 4.36 3.84 -1.26 -4.63 114.94 120.98 1g63 s ASN 45 Ca 0.22 -1.07 0.24 0.00 0.21 0.00 0.00 52.86 52.47 1g63 s ASN 45 Cb 0.02 -2.34 1.50 0.00 -0.55 0.00 0.00 41.25 39.89 1g63 s ASN 45 CO 0.05 -1.12 2.15 0.71 -2.79 0.00 0.00 177.10 176.10 1g63 h THR 46 N 5.92 0.72 0.00 -5.21 1.35 -1.93 -2.69 112.91 111.07 1g63 h THR 46 Ca -0.28 -0.25 -0.01 0.00 -0.55 0.00 0.00 66.41 65.32 1g63 h THR 46 Cb 1.08 1.15 -0.00 0.00 -1.73 0.00 0.00 68.15 68.65 1g63 h THR 46 CO 1.07 0.06 -0.04 0.44 -0.25 0.00 0.00 175.52 176.80 1g63 h ASP 47 N 0.00 0.00 -0.36 5.36 3.32 -2.02 -1.79 116.42 120.93 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 0.14 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 1g63 h ASP 47 CO 0.01 0.04 0.20 0.58 -1.72 0.00 0.00 179.24 178.35 1g63 h VAL 48 N 0.00 1.13 0.00 -1.35 2.07 -1.91 -1.60 116.25 114.60 1g63 h VAL 48 Ca -0.00 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1g63 h VAL 48 Cb 0.10 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1g63 h VAL 48 CO 0.01 0.15 0.00 -0.07 0.02 0.00 0.00 177.57 177.68 1g63 h LEU 49 N 0.55 0.00 -2.25 2.57 -0.00 -1.51 -0.01 115.31 114.65 1g63 h LEU 49 Ca 0.14 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 58.01 1g63 h LEU 49 Cb 0.05 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.71 1g63 h LEU 49 CO -0.02 0.00 -0.02 0.11 -0.00 0.00 0.00 178.44 178.51 1g63 h LYS 50 N 0.00 0.00 0.00 1.13 1.57 -1.44 0.15 116.57 117.99 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 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1g63 h LYS 50 CO 0.00 0.02 -0.02 1.28 -0.57 0.00 0.00 179.45 180.16 1g63 n LEU 51 N -3.21 0.76 -0.01 2.94 4.77 -0.02 -4.13 117.00 118.10 1g63 n LEU 51 Ca -0.02 0.56 -0.02 0.00 -0.03 0.00 0.00 56.01 56.51 1g63 n LEU 51 Cb 0.18 -0.33 -0.02 0.00 -2.33 0.00 0.00 43.42 40.93 1g63 n LEU 51 CO 0.25 -0.17 -0.60 0.49 -1.33 0.00 0.00 177.39 176.03 1g63 n PHE 52 N -2.21 0.00 -2.80 -1.77 3.01 -0.61 -5.05 117.46 108.03 1g63 n PHE 52 Ca 0.06 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.22 1g63 n PHE 52 Cb 0.43 -0.14 -0.02 0.00 -0.01 0.00 0.00 39.48 39.74 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 0.97 0.93 -4.16 0.00 3.32 -1.80 -3.45 116.42 112.23 1g63 h ASP 54 Ca -0.47 -0.63 -0.15 0.00 0.02 0.00 0.00 57.03 55.80 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 1.40 -0.38 0.20 -1.72 0.00 0.00 179.24 179.37 1g63 s ASN 55 N -7.07 -0.24 -0.18 6.45 -0.87 -1.26 -5.05 114.94 106.72 1g63 s ASN 55 Ca -0.11 0.39 -0.00 0.00 -1.57 0.00 0.00 52.86 51.57 1g63 s ASN 55 Cb 0.08 0.48 0.01 0.00 -0.02 0.00 0.00 41.25 41.80 1g63 s ASN 55 CO 0.90 -0.19 -0.16 -0.22 -2.57 0.00 0.00 177.10 174.86 1g63 s LEU 56 N -0.28 2.36 -0.38 0.60 2.96 -1.26 -1.45 118.68 121.23 1g63 s LEU 56 Ca -0.04 -0.56 -0.19 0.00 -0.22 0.00 0.00 54.13 53.12 1g63 s LEU 56 Cb -0.03 -1.55 0.01 0.00 0.50 0.00 0.00 46.19 45.12 1g63 s LEU 56 CO 0.01 0.01 0.56 -0.31 -1.32 0.00 0.00 176.35 175.30 1g63 s TYR 57 N 1.23 3.14 -0.31 5.38 1.51 -0.42 -5.00 117.35 122.89 1g63 s TYR 57 Ca 0.03 0.08 -0.01 0.00 -1.01 0.00 0.00 57.07 56.16 1g63 s TYR 57 Cb -0.14 -3.06 0.06 0.00 -0.11 0.00 0.00 41.96 38.71 1g63 s TYR 57 CO -0.08 -0.66 0.01 0.34 -1.11 0.00 0.00 175.55 174.05 1g63 s ASP 58 N 1.83 4.85 0.25 2.29 3.68 -1.26 -4.36 116.67 123.96 1g63 s ASP 58 Ca 0.20 -1.45 0.24 0.00 2.13 0.00 0.00 52.55 53.67 1g63 s ASP 58 Cb -0.15 -1.69 0.96 0.00 -1.45 0.00 0.00 42.92 40.58 1g63 s ASP 58 CO 0.15 -0.29 1.71 -1.84 0.13 0.00 0.00 175.17 175.03 1g63 n GLU 59 N 4.56 0.19 0.04 4.34 0.28 -1.26 -1.55 120.64 127.24 1g63 n GLU 59 Ca -0.11 0.40 -0.21 0.00 -0.16 0.00 0.00 57.16 57.08 1g63 n GLU 59 Cb 0.43 -1.85 -0.14 0.00 1.43 0.00 0.00 31.44 31.30 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 -0.41 3.84 2.04 -1.97 -2.46 117.51 119.78 1g63 h ILE 60 Ca 0.00 -2.49 -0.09 0.00 1.00 0.00 0.00 64.86 63.28 1g63 h ILE 60 Cb 0.40 2.93 -0.02 0.00 -0.74 0.00 0.00 36.82 39.39 1g63 h ILE 60 CO 0.00 0.73 -0.11 0.50 0.00 0.00 0.00 178.15 179.27 1g63 h LYS 61 N -0.25 0.72 -2.77 2.37 3.64 -1.96 -3.38 116.57 114.94 1g63 h LYS 61 Ca -0.24 -0.23 -0.57 0.00 -1.27 0.00 0.00 60.65 58.33 1g63 h LYS 61 Cb 1.79 -0.06 -0.39 0.00 -0.41 0.00 0.00 32.23 33.15 1g63 h LYS 61 CO 0.13 0.81 -0.81 0.34 -2.27 0.00 0.00 179.45 177.65 1g63 s ASP 62 N -6.71 3.29 0.23 4.20 3.68 -0.60 -5.00 116.67 115.77 1g63 s ASP 62 Ca -0.09 -1.95 0.20 0.00 2.13 0.00 0.00 52.55 52.84 1g63 s ASP 62 Cb 0.14 -0.50 0.92 0.00 -1.45 0.00 0.00 42.92 42.03 1g63 s ASP 62 CO 0.81 -0.35 1.61 -2.65 0.13 0.00 0.00 175.17 174.72 1g63 n PRO 63 N 4.38 0.14 -1.23 4.34 -0.02 -0.93 -3.19 135.00 138.49 1g63 n PRO 63 Ca 0.06 0.48 -0.17 0.00 -2.02 0.00 0.00 63.50 61.85 1g63 n PRO 63 Cb 0.38 -1.83 0.13 0.00 -0.02 0.00 0.00 33.50 32.17 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 -2.10 5.22 -4.76 2.45 7.99 -1.26 -5.03 117.00 119.51 1g63 n LEU 64 Ca 0.01 -4.10 -0.41 0.00 -0.01 0.00 0.00 56.01 51.50 1g63 n LEU 64 Cb 0.14 -0.65 -0.02 0.00 -0.11 0.00 0.00 43.42 42.78 1g63 n LEU 64 CO 0.14 1.49 1.10 -0.22 -1.51 0.00 0.00 177.39 178.39 1g63 s LEU 65 N -3.45 4.38 -0.76 2.23 2.96 -1.19 -4.93 118.68 117.91 1g63 s LEU 65 Ca 0.51 2.77 -0.25 0.00 -0.22 0.00 0.00 54.13 56.94 1g63 s LEU 65 Cb 0.43 -3.64 0.05 0.00 0.50 0.00 0.00 46.19 43.54 1g63 s LEU 65 CO 0.01 -0.71 1.19 0.21 -1.32 0.00 0.00 176.35 175.73 1g63 s ASN 66 N 0.09 6.24 0.51 3.68 3.84 -1.26 -4.88 114.94 123.15 1g63 s ASN 66 Ca 0.56 -0.85 0.19 0.00 0.21 0.00 0.00 52.86 52.98 1g63 s ASN 66 Cb -0.43 -2.51 1.30 0.00 -0.55 0.00 0.00 41.25 39.06 1g63 s ASN 66 CO 0.49 -1.62 2.10 1.12 -2.79 0.00 0.00 177.10 176.40 1g63 h HIS 67 N 9.78 0.00 -0.22 0.43 2.07 -1.97 -1.95 115.15 123.28 1g63 h HIS 67 Ca -0.19 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.28 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 0.09 -0.04 0.82 -3.07 0.00 0.00 177.93 176.82 1g63 h ILE 68 N 0.00 1.28 -0.71 6.12 2.04 -1.96 -1.81 117.51 122.47 1g63 h ILE 68 Ca -0.00 -1.02 -0.06 0.00 1.00 0.00 0.00 64.86 64.78 1g63 h ILE 68 Cb 0.17 1.49 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 1g63 h ILE 68 CO 0.01 0.31 0.22 0.78 0.00 0.00 0.00 178.15 179.47 1g63 h ASN 69 N 0.16 1.02 -0.60 1.72 -0.26 -1.87 -0.87 115.58 114.89 1g63 h ASN 69 Ca 0.06 -0.19 0.04 0.00 -0.56 0.00 0.00 56.30 55.65 1g63 h ASN 69 Cb 0.49 -0.27 -0.04 0.00 -1.06 0.00 0.00 38.32 37.44 1g63 h ASN 69 CO 0.02 0.95 0.35 0.40 -1.06 0.00 0.00 177.43 178.09 1g63 h ILE 70 N 1.05 1.03 -0.42 2.81 2.04 -1.20 0.41 117.51 123.22 1g63 h ILE 70 Ca 0.23 -0.23 -0.09 0.00 1.00 0.00 0.00 64.86 65.76 1g63 h ILE 70 Cb 0.30 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 1g63 h ILE 70 CO -0.01 0.12 -0.09 0.58 0.00 0.00 0.00 178.15 178.76 1g63 h VAL 71 N 0.68 1.27 0.00 1.67 2.07 -0.86 -2.96 116.25 118.13 1g63 h VAL 71 Ca 0.25 -1.19 -0.06 0.00 0.82 0.00 0.00 66.70 66.52 1g63 h VAL 71 Cb 0.07 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 1g63 h VAL 71 CO -0.12 0.40 -0.29 -0.33 0.02 0.00 0.00 177.57 177.25 1g63 h GLU 72 N 0.64 0.00 0.00 1.57 5.08 -0.80 -2.73 114.58 118.34 1g63 h GLU 72 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1g63 h GLU 72 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1g63 h GLU 72 CO 0.04 0.29 0.00 -1.71 -1.00 0.00 0.00 179.01 176.63 1g63 n ASN 73 N -3.74 0.00 -4.21 1.42 4.05 0.10 -4.82 115.26 108.07 1g63 n ASN 73 Ca -0.01 -0.18 -0.22 0.00 0.45 0.00 0.00 54.58 54.62 1g63 n ASN 73 Cb 0.39 -0.25 -0.13 0.00 1.23 0.00 0.00 39.78 41.02 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 -2.50 1.49 -0.13 1.20 3.76 -1.03 -4.70 115.29 113.38 1g63 s HIS 74 Ca 0.26 -0.40 0.17 0.00 -0.15 0.00 0.00 55.06 54.95 1g63 s HIS 74 Cb 0.17 -0.86 -0.23 0.00 1.11 0.00 0.00 32.58 32.78 1g63 s HIS 74 CO 0.38 0.10 0.45 0.39 -0.85 0.00 0.00 174.74 175.21 1g63 n GLU 75 N 1.54 0.66 -4.40 1.40 1.02 -0.14 -4.91 120.64 115.80 1g63 n GLU 75 Ca -0.19 0.08 -0.20 0.00 -0.02 0.00 0.00 57.16 56.83 1g63 n GLU 75 Cb 0.54 -1.65 -0.15 0.00 -0.02 0.00 0.00 31.44 30.16 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 -2.80 0.90 -0.19 -0.32 1.51 -1.16 -4.85 117.35 110.44 1g63 s TYR 76 Ca -0.07 -0.19 -0.01 0.00 -1.01 0.00 0.00 57.07 55.80 1g63 s TYR 76 Cb 0.08 -0.61 0.05 0.00 -0.11 0.00 0.00 41.96 41.37 1g63 s TYR 76 CO 0.84 -0.05 -0.04 0.42 -1.11 0.00 0.00 175.55 175.61 1g63 s ILE 77 N -0.06 1.14 -0.08 2.71 1.01 -0.37 -0.98 121.20 124.57 1g63 s ILE 77 Ca 0.01 -0.78 -0.01 0.00 0.00 0.00 0.00 60.65 59.87 1g63 s ILE 77 Cb -0.06 -1.39 -0.03 0.00 0.01 0.00 0.00 42.46 40.99 1g63 s ILE 77 CO -0.00 0.01 -0.02 -0.76 0.00 0.00 0.00 174.94 174.17 1g63 s LEU 78 N 1.60 3.43 -0.47 2.97 1.02 0.31 -0.54 118.68 126.99 1g63 s LEU 78 Ca -0.01 0.08 -0.07 0.00 0.02 0.00 0.00 54.13 54.14 1g63 s LEU 78 Cb -0.17 -1.77 0.12 0.00 0.02 0.00 0.00 46.19 44.39 1g63 s LEU 78 CO -0.07 0.36 0.33 0.54 0.02 0.00 0.00 176.35 177.53 1g63 s VAL 79 N -0.80 3.96 -0.10 -1.59 0.11 -0.17 0.11 120.40 121.92 1g63 s VAL 79 Ca 0.12 -1.96 -0.03 0.00 -2.93 0.00 0.00 61.98 57.18 1g63 s VAL 79 Cb -0.11 -3.63 0.05 0.00 -1.53 0.00 0.00 36.38 31.16 1g63 s VAL 79 CO 0.02 -0.77 0.13 -0.22 -3.33 0.00 0.00 175.10 170.93 1g63 s LEU 80 N 1.18 0.05 0.59 2.54 2.96 -0.46 -1.93 118.68 123.60 1g63 s LEU 80 Ca 0.07 0.04 -0.13 0.00 -0.22 0.00 0.00 54.13 53.89 1g63 s LEU 80 Cb -0.24 0.10 -0.05 0.00 0.50 0.00 0.00 46.19 46.49 1g63 s LEU 80 CO -0.02 -0.27 1.02 -2.84 -1.32 0.00 0.00 176.35 172.91 1g63 s PRO 81 N 2.24 3.64 -0.24 0.98 0.02 -1.26 -4.08 135.00 136.29 1g63 s PRO 81 Ca 0.04 0.89 -0.05 0.00 0.02 0.00 0.00 61.00 61.89 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 -0.06 -0.53 0.01 0.00 -0.33 0.00 0.00 177.00 176.08 1g63 s ALA 82 N -2.90 2.96 0.55 -1.55 0.00 -0.45 -2.57 121.76 117.80 1g63 s ALA 82 Ca 0.57 -1.19 -0.13 0.00 0.00 0.00 0.00 51.96 51.22 1g63 s ALA 82 Cb -0.11 -1.88 -0.06 0.00 0.00 0.00 0.00 23.12 21.07 1g63 s ALA 82 CO 0.44 -0.51 0.98 -1.54 0.00 0.00 0.00 175.76 175.13 1g63 s SER 83 N 1.53 6.41 0.20 0.00 1.04 -1.26 -1.27 113.70 120.34 1g63 s SER 83 Ca 0.06 1.42 -0.10 0.00 0.48 0.00 0.00 55.95 57.80 1g63 s SER 83 Cb -0.15 -2.46 0.21 0.00 0.10 0.00 0.00 66.02 63.72 1g63 s SER 83 CO -0.00 -0.70 1.81 0.00 0.98 0.00 0.00 173.24 175.32 1g63 h ALA 84 N 0.32 0.83 -0.13 5.32 0.00 -1.98 -1.55 119.26 122.07 1g63 h ALA 84 Ca -0.46 0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.51 1g63 h ALA 84 Cb 1.19 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 1g63 h ALA 84 CO 0.62 0.03 -0.19 -0.97 0.00 0.00 0.00 179.25 178.74 1g63 h ASN 85 N 0.65 -0.59 -0.53 0.00 -0.73 -1.99 -0.39 115.58 112.01 1g63 h ASN 85 Ca 0.28 0.10 -0.11 0.00 1.87 0.00 0.00 56.30 58.44 1g63 h ASN 85 Cb 0.16 0.27 -0.02 0.00 0.27 0.00 0.00 38.32 39.00 1g63 h ASN 85 CO -0.17 -0.24 -0.08 0.74 -0.37 0.00 0.00 177.43 177.32 1g63 h THR 86 N -0.24 1.27 -0.15 -3.57 2.02 -1.89 -1.08 112.91 109.26 1g63 h THR 86 Ca 0.10 -1.22 0.03 0.00 0.77 0.00 0.00 66.41 66.09 1g63 h THR 86 Cb 0.39 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 1g63 h THR 86 CO -0.27 0.43 -0.05 0.40 0.37 0.00 0.00 175.52 176.41 1g63 h ILE 87 N 0.91 0.82 -0.20 3.11 2.04 -0.93 0.72 117.51 123.99 1g63 h ILE 87 Ca 0.15 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.95 1g63 h ILE 87 Cb 0.63 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.52 1g63 h ILE 87 CO 0.04 0.00 -0.15 0.78 0.00 0.00 0.00 178.15 178.82 1g63 h ASN 88 N -0.02 0.31 -0.11 1.72 -0.26 -0.90 -1.35 115.58 114.97 1g63 h ASN 88 Ca 0.08 -0.07 -0.04 0.00 -0.56 0.00 0.00 56.30 55.70 1g63 h ASN 88 Cb 0.13 -0.08 -0.00 0.00 -1.06 0.00 0.00 38.32 37.31 1g63 h ASN 88 CO -0.17 0.49 -0.08 0.11 -1.06 0.00 0.00 177.43 176.72 1g63 h LYS 89 N 0.30 0.25 -0.50 0.81 1.57 -0.48 -2.57 116.57 115.95 1g63 h LYS 89 Ca 0.06 -0.12 0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1g63 h LYS 89 Cb 0.45 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.72 1g63 h LYS 89 CO 0.03 0.63 0.29 0.82 -0.57 0.00 0.00 179.45 180.64 1g63 h ILE 90 N -0.12 1.03 -0.42 1.86 2.04 -0.68 0.14 117.51 121.36 1g63 h ILE 90 Ca 0.02 -0.20 0.07 0.00 1.00 0.00 0.00 64.86 65.75 1g63 h ILE 90 Cb 0.56 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1g63 h ILE 90 CO 0.02 0.11 0.29 0.00 0.00 0.00 0.00 178.15 178.56 1g63 h ALA 91 N 1.23 2.02 -0.61 1.87 0.00 -1.21 -1.22 119.26 121.35 1g63 h ALA 91 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1g63 h ALA 91 Cb 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1g63 h ALA 91 CO -0.11 -0.11 0.00 0.09 0.00 0.00 0.00 179.25 179.13 1g63 n ASN 92 N -4.47 3.74 -0.25 0.00 4.13 -0.68 -4.95 115.26 112.78 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 -0.40 -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 0.59 3.66 7.41 0.00 -0.34 -4.97 105.19 113.15 1g63 n GLY 93 Ca 0.23 -0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 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 -1.90 4.63 -0.53 -0.61 1.01 0.36 -4.96 121.20 119.21 1g63 s ILE 94 Ca 0.00 1.97 0.06 0.00 0.00 0.00 0.00 60.65 62.68 1g63 s ILE 94 Cb 0.00 -4.27 0.22 0.00 0.01 0.00 0.00 42.46 38.42 1g63 s ILE 94 CO 0.00 -0.16 0.54 0.00 0.00 0.00 0.00 174.94 175.32 1g63 n ASP 96 N 1.67 2.97 -3.95 0.00 5.68 -1.26 -4.56 116.55 117.10 1g63 n ASP 96 Ca 0.25 -2.00 -0.10 0.00 -0.50 0.00 0.00 54.79 52.45 1g63 n ASP 96 Cb 0.45 -0.37 -0.06 0.00 -1.14 0.00 0.00 41.12 40.00 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 -1.01 -0.03 0.12 -1.12 2.20 -1.26 -5.05 114.94 108.80 1g63 s ASN 97 Ca 0.37 -0.86 -0.21 0.00 -0.94 0.00 0.00 52.86 51.22 1g63 s ASN 97 Cb 0.19 0.49 -0.05 0.00 -2.00 0.00 0.00 41.25 39.88 1g63 s ASN 97 CO 0.25 -0.97 1.71 0.25 -2.94 0.00 0.00 177.10 175.39 1g63 h LEU 98 N 2.43 -0.19 -0.22 3.54 5.85 -1.92 -0.21 115.31 124.59 1g63 h LEU 98 Ca -0.30 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.53 1g63 h LEU 98 Cb 1.24 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 42.32 1g63 h LEU 98 CO 0.44 -0.07 -0.19 0.25 -0.34 0.00 0.00 178.44 178.53 1g63 h LEU 99 N -0.03 -0.60 -1.36 2.25 6.46 -1.94 0.12 115.31 120.21 1g63 h LEU 99 Ca 0.08 0.12 -0.07 0.00 -0.12 0.00 0.00 57.88 57.89 1g63 h LEU 99 Cb 0.15 0.29 -0.01 0.00 -0.73 0.00 0.00 40.66 40.36 1g63 h LEU 99 CO -0.17 -0.23 -0.31 0.00 -0.62 0.00 0.00 178.44 177.11 1g63 h THR 100 N -0.19 1.12 -0.06 1.05 1.03 -1.87 -1.00 112.91 112.99 1g63 h THR 100 Ca 0.13 -1.12 -0.19 0.00 -0.01 0.00 0.00 66.41 65.22 1g63 h THR 100 Cb 0.39 1.62 -0.00 0.00 -1.07 0.00 0.00 68.15 69.08 1g63 h THR 100 CO -0.33 0.31 -0.79 0.74 -0.01 0.00 0.00 175.52 175.44 1g63 h THR 101 N 0.00 1.39 -0.53 0.00 2.02 -0.04 -2.64 112.91 113.12 1g63 h THR 101 Ca -0.00 -2.24 -0.12 0.00 0.77 0.00 0.00 66.41 64.82 1g63 h THR 101 Cb 0.59 2.20 -0.02 0.00 -1.74 0.00 0.00 68.15 69.19 1g63 h THR 101 CO 0.04 0.67 -0.12 0.58 0.37 0.00 0.00 175.52 177.06 1g63 h VAL 102 N 0.26 1.27 -0.06 3.16 2.07 -0.20 -2.52 116.25 120.23 1g63 h VAL 102 Ca -0.04 -1.28 -0.08 0.00 0.82 0.00 0.00 66.70 66.12 1g63 h VAL 102 Cb 1.38 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 1g63 h VAL 102 CO 0.13 0.45 -0.32 0.00 0.02 0.00 0.00 177.57 177.86 1g63 h LEU 104 N 0.09 0.10 -1.04 0.00 5.85 -1.31 -2.86 115.31 116.14 1g63 h LEU 104 Ca 0.01 -0.52 -0.02 0.00 0.84 0.00 0.00 57.88 58.19 1g63 h LEU 104 Cb 0.61 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.58 1g63 h LEU 104 CO 0.04 0.60 0.43 0.74 -0.34 0.00 0.00 178.44 179.92 1g63 h THR 105 N -0.40 1.23 -0.89 1.05 2.02 -1.31 -3.17 112.91 111.44 1g63 h THR 105 Ca 0.00 -0.58 -0.62 0.00 0.77 0.00 0.00 66.41 65.98 1g63 h THR 105 Cb 0.58 0.16 -0.34 0.00 -1.74 0.00 0.00 68.15 66.82 1g63 h THR 105 CO 0.01 0.26 0.25 0.61 0.37 0.00 0.00 175.52 177.02 1g63 n GLY 106 N -1.18 6.01 0.35 2.16 0.00 -0.31 -4.73 105.19 107.50 1g63 n GLY 106 Ca 0.08 -2.38 0.18 0.00 0.00 0.00 0.00 46.02 43.90 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 2.02 0.00 0.00 1.61 -0.00 -1.48 -1.17 116.97 117.95 1g63 h TYR 107 Ca 0.51 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 59.23 1g63 h TYR 107 Cb 1.13 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.86 1g63 h TYR 107 CO 1.22 0.00 -0.05 1.96 -0.00 0.00 0.00 178.16 181.29 1g63 h GLN 108 N 0.00 0.00 -0.29 0.10 4.20 -1.87 -3.11 115.11 114.13 1g63 h GLN 108 Ca 0.14 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 1g63 h GLN 108 Cb 0.71 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.49 1g63 h GLN 108 CO -0.00 0.05 0.00 1.63 -0.67 0.00 0.00 178.83 179.84 1g63 n LYS 109 N -3.14 2.87 -2.98 1.46 5.02 -0.46 -5.04 118.16 115.89 1g63 n LYS 109 Ca 0.02 -2.30 -0.40 0.00 -2.02 0.00 0.00 58.31 53.61 1g63 n LYS 109 Cb 0.42 -1.45 -0.05 0.00 -0.02 0.00 0.00 35.03 33.92 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 -1.66 4.43 -0.12 -0.35 2.96 -1.08 -1.23 118.68 121.63 1g63 s LEU 110 Ca 0.29 1.43 -0.01 0.00 -0.22 0.00 0.00 54.13 55.62 1g63 s LEU 110 Cb 0.19 -3.23 0.03 0.00 0.50 0.00 0.00 46.19 43.68 1g63 s LEU 110 CO 0.12 -0.01 -0.06 -0.36 -1.32 0.00 0.00 176.35 174.73 1g63 s PHE 111 N 0.06 1.38 -0.18 5.38 0.40 0.30 -2.82 117.98 122.49 1g63 s PHE 111 Ca 0.39 -0.71 -0.06 0.00 -0.60 0.00 0.00 56.93 55.95 1g63 s PHE 111 Cb -0.20 -1.17 -0.04 0.00 0.51 0.00 0.00 43.02 42.12 1g63 s PHE 111 CO 0.23 -0.50 0.04 0.42 0.70 0.00 0.00 175.22 176.10 1g63 s ILE 112 N 1.74 4.52 -0.59 0.64 1.01 0.99 -1.00 121.20 128.51 1g63 s ILE 112 Ca 0.04 -0.13 0.01 0.00 0.00 0.00 0.00 60.65 60.58 1g63 s ILE 112 Cb -0.13 -3.03 0.15 0.00 0.01 0.00 0.00 42.46 39.46 1g63 s ILE 112 CO -0.08 0.45 0.37 -0.36 0.00 0.00 0.00 174.94 175.33 1g63 s PHE 113 N 0.51 3.33 0.38 3.97 0.40 -0.81 -0.73 117.98 125.02 1g63 s PHE 113 Ca 0.02 -3.02 -0.27 0.00 -0.60 0.00 0.00 56.93 53.05 1g63 s PHE 113 Cb -0.13 -2.97 -0.11 0.00 0.51 0.00 0.00 43.02 40.32 1g63 s PHE 113 CO 0.01 -0.76 1.25 -2.30 0.70 0.00 0.00 175.22 174.13 1g63 n PRO 114 N 3.09 1.97 -3.61 0.24 -0.02 -1.26 -1.35 135.00 134.06 1g63 n PRO 114 Ca 0.08 0.69 -0.09 0.00 -2.02 0.00 0.00 63.50 62.16 1g63 n PRO 114 Cb 0.35 -2.31 -0.10 0.00 -0.02 0.00 0.00 33.50 31.42 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 -0.43 -0.09 0.04 2.55 3.84 -0.40 -4.73 114.94 115.71 1g63 s ASN 115 Ca 0.58 0.82 -0.29 0.00 0.21 0.00 0.00 52.86 54.19 1g63 s ASN 115 Cb -0.55 1.22 0.10 0.00 -0.55 0.00 0.00 41.25 41.47 1g63 s ASN 115 CO 0.60 -0.24 1.16 0.00 -2.79 0.00 0.00 177.10 175.83 1g63 s MET 116 N 2.58 0.68 0.55 0.43 0.23 -1.26 -4.49 119.30 118.03 1g63 s MET 116 Ca 0.01 -0.37 -0.20 0.00 -1.03 0.00 0.00 55.69 54.09 1g63 s MET 116 Cb -0.12 0.24 -0.05 0.00 -1.53 0.00 0.00 34.83 33.36 1g63 s MET 116 CO -0.13 -0.31 1.20 1.21 -2.03 0.00 0.00 175.02 174.96 1g63 s ASN 117 N -2.94 5.48 0.36 -1.18 3.84 -1.26 -4.26 114.94 114.98 1g63 s ASN 117 Ca 0.13 2.36 0.10 0.00 0.21 0.00 0.00 52.86 55.67 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 -1.39 1.85 -0.29 -2.79 0.00 0.00 177.10 174.46 1g63 h ILE 118 N 1.18 0.78 -0.39 -5.21 6.09 -1.93 -1.53 117.51 116.50 1g63 h ILE 118 Ca -0.50 -0.22 -0.06 0.00 -1.37 0.00 0.00 64.86 62.71 1g63 h ILE 118 Cb 1.28 0.08 -0.02 0.00 0.47 0.00 0.00 36.82 38.63 1g63 h ILE 118 CO 0.57 0.12 -0.01 -0.09 -3.07 0.00 0.00 178.15 175.66 1g63 h ARG 119 N 0.64 0.63 -0.23 2.19 2.43 -1.99 -2.37 114.38 115.68 1g63 h ARG 119 Ca 0.48 -0.15 -0.13 0.00 -0.81 0.00 0.00 59.98 59.37 1g63 h ARG 119 Cb 0.86 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.31 1g63 h ARG 119 CO -0.23 0.65 -0.40 0.52 -1.51 0.00 0.00 179.97 179.01 1g63 h MET 120 N 0.59 0.52 0.00 0.20 2.86 -1.65 -2.82 114.93 114.63 1g63 h MET 120 Ca 0.12 -0.26 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 1g63 h MET 120 Cb 0.39 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.05 1g63 h MET 120 CO 0.02 0.84 -0.02 2.35 1.06 0.00 0.00 176.91 181.15 1g63 h TRP 121 N 0.43 0.00 -0.00 -0.22 2.91 -1.11 -1.96 115.95 116.01 1g63 h TRP 121 Ca 0.04 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.06 1g63 h TRP 121 Cb 0.88 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.53 1g63 h TRP 121 CO 0.03 0.02 -0.00 0.41 -1.03 0.00 0.00 178.44 177.87 1g63 n GLY 122 N -1.34 -0.86 3.70 2.65 0.00 -1.06 -4.72 105.19 103.55 1g63 n GLY 122 Ca -0.03 -0.24 -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 -2.05 6.50 0.22 1.61 3.84 -0.74 -4.90 114.94 119.42 1g63 s ASN 123 Ca 0.45 2.67 -0.08 0.00 0.21 0.00 0.00 52.86 56.10 1g63 s ASN 123 Cb 0.22 -2.58 0.27 0.00 -0.55 0.00 0.00 41.25 38.61 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 7.82 0.67 -0.31 0.43 0.11 -1.91 -1.44 132.00 137.38 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 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1g63 h PRO 124 CO 0.94 0.44 -0.34 0.74 -0.21 0.00 0.00 178.00 179.57 1g63 h PHE 125 N 0.69 0.79 0.24 0.65 -1.00 -1.98 -0.59 116.94 115.74 1g63 h PHE 125 Ca 0.32 -0.21 -0.01 0.00 2.81 0.00 0.00 57.97 60.87 1g63 h PHE 125 Cb 0.22 -0.18 0.00 0.00 3.61 0.00 0.00 35.95 39.61 1g63 h PHE 125 CO -0.08 0.93 -0.11 1.25 -1.61 0.00 0.00 178.31 178.68 1g63 h LEU 126 N 0.57 -0.27 -0.88 1.54 5.85 -1.83 -2.29 115.31 118.01 1g63 h LEU 126 Ca 0.06 -0.15 0.07 0.00 0.84 0.00 0.00 57.88 58.70 1g63 h LEU 126 Cb 0.85 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.89 1g63 h LEU 126 CO 0.07 0.00 0.54 1.56 -0.34 0.00 0.00 178.44 180.28 1g63 h GLN 127 N -0.55 0.93 -0.68 1.25 1.08 -1.20 0.41 115.11 116.35 1g63 h GLN 127 Ca -0.03 -0.06 -0.02 0.00 -1.45 0.00 0.00 58.65 57.10 1g63 h GLN 127 Cb 0.41 -0.21 -0.03 0.00 -0.05 0.00 0.00 27.48 27.59 1g63 h GLN 127 CO 0.05 0.62 0.36 -0.22 -0.95 0.00 0.00 178.83 178.69 1g63 h LYS 128 N 0.96 0.94 -0.10 1.46 3.64 -1.05 -1.40 116.57 121.03 1g63 h LYS 128 Ca 0.39 -0.11 -0.16 0.00 -1.27 0.00 0.00 60.65 59.50 1g63 h LYS 128 Cb 0.23 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1g63 h LYS 128 CO -0.19 0.70 -0.64 -0.91 -2.27 0.00 0.00 179.45 176.14 1g63 h ASN 129 N 0.95 0.42 -0.54 4.20 -0.26 -0.58 -2.03 115.58 117.74 1g63 h ASN 129 Ca 0.24 -0.25 -0.09 0.00 -0.56 0.00 0.00 56.30 55.64 1g63 h ASN 129 Cb 0.04 -0.12 -0.02 0.00 -1.06 0.00 0.00 38.32 37.16 1g63 h ASN 129 CO -0.04 0.95 0.01 0.40 -1.06 0.00 0.00 177.43 177.70 1g63 h ILE 130 N 0.27 1.26 -0.36 2.81 2.04 -0.33 -0.09 117.51 123.10 1g63 h ILE 130 Ca -0.01 -1.09 -0.04 0.00 1.00 0.00 0.00 64.86 64.72 1g63 h ILE 130 Cb 1.18 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 38.05 1g63 h ILE 130 CO 0.11 0.39 0.07 0.44 0.00 0.00 0.00 178.15 179.16 1g63 h ASP 131 N 0.90 0.56 -0.77 1.72 3.45 -1.18 -1.60 116.42 119.50 1g63 h ASP 131 Ca 0.17 -0.25 0.06 0.00 0.43 0.00 0.00 57.03 57.44 1g63 h ASP 131 Cb 0.51 -0.15 -0.06 0.00 -0.56 0.00 0.00 39.33 39.07 1g63 h ASP 131 CO 0.02 0.66 0.46 0.25 -1.57 0.00 0.00 179.24 179.07 1g63 h LEU 132 N 0.43 0.72 -0.26 1.55 5.85 -0.91 -0.05 115.31 122.64 1g63 h LEU 132 Ca 0.11 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1g63 h LEU 132 Cb 0.33 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 1g63 h LEU 132 CO 0.00 0.46 0.07 -0.07 -0.34 0.00 0.00 178.44 178.57 1g63 h LEU 133 N 0.85 0.39 -0.51 2.25 3.38 -0.77 -3.05 115.31 117.85 1g63 h LEU 133 Ca 0.34 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1g63 h LEU 133 Cb 0.16 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1g63 h LEU 133 CO -0.17 0.51 0.22 0.11 0.09 0.00 0.00 178.44 179.20 1g63 h LYS 134 N 0.25 0.75 0.00 1.13 1.57 -0.81 -1.83 116.57 117.64 1g63 h LYS 134 Ca 0.08 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1g63 h LYS 134 Cb 0.27 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.45 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 -4.57 0.00 -0.97 0.86 5.03 -0.07 -2.63 115.26 112.91 1g63 n ASN 135 Ca 0.02 -1.12 0.04 0.00 0.87 0.00 0.00 54.58 54.39 1g63 n ASN 135 Cb 0.14 0.00 0.08 0.00 -1.02 0.00 0.00 39.78 38.98 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 -0.56 1.17 -0.75 6.41 3.02 -0.76 -5.01 115.26 118.79 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 -0.21 -4.19 -4.56 6.41 9.92 -1.08 -5.01 116.55 117.83 1g63 n ASP 137 Ca 0.10 0.24 -0.38 0.00 -0.53 0.00 0.00 54.79 54.22 1g63 n ASP 137 Cb 0.91 -2.56 -0.11 0.00 -0.64 0.00 0.00 41.12 38.72 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 -0.19 2.53 1.01 -0.80 -4.82 120.40 120.88 1g63 s VAL 138 Ca 0.00 0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.76 1g63 s VAL 138 Cb 0.00 -3.44 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 1g63 s VAL 138 CO 0.00 0.25 1.36 -0.54 0.00 0.00 0.00 175.10 176.17 1g63 s LYS 139 N 1.73 4.11 -0.18 2.72 3.01 -1.13 -3.90 119.74 126.10 1g63 s LYS 139 Ca 0.07 1.63 0.01 0.00 -1.01 0.00 0.00 55.97 56.67 1g63 s LYS 139 Cb -0.16 -3.85 0.02 0.00 -1.01 0.00 0.00 37.83 32.84 1g63 s LYS 139 CO 0.09 -0.88 -0.19 0.08 0.51 0.00 0.00 175.35 174.96 1g63 s VAL 140 N 3.94 2.03 0.28 3.17 1.01 -1.26 -0.00 120.40 129.57 1g63 s VAL 140 Ca 0.59 -0.94 -0.28 0.00 0.00 0.00 0.00 61.98 61.35 1g63 s VAL 140 Cb -0.22 -1.84 -0.09 0.00 0.00 0.00 0.00 36.38 34.22 1g63 s VAL 140 CO 0.20 0.52 0.95 -0.47 0.00 0.00 0.00 175.10 176.30 1g63 s TYR 141 N 1.30 3.82 -0.36 5.22 6.14 0.09 -4.97 117.35 128.58 1g63 s TYR 141 Ca 0.05 1.84 -0.26 0.00 0.64 0.00 0.00 57.07 59.34 1g63 s TYR 141 Cb -0.13 -2.97 0.01 0.00 0.42 0.00 0.00 41.96 39.29 1g63 s TYR 141 CO -0.13 0.28 0.92 -1.12 0.64 0.00 0.00 175.55 176.14 1g63 s SER 142 N -1.37 6.68 0.13 4.32 0.01 -1.26 -4.35 113.70 117.86 1g63 s SER 142 Ca 0.46 0.59 -0.34 0.00 1.31 0.00 0.00 55.95 57.97 1g63 s SER 142 Cb -0.23 -2.46 -0.17 0.00 0.21 0.00 0.00 66.02 63.37 1g63 s SER 142 CO 0.29 -0.85 1.02 -2.65 0.41 0.00 0.00 173.24 171.45 1g63 n PRO 143 N 6.75 0.64 -2.03 12.44 -0.02 -1.26 -4.99 135.00 146.53 1g63 n PRO 143 Ca 0.07 0.23 -0.29 0.00 -2.02 0.00 0.00 63.50 61.49 1g63 n PRO 143 Cb 0.48 -1.63 0.05 0.00 -0.02 0.00 0.00 33.50 32.38 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 -0.19 5.31 0.23 2.55 1.11 -1.26 -4.97 116.67 119.45 1g63 s ASP 144 Ca 0.76 0.93 -0.14 0.00 0.18 0.00 0.00 52.55 54.29 1g63 s ASP 144 Cb -0.98 -1.72 0.00 0.00 1.07 0.00 0.00 42.92 41.29 1g63 s ASP 144 CO 0.54 -1.37 0.48 -0.04 1.18 0.00 0.00 175.17 175.96 1g63 s MET 145 N -5.29 1.50 -0.10 8.23 -1.94 -1.26 -2.62 119.30 117.82 1g63 s MET 145 Ca 0.58 -1.16 0.04 0.00 -1.71 0.00 0.00 55.69 53.44 1g63 s MET 145 Cb -0.11 0.48 -0.00 0.00 2.01 0.00 0.00 34.83 37.21 1g63 s MET 145 CO 0.49 -0.62 -0.24 1.21 -0.01 0.00 0.00 175.02 175.85 1g63 s ASN 158 N -2.98 3.09 0.10 3.03 3.04 -1.26 -4.82 114.94 115.14 1g63 s ASN 158 Ca 0.19 -0.56 -0.26 0.00 0.04 0.00 0.00 52.86 52.27 1g63 s ASN 158 Cb -0.01 -1.37 0.08 0.00 -1.54 0.00 0.00 41.25 38.41 1g63 s ASN 158 CO 0.06 0.17 0.98 0.21 -3.04 0.00 0.00 177.10 175.47 1g63 s ASN 159 N 0.30 -0.20 0.22 -4.21 3.04 -1.26 -4.92 114.94 107.90 1g63 s ASN 159 Ca -0.18 -0.29 -0.30 0.00 0.04 0.00 0.00 52.86 52.13 1g63 s ASN 159 Cb -0.18 0.43 -0.08 0.00 -1.54 0.00 0.00 41.25 39.88 1g63 s ASN 159 CO 0.09 -0.78 1.10 -0.63 -3.04 0.00 0.00 177.10 173.83 1g63 s ILE 160 N -3.17 3.72 0.26 -5.21 1.09 -1.26 -4.98 121.20 111.65 1g63 s ILE 160 Ca 0.11 1.56 0.11 0.00 -1.10 0.00 0.00 60.65 61.33 1g63 s ILE 160 Cb -0.01 -4.00 -0.05 0.00 -1.06 0.00 0.00 42.46 37.35 1g63 s ILE 160 CO -0.01 0.31 -0.18 0.42 -0.10 0.00 0.00 174.94 175.38 1g63 s THR 161 N -0.57 2.26 0.69 2.92 -4.23 -1.08 -4.83 115.64 110.80 1g63 s THR 161 Ca 0.48 -2.34 -0.16 0.00 -1.18 0.00 0.00 61.69 58.48 1g63 s THR 161 Cb -0.30 -2.26 0.01 0.00 1.34 0.00 0.00 72.50 71.29 1g63 s THR 161 CO 0.37 -0.44 1.23 -0.04 -0.54 0.00 0.00 174.62 175.20 1g63 s MET 162 N -3.55 2.37 0.43 3.99 -1.94 -1.26 -4.06 119.30 115.27 1g63 s MET 162 Ca 0.28 1.84 -0.24 0.00 -1.71 0.00 0.00 55.69 55.86 1g63 s MET 162 Cb -0.03 -1.85 -0.08 0.00 2.01 0.00 0.00 34.83 34.88 1g63 s MET 162 CO 0.13 -1.68 1.19 -2.14 -0.01 0.00 0.00 175.02 172.51 1g63 s PRO 163 N -3.69 3.91 0.36 2.03 0.02 -1.26 -4.91 135.00 131.47 1g63 s PRO 163 Ca 0.77 1.87 -0.25 0.00 0.02 0.00 0.00 61.00 63.40 1g63 s PRO 163 Cb -0.31 -2.58 -0.09 0.00 0.02 0.00 0.00 34.50 31.53 1g63 s PRO 163 CO 0.42 -0.45 1.04 1.21 -0.33 0.00 0.00 177.00 178.89 1g63 s ASN 164 N -1.16 6.97 0.28 2.53 3.84 -1.26 -4.87 114.94 121.27 1g63 s ASN 164 Ca 0.60 2.04 0.01 0.00 0.21 0.00 0.00 52.86 55.72 1g63 s ASN 164 Cb -0.31 -2.59 0.57 0.00 -0.55 0.00 0.00 41.25 38.37 1g63 s ASN 164 CO 0.39 -0.34 1.80 -0.29 -2.79 0.00 0.00 177.10 175.87 1g63 h ILE 165 N 2.45 0.83 -0.49 -5.21 6.09 -1.99 0.09 117.51 119.28 1g63 h ILE 165 Ca -0.48 -0.29 0.08 0.00 -1.37 0.00 0.00 64.86 62.81 1g63 h ILE 165 Cb 1.21 -0.08 -0.07 0.00 0.47 0.00 0.00 36.82 38.35 1g63 h ILE 165 CO 0.64 0.15 0.11 -0.08 -3.07 0.00 0.00 178.15 175.90 1g63 h GLU 166 N 0.84 0.24 -0.06 2.19 4.81 -1.99 -0.85 114.58 119.76 1g63 h GLU 166 Ca 0.50 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.69 1g63 h GLU 166 Cb 0.60 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.92 1g63 h GLU 166 CO -0.31 0.16 -0.03 -0.91 -0.73 0.00 0.00 179.01 177.18 1g63 h ASN 167 N 0.25 0.13 -0.87 1.04 4.21 -1.42 -2.39 115.58 116.52 1g63 h ASN 167 Ca 0.25 -0.44 0.06 0.00 1.21 0.00 0.00 56.30 57.38 1g63 h ASN 167 Cb 0.32 -0.04 -0.06 0.00 -1.12 0.00 0.00 38.32 37.43 1g63 h ASN 167 CO -0.31 0.54 0.57 -0.37 -1.29 0.00 0.00 177.43 176.56 1g63 h VAL 168 N -0.28 1.06 -0.22 2.81 -1.51 -0.96 0.11 116.25 117.26 1g63 h VAL 168 Ca 0.01 -0.34 -0.01 0.00 -1.23 0.00 0.00 66.70 65.14 1g63 h VAL 168 Cb 0.49 -0.00 -0.01 0.00 -2.13 0.00 0.00 31.29 29.64 1g63 h VAL 168 CO 0.01 0.18 0.11 0.25 -1.23 0.00 0.00 177.57 176.89 1g63 h LEU 169 N 0.98 0.27 0.70 4.19 5.85 -1.10 -0.52 115.31 125.69 1g63 h LEU 169 Ca 0.37 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.96 1g63 h LEU 169 Cb 0.20 -0.07 0.01 0.00 0.37 0.00 0.00 40.66 41.16 1g63 h LEU 169 CO -0.13 0.29 -0.34 0.78 -0.34 0.00 0.00 178.44 178.70 1g63 h ASN 170 N 0.23 -0.80 -0.63 1.25 -0.26 -0.78 -2.89 115.58 111.70 1g63 h ASN 170 Ca 0.08 0.01 0.13 0.00 -0.56 0.00 0.00 56.30 55.95 1g63 h ASN 170 Cb 0.08 0.21 -0.11 0.00 -1.06 0.00 0.00 38.32 37.44 1g63 h ASN 170 CO -0.01 -0.44 -0.06 0.15 -1.06 0.00 0.00 177.43 176.00 1g63 h PHE 171 N -1.19 -0.16 0.00 1.19 3.57 -0.83 0.80 116.94 120.30 1g63 h PHE 171 Ca -0.10 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.45 1g63 h PHE 171 Cb 0.75 0.17 -0.00 0.00 2.79 0.00 0.00 35.95 39.66 1g63 h PHE 171 CO 0.00 -0.22 -0.03 0.28 -2.23 0.00 0.00 178.31 176.11 1g63 h VAL 172 N 0.06 0.09 0.00 1.41 2.07 -1.15 -3.28 116.25 115.45 1g63 h VAL 172 Ca 0.32 -0.49 -0.31 0.00 0.82 0.00 0.00 66.70 67.04 1g63 h VAL 172 Cb 0.52 1.44 -0.06 0.00 -1.52 0.00 0.00 31.29 31.67 1g63 h VAL 172 CO -0.59 0.03 -2.18 0.18 0.02 0.00 0.00 177.57 175.03 1g63 n LEU 173 N -3.16 2.95 0.00 2.57 7.99 -0.32 -5.09 117.00 121.94 1g63 n LEU 173 Ca -0.00 -0.10 0.10 0.00 -0.01 0.00 0.00 56.01 56.00 1g63 n LEU 173 Cb 0.28 -0.73 0.61 0.00 -0.11 0.00 0.00 43.42 43.47 1g63 n LEU 173 CO 0.27 0.84 0.80 0.59 -1.51 0.00 0.00 177.39 178.38