#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sym s SER 1 N 0.00 0.88 -0.08 7.83 1.04 -1.26 -5.06 113.70 117.05 1sym s SER 1 Ca 0.00 -1.53 -0.03 0.00 0.48 0.00 0.00 55.95 54.87 1sym s SER 1 Cb 0.00 0.43 -0.01 0.00 0.10 0.00 0.00 66.02 66.53 1sym s SER 1 CO 0.00 -0.91 0.12 -0.08 0.98 0.00 0.00 173.24 173.34 1sym h GLU 2 N 2.40 -0.09 0.34 4.02 4.57 -2.05 -3.13 114.58 120.64 1sym h GLU 2 Ca -0.32 0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 57.85 1sym h GLU 2 Cb 1.24 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 1sym h GLU 2 CO 0.48 -0.06 -0.16 1.25 -1.18 0.00 0.00 179.01 179.33 1sym h LEU 3 N -0.92 -0.39 -1.40 1.64 5.85 -1.98 -1.06 115.31 117.05 1sym h LEU 3 Ca -0.01 -0.07 0.29 0.00 0.84 0.00 0.00 57.88 58.93 1sym h LEU 3 Cb 0.07 0.10 -0.09 0.00 0.37 0.00 0.00 40.66 41.11 1sym h LEU 3 CO 0.02 -0.17 0.70 -0.08 -0.34 0.00 0.00 178.44 178.56 1sym h GLU 4 N -0.59 0.33 0.09 1.25 4.22 -1.99 0.44 114.58 118.34 1sym h GLU 4 Ca -0.05 -0.02 -0.25 0.00 0.08 0.00 0.00 59.36 59.12 1sym h GLU 4 Cb 0.43 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1sym h GLU 4 CO 0.08 0.22 -1.17 -0.22 -2.18 0.00 0.00 179.01 175.73 1sym h LYS 5 N 0.34 0.18 0.00 1.92 1.63 -1.42 -3.02 116.57 116.20 1sym h LYS 5 Ca 0.62 -0.31 0.00 0.00 -0.85 0.00 0.00 60.65 60.10 1sym h LYS 5 Cb 1.66 0.12 0.00 0.00 -0.60 0.00 0.00 32.23 33.41 1sym h LYS 5 CO -0.29 1.15 -0.01 0.00 -3.45 0.00 0.00 179.45 176.84 1sym h ALA 6 N 0.71 0.00 -0.64 5.00 0.00 0.87 -2.49 119.26 122.71 1sym h ALA 6 Ca -0.10 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 54.91 1sym h ALA 6 Cb 1.91 0.01 -0.12 0.00 0.00 0.00 0.00 17.79 19.58 1sym h ALA 6 CO 0.18 0.01 -0.23 1.98 0.00 0.00 0.00 179.25 181.19 1sym h MET 7 N -0.22 -0.06 -0.14 0.00 1.85 -0.52 0.51 114.93 116.34 1sym h MET 7 Ca 0.00 0.00 -0.05 0.00 -0.61 0.00 0.00 59.70 59.05 1sym h MET 7 Cb 0.01 0.01 -0.01 0.00 0.43 0.00 0.00 31.60 32.04 1sym h MET 7 CO 0.00 -0.04 -0.12 0.28 -0.40 0.00 0.00 176.91 176.63 1sym h VAL 8 N -0.06 1.17 -0.31 -5.77 2.07 -1.63 -2.02 116.25 109.69 1sym h VAL 8 Ca 0.29 -0.73 -0.07 0.00 0.82 0.00 0.00 66.70 67.01 1sym h VAL 8 Cb 0.52 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 1sym h VAL 8 CO -0.69 0.23 -0.10 0.00 0.02 0.00 0.00 177.57 177.03 1sym h ALA 9 N 1.68 1.26 0.64 1.67 0.00 0.43 -2.66 119.26 122.27 1sym h ALA 9 Ca 0.04 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1sym h ALA 9 Cb 0.35 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.01 1sym h ALA 9 CO 0.02 0.49 -0.31 1.25 0.00 0.00 0.00 179.25 180.70 1sym h LEU 10 N 0.48 -0.73 -1.85 0.00 6.46 -0.43 -2.11 115.31 117.13 1sym h LEU 10 Ca 0.09 0.03 0.35 0.00 -0.12 0.00 0.00 57.88 58.22 1sym h LEU 10 Cb 0.46 0.19 -0.05 0.00 -0.73 0.00 0.00 40.66 40.53 1sym h LEU 10 CO 0.03 -0.46 0.96 0.40 -0.62 0.00 0.00 178.44 178.75 1sym h ILE 11 N -0.97 0.26 0.16 4.05 2.04 -1.51 0.46 117.51 122.00 1sym h ILE 11 Ca -0.09 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 1sym h ILE 11 Cb 0.66 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.04 1sym h ILE 11 CO 0.14 0.00 -0.08 -0.78 0.00 0.00 0.00 178.15 177.43 1sym h ASP 12 N 0.00 -0.19 -1.26 1.72 3.58 -1.02 -2.02 116.42 117.23 1sym h ASP 12 Ca 0.57 -0.10 0.37 0.00 0.42 0.00 0.00 57.03 58.29 1sym h ASP 12 Cb 2.49 0.05 -0.09 0.00 1.72 0.00 0.00 39.33 43.49 1sym h ASP 12 CO -0.01 -0.02 0.84 0.58 -2.88 0.00 0.00 179.24 177.76 1sym h VAL 13 N -0.35 0.31 -0.02 2.25 2.07 0.24 0.55 116.25 121.29 1sym h VAL 13 Ca -0.02 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 1sym h VAL 13 Cb 0.28 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1sym h VAL 13 CO 0.04 0.03 0.01 0.15 0.02 0.00 0.00 177.57 177.82 1sym h PHE 14 N 0.16 0.03 0.00 1.57 3.57 -1.31 -1.32 116.94 119.64 1sym h PHE 14 Ca 0.70 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 62.20 1sym h PHE 14 Cb 2.26 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 40.99 1sym h PHE 14 CO -0.00 0.14 0.00 1.58 -2.23 0.00 0.00 178.31 177.79 1sym n HIS 15 N -5.02 0.00 0.03 0.41 -0.00 0.17 0.24 115.22 111.05 1sym n HIS 15 Ca -0.07 0.00 -0.14 0.00 0.46 0.00 0.00 57.72 57.97 1sym n HIS 15 Cb 0.08 -0.25 -0.04 0.00 -0.12 0.00 0.00 29.99 29.67 1sym n HIS 15 CO 0.00 0.00 0.00 0.37 0.46 0.00 0.00 176.34 177.17 1sym h GLN 16 N 0.00 0.59 -0.00 1.57 5.75 0.39 -3.40 115.11 120.00 1sym h GLN 16 Ca 0.00 -0.52 -0.14 0.00 -0.15 0.00 0.00 58.65 57.84 1sym h GLN 16 Cb 0.20 0.12 -0.14 0.00 1.07 0.00 0.00 27.48 28.72 1sym h GLN 16 CO 0.00 1.14 -0.30 2.48 -2.65 0.00 0.00 178.83 179.50 1sym n TYR 17 N -3.86 -0.61 -0.32 3.99 0.18 -1.18 -4.95 117.16 110.41 1sym n TYR 17 Ca -0.07 -0.87 -0.00 0.00 1.88 0.00 0.00 57.90 58.84 1sym n TYR 17 Cb 0.76 0.80 0.17 0.00 -0.38 0.00 0.00 39.34 40.70 1sym n TYR 17 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 1sym h SER 18 N 0.33 1.03 0.00 9.48 0.87 -0.42 -3.42 113.55 121.42 1sym h SER 18 Ca -0.53 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.01 1sym h SER 18 Cb 1.38 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 1sym h SER 18 CO -0.25 0.73 0.00 0.61 -0.53 0.00 0.00 176.83 177.39 1sym n GLY 19 N -1.39 -1.90 0.26 5.77 0.00 -1.26 -4.18 105.19 102.49 1sym n GLY 19 Ca 0.11 0.87 0.20 0.00 0.00 0.00 0.00 46.02 47.21 1sym n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sym n ARG 20 N 0.00 -0.05 0.00 1.61 1.74 -1.26 -4.53 116.66 114.16 1sym n ARG 20 Ca 0.00 1.14 0.00 0.00 -0.77 0.00 0.00 57.85 58.22 1sym n ARG 20 Cb 0.00 -1.95 0.00 0.00 -1.02 0.00 0.00 32.46 29.49 1sym n ARG 20 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1sym n GLU 21 N -4.93 2.86 0.00 5.56 2.13 -1.26 -5.03 120.64 119.97 1sym n GLU 21 Ca 0.26 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.08 1sym n GLU 21 Cb 0.86 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.57 1sym n GLU 21 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1sym n GLY 22 N 3.58 3.53 1.10 8.31 0.00 -1.26 -4.61 105.19 115.83 1sym n GLY 22 Ca 0.00 -0.03 -0.09 0.00 0.00 0.00 0.00 46.02 45.89 1sym n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sym n ASP 23 N 4.86 -1.22 -3.93 1.61 8.00 -1.26 -5.06 116.55 119.56 1sym n ASP 23 Ca 0.00 -0.75 -0.22 0.00 0.71 0.00 0.00 54.79 54.54 1sym n ASP 23 Cb 0.00 -0.31 -0.16 0.00 -0.02 0.00 0.00 41.12 40.62 1sym n ASP 23 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1sym s LYS 24 N -3.78 1.13 -1.73 -1.24 2.20 -1.26 -4.76 119.74 110.30 1sym s LYS 24 Ca 0.22 -0.20 0.00 0.00 -0.36 0.00 0.00 55.97 55.63 1sym s LYS 24 Cb -0.02 -1.06 0.00 0.00 -1.51 0.00 0.00 37.83 35.24 1sym s LYS 24 CO 0.17 -0.06 0.00 0.72 -0.36 0.00 0.00 175.35 175.82 1sym n HIS 25 N 4.05 -0.69 -4.61 4.03 8.25 -1.26 -4.97 115.22 120.01 1sym n HIS 25 Ca -0.23 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 56.92 1sym n HIS 25 Cb 0.51 -3.61 -0.17 0.00 1.12 0.00 0.00 29.99 27.85 1sym n HIS 25 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1sym s LYS 26 N -4.64 2.63 0.00 -0.41 -0.14 -1.26 -4.22 119.74 111.70 1sym s LYS 26 Ca 0.00 -0.71 0.00 0.00 -1.36 0.00 0.00 55.97 53.90 1sym s LYS 26 Cb 0.00 -2.15 0.00 0.00 -1.68 0.00 0.00 37.83 34.00 1sym s LYS 26 CO 0.00 -0.02 0.00 -0.11 -0.76 0.00 0.00 175.35 174.46 1sym n LEU 27 N 4.08 0.00 0.00 3.17 7.94 -0.75 -4.43 117.00 127.01 1sym n LEU 27 Ca -0.20 0.00 -0.05 0.00 -1.11 0.00 0.00 56.01 54.66 1sym n LEU 27 Cb 0.51 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.46 1sym n LEU 27 CO 0.26 0.00 0.08 0.29 -1.11 0.00 0.00 177.39 176.90 1sym n LYS 28 N 0.00 0.26 0.06 1.96 5.02 -1.26 -1.67 118.16 122.52 1sym n LYS 28 Ca 0.00 -0.90 -0.06 0.00 -2.02 0.00 0.00 58.31 55.33 1sym n LYS 28 Cb 0.00 0.90 -0.11 0.00 -0.02 0.00 0.00 35.03 35.80 1sym n LYS 28 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1sym h LYS 29 N 0.00 0.00 0.16 1.97 1.79 -1.63 -1.40 116.57 117.46 1sym h LYS 29 Ca -0.09 0.00 -0.30 0.00 -2.18 0.00 0.00 60.65 58.08 1sym h LYS 29 Cb 0.40 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.06 1sym h LYS 29 CO 0.13 0.90 -1.35 0.66 -1.08 0.00 0.00 179.45 178.71 1sym h SER 30 N 0.00 0.53 1.48 0.86 4.64 -1.85 -1.26 113.55 117.94 1sym h SER 30 Ca -0.03 -0.59 -0.10 0.00 -0.47 0.00 0.00 61.79 60.60 1sym h SER 30 Cb 1.74 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 63.64 1sym h SER 30 CO 0.12 1.47 -0.53 -0.08 -0.87 0.00 0.00 176.83 176.94 1sym h GLU 31 N 0.09 0.00 0.20 4.77 4.81 -1.91 -2.80 114.58 119.75 1sym h GLU 31 Ca -0.18 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.78 1sym h GLU 31 Cb 2.03 0.00 0.03 0.00 0.63 0.00 0.00 28.75 31.44 1sym h GLU 31 CO 0.22 0.47 -1.20 1.25 -0.73 0.00 0.00 179.01 179.02 1sym h LEU 32 N 0.00 0.66 -1.39 1.64 5.85 -1.30 0.61 115.31 121.38 1sym h LEU 32 Ca -0.01 -0.93 -0.00 0.00 0.84 0.00 0.00 57.88 57.77 1sym h LEU 32 Cb 1.38 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 42.17 1sym h LEU 32 CO 0.06 1.57 0.32 0.50 -0.34 0.00 0.00 178.44 180.56 1sym h LYS 33 N -0.10 0.73 0.06 1.25 3.11 -1.28 -0.75 116.57 119.60 1sym h LYS 33 Ca -0.21 -0.06 -0.24 0.00 -2.81 0.00 0.00 60.65 57.32 1sym h LYS 33 Cb 1.93 -0.16 -0.01 0.00 -1.00 0.00 0.00 32.23 32.98 1sym h LYS 33 CO 0.21 0.52 -1.14 1.05 -2.81 0.00 0.00 179.45 177.28 1sym h GLU 34 N 0.75 0.13 -0.43 1.90 -0.00 -1.52 -1.69 114.58 113.72 1sym h GLU 34 Ca 0.20 -0.23 0.08 0.00 -0.00 0.00 0.00 59.36 59.41 1sym h GLU 34 Cb -0.02 0.08 -0.07 0.00 -0.00 0.00 0.00 28.75 28.74 1sym h GLU 34 CO -0.04 1.10 0.03 1.25 -0.00 0.00 0.00 179.01 181.35 1sym h LEU 35 N 0.04 -0.11 0.00 3.06 7.12 0.56 0.58 115.31 126.56 1sym h LEU 35 Ca -0.08 0.09 -0.01 0.00 0.13 0.00 0.00 57.88 58.02 1sym h LEU 35 Cb 1.88 0.15 -0.00 0.00 -0.53 0.00 0.00 40.66 42.15 1sym h LEU 35 CO 0.16 -0.02 -0.04 0.40 -0.13 0.00 0.00 178.44 178.81 1sym h ILE 36 N 0.15 1.00 0.00 4.05 2.04 -1.38 -3.20 117.51 120.16 1sym h ILE 36 Ca 0.21 -1.76 0.00 0.00 1.00 0.00 0.00 64.86 64.31 1sym h ILE 36 Cb 0.29 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.27 1sym h ILE 36 CO -0.33 0.34 0.00 -3.20 0.00 0.00 0.00 178.15 174.96 1sym n ASN 37 N -4.68 0.00 -0.09 1.72 5.15 -0.64 -0.60 115.26 116.12 1sym n ASN 37 Ca -0.06 -0.45 -0.11 0.00 -0.60 0.00 0.00 54.58 53.36 1sym n ASN 37 Cb 0.28 -0.03 -0.13 0.00 -0.53 0.00 0.00 39.78 39.37 1sym n ASN 37 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1sym n ASN 38 N -1.03 1.19 -0.02 1.20 5.15 0.20 -4.31 115.26 117.64 1sym n ASN 38 Ca 0.12 -0.04 -0.01 0.00 -0.60 0.00 0.00 54.58 54.06 1sym n ASN 38 Cb 0.07 0.54 -0.04 0.00 -0.53 0.00 0.00 39.78 39.81 1sym n ASN 38 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1sym n GLU 39 N -2.79 1.97 -0.06 1.20 -0.58 -1.17 -4.71 120.64 114.50 1sym n GLU 39 Ca -0.32 -0.02 -0.10 0.00 -0.42 0.00 0.00 57.16 56.30 1sym n GLU 39 Cb 1.02 -1.14 -0.09 0.00 -0.57 0.00 0.00 31.44 30.65 1sym n GLU 39 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1sym h LEU 40 N 0.00 -0.01 -7.70 -4.62 -0.00 -1.05 -3.43 115.31 98.49 1sym h LEU 40 Ca -0.09 -0.70 -0.44 0.00 -0.00 0.00 0.00 57.88 56.65 1sym h LEU 40 Cb 0.93 0.00 -0.09 0.00 -0.00 0.00 0.00 40.66 41.50 1sym h LEU 40 CO 0.01 0.83 1.77 -0.24 -0.00 0.00 0.00 178.44 180.80 1sym n SER 41 N -4.68 -0.19 0.00 -0.43 2.88 -1.14 -3.46 113.62 106.60 1sym n SER 41 Ca -0.07 -0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.45 1sym n SER 41 Cb 0.34 -0.78 0.00 0.00 -0.75 0.00 0.00 64.21 63.02 1sym n SER 41 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 1sym n HIS 42 N 8.77 0.00 -1.30 0.66 -0.00 -1.26 -4.94 115.22 117.15 1sym n HIS 42 Ca 0.64 0.00 0.05 0.00 -0.00 0.00 0.00 57.72 58.41 1sym n HIS 42 Cb 0.06 0.00 0.19 0.00 -0.00 0.00 0.00 29.99 30.24 1sym n HIS 42 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 176.34 178.31 1sym n PHE 43 N -0.22 0.43 -3.43 1.57 1.16 -1.22 -4.97 117.46 110.77 1sym n PHE 43 Ca 0.00 -1.26 -0.41 0.00 -1.87 0.00 0.00 57.45 53.91 1sym n PHE 43 Cb 0.00 -0.29 -0.10 0.00 -1.61 0.00 0.00 39.48 37.49 1sym n PHE 43 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1sym s LEU 44 N -3.06 4.44 0.00 5.98 1.02 -1.26 -3.86 118.68 121.94 1sym s LEU 44 Ca 0.38 -0.25 0.00 0.00 0.02 0.00 0.00 54.13 54.28 1sym s LEU 44 Cb 0.35 -2.30 0.00 0.00 0.02 0.00 0.00 46.19 44.26 1sym s LEU 44 CO 0.00 -0.31 0.00 -0.62 0.02 0.00 0.00 176.35 175.45 1sym n GLU 45 N 5.32 0.00 -0.06 1.70 1.02 -1.26 -4.96 120.64 122.40 1sym n GLU 45 Ca -0.10 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.82 1sym n GLU 45 Cb 0.49 0.00 -0.12 0.00 -0.02 0.00 0.00 31.44 31.79 1sym n GLU 45 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1sym n GLU 46 N -1.72 0.65 -2.40 3.49 1.02 -1.26 -5.05 120.64 115.36 1sym n GLU 46 Ca 0.00 0.42 -0.04 0.00 -0.02 0.00 0.00 57.16 57.52 1sym n GLU 46 Cb 0.00 -1.72 0.01 0.00 -0.02 0.00 0.00 31.44 29.71 1sym n GLU 46 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1sym n ILE 47 N -4.00 -8.37 0.05 -3.67 2.08 -1.26 -4.91 119.36 99.27 1sym n ILE 47 Ca -0.33 0.76 -0.05 0.00 0.56 0.00 0.00 62.75 63.68 1sym n ILE 47 Cb 0.85 -6.21 0.14 0.00 -0.75 0.00 0.00 39.64 33.67 1sym n ILE 47 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 1sym h LYS 48 N 1.52 0.38 -2.93 0.38 3.64 -1.85 -3.26 116.57 114.45 1sym h LYS 48 Ca 0.00 -0.21 -0.72 0.00 -1.27 0.00 0.00 60.65 58.45 1sym h LYS 48 Cb 0.53 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.30 1sym h LYS 48 CO 0.12 0.78 2.92 0.39 -2.27 0.00 0.00 179.45 181.40 1sym n GLU 49 N -3.97 4.08 0.21 1.90 -0.58 -1.26 -4.67 120.64 116.34 1sym n GLU 49 Ca -0.02 -2.98 0.18 0.00 -0.42 0.00 0.00 57.16 53.92 1sym n GLU 49 Cb 0.55 -2.76 0.84 0.00 -0.57 0.00 0.00 31.44 29.49 1sym n GLU 49 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 1sym h GLN 50 N 4.95 0.00 0.02 3.49 4.15 -1.93 0.12 115.11 125.91 1sym h GLN 50 Ca 0.72 0.00 -0.20 0.00 0.77 0.00 0.00 58.65 59.94 1sym h GLN 50 Cb 0.35 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.03 1sym h GLN 50 CO 1.63 0.00 -0.93 0.93 -1.93 0.00 0.00 178.83 178.53 1sym h GLU 51 N 0.00 0.16 -0.00 1.69 5.08 -1.93 -0.17 114.58 119.41 1sym h GLU 51 Ca 0.09 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1sym h GLU 51 Cb 0.58 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.89 1sym h GLU 51 CO -0.00 0.97 -0.00 0.28 -1.00 0.00 0.00 179.01 179.26 1sym h VAL 52 N 0.08 1.38 -0.00 3.13 2.07 -1.13 0.32 116.25 122.09 1sym h VAL 52 Ca -0.05 -1.12 -0.16 0.00 0.82 0.00 0.00 66.70 66.19 1sym h VAL 52 Cb 1.58 2.13 -0.02 0.00 -1.52 0.00 0.00 31.29 33.47 1sym h VAL 52 CO 0.14 0.29 -0.77 0.58 0.02 0.00 0.00 177.57 177.83 1sym h VAL 53 N -0.46 1.53 0.00 2.57 2.07 -1.56 -2.78 116.25 117.62 1sym h VAL 53 Ca 0.00 -2.58 0.00 0.00 0.82 0.00 0.00 66.70 64.94 1sym h VAL 53 Cb 0.48 2.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.64 1sym h VAL 53 CO 0.00 0.74 0.00 0.44 0.02 0.00 0.00 177.57 178.77 1sym h ASP 54 N 0.02 0.00 0.07 0.57 5.19 -1.02 -1.37 116.42 119.88 1sym h ASP 54 Ca -0.01 0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 56.27 1sym h ASP 54 Cb 1.36 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.88 1sym h ASP 54 CO 0.10 0.00 -0.56 0.50 -3.12 0.00 0.00 179.24 176.17 1sym h LYS 55 N 0.00 0.26 0.01 3.56 3.11 -0.14 -0.89 116.57 122.47 1sym h LYS 55 Ca 0.00 -0.37 -0.26 0.00 -2.81 0.00 0.00 60.65 57.21 1sym h LYS 55 Cb 0.90 0.13 0.02 0.00 -1.00 0.00 0.00 32.23 32.27 1sym h LYS 55 CO 0.00 1.13 -1.04 -0.39 -2.81 0.00 0.00 179.45 176.34 1sym h VAL 56 N -0.43 1.31 0.00 2.00 -1.51 -1.55 -2.59 116.25 113.48 1sym h VAL 56 Ca -0.09 -2.33 -0.04 0.00 -1.23 0.00 0.00 66.70 63.01 1sym h VAL 56 Cb 1.38 2.43 -0.01 0.00 -2.13 0.00 0.00 31.29 32.96 1sym h VAL 56 CO 0.11 0.71 -0.17 -0.03 -1.23 0.00 0.00 177.57 176.96 1sym h MET 57 N 0.34 0.00 0.21 5.19 1.85 -1.36 -0.91 114.93 120.25 1sym h MET 57 Ca -0.12 0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 58.96 1sym h MET 57 Cb 1.69 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.72 1sym h MET 57 CO 0.20 0.17 -0.10 0.93 -0.40 0.00 0.00 176.91 177.71 1sym h GLU 58 N 0.00 -0.27 0.00 0.39 5.08 -1.01 -1.62 114.58 117.15 1sym h GLU 58 Ca -0.00 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1sym h GLU 58 Cb 0.57 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.89 1sym h GLU 58 CO 0.02 0.04 -0.01 1.15 -1.00 0.00 0.00 179.01 179.21 1sym h THR 59 N -0.98 0.69 0.24 1.13 2.02 -1.42 0.23 112.91 114.82 1sym h THR 59 Ca -0.03 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.10 1sym h THR 59 Cb 0.43 1.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1sym h THR 59 CO 0.05 0.01 -0.12 -0.07 0.37 0.00 0.00 175.52 175.76 1sym h LEU 60 N 0.00 -0.27 0.00 2.58 3.38 -1.12 -2.88 115.31 116.99 1sym h LEU 60 Ca -0.00 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1sym h LEU 60 Cb 0.02 0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1sym h LEU 60 CO 0.00 0.10 0.00 -0.67 0.09 0.00 0.00 178.44 177.97 1sym n ASP 61 N -5.08 0.00 0.10 -0.43 -0.08 -0.62 -2.88 116.55 107.57 1sym n ASP 61 Ca -0.09 -0.12 -0.08 0.00 -1.51 0.00 0.00 54.79 52.99 1sym n ASP 61 Cb 0.25 -0.28 -0.05 0.00 2.34 0.00 0.00 41.12 43.38 1sym n ASP 61 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1sym h GLU 62 N 0.00 -0.33 0.02 -0.67 4.81 -0.34 -3.40 114.58 114.68 1sym h GLU 62 Ca 0.00 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1sym h GLU 62 Cb 0.25 0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.70 1sym h GLU 62 CO 0.00 -0.05 -0.01 -0.44 -0.73 0.00 0.00 179.01 177.78 1sym h ASP 63 N -1.01 -0.02 0.00 1.04 5.19 -1.63 -3.48 116.42 116.51 1sym h ASP 63 Ca -0.03 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 1sym h ASP 63 Cb 0.42 0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.94 1sym h ASP 63 CO 0.06 0.27 0.00 0.61 -3.12 0.00 0.00 179.24 177.05 1sym n GLY 64 N 1.77 2.41 1.14 2.75 0.00 -1.14 -4.52 105.19 107.60 1sym n GLY 64 Ca -0.00 -0.49 0.01 0.00 0.00 0.00 0.00 46.02 45.54 1sym n GLY 64 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1sym n ASP 65 N 2.51 2.02 -4.93 1.61 2.03 -1.26 -3.05 116.55 115.48 1sym n ASP 65 Ca 0.00 -3.35 -0.25 0.00 0.52 0.00 0.00 54.79 51.71 1sym n ASP 65 Cb 0.00 -0.45 0.01 0.00 -0.72 0.00 0.00 41.12 39.96 1sym n ASP 65 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1sym s GLY 66 N -3.05 1.53 0.23 0.27 0.00 -1.26 -4.86 107.32 100.18 1sym s GLY 66 Ca 0.38 -0.80 -0.13 0.00 0.00 0.00 0.00 44.72 44.18 1sym s GLY 66 CO -0.07 -0.61 0.60 -0.54 0.00 0.00 0.00 173.10 172.47 1sym s GLU 67 N -4.70 3.92 0.13 2.90 2.02 -1.26 -2.41 118.70 119.29 1sym s GLU 67 Ca 0.49 0.45 0.07 0.00 0.02 0.00 0.00 54.97 55.99 1sym s GLU 67 Cb -0.10 -2.69 -0.04 0.00 0.10 0.00 0.00 34.13 31.40 1sym s GLU 67 CO 0.41 0.33 -0.17 0.00 0.02 0.00 0.00 175.26 175.86 1sym n ASP 69 N 0.61 1.15 0.06 0.00 8.00 -1.26 -1.82 116.55 123.28 1sym n ASP 69 Ca -0.16 -1.96 -0.04 0.00 0.71 0.00 0.00 54.79 53.35 1sym n ASP 69 Cb 0.56 -0.52 -0.08 0.00 -0.02 0.00 0.00 41.12 41.06 1sym n ASP 69 CO 0.00 0.00 0.00 2.19 -0.39 0.00 0.00 177.20 179.00 1sym h PHE 70 N -0.53 0.00 0.00 1.24 -0.00 -1.99 -3.14 116.94 112.51 1sym h PHE 70 Ca -0.27 0.00 -0.05 0.00 -0.00 0.00 0.00 57.97 57.65 1sym h PHE 70 Cb 1.01 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.95 1sym h PHE 70 CO 0.00 0.80 -0.23 1.96 -0.00 0.00 0.00 178.31 180.84 1sym h GLN 71 N 0.00 0.00 0.20 6.09 4.20 -1.95 -1.87 115.11 121.78 1sym h GLN 71 Ca -0.09 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.31 1sym h GLN 71 Cb 1.69 0.00 0.02 0.00 0.30 0.00 0.00 27.48 29.49 1sym h GLN 71 CO 0.09 0.22 -1.40 1.05 -0.67 0.00 0.00 178.83 178.12 1sym h GLU 72 N 0.00 0.42 0.00 1.46 -0.00 -1.95 -1.44 114.58 113.06 1sym h GLU 72 Ca -0.00 -0.72 -0.13 0.00 -0.00 0.00 0.00 59.36 58.51 1sym h GLU 72 Cb 1.17 0.27 -0.02 0.00 -0.00 0.00 0.00 28.75 30.17 1sym h GLU 72 CO 0.03 1.34 -0.61 0.27 -0.00 0.00 0.00 179.01 180.04 1sym h PHE 73 N 0.11 0.00 0.03 2.06 -0.00 -1.59 -1.42 116.94 116.13 1sym h PHE 73 Ca -0.21 0.00 -0.12 0.00 -0.00 0.00 0.00 57.97 57.64 1sym h PHE 73 Cb 2.09 0.00 0.01 0.00 -0.00 0.00 0.00 35.95 38.05 1sym h PHE 73 CO 0.10 0.61 -0.49 0.52 -0.00 0.00 0.00 178.31 179.05 1sym h MET 74 N 0.00 0.29 0.00 6.09 2.86 -1.37 -0.93 114.93 121.87 1sym h MET 74 Ca -0.01 -0.34 -0.02 0.00 -2.06 0.00 0.00 59.70 57.27 1sym h MET 74 Cb 1.41 0.11 -0.00 0.00 0.06 0.00 0.00 31.60 33.18 1sym h MET 74 CO 0.08 1.06 -0.12 0.00 1.06 0.00 0.00 176.91 179.00 1sym h ALA 75 N 0.24 1.03 0.13 6.32 0.00 -1.31 -2.66 119.26 123.00 1sym h ALA 75 Ca -0.07 -0.11 -0.28 0.00 0.00 0.00 0.00 54.91 54.45 1sym h ALA 75 Cb 1.26 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 19.04 1sym h ALA 75 CO 0.10 0.15 -1.24 0.74 0.00 0.00 0.00 179.25 178.99 1sym h PHE 76 N 0.00 0.70 0.00 0.00 -1.00 -1.19 -3.03 116.94 112.41 1sym h PHE 76 Ca -0.00 -0.47 -0.03 0.00 2.81 0.00 0.00 57.97 60.28 1sym h PHE 76 Cb 0.62 -0.04 -0.00 0.00 3.61 0.00 0.00 35.95 40.14 1sym h PHE 76 CO 0.00 1.35 -0.13 0.28 -1.61 0.00 0.00 178.31 178.20 1sym h VAL 77 N 0.15 0.70 0.01 -0.55 2.07 -0.81 -2.86 116.25 114.96 1sym h VAL 77 Ca -0.16 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 1sym h VAL 77 Cb 1.94 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 33.03 1sym h VAL 77 CO 0.22 0.13 -0.00 0.77 0.02 0.00 0.00 177.57 178.70 1sym h SER 78 N 0.00 -0.01 -1.50 0.57 4.64 -1.49 -2.36 113.55 113.41 1sym h SER 78 Ca -0.00 0.00 0.45 0.00 -0.47 0.00 0.00 61.79 61.77 1sym h SER 78 Cb 0.31 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.32 1sym h SER 78 CO 0.02 0.18 1.04 0.00 -0.87 0.00 0.00 176.83 177.20 1sym h MET 79 N -0.39 0.06 0.10 4.77 3.00 -1.58 0.54 114.93 121.43 1sym h MET 79 Ca -0.00 -0.00 -0.14 0.00 0.00 0.00 0.00 59.70 59.56 1sym h MET 79 Cb 0.01 -0.01 0.02 0.00 0.00 0.00 0.00 31.60 31.61 1sym h MET 79 CO 0.00 0.04 -0.61 -0.39 0.00 0.00 0.00 176.91 175.95 1sym h VAL 80 N 0.06 1.58 0.00 -0.10 -1.51 -1.61 0.62 116.25 115.29 1sym h VAL 80 Ca 0.78 -2.48 0.00 0.00 -1.23 0.00 0.00 66.70 63.76 1sym h VAL 80 Cb 2.84 3.25 0.00 0.00 -2.13 0.00 0.00 31.29 35.24 1sym h VAL 80 CO -0.16 0.69 0.00 0.41 -1.23 0.00 0.00 177.57 177.28 1sym n THR 81 N -4.25 0.00 -0.80 7.19 -1.04 0.66 -3.01 114.28 113.02 1sym n THR 81 Ca -0.13 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 1sym n THR 81 Cb 0.73 -0.42 0.00 0.00 -1.82 0.00 0.00 70.33 68.82 1sym n THR 81 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1sym n THR 82 N -0.87 0.12 0.00 12.58 -1.04 0.15 -4.92 114.28 120.30 1sym n THR 82 Ca 0.16 -0.16 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1sym n THR 82 Cb 0.07 1.28 0.00 0.00 -1.82 0.00 0.00 70.33 69.86 1sym n THR 82 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1sym n ALA 83 N -0.06 -0.19 0.00 2.41 0.00 0.21 -4.80 120.51 118.09 1sym n ALA 83 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1sym n ALA 83 Cb 0.34 0.25 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1sym n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sym n HIS 85 N 0.00 -3.73 -2.03 0.00 1.44 -1.26 -2.55 115.22 107.09 1sym n HIS 85 Ca 0.00 -0.08 -0.37 0.00 -2.01 0.00 0.00 57.72 55.26 1sym n HIS 85 Cb 0.00 -0.08 -0.00 0.00 0.12 0.00 0.00 29.99 30.03 1sym n HIS 85 CO 0.00 0.00 0.00 -1.91 -2.81 0.00 0.00 176.34 171.62 1sym n GLU 86 N -1.36 3.84 -0.53 -1.40 2.13 -1.25 -4.91 120.64 117.16 1sym n GLU 86 Ca 0.01 -3.53 -0.07 0.00 0.66 0.00 0.00 57.16 54.24 1sym n GLU 86 Cb 0.04 -2.38 0.05 0.00 0.27 0.00 0.00 31.44 29.42 1sym n GLU 86 CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69 1sym n PHE 87 N 0.48 -3.91 -2.25 4.31 -1.74 -1.26 -4.20 117.46 108.89 1sym n PHE 87 Ca 0.53 -0.30 -0.16 0.00 -0.56 0.00 0.00 57.45 56.97 1sym n PHE 87 Cb 0.32 -0.24 -0.02 0.00 1.52 0.00 0.00 39.48 41.07 1sym n PHE 87 CO 0.00 0.00 0.00 1.19 -0.56 0.00 0.00 176.76 177.39 1sym n PHE 88 N -2.35 -1.06 0.00 2.97 3.72 -1.26 -4.82 117.46 114.65 1sym n PHE 88 Ca 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.44 1sym n PHE 88 Cb 0.14 -3.20 0.00 0.00 -0.94 0.00 0.00 39.48 35.48 1sym n PHE 88 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1sym n GLU 89 N -2.74 0.00 -0.78 -1.08 4.07 -1.26 -4.98 120.64 113.87 1sym n GLU 89 Ca -0.18 0.00 -0.02 0.00 -0.06 0.00 0.00 57.16 56.90 1sym n GLU 89 Cb 0.62 -0.20 -0.02 0.00 -0.06 0.00 0.00 31.44 31.78 1sym n GLU 89 CO 0.00 0.00 0.00 -2.39 -0.06 0.00 0.00 177.13 174.68 1sym n HIS 90 N -2.39 0.00 0.75 4.31 1.44 -1.26 -5.28 115.22 112.79 1sym n HIS 90 Ca 0.00 -0.23 0.09 0.00 -2.01 0.00 0.00 57.72 55.57 1sym n HIS 90 Cb 0.00 0.25 0.07 0.00 0.12 0.00 0.00 29.99 30.43 1sym n HIS 90 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92