#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1imp n GLU 2 N 0.00 2.73 0.00 0.03 0.28 -1.26 -4.97 120.64 117.46 1imp n GLU 2 Ca 0.00 1.00 0.00 0.00 -0.16 0.00 0.00 57.16 58.00 1imp n GLU 2 Cb 0.00 -2.89 0.00 0.00 1.43 0.00 0.00 31.44 29.98 1imp n GLU 2 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 1imp n LEU 3 N 5.86 0.00 0.00 -1.84 0.00 -1.26 -5.02 117.00 114.74 1imp n LEU 3 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.20 1imp n LEU 3 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.79 1imp n LEU 3 CO 0.67 -0.11 0.00 0.29 0.00 0.00 0.00 177.39 178.24 1imp n LYS 4 N 0.00 2.07 -0.01 1.96 5.02 -1.26 -5.03 118.16 120.91 1imp n LYS 4 Ca 0.00 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.24 1imp n LYS 4 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 34.99 1imp n LYS 4 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 1imp n HIS 5 N -0.14 0.00 -2.87 2.13 -0.00 -1.26 -5.10 115.22 107.98 1imp n HIS 5 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1imp n HIS 5 Cb 0.00 -0.22 0.00 0.00 -0.00 0.00 0.00 29.99 29.77 1imp n HIS 5 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 1imp n SER 6 N -3.73 0.00 0.22 0.26 3.41 -1.26 -4.86 113.62 107.65 1imp n SER 6 Ca -0.09 -0.46 0.15 0.00 -0.26 0.00 0.00 58.87 58.21 1imp n SER 6 Cb 0.30 0.00 0.74 0.00 -0.26 0.00 0.00 64.21 64.99 1imp n SER 6 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1imp h ILE 7 N 0.46 0.00 0.00 -1.33 2.10 -1.72 -1.59 117.51 115.43 1imp h ILE 7 Ca 0.00 -0.14 -0.04 0.00 1.08 0.00 0.00 64.86 65.76 1imp h ILE 7 Cb 0.00 0.90 -0.01 0.00 -1.09 0.00 0.00 36.82 36.62 1imp h ILE 7 CO 0.00 0.00 -0.18 -1.28 -1.08 0.00 0.00 178.15 175.61 1imp h SER 8 N 0.00 0.00 0.93 2.19 0.87 -1.83 -2.10 113.55 113.61 1imp h SER 8 Ca 0.00 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.36 1imp h SER 8 Cb 0.18 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.11 1imp h SER 8 CO 0.00 0.18 -0.97 -0.78 -0.53 0.00 0.00 176.83 174.73 1imp h ASP 9 N 0.00 0.03 -3.40 6.23 3.58 -1.60 -2.63 116.42 118.62 1imp h ASP 9 Ca -0.00 -0.03 -0.60 0.00 0.42 0.00 0.00 57.03 56.82 1imp h ASP 9 Cb 0.39 -0.01 -0.12 0.00 1.72 0.00 0.00 39.33 41.31 1imp h ASP 9 CO 0.02 0.98 -0.38 -0.31 -2.88 0.00 0.00 179.24 176.67 1imp s TYR 10 N -2.82 3.39 0.44 0.28 2.02 -0.79 -4.66 117.35 115.22 1imp s TYR 10 Ca 0.00 0.45 -0.07 0.00 -0.37 0.00 0.00 57.07 57.08 1imp s TYR 10 Cb 0.10 -2.33 0.11 0.00 -0.40 0.00 0.00 41.96 39.44 1imp s TYR 10 CO 0.82 0.15 0.48 0.25 -1.57 0.00 0.00 175.55 175.68 1imp n THR 11 N 3.92 0.00 0.26 -0.71 -2.24 -1.26 -1.91 114.28 112.34 1imp n THR 11 Ca -0.13 -0.29 0.15 0.00 -2.27 0.00 0.00 64.05 61.51 1imp n THR 11 Cb 0.52 -1.44 0.67 0.00 -2.10 0.00 0.00 70.33 67.98 1imp n THR 11 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1imp h GLU 12 N 0.00 0.00 0.00 -0.78 4.11 -1.88 0.03 114.58 116.06 1imp h GLU 12 Ca -0.17 0.00 -0.31 0.00 0.07 0.00 0.00 59.36 58.95 1imp h GLU 12 Cb 0.49 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.69 1imp h GLU 12 CO 0.11 0.09 -1.85 0.00 0.07 0.00 0.00 179.01 177.43 1imp n ALA 13 N -2.16 0.98 -0.21 1.06 0.00 -1.26 -2.78 120.51 116.14 1imp n ALA 13 Ca -0.00 -0.83 0.02 0.00 0.00 0.00 0.00 53.44 52.63 1imp n ALA 13 Cb 0.31 -0.10 0.27 0.00 0.00 0.00 0.00 19.45 19.93 1imp n ALA 13 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1imp h GLU 14 N -1.00 0.92 -0.11 0.00 5.08 -1.90 0.29 114.58 117.85 1imp h GLU 14 Ca -0.47 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 57.77 1imp h GLU 14 Cb 1.38 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 30.42 1imp h GLU 14 CO -0.29 0.61 -0.16 0.35 -1.00 0.00 0.00 179.01 178.52 1imp h PHE 15 N 0.95 0.39 -0.03 4.33 3.57 -1.17 -2.10 116.94 122.88 1imp h PHE 15 Ca 0.29 -0.13 0.01 0.00 3.53 0.00 0.00 57.97 61.67 1imp h PHE 15 Cb 0.00 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 38.67 1imp h PHE 15 CO -0.00 0.76 0.07 1.25 -2.23 0.00 0.00 178.31 178.16 1imp h LEU 16 N -0.10 0.00 -0.38 0.59 6.46 -1.15 0.21 115.31 120.94 1imp h LEU 16 Ca 0.01 0.00 -0.18 0.00 -0.12 0.00 0.00 57.88 57.59 1imp h LEU 16 Cb 0.72 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.65 1imp h LEU 16 CO 0.04 0.00 -0.61 -0.61 -0.62 0.00 0.00 178.44 176.64 1imp h GLN 17 N 0.00 0.68 0.84 1.25 4.15 0.22 -2.59 115.11 119.66 1imp h GLN 17 Ca 0.01 -0.46 -0.04 0.00 0.77 0.00 0.00 58.65 58.93 1imp h GLN 17 Cb 0.15 0.07 0.01 0.00 0.21 0.00 0.00 27.48 27.92 1imp h GLN 17 CO -0.00 1.08 -0.40 1.25 -1.93 0.00 0.00 178.83 178.82 1imp h LEU 18 N 0.50 -0.96 -1.86 -2.39 5.85 -0.26 -1.34 115.31 114.86 1imp h LEU 18 Ca -0.00 0.03 0.06 0.00 0.84 0.00 0.00 57.88 58.81 1imp h LEU 18 Cb 1.19 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.46 1imp h LEU 18 CO 0.12 -0.64 0.44 0.58 -0.34 0.00 0.00 178.44 178.60 1imp h VAL 19 N -1.21 0.15 0.01 1.05 2.07 -1.55 0.85 116.25 117.63 1imp h VAL 19 Ca -0.12 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.35 1imp h VAL 19 Cb 0.87 0.60 0.01 0.00 -1.52 0.00 0.00 31.29 31.25 1imp h VAL 19 CO 0.19 0.00 -0.23 0.74 0.02 0.00 0.00 177.57 178.29 1imp h THR 20 N 0.00 1.59 -0.16 2.57 2.02 -0.95 -1.64 112.91 116.34 1imp h THR 20 Ca 0.09 -2.04 0.05 0.00 0.77 0.00 0.00 66.41 65.28 1imp h THR 20 Cb 0.97 2.91 -0.01 0.00 -1.74 0.00 0.00 68.15 70.28 1imp h THR 20 CO -0.00 0.55 0.17 0.74 0.37 0.00 0.00 175.52 177.35 1imp h THR 21 N -0.59 0.52 0.00 3.16 2.02 0.24 0.56 112.91 118.82 1imp h THR 21 Ca -0.03 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 1imp h THR 21 Cb 1.03 0.87 -0.00 0.00 -1.74 0.00 0.00 68.15 68.31 1imp h THR 21 CO 0.05 0.00 -0.16 0.40 0.37 0.00 0.00 175.52 176.18 1imp h ILE 22 N 0.00 0.90 0.00 3.11 2.04 -1.35 -2.06 117.51 120.15 1imp h ILE 22 Ca 0.08 -1.72 0.00 0.00 1.00 0.00 0.00 64.86 64.22 1imp h ILE 22 Cb 0.41 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.24 1imp h ILE 22 CO -0.00 0.30 0.00 0.00 0.00 0.00 0.00 178.15 178.45 1imp n ASN 24 N -1.21 0.73 -3.63 0.00 5.03 0.19 -4.92 115.26 111.46 1imp n ASN 24 Ca 0.10 -0.65 -0.21 0.00 0.87 0.00 0.00 54.58 54.69 1imp n ASN 24 Cb 0.12 1.06 0.05 0.00 -1.02 0.00 0.00 39.78 39.99 1imp n ASN 24 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1imp n ALA 25 N -1.32 -1.94 0.44 5.41 0.00 -0.80 -4.85 120.51 117.45 1imp n ALA 25 Ca 0.01 -0.09 0.08 0.00 0.00 0.00 0.00 53.44 53.45 1imp n ALA 25 Cb 0.17 -2.39 0.23 0.00 0.00 0.00 0.00 19.45 17.46 1imp n ALA 25 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1imp n ASP 26 N -3.06 2.66 -2.31 0.00 -0.08 -1.03 -4.90 116.55 107.82 1imp n ASP 26 Ca -0.26 -1.99 -0.04 0.00 -1.51 0.00 0.00 54.79 50.99 1imp n ASP 26 Cb 0.66 -0.32 0.03 0.00 2.34 0.00 0.00 41.12 43.83 1imp n ASP 26 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1imp n THR 27 N 0.95 0.00 0.49 5.18 -2.24 -1.26 -4.95 114.28 112.45 1imp n THR 27 Ca 0.17 -0.16 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 1imp n THR 27 Cb 0.42 -1.85 0.26 0.00 -2.10 0.00 0.00 70.33 67.07 1imp n THR 27 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1imp n SER 28 N -3.12 2.96 -3.64 3.42 7.64 -1.26 -4.91 113.62 114.71 1imp n SER 28 Ca 0.03 -1.93 -0.03 0.00 1.01 0.00 0.00 58.87 57.94 1imp n SER 28 Cb 0.09 -0.25 -0.06 0.00 -1.01 0.00 0.00 64.21 62.98 1imp n SER 28 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1imp s SER 29 N -1.39 -0.09 0.49 6.43 0.01 -1.26 -5.00 113.70 112.88 1imp s SER 29 Ca 0.37 0.15 0.16 0.00 1.31 0.00 0.00 55.95 57.95 1imp s SER 29 Cb 0.21 0.15 1.20 0.00 0.21 0.00 0.00 66.02 67.79 1imp s SER 29 CO 0.29 -0.05 2.08 -0.33 0.41 0.00 0.00 173.24 175.64 1imp h GLU 30 N 2.85 0.13 -0.43 12.44 5.08 -1.95 -1.35 114.58 131.35 1imp h GLU 30 Ca -0.21 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.19 1imp h GLU 30 Cb 1.19 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 30.37 1imp h GLU 30 CO 0.19 0.09 0.18 1.49 -1.00 0.00 0.00 179.01 179.96 1imp h GLU 31 N 0.14 0.35 -0.23 2.33 4.81 -2.01 0.11 114.58 120.08 1imp h GLU 31 Ca 0.11 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1imp h GLU 31 Cb 0.28 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1imp h GLU 31 CO -0.02 0.23 0.13 1.49 -0.73 0.00 0.00 179.01 180.11 1imp h GLU 32 N 0.36 0.31 -0.38 1.92 4.81 -1.64 0.08 114.58 120.04 1imp h GLU 32 Ca 0.20 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.45 1imp h GLU 32 Cb 0.16 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 1imp h GLU 32 CO -0.18 0.23 0.26 1.25 -0.73 0.00 0.00 179.01 179.84 1imp h LEU 33 N 0.32 0.25 0.14 1.64 5.85 -0.58 0.15 115.31 123.08 1imp h LEU 33 Ca 0.08 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1imp h LEU 33 Cb 0.01 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 40.99 1imp h LEU 33 CO -0.01 0.17 -0.07 1.62 -0.34 0.00 0.00 178.44 179.81 1imp h VAL 34 N 0.29 1.01 0.00 1.05 3.04 -0.61 -0.56 116.25 120.47 1imp h VAL 34 Ca 0.16 -1.09 0.00 0.00 -1.01 0.00 0.00 66.70 64.76 1imp h VAL 34 Cb 0.28 1.63 0.00 0.00 -2.01 0.00 0.00 31.29 31.19 1imp h VAL 34 CO -0.03 0.24 0.20 0.11 -1.01 0.00 0.00 177.57 177.07 1imp h LYS 35 N -0.75 0.00 0.21 4.17 1.57 -1.00 0.47 116.57 121.25 1imp h LYS 35 Ca -0.02 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.44 1imp h LYS 35 Cb 0.53 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.87 1imp h LYS 35 CO 0.03 0.00 -1.42 -0.07 -0.57 0.00 0.00 179.45 177.42 1imp h LEU 36 N 0.00 0.71 0.06 2.94 4.07 -0.14 -2.93 115.31 120.02 1imp h LEU 36 Ca 0.00 -0.77 -0.00 0.00 0.08 0.00 0.00 57.88 57.19 1imp h LEU 36 Cb 0.39 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 41.90 1imp h LEU 36 CO 0.00 1.60 -0.03 1.62 -1.08 0.00 0.00 178.44 180.55 1imp h VAL 37 N 0.12 1.24 -0.98 1.22 3.04 0.14 -2.63 116.25 118.41 1imp h VAL 37 Ca -0.22 -1.44 0.20 0.00 -1.01 0.00 0.00 66.70 64.23 1imp h VAL 37 Cb 2.11 2.13 -0.09 0.00 -2.01 0.00 0.00 31.29 33.43 1imp h VAL 37 CO 0.25 0.34 0.62 0.74 -1.01 0.00 0.00 177.57 178.51 1imp h THR 38 N -0.78 0.68 -0.56 3.17 2.02 -1.06 0.74 112.91 117.12 1imp h THR 38 Ca -0.01 -0.21 0.02 0.00 0.77 0.00 0.00 66.41 66.98 1imp h THR 38 Cb 0.62 0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.01 1imp h THR 38 CO 0.01 0.11 0.36 -0.74 0.37 0.00 0.00 175.52 175.63 1imp h HIS 39 N 0.61 0.67 -1.00 3.16 6.17 -1.44 0.12 115.15 123.43 1imp h HIS 39 Ca 0.55 0.02 0.16 0.00 0.71 0.00 0.00 60.37 61.80 1imp h HIS 39 Cb 1.06 -0.22 -0.09 0.00 2.52 0.00 0.00 27.41 30.68 1imp h HIS 39 CO -0.00 0.40 0.62 0.35 0.71 0.00 0.00 177.93 180.01 1imp h PHE 40 N 0.71 1.09 -0.60 5.26 3.04 0.85 0.12 116.94 127.41 1imp h PHE 40 Ca 0.22 0.03 0.02 0.00 3.98 0.00 0.00 57.97 62.22 1imp h PHE 40 Cb -0.03 -0.34 -0.04 0.00 2.56 0.00 0.00 35.95 38.11 1imp h PHE 40 CO -0.05 0.34 0.38 0.93 -2.02 0.00 0.00 178.31 177.89 1imp h GLU 41 N 0.86 0.72 0.00 1.11 4.39 -0.19 -0.46 114.58 121.02 1imp h GLU 41 Ca 0.54 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.19 1imp h GLU 41 Cb 0.71 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 1imp h GLU 41 CO -0.32 0.48 0.00 -1.91 -1.16 0.00 0.00 179.01 176.10 1imp n GLU 42 N -4.72 0.44 0.00 2.33 4.07 0.31 -1.43 120.64 121.65 1imp n GLU 42 Ca 0.05 0.05 0.00 0.00 -0.06 0.00 0.00 57.16 57.20 1imp n GLU 42 Cb 0.07 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 29.95 1imp n GLU 42 CO 0.00 0.00 0.00 -1.33 -0.06 0.00 0.00 177.13 175.74 1imp n MET 43 N -1.21 0.00 -0.04 5.31 2.81 -0.20 -4.47 117.12 119.32 1imp n MET 43 Ca 0.13 0.21 0.12 0.00 -1.81 0.00 0.00 57.70 56.35 1imp n MET 43 Cb 0.15 -0.68 0.45 0.00 -0.71 0.00 0.00 33.22 32.43 1imp n MET 43 CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11 1imp n THR 44 N -2.12 0.10 -1.26 2.03 5.66 -1.06 -2.56 114.28 115.07 1imp n THR 44 Ca 0.00 -0.30 -0.11 0.00 -3.05 0.00 0.00 64.05 60.58 1imp n THR 44 Cb 0.00 0.46 -0.05 0.00 -1.55 0.00 0.00 70.33 69.19 1imp n THR 44 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1imp n GLU 45 N 0.27 -1.52 -1.41 1.09 1.02 -0.51 -4.85 120.64 114.73 1imp n GLU 45 Ca 0.18 0.78 -0.41 0.00 -0.02 0.00 0.00 57.16 57.68 1imp n GLU 45 Cb 0.35 -4.99 0.01 0.00 -0.02 0.00 0.00 31.44 26.79 1imp n GLU 45 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 1imp n HIS 46 N -1.89 -0.94 -0.06 -0.32 -0.00 -1.26 -4.87 115.22 105.88 1imp n HIS 46 Ca -0.11 0.59 -0.14 0.00 0.46 0.00 0.00 57.72 58.52 1imp n HIS 46 Cb 0.48 -1.93 -0.07 0.00 -0.12 0.00 0.00 29.99 28.35 1imp n HIS 46 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1imp h PRO 47 N 0.62 0.45 -0.10 1.57 0.13 -1.96 -3.06 132.00 129.65 1imp h PRO 47 Ca -0.40 -0.26 -0.13 0.00 -0.87 0.00 0.00 66.00 64.34 1imp h PRO 47 Cb 1.41 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.55 1imp h PRO 47 CO 0.50 0.85 -0.51 0.77 -0.23 0.00 0.00 178.00 179.38 1imp h SER 48 N 0.08 0.29 0.00 1.44 0.02 -1.98 -3.47 113.55 109.94 1imp h SER 48 Ca 0.02 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 1imp h SER 48 Cb 0.80 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.26 1imp h SER 48 CO 0.05 0.75 0.00 0.61 -1.14 0.00 0.00 176.83 177.11 1imp n GLY 49 N 0.06 1.22 0.00 -3.77 0.00 -1.16 -1.18 105.19 100.36 1imp n GLY 49 Ca -0.02 0.41 0.03 0.00 0.00 0.00 0.00 46.02 46.44 1imp n GLY 49 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1imp n SER 50 N 11.56 0.00 0.05 1.61 3.41 -1.26 -2.67 113.62 126.32 1imp n SER 50 Ca 0.00 -1.33 -0.18 0.00 -0.26 0.00 0.00 58.87 57.10 1imp n SER 50 Cb 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 63.81 1imp n SER 50 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1imp h ASP 51 N 0.00 0.40 -0.76 4.04 1.82 -1.43 -0.68 116.42 119.81 1imp h ASP 51 Ca 0.00 -0.62 0.22 0.00 -0.39 0.00 0.00 57.03 56.24 1imp h ASP 51 Cb 0.00 -0.13 -0.03 0.00 0.68 0.00 0.00 39.33 39.85 1imp h ASP 51 CO 0.00 1.53 0.87 0.25 -1.61 0.00 0.00 179.24 180.27 1imp h LEU 52 N 0.07 0.00 0.00 2.28 5.85 -1.72 3.35 115.31 125.13 1imp h LEU 52 Ca -0.29 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.20 1imp h LEU 52 Cb 2.03 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 43.02 1imp h LEU 52 CO 0.15 0.00 -1.86 -0.38 -0.34 0.00 0.00 178.44 176.01 1imp n ILE 53 N -3.46 0.87 -0.75 4.05 5.41 -1.23 -4.48 119.36 119.77 1imp n ILE 53 Ca 0.16 -0.33 -0.19 0.00 1.00 0.00 0.00 62.75 63.39 1imp n ILE 53 Cb 1.12 -1.06 0.12 0.00 -0.71 0.00 0.00 39.64 39.10 1imp n ILE 53 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 1imp n TYR 54 N -2.97 2.30 -2.83 1.39 4.02 0.34 -4.39 117.16 115.02 1imp n TYR 54 Ca -0.27 -1.71 -0.11 0.00 -0.01 0.00 0.00 57.90 55.80 1imp n TYR 54 Cb 0.78 -0.86 0.06 0.00 -0.02 0.00 0.00 39.34 39.30 1imp n TYR 54 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 176.86 176.83 1imp n TYR 55 N -0.62 -1.94 -2.70 -0.72 9.36 1.09 -4.72 117.16 116.90 1imp n TYR 55 Ca 0.45 -2.53 -0.43 0.00 3.32 0.00 0.00 57.90 58.71 1imp n TYR 55 Cb 1.21 1.07 -0.03 0.00 -0.63 0.00 0.00 39.34 40.96 1imp n TYR 55 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 1imp s PRO 56 N -0.52 3.65 0.94 2.98 0.04 -1.26 -4.74 135.00 136.09 1imp s PRO 56 Ca 0.26 0.41 -0.12 0.00 0.04 0.00 0.00 61.00 61.59 1imp s PRO 56 Cb 0.32 -3.91 0.12 0.00 0.04 0.00 0.00 34.50 31.08 1imp s PRO 56 CO -0.06 -1.30 0.16 1.63 0.04 0.00 0.00 177.00 177.47 1imp n LYS 57 N 7.52 -1.78 -2.75 4.56 5.02 -1.26 -4.74 118.16 124.73 1imp n LYS 57 Ca 0.09 -0.53 -0.43 0.00 -2.02 0.00 0.00 58.31 55.43 1imp n LYS 57 Cb 0.49 -1.39 -0.02 0.00 -0.02 0.00 0.00 35.03 34.10 1imp n LYS 57 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1imp s GLU 58 N -3.17 3.80 0.00 1.97 2.12 -1.26 -3.19 118.70 118.97 1imp s GLU 58 Ca 0.32 -1.82 0.00 0.00 0.36 0.00 0.00 54.97 53.83 1imp s GLU 58 Cb -0.05 -5.22 0.00 0.00 0.26 0.00 0.00 34.13 29.13 1imp s GLU 58 CO 0.32 -2.01 0.00 0.41 -0.54 0.00 0.00 175.26 173.44 1imp n GLY 59 N 5.56 0.63 3.97 -1.50 0.00 -1.26 -5.13 105.19 107.46 1imp n GLY 59 Ca 0.35 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.15 1imp n GLY 59 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1imp s ASP 60 N -0.63 4.92 -0.16 1.61 -1.08 -1.19 -5.08 116.67 115.05 1imp s ASP 60 Ca 0.00 -0.08 -0.04 0.00 -0.52 0.00 0.00 52.55 51.91 1imp s ASP 60 Cb 0.00 -0.61 -0.03 0.00 -1.46 0.00 0.00 42.92 40.82 1imp s ASP 60 CO 0.00 -1.43 -0.02 1.51 0.52 0.00 0.00 175.17 175.76 1imp s ASP 61 N -4.54 4.98 -0.09 -0.34 1.47 -1.26 -4.77 116.67 112.11 1imp s ASP 61 Ca 0.61 -0.08 0.10 0.00 1.18 0.00 0.00 52.55 54.35 1imp s ASP 61 Cb -0.09 -1.82 0.45 0.00 -0.34 0.00 0.00 42.92 41.12 1imp s ASP 61 CO 0.41 0.17 1.26 -0.90 0.68 0.00 0.00 175.17 176.79 1imp n ASP 62 N 3.53 3.29 -4.28 2.11 5.75 -1.26 -4.80 116.55 120.89 1imp n ASP 62 Ca -0.17 -2.36 -0.32 0.00 -0.01 0.00 0.00 54.79 51.93 1imp n ASP 62 Cb 0.52 -0.50 0.18 0.00 -1.03 0.00 0.00 41.12 40.29 1imp n ASP 62 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1imp n SER 63 N 0.51 -2.35 -0.04 -1.12 7.64 -1.26 -4.86 113.62 112.14 1imp n SER 63 Ca 0.16 -0.13 -0.12 0.00 1.01 0.00 0.00 58.87 59.79 1imp n SER 63 Cb 0.66 -0.96 -0.10 0.00 -1.01 0.00 0.00 64.21 62.79 1imp n SER 63 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1imp h PRO 64 N -2.09 -0.03 -0.69 1.43 0.13 -1.91 -3.18 132.00 125.65 1imp h PRO 64 Ca -0.54 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.65 1imp h PRO 64 Cb 1.36 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.44 1imp h PRO 64 CO 0.39 0.68 0.40 1.03 -0.23 0.00 0.00 178.00 180.26 1imp h SER 65 N -0.88 0.60 0.46 1.44 0.87 -1.89 -0.39 113.55 113.77 1imp h SER 65 Ca -0.00 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1imp h SER 65 Cb 0.73 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.59 1imp h SER 65 CO 0.01 0.39 -0.01 1.23 -0.53 0.00 0.00 176.83 177.92 1imp h GLY 66 N 0.74 0.00 1.28 5.77 0.00 -1.90 0.14 103.07 109.09 1imp h GLY 66 Ca 0.30 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.36 1imp h GLY 66 CO -0.17 0.00 -1.50 -2.22 0.00 0.00 0.00 176.54 172.65 1imp h ILE 67 N 0.00 1.13 0.00 2.60 2.04 -1.09 -2.40 117.51 119.79 1imp h ILE 67 Ca -0.00 -2.89 -0.04 0.00 1.00 0.00 0.00 64.86 62.93 1imp h ILE 67 Cb 0.24 2.61 -0.01 0.00 -0.74 0.00 0.00 36.82 38.92 1imp h ILE 67 CO 0.00 0.71 -0.18 0.58 0.00 0.00 0.00 178.15 179.26 1imp h VAL 68 N 0.02 0.32 0.00 1.67 2.07 -0.37 -1.99 116.25 117.97 1imp h VAL 68 Ca -0.21 -1.36 -0.12 0.00 0.82 0.00 0.00 66.70 65.83 1imp h VAL 68 Cb 1.95 2.08 -0.02 0.00 -1.52 0.00 0.00 31.29 33.78 1imp h VAL 68 CO 0.11 0.17 -0.61 -1.13 0.02 0.00 0.00 177.57 176.14 1imp h ASN 69 N 0.00 0.00 -0.22 0.57 -0.73 -0.78 -1.45 115.58 112.96 1imp h ASN 69 Ca -0.00 0.00 -0.18 0.00 1.87 0.00 0.00 56.30 57.98 1imp h ASN 69 Cb 1.06 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.66 1imp h ASN 69 CO 0.02 0.56 -0.58 0.74 -0.37 0.00 0.00 177.43 177.80 1imp h THR 70 N 0.00 1.29 -0.06 -3.57 2.02 -0.87 -2.97 112.91 108.75 1imp h THR 70 Ca -0.01 -1.78 -0.06 0.00 0.77 0.00 0.00 66.41 65.33 1imp h THR 70 Cb 1.44 1.81 0.00 0.00 -1.74 0.00 0.00 68.15 69.66 1imp h THR 70 CO 0.07 0.57 -0.19 1.62 0.37 0.00 0.00 175.52 177.96 1imp h VAL 71 N 0.53 1.43 -1.00 3.16 3.04 -1.36 0.79 116.25 122.84 1imp h VAL 71 Ca -0.01 -1.56 0.38 0.00 -1.01 0.00 0.00 66.70 64.50 1imp h VAL 71 Cb 1.20 2.29 -0.17 0.00 -2.01 0.00 0.00 31.29 32.59 1imp h VAL 71 CO 0.13 0.44 0.53 0.50 -1.01 0.00 0.00 177.57 178.16 1imp h LYS 72 N -0.27 0.10 0.03 4.17 3.64 -1.28 1.87 116.57 124.84 1imp h LYS 72 Ca -0.01 -0.01 -0.27 0.00 -1.27 0.00 0.00 60.65 59.10 1imp h LYS 72 Cb 0.80 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.57 1imp h LYS 72 CO 0.04 0.07 -1.43 1.96 -2.27 0.00 0.00 179.45 177.82 1imp h GLN 73 N 0.11 0.06 0.32 1.90 4.20 -1.39 -3.36 115.11 116.95 1imp h GLN 73 Ca 0.80 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 59.39 1imp h GLN 73 Cb 2.03 0.04 -0.00 0.00 0.30 0.00 0.00 27.48 29.85 1imp h GLN 73 CO -0.72 0.83 -0.21 2.35 -0.67 0.00 0.00 178.83 180.41 1imp h TRP 74 N 0.02 -0.57 0.00 2.96 7.01 0.53 -0.93 115.95 124.97 1imp h TRP 74 Ca -0.18 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.81 1imp h TRP 74 Cb 1.93 0.21 0.00 0.00 -2.10 0.00 0.00 29.16 29.20 1imp h TRP 74 CO 0.02 -0.31 0.88 -0.09 -2.79 0.00 0.00 178.44 176.15 1imp h ARG 75 N -0.50 0.00 0.12 2.65 9.65 -0.87 0.77 114.38 126.21 1imp h ARG 75 Ca -0.04 0.00 -0.29 0.00 -1.10 0.00 0.00 59.98 58.55 1imp h ARG 75 Cb 0.40 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.98 1imp h ARG 75 CO 0.03 0.00 -1.50 0.00 2.80 0.00 0.00 179.97 181.30 1imp h ALA 76 N 0.23 0.20 -0.14 2.80 0.00 -1.33 0.44 119.26 121.45 1imp h ALA 76 Ca 0.00 -1.12 -0.02 0.00 0.00 0.00 0.00 54.91 53.77 1imp h ALA 76 Cb 1.77 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 20.06 1imp h ALA 76 CO 0.00 0.89 0.02 0.00 0.00 0.00 0.00 179.25 180.16 1imp h ALA 77 N -0.03 0.19 0.00 0.00 0.00 0.12 -0.83 119.26 118.71 1imp h ALA 77 Ca -0.32 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1imp h ALA 77 Cb 1.81 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.55 1imp h ALA 77 CO 0.07 -0.15 0.00 0.09 0.00 0.00 0.00 179.25 179.26 1imp n ASN 78 N -4.80 0.00 -4.18 0.00 3.02 0.40 -4.84 115.26 104.86 1imp n ASN 78 Ca -0.05 -1.07 -0.36 0.00 -0.03 0.00 0.00 54.58 53.07 1imp n ASN 78 Cb 0.18 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.30 1imp n ASN 78 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1imp n GLY 79 N 0.71 -0.43 0.00 7.41 0.00 -0.32 -4.90 105.19 107.66 1imp n GLY 79 Ca 0.17 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1imp n GLY 79 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1imp n LYS 80 N -4.02 0.73 0.00 1.61 4.76 0.14 -4.97 118.16 116.42 1imp n LYS 80 Ca 0.09 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.53 1imp n LYS 80 Cb 0.47 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.66 1imp n LYS 80 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1imp n SER 81 N -0.74 0.00 0.00 4.39 2.88 -1.26 -4.86 113.62 114.02 1imp n SER 81 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1imp n SER 81 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1imp n SER 81 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1imp n GLY 82 N 4.95 -1.51 2.76 0.46 0.00 -1.26 -4.92 105.19 105.67 1imp n GLY 82 Ca 0.00 -1.04 -0.21 0.00 0.00 0.00 0.00 46.02 44.76 1imp n GLY 82 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1imp n PHE 83 N 2.48 -3.94 0.00 1.61 3.72 -1.26 -3.21 117.46 116.86 1imp n PHE 83 Ca 0.00 -0.83 0.00 0.00 -0.05 0.00 0.00 57.45 56.57 1imp n PHE 83 Cb 0.00 -0.76 0.00 0.00 -0.94 0.00 0.00 39.48 37.78 1imp n PHE 83 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1imp n LYS 84 N -3.20 2.89 -2.87 -1.08 4.81 -0.80 -4.71 118.16 113.20 1imp n LYS 84 Ca 0.12 0.00 -0.39 0.00 -0.87 0.00 0.00 58.31 57.17 1imp n LYS 84 Cb 0.42 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.41 1imp n LYS 84 CO 0.00 0.00 0.00 -1.14 1.17 0.00 0.00 177.40 177.43 1imp s GLN 85 N 0.00 4.66 0.00 1.64 0.74 -1.26 -4.84 119.66 120.60 1imp s GLN 85 Ca 0.00 1.29 0.07 0.00 0.05 0.00 0.00 55.36 56.78 1imp s GLN 85 Cb 0.00 -3.16 0.06 0.00 1.10 0.00 0.00 33.01 31.01 1imp s GLN 85 CO 0.00 0.49 0.74 0.41 -0.55 0.00 0.00 175.29 176.38