#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1imp s GLU 2 N 0.00 2.92 0.00 0.03 1.03 -1.26 -5.11 118.70 116.31 1imp s GLU 2 Ca 0.00 -0.46 0.00 0.00 0.03 0.00 0.00 54.97 54.54 1imp s GLU 2 Cb 0.00 -2.74 0.00 0.00 -0.80 0.00 0.00 34.13 30.59 1imp s GLU 2 CO 0.00 0.69 0.00 1.28 -1.33 0.00 0.00 175.26 175.90 1imp n LEU 3 N 2.02 0.00 0.00 1.83 4.77 -1.26 -5.05 117.00 119.31 1imp n LEU 3 Ca -0.18 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1imp n LEU 3 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 1imp n LEU 3 CO 0.29 -0.08 0.00 0.29 -1.33 0.00 0.00 177.39 176.56 1imp n LYS 4 N 0.00 2.95 -0.02 3.23 5.02 -1.26 -5.04 118.16 123.04 1imp n LYS 4 Ca 0.00 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.25 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 0.00 0.00 -2.61 2.13 -0.00 -1.26 -5.09 115.22 108.39 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 -0.15 0.00 0.00 -0.00 0.00 0.00 29.99 29.84 1imp n HIS 5 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 1imp n SER 6 N -3.00 0.00 0.32 0.26 7.64 -1.26 -4.89 113.62 112.68 1imp n SER 6 Ca -0.08 -0.16 0.21 0.00 1.01 0.00 0.00 58.87 59.85 1imp n SER 6 Cb 0.56 0.00 1.08 0.00 -1.01 0.00 0.00 64.21 64.84 1imp n SER 6 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 1imp h ILE 7 N 0.16 0.00 0.00 0.44 2.10 -1.85 -1.41 117.51 116.95 1imp h ILE 7 Ca 0.00 -0.12 -0.04 0.00 1.08 0.00 0.00 64.86 65.77 1imp h ILE 7 Cb 0.00 1.10 -0.01 0.00 -1.09 0.00 0.00 36.82 36.83 1imp h ILE 7 CO 0.00 0.00 -0.21 0.28 -1.08 0.00 0.00 178.15 177.14 1imp h SER 8 N 0.00 0.00 0.84 2.19 0.02 -1.86 -2.23 113.55 112.51 1imp h SER 8 Ca 0.00 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.74 1imp h SER 8 Cb 0.12 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.64 1imp h SER 8 CO 0.00 0.21 -0.99 -0.78 -1.14 0.00 0.00 176.83 174.13 1imp h ASP 9 N 0.00 0.11 -3.05 3.07 1.82 -1.58 -2.98 116.42 113.82 1imp h ASP 9 Ca -0.00 -0.11 -0.62 0.00 -0.39 0.00 0.00 57.03 55.91 1imp h ASP 9 Cb 0.41 -0.04 -0.10 0.00 0.68 0.00 0.00 39.33 40.29 1imp h ASP 9 CO 0.03 1.03 -0.47 -0.31 -1.61 0.00 0.00 179.24 177.91 1imp s TYR 10 N -2.85 3.49 0.42 0.28 2.02 -0.84 -4.74 117.35 115.12 1imp s TYR 10 Ca -0.01 0.44 -0.07 0.00 -0.37 0.00 0.00 57.07 57.06 1imp s TYR 10 Cb 0.10 -2.10 0.10 0.00 -0.40 0.00 0.00 41.96 39.66 1imp s TYR 10 CO 0.83 0.45 0.45 0.25 -1.57 0.00 0.00 175.55 175.96 1imp n THR 11 N 2.94 0.00 0.28 -0.71 -2.24 -1.26 -2.38 114.28 110.91 1imp n THR 11 Ca -0.17 -0.26 0.17 0.00 -2.27 0.00 0.00 64.05 61.52 1imp n THR 11 Cb 0.53 -1.40 0.75 0.00 -2.10 0.00 0.00 70.33 68.11 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 -0.00 -1.90 -0.47 114.58 111.43 1imp h GLU 12 Ca -0.16 0.00 -0.33 0.00 -0.00 0.00 0.00 59.36 58.88 1imp h GLU 12 Cb 0.46 0.00 -0.05 0.00 -0.00 0.00 0.00 28.75 29.16 1imp h GLU 12 CO 0.11 0.05 -1.90 0.00 -0.00 0.00 0.00 179.01 177.26 1imp n ALA 13 N -2.13 1.00 -0.34 1.06 0.00 -1.26 -2.71 120.51 116.13 1imp n ALA 13 Ca -0.00 -0.85 0.06 0.00 0.00 0.00 0.00 53.44 52.64 1imp n ALA 13 Cb 0.27 -0.09 0.24 0.00 0.00 0.00 0.00 19.45 19.87 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 0.98 -0.25 0.00 5.08 -1.89 0.36 114.58 117.86 1imp h GLU 14 Ca -0.49 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 57.71 1imp h GLU 14 Cb 1.40 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 1imp h GLU 14 CO -0.30 0.65 -0.25 0.35 -1.00 0.00 0.00 179.01 178.46 1imp h PHE 15 N 1.01 0.72 -0.02 4.33 3.57 -1.26 -1.62 116.94 123.68 1imp h PHE 15 Ca 0.46 -0.22 0.00 0.00 3.53 0.00 0.00 57.97 61.75 1imp h PHE 15 Cb 0.40 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 38.98 1imp h PHE 15 CO -0.00 0.93 0.09 1.25 -2.23 0.00 0.00 178.31 178.35 1imp h LEU 16 N 0.31 0.00 -0.25 0.59 6.46 -0.71 0.26 115.31 121.98 1imp h LEU 16 Ca 0.04 0.00 -0.21 0.00 -0.12 0.00 0.00 57.88 57.59 1imp h LEU 16 Cb 0.80 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.74 1imp h LEU 16 CO 0.06 0.00 -0.76 -0.61 -0.62 0.00 0.00 178.44 176.52 1imp h GLN 17 N 0.00 0.67 0.86 1.25 4.15 0.60 -2.21 115.11 120.42 1imp h GLN 17 Ca 0.01 -0.54 -0.04 0.00 0.77 0.00 0.00 58.65 58.84 1imp h GLN 17 Cb 0.19 0.11 0.01 0.00 0.21 0.00 0.00 27.48 28.00 1imp h GLN 17 CO -0.00 1.16 -0.41 1.25 -1.93 0.00 0.00 178.83 178.90 1imp h LEU 18 N 0.46 -0.97 -2.15 -2.39 5.85 -0.27 -0.96 115.31 114.87 1imp h LEU 18 Ca -0.04 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.73 1imp h LEU 18 Cb 1.37 0.25 -0.00 0.00 0.37 0.00 0.00 40.66 42.65 1imp h LEU 18 CO 0.15 -0.70 0.29 0.58 -0.34 0.00 0.00 178.44 178.42 1imp h VAL 19 N -1.15 0.10 -0.01 1.05 2.07 -1.56 0.37 116.25 117.12 1imp h VAL 19 Ca -0.12 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.26 1imp h VAL 19 Cb 0.88 0.73 0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1imp h VAL 19 CO 0.19 0.00 -0.57 0.74 0.02 0.00 0.00 177.57 177.95 1imp h THR 20 N 0.00 1.43 0.00 2.57 2.02 -0.63 -1.58 112.91 116.72 1imp h THR 20 Ca 0.04 -2.05 0.00 0.00 0.77 0.00 0.00 66.41 65.17 1imp h THR 20 Cb 0.62 2.58 0.00 0.00 -1.74 0.00 0.00 68.15 69.61 1imp h THR 20 CO -0.00 0.60 0.00 0.74 0.37 0.00 0.00 175.52 177.23 1imp h THR 21 N -0.12 0.00 0.00 3.16 2.02 0.34 0.19 112.91 118.50 1imp h THR 21 Ca -0.07 -0.12 -0.14 0.00 0.77 0.00 0.00 66.41 66.86 1imp h THR 21 Cb 1.28 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 68.66 1imp h THR 21 CO 0.11 0.00 -0.91 0.40 0.37 0.00 0.00 175.52 175.49 1imp h ILE 22 N 0.00 0.64 0.00 3.11 2.04 -1.33 -2.98 117.51 118.98 1imp h ILE 22 Ca 0.00 -1.77 0.00 0.00 1.00 0.00 0.00 64.86 64.09 1imp h ILE 22 Cb 0.13 1.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.70 1imp h ILE 22 CO 0.00 0.22 0.00 0.00 0.00 0.00 0.00 178.15 178.37 1imp n ASN 24 N -1.85 0.75 -3.44 0.00 5.03 0.65 -4.97 115.26 111.42 1imp n ASN 24 Ca 0.04 -0.75 -0.22 0.00 0.87 0.00 0.00 54.58 54.51 1imp n ASN 24 Cb 0.24 1.24 0.06 0.00 -1.02 0.00 0.00 39.78 40.29 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 -1.69 -2.51 -0.21 5.41 0.00 -1.02 -4.89 120.51 115.60 1imp n ALA 25 Ca 0.02 -0.03 0.08 0.00 0.00 0.00 0.00 53.44 53.51 1imp n ALA 25 Cb 0.39 -5.04 0.22 0.00 0.00 0.00 0.00 19.45 15.02 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 -2.98 3.34 -2.05 0.00 -0.08 -1.14 -4.96 116.55 108.69 1imp n ASP 26 Ca -0.08 -1.98 0.00 0.00 -1.51 0.00 0.00 54.79 51.22 1imp n ASP 26 Cb 0.61 -0.33 0.00 0.00 2.34 0.00 0.00 41.12 43.74 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 1.03 0.00 1.18 5.18 -2.24 -1.26 -4.93 114.28 113.24 1imp n THR 27 Ca 0.17 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 62.01 1imp n THR 27 Cb 0.51 -1.70 0.19 0.00 -2.10 0.00 0.00 70.33 67.23 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 -1.60 1.44 0.00 3.42 7.64 -1.26 -4.95 113.62 118.30 1imp n SER 28 Ca 0.00 -1.91 0.00 0.00 1.01 0.00 0.00 58.87 57.97 1imp n SER 28 Cb 0.00 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.04 1imp n SER 28 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1imp n SER 29 N 0.25 0.00 0.18 6.43 7.64 -1.26 -4.94 113.62 121.92 1imp n SER 29 Ca 0.11 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.13 1imp n SER 29 Cb 0.24 0.00 0.51 0.00 -1.01 0.00 0.00 64.21 63.95 1imp n SER 29 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1imp h GLU 30 N 0.00 0.00 0.61 1.43 5.08 -1.97 -3.14 114.58 116.59 1imp h GLU 30 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1imp h GLU 30 Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 1imp h GLU 30 CO 0.00 0.00 -0.29 1.49 -1.00 0.00 0.00 179.01 179.21 1imp h GLU 31 N 0.00 -0.79 0.00 2.33 4.57 -2.00 -1.09 114.58 117.61 1imp h GLU 31 Ca 0.00 0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.22 1imp h GLU 31 Cb 0.52 0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.29 1imp h GLU 31 CO 0.00 -0.48 -0.05 0.93 -1.18 0.00 0.00 179.01 178.23 1imp h GLU 32 N -0.97 0.00 -0.07 1.92 3.07 -1.94 0.36 114.58 116.96 1imp h GLU 32 Ca -0.08 0.00 -0.06 0.00 -0.50 0.00 0.00 59.36 58.72 1imp h GLU 32 Cb 0.67 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.57 1imp h GLU 32 CO 0.14 0.05 -0.21 1.25 -1.40 0.00 0.00 179.01 178.83 1imp h LEU 33 N 0.00 0.11 0.10 1.33 5.85 -1.38 0.46 115.31 121.79 1imp h LEU 33 Ca -0.00 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 1imp h LEU 33 Cb 0.10 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1imp h LEU 33 CO 0.01 0.34 -0.05 1.62 -0.34 0.00 0.00 178.44 180.02 1imp h VAL 34 N 0.11 0.99 0.00 1.05 3.04 0.34 -1.09 116.25 120.68 1imp h VAL 34 Ca 0.02 -1.37 0.00 0.00 -1.01 0.00 0.00 66.70 64.34 1imp h VAL 34 Cb 0.45 1.73 0.00 0.00 -2.01 0.00 0.00 31.29 31.45 1imp h VAL 34 CO 0.03 0.28 0.13 0.11 -1.01 0.00 0.00 177.57 177.11 1imp h LYS 35 N -0.88 0.00 0.16 4.17 1.57 -1.21 0.37 116.57 120.75 1imp h LYS 35 Ca -0.01 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.46 1imp h LYS 35 Cb 0.56 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.88 1imp h LYS 35 CO 0.02 0.00 -1.46 -0.07 -0.57 0.00 0.00 179.45 177.37 1imp h LEU 36 N 0.00 0.53 0.06 2.94 -0.00 -0.65 -2.97 115.31 115.22 1imp h LEU 36 Ca 0.00 -0.64 -0.00 0.00 -0.00 0.00 0.00 57.88 57.24 1imp h LEU 36 Cb 0.27 -0.17 0.00 0.00 -0.00 0.00 0.00 40.66 40.75 1imp h LEU 36 CO 0.00 1.52 -0.03 1.62 -0.00 0.00 0.00 178.44 181.55 1imp h VAL 37 N 0.09 1.25 -0.88 1.22 3.04 0.94 -2.74 116.25 119.17 1imp h VAL 37 Ca -0.23 -1.48 0.18 0.00 -1.01 0.00 0.00 66.70 64.16 1imp h VAL 37 Cb 2.05 2.16 -0.11 0.00 -2.01 0.00 0.00 31.29 33.38 1imp h VAL 37 CO 0.20 0.35 0.44 0.74 -1.01 0.00 0.00 177.57 178.29 1imp h THR 38 N -0.79 0.63 -0.60 3.17 2.02 -1.11 0.68 112.91 116.90 1imp h THR 38 Ca -0.01 -0.19 0.08 0.00 0.77 0.00 0.00 66.41 67.06 1imp h THR 38 Cb 0.63 0.03 -0.07 0.00 -1.74 0.00 0.00 68.15 67.00 1imp h THR 38 CO 0.01 0.10 0.25 -0.74 0.37 0.00 0.00 175.52 175.52 1imp h HIS 39 N 0.55 0.45 -0.72 3.16 6.17 -1.49 0.11 115.15 123.38 1imp h HIS 39 Ca 0.51 0.03 0.12 0.00 0.71 0.00 0.00 60.37 61.74 1imp h HIS 39 Cb 0.84 -0.11 -0.08 0.00 2.52 0.00 0.00 27.41 30.57 1imp h HIS 39 CO -0.10 0.15 0.31 0.35 0.71 0.00 0.00 177.93 179.35 1imp h PHE 40 N 0.46 0.54 -0.57 5.26 3.04 0.65 -0.16 116.94 126.16 1imp h PHE 40 Ca 0.29 0.03 0.09 0.00 3.98 0.00 0.00 57.97 62.37 1imp h PHE 40 Cb 0.32 -0.13 -0.07 0.00 2.56 0.00 0.00 35.95 38.63 1imp h PHE 40 CO -0.14 0.12 0.18 0.93 -2.02 0.00 0.00 178.31 177.38 1imp h GLU 41 N 0.49 0.34 0.00 1.11 5.08 -0.01 0.35 114.58 121.94 1imp h GLU 41 Ca 0.38 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.72 1imp h GLU 41 Cb 0.51 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 1imp h GLU 41 CO -0.35 0.22 -0.01 1.49 -1.00 0.00 0.00 179.01 179.37 1imp h GLU 42 N 0.35 0.00 0.00 2.33 4.57 -0.44 0.17 114.58 121.56 1imp h GLU 42 Ca 0.29 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.47 1imp h GLU 42 Cb 0.37 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1imp h GLU 42 CO -0.32 0.01 0.00 -1.33 -1.18 0.00 0.00 179.01 176.19 1imp n MET 43 N -3.11 0.00 -0.10 1.92 2.81 0.09 -4.24 117.12 114.49 1imp n MET 43 Ca -0.00 0.30 0.08 0.00 -1.81 0.00 0.00 57.70 56.27 1imp n MET 43 Cb 0.25 -0.89 0.28 0.00 -0.71 0.00 0.00 33.22 32.16 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 -1.41 0.27 -1.65 2.03 5.66 -1.07 -4.04 114.28 114.07 1imp n THR 44 Ca 0.00 -0.33 -0.06 0.00 -3.05 0.00 0.00 64.05 60.61 1imp n THR 44 Cb 0.00 0.22 -0.02 0.00 -1.55 0.00 0.00 70.33 68.99 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 0.22 -1.68 -1.50 1.09 1.02 0.60 -4.80 120.64 115.59 1imp n GLU 45 Ca 0.13 0.32 -0.41 0.00 -0.02 0.00 0.00 57.16 57.18 1imp n GLU 45 Cb 0.26 -4.60 0.01 0.00 -0.02 0.00 0.00 31.44 27.10 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 -1.96 0.01 -0.12 -0.32 -0.00 -1.25 -4.87 115.22 106.72 1imp n HIS 46 Ca -0.06 0.58 -0.13 0.00 0.46 0.00 0.00 57.72 58.56 1imp n HIS 46 Cb 0.33 -2.06 -0.02 0.00 -0.12 0.00 0.00 29.99 28.11 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 0.95 0.94 -0.06 1.57 0.13 -1.96 -2.90 132.00 130.67 1imp h PRO 47 Ca -0.42 -0.50 -0.18 0.00 -0.87 0.00 0.00 66.00 64.02 1imp h PRO 47 Cb 1.38 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.53 1imp h PRO 47 CO 0.53 1.16 -0.74 0.77 -0.23 0.00 0.00 178.00 179.48 1imp h SER 48 N 0.75 0.43 0.00 1.44 0.02 -1.98 -3.47 113.55 110.74 1imp h SER 48 Ca 0.06 -0.29 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 1imp h SER 48 Cb 1.00 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1imp h SER 48 CO 0.10 1.02 0.00 0.61 -1.14 0.00 0.00 176.83 177.42 1imp n GLY 49 N 0.58 1.07 0.00 -3.77 0.00 -1.10 -1.21 105.19 100.76 1imp n GLY 49 Ca -0.04 0.45 0.06 0.00 0.00 0.00 0.00 46.02 46.49 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 10.97 0.00 0.05 1.61 3.41 -1.26 -2.56 113.62 125.84 1imp n SER 50 Ca 0.00 -0.96 -0.14 0.00 -0.26 0.00 0.00 58.87 57.51 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 0.28 -0.80 4.04 3.58 -1.46 -1.34 116.42 120.72 1imp h ASP 51 Ca 0.00 -0.40 0.23 0.00 0.42 0.00 0.00 57.03 57.29 1imp h ASP 51 Cb 0.00 -0.09 -0.03 0.00 1.72 0.00 0.00 39.33 40.93 1imp h ASP 51 CO 0.00 1.33 0.85 0.25 -2.88 0.00 0.00 179.24 178.80 1imp h LEU 52 N 0.05 0.00 0.00 2.28 5.85 -1.71 3.66 115.31 125.44 1imp h LEU 52 Ca -0.22 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.16 1imp h LEU 52 Cb 1.98 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.95 1imp h LEU 52 CO 0.14 0.00 -2.22 -0.38 -0.34 0.00 0.00 178.44 175.64 1imp n ILE 53 N -3.54 1.22 -0.64 4.05 5.41 -1.22 -4.39 119.36 120.25 1imp n ILE 53 Ca 0.17 -0.43 -0.18 0.00 1.00 0.00 0.00 62.75 63.31 1imp n ILE 53 Cb 1.12 -1.38 0.10 0.00 -0.71 0.00 0.00 39.64 38.77 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 -3.33 2.09 -2.79 1.39 4.01 0.65 -4.32 117.16 114.86 1imp n TYR 54 Ca -0.39 -1.65 -0.10 0.00 -0.16 0.00 0.00 57.90 55.60 1imp n TYR 54 Cb 0.88 -0.83 0.07 0.00 -0.31 0.00 0.00 39.34 39.16 1imp n TYR 54 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 1imp n TYR 55 N -0.48 -2.56 -2.79 -0.72 9.36 1.18 -4.75 117.16 116.40 1imp n TYR 55 Ca 0.41 -2.30 -0.35 0.00 3.32 0.00 0.00 57.90 58.98 1imp n TYR 55 Cb 1.11 1.40 -0.07 0.00 -0.63 0.00 0.00 39.34 41.15 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 -0.01 4.38 0.81 2.98 0.04 -1.26 -4.68 135.00 137.26 1imp s PRO 56 Ca 0.25 1.22 -0.16 0.00 0.04 0.00 0.00 61.00 62.35 1imp s PRO 56 Cb 0.29 -2.45 -0.07 0.00 0.04 0.00 0.00 34.50 32.31 1imp s PRO 56 CO -0.07 0.10 0.06 1.63 0.04 0.00 0.00 177.00 178.76 1imp n LYS 57 N -0.11 0.05 -2.69 4.56 4.76 -1.26 -4.77 118.16 118.69 1imp n LYS 57 Ca 0.05 0.04 -0.43 0.00 -2.87 0.00 0.00 58.31 55.10 1imp n LYS 57 Cb 0.52 -1.50 -0.01 0.00 -1.84 0.00 0.00 35.03 32.20 1imp n LYS 57 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1imp s GLU 58 N -2.50 3.88 0.00 1.97 -6.30 -1.26 -2.97 118.70 111.51 1imp s GLU 58 Ca 0.56 -1.90 0.00 0.00 -2.50 0.00 0.00 54.97 51.13 1imp s GLU 58 Cb -0.30 -5.33 0.00 0.00 0.00 0.00 0.00 34.13 28.50 1imp s GLU 58 CO 0.68 -2.09 0.00 0.41 0.02 0.00 0.00 175.26 174.27 1imp n GLY 59 N 5.48 0.70 0.00 -1.50 0.00 -1.26 -5.11 105.19 103.49 1imp n GLY 59 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1imp n GLY 59 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1imp n ASP 60 N 0.00 0.00 -4.29 1.61 2.03 -1.16 -5.14 116.55 109.61 1imp n ASP 60 Ca 0.00 0.00 -0.16 0.00 0.52 0.00 0.00 54.79 55.15 1imp n ASP 60 Cb 0.00 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.30 1imp n ASP 60 CO 0.00 0.00 0.00 1.51 -1.92 0.00 0.00 177.20 176.79 1imp s ASP 61 N -1.00 1.87 -0.35 1.67 -4.77 -1.26 -4.89 116.67 107.94 1imp s ASP 61 Ca 0.00 -1.09 0.08 0.00 -3.30 0.00 0.00 52.55 48.23 1imp s ASP 61 Cb 0.00 -0.01 0.60 0.00 -1.09 0.00 0.00 42.92 42.41 1imp s ASP 61 CO 0.00 -0.39 1.67 -0.90 0.70 0.00 0.00 175.17 176.25 1imp n ASP 62 N -0.30 3.31 -4.41 2.11 5.75 -1.26 -4.52 116.55 117.23 1imp n ASP 62 Ca -0.08 -3.60 -0.32 0.00 -0.01 0.00 0.00 54.79 50.77 1imp n ASP 62 Cb 0.62 -0.72 0.16 0.00 -1.03 0.00 0.00 41.12 40.15 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 -0.98 -1.86 -0.03 -1.12 7.64 -1.26 -4.90 113.62 111.10 1imp n SER 63 Ca 0.43 0.14 -0.10 0.00 1.01 0.00 0.00 58.87 60.34 1imp n SER 63 Cb 1.31 -1.16 -0.09 0.00 -1.01 0.00 0.00 64.21 63.25 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 -1.90 -0.05 -0.49 1.43 0.13 -1.94 -3.19 132.00 125.99 1imp h PRO 64 Ca -0.49 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 64.74 1imp h PRO 64 Cb 1.31 0.01 -0.10 0.00 0.13 0.00 0.00 31.00 32.35 1imp h PRO 64 CO 0.38 0.57 -0.22 1.03 -0.23 0.00 0.00 178.00 179.53 1imp h SER 65 N -0.92 -0.75 -0.01 1.44 0.87 -1.92 0.26 113.55 112.52 1imp h SER 65 Ca -0.01 0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 1imp h SER 65 Cb 0.65 0.41 -0.00 0.00 -0.44 0.00 0.00 62.40 63.02 1imp h SER 65 CO 0.01 -0.24 0.01 1.23 -0.53 0.00 0.00 176.83 177.31 1imp h GLY 66 N -0.11 0.00 1.88 5.77 0.00 -1.95 0.21 103.07 108.87 1imp h GLY 66 Ca 0.23 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.45 1imp h GLY 66 CO -0.56 0.00 -0.57 -2.22 0.00 0.00 0.00 176.54 173.19 1imp h ILE 67 N 0.00 0.76 0.00 2.60 2.04 -0.57 -1.85 117.51 120.50 1imp h ILE 67 Ca 0.01 -2.11 -0.00 0.00 1.00 0.00 0.00 64.86 63.76 1imp h ILE 67 Cb 0.03 2.35 -0.00 0.00 -0.74 0.00 0.00 36.82 38.45 1imp h ILE 67 CO -0.00 0.43 -0.58 0.58 0.00 0.00 0.00 178.15 178.59 1imp h VAL 68 N 0.00 0.02 0.00 1.67 2.07 0.92 -2.73 116.25 118.20 1imp h VAL 68 Ca -0.02 -1.03 -0.14 0.00 0.82 0.00 0.00 66.70 66.33 1imp h VAL 68 Cb 1.38 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 32.86 1imp h VAL 68 CO 0.06 0.01 -0.73 -1.13 0.02 0.00 0.00 177.57 175.80 1imp h ASN 69 N 0.00 0.00 -0.27 0.57 -0.00 -0.57 -1.24 115.58 114.07 1imp h ASN 69 Ca -0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 56.30 56.17 1imp h ASN 69 Cb 1.01 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 39.33 1imp h ASN 69 CO 0.00 0.63 -0.35 0.74 -0.00 0.00 0.00 177.43 178.45 1imp h THR 70 N 0.00 1.30 -0.08 -3.57 2.02 -1.17 -2.96 112.91 108.45 1imp h THR 70 Ca -0.03 -1.53 -0.05 0.00 0.77 0.00 0.00 66.41 65.57 1imp h THR 70 Cb 1.50 1.65 0.00 0.00 -1.74 0.00 0.00 68.15 69.57 1imp h THR 70 CO 0.08 0.49 -0.17 1.62 0.37 0.00 0.00 175.52 177.91 1imp h VAL 71 N 0.45 1.41 -1.06 3.16 3.04 -1.48 0.41 116.25 122.17 1imp h VAL 71 Ca 0.03 -1.48 0.43 0.00 -1.01 0.00 0.00 66.70 64.67 1imp h VAL 71 Cb 0.93 2.20 -0.17 0.00 -2.01 0.00 0.00 31.29 32.23 1imp h VAL 71 CO 0.08 0.42 0.60 1.17 -1.01 0.00 0.00 177.57 178.83 1imp n LYS 72 N -4.58 -0.06 -0.02 4.17 4.81 -0.47 0.16 118.16 122.17 1imp n LYS 72 Ca -0.08 1.36 -0.09 0.00 -0.87 0.00 0.00 58.31 58.63 1imp n LYS 72 Cb 0.39 -2.48 -0.14 0.00 0.02 0.00 0.00 35.03 32.82 1imp n LYS 72 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1imp n GLN 73 N -5.17 0.64 -0.06 1.64 6.02 -1.12 -3.90 117.38 115.42 1imp n GLN 73 Ca 0.38 0.29 -0.07 0.00 -0.01 0.00 0.00 57.00 57.59 1imp n GLN 73 Cb 1.34 -1.78 -0.01 0.00 1.02 0.00 0.00 30.24 30.81 1imp n GLN 73 CO 0.00 0.00 0.00 2.35 -1.01 0.00 0.00 177.06 178.40 1imp h TRP 74 N 0.00 -0.39 -0.00 1.08 7.01 0.38 -1.15 115.95 122.89 1imp h TRP 74 Ca -0.30 0.03 0.03 0.00 2.11 0.00 0.00 58.89 60.76 1imp h TRP 74 Cb 2.02 0.21 -0.06 0.00 -2.10 0.00 0.00 29.16 29.24 1imp h TRP 74 CO 0.00 -0.23 -0.47 -0.09 -2.79 0.00 0.00 178.44 174.87 1imp h ARG 75 N -0.13 -0.60 -0.24 2.65 9.65 -1.16 0.39 114.38 124.95 1imp h ARG 75 Ca 0.15 0.04 0.07 0.00 -1.10 0.00 0.00 59.98 59.14 1imp h ARG 75 Cb 0.35 0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 29.06 1imp h ARG 75 CO -0.35 -0.40 0.32 0.00 2.80 0.00 0.00 179.97 182.34 1imp h ALA 76 N -0.19 1.81 0.07 2.80 0.00 -1.54 2.16 119.26 124.36 1imp h ALA 76 Ca 0.03 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1imp h ALA 76 Cb 0.69 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1imp h ALA 76 CO -0.34 -0.44 -0.03 0.00 0.00 0.00 0.00 179.25 178.44 1imp h ALA 77 N 1.58 -0.09 -0.12 0.00 0.00 0.84 -3.11 119.26 118.36 1imp h ALA 77 Ca 0.11 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1imp h ALA 77 Cb 0.75 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1imp h ALA 77 CO -0.00 -0.16 0.00 0.09 0.00 0.00 0.00 179.25 179.18 1imp n ASN 78 N -4.79 0.65 -4.19 0.00 3.02 0.68 -4.87 115.26 105.76 1imp n ASN 78 Ca -0.08 -1.98 -0.34 0.00 -0.03 0.00 0.00 54.58 52.15 1imp n ASN 78 Cb 0.30 -0.08 -0.04 0.00 -0.61 0.00 0.00 39.78 39.35 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 0.70 -0.36 0.00 7.41 0.00 0.71 -4.93 105.19 108.72 1imp n GLY 79 Ca 0.04 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -4.38 2.34 0.00 1.61 4.01 -0.47 -4.98 118.16 116.29 1imp n LYS 80 Ca -0.05 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.75 1imp n LYS 80 Cb 0.56 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.08 1imp n LYS 80 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1imp n SER 81 N 0.00 0.00 0.00 4.39 3.41 -1.26 -4.90 113.62 115.26 1imp n SER 81 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1imp n SER 81 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1imp n SER 81 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1imp n GLY 82 N 2.73 -0.39 3.88 5.00 0.00 -1.26 -4.97 105.19 110.18 1imp n GLY 82 Ca 0.00 -1.65 -0.29 0.00 0.00 0.00 0.00 46.02 44.08 1imp n GLY 82 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1imp s PHE 83 N -1.88 2.78 0.00 1.61 0.08 -1.26 -3.29 117.98 116.02 1imp s PHE 83 Ca 0.00 0.75 0.00 0.00 0.12 0.00 0.00 56.93 57.80 1imp s PHE 83 Cb 0.00 -3.50 0.00 0.00 -0.57 0.00 0.00 43.02 38.95 1imp s PHE 83 CO 0.00 -1.96 0.00 1.17 -0.10 0.00 0.00 175.22 174.33 1imp n LYS 84 N -3.44 3.00 -4.32 0.44 4.81 -1.00 -4.80 118.16 112.84 1imp n LYS 84 Ca 0.08 0.00 -0.27 0.00 -0.87 0.00 0.00 58.31 57.25 1imp n LYS 84 Cb 0.61 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 35.55 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 1.88 0.00 1.64 0.74 -1.26 -4.86 119.66 117.80 1imp s GLN 85 Ca 0.00 -1.31 0.00 0.00 0.05 0.00 0.00 55.36 54.10 1imp s GLN 85 Cb 0.00 -2.08 0.00 0.00 1.10 0.00 0.00 33.01 32.03 1imp s GLN 85 CO 0.00 0.44 0.00 0.41 -0.55 0.00 0.00 175.29 175.59