#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 -4.35 0.00 3.17 1.02 -1.26 -5.02 120.64 114.20 1imp n GLU 2 Ca 0.00 3.31 0.00 0.00 -0.02 0.00 0.00 57.16 60.45 1imp n GLU 2 Cb 0.00 -5.20 0.00 0.00 -0.02 0.00 0.00 31.44 26.22 1imp n GLU 2 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1imp n LEU 3 N 1.44 0.00 0.00 -4.62 4.77 -1.26 -5.10 117.00 112.23 1imp n LEU 3 Ca -0.31 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.67 1imp n LEU 3 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1imp n LEU 3 CO 0.42 0.00 0.00 0.29 -1.33 0.00 0.00 177.39 176.77 1imp n LYS 4 N 0.00 3.19 -0.04 3.23 5.02 -1.26 -5.09 118.16 123.21 1imp n LYS 4 Ca 0.00 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.22 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 -3.76 2.13 -0.00 -1.26 -5.10 115.22 107.23 1imp n HIS 5 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 57.72 57.70 1imp n HIS 5 Cb 0.00 -0.35 -0.01 0.00 -0.00 0.00 0.00 29.99 29.63 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 -4.07 -0.16 0.27 0.26 3.41 -1.26 -4.82 113.62 107.24 1imp n SER 6 Ca -0.12 -1.28 0.18 0.00 -0.26 0.00 0.00 58.87 57.40 1imp n SER 6 Cb 0.38 0.32 0.94 0.00 -0.26 0.00 0.00 64.21 65.59 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 1.14 0.00 -0.32 -1.33 2.10 -1.56 -1.27 117.51 116.27 1imp h ILE 7 Ca -0.04 -0.04 -0.04 0.00 1.08 0.00 0.00 64.86 65.83 1imp h ILE 7 Cb 0.17 0.85 -0.02 0.00 -1.09 0.00 0.00 36.82 36.73 1imp h ILE 7 CO 0.05 0.00 0.04 -1.28 -1.08 0.00 0.00 178.15 175.88 1imp h SER 8 N 0.00 0.44 1.78 2.19 0.87 -1.77 -1.57 113.55 115.50 1imp h SER 8 Ca 0.00 -0.07 -0.04 0.00 -1.23 0.00 0.00 61.79 60.46 1imp h SER 8 Cb 0.04 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 1imp h SER 8 CO 0.00 0.48 -0.17 0.44 -0.53 0.00 0.00 176.83 177.04 1imp h ASP 9 N 0.47 0.00 -3.17 6.23 5.19 -1.52 -1.06 116.42 122.55 1imp h ASP 9 Ca 0.11 0.00 -0.61 0.00 -0.62 0.00 0.00 57.03 55.91 1imp h ASP 9 Cb 0.24 0.00 -0.10 0.00 0.18 0.00 0.00 39.33 39.64 1imp h ASP 9 CO 0.00 0.17 -0.43 -0.31 -3.12 0.00 0.00 179.24 175.56 1imp s TYR 10 N -3.15 3.46 1.11 4.55 2.02 -0.59 -4.63 117.35 120.13 1imp s TYR 10 Ca 0.06 0.46 -0.18 0.00 -0.37 0.00 0.00 57.07 57.03 1imp s TYR 10 Cb 0.06 -2.19 0.26 0.00 -0.40 0.00 0.00 41.96 39.69 1imp s TYR 10 CO 0.69 0.35 1.21 0.95 -1.57 0.00 0.00 175.55 177.18 1imp s THR 11 N 0.14 1.75 0.02 -0.71 -4.23 -1.26 -1.39 115.64 109.96 1imp s THR 11 Ca 0.12 0.00 0.32 0.00 -1.18 0.00 0.00 61.69 60.95 1imp s THR 11 Cb -0.12 -2.71 0.37 0.00 1.34 0.00 0.00 72.50 71.38 1imp s THR 11 CO 0.01 0.00 1.95 1.05 -0.54 0.00 0.00 174.62 177.09 1imp h GLU 12 N -2.23 0.00 0.00 3.99 -0.00 -1.91 -1.22 114.58 113.21 1imp h GLU 12 Ca -0.44 0.00 -0.36 0.00 -0.00 0.00 0.00 59.36 58.56 1imp h GLU 12 Cb 1.26 0.00 -0.05 0.00 -0.00 0.00 0.00 28.75 29.96 1imp h GLU 12 CO 0.34 0.00 -1.97 0.00 -0.00 0.00 0.00 179.01 177.37 1imp n ALA 13 N -2.04 1.01 -0.17 1.06 0.00 -1.26 -2.81 120.51 116.30 1imp n ALA 13 Ca 0.01 -0.83 0.04 0.00 0.00 0.00 0.00 53.44 52.66 1imp n ALA 13 Cb 0.28 -0.18 0.32 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 -0.99 0.81 -0.17 0.00 5.08 -1.91 0.38 114.58 117.79 1imp h GLU 14 Ca -0.55 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 57.68 1imp h GLU 14 Cb 1.48 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.55 1imp h GLU 14 CO -0.33 0.53 -0.25 0.35 -1.00 0.00 0.00 179.01 178.32 1imp h PHE 15 N 0.83 0.57 -0.46 4.33 3.57 -1.39 -2.49 116.94 121.90 1imp h PHE 15 Ca 0.28 -0.19 0.13 0.00 3.53 0.00 0.00 57.97 61.72 1imp h PHE 15 Cb 0.07 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 1imp h PHE 15 CO -0.00 0.88 0.35 1.25 -2.23 0.00 0.00 178.31 178.56 1imp h LEU 16 N 0.10 0.00 -0.54 0.59 6.46 -1.08 0.32 115.31 121.15 1imp h LEU 16 Ca 0.02 0.00 -0.13 0.00 -0.12 0.00 0.00 57.88 57.64 1imp h LEU 16 Cb 0.82 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 -0.27 1.56 -0.62 0.00 0.00 178.44 179.17 1imp h GLN 17 N 0.00 0.89 0.73 1.25 1.08 -0.52 -2.50 115.11 116.05 1imp h GLN 17 Ca 0.22 -0.40 -0.03 0.00 -1.45 0.00 0.00 58.65 56.99 1imp h GLN 17 Cb 0.91 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.32 1imp h GLN 17 CO -0.00 1.05 -0.41 1.25 -0.95 0.00 0.00 178.83 179.76 1imp h LEU 18 N 0.76 -1.03 -1.64 1.46 5.85 -0.17 -0.50 115.31 120.05 1imp h LEU 18 Ca 0.09 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.91 1imp h LEU 18 Cb 0.83 0.29 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 1imp h LEU 18 CO 0.07 -0.66 0.51 0.58 -0.34 0.00 0.00 178.44 178.61 1imp h VAL 19 N -1.06 0.08 0.05 1.05 2.07 -1.46 0.38 116.25 117.36 1imp h VAL 19 Ca -0.10 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 1imp h VAL 19 Cb 0.84 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1imp h VAL 19 CO 0.12 0.00 -0.02 0.74 0.02 0.00 0.00 177.57 178.43 1imp h THR 20 N 0.00 1.26 0.00 2.57 2.02 -0.66 -1.68 112.91 116.42 1imp h THR 20 Ca 0.07 -1.61 0.00 0.00 0.77 0.00 0.00 66.41 65.64 1imp h THR 20 Cb 1.10 2.23 0.00 0.00 -1.74 0.00 0.00 68.15 69.74 1imp h THR 20 CO -0.00 0.37 0.19 0.74 0.37 0.00 0.00 175.52 177.19 1imp h THR 21 N -0.86 0.00 0.00 3.16 2.02 0.08 0.54 112.91 117.86 1imp h THR 21 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.17 1imp h THR 21 Cb 0.66 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 1imp h THR 21 CO 0.01 0.00 -0.25 0.40 0.37 0.00 0.00 175.52 176.05 1imp h ILE 22 N 0.00 0.00 0.68 3.11 2.04 -1.36 -2.75 117.51 119.23 1imp h ILE 22 Ca 0.00 -0.69 -0.03 0.00 1.00 0.00 0.00 64.86 65.14 1imp h ILE 22 Cb 0.39 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.46 1imp h ILE 22 CO 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 178.15 177.75 1imp h ASN 24 N -1.01 0.00 -4.73 0.00 -0.26 -1.11 -3.45 115.58 105.02 1imp h ASN 24 Ca -0.09 0.00 -0.19 0.00 -0.56 0.00 0.00 56.30 55.47 1imp h ASN 24 Cb 0.81 0.00 0.14 0.00 -1.06 0.00 0.00 38.32 38.21 1imp h ASN 24 CO 0.10 0.00 -0.60 0.00 -1.06 0.00 0.00 177.43 175.87 1imp n ALA 25 N -2.03 -1.85 -0.00 -0.83 0.00 -0.50 -4.90 120.51 110.39 1imp n ALA 25 Ca 0.02 0.08 0.08 0.00 0.00 0.00 0.00 53.44 53.63 1imp n ALA 25 Cb 0.55 -3.95 0.27 0.00 0.00 0.00 0.00 19.45 16.32 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 -2.70 3.50 -4.69 0.00 -0.08 -1.04 -4.86 116.55 106.67 1imp n ASP 26 Ca -0.07 -2.18 -0.35 0.00 -1.51 0.00 0.00 54.79 50.68 1imp n ASP 26 Cb 0.59 -0.45 -0.09 0.00 2.34 0.00 0.00 41.12 43.51 1imp n ASP 26 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 1imp s THR 27 N -1.51 4.81 -0.06 5.18 -4.23 -1.26 -4.98 115.64 113.60 1imp s THR 27 Ca 0.40 -0.04 -0.00 0.00 -1.18 0.00 0.00 61.69 60.87 1imp s THR 27 Cb 0.23 -3.12 0.04 0.00 1.34 0.00 0.00 72.50 70.99 1imp s THR 27 CO 0.23 0.52 1.89 -1.20 -0.54 0.00 0.00 174.62 175.52 1imp n SER 28 N 2.94 5.26 -3.65 3.99 7.64 -1.26 -4.70 113.62 123.84 1imp n SER 28 Ca -0.18 -2.48 -0.01 0.00 1.01 0.00 0.00 58.87 57.21 1imp n SER 28 Cb 0.53 -1.05 -0.06 0.00 -1.01 0.00 0.00 64.21 62.62 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 1.56 -0.32 0.59 6.43 0.01 -1.26 -5.01 113.70 115.70 1imp s SER 29 Ca 0.06 0.52 0.35 0.00 1.31 0.00 0.00 55.95 58.19 1imp s SER 29 Cb 0.04 1.07 1.84 0.00 0.21 0.00 0.00 66.02 69.19 1imp s SER 29 CO 0.00 -0.08 2.20 -0.08 0.41 0.00 0.00 173.24 175.68 1imp h GLU 30 N 5.49 0.00 0.00 12.44 4.22 -1.99 -1.19 114.58 133.55 1imp h GLU 30 Ca -0.27 0.00 -0.11 0.00 0.08 0.00 0.00 59.36 59.06 1imp h GLU 30 Cb 1.18 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.41 1imp h GLU 30 CO 0.21 0.04 -0.52 1.49 -2.18 0.00 0.00 179.01 178.04 1imp h GLU 31 N 0.00 0.00 0.00 1.92 4.81 -1.96 -1.44 114.58 117.91 1imp h GLU 31 Ca -0.00 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 1imp h GLU 31 Cb 0.19 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1imp h GLU 31 CO 0.01 0.52 -0.66 0.93 -0.73 0.00 0.00 179.01 179.08 1imp h GLU 32 N 0.00 0.00 0.00 1.92 5.08 -1.61 -1.61 114.58 118.36 1imp h GLU 32 Ca -0.01 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 1imp h GLU 32 Cb 0.93 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 1imp h GLU 32 CO 0.07 0.54 -0.25 1.25 -1.00 0.00 0.00 179.01 179.62 1imp h LEU 33 N 0.00 0.00 0.00 1.33 7.12 -1.15 -2.42 115.31 120.19 1imp h LEU 33 Ca -0.02 0.00 -0.07 0.00 0.13 0.00 0.00 57.88 57.91 1imp h LEU 33 Cb 1.46 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.58 1imp h LEU 33 CO 0.07 0.25 -0.66 1.62 -0.13 0.00 0.00 178.44 179.59 1imp h VAL 34 N 0.00 0.41 -0.28 1.05 3.04 -1.24 -2.98 116.25 116.25 1imp h VAL 34 Ca -0.00 -1.46 0.08 0.00 -1.01 0.00 0.00 66.70 64.31 1imp h VAL 34 Cb 1.16 0.93 -0.01 0.00 -2.01 0.00 0.00 31.29 31.36 1imp h VAL 34 CO 0.03 0.14 0.52 0.50 -1.01 0.00 0.00 177.57 177.75 1imp h LYS 35 N -1.00 0.00 -0.02 4.17 3.64 -1.40 0.64 116.57 122.59 1imp h LYS 35 Ca -0.11 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.25 1imp h LYS 35 Cb 0.73 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 1imp h LYS 35 CO -0.07 0.00 -0.07 1.25 -2.27 0.00 0.00 179.45 178.29 1imp h LEU 36 N 0.00 0.10 0.26 5.20 5.85 -1.49 -2.15 115.31 123.07 1imp h LEU 36 Ca 0.13 -0.63 -0.01 0.00 0.84 0.00 0.00 57.88 58.21 1imp h LEU 36 Cb 1.18 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.18 1imp h LEU 36 CO -0.00 0.71 -0.12 1.62 -0.34 0.00 0.00 178.44 180.31 1imp h VAL 37 N -0.51 0.80 -0.96 1.05 3.04 0.33 -1.95 116.25 118.05 1imp h VAL 37 Ca -0.00 -0.55 0.22 0.00 -1.01 0.00 0.00 66.70 65.35 1imp h VAL 37 Cb 0.70 1.10 -0.12 0.00 -2.01 0.00 0.00 31.29 30.97 1imp h VAL 37 CO 0.02 0.12 0.53 0.74 -1.01 0.00 0.00 177.57 177.96 1imp h THR 38 N -0.64 0.58 -0.52 3.17 2.02 -1.00 0.77 112.91 117.29 1imp h THR 38 Ca -0.04 -0.20 0.03 0.00 0.77 0.00 0.00 66.41 66.98 1imp h THR 38 Cb 0.45 -0.05 -0.04 0.00 -1.74 0.00 0.00 68.15 66.78 1imp h THR 38 CO 0.06 0.11 0.30 -0.74 0.37 0.00 0.00 175.52 175.61 1imp h HIS 39 N 0.58 0.56 -0.72 3.16 6.17 -1.06 -0.54 115.15 123.30 1imp h HIS 39 Ca 0.59 0.02 0.13 0.00 0.71 0.00 0.00 60.37 61.81 1imp h HIS 39 Cb 1.05 -0.17 -0.09 0.00 2.52 0.00 0.00 27.41 30.71 1imp h HIS 39 CO -0.05 0.30 0.28 0.35 0.71 0.00 0.00 177.93 179.52 1imp h PHE 40 N 0.59 0.48 -0.30 5.26 3.04 0.13 -0.38 116.94 125.75 1imp h PHE 40 Ca 0.22 0.03 0.05 0.00 3.98 0.00 0.00 57.97 62.26 1imp h PHE 40 Cb 0.06 -0.10 -0.05 0.00 2.56 0.00 0.00 35.95 38.42 1imp h PHE 40 CO -0.08 0.07 -0.01 0.93 -2.02 0.00 0.00 178.31 177.21 1imp h GLU 41 N 0.44 0.07 0.00 1.11 5.08 -0.17 0.02 114.58 121.13 1imp h GLU 41 Ca 0.38 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 1imp h GLU 41 Cb 0.55 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1imp h GLU 41 CO -0.38 0.05 0.00 -1.91 -1.00 0.00 0.00 179.01 175.77 1imp n GLU 42 N -5.17 0.12 -0.02 2.33 2.13 -0.28 -0.19 120.64 119.55 1imp n GLU 42 Ca 0.00 0.37 -0.00 0.00 0.66 0.00 0.00 57.16 58.18 1imp n GLU 42 Cb 0.16 -1.73 -0.00 0.00 0.27 0.00 0.00 31.44 30.14 1imp n GLU 42 CO 0.00 0.00 0.00 1.98 -0.41 0.00 0.00 177.13 178.70 1imp h MET 43 N 0.00 0.00 -0.30 5.31 4.05 0.29 -3.38 114.93 120.90 1imp h MET 43 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1imp h MET 43 Cb 0.30 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.10 1imp h MET 43 CO 0.00 0.00 0.00 -2.37 0.23 0.00 0.00 176.91 174.77 1imp n THR 44 N -3.02 0.39 -1.74 -0.77 5.66 -0.95 -1.67 114.28 112.18 1imp n THR 44 Ca -0.01 -0.47 -0.06 0.00 -3.05 0.00 0.00 64.05 60.46 1imp n THR 44 Cb 0.02 0.39 -0.02 0.00 -1.55 0.00 0.00 70.33 69.17 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 0.60 -1.78 -1.85 1.09 1.02 0.73 -4.83 120.64 115.63 1imp n GLU 45 Ca 0.15 0.33 -0.39 0.00 -0.02 0.00 0.00 57.16 57.23 1imp n GLU 45 Cb 0.36 -4.63 0.02 0.00 -0.02 0.00 0.00 31.44 27.18 1imp n GLU 45 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1imp s HIS 46 N -1.85 2.48 0.00 -0.32 2.46 -1.25 -4.94 115.29 111.88 1imp s HIS 46 Ca 0.00 1.32 -0.25 0.00 0.47 0.00 0.00 55.06 56.60 1imp s HIS 46 Cb 0.00 -3.83 -0.18 0.00 -0.13 0.00 0.00 32.58 28.44 1imp s HIS 46 CO 0.00 -2.75 1.28 -1.00 -2.47 0.00 0.00 174.74 169.80 1imp h PRO 47 N 2.14 -0.22 -0.52 2.88 0.13 -1.94 -3.13 132.00 131.34 1imp h PRO 47 Ca -0.51 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1imp h PRO 47 Cb 1.27 0.05 -0.03 0.00 0.13 0.00 0.00 31.00 32.42 1imp h PRO 47 CO 0.60 0.13 0.34 0.66 -0.23 0.00 0.00 178.00 179.51 1imp h SER 48 N -0.60 0.59 0.00 1.44 4.64 -1.98 -3.45 113.55 114.19 1imp h SER 48 Ca -0.02 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1imp h SER 48 Cb 0.45 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1imp h SER 48 CO 0.04 0.43 0.00 0.61 -0.87 0.00 0.00 176.83 177.04 1imp n GLY 49 N -1.24 1.02 0.00 -0.77 0.00 -1.18 -1.21 105.19 101.81 1imp n GLY 49 Ca 0.03 0.44 0.07 0.00 0.00 0.00 0.00 46.02 46.56 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 10.53 0.00 0.06 1.61 3.41 -1.26 -2.67 113.62 125.30 1imp n SER 50 Ca 0.00 -1.05 -0.16 0.00 -0.26 0.00 0.00 58.87 57.41 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 0.34 0.00 4.04 1.82 -1.49 0.51 116.42 121.63 1imp h ASP 51 Ca 0.00 -0.47 0.00 0.00 -0.39 0.00 0.00 57.03 56.17 1imp h ASP 51 Cb 0.00 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 39.90 1imp h ASP 51 CO 0.00 1.39 0.12 -0.07 -1.61 0.00 0.00 179.24 179.07 1imp h LEU 52 N 0.06 0.00 0.00 2.28 4.07 -1.72 2.03 115.31 122.03 1imp h LEU 52 Ca -0.23 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.55 1imp h LEU 52 Cb 2.00 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 43.70 1imp h LEU 52 CO 0.16 0.00 -1.67 -0.38 -1.08 0.00 0.00 178.44 175.46 1imp n ILE 53 N -2.76 0.68 -0.37 1.22 5.41 -1.21 -4.47 119.36 117.86 1imp n ILE 53 Ca -0.02 -0.37 0.06 0.00 1.00 0.00 0.00 62.75 63.42 1imp n ILE 53 Cb 0.17 -0.80 0.30 0.00 -0.71 0.00 0.00 39.64 38.60 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 -2.51 1.50 -2.75 1.39 4.02 0.17 -4.47 117.16 114.51 1imp n TYR 54 Ca -0.18 -0.53 -0.09 0.00 -0.01 0.00 0.00 57.90 57.10 1imp n TYR 54 Cb 0.79 -0.38 0.07 0.00 -0.02 0.00 0.00 39.34 39.80 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 0.52 -3.03 -2.23 -0.72 9.36 0.68 -4.86 117.16 116.87 1imp n TYR 55 Ca 0.21 -1.99 -0.32 0.00 3.32 0.00 0.00 57.90 59.11 1imp n TYR 55 Cb 0.92 1.56 -0.01 0.00 -0.63 0.00 0.00 39.34 41.18 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 0.42 3.67 0.55 2.98 0.04 -1.26 -4.71 135.00 136.68 1imp s PRO 56 Ca 0.27 1.06 -0.19 0.00 0.04 0.00 0.00 61.00 62.18 1imp s PRO 56 Cb 0.26 -2.09 -0.08 0.00 0.04 0.00 0.00 34.50 32.63 1imp s PRO 56 CO -0.14 -0.51 0.68 1.63 0.04 0.00 0.00 177.00 178.70 1imp n LYS 57 N -1.80 0.69 -2.51 4.56 4.76 -1.26 -4.79 118.16 117.81 1imp n LYS 57 Ca 0.07 0.26 -0.40 0.00 -2.87 0.00 0.00 58.31 55.37 1imp n LYS 57 Cb 0.53 -1.83 -0.02 0.00 -1.84 0.00 0.00 35.03 31.88 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 -2.19 3.66 0.00 1.97 2.12 -1.26 -2.52 118.70 120.48 1imp s GLU 58 Ca 0.69 -1.54 0.00 0.00 0.36 0.00 0.00 54.97 54.48 1imp s GLU 58 Cb -0.46 -5.43 0.00 0.00 0.26 0.00 0.00 34.13 28.50 1imp s GLU 58 CO 0.53 -2.44 0.00 0.41 -0.54 0.00 0.00 175.26 173.23 1imp n GLY 59 N 6.02 0.77 0.00 -1.50 0.00 -1.26 -5.12 105.19 104.10 1imp n GLY 59 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 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 -4.25 1.61 2.03 -1.05 -5.14 116.55 109.76 1imp n ASP 60 Ca 0.00 0.00 -0.14 0.00 0.52 0.00 0.00 54.79 55.17 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 -1.81 -1.92 0.00 0.00 177.20 173.47 1imp s ASP 61 N -1.00 1.32 -0.46 1.67 1.11 -1.26 -4.91 116.67 113.13 1imp s ASP 61 Ca 0.00 -1.16 0.03 0.00 0.18 0.00 0.00 52.55 51.60 1imp s ASP 61 Cb 0.00 0.10 0.48 0.00 1.07 0.00 0.00 42.92 44.57 1imp s ASP 61 CO 0.00 -0.55 1.65 -0.90 1.18 0.00 0.00 175.17 176.55 1imp n ASP 62 N -0.25 5.58 -4.43 0.27 5.75 -1.26 -4.60 116.55 117.61 1imp n ASP 62 Ca -0.07 -3.76 -0.32 0.00 -0.01 0.00 0.00 54.79 50.62 1imp n ASP 62 Cb 0.63 -0.70 0.14 0.00 -1.03 0.00 0.00 41.12 40.16 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 -0.90 -1.81 -0.04 -1.12 7.64 -1.26 -4.93 113.62 111.20 1imp n SER 63 Ca 0.51 0.25 -0.12 0.00 1.01 0.00 0.00 58.87 60.52 1imp n SER 63 Cb 0.91 -1.20 -0.11 0.00 -1.01 0.00 0.00 64.21 62.80 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 -1.74 -0.03 -0.73 1.43 0.13 -1.94 -3.27 132.00 125.85 1imp h PRO 64 Ca -0.46 0.00 0.19 0.00 -0.87 0.00 0.00 66.00 64.87 1imp h PRO 64 Cb 1.29 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.39 1imp h PRO 64 CO 0.36 0.71 0.51 1.03 -0.23 0.00 0.00 178.00 180.39 1imp h SER 65 N -0.87 0.14 -0.10 1.44 0.87 -1.89 0.34 113.55 113.48 1imp h SER 65 Ca -0.00 0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.49 1imp h SER 65 Cb 0.75 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.68 1imp h SER 65 CO 0.00 0.06 -0.15 1.23 -0.53 0.00 0.00 176.83 177.44 1imp h GLY 66 N 0.14 0.50 2.00 5.77 0.00 -1.93 0.25 103.07 109.80 1imp h GLY 66 Ca 0.36 -0.35 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 1imp h GLY 66 CO -0.05 0.32 -0.62 -2.22 0.00 0.00 0.00 176.54 173.97 1imp h ILE 67 N 0.42 1.20 0.00 2.60 5.03 -1.02 -1.73 117.51 124.01 1imp h ILE 67 Ca 0.08 -2.35 -0.02 0.00 -0.12 0.00 0.00 64.86 62.45 1imp h ILE 67 Cb 0.52 2.36 -0.00 0.00 -3.03 0.00 0.00 36.82 36.67 1imp h ILE 67 CO 0.03 0.61 -0.44 0.58 -0.68 0.00 0.00 178.15 178.26 1imp h VAL 68 N 0.00 0.13 0.10 1.67 2.07 -0.93 -2.86 116.25 116.42 1imp h VAL 68 Ca -0.01 -1.20 -0.26 0.00 0.82 0.00 0.00 66.70 66.05 1imp h VAL 68 Cb 1.31 1.90 -0.00 0.00 -1.52 0.00 0.00 31.29 32.98 1imp h VAL 68 CO 0.08 0.07 -1.22 -1.13 0.02 0.00 0.00 177.57 175.39 1imp h ASN 69 N 0.00 0.33 -0.26 0.57 -1.24 -0.27 -1.39 115.58 113.32 1imp h ASN 69 Ca -0.01 -0.36 -0.16 0.00 0.71 0.00 0.00 56.30 56.48 1imp h ASN 69 Cb 1.08 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 40.01 1imp h ASN 69 CO 0.01 1.29 -0.44 0.74 -1.29 0.00 0.00 177.43 177.74 1imp h THR 70 N 0.06 1.28 -0.03 -3.57 2.02 -1.32 -2.98 112.91 108.36 1imp h THR 70 Ca -0.12 -1.62 -0.03 0.00 0.77 0.00 0.00 66.41 65.41 1imp h THR 70 Cb 1.94 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 69.84 1imp h THR 70 CO 0.18 0.53 -0.11 1.62 0.37 0.00 0.00 175.52 178.12 1imp h VAL 71 N 0.66 1.47 -1.14 3.16 3.04 -1.54 0.33 116.25 122.23 1imp h VAL 71 Ca 0.04 -1.54 0.37 0.00 -1.01 0.00 0.00 66.70 64.57 1imp h VAL 71 Cb 1.02 2.40 -0.14 0.00 -2.01 0.00 0.00 31.29 32.56 1imp h VAL 71 CO 0.10 0.42 0.69 0.50 -1.01 0.00 0.00 177.57 178.27 1imp h LYS 72 N -0.43 0.19 0.00 4.17 3.64 -1.24 0.88 116.57 123.77 1imp h LYS 72 Ca -0.00 -0.01 -0.20 0.00 -1.27 0.00 0.00 60.65 59.16 1imp h LYS 72 Cb 0.74 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.48 1imp h LYS 72 CO 0.02 0.12 -1.46 1.96 -2.27 0.00 0.00 179.45 177.83 1imp h GLN 73 N 0.19 0.00 -0.15 1.90 4.20 -1.42 -3.26 115.11 116.57 1imp h GLN 73 Ca 0.77 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.48 1imp h GLN 73 Cb 2.10 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.87 1imp h GLN 73 CO -0.51 0.36 0.09 2.35 -0.67 0.00 0.00 178.83 180.44 1imp h TRP 74 N 0.00 0.19 -0.03 2.96 7.01 0.29 -2.04 115.95 124.34 1imp h TRP 74 Ca -0.19 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 60.80 1imp h TRP 74 Cb 1.70 -0.06 -0.00 0.00 -2.10 0.00 0.00 29.16 28.69 1imp h TRP 74 CO 0.00 0.17 -0.01 0.00 -2.79 0.00 0.00 178.44 175.81 1imp h ARG 75 N 0.16 0.06 -0.02 2.65 2.47 -1.33 -0.36 114.38 118.00 1imp h ARG 75 Ca 0.05 -0.02 0.01 0.00 -1.26 0.00 0.00 59.98 58.75 1imp h ARG 75 Cb 0.04 -0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.36 1imp h ARG 75 CO -0.01 0.46 0.14 0.00 0.56 0.00 0.00 179.97 181.12 1imp h ALA 76 N 0.60 1.24 0.00 0.04 0.00 -1.59 1.58 119.26 121.13 1imp h ALA 76 Ca 0.01 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1imp h ALA 76 Cb 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1imp h ALA 76 CO 0.00 -0.15 -0.35 0.00 0.00 0.00 0.00 179.25 178.75 1imp h ALA 77 N 1.75 0.06 0.00 0.00 0.00 -0.95 -3.28 119.26 116.84 1imp h ALA 77 Ca 0.01 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1imp h ALA 77 Cb 0.29 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1imp h ALA 77 CO -0.00 0.22 0.00 0.09 0.00 0.00 0.00 179.25 179.56 1imp n ASN 78 N -4.60 0.00 -3.86 0.00 3.02 -0.18 -4.87 115.26 104.77 1imp n ASN 78 Ca -0.13 -1.61 -0.28 0.00 -0.03 0.00 0.00 54.58 52.54 1imp n ASN 78 Cb 0.41 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.58 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 0.67 -0.48 0.00 7.41 0.00 0.53 -4.96 105.19 108.36 1imp n GLY 79 Ca 0.09 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.36 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 -4.35 3.11 0.02 1.61 4.76 -0.38 -4.93 118.16 118.00 1imp n LYS 80 Ca -0.24 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.32 1imp n LYS 80 Cb 0.65 0.00 0.23 0.00 -1.84 0.00 0.00 35.03 34.08 1imp n LYS 80 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1imp n SER 81 N 0.00 0.54 -1.11 4.39 3.41 -1.26 -4.97 113.62 114.62 1imp n SER 81 Ca 0.00 -0.10 0.13 0.00 -0.26 0.00 0.00 58.87 58.63 1imp n SER 81 Cb 0.00 0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 64.14 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 1.45 -1.37 3.56 5.00 0.00 -1.26 -4.65 105.19 107.92 1imp n GLY 82 Ca 0.05 -0.91 -0.27 0.00 0.00 0.00 0.00 46.02 44.89 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 -3.15 -3.98 0.08 1.61 3.72 -1.25 -2.63 117.46 111.86 1imp n PHE 83 Ca 0.01 -1.08 -0.12 0.00 -0.05 0.00 0.00 57.45 56.21 1imp n PHE 83 Cb 0.42 -0.97 -0.07 0.00 -0.94 0.00 0.00 39.48 37.93 1imp n PHE 83 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1imp h LYS 84 N 0.00 0.25 -2.82 -1.08 3.64 0.06 -3.43 116.57 113.18 1imp h LYS 84 Ca -0.40 -0.32 0.07 0.00 -1.27 0.00 0.00 60.65 58.73 1imp h LYS 84 Cb 1.11 0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 33.00 1imp h LYS 84 CO 0.28 1.07 -0.61 0.94 -2.27 0.00 0.00 179.45 178.86 1imp n GLN 85 N -3.61 -2.19 0.00 1.90 7.27 -1.26 -4.96 117.38 114.52 1imp n GLN 85 Ca -0.05 1.73 0.00 0.00 0.07 0.00 0.00 57.00 58.74 1imp n GLN 85 Cb 0.89 -2.48 0.00 0.00 2.41 0.00 0.00 30.24 31.06 1imp n GLN 85 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54