#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 0.31 0.00 3.17 -0.00 -1.26 -5.16 120.64 117.70 1imp n GLU 2 Ca 0.00 -1.45 0.00 0.00 -0.00 0.00 0.00 57.16 55.71 1imp n GLU 2 Cb 0.00 1.34 0.00 0.00 -0.00 0.00 0.00 31.44 32.78 1imp n GLU 2 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1imp n LEU 3 N 0.00 0.00 0.00 -1.84 4.77 -1.26 -5.03 117.00 113.64 1imp n LEU 3 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1imp n LEU 3 Cb 0.29 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1imp n LEU 3 CO 0.15 -0.28 0.00 0.29 -1.33 0.00 0.00 177.39 176.22 1imp n LYS 4 N 0.00 2.93 -0.08 3.23 5.02 -1.26 -5.04 118.16 122.96 1imp n LYS 4 Ca 0.00 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.11 1imp n LYS 4 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 34.95 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 -3.22 2.13 -0.00 -1.26 -5.09 115.22 107.78 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 -0.59 0.00 0.00 -0.00 0.00 0.00 29.99 29.40 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 -3.77 0.69 0.20 0.26 3.41 -1.26 -4.81 113.62 108.34 1imp n SER 6 Ca -0.32 -0.22 0.12 0.00 -0.26 0.00 0.00 58.87 58.19 1imp n SER 6 Cb 0.72 0.00 0.24 0.00 -0.26 0.00 0.00 64.21 64.91 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 0.22 0.00 0.00 -1.33 2.10 -1.83 -3.06 117.51 113.60 1imp h ILE 7 Ca 0.00 -0.87 0.00 0.00 1.08 0.00 0.00 64.86 65.07 1imp h ILE 7 Cb 0.00 1.87 0.00 0.00 -1.09 0.00 0.00 36.82 37.60 1imp h ILE 7 CO 0.00 0.00 0.00 -0.24 -1.08 0.00 0.00 178.15 176.83 1imp n SER 8 N -2.92 0.01 0.05 2.19 2.88 -1.01 -1.46 113.62 113.36 1imp n SER 8 Ca 0.04 0.50 0.11 0.00 -1.33 0.00 0.00 58.87 58.19 1imp n SER 8 Cb 0.50 -0.50 -0.07 0.00 -0.75 0.00 0.00 64.21 63.38 1imp n SER 8 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1imp n ASP 9 N -1.51 0.49 -4.57 -3.46 5.75 -1.16 -3.21 116.55 108.89 1imp n ASP 9 Ca 0.03 0.19 -0.34 0.00 -0.01 0.00 0.00 54.79 54.66 1imp n ASP 9 Cb 0.12 1.11 -0.11 0.00 -1.03 0.00 0.00 41.12 41.20 1imp n ASP 9 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1imp s TYR 10 N -3.42 2.90 1.11 2.11 2.02 -0.53 -4.74 117.35 116.79 1imp s TYR 10 Ca -0.04 -0.00 -0.19 0.00 -0.37 0.00 0.00 57.07 56.47 1imp s TYR 10 Cb 0.11 -1.70 0.27 0.00 -0.40 0.00 0.00 41.96 40.24 1imp s TYR 10 CO 0.84 0.31 1.20 0.25 -1.57 0.00 0.00 175.55 176.59 1imp n THR 11 N 2.22 0.00 0.47 -0.71 -2.24 -1.26 -1.40 114.28 111.35 1imp n THR 11 Ca -0.18 -0.72 0.12 0.00 -2.27 0.00 0.00 64.05 61.01 1imp n THR 11 Cb 0.53 -1.37 0.47 0.00 -2.10 0.00 0.00 70.33 67.86 1imp n THR 11 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1imp n GLU 12 N -4.35 0.21 -0.11 -0.78 0.28 -1.26 -1.37 120.64 113.26 1imp n GLU 12 Ca 0.16 0.36 -0.17 0.00 -0.16 0.00 0.00 57.16 57.34 1imp n GLU 12 Cb 0.58 -1.84 -0.13 0.00 1.43 0.00 0.00 31.44 31.48 1imp n GLU 12 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1imp n ALA 13 N -1.77 1.39 -0.01 -1.84 0.00 -1.26 -2.74 120.51 114.28 1imp n ALA 13 Ca 0.03 -1.08 -0.04 0.00 0.00 0.00 0.00 53.44 52.35 1imp n ALA 13 Cb 0.29 -0.19 0.18 0.00 0.00 0.00 0.00 19.45 19.72 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 0.01 0.54 -0.01 0.00 5.08 -1.88 -0.28 114.58 118.04 1imp h GLU 14 Ca -0.55 -0.21 -0.08 0.00 -1.00 0.00 0.00 59.36 57.52 1imp h GLU 14 Cb 1.97 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 31.19 1imp h GLU 14 CO -0.05 0.74 -0.30 0.35 -1.00 0.00 0.00 179.01 178.76 1imp h PHE 15 N 0.48 0.32 -0.69 4.33 3.57 -1.40 -2.96 116.94 120.59 1imp h PHE 15 Ca 0.07 -0.17 0.17 0.00 3.53 0.00 0.00 57.97 61.57 1imp h PHE 15 Cb 0.68 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.34 1imp h PHE 15 CO 0.02 0.96 0.48 1.25 -2.23 0.00 0.00 178.31 178.79 1imp h LEU 16 N -0.41 0.19 -0.56 0.59 6.46 -1.34 0.43 115.31 120.66 1imp h LEU 16 Ca -0.03 0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 57.69 1imp h LEU 16 Cb 1.03 -0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.91 1imp h LEU 16 CO 0.06 0.09 0.18 -0.61 -0.62 0.00 0.00 178.44 177.55 1imp h GLN 17 N 0.20 0.87 0.25 1.25 -0.00 -0.90 -2.37 115.11 114.41 1imp h GLN 17 Ca 0.34 -0.18 -0.01 0.00 -0.00 0.00 0.00 58.65 58.79 1imp h GLN 17 Cb 1.04 -0.13 -0.01 0.00 0.00 0.00 0.00 27.48 28.39 1imp h GLN 17 CO -0.06 0.79 -0.21 1.25 0.00 0.00 0.00 178.83 180.59 1imp h LEU 18 N 0.79 -0.57 -1.81 -2.39 5.85 0.00 -0.99 115.31 116.18 1imp h LEU 18 Ca 0.18 0.04 0.49 0.00 0.84 0.00 0.00 57.88 59.44 1imp h LEU 18 Cb 0.27 0.18 -0.09 0.00 0.37 0.00 0.00 40.66 41.39 1imp h LEU 18 CO -0.01 -0.29 1.15 0.58 -0.34 0.00 0.00 178.44 179.53 1imp h VAL 19 N -0.45 0.11 0.13 1.05 2.07 -1.37 0.44 116.25 118.22 1imp h VAL 19 Ca -0.03 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1imp h VAL 19 Cb 0.38 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1imp h VAL 19 CO -0.01 0.00 -0.06 0.74 0.02 0.00 0.00 177.57 178.27 1imp h THR 20 N 0.03 1.02 0.00 2.57 2.02 -0.68 -1.31 112.91 116.57 1imp h THR 20 Ca 0.84 -1.12 0.00 0.00 0.77 0.00 0.00 66.41 66.90 1imp h THR 20 Cb 3.16 1.67 0.00 0.00 -1.74 0.00 0.00 68.15 71.24 1imp h THR 20 CO -0.14 0.25 0.21 0.74 0.37 0.00 0.00 175.52 176.94 1imp h THR 21 N -0.75 0.00 0.00 3.16 2.02 0.95 0.16 112.91 118.45 1imp h THR 21 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1imp h THR 21 Cb 0.54 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 1imp h THR 21 CO 0.03 0.00 -0.29 0.40 0.37 0.00 0.00 175.52 176.03 1imp h ILE 22 N 0.00 0.00 0.00 3.11 2.04 -1.05 -2.47 117.51 119.14 1imp h ILE 22 Ca 0.00 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.22 1imp h ILE 22 Cb 0.41 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1imp h ILE 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.15 1imp n ASN 24 N -1.77 0.86 -2.91 0.00 3.02 0.55 -4.96 115.26 110.05 1imp n ASN 24 Ca 0.00 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.50 1imp n ASN 24 Cb 0.06 1.58 0.02 0.00 -0.61 0.00 0.00 39.78 40.83 1imp n ASN 24 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1imp n ALA 25 N -2.26 -2.31 -0.27 5.41 0.00 -0.63 -4.93 120.51 115.52 1imp n ALA 25 Ca -0.10 0.05 0.06 0.00 0.00 0.00 0.00 53.44 53.45 1imp n ALA 25 Cb 0.63 -2.84 0.16 0.00 0.00 0.00 0.00 19.45 17.40 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 -2.21 3.02 -2.35 0.00 -0.08 -1.12 -4.99 116.55 108.83 1imp n ASP 26 Ca -0.02 -2.12 0.00 0.00 -1.51 0.00 0.00 54.79 51.14 1imp n ASP 26 Cb 0.54 -0.26 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 0.37 0.00 0.77 5.18 -2.24 -1.26 -4.91 114.28 112.19 1imp n THR 27 Ca 0.12 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.96 1imp n THR 27 Cb 0.48 -1.97 0.16 0.00 -2.10 0.00 0.00 70.33 66.90 1imp n THR 27 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1imp n SER 28 N -2.01 2.08 0.00 3.42 3.41 -1.26 -4.95 113.62 114.31 1imp n SER 28 Ca 0.00 -2.08 0.00 0.00 -0.26 0.00 0.00 58.87 56.53 1imp n SER 28 Cb 0.00 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 1imp n SER 28 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1imp n SER 29 N 0.46 0.00 0.14 4.04 7.64 -1.26 -4.95 113.62 119.69 1imp n SER 29 Ca 0.12 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.13 1imp n SER 29 Cb 0.36 0.00 0.41 0.00 -1.01 0.00 0.00 64.21 63.97 1imp n SER 29 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 1imp h GLU 30 N 0.00 0.00 0.28 1.43 4.11 -1.98 -3.15 114.58 115.28 1imp h GLU 30 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 1imp h GLU 30 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1imp h GLU 30 CO 0.00 0.00 -0.14 1.49 0.07 0.00 0.00 179.01 180.43 1imp h GLU 31 N 0.00 -0.36 0.00 1.06 4.81 -2.00 -1.82 114.58 116.26 1imp h GLU 31 Ca 0.00 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1imp h GLU 31 Cb 0.69 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.15 1imp h GLU 31 CO 0.00 -0.06 -0.05 0.93 -0.73 0.00 0.00 179.01 179.10 1imp h GLU 32 N -0.69 0.00 -0.03 1.92 3.07 -1.94 0.12 114.58 117.03 1imp h GLU 32 Ca -0.04 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.73 1imp h GLU 32 Cb 0.48 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.37 1imp h GLU 32 CO 0.06 0.05 -0.41 1.25 -1.40 0.00 0.00 179.01 178.56 1imp h LEU 33 N 0.00 0.06 0.02 1.33 7.12 -1.38 0.40 115.31 122.86 1imp h LEU 33 Ca -0.00 -0.02 -0.00 0.00 0.13 0.00 0.00 57.88 57.98 1imp h LEU 33 Cb 0.24 -0.02 0.00 0.00 -0.53 0.00 0.00 40.66 40.35 1imp h LEU 33 CO 0.01 0.47 -0.01 1.62 -0.13 0.00 0.00 178.44 180.39 1imp h VAL 34 N 0.05 1.28 0.00 1.05 3.04 -0.18 -2.37 116.25 119.12 1imp h VAL 34 Ca 0.00 -1.81 0.00 0.00 -1.01 0.00 0.00 66.70 63.88 1imp h VAL 34 Cb 0.75 2.36 0.00 0.00 -2.01 0.00 0.00 31.29 32.39 1imp h VAL 34 CO 0.06 0.41 0.17 0.11 -1.01 0.00 0.00 177.57 177.30 1imp h LYS 35 N -0.94 0.00 0.01 4.17 1.79 -1.23 0.16 116.57 120.53 1imp h LYS 35 Ca -0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 1imp h LYS 35 Cb 0.70 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.35 1imp h LYS 35 CO 0.01 0.00 -0.08 1.25 -1.08 0.00 0.00 179.45 179.55 1imp h LEU 36 N 0.00 0.06 0.27 2.94 5.85 -0.74 -2.49 115.31 121.20 1imp h LEU 36 Ca 0.00 -0.87 -0.01 0.00 0.84 0.00 0.00 57.88 57.84 1imp h LEU 36 Cb 0.33 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.35 1imp h LEU 36 CO 0.00 0.92 -0.13 1.62 -0.34 0.00 0.00 178.44 180.51 1imp h VAL 37 N -0.80 0.78 -0.66 1.05 3.04 -0.28 -2.18 116.25 117.20 1imp h VAL 37 Ca -0.01 -0.47 0.14 0.00 -1.01 0.00 0.00 66.70 65.35 1imp h VAL 37 Cb 0.94 1.03 -0.11 0.00 -2.01 0.00 0.00 31.29 31.15 1imp h VAL 37 CO 0.01 0.10 0.07 0.74 -1.01 0.00 0.00 177.57 177.48 1imp h THR 38 N -0.61 0.50 -0.64 3.17 2.02 -1.02 0.59 112.91 116.92 1imp h THR 38 Ca -0.04 -0.06 0.12 0.00 0.77 0.00 0.00 66.41 67.20 1imp h THR 38 Cb 0.44 0.31 -0.09 0.00 -1.74 0.00 0.00 68.15 67.07 1imp h THR 38 CO 0.06 0.03 0.16 -0.74 0.37 0.00 0.00 175.52 175.41 1imp h HIS 39 N 0.17 0.27 -0.93 3.16 6.17 -1.22 0.42 115.15 123.19 1imp h HIS 39 Ca 0.36 0.04 0.15 0.00 0.71 0.00 0.00 60.37 61.62 1imp h HIS 39 Cb 0.59 -0.02 -0.09 0.00 2.52 0.00 0.00 27.41 30.40 1imp h HIS 39 CO -0.33 -0.01 0.54 0.35 0.71 0.00 0.00 177.93 179.19 1imp h PHE 40 N 0.30 0.95 0.35 5.26 3.04 0.79 -1.88 116.94 125.75 1imp h PHE 40 Ca 0.34 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 62.30 1imp h PHE 40 Cb 0.50 -0.29 0.00 0.00 2.56 0.00 0.00 35.95 38.73 1imp h PHE 40 CO -0.23 0.28 -0.19 0.93 -2.02 0.00 0.00 178.31 177.09 1imp h GLU 41 N 0.77 -0.47 0.00 1.11 5.08 0.76 -2.49 114.58 119.35 1imp h GLU 41 Ca 0.49 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.89 1imp h GLU 41 Cb 0.64 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1imp h GLU 41 CO -0.33 -0.31 0.13 -1.91 -1.00 0.00 0.00 179.01 175.58 1imp n GLU 42 N -3.40 0.07 0.00 2.33 0.00 -0.84 -1.39 120.64 117.40 1imp n GLU 42 Ca -0.06 0.52 0.00 0.00 0.00 0.00 0.00 57.16 57.62 1imp n GLU 42 Cb 0.20 -1.85 0.00 0.00 0.00 0.00 0.00 31.44 29.78 1imp n GLU 42 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1imp n MET 43 N -1.86 0.00 0.00 5.31 2.81 -0.73 -4.36 117.12 118.29 1imp n MET 43 Ca -0.01 0.11 0.06 0.00 -1.81 0.00 0.00 57.70 56.06 1imp n MET 43 Cb 0.14 -0.51 0.38 0.00 -0.71 0.00 0.00 33.22 32.53 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 -1.25 0.00 -1.54 2.03 5.66 -1.01 -3.82 114.28 114.34 1imp n THR 44 Ca 0.00 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 60.94 1imp n THR 44 Cb 0.00 -0.43 -0.02 0.00 -1.55 0.00 0.00 70.33 68.33 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 -0.78 -1.54 -1.60 1.09 1.02 -0.49 -4.82 120.64 113.52 1imp n GLU 45 Ca 0.10 0.36 -0.39 0.00 -0.02 0.00 0.00 57.16 57.20 1imp n GLU 45 Cb 0.04 -4.59 0.04 0.00 -0.02 0.00 0.00 31.44 26.91 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 -1.84 0.84 -0.08 -0.32 -0.00 -1.26 -4.90 115.22 107.67 1imp n HIS 46 Ca -0.07 0.48 -0.14 0.00 0.46 0.00 0.00 57.72 58.45 1imp n HIS 46 Cb 0.30 -2.16 -0.05 0.00 -0.12 0.00 0.00 29.99 27.96 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 0.88 0.68 -0.09 1.57 0.13 -1.97 -2.93 132.00 130.28 1imp h PRO 47 Ca -0.47 -0.39 -0.15 0.00 -0.87 0.00 0.00 66.00 64.12 1imp h PRO 47 Cb 1.36 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.50 1imp h PRO 47 CO 0.53 1.00 -0.61 0.77 -0.23 0.00 0.00 178.00 179.46 1imp h SER 48 N 0.40 0.35 0.00 1.44 0.02 -1.98 -3.47 113.55 110.31 1imp h SER 48 Ca 0.03 -0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1imp h SER 48 Cb 0.91 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.35 1imp h SER 48 CO 0.08 0.87 0.00 0.61 -1.14 0.00 0.00 176.83 177.25 1imp n GLY 49 N 0.30 1.57 0.00 -3.77 0.00 -1.11 -1.16 105.19 101.02 1imp n GLY 49 Ca -0.03 0.30 0.03 0.00 0.00 0.00 0.00 46.02 46.33 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 11.52 0.00 0.07 1.61 3.41 -1.26 -2.72 113.62 126.25 1imp n SER 50 Ca 0.00 -1.35 -0.19 0.00 -0.26 0.00 0.00 58.87 57.07 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 0.47 -1.04 4.04 3.58 -1.43 -0.99 116.42 121.05 1imp h ASP 51 Ca 0.00 -0.65 0.30 0.00 0.42 0.00 0.00 57.03 57.10 1imp h ASP 51 Cb 0.00 -0.15 -0.04 0.00 1.72 0.00 0.00 39.33 40.85 1imp h ASP 51 CO 0.00 1.54 1.00 0.25 -2.88 0.00 0.00 179.24 179.15 1imp h LEU 52 N 0.08 0.00 0.00 2.28 5.85 -1.73 3.24 115.31 125.04 1imp h LEU 52 Ca -0.26 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 58.19 1imp h LEU 52 Cb 2.04 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 43.03 1imp h LEU 52 CO 0.18 0.00 -2.00 -0.38 -0.34 0.00 0.00 178.44 175.89 1imp n ILE 53 N -3.60 1.00 -0.77 4.05 5.41 -1.23 -4.47 119.36 119.76 1imp n ILE 53 Ca 0.23 -0.36 -0.20 0.00 1.00 0.00 0.00 62.75 63.42 1imp n ILE 53 Cb 1.33 -1.22 0.11 0.00 -0.71 0.00 0.00 39.64 39.15 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 -3.15 2.29 -2.76 1.39 4.01 0.49 -4.37 117.16 115.06 1imp n TYR 54 Ca -0.32 -1.79 -0.09 0.00 -0.16 0.00 0.00 57.90 55.54 1imp n TYR 54 Cb 0.82 -0.89 0.08 0.00 -0.31 0.00 0.00 39.34 39.03 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 -0.58 -2.76 -2.71 -0.72 9.36 1.05 -4.73 117.16 116.09 1imp n TYR 55 Ca 0.45 -2.19 -0.42 0.00 3.32 0.00 0.00 57.90 59.06 1imp n TYR 55 Cb 1.14 1.53 -0.03 0.00 -0.63 0.00 0.00 39.34 41.34 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 0.17 4.60 1.07 2.98 0.04 -1.26 -4.68 135.00 137.91 1imp s PRO 56 Ca 0.24 1.44 -0.19 0.00 0.04 0.00 0.00 61.00 62.53 1imp s PRO 56 Cb 0.29 -3.43 0.04 0.00 0.04 0.00 0.00 34.50 31.43 1imp s PRO 56 CO -0.07 0.03 -0.19 1.63 0.04 0.00 0.00 177.00 178.44 1imp n LYS 57 N 3.55 -1.05 -2.94 4.56 5.02 -1.26 -4.81 118.16 121.23 1imp n LYS 57 Ca 0.05 -0.29 -0.44 0.00 -2.02 0.00 0.00 58.31 55.61 1imp n LYS 57 Cb 0.50 -1.59 -0.02 0.00 -0.02 0.00 0.00 35.03 33.91 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 -3.20 3.77 0.00 1.97 2.12 -1.26 -3.53 118.70 118.58 1imp s GLU 58 Ca 0.52 -2.06 0.00 0.00 0.36 0.00 0.00 54.97 53.79 1imp s GLU 58 Cb -0.11 -4.96 0.00 0.00 0.26 0.00 0.00 34.13 29.33 1imp s GLU 58 CO 0.67 -1.76 0.00 0.41 -0.54 0.00 0.00 175.26 174.04 1imp n GLY 59 N 4.98 0.86 0.00 -1.50 0.00 -1.26 -5.11 105.19 103.16 1imp n GLY 59 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.30 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 -4.07 1.61 -0.08 -1.23 -5.12 116.55 107.66 1imp n ASP 60 Ca 0.00 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.15 1imp n ASP 60 Cb 0.00 0.00 -0.12 0.00 2.34 0.00 0.00 41.12 43.34 1imp n ASP 60 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 1imp s ASP 61 N -1.00 0.91 0.00 1.67 1.01 -1.26 -4.94 116.67 113.05 1imp s ASP 61 Ca 0.00 -0.54 0.20 0.00 0.71 0.00 0.00 52.55 52.92 1imp s ASP 61 Cb 0.00 0.03 0.56 0.00 1.01 0.00 0.00 42.92 44.51 1imp s ASP 61 CO 0.00 -0.19 1.46 -0.90 0.21 0.00 0.00 175.17 175.76 1imp n ASP 62 N 1.49 3.69 -4.18 0.27 5.68 -1.26 -4.75 116.55 117.50 1imp n ASP 62 Ca -0.22 -2.00 -0.35 0.00 -0.50 0.00 0.00 54.79 51.72 1imp n ASP 62 Cb 0.55 -0.42 0.08 0.00 -1.14 0.00 0.00 41.12 40.19 1imp n ASP 62 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1imp n SER 63 N 1.39 -4.23 0.03 -1.12 7.64 -1.26 -4.84 113.62 111.23 1imp n SER 63 Ca 0.21 0.23 -0.04 0.00 1.01 0.00 0.00 58.87 60.27 1imp n SER 63 Cb 0.58 -0.94 -0.03 0.00 -1.01 0.00 0.00 64.21 62.81 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 -1.26 -0.18 -0.65 1.43 0.13 -1.93 -3.12 132.00 126.42 1imp h PRO 64 Ca -0.44 0.01 0.13 0.00 -0.87 0.00 0.00 66.00 64.83 1imp h PRO 64 Cb 1.30 0.04 -0.12 0.00 0.13 0.00 0.00 31.00 32.35 1imp h PRO 64 CO 0.28 -0.04 -0.23 1.03 -0.23 0.00 0.00 178.00 178.82 1imp h SER 65 N -1.04 -0.81 -0.79 1.44 0.87 -1.88 0.38 113.55 111.72 1imp h SER 65 Ca -0.02 0.21 0.12 0.00 -1.23 0.00 0.00 61.79 60.87 1imp h SER 65 Cb 0.23 0.47 -0.06 0.00 -0.44 0.00 0.00 62.40 62.61 1imp h SER 65 CO 0.03 -0.25 0.52 1.23 -0.53 0.00 0.00 176.83 177.83 1imp h GLY 66 N -0.06 0.97 2.00 5.77 0.00 -1.94 0.22 103.07 110.03 1imp h GLY 66 Ca 0.29 -0.26 -0.12 0.00 0.00 0.00 0.00 47.33 47.24 1imp h GLY 66 CO -0.69 0.12 -0.58 -2.22 0.00 0.00 0.00 176.54 173.18 1imp h ILE 67 N 0.63 1.41 0.00 2.60 2.04 -0.25 -2.15 117.51 121.79 1imp h ILE 67 Ca 0.38 -1.98 -0.06 0.00 1.00 0.00 0.00 64.86 64.19 1imp h ILE 67 Cb 0.60 2.07 -0.01 0.00 -0.74 0.00 0.00 36.82 38.74 1imp h ILE 67 CO -0.14 0.56 -0.30 0.58 0.00 0.00 0.00 178.15 178.85 1imp h VAL 68 N 0.00 0.57 0.00 1.67 2.07 0.93 -2.29 116.25 119.20 1imp h VAL 68 Ca -0.01 -1.54 -0.10 0.00 0.82 0.00 0.00 66.70 65.87 1imp h VAL 68 Cb 1.02 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.86 1imp h VAL 68 CO 0.07 0.29 -0.48 -1.13 0.02 0.00 0.00 177.57 176.34 1imp h ASN 69 N 0.00 0.00 -0.20 0.57 -1.24 -0.35 -0.86 115.58 113.50 1imp h ASN 69 Ca -0.00 0.00 -0.20 0.00 0.71 0.00 0.00 56.30 56.80 1imp h ASN 69 Cb 1.05 0.00 0.01 0.00 0.73 0.00 0.00 38.32 40.11 1imp h ASN 69 CO 0.04 0.48 -0.67 0.74 -1.29 0.00 0.00 177.43 176.73 1imp h THR 70 N 0.00 1.28 -0.01 -3.57 2.02 -0.88 -3.02 112.91 108.74 1imp h THR 70 Ca -0.00 -1.86 -0.02 0.00 0.77 0.00 0.00 66.41 65.29 1imp h THR 70 Cb 1.09 1.86 0.00 0.00 -1.74 0.00 0.00 68.15 69.37 1imp h THR 70 CO 0.06 0.60 -0.08 1.62 0.37 0.00 0.00 175.52 178.09 1imp h VAL 71 N 0.56 1.57 -1.13 3.16 3.04 -1.34 0.19 116.25 122.29 1imp h VAL 71 Ca -0.03 -1.79 0.35 0.00 -1.01 0.00 0.00 66.70 64.22 1imp h VAL 71 Cb 1.29 2.75 -0.13 0.00 -2.01 0.00 0.00 31.29 33.19 1imp h VAL 71 CO 0.14 0.47 0.70 0.07 -1.01 0.00 0.00 177.57 177.94 1imp h LYS 72 N -0.64 0.24 0.01 4.17 2.10 -1.23 0.94 116.57 122.15 1imp h LYS 72 Ca -0.01 -0.01 -0.26 0.00 -2.00 0.00 0.00 60.65 58.37 1imp h LYS 72 Cb 0.82 -0.05 -0.04 0.00 -0.90 0.00 0.00 32.23 32.06 1imp h LYS 72 CO 0.02 0.16 -1.40 1.96 -2.00 0.00 0.00 179.45 178.19 1imp h GLN 73 N 0.25 0.01 0.55 0.07 4.20 -1.47 -3.23 115.11 115.49 1imp h GLN 73 Ca 0.73 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 59.39 1imp h GLN 73 Cb 1.97 0.01 0.01 0.00 0.30 0.00 0.00 27.48 29.77 1imp h GLN 73 CO -0.46 0.74 -0.26 2.35 -0.67 0.00 0.00 178.83 180.53 1imp h TRP 74 N 0.00 -0.68 -0.04 2.96 7.01 0.30 -2.17 115.95 123.33 1imp h TRP 74 Ca -0.17 -0.02 0.02 0.00 2.11 0.00 0.00 58.89 60.84 1imp h TRP 74 Cb 1.91 0.23 -0.02 0.00 -2.10 0.00 0.00 29.16 29.18 1imp h TRP 74 CO 0.00 -0.41 -0.07 0.00 -2.79 0.00 0.00 178.44 175.18 1imp h ARG 75 N -0.79 -0.10 -0.03 2.65 2.47 -1.29 0.12 114.38 117.42 1imp h ARG 75 Ca -0.08 0.01 0.01 0.00 -1.26 0.00 0.00 59.98 58.66 1imp h ARG 75 Cb 0.59 0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 28.93 1imp h ARG 75 CO 0.12 -0.07 0.20 0.00 0.56 0.00 0.00 179.97 180.79 1imp h ALA 76 N 0.92 1.27 0.00 0.04 0.00 -1.56 1.58 119.26 121.51 1imp h ALA 76 Ca 0.04 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1imp h ALA 76 Cb 0.17 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1imp h ALA 76 CO -0.10 -0.22 -0.21 0.00 0.00 0.00 0.00 179.25 178.72 1imp h ALA 77 N 1.62 0.03 -0.00 0.00 0.00 -0.19 -3.27 119.26 117.45 1imp h ALA 77 Ca 0.01 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1imp h ALA 77 Cb 0.42 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1imp h ALA 77 CO -0.00 0.14 0.00 0.09 0.00 0.00 0.00 179.25 179.48 1imp n ASN 78 N -4.64 0.01 -3.93 0.00 3.02 0.04 -4.86 115.26 104.90 1imp n ASN 78 Ca -0.09 -1.79 -0.28 0.00 -0.03 0.00 0.00 54.58 52.39 1imp n ASN 78 Cb 0.33 -0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.49 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 0.61 -0.40 0.00 7.41 0.00 0.53 -4.94 105.19 108.40 1imp n GLY 79 Ca 0.05 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.29 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 -4.41 2.47 0.00 1.61 4.76 -0.40 -4.93 118.16 117.26 1imp n LYS 80 Ca -0.26 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.30 1imp n LYS 80 Cb 0.66 0.00 0.32 0.00 -1.84 0.00 0.00 35.03 34.17 1imp n LYS 80 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1imp n SER 81 N 0.00 0.87 -0.81 4.39 7.64 -1.26 -4.95 113.62 119.50 1imp n SER 81 Ca 0.00 -0.70 0.09 0.00 1.01 0.00 0.00 58.87 59.27 1imp n SER 81 Cb 0.00 0.20 -0.02 0.00 -1.01 0.00 0.00 64.21 63.38 1imp n SER 81 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1imp n GLY 82 N 1.40 -0.99 0.00 0.23 0.00 -1.26 -4.55 105.19 100.02 1imp n GLY 82 Ca 0.10 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.37 -3.47 0.00 1.61 3.72 -1.26 -2.42 117.46 113.28 1imp n PHE 83 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1imp n PHE 83 Cb 0.30 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 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 -1.02 3.50 -4.41 -1.08 4.81 -0.50 -4.57 118.16 114.90 1imp n LYS 84 Ca 0.00 0.00 -0.22 0.00 -0.87 0.00 0.00 58.31 57.22 1imp n LYS 84 Cb 0.00 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 34.95 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 1.51 0.00 1.64 0.74 -1.26 -4.88 119.66 117.41 1imp s GLN 85 Ca 0.00 -1.66 0.00 0.00 0.05 0.00 0.00 55.36 53.75 1imp s GLN 85 Cb 0.00 -1.50 0.00 0.00 1.10 0.00 0.00 33.01 32.61 1imp s GLN 85 CO 0.00 0.28 0.00 0.41 -0.55 0.00 0.00 175.29 175.43