#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 1.19 0.00 0.03 2.13 -1.26 -4.95 120.64 117.79 1imp n GLU 2 Ca 0.00 0.43 0.00 0.00 0.66 0.00 0.00 57.16 58.25 1imp n GLU 2 Cb 0.00 -2.09 0.00 0.00 0.27 0.00 0.00 31.44 29.62 1imp n GLU 2 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1imp n LEU 3 N 3.12 0.00 0.00 4.31 0.00 -1.26 -5.09 117.00 118.09 1imp n LEU 3 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.21 1imp n LEU 3 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.60 1imp n LEU 3 CO 0.66 -0.01 0.00 0.29 0.00 0.00 0.00 177.39 178.33 1imp n LYS 4 N 0.00 2.76 -0.05 1.96 5.02 -1.26 -5.07 118.16 121.51 1imp n LYS 4 Ca 0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.18 1imp n LYS 4 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.97 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 -3.11 2.13 -0.00 -1.26 -5.09 115.22 107.89 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 -0.41 0.00 0.00 -0.00 0.00 0.00 29.99 29.58 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 -3.69 0.00 0.21 0.26 7.64 -1.26 -4.87 113.62 111.91 1imp n SER 6 Ca -0.21 -0.92 0.14 0.00 1.01 0.00 0.00 58.87 58.90 1imp n SER 6 Cb 0.56 0.00 0.74 0.00 -1.01 0.00 0.00 64.21 64.50 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 0.92 0.00 -0.08 0.44 2.10 -1.73 -1.02 117.51 118.14 1imp h ILE 7 Ca 0.00 -0.06 -0.10 0.00 1.08 0.00 0.00 64.86 65.79 1imp h ILE 7 Cb 0.00 0.73 -0.01 0.00 -1.09 0.00 0.00 36.82 36.45 1imp h ILE 7 CO 0.00 0.00 -0.39 -1.28 -1.08 0.00 0.00 178.15 175.40 1imp h SER 8 N 0.00 0.16 1.20 2.19 0.87 -1.81 -2.08 113.55 114.09 1imp h SER 8 Ca 0.00 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.50 1imp h SER 8 Cb 0.08 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 1imp h SER 8 CO 0.00 0.54 0.00 0.47 -0.53 0.00 0.00 176.83 177.31 1imp n ASP 9 N -4.05 0.47 -4.54 6.23 9.92 -0.39 -2.29 116.55 121.90 1imp n ASP 9 Ca -0.01 0.55 -0.34 0.00 -0.53 0.00 0.00 54.79 54.46 1imp n ASP 9 Cb 0.45 -0.67 -0.12 0.00 -0.64 0.00 0.00 41.12 40.14 1imp n ASP 9 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1imp s TYR 10 N -3.07 3.04 1.11 1.24 2.02 -0.78 -4.81 117.35 116.10 1imp s TYR 10 Ca 0.11 -0.18 -0.18 0.00 -0.37 0.00 0.00 57.07 56.45 1imp s TYR 10 Cb 0.14 -1.91 0.26 0.00 -0.40 0.00 0.00 41.96 40.05 1imp s TYR 10 CO 0.54 0.09 1.20 0.95 -1.57 0.00 0.00 175.55 176.76 1imp s THR 11 N 0.05 1.75 0.43 -0.71 -4.23 -1.26 -1.50 115.64 110.18 1imp s THR 11 Ca 0.00 0.00 0.36 0.00 -1.18 0.00 0.00 61.69 60.87 1imp s THR 11 Cb -0.13 -2.70 0.38 0.00 1.34 0.00 0.00 72.50 71.39 1imp s THR 11 CO 0.03 0.00 2.17 1.05 -0.54 0.00 0.00 174.62 177.33 1imp h GLU 12 N -2.22 0.00 0.00 3.99 -0.00 -1.89 -1.24 114.58 113.22 1imp h GLU 12 Ca -0.44 0.00 -0.12 0.00 -0.00 0.00 0.00 59.36 58.80 1imp h GLU 12 Cb 1.27 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 30.00 1imp h GLU 12 CO 0.35 0.04 -1.09 0.00 -0.00 0.00 0.00 179.01 178.30 1imp n ALA 13 N -2.15 0.74 -0.29 1.06 0.00 -1.26 -2.84 120.51 115.77 1imp n ALA 13 Ca -0.02 -0.63 0.20 0.00 0.00 0.00 0.00 53.44 52.99 1imp n ALA 13 Cb 0.19 -0.09 0.50 0.00 0.00 0.00 0.00 19.45 20.05 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 0.41 -0.06 0.00 5.08 -1.89 0.24 114.58 117.36 1imp h GLU 14 Ca -0.18 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.10 1imp h GLU 14 Cb 0.96 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1imp h GLU 14 CO -0.11 0.27 -0.18 0.35 -1.00 0.00 0.00 179.01 178.34 1imp h PHE 15 N 0.42 0.31 -0.27 4.33 3.57 -1.40 -2.62 116.94 121.28 1imp h PHE 15 Ca 0.53 -0.12 0.08 0.00 3.53 0.00 0.00 57.97 61.98 1imp h PHE 15 Cb 1.30 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.98 1imp h PHE 15 CO -0.00 0.80 0.39 1.25 -2.23 0.00 0.00 178.31 178.52 1imp h LEU 16 N -0.27 0.00 -0.19 0.59 6.46 -0.48 0.46 115.31 121.88 1imp h LEU 16 Ca -0.01 0.00 -0.13 0.00 -0.12 0.00 0.00 57.88 57.62 1imp h LEU 16 Cb 0.80 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.73 1imp h LEU 16 CO 0.04 0.00 -0.40 -0.61 -0.62 0.00 0.00 178.44 176.85 1imp h GLN 17 N 0.00 0.60 0.51 1.25 4.15 -0.52 -2.29 115.11 118.82 1imp h GLN 17 Ca 0.13 -0.40 -0.02 0.00 0.77 0.00 0.00 58.65 59.13 1imp h GLN 17 Cb 0.91 0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.65 1imp h GLN 17 CO -0.00 1.01 -0.32 1.25 -1.93 0.00 0.00 178.83 178.84 1imp h LEU 18 N 0.27 -0.83 -1.76 -2.39 5.85 0.05 -0.43 115.31 116.08 1imp h LEU 18 Ca 0.00 0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.79 1imp h LEU 18 Cb 1.01 0.24 -0.00 0.00 0.37 0.00 0.00 40.66 42.28 1imp h LEU 18 CO 0.09 -0.49 0.43 0.58 -0.34 0.00 0.00 178.44 178.71 1imp h VAL 19 N -0.79 0.04 -0.00 1.05 2.07 -1.51 0.12 116.25 117.23 1imp h VAL 19 Ca -0.07 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 1imp h VAL 19 Cb 0.63 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1imp h VAL 19 CO 0.06 0.00 -0.06 0.74 0.02 0.00 0.00 177.57 178.34 1imp h THR 20 N 0.00 1.58 0.00 2.57 2.02 -0.51 -1.93 112.91 116.65 1imp h THR 20 Ca 0.03 -1.79 -0.03 0.00 0.77 0.00 0.00 66.41 65.39 1imp h THR 20 Cb 0.89 2.76 -0.00 0.00 -1.74 0.00 0.00 68.15 70.06 1imp h THR 20 CO -0.00 0.47 -0.14 0.74 0.37 0.00 0.00 175.52 176.96 1imp h THR 21 N -0.68 0.70 0.07 3.16 2.02 0.03 -1.64 112.91 116.58 1imp h THR 21 Ca -0.01 -0.58 -0.00 0.00 0.77 0.00 0.00 66.41 66.59 1imp h THR 21 Cb 0.80 1.36 0.00 0.00 -1.74 0.00 0.00 68.15 68.57 1imp h THR 21 CO 0.01 0.14 -0.03 0.40 0.37 0.00 0.00 175.52 176.41 1imp h ILE 22 N 0.00 0.99 0.12 3.11 2.04 -1.42 -2.21 117.51 120.13 1imp h ILE 22 Ca -0.00 -1.51 0.01 0.00 1.00 0.00 0.00 64.86 64.36 1imp h ILE 22 Cb 0.34 1.78 -0.03 0.00 -0.74 0.00 0.00 36.82 38.18 1imp h ILE 22 CO 0.02 0.30 -0.21 0.00 0.00 0.00 0.00 178.15 178.26 1imp h ASN 24 N -0.40 0.00 -3.59 0.00 7.08 -1.44 -3.46 115.58 113.77 1imp h ASN 24 Ca 0.02 0.00 -0.20 0.00 -3.08 0.00 0.00 56.30 53.04 1imp h ASN 24 Cb 0.41 0.00 0.08 0.00 -2.08 0.00 0.00 38.32 36.73 1imp h ASN 24 CO -0.11 0.17 -0.36 0.00 -2.08 0.00 0.00 177.43 175.04 1imp n ALA 25 N -2.39 -0.75 0.25 4.14 0.00 -0.80 -4.88 120.51 116.09 1imp n ALA 25 Ca -0.02 0.17 0.06 0.00 0.00 0.00 0.00 53.44 53.64 1imp n ALA 25 Cb 0.25 -2.82 0.22 0.00 0.00 0.00 0.00 19.45 17.10 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 -1.09 3.05 -2.99 0.00 -0.08 -1.06 -4.90 116.55 109.48 1imp n ASP 26 Ca -0.02 -2.27 -0.15 0.00 -1.51 0.00 0.00 54.79 50.84 1imp n ASP 26 Cb 0.54 -0.45 0.11 0.00 2.34 0.00 0.00 41.12 43.66 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 0.58 0.00 -0.07 5.18 -2.24 -1.26 -4.95 114.28 111.52 1imp n THR 27 Ca 0.16 -0.50 0.09 0.00 -2.27 0.00 0.00 64.05 61.53 1imp n THR 27 Cb 0.58 -1.71 0.28 0.00 -2.10 0.00 0.00 70.33 67.39 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 -3.48 3.60 -3.64 3.42 3.41 -1.26 -4.91 113.62 110.76 1imp n SER 28 Ca 0.09 -2.15 -0.04 0.00 -0.26 0.00 0.00 58.87 56.51 1imp n SER 28 Cb 0.30 -0.46 -0.05 0.00 -0.26 0.00 0.00 64.21 63.74 1imp n SER 28 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1imp s SER 29 N -0.93 -0.10 0.40 4.04 0.01 -1.26 -5.01 113.70 110.85 1imp s SER 29 Ca 0.42 0.15 0.15 0.00 1.31 0.00 0.00 55.95 57.98 1imp s SER 29 Cb 0.24 0.13 0.84 0.00 0.21 0.00 0.00 66.02 67.44 1imp s SER 29 CO 0.25 -0.07 1.86 -0.33 0.41 0.00 0.00 173.24 175.37 1imp h GLU 30 N 2.60 0.00 -0.37 12.44 5.08 -1.95 -2.70 114.58 129.68 1imp h GLU 30 Ca -0.17 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 1imp h GLU 30 Cb 1.19 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.42 1imp h GLU 30 CO 0.21 0.32 0.20 1.49 -1.00 0.00 0.00 179.01 180.23 1imp h GLU 31 N 0.00 0.51 0.00 2.33 4.57 -2.00 -0.47 114.58 119.51 1imp h GLU 31 Ca -0.00 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.09 1imp h GLU 31 Cb 0.61 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 29.10 1imp h GLU 31 CO 0.04 0.42 -0.11 1.49 -1.18 0.00 0.00 179.01 179.67 1imp h GLU 32 N 0.46 0.00 0.00 1.92 4.81 -1.88 -0.40 114.58 119.49 1imp h GLU 32 Ca 0.13 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.30 1imp h GLU 32 Cb 0.06 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1imp h GLU 32 CO -0.02 0.11 -0.28 1.25 -0.73 0.00 0.00 179.01 179.34 1imp h LEU 33 N 0.00 0.00 0.00 1.64 7.12 -0.82 0.37 115.31 123.62 1imp h LEU 33 Ca -0.00 0.00 -0.05 0.00 0.13 0.00 0.00 57.88 57.96 1imp h LEU 33 Cb 0.34 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.47 1imp h LEU 33 CO 0.01 0.28 -0.32 1.62 -0.13 0.00 0.00 178.44 179.91 1imp h VAL 34 N 0.00 1.09 0.00 1.05 3.04 -0.64 -2.70 116.25 118.09 1imp h VAL 34 Ca -0.00 -1.93 0.00 0.00 -1.01 0.00 0.00 66.70 63.76 1imp h VAL 34 Cb 0.61 2.17 0.00 0.00 -2.01 0.00 0.00 31.29 32.06 1imp h VAL 34 CO 0.04 0.37 0.18 0.11 -1.01 0.00 0.00 177.57 177.26 1imp h LYS 35 N -1.00 0.00 0.02 4.17 1.57 -1.24 0.16 116.57 120.25 1imp h LYS 35 Ca -0.08 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.66 1imp h LYS 35 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.14 1imp h LYS 35 CO -0.05 0.00 -0.18 1.25 -0.57 0.00 0.00 179.45 179.91 1imp h LEU 36 N 0.00 0.13 0.27 2.94 5.85 -0.90 -2.66 115.31 120.93 1imp h LEU 36 Ca 0.00 -0.87 -0.01 0.00 0.84 0.00 0.00 57.88 57.83 1imp h LEU 36 Cb 0.36 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.36 1imp h LEU 36 CO 0.00 0.99 -0.13 1.62 -0.34 0.00 0.00 178.44 180.58 1imp h VAL 37 N -0.72 0.78 -0.88 1.05 3.04 -0.45 -1.53 116.25 117.54 1imp h VAL 37 Ca -0.03 -0.38 0.22 0.00 -1.01 0.00 0.00 66.70 65.50 1imp h VAL 37 Cb 1.03 1.00 -0.13 0.00 -2.01 0.00 0.00 31.29 31.18 1imp h VAL 37 CO 0.03 0.08 0.35 0.74 -1.01 0.00 0.00 177.57 177.77 1imp h THR 38 N -0.56 0.45 -0.42 3.17 2.02 -1.05 0.97 112.91 117.49 1imp h THR 38 Ca -0.04 -0.12 0.05 0.00 0.77 0.00 0.00 66.41 67.07 1imp h THR 38 Cb 0.41 0.06 -0.05 0.00 -1.74 0.00 0.00 68.15 66.84 1imp h THR 38 CO 0.06 0.06 0.16 -0.74 0.37 0.00 0.00 175.52 175.43 1imp h HIS 39 N 0.35 0.29 -0.69 3.16 6.17 -1.05 -0.20 115.15 123.18 1imp h HIS 39 Ca 0.55 0.02 0.13 0.00 0.71 0.00 0.00 60.37 61.79 1imp h HIS 39 Cb 1.05 -0.07 -0.10 0.00 2.52 0.00 0.00 27.41 30.82 1imp h HIS 39 CO -0.17 0.12 0.20 0.35 0.71 0.00 0.00 177.93 179.14 1imp h PHE 40 N 0.33 0.33 0.37 5.26 3.04 0.19 -0.79 116.94 125.67 1imp h PHE 40 Ca 0.19 0.04 -0.00 0.00 3.98 0.00 0.00 57.97 62.18 1imp h PHE 40 Cb 0.17 -0.04 -0.03 0.00 2.56 0.00 0.00 35.95 38.61 1imp h PHE 40 CO -0.14 -0.01 -0.51 0.93 -2.02 0.00 0.00 178.31 176.55 1imp h GLU 41 N 0.33 -0.88 0.00 1.11 5.08 0.13 -0.19 114.58 120.15 1imp h GLU 41 Ca 0.38 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.80 1imp h GLU 41 Cb 0.59 0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.04 1imp h GLU 41 CO -0.43 -0.59 0.00 -1.91 -1.00 0.00 0.00 179.01 175.08 1imp n GLU 42 N -5.54 0.02 -0.01 2.33 2.13 -0.79 -0.27 120.64 118.50 1imp n GLU 42 Ca -0.11 0.37 -0.00 0.00 0.66 0.00 0.00 57.16 58.08 1imp n GLU 42 Cb 0.45 -1.50 -0.00 0.00 0.27 0.00 0.00 31.44 30.65 1imp n GLU 42 CO 0.00 0.00 0.00 0.52 -0.41 0.00 0.00 177.13 177.24 1imp h MET 43 N 0.00 0.00 -0.25 5.31 2.86 0.38 -3.40 114.93 119.83 1imp h MET 43 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1imp h MET 43 Cb 0.09 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.75 1imp h MET 43 CO 0.00 0.00 0.00 -2.37 1.06 0.00 0.00 176.91 175.60 1imp n THR 44 N -2.42 0.33 -1.66 2.22 5.66 -0.83 -2.47 114.28 115.11 1imp n THR 44 Ca -0.00 -0.43 -0.06 0.00 -3.05 0.00 0.00 64.05 60.50 1imp n THR 44 Cb 0.02 0.38 -0.02 0.00 -1.55 0.00 0.00 70.33 69.16 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 0.51 -1.68 -1.48 1.09 1.02 0.62 -4.81 120.64 115.92 1imp n GLU 45 Ca 0.15 0.35 -0.40 0.00 -0.02 0.00 0.00 57.16 57.25 1imp n GLU 45 Cb 0.35 -4.63 0.02 0.00 -0.02 0.00 0.00 31.44 27.16 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 -1.99 -0.40 0.00 -0.32 -0.00 -1.26 -4.86 115.22 106.39 1imp n HIS 46 Ca -0.07 0.53 -0.09 0.00 0.46 0.00 0.00 57.72 58.55 1imp n HIS 46 Cb 0.34 -2.00 0.06 0.00 -0.12 0.00 0.00 29.99 28.27 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 0.66 0.56 0.00 1.57 0.13 -1.97 -2.73 132.00 130.23 1imp h PRO 47 Ca -0.43 -0.34 -0.19 0.00 -0.87 0.00 0.00 66.00 64.17 1imp h PRO 47 Cb 1.39 0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.53 1imp h PRO 47 CO 0.50 0.95 -0.91 0.77 -0.23 0.00 0.00 178.00 179.08 1imp h SER 48 N 0.44 0.01 0.00 1.44 0.02 -1.98 -3.47 113.55 110.01 1imp h SER 48 Ca 0.01 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1imp h SER 48 Cb 1.06 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.60 1imp h SER 48 CO 0.10 0.92 0.00 0.61 -1.14 0.00 0.00 176.83 177.32 1imp n GLY 49 N 1.09 1.65 0.00 -3.77 0.00 -1.03 -1.09 105.19 102.04 1imp n GLY 49 Ca -0.00 0.34 0.02 0.00 0.00 0.00 0.00 46.02 46.37 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 11.55 0.00 0.06 1.61 3.41 -1.26 -2.77 113.62 126.21 1imp n SER 50 Ca 0.00 -1.41 -0.18 0.00 -0.26 0.00 0.00 58.87 57.02 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 0.41 -0.70 4.04 3.58 -1.40 -1.00 116.42 121.34 1imp h ASP 51 Ca 0.00 -0.60 0.20 0.00 0.42 0.00 0.00 57.03 57.05 1imp h ASP 51 Cb 0.00 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 40.89 1imp h ASP 51 CO 0.00 1.51 0.82 0.25 -2.88 0.00 0.00 179.24 178.93 1imp h LEU 52 N 0.07 0.00 0.00 2.28 5.85 -1.73 3.35 115.31 125.13 1imp h LEU 52 Ca -0.27 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.15 1imp h LEU 52 Cb 2.03 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 43.01 1imp h LEU 52 CO 0.15 0.00 -2.09 -0.38 -0.34 0.00 0.00 178.44 175.79 1imp n ILE 53 N -3.46 1.09 -0.77 4.05 5.41 -1.23 -4.45 119.36 120.01 1imp n ILE 53 Ca 0.15 -0.39 -0.20 0.00 1.00 0.00 0.00 62.75 63.31 1imp n ILE 53 Cb 1.06 -1.28 0.11 0.00 -0.71 0.00 0.00 39.64 38.82 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 -3.21 2.31 -2.78 1.39 4.01 0.42 -4.38 117.16 114.92 1imp n TYR 54 Ca -0.35 -1.76 -0.10 0.00 -0.16 0.00 0.00 57.90 55.53 1imp n TYR 54 Cb 0.84 -0.88 0.07 0.00 -0.31 0.00 0.00 39.34 39.06 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 -0.60 -2.65 -2.72 -0.72 9.36 1.09 -4.74 117.16 116.18 1imp n TYR 55 Ca 0.45 -2.25 -0.37 0.00 3.32 0.00 0.00 57.90 59.05 1imp n TYR 55 Cb 1.17 1.44 -0.06 0.00 -0.63 0.00 0.00 39.34 41.26 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 0.08 4.52 0.71 2.98 0.04 -1.26 -4.68 135.00 137.38 1imp s PRO 56 Ca 0.25 1.39 -0.17 0.00 0.04 0.00 0.00 61.00 62.51 1imp s PRO 56 Cb 0.29 -2.78 -0.12 0.00 0.04 0.00 0.00 34.50 31.93 1imp s PRO 56 CO -0.08 0.21 -0.14 1.63 0.04 0.00 0.00 177.00 178.66 1imp n LYS 57 N 0.49 0.07 -2.58 4.56 5.02 -1.26 -4.73 118.16 119.74 1imp n LYS 57 Ca 0.02 0.04 -0.42 0.00 -2.02 0.00 0.00 58.31 55.93 1imp n LYS 57 Cb 0.50 -1.23 -0.01 0.00 -0.02 0.00 0.00 35.03 34.26 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 -1.79 3.80 0.00 1.97 2.56 -1.26 -2.66 118.70 121.32 1imp s GLU 58 Ca 0.54 -1.58 0.00 0.00 0.00 0.00 0.00 54.97 53.93 1imp s GLU 58 Cb -0.36 -5.45 0.00 0.00 2.00 0.00 0.00 34.13 30.32 1imp s GLU 58 CO 0.69 -2.23 0.00 0.41 -0.56 0.00 0.00 175.26 173.57 1imp n GLY 59 N 6.10 1.17 0.00 -1.50 0.00 -1.26 -5.11 105.19 104.59 1imp n GLY 59 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.43 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 -4.22 1.61 -0.08 -1.09 -5.13 116.55 107.64 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 -0.10 0.00 2.34 0.00 0.00 41.12 43.36 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 1.10 -0.36 1.67 1.11 -1.26 -4.88 116.67 113.05 1imp s ASP 61 Ca 0.00 -1.16 0.08 0.00 0.18 0.00 0.00 52.55 51.64 1imp s ASP 61 Cb 0.00 0.14 0.63 0.00 1.07 0.00 0.00 42.92 44.76 1imp s ASP 61 CO 0.00 -0.58 1.73 -0.90 1.18 0.00 0.00 175.17 176.60 1imp n ASP 62 N -0.21 3.66 -4.16 0.27 5.75 -1.26 -4.46 116.55 116.14 1imp n ASP 62 Ca -0.07 -3.53 -0.37 0.00 -0.01 0.00 0.00 54.79 50.82 1imp n ASP 62 Cb 0.63 -0.74 0.04 0.00 -1.03 0.00 0.00 41.12 40.02 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 -0.86 -4.47 -0.01 -1.12 7.64 -1.26 -4.87 113.62 108.67 1imp n SER 63 Ca 0.45 0.40 -0.08 0.00 1.01 0.00 0.00 58.87 60.65 1imp n SER 63 Cb 1.38 -0.87 -0.06 0.00 -1.01 0.00 0.00 64.21 63.64 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 -0.63 -0.10 -0.56 1.43 0.13 -1.93 -3.21 132.00 127.13 1imp h PRO 64 Ca -0.43 0.01 0.06 0.00 -0.87 0.00 0.00 66.00 64.77 1imp h PRO 64 Cb 1.35 0.02 -0.05 0.00 0.13 0.00 0.00 31.00 32.45 1imp h PRO 64 CO 0.32 0.33 0.26 0.77 -0.23 0.00 0.00 178.00 179.45 1imp h SER 65 N -0.96 0.34 0.14 1.44 0.02 -1.88 -0.43 113.55 112.21 1imp h SER 65 Ca -0.01 0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1imp h SER 65 Cb 0.47 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.00 1imp h SER 65 CO 0.02 0.22 -0.00 1.23 -1.14 0.00 0.00 176.83 177.16 1imp h GLY 66 N 0.49 0.00 1.25 -3.77 0.00 -1.94 0.14 103.07 99.24 1imp h GLY 66 Ca 0.26 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.30 1imp h GLY 66 CO -0.21 0.00 -1.52 -2.22 0.00 0.00 0.00 176.54 172.59 1imp h ILE 67 N 0.00 1.12 0.00 2.60 2.04 -1.11 -2.61 117.51 119.55 1imp h ILE 67 Ca -0.00 -2.85 -0.04 0.00 1.00 0.00 0.00 64.86 62.97 1imp h ILE 67 Cb 0.07 2.65 -0.01 0.00 -0.74 0.00 0.00 36.82 38.80 1imp h ILE 67 CO 0.00 0.75 -0.20 0.58 0.00 0.00 0.00 178.15 179.28 1imp h VAL 68 N 0.03 0.41 0.00 1.67 2.07 -0.30 -1.76 116.25 118.37 1imp h VAL 68 Ca -0.23 -1.23 -0.18 0.00 0.82 0.00 0.00 66.70 65.88 1imp h VAL 68 Cb 1.97 1.91 -0.03 0.00 -1.52 0.00 0.00 31.29 33.63 1imp h VAL 68 CO 0.13 0.20 -0.87 -1.13 0.02 0.00 0.00 177.57 175.91 1imp h ASN 69 N 0.00 0.00 -0.19 0.57 -0.73 -0.80 -1.28 115.58 113.15 1imp h ASN 69 Ca -0.00 0.00 -0.14 0.00 1.87 0.00 0.00 56.30 58.02 1imp h ASN 69 Cb 0.90 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.49 1imp h ASN 69 CO 0.03 0.87 -0.44 0.74 -0.37 0.00 0.00 177.43 178.25 1imp h THR 70 N 0.00 1.33 -0.09 -3.57 2.02 -1.00 -2.92 112.91 108.68 1imp h THR 70 Ca -0.01 -1.68 -0.04 0.00 0.77 0.00 0.00 66.41 65.45 1imp h THR 70 Cb 1.61 1.91 -0.00 0.00 -1.74 0.00 0.00 68.15 69.93 1imp h THR 70 CO 0.11 0.52 -0.09 1.62 0.37 0.00 0.00 175.52 178.06 1imp h VAL 71 N 0.31 1.37 -1.19 3.16 3.04 -1.35 0.41 116.25 121.99 1imp h VAL 71 Ca -0.00 -1.25 0.36 0.00 -1.01 0.00 0.00 66.70 64.80 1imp h VAL 71 Cb 1.05 2.00 -0.11 0.00 -2.01 0.00 0.00 31.29 32.22 1imp h VAL 71 CO 0.10 0.35 0.77 0.50 -1.01 0.00 0.00 177.57 178.27 1imp h LYS 72 N -0.21 0.21 0.00 4.17 3.64 -1.26 0.96 116.57 124.07 1imp h LYS 72 Ca 0.01 -0.01 -0.24 0.00 -1.27 0.00 0.00 60.65 59.14 1imp h LYS 72 Cb 0.60 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.34 1imp h LYS 72 CO 0.02 0.14 -1.43 1.96 -2.27 0.00 0.00 179.45 177.87 1imp h GLN 73 N 0.21 0.00 0.53 1.90 4.20 -1.29 -3.22 115.11 117.44 1imp h GLN 73 Ca 0.72 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 59.41 1imp h GLN 73 Cb 2.11 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.90 1imp h GLN 73 CO -0.37 0.58 -0.25 2.35 -0.67 0.00 0.00 178.83 180.46 1imp h TRP 74 N 0.00 -0.65 -0.18 2.96 7.01 0.31 -2.23 115.95 123.17 1imp h TRP 74 Ca -0.18 -0.02 0.02 0.00 2.11 0.00 0.00 58.89 60.82 1imp h TRP 74 Cb 1.85 0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 29.11 1imp h TRP 74 CO 0.00 -0.34 0.05 0.00 -2.79 0.00 0.00 178.44 175.36 1imp h ARG 75 N -0.87 0.13 -0.02 2.65 2.47 -1.27 0.11 114.38 117.59 1imp h ARG 75 Ca -0.07 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.64 1imp h ARG 75 Cb 0.60 -0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 28.89 1imp h ARG 75 CO 0.12 0.09 0.14 0.00 0.56 0.00 0.00 179.97 180.88 1imp h ALA 76 N 1.12 1.21 0.00 0.04 0.00 -1.55 1.60 119.26 121.67 1imp h ALA 76 Ca 0.08 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1imp h ALA 76 Cb 0.06 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1imp h ALA 76 CO -0.09 -0.15 -0.17 0.00 0.00 0.00 0.00 179.25 178.84 1imp h ALA 77 N 1.73 0.03 0.00 0.00 0.00 -0.23 -3.26 119.26 117.52 1imp h ALA 77 Ca 0.01 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1imp h ALA 77 Cb 0.29 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1imp h ALA 77 CO -0.00 0.11 0.00 0.09 0.00 0.00 0.00 179.25 179.45 1imp n ASN 78 N -4.65 0.00 -3.90 0.00 3.02 -0.09 -4.87 115.26 104.77 1imp n ASN 78 Ca -0.09 -1.68 -0.27 0.00 -0.03 0.00 0.00 54.58 52.52 1imp n ASN 78 Cb 0.32 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.48 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 0.64 -0.37 0.00 7.41 0.00 0.53 -4.95 105.19 108.45 1imp n GLY 79 Ca 0.07 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.30 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 3.13 0.02 1.61 4.76 -0.40 -4.93 118.16 117.96 1imp n LYS 80 Ca -0.27 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.29 1imp n LYS 80 Cb 0.67 0.00 0.21 0.00 -1.84 0.00 0.00 35.03 34.07 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 0.00 0.56 -0.71 4.39 2.88 -1.26 -4.96 113.62 114.52 1imp n SER 81 Ca 0.00 -0.14 0.09 0.00 -1.33 0.00 0.00 58.87 57.49 1imp n SER 81 Cb 0.00 0.27 -0.02 0.00 -0.75 0.00 0.00 64.21 63.71 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 1.45 -0.90 3.90 0.46 0.00 -1.26 -4.66 105.19 104.17 1imp n GLY 82 Ca 0.05 -0.56 -0.29 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.52 2.90 1.09 1.61 0.08 -1.25 -3.07 117.98 117.83 1imp s PHE 83 Ca 0.00 0.73 -0.12 0.00 0.12 0.00 0.00 56.93 57.65 1imp s PHE 83 Cb 0.00 -3.52 0.24 0.00 -0.57 0.00 0.00 43.02 39.18 1imp s PHE 83 CO 0.00 -1.80 1.06 -1.59 -0.10 0.00 0.00 175.22 172.78 1imp s LYS 84 N -5.58 -0.36 0.81 0.44 -2.85 -0.56 -4.84 119.74 106.80 1imp s LYS 84 Ca 0.62 0.76 -0.14 0.00 -1.00 0.00 0.00 55.97 56.21 1imp s LYS 84 Cb -0.11 -1.63 0.03 0.00 -2.06 0.00 0.00 37.83 34.07 1imp s LYS 84 CO 0.49 -3.33 0.79 0.94 0.10 0.00 0.00 175.35 174.34 1imp n GLN 85 N -4.63 0.12 0.00 1.78 7.27 -1.26 -4.46 117.38 116.20 1imp n GLN 85 Ca 0.04 0.10 0.12 0.00 0.07 0.00 0.00 57.00 57.33 1imp n GLN 85 Cb 0.55 -2.10 0.20 0.00 2.41 0.00 0.00 30.24 31.31 1imp n GLN 85 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54