#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 0.02 0.00 0.03 -1.05 -1.26 -5.16 118.70 111.27 1imp s GLU 2 Ca 0.00 0.02 0.00 0.00 -0.15 0.00 0.00 54.97 54.84 1imp s GLU 2 Cb 0.00 0.01 0.00 0.00 -0.44 0.00 0.00 34.13 33.70 1imp s GLU 2 CO 0.00 -0.00 0.00 1.28 0.95 0.00 0.00 175.26 177.49 1imp n LEU 3 N 1.84 0.00 0.00 1.83 4.77 -1.26 -5.04 117.00 119.14 1imp n LEU 3 Ca -0.12 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 1imp n LEU 3 Cb 0.57 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 1imp n LEU 3 CO 0.02 -0.13 0.00 0.29 -1.33 0.00 0.00 177.39 176.24 1imp n LYS 4 N 0.00 2.15 -0.07 3.23 5.02 -1.26 -5.05 118.16 122.18 1imp n LYS 4 Ca 0.00 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.15 1imp n LYS 4 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 34.96 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 -2.58 2.13 -0.00 -1.26 -5.09 115.22 108.42 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 -0.53 0.00 0.00 -0.00 0.00 0.00 29.99 29.46 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 -4.06 0.00 0.23 0.26 7.64 -1.26 -4.96 113.62 111.47 1imp n SER 6 Ca -0.24 -0.47 0.16 0.00 1.01 0.00 0.00 58.87 59.32 1imp n SER 6 Cb 0.57 0.00 0.80 0.00 -1.01 0.00 0.00 64.21 64.57 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 0.47 0.00 -0.11 0.44 2.10 -1.84 -1.28 117.51 117.29 1imp h ILE 7 Ca 0.00 -0.06 -0.05 0.00 1.08 0.00 0.00 64.86 65.83 1imp h ILE 7 Cb 0.00 0.77 -0.01 0.00 -1.09 0.00 0.00 36.82 36.49 1imp h ILE 7 CO 0.00 0.00 -0.17 -1.28 -1.08 0.00 0.00 178.15 175.62 1imp h SER 8 N 0.00 0.17 1.34 2.19 0.87 -1.82 -1.84 113.55 114.46 1imp h SER 8 Ca 0.00 -0.04 -0.11 0.00 -1.23 0.00 0.00 61.79 60.41 1imp h SER 8 Cb 0.07 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 61.97 1imp h SER 8 CO 0.00 0.36 -0.54 -0.78 -0.53 0.00 0.00 176.83 175.34 1imp h ASP 9 N 0.17 0.00 -3.39 6.23 1.82 -1.54 -1.99 116.42 117.71 1imp h ASP 9 Ca 0.03 0.00 -0.60 0.00 -0.39 0.00 0.00 57.03 56.07 1imp h ASP 9 Cb 0.40 0.00 -0.12 0.00 0.68 0.00 0.00 39.33 40.29 1imp h ASP 9 CO 0.03 0.54 -0.44 -0.31 -1.61 0.00 0.00 179.24 177.44 1imp s TYR 10 N -3.03 3.38 0.86 0.28 2.02 -0.69 -4.68 117.35 115.50 1imp s TYR 10 Ca 0.03 0.36 -0.15 0.00 -0.37 0.00 0.00 57.07 56.95 1imp s TYR 10 Cb 0.08 -2.26 0.21 0.00 -0.40 0.00 0.00 41.96 39.60 1imp s TYR 10 CO 0.74 0.18 0.92 0.25 -1.57 0.00 0.00 175.55 176.08 1imp n THR 11 N 3.85 0.00 0.30 -0.71 -2.24 -1.26 -1.99 114.28 112.23 1imp n THR 11 Ca -0.14 -0.54 0.17 0.00 -2.27 0.00 0.00 64.05 61.27 1imp n THR 11 Cb 0.52 -1.37 0.72 0.00 -2.10 0.00 0.00 70.33 68.10 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 0.02 -0.78 4.11 -1.90 -1.22 114.58 114.81 1imp h GLU 12 Ca -0.32 0.00 -0.40 0.00 0.07 0.00 0.00 59.36 58.71 1imp h GLU 12 Cb 0.94 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.13 1imp h GLU 12 CO 0.22 0.00 -2.36 0.00 0.07 0.00 0.00 179.01 176.94 1imp n ALA 13 N -2.03 1.25 -0.04 1.06 0.00 -1.26 -2.83 120.51 116.65 1imp n ALA 13 Ca 0.00 -1.00 0.03 0.00 0.00 0.00 0.00 53.44 52.47 1imp n ALA 13 Cb 0.26 -0.13 0.37 0.00 0.00 0.00 0.00 19.45 19.95 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 -0.39 0.61 -0.01 0.00 5.08 -1.88 0.93 114.58 118.93 1imp h GLU 14 Ca -0.59 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 57.59 1imp h GLU 14 Cb 1.78 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 30.91 1imp h GLU 14 CO -0.19 0.44 -0.52 0.35 -1.00 0.00 0.00 179.01 178.09 1imp h PHE 15 N 0.63 0.54 -0.21 4.33 3.57 -1.40 -2.84 116.94 121.55 1imp h PHE 15 Ca 0.16 -0.29 0.06 0.00 3.53 0.00 0.00 57.97 61.44 1imp h PHE 15 Cb -0.00 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 1imp h PHE 15 CO 0.00 1.10 0.25 1.25 -2.23 0.00 0.00 178.31 178.68 1imp h LEU 16 N -0.17 0.00 -0.25 0.59 6.46 -1.20 0.37 115.31 121.11 1imp h LEU 16 Ca -0.06 0.00 -0.21 0.00 -0.12 0.00 0.00 57.88 57.49 1imp h LEU 16 Cb 1.24 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.17 1imp h LEU 16 CO 0.10 0.00 -0.75 -0.61 -0.62 0.00 0.00 178.44 176.56 1imp h GLN 17 N 0.00 0.67 0.91 1.25 -0.00 -0.62 -2.43 115.11 114.88 1imp h GLN 17 Ca 0.10 -0.54 -0.04 0.00 -0.00 0.00 0.00 58.65 58.17 1imp h GLN 17 Cb 0.60 0.11 0.01 0.00 0.00 0.00 0.00 27.48 28.20 1imp h GLN 17 CO -0.00 1.16 -0.43 1.25 0.00 0.00 0.00 178.83 180.80 1imp h LEU 18 N 0.46 -1.03 -2.18 -2.39 5.85 -0.09 -1.05 115.31 114.88 1imp h LEU 18 Ca -0.04 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.76 1imp h LEU 18 Cb 1.36 0.27 -0.01 0.00 0.37 0.00 0.00 40.66 42.65 1imp h LEU 18 CO 0.15 -0.73 0.28 0.58 -0.34 0.00 0.00 178.44 178.37 1imp h VAL 19 N -1.23 0.26 -0.05 1.05 2.07 -1.49 -0.03 116.25 116.84 1imp h VAL 19 Ca -0.12 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.32 1imp h VAL 19 Cb 0.93 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1imp h VAL 19 CO 0.20 0.00 -0.28 0.74 0.02 0.00 0.00 177.57 178.26 1imp h THR 20 N 0.00 1.45 0.00 2.57 2.02 -0.78 -1.37 112.91 116.80 1imp h THR 20 Ca 0.08 -1.74 0.00 0.00 0.77 0.00 0.00 66.41 65.52 1imp h THR 20 Cb 0.63 2.42 0.00 0.00 -1.74 0.00 0.00 68.15 69.47 1imp h THR 20 CO -0.00 0.49 0.04 0.74 0.37 0.00 0.00 175.52 177.16 1imp h THR 21 N -0.26 0.00 0.00 3.16 2.02 0.22 -0.21 112.91 117.84 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 0.94 0.72 0.00 0.00 -1.74 0.00 0.00 68.15 68.08 1imp h THR 21 CO 0.06 0.00 -0.21 -0.38 0.37 0.00 0.00 175.52 175.35 1imp n ILE 22 N -2.67 0.60 0.02 3.11 5.41 -1.00 -2.50 119.36 122.33 1imp n ILE 22 Ca -0.02 0.38 -0.10 0.00 1.00 0.00 0.00 62.75 64.01 1imp n ILE 22 Cb 0.09 -1.88 -0.04 0.00 -0.71 0.00 0.00 39.64 37.10 1imp n ILE 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1imp n ASN 24 N -5.25 0.60 -3.20 0.00 5.03 -0.10 -4.87 115.26 107.47 1imp n ASN 24 Ca -0.04 0.76 -0.09 0.00 0.87 0.00 0.00 54.58 56.08 1imp n ASN 24 Cb 0.17 -0.85 0.03 0.00 -1.02 0.00 0.00 39.78 38.12 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 -1.79 -2.51 -0.32 5.41 0.00 -0.08 -4.90 120.51 116.32 1imp n ALA 25 Ca -0.01 0.04 0.10 0.00 0.00 0.00 0.00 53.44 53.57 1imp n ALA 25 Cb 0.06 -3.63 0.27 0.00 0.00 0.00 0.00 19.45 16.15 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 -2.52 3.65 -2.33 0.00 2.03 -1.04 -4.96 116.55 111.39 1imp n ASP 26 Ca -0.05 -2.02 -0.04 0.00 0.52 0.00 0.00 54.79 53.21 1imp n ASP 26 Cb 0.57 -0.41 0.02 0.00 -0.72 0.00 0.00 41.12 40.58 1imp n ASP 26 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1imp n THR 27 N 1.25 0.00 0.34 5.18 -2.24 -1.26 -4.95 114.28 112.60 1imp n THR 27 Ca 0.20 -0.19 0.07 0.00 -2.27 0.00 0.00 64.05 61.86 1imp n THR 27 Cb 0.57 -1.59 0.22 0.00 -2.10 0.00 0.00 70.33 67.42 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 -3.05 2.87 0.00 3.42 7.64 -1.26 -4.94 113.62 118.30 1imp n SER 28 Ca 0.02 -2.15 0.00 0.00 1.01 0.00 0.00 58.87 57.75 1imp n SER 28 Cb 0.08 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.89 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 0.74 0.00 0.31 6.43 7.64 -1.26 -4.95 113.62 122.52 1imp n SER 29 Ca 0.16 0.00 0.19 0.00 1.01 0.00 0.00 58.87 60.23 1imp n SER 29 Cb 0.51 0.00 1.00 0.00 -1.01 0.00 0.00 64.21 64.71 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 0.73 1.43 3.07 -1.99 -2.83 114.58 114.99 1imp h GLU 30 Ca 0.00 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.83 1imp h GLU 30 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1imp h GLU 30 CO 0.00 0.02 -0.37 1.49 -1.40 0.00 0.00 179.01 178.75 1imp h GLU 31 N 0.00 -0.97 -0.32 2.33 4.57 -2.00 0.22 114.58 118.42 1imp h GLU 31 Ca -0.00 0.07 0.02 0.00 -1.18 0.00 0.00 59.36 58.26 1imp h GLU 31 Cb 0.14 0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.94 1imp h GLU 31 CO 0.00 -0.64 0.21 0.93 -1.18 0.00 0.00 179.01 178.33 1imp h GLU 32 N -1.00 0.36 -0.07 1.92 5.08 -1.89 0.65 114.58 119.64 1imp h GLU 32 Ca -0.10 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 1imp h GLU 32 Cb 0.78 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 1imp h GLU 32 CO 0.15 0.24 -0.18 1.25 -1.00 0.00 0.00 179.01 179.47 1imp h LEU 33 N 0.37 0.10 0.12 1.33 5.85 -1.20 -0.30 115.31 121.58 1imp h LEU 33 Ca 0.13 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1imp h LEU 33 Cb 0.04 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.05 1imp h LEU 33 CO -0.03 0.29 -0.06 1.62 -0.34 0.00 0.00 178.44 179.92 1imp h VAL 34 N 0.10 0.95 0.00 1.05 3.04 0.12 -1.08 116.25 120.42 1imp h VAL 34 Ca 0.02 -1.29 0.00 0.00 -1.01 0.00 0.00 66.70 64.42 1imp h VAL 34 Cb 0.37 1.64 0.00 0.00 -2.01 0.00 0.00 31.29 31.29 1imp h VAL 34 CO 0.03 0.26 0.22 0.11 -1.01 0.00 0.00 177.57 177.17 1imp h LYS 35 N -0.87 0.00 0.21 4.17 1.79 -1.11 0.52 116.57 121.28 1imp h LYS 35 Ca -0.02 0.00 -0.32 0.00 -2.18 0.00 0.00 60.65 58.13 1imp h LYS 35 Cb 0.55 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.22 1imp h LYS 35 CO 0.03 0.00 -1.45 -0.07 -1.08 0.00 0.00 179.45 176.88 1imp h LEU 36 N 0.00 0.69 0.05 2.94 -0.00 -0.73 -2.99 115.31 115.28 1imp h LEU 36 Ca 0.00 -0.77 -0.00 0.00 -0.00 0.00 0.00 57.88 57.11 1imp h LEU 36 Cb 0.43 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 40.87 1imp h LEU 36 CO 0.00 1.61 -0.03 1.62 -0.00 0.00 0.00 178.44 181.64 1imp h VAL 37 N 0.12 1.29 -0.87 1.22 3.04 0.12 -2.69 116.25 118.48 1imp h VAL 37 Ca -0.23 -1.48 0.20 0.00 -1.01 0.00 0.00 66.70 64.18 1imp h VAL 37 Cb 2.11 2.21 -0.12 0.00 -2.01 0.00 0.00 31.29 33.48 1imp h VAL 37 CO 0.24 0.35 0.38 0.74 -1.01 0.00 0.00 177.57 178.28 1imp h THR 38 N -0.77 0.54 -0.55 3.17 2.02 -1.03 0.82 112.91 117.10 1imp h THR 38 Ca -0.01 -0.15 0.07 0.00 0.77 0.00 0.00 66.41 67.09 1imp h THR 38 Cb 0.63 0.06 -0.06 0.00 -1.74 0.00 0.00 68.15 67.04 1imp h THR 38 CO 0.01 0.08 0.24 -0.74 0.37 0.00 0.00 175.52 175.48 1imp h HIS 39 N 0.44 0.42 -0.79 3.16 6.17 -1.48 0.36 115.15 123.44 1imp h HIS 39 Ca 0.52 0.03 0.11 0.00 0.71 0.00 0.00 60.37 61.74 1imp h HIS 39 Cb 0.93 -0.11 -0.08 0.00 2.52 0.00 0.00 27.41 30.68 1imp h HIS 39 CO -0.14 0.16 0.41 0.35 0.71 0.00 0.00 177.93 179.43 1imp h PHE 40 N 0.45 0.74 -0.56 5.26 3.04 0.96 -0.65 116.94 126.19 1imp h PHE 40 Ca 0.26 0.03 0.04 0.00 3.98 0.00 0.00 57.97 62.28 1imp h PHE 40 Cb 0.25 -0.21 -0.04 0.00 2.56 0.00 0.00 35.95 38.50 1imp h PHE 40 CO -0.14 0.26 0.31 0.93 -2.02 0.00 0.00 178.31 177.65 1imp h GLU 41 N 0.67 0.58 0.00 1.11 4.39 0.19 -0.36 114.58 121.16 1imp h GLU 41 Ca 0.40 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.06 1imp h GLU 41 Cb 0.44 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 1imp h GLU 41 CO -0.29 0.39 0.00 -1.91 -1.16 0.00 0.00 179.01 176.04 1imp n GLU 42 N -4.82 0.13 0.00 2.33 0.00 -0.36 -0.40 120.64 117.51 1imp n GLU 42 Ca 0.05 0.31 0.00 0.00 0.00 0.00 0.00 57.16 57.53 1imp n GLU 42 Cb 0.12 -1.73 0.00 0.00 0.00 0.00 0.00 31.44 29.84 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 -1.97 0.00 -0.17 5.31 2.81 -0.17 -4.29 117.12 118.65 1imp n MET 43 Ca 0.03 0.38 0.08 0.00 -1.81 0.00 0.00 57.70 56.38 1imp n MET 43 Cb 0.25 -0.90 0.23 0.00 -0.71 0.00 0.00 33.22 32.08 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 -1.65 0.46 -1.49 2.03 5.66 -1.09 -3.68 114.28 114.51 1imp n THR 44 Ca 0.00 -0.50 -0.10 0.00 -3.05 0.00 0.00 64.05 60.40 1imp n THR 44 Cb 0.00 0.32 -0.04 0.00 -1.55 0.00 0.00 70.33 69.07 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 0.62 -1.42 -1.58 1.09 1.02 0.46 -4.82 120.64 116.00 1imp n GLU 45 Ca 0.14 0.56 -0.41 0.00 -0.02 0.00 0.00 57.16 57.43 1imp n GLU 45 Cb 0.35 -4.81 0.01 0.00 -0.02 0.00 0.00 31.44 26.97 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 -1.93 0.85 -0.03 -0.32 -0.00 -1.25 -4.90 115.22 107.65 1imp n HIS 46 Ca -0.10 0.56 -0.13 0.00 0.46 0.00 0.00 57.72 58.51 1imp n HIS 46 Cb 0.37 -2.18 -0.09 0.00 -0.12 0.00 0.00 29.99 27.97 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 1.34 0.18 -0.50 1.57 0.13 -1.94 -3.21 132.00 129.56 1imp h PRO 47 Ca -0.44 -0.10 -0.06 0.00 -0.87 0.00 0.00 66.00 64.53 1imp h PRO 47 Cb 1.35 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.47 1imp h PRO 47 CO 0.56 0.65 0.07 0.66 -0.23 0.00 0.00 178.00 179.71 1imp h SER 48 N -0.29 0.81 0.00 1.44 4.64 -1.99 -3.46 113.55 114.70 1imp h SER 48 Ca 0.01 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1imp h SER 48 Cb 0.63 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1imp h SER 48 CO 0.02 0.87 0.00 0.61 -0.87 0.00 0.00 176.83 177.47 1imp n GLY 49 N -0.51 1.77 0.00 -0.77 0.00 -1.21 -1.27 105.19 103.21 1imp n GLY 49 Ca 0.01 0.28 0.05 0.00 0.00 0.00 0.00 46.02 46.37 1imp n GLY 49 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1imp n SER 50 N 11.32 0.00 0.10 1.61 7.64 -1.26 -2.71 113.62 130.32 1imp n SER 50 Ca 0.00 -1.14 -0.20 0.00 1.01 0.00 0.00 58.87 58.54 1imp n SER 50 Cb 0.00 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.05 1imp n SER 50 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 1imp h ASP 51 N 0.00 0.59 -0.16 6.43 1.82 -1.51 -0.53 116.42 123.06 1imp h ASP 51 Ca 0.00 -0.70 0.05 0.00 -0.39 0.00 0.00 57.03 55.99 1imp h ASP 51 Cb 0.00 -0.19 -0.01 0.00 0.68 0.00 0.00 39.33 39.81 1imp h ASP 51 CO 0.00 1.56 0.44 -0.07 -1.61 0.00 0.00 179.24 179.57 1imp h LEU 52 N 0.10 0.00 0.00 2.28 4.07 -1.73 1.37 115.31 121.40 1imp h LEU 52 Ca -0.23 0.00 -0.22 0.00 0.08 0.00 0.00 57.88 57.51 1imp h LEU 52 Cb 2.07 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 43.77 1imp h LEU 52 CO 0.22 0.00 -1.82 -0.38 -1.08 0.00 0.00 178.44 175.37 1imp n ILE 53 N -3.13 0.83 -0.49 1.22 5.41 -1.21 -4.49 119.36 117.49 1imp n ILE 53 Ca 0.02 -0.38 -0.06 0.00 1.00 0.00 0.00 62.75 63.33 1imp n ILE 53 Cb 0.54 -0.90 0.22 0.00 -0.71 0.00 0.00 39.64 38.78 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 -2.75 1.86 -2.86 1.39 4.01 -0.18 -4.43 117.16 114.19 1imp n TYR 54 Ca -0.24 -0.98 -0.12 0.00 -0.16 0.00 0.00 57.90 56.41 1imp n TYR 54 Cb 0.81 -0.57 0.05 0.00 -0.31 0.00 0.00 39.34 39.32 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 -0.10 -2.11 -2.69 -0.72 4.19 0.45 -4.86 117.16 111.32 1imp n TYR 55 Ca 0.31 -2.55 -0.42 0.00 3.31 0.00 0.00 57.90 58.55 1imp n TYR 55 Cb 1.14 1.08 -0.03 0.00 0.49 0.00 0.00 39.34 42.02 1imp n TYR 55 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 1imp s PRO 56 N -0.38 4.40 0.98 2.98 0.04 -1.26 -4.80 135.00 136.96 1imp s PRO 56 Ca 0.28 1.37 -0.15 0.00 0.04 0.00 0.00 61.00 62.54 1imp s PRO 56 Cb 0.29 -3.56 -0.06 0.00 0.04 0.00 0.00 34.50 31.22 1imp s PRO 56 CO -0.08 -0.35 -0.25 1.63 0.04 0.00 0.00 177.00 177.99 1imp n LYS 57 N 5.17 -0.17 -2.68 4.56 4.01 -1.26 -4.75 118.16 123.05 1imp n LYS 57 Ca 0.09 -0.03 -0.43 0.00 -0.51 0.00 0.00 58.31 57.43 1imp n LYS 57 Cb 0.48 -1.41 -0.01 0.00 -0.51 0.00 0.00 35.03 33.58 1imp n LYS 57 CO 0.00 0.00 0.00 -2.00 -1.11 0.00 0.00 177.40 174.29 1imp s GLU 58 N -2.78 3.83 0.00 1.97 2.12 -1.26 -3.00 118.70 119.58 1imp s GLU 58 Ca 0.48 -1.80 0.00 0.00 0.36 0.00 0.00 54.97 54.01 1imp s GLU 58 Cb -0.19 -5.33 0.00 0.00 0.26 0.00 0.00 34.13 28.88 1imp s GLU 58 CO 0.75 -2.10 0.00 0.41 -0.54 0.00 0.00 175.26 173.78 1imp n GLY 59 N 5.66 0.09 0.00 -1.50 0.00 -1.26 -5.12 105.19 103.06 1imp n GLY 59 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.41 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 -4.02 1.61 -0.08 -1.16 -5.13 116.55 107.77 1imp n ASP 60 Ca 0.00 0.00 -0.14 0.00 -1.51 0.00 0.00 54.79 53.14 1imp n ASP 60 Cb 0.00 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.33 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 0.76 -0.13 1.67 1.01 -1.26 -4.95 116.67 112.77 1imp s ASP 61 Ca 0.00 -0.36 0.15 0.00 0.71 0.00 0.00 52.55 53.05 1imp s ASP 61 Cb 0.00 -0.01 0.55 0.00 1.01 0.00 0.00 42.92 44.47 1imp s ASP 61 CO 0.00 -0.09 1.47 -0.90 0.21 0.00 0.00 175.17 175.86 1imp n ASP 62 N 2.09 4.06 -4.15 0.27 5.75 -1.26 -4.81 116.55 118.50 1imp n ASP 62 Ca -0.19 -2.64 -0.35 0.00 -0.01 0.00 0.00 54.79 51.60 1imp n ASP 62 Cb 0.56 -0.49 0.08 0.00 -1.03 0.00 0.00 41.12 40.24 1imp n ASP 62 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1imp n SER 63 N 0.22 -3.62 0.03 -1.12 3.41 -1.26 -4.88 113.62 106.41 1imp n SER 63 Ca 0.21 0.11 -0.19 0.00 -0.26 0.00 0.00 58.87 58.73 1imp n SER 63 Cb 0.82 -0.84 -0.12 0.00 -0.26 0.00 0.00 64.21 63.81 1imp n SER 63 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1imp h PRO 64 N -1.35 0.51 0.00 4.33 0.13 -1.94 -3.21 132.00 130.47 1imp h PRO 64 Ca -0.45 -0.60 -0.00 0.00 -0.87 0.00 0.00 66.00 64.08 1imp h PRO 64 Cb 1.33 0.18 -0.00 0.00 0.13 0.00 0.00 31.00 32.64 1imp h PRO 64 CO 0.28 1.23 -0.02 1.03 -0.23 0.00 0.00 178.00 180.29 1imp h SER 65 N 0.06 0.00 0.98 1.44 0.87 -1.90 -0.81 113.55 114.19 1imp h SER 65 Ca -0.12 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.38 1imp h SER 65 Cb 1.55 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.50 1imp h SER 65 CO 0.17 0.02 -0.29 1.23 -0.53 0.00 0.00 176.83 177.43 1imp h GLY 66 N 0.10 0.00 1.43 5.77 0.00 -1.89 0.32 103.07 108.80 1imp h GLY 66 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.07 1imp h GLY 66 CO 0.00 0.00 -1.39 -2.22 0.00 0.00 0.00 176.54 172.93 1imp h ILE 67 N 0.00 1.24 0.00 2.60 5.03 -1.25 -2.74 117.51 122.39 1imp h ILE 67 Ca -0.00 -3.01 -0.01 0.00 -0.12 0.00 0.00 64.86 61.71 1imp h ILE 67 Cb 0.86 2.64 -0.00 0.00 -3.03 0.00 0.00 36.82 37.29 1imp h ILE 67 CO 0.04 0.74 -0.31 0.58 -0.68 0.00 0.00 178.15 178.51 1imp h VAL 68 N 0.01 0.07 0.00 1.67 2.07 -1.17 -2.92 116.25 115.98 1imp h VAL 68 Ca -0.17 -1.11 -0.20 0.00 0.82 0.00 0.00 66.70 66.04 1imp h VAL 68 Cb 1.91 1.91 -0.03 0.00 -1.52 0.00 0.00 31.29 33.56 1imp h VAL 68 CO 0.11 0.04 -0.96 -1.13 0.02 0.00 0.00 177.57 175.65 1imp h ASN 69 N 0.00 0.02 0.23 0.57 -1.24 -0.38 -1.37 115.58 113.41 1imp h ASN 69 Ca -0.00 -0.02 -0.18 0.00 0.71 0.00 0.00 56.30 56.81 1imp h ASN 69 Cb 1.04 -0.01 -0.00 0.00 0.73 0.00 0.00 38.32 40.08 1imp h ASN 69 CO 0.01 0.97 -0.72 0.74 -1.29 0.00 0.00 177.43 177.14 1imp h THR 70 N 0.00 1.37 0.01 -3.57 2.02 -1.40 -2.93 112.91 108.42 1imp h THR 70 Ca -0.01 -2.10 -0.05 0.00 0.77 0.00 0.00 66.41 65.01 1imp h THR 70 Cb 1.70 2.08 0.00 0.00 -1.74 0.00 0.00 68.15 70.19 1imp h THR 70 CO 0.13 0.64 -0.21 1.62 0.37 0.00 0.00 175.52 178.07 1imp h VAL 71 N 0.30 1.60 -1.19 3.16 3.04 -1.50 0.27 116.25 121.94 1imp h VAL 71 Ca -0.03 -2.05 0.34 0.00 -1.01 0.00 0.00 66.70 63.96 1imp h VAL 71 Cb 1.29 2.93 -0.09 0.00 -2.01 0.00 0.00 31.29 33.41 1imp h VAL 71 CO 0.12 0.55 0.79 0.07 -1.01 0.00 0.00 177.57 178.09 1imp h LYS 72 N -0.63 0.20 0.00 4.17 5.09 -1.29 0.94 116.57 125.04 1imp h LYS 72 Ca -0.03 -0.01 -0.17 0.00 0.09 0.00 0.00 60.65 60.53 1imp h LYS 72 Cb 1.02 -0.05 -0.03 0.00 0.10 0.00 0.00 32.23 33.27 1imp h LYS 72 CO 0.04 0.14 -1.50 1.04 -2.09 0.00 0.00 179.45 177.07 1imp n GLN 73 N -4.53 0.63 -0.09 0.07 6.02 -1.11 -4.20 117.38 114.17 1imp n GLN 73 Ca 0.30 0.19 -0.09 0.00 -0.01 0.00 0.00 57.00 57.38 1imp n GLN 73 Cb 1.16 -1.78 -0.02 0.00 1.02 0.00 0.00 30.24 30.62 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 0.40 0.00 1.08 7.01 0.46 -0.93 115.95 123.98 1imp h TRP 74 Ca -0.18 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.81 1imp h TRP 74 Cb 1.60 -0.13 0.00 0.00 -2.10 0.00 0.00 29.16 28.53 1imp h TRP 74 CO 0.00 0.33 0.00 0.54 -2.79 0.00 0.00 178.44 176.52 1imp n ARG 75 N -4.82 0.06 -0.03 2.65 5.12 -0.45 -0.45 116.66 118.74 1imp n ARG 75 Ca -0.02 0.28 -0.13 0.00 -1.93 0.00 0.00 57.85 56.06 1imp n ARG 75 Cb 0.08 -1.50 -0.14 0.00 -1.16 0.00 0.00 32.46 29.73 1imp n ARG 75 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1imp n ALA 76 N -1.39 1.34 -0.05 7.54 0.00 -0.40 0.76 120.51 128.32 1imp n ALA 76 Ca 0.03 -0.83 -0.13 0.00 0.00 0.00 0.00 53.44 52.51 1imp n ALA 76 Cb 0.08 -0.66 -0.12 0.00 0.00 0.00 0.00 19.45 18.76 1imp n ALA 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1imp h ALA 77 N 0.70 -0.01 0.00 0.00 0.00 -0.75 -3.05 119.26 116.15 1imp h ALA 77 Ca -0.38 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.12 1imp h ALA 77 Cb 2.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.84 1imp h ALA 77 CO 0.06 -0.08 0.00 0.09 0.00 0.00 0.00 179.25 179.32 1imp n ASN 78 N -4.69 0.00 -3.88 0.00 3.02 0.41 -4.87 115.26 105.24 1imp n ASN 78 Ca -0.09 -0.90 -0.27 0.00 -0.03 0.00 0.00 54.58 53.29 1imp n ASN 78 Cb 0.40 0.00 0.02 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 0.79 -0.38 0.00 7.41 0.00 -0.79 -4.95 105.19 107.26 1imp n GLY 79 Ca 0.21 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.39 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 -4.48 -0.31 0.02 1.61 4.01 0.23 -4.96 118.16 114.28 1imp n LYS 80 Ca -0.13 0.00 -0.01 0.00 -0.51 0.00 0.00 58.31 57.67 1imp n LYS 80 Cb 0.60 0.00 -0.00 0.00 -0.51 0.00 0.00 35.03 35.11 1imp n LYS 80 CO 0.00 0.00 0.00 0.77 -1.11 0.00 0.00 177.40 177.06 1imp h SER 81 N -0.31 -0.05 -4.37 4.39 0.02 -1.93 -3.46 113.55 107.84 1imp h SER 81 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1imp h SER 81 Cb 0.00 0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.55 1imp h SER 81 CO 0.00 0.02 0.00 0.61 -1.14 0.00 0.00 176.83 176.32 1imp n GLY 82 N 1.13 0.88 2.64 -3.77 0.00 -1.26 -5.05 105.19 99.76 1imp n GLY 82 Ca -0.01 -2.08 -0.20 0.00 0.00 0.00 0.00 46.02 43.73 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 0.94 -3.94 0.00 1.61 3.72 -1.26 -3.08 117.46 115.46 1imp n PHE 83 Ca 0.00 -0.79 0.00 0.00 -0.05 0.00 0.00 57.45 56.61 1imp n PHE 83 Cb 0.00 -0.73 0.00 0.00 -0.94 0.00 0.00 39.48 37.81 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 -3.10 2.70 -2.95 -1.08 4.81 -0.75 -4.69 118.16 113.10 1imp n LYS 84 Ca 0.11 0.00 -0.18 0.00 -0.87 0.00 0.00 58.31 57.37 1imp n LYS 84 Cb 0.40 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.48 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 2.61 0.00 1.64 0.74 -1.26 -4.88 119.66 118.50 1imp s GLN 85 Ca 0.00 -1.28 0.29 0.00 0.05 0.00 0.00 55.36 54.41 1imp s GLN 85 Cb 0.00 -2.68 1.19 0.00 1.10 0.00 0.00 33.01 32.62 1imp s GLN 85 CO 0.00 -0.53 1.82 0.41 -0.55 0.00 0.00 175.29 176.44