#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vln h ILE 7 N 0.00 0.83 0.00 -1.33 2.10 -1.91 -0.86 117.51 116.34 2vln h ILE 7 Ca 0.00 -0.33 0.00 0.00 1.08 0.00 0.00 64.86 65.61 2vln h ILE 7 Cb 0.00 1.19 0.00 0.00 -1.09 0.00 0.00 36.82 36.92 2vln h ILE 7 CO 0.00 0.09 0.00 -1.54 -1.08 0.00 0.00 178.15 175.62 2vln n SER 8 N -4.09 0.00 0.00 2.19 3.41 -1.25 -1.21 113.62 112.67 2vln n SER 8 Ca -0.03 -0.18 0.14 0.00 -0.26 0.00 0.00 58.87 58.54 2vln n SER 8 Cb 0.17 -0.26 0.61 0.00 -0.26 0.00 0.00 64.21 64.48 2vln n SER 8 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2vln n ASP 9 N -1.26 0.00 -4.81 4.04 10.43 -0.33 -3.22 116.55 121.41 2vln n ASP 9 Ca 0.14 0.45 -0.36 0.00 2.57 0.00 0.00 54.79 57.59 2vln n ASP 9 Cb 0.21 -0.48 -0.07 0.00 1.84 0.00 0.00 41.12 42.61 2vln n ASP 9 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 2vln s TYR 10 N -2.97 3.43 0.79 1.24 1.51 -0.35 -4.88 117.35 116.12 2vln s TYR 10 Ca 0.15 0.40 -0.11 0.00 -1.01 0.00 0.00 57.07 56.49 2vln s TYR 10 Cb 0.18 -1.88 0.06 0.00 -0.11 0.00 0.00 41.96 40.22 2vln s TYR 10 CO 0.51 0.64 1.09 0.95 -1.11 0.00 0.00 175.55 177.62 2vln s THR 11 N -0.98 3.24 0.21 -0.71 -4.23 -1.26 -0.64 115.64 111.27 2vln s THR 11 Ca 0.15 0.40 -0.10 0.00 -1.18 0.00 0.00 61.69 60.96 2vln s THR 11 Cb -0.12 -3.11 0.16 0.00 1.34 0.00 0.00 72.50 70.77 2vln s THR 11 CO 0.04 -0.53 1.87 -0.08 -0.54 0.00 0.00 174.62 175.38 2vln h GLU 12 N -1.06 0.94 -0.25 3.99 4.81 -1.92 -0.07 114.58 121.01 2vln h GLU 12 Ca -0.46 -0.06 0.06 0.00 -0.13 0.00 0.00 59.36 58.77 2vln h GLU 12 Cb 1.26 -0.21 -0.06 0.00 0.63 0.00 0.00 28.75 30.37 2vln h GLU 12 CO 0.58 0.62 -0.12 0.00 -0.73 0.00 0.00 179.01 179.36 2vln h ALA 13 N 1.30 0.09 -0.89 2.92 0.00 -1.94 0.15 119.26 120.88 2vln h ALA 13 Ca 0.29 0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.32 2vln h ALA 13 Cb -0.05 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 2vln h ALA 13 CO -0.08 -0.53 0.58 0.93 0.00 0.00 0.00 179.25 180.15 2vln h GLU 14 N -0.09 1.12 -0.55 0.00 5.08 -1.78 -0.94 114.58 117.42 2vln h GLU 14 Ca 0.13 -0.07 -0.11 0.00 -1.00 0.00 0.00 59.36 58.32 2vln h GLU 14 Cb 0.29 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 2vln h GLU 14 CO -0.31 0.74 -0.07 0.35 -1.00 0.00 0.00 179.01 178.73 2vln h PHE 15 N 1.16 1.13 -0.99 4.33 3.57 -0.47 -1.55 116.94 124.11 2vln h PHE 15 Ca 0.34 -0.22 0.02 0.00 3.53 0.00 0.00 57.97 61.64 2vln h PHE 15 Cb -0.05 -0.28 -0.05 0.00 2.79 0.00 0.00 35.95 38.35 2vln h PHE 15 CO -0.01 1.03 0.65 1.25 -2.23 0.00 0.00 178.31 179.00 2vln h LEU 16 N 0.90 1.12 -0.64 0.59 5.85 -0.46 -0.31 115.31 122.37 2vln h LEU 16 Ca 0.15 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 2vln h LEU 16 Cb 0.63 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 2vln h LEU 16 CO 0.04 0.80 0.39 1.56 -0.34 0.00 0.00 178.44 180.90 2vln h GLN 17 N 1.32 0.86 -0.25 1.25 1.08 -0.81 -0.76 115.11 117.81 2vln h GLN 17 Ca 0.37 -0.07 -0.01 0.00 -1.45 0.00 0.00 58.65 57.49 2vln h GLN 17 Cb -0.12 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.12 2vln h GLN 17 CO -0.09 0.61 0.12 1.25 -0.95 0.00 0.00 178.83 179.77 2vln h LEU 18 N 0.87 0.32 -0.95 1.46 5.85 -0.74 0.19 115.31 122.31 2vln h LEU 18 Ca 0.23 -0.12 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 2vln h LEU 18 Cb -0.04 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 2vln h LEU 18 CO -0.04 0.35 0.06 0.58 -0.34 0.00 0.00 178.44 179.04 2vln h VAL 19 N 0.27 1.24 -0.56 1.05 2.07 -0.86 -1.81 116.25 117.65 2vln h VAL 19 Ca 0.09 -0.93 -0.10 0.00 0.82 0.00 0.00 66.70 66.57 2vln h VAL 19 Cb 0.11 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 2vln h VAL 19 CO -0.01 0.34 -0.06 0.74 0.02 0.00 0.00 177.57 178.60 2vln h THR 20 N 0.79 1.27 -0.59 2.57 2.02 -0.75 0.28 112.91 118.49 2vln h THR 20 Ca 0.16 -1.21 0.09 0.00 0.77 0.00 0.00 66.41 66.22 2vln h THR 20 Cb 0.39 0.92 -0.07 0.00 -1.74 0.00 0.00 68.15 67.65 2vln h THR 20 CO 0.01 0.43 0.23 0.74 0.37 0.00 0.00 175.52 177.30 2vln h THR 21 N 0.91 0.79 -0.12 3.16 2.02 -0.41 -0.44 112.91 118.82 2vln h THR 21 Ca 0.15 -0.14 -0.05 0.00 0.77 0.00 0.00 66.41 67.14 2vln h THR 21 Cb 0.62 0.34 -0.00 0.00 -1.74 0.00 0.00 68.15 67.37 2vln h THR 21 CO 0.04 0.08 -0.11 0.40 0.37 0.00 0.00 175.52 176.30 2vln h ILE 22 N 0.41 1.35 -0.51 3.11 2.04 -0.68 -0.53 117.51 122.70 2vln h ILE 22 Ca 0.29 -1.25 -0.05 0.00 1.00 0.00 0.00 64.86 64.85 2vln h ILE 22 Cb 0.34 1.90 -0.02 0.00 -0.74 0.00 0.00 36.82 38.30 2vln h ILE 22 CO -0.29 0.36 0.10 0.00 0.00 0.00 0.00 178.15 178.32 2vln n ASN 24 N -4.27 0.09 -3.83 0.00 3.02 -0.20 -4.93 115.26 105.15 2vln n ASN 24 Ca 0.03 0.13 -0.27 0.00 -0.03 0.00 0.00 54.58 54.45 2vln n ASN 24 Cb 0.24 -0.33 0.03 0.00 -0.61 0.00 0.00 39.78 39.11 2vln n ASN 24 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vln n ALA 25 N -1.38 -1.54 -1.59 5.41 0.00 -0.22 -4.86 120.51 116.33 2vln n ALA 25 Ca 0.10 0.08 -0.40 0.00 0.00 0.00 0.00 53.44 53.22 2vln n ALA 25 Cb 0.30 -3.67 -0.02 0.00 0.00 0.00 0.00 19.45 16.06 2vln n ALA 25 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2vln n ASP 26 N -2.92 8.31 -4.44 0.00 10.43 -0.32 -4.88 116.55 122.74 2vln n ASP 26 Ca -0.08 -2.80 -0.21 0.00 2.57 0.00 0.00 54.79 54.27 2vln n ASP 26 Cb 0.58 -1.49 -0.10 0.00 1.84 0.00 0.00 41.12 41.95 2vln n ASP 26 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 2vln s THR 27 N 0.95 1.58 -0.36 -3.53 -4.23 -1.26 -4.97 115.64 103.82 2vln s THR 27 Ca 0.63 -2.10 0.25 0.00 -1.18 0.00 0.00 61.69 59.29 2vln s THR 27 Cb 0.18 -2.52 0.34 0.00 1.34 0.00 0.00 72.50 71.84 2vln s THR 27 CO -0.07 -0.24 1.70 0.77 -0.54 0.00 0.00 174.62 176.23 2vln h SER 28 N 2.24 0.00 -4.97 3.99 4.64 -1.96 -3.47 113.55 114.01 2vln h SER 28 Ca -0.40 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.93 2vln h SER 28 Cb 1.24 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.21 2vln h SER 28 CO 0.68 0.00 0.25 -0.94 -0.87 0.00 0.00 176.83 175.95 2vln s SER 29 N -5.91 -0.50 0.25 4.97 1.04 -1.26 -5.02 113.70 107.27 2vln s SER 29 Ca 0.06 -0.10 -0.05 0.00 0.48 0.00 0.00 55.95 56.34 2vln s SER 29 Cb 0.07 0.60 0.30 0.00 0.10 0.00 0.00 66.02 67.08 2vln s SER 29 CO 0.63 -0.99 1.89 -0.08 0.98 0.00 0.00 173.24 175.68 2vln h GLU 30 N 2.00 1.15 -0.87 4.02 4.81 -1.99 -2.32 114.58 121.39 2vln h GLU 30 Ca -0.30 -0.07 0.07 0.00 -0.13 0.00 0.00 59.36 58.93 2vln h GLU 30 Cb 1.29 -0.26 -0.06 0.00 0.63 0.00 0.00 28.75 30.35 2vln h GLU 30 CO 0.35 0.76 0.53 1.49 -0.73 0.00 0.00 179.01 181.41 2vln h GLU 31 N 1.19 0.93 -0.46 1.92 4.81 -1.99 0.92 114.58 121.89 2vln h GLU 31 Ca 0.38 -0.06 -0.12 0.00 -0.13 0.00 0.00 59.36 59.43 2vln h GLU 31 Cb 0.01 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.16 2vln h GLU 31 CO -0.12 0.61 -0.19 1.49 -0.73 0.00 0.00 179.01 180.07 2vln h GLU 32 N 0.95 0.94 -0.52 1.92 4.81 -1.87 -1.25 114.58 119.57 2vln h GLU 32 Ca 0.39 -0.40 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 2vln h GLU 32 Cb 0.21 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 2vln h GLU 32 CO -0.19 1.06 0.19 1.25 -0.73 0.00 0.00 179.01 180.59 2vln h LEU 33 N 0.78 0.74 -0.69 1.64 5.85 -0.80 -0.86 115.31 121.97 2vln h LEU 33 Ca 0.11 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 2vln h LEU 33 Cb 0.76 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 2vln h LEU 33 CO 0.06 0.73 0.40 0.58 -0.34 0.00 0.00 178.44 179.87 2vln h VAL 34 N 0.71 1.21 -0.79 1.05 2.07 -0.64 -0.47 116.25 119.38 2vln h VAL 34 Ca 0.17 -0.48 0.02 0.00 0.82 0.00 0.00 66.70 67.23 2vln h VAL 34 Cb 0.24 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 2vln h VAL 34 CO -0.01 0.22 0.51 0.50 0.02 0.00 0.00 177.57 178.81 2vln h LYS 35 N 0.95 0.99 -0.30 1.57 3.64 -0.88 0.26 116.57 122.81 2vln h LYS 35 Ca 0.25 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.51 2vln h LYS 35 Cb -0.00 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.58 2vln h LYS 35 CO -0.04 0.66 -0.05 -0.07 -2.27 0.00 0.00 179.45 177.67 2vln h LEU 36 N 1.02 0.56 -0.47 5.20 3.38 -0.81 0.36 115.31 124.57 2vln h LEU 36 Ca 0.30 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2vln h LEU 36 Cb -0.05 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 2vln h LEU 36 CO -0.09 0.78 0.26 0.58 0.09 0.00 0.00 178.44 180.06 2vln h VAL 37 N 0.33 1.16 -0.47 1.22 2.07 -0.80 0.14 116.25 119.90 2vln h VAL 37 Ca 0.08 -0.41 0.07 0.00 0.82 0.00 0.00 66.70 67.26 2vln h VAL 37 Cb 0.53 0.58 -0.06 0.00 -1.52 0.00 0.00 31.29 30.82 2vln h VAL 37 CO 0.03 0.17 0.14 0.74 0.02 0.00 0.00 177.57 178.67 2vln h THR 38 N 0.61 0.81 -0.71 2.57 2.02 -0.72 0.12 112.91 117.62 2vln h THR 38 Ca 0.16 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 67.23 2vln h THR 38 Cb 0.04 0.48 -0.03 0.00 -1.74 0.00 0.00 68.15 66.90 2vln h THR 38 CO -0.03 0.05 0.39 -0.74 0.37 0.00 0.00 175.52 175.56 2vln h HIS 39 N 0.30 0.98 -0.56 3.16 6.17 -0.41 -1.76 115.15 123.03 2vln h HIS 39 Ca 0.23 -0.03 0.06 0.00 0.71 0.00 0.00 60.37 61.35 2vln h HIS 39 Cb 0.26 -0.31 -0.06 0.00 2.52 0.00 0.00 27.41 29.82 2vln h HIS 39 CO -0.18 0.70 0.25 0.35 0.71 0.00 0.00 177.93 179.76 2vln h PHE 40 N 0.98 0.46 -0.82 5.26 3.04 -0.05 -0.56 116.94 125.25 2vln h PHE 40 Ca 0.25 0.02 0.01 0.00 3.98 0.00 0.00 57.97 62.23 2vln h PHE 40 Cb 0.04 -0.12 -0.04 0.00 2.56 0.00 0.00 35.95 38.39 2vln h PHE 40 CO -0.00 0.19 0.54 0.93 -2.02 0.00 0.00 178.31 177.95 2vln h GLU 41 N 0.48 1.07 -0.55 1.11 5.08 -0.54 -0.27 114.58 120.96 2vln h GLU 41 Ca 0.26 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.46 2vln h GLU 41 Cb 0.23 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 2vln h GLU 41 CO -0.22 0.71 -0.03 0.93 -1.00 0.00 0.00 179.01 179.41 2vln h GLU 42 N 1.10 0.96 -0.11 2.33 5.08 -0.70 -1.85 114.58 121.39 2vln h GLU 42 Ca 0.30 -0.30 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2vln h GLU 42 Cb -0.12 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.04 2vln h GLU 42 CO -0.07 0.96 -0.08 0.52 -1.00 0.00 0.00 179.01 179.35 2vln h MET 43 N 0.88 0.24 -0.13 2.33 2.86 -0.67 -3.27 114.93 117.16 2vln h MET 43 Ca 0.16 -0.12 -0.10 0.00 -2.06 0.00 0.00 59.70 57.58 2vln h MET 43 Cb 0.55 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 2vln h MET 43 CO 0.03 0.62 -0.35 1.79 1.06 0.00 0.00 176.91 180.06 2vln h THR 44 N -0.14 1.29 -0.37 2.22 1.35 -1.02 -3.38 112.91 112.85 2vln h THR 44 Ca 0.02 -1.39 -0.16 0.00 -0.55 0.00 0.00 66.41 64.33 2vln h THR 44 Cb 0.56 1.58 -0.06 0.00 -1.73 0.00 0.00 68.15 68.49 2vln h THR 44 CO 0.02 0.42 -0.15 -0.62 -0.25 0.00 0.00 175.52 174.94 2vln n GLU 45 N -4.07 -1.77 -2.58 4.72 1.02 -0.70 -4.92 120.64 112.33 2vln n GLU 45 Ca -0.01 0.77 -0.41 0.00 -0.02 0.00 0.00 57.16 57.49 2vln n GLU 45 Cb 0.44 -5.22 -0.04 0.00 -0.02 0.00 0.00 31.44 26.61 2vln n GLU 45 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2vln s HIS 46 N -1.68 3.63 0.61 -0.32 2.46 -1.26 -4.92 115.29 113.82 2vln s HIS 46 Ca 0.00 1.61 0.32 0.00 0.47 0.00 0.00 55.06 57.46 2vln s HIS 46 Cb 0.00 -3.22 1.84 0.00 -0.13 0.00 0.00 32.58 31.07 2vln s HIS 46 CO 0.00 -0.43 2.17 -1.00 -2.47 0.00 0.00 174.74 173.00 2vln h PRO 47 N 5.77 0.00 0.00 2.88 0.13 -1.96 -1.54 132.00 137.28 2vln h PRO 47 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2vln h PRO 47 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2vln h PRO 47 CO 0.74 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.94 2vln n SER 48 N -3.56 0.04 0.00 1.44 7.64 -1.26 -4.98 113.62 112.94 2vln n SER 48 Ca -0.01 0.50 0.00 0.00 1.01 0.00 0.00 58.87 60.38 2vln n SER 48 Cb 0.23 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 62.92 2vln n SER 48 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vln n GLY 49 N 1.40 2.37 0.06 0.23 0.00 -0.58 -1.23 105.19 107.44 2vln n GLY 49 Ca 0.07 -0.24 0.07 0.00 0.00 0.00 0.00 46.02 45.92 2vln n GLY 49 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2vln n SER 50 N 0.48 0.26 0.26 1.61 3.41 -1.26 -2.21 113.62 116.16 2vln n SER 50 Ca 0.00 0.59 0.11 0.00 -0.26 0.00 0.00 58.87 59.31 2vln n SER 50 Cb 0.00 -0.64 0.69 0.00 -0.26 0.00 0.00 64.21 64.00 2vln n SER 50 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2vln h ASP 51 N 0.00 0.00 -0.93 4.04 3.45 -1.50 -0.42 116.42 121.06 2vln h ASP 51 Ca 0.00 0.00 0.23 0.00 0.43 0.00 0.00 57.03 57.69 2vln h ASP 51 Cb 0.15 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 38.86 2vln h ASP 51 CO 0.00 0.11 0.63 -0.07 -1.57 0.00 0.00 179.24 178.33 2vln h LEU 52 N 0.00 0.31 0.01 1.55 3.38 -1.59 0.85 115.31 119.83 2vln h LEU 52 Ca -0.00 0.04 -0.32 0.00 0.09 0.00 0.00 57.88 57.69 2vln h LEU 52 Cb 0.23 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 2vln h LEU 52 CO 0.01 0.11 -1.74 -0.38 0.09 0.00 0.00 178.44 176.53 2vln n ILE 53 N -4.47 1.56 0.17 1.22 5.41 -0.25 -4.53 119.36 118.48 2vln n ILE 53 Ca 0.20 -0.21 0.10 0.00 1.00 0.00 0.00 62.75 63.84 2vln n ILE 53 Cb 0.80 -1.94 -0.15 0.00 -0.71 0.00 0.00 39.64 37.64 2vln n ILE 53 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 2vln n TYR 54 N -4.24 0.00 -3.19 1.39 4.02 -0.69 -4.63 117.16 109.82 2vln n TYR 54 Ca -0.39 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.32 2vln n TYR 54 Cb 0.79 -0.37 -0.03 0.00 -0.02 0.00 0.00 39.34 39.70 2vln n TYR 54 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 2vln n TYR 55 N -2.06 0.14 -2.24 -0.72 4.02 0.26 -5.02 117.16 111.55 2vln n TYR 55 Ca -0.02 -3.80 -0.36 0.00 -0.01 0.00 0.00 57.90 53.71 2vln n TYR 55 Cb 0.49 -0.41 0.00 0.00 -0.02 0.00 0.00 39.34 39.40 2vln n TYR 55 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 2vln s PRO 56 N -2.33 3.40 0.46 -0.72 0.04 -1.03 -4.63 135.00 130.20 2vln s PRO 56 Ca 0.40 1.67 -0.24 0.00 0.04 0.00 0.00 61.00 62.86 2vln s PRO 56 Cb 0.34 -2.08 -0.07 0.00 0.04 0.00 0.00 34.50 32.72 2vln s PRO 56 CO -0.08 -0.82 1.35 -1.59 0.04 0.00 0.00 177.00 175.90 2vln s LYS 57 N -3.17 3.62 0.21 4.56 0.00 -1.26 -4.92 119.74 118.78 2vln s LYS 57 Ca 0.71 2.25 -0.32 0.00 0.00 0.00 0.00 55.97 58.61 2vln s LYS 57 Cb -0.26 -2.56 -0.14 0.00 0.00 0.00 0.00 37.83 34.88 2vln s LYS 57 CO 0.29 -0.81 1.32 -1.91 0.00 0.00 0.00 175.35 174.25 2vln n GLU 58 N -0.36 1.70 0.00 1.78 2.13 -1.26 -1.31 120.64 123.32 2vln n GLU 58 Ca 0.06 0.60 0.00 0.00 0.66 0.00 0.00 57.16 58.49 2vln n GLU 58 Cb 0.44 -2.21 0.00 0.00 0.27 0.00 0.00 31.44 29.94 2vln n GLU 58 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2vln n GLY 59 N 2.18 2.03 3.79 8.31 0.00 -1.26 -5.04 105.19 115.20 2vln n GLY 59 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 2vln n GLY 59 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2vln s ASP 60 N -2.79 7.28 -0.41 1.61 -0.00 -0.43 -5.01 116.67 116.91 2vln s ASP 60 Ca 0.00 1.64 -0.27 0.00 -0.00 0.00 0.00 52.55 53.92 2vln s ASP 60 Cb 0.00 -2.50 0.02 0.00 -0.00 0.00 0.00 42.92 40.44 2vln s ASP 60 CO 0.00 0.07 1.01 -0.62 -0.00 0.00 0.00 175.17 175.63 2vln s ASP 61 N -1.45 6.66 -0.13 0.27 -1.08 -1.26 -4.89 116.67 114.79 2vln s ASP 61 Ca 0.43 0.51 0.16 0.00 -0.52 0.00 0.00 52.55 53.12 2vln s ASP 61 Cb -0.20 -2.50 0.68 0.00 -1.46 0.00 0.00 42.92 39.44 2vln s ASP 61 CO 0.24 -1.02 1.57 -0.90 0.52 0.00 0.00 175.17 175.58 2vln n ASP 62 N 7.18 4.59 -4.76 -0.34 3.85 -1.26 -3.06 116.55 122.75 2vln n ASP 62 Ca 0.09 -2.51 -0.30 0.00 -0.71 0.00 0.00 54.79 51.36 2vln n ASP 62 Cb 0.48 -0.58 0.11 0.00 -1.35 0.00 0.00 41.12 39.78 2vln n ASP 62 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 2vln s SER 63 N -0.81 4.00 0.23 -1.12 1.04 -1.26 -4.77 113.70 111.02 2vln s SER 63 Ca 0.47 1.48 -0.06 0.00 0.48 0.00 0.00 55.95 58.32 2vln s SER 63 Cb 0.32 -2.18 0.38 0.00 0.10 0.00 0.00 66.02 64.63 2vln s SER 63 CO 0.20 -2.30 1.76 -0.65 0.98 0.00 0.00 173.24 173.23 2vln h PRO 64 N -1.32 0.53 -0.01 4.02 0.11 -1.91 0.14 132.00 133.57 2vln h PRO 64 Ca -0.48 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.47 2vln h PRO 64 Cb 1.27 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2vln h PRO 64 CO 0.56 0.35 -0.60 0.66 -0.21 0.00 0.00 178.00 178.76 2vln h SER 65 N 0.55 0.02 -0.38 -2.05 4.64 -1.93 -1.34 113.55 113.06 2vln h SER 65 Ca 0.37 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.68 2vln h SER 65 Cb 0.46 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.52 2vln h SER 65 CO -0.31 0.61 0.22 1.23 -0.87 0.00 0.00 176.83 177.71 2vln h GLY 66 N 1.77 0.56 1.06 -0.77 0.00 -1.41 -0.98 103.07 103.30 2vln h GLY 66 Ca -0.01 -0.24 -0.12 0.00 0.00 0.00 0.00 47.33 46.97 2vln h GLY 66 CO 0.08 0.23 -0.17 -2.22 0.00 0.00 0.00 176.54 174.47 2vln h ILE 67 N 0.50 1.27 -0.59 2.60 2.04 -0.32 -0.59 117.51 122.42 2vln h ILE 67 Ca 0.14 -1.31 0.05 0.00 1.00 0.00 0.00 64.86 64.74 2vln h ILE 67 Cb 0.02 1.16 -0.05 0.00 -0.74 0.00 0.00 36.82 37.21 2vln h ILE 67 CO -0.02 0.45 0.31 0.58 0.00 0.00 0.00 178.15 179.46 2vln h VAL 68 N 0.76 0.95 -0.45 1.67 2.07 -1.11 -0.86 116.25 119.27 2vln h VAL 68 Ca 0.11 -0.20 -0.10 0.00 0.82 0.00 0.00 66.70 67.33 2vln h VAL 68 Cb 0.73 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 2vln h VAL 68 CO 0.06 0.11 -0.11 -1.13 0.02 0.00 0.00 177.57 176.51 2vln h ASN 69 N 0.58 0.88 -0.66 0.57 -0.73 -0.90 -0.13 115.58 115.19 2vln h ASN 69 Ca 0.26 -0.36 0.04 0.00 1.87 0.00 0.00 56.30 58.11 2vln h ASN 69 Cb 0.17 -0.24 -0.04 0.00 0.27 0.00 0.00 38.32 38.47 2vln h ASN 69 CO -0.18 1.04 0.40 0.74 -0.37 0.00 0.00 177.43 179.07 2vln h THR 70 N 0.71 1.06 -0.38 -3.57 2.02 -0.76 0.51 112.91 112.50 2vln h THR 70 Ca 0.12 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 67.01 2vln h THR 70 Cb 0.65 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 2vln h THR 70 CO 0.04 0.14 0.16 0.58 0.37 0.00 0.00 175.52 176.82 2vln h VAL 71 N 0.78 1.18 -0.40 3.16 2.07 -0.88 -0.50 116.25 121.66 2vln h VAL 71 Ca 0.27 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 2vln h VAL 71 Cb 0.06 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 2vln h VAL 71 CO -0.12 0.20 0.20 0.50 0.02 0.00 0.00 177.57 178.37 2vln h LYS 72 N 0.47 0.57 -0.32 1.57 3.64 -0.39 -0.13 116.57 121.98 2vln h LYS 72 Ca 0.13 -0.08 -0.14 0.00 -1.27 0.00 0.00 60.65 59.29 2vln h LYS 72 Cb 0.16 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2vln h LYS 72 CO -0.01 0.50 -0.34 1.96 -2.27 0.00 0.00 179.45 179.28 2vln h GLN 73 N 0.51 0.80 -0.17 1.90 4.20 -0.82 -1.12 115.11 120.41 2vln h GLN 73 Ca 0.14 -0.43 -0.00 0.00 0.06 0.00 0.00 58.65 58.42 2vln h GLN 73 Cb 0.11 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 2vln h GLN 73 CO -0.02 1.06 0.09 2.35 -0.67 0.00 0.00 178.83 181.64 2vln h TRP 74 N 0.57 0.23 -0.88 2.96 7.01 -0.92 0.87 115.95 125.79 2vln h TRP 74 Ca 0.05 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.04 2vln h TRP 74 Cb 0.92 -0.07 -0.04 0.00 -2.10 0.00 0.00 29.16 27.87 2vln h TRP 74 CO 0.07 0.23 0.53 0.00 -2.79 0.00 0.00 178.44 176.47 2vln h ARG 75 N 0.17 1.20 -0.04 2.65 3.08 -0.93 -1.82 114.38 118.68 2vln h ARG 75 Ca 0.06 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.00 2vln h ARG 75 Cb 0.07 -0.25 -0.00 0.00 0.08 0.00 0.00 29.97 29.87 2vln h ARG 75 CO -0.01 0.84 0.03 0.00 -1.07 0.00 0.00 179.97 179.76 2vln h ALA 76 N 1.29 0.06 -0.13 0.04 0.00 -0.90 -1.06 119.26 118.54 2vln h ALA 76 Ca 0.32 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.26 2vln h ALA 76 Cb -0.05 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2vln h ALA 76 CO -0.06 -0.44 0.14 0.00 0.00 0.00 0.00 179.25 178.89 2vln h ALA 77 N 1.01 1.77 -0.37 0.00 0.00 -0.60 -2.84 119.26 118.22 2vln h ALA 77 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2vln h ALA 77 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2vln h ALA 77 CO -0.00 -0.21 0.00 0.09 0.00 0.00 0.00 179.25 179.12 2vln n ASN 78 N -3.88 4.10 -1.67 0.00 3.02 -0.70 -4.96 115.26 111.17 2vln n ASN 78 Ca 0.00 -2.76 -0.17 0.00 -0.03 0.00 0.00 54.58 51.62 2vln n ASN 78 Cb 0.26 -0.52 -0.03 0.00 -0.61 0.00 0.00 39.78 38.88 2vln n ASN 78 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vln n GLY 79 N 0.02 0.40 3.96 7.41 0.00 -1.01 -5.00 105.19 110.97 2vln n GLY 79 Ca 0.21 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2vln n GLY 79 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vln s LYS 80 N -4.31 3.35 0.70 1.61 1.02 -0.45 -5.05 119.74 116.61 2vln s LYS 80 Ca 0.00 -0.55 -0.15 0.00 0.02 0.00 0.00 55.97 55.29 2vln s LYS 80 Cb 0.00 -2.72 0.02 0.00 -0.52 0.00 0.00 37.83 34.62 2vln s LYS 80 CO 0.00 0.13 1.17 -1.54 -0.92 0.00 0.00 175.35 174.19 2vln s SER 81 N -4.07 4.52 0.00 2.83 1.04 -1.26 -4.51 113.70 112.25 2vln s SER 81 Ca 0.41 2.24 0.00 0.00 0.48 0.00 0.00 55.95 59.08 2vln s SER 81 Cb -0.09 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.45 2vln s SER 81 CO 0.34 -2.03 0.00 0.61 0.98 0.00 0.00 173.24 173.14 2vln n GLY 82 N 0.10 3.52 3.78 7.32 0.00 -1.26 -4.88 105.19 113.78 2vln n GLY 82 Ca 0.12 -2.07 -0.33 0.00 0.00 0.00 0.00 46.02 43.74 2vln n GLY 82 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vln s PHE 83 N 1.32 2.77 0.23 1.61 0.40 -1.26 -3.96 117.98 119.09 2vln s PHE 83 Ca 0.00 1.54 -0.31 0.00 -0.60 0.00 0.00 56.93 57.55 2vln s PHE 83 Cb 0.00 -3.14 -0.13 0.00 0.51 0.00 0.00 43.02 40.26 2vln s PHE 83 CO 0.00 -1.43 1.50 1.17 0.70 0.00 0.00 175.22 177.15 2vln n LYS 84 N -1.97 2.24 -0.68 0.44 4.81 0.19 -4.93 118.16 118.26 2vln n LYS 84 Ca 0.10 0.80 0.00 0.00 -0.87 0.00 0.00 58.31 58.34 2vln n LYS 84 Cb 0.52 -2.51 0.00 0.00 0.02 0.00 0.00 35.03 33.06 2vln n LYS 84 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61