#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wse n SER 5 N 0.00 3.58 -4.56 2.55 7.64 -1.26 -4.94 113.62 116.63 2wse n SER 5 Ca 0.00 0.80 -0.25 0.00 1.01 0.00 0.00 58.87 60.42 2wse n SER 5 Cb 0.00 -1.44 -0.05 0.00 -1.01 0.00 0.00 64.21 61.71 2wse n SER 5 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2wse s LEU 6 N 5.07 3.12 -0.08 -3.43 1.02 -1.26 -4.74 118.68 118.38 2wse s LEU 6 Ca 0.94 -0.09 -0.01 0.00 0.02 0.00 0.00 54.13 54.99 2wse s LEU 6 Cb -0.57 -2.55 -0.00 0.00 0.02 0.00 0.00 46.19 43.09 2wse s LEU 6 CO 0.46 -3.07 -0.03 -0.37 0.02 0.00 0.00 176.35 173.36 2wse h VAL 7 N 7.39 0.00 0.00 -1.59 -1.51 -2.01 -2.83 116.25 115.69 2wse h VAL 7 Ca -0.03 -0.72 0.00 0.00 -1.23 0.00 0.00 66.70 64.72 2wse h VAL 7 Cb 1.06 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 30.22 2wse h VAL 7 CO 1.14 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 177.48 2wse n ILE 8 N -3.99 0.03 0.12 7.19 0.13 -1.26 -1.81 119.36 119.77 2wse n ILE 8 Ca -0.01 0.01 -0.13 0.00 -1.10 0.00 0.00 62.75 61.52 2wse n ILE 8 Cb 0.04 -1.01 -0.06 0.00 -0.84 0.00 0.00 39.64 37.77 2wse n ILE 8 CO 0.00 0.00 0.00 0.77 2.80 0.00 0.00 176.55 180.12 2wse h SER 9 N 0.00 -0.88 0.48 9.51 4.64 -1.83 -3.25 113.55 122.22 2wse h SER 9 Ca 0.00 0.10 -0.04 0.00 -0.47 0.00 0.00 61.79 61.38 2wse h SER 9 Cb 0.00 0.33 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 2wse h SER 9 CO 0.00 -0.40 -1.55 0.18 -0.87 0.00 0.00 176.83 174.19 2wse n LEU 10 N -5.41 0.44 0.22 5.97 4.77 -0.75 -2.69 117.00 119.55 2wse n LEU 10 Ca -0.07 0.18 0.11 0.00 -0.03 0.00 0.00 56.01 56.19 2wse n LEU 10 Cb 0.32 0.01 0.42 0.00 -2.33 0.00 0.00 43.42 41.85 2wse n LEU 10 CO 0.24 -0.03 0.80 -1.28 -1.33 0.00 0.00 177.39 175.79 2wse h SER 11 N 0.00 0.00 0.03 -1.43 0.87 -1.72 1.24 113.55 112.54 2wse h SER 11 Ca -0.05 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.52 2wse h SER 11 Cb 1.14 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.06 2wse h SER 11 CO 0.01 0.19 -0.48 0.74 -0.53 0.00 0.00 176.83 176.76 2wse h THR 12 N 0.00 0.00 -0.00 2.23 2.02 -1.64 -3.14 112.91 112.37 2wse h THR 12 Ca -0.00 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.21 2wse h THR 12 Cb 0.80 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.17 2wse h THR 12 CO 0.03 0.00 -0.27 1.23 0.37 0.00 0.00 175.52 176.87 2wse h GLY 13 N -0.62 -0.42 0.99 2.16 0.00 -0.57 -0.74 103.07 103.87 2wse h GLY 13 Ca 0.01 0.33 -0.06 0.00 0.00 0.00 0.00 47.33 47.60 2wse h GLY 13 CO -0.30 -0.22 0.07 -2.00 0.00 0.00 0.00 176.54 174.09 2wse h LEU 14 N -0.41 0.81 -2.60 3.11 5.85 0.13 0.44 115.31 122.63 2wse h LEU 14 Ca 0.06 -0.27 -0.16 0.00 0.84 0.00 0.00 57.88 58.35 2wse h LEU 14 Cb 0.50 -0.22 -0.10 0.00 0.37 0.00 0.00 40.66 41.22 2wse h LEU 14 CO -0.24 0.88 0.20 -0.24 -0.34 0.00 0.00 178.44 178.70 2wse n SER 15 N -4.39 3.19 0.00 1.25 2.88 -1.19 0.08 113.62 115.45 2wse n SER 15 Ca 0.01 -2.53 0.00 0.00 -1.33 0.00 0.00 58.87 55.03 2wse n SER 15 Cb 0.27 -0.61 0.00 0.00 -0.75 0.00 0.00 64.21 63.12 2wse n SER 15 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2wse n LEU 16 N -0.03 0.00 0.10 2.46 4.77 0.15 -4.51 117.00 119.93 2wse n LEU 16 Ca 0.19 0.88 -0.15 0.00 -0.03 0.00 0.00 56.01 56.90 2wse n LEU 16 Cb 0.87 -0.38 -0.12 0.00 -2.33 0.00 0.00 43.42 41.47 2wse n LEU 16 CO 0.20 -0.38 0.01 -0.26 -1.33 0.00 0.00 177.39 175.63 2wse h PHE 17 N 0.00 0.48 -0.03 -1.77 0.04 -0.40 -3.24 116.94 112.03 2wse h PHE 17 Ca 0.00 -0.33 0.00 0.00 2.80 0.00 0.00 57.97 60.44 2wse h PHE 17 Cb 0.00 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.12 2wse h PHE 17 CO -0.09 1.23 0.00 1.47 -0.60 0.00 0.00 178.31 180.32 2wse n LEU 18 N -3.57 0.26 -0.11 1.54 -0.00 -1.20 -2.06 117.00 111.87 2wse n LEU 18 Ca -0.08 -0.13 -0.13 0.00 -0.00 0.00 0.00 56.01 55.67 2wse n LEU 18 Cb 0.98 -0.07 -0.13 0.00 -0.00 0.00 0.00 43.42 44.20 2wse n LEU 18 CO 0.53 0.06 -1.22 0.61 -0.00 0.00 0.00 177.39 177.37 2wse n GLY 19 N 0.50 -0.62 0.46 1.47 0.00 -1.22 -1.84 105.19 103.95 2wse n GLY 19 Ca 0.01 -0.23 0.23 0.00 0.00 0.00 0.00 46.02 46.03 2wse n GLY 19 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2wse h ARG 20 N 0.00 0.00 0.73 1.61 2.47 -1.52 2.45 114.38 120.12 2wse h ARG 20 Ca -0.53 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.15 2wse h ARG 20 Cb 2.00 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 30.33 2wse h ARG 20 CO -0.03 0.00 -0.35 0.74 0.56 0.00 0.00 179.97 180.89 2wse h PHE 21 N 0.00 -0.91 0.00 3.04 -1.00 -0.77 -3.32 116.94 113.98 2wse h PHE 21 Ca 0.34 -0.02 0.00 0.00 2.81 0.00 0.00 57.97 61.10 2wse h PHE 21 Cb 2.22 0.30 0.00 0.00 3.61 0.00 0.00 35.95 42.08 2wse h PHE 21 CO 0.00 -0.55 0.62 1.55 -1.61 0.00 0.00 178.31 178.32 2wse n VAL 22 N -5.43 0.00 0.00 -0.55 3.14 0.82 -4.33 118.33 111.98 2wse n VAL 22 Ca -0.13 0.62 0.00 0.00 -2.96 0.00 0.00 64.34 61.87 2wse n VAL 22 Cb 0.39 -1.61 0.00 0.00 -1.06 0.00 0.00 33.84 31.57 2wse n VAL 22 CO 0.00 0.00 0.00 0.33 -6.46 0.00 0.00 176.83 170.70 2wse n PHE 23 N -1.37 0.00 -0.43 1.45 7.35 -1.14 -4.48 117.46 118.84 2wse n PHE 23 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2wse n PHE 23 Cb 0.62 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.45 2wse n PHE 23 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 2wse n PHE 24 N 5.91 0.00 -0.22 -5.13 3.01 -1.26 -4.58 117.46 115.19 2wse n PHE 24 Ca 0.00 -0.18 0.31 0.00 1.01 0.00 0.00 57.45 58.60 2wse n PHE 24 Cb 0.00 -0.02 0.69 0.00 -0.01 0.00 0.00 39.48 40.14 2wse n PHE 24 CO 0.00 0.00 0.00 -2.95 1.01 0.00 0.00 176.76 174.82 2wse h ASN 25 N 0.00 0.00 0.00 4.37 -1.07 -1.92 -2.92 115.58 114.04 2wse h ASN 25 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 56.30 56.36 2wse h ASN 25 Cb 0.53 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.77 2wse h ASN 25 CO 0.00 0.00 -0.30 -0.26 0.07 0.00 0.00 177.43 176.94 2wse h PHE 26 N 0.00 0.00 -3.07 4.14 0.04 -1.86 -3.44 116.94 112.74 2wse h PHE 26 Ca 0.48 0.00 -0.74 0.00 2.80 0.00 0.00 57.97 60.51 2wse h PHE 26 Cb 2.20 0.00 -0.33 0.00 2.20 0.00 0.00 35.95 40.02 2wse h PHE 26 CO 0.00 0.15 0.21 1.04 -0.60 0.00 0.00 178.31 179.11 2wse n GLN 27 N -4.68 3.37 0.00 1.51 6.02 -1.11 -4.57 117.38 117.93 2wse n GLN 27 Ca -0.06 -4.53 0.00 0.00 -0.01 0.00 0.00 57.00 52.40 2wse n GLN 27 Cb 0.18 -2.45 0.00 0.00 1.02 0.00 0.00 30.24 29.00 2wse n GLN 27 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 2wse n ARG 28 N 1.85 0.00 -0.84 -1.09 1.85 -1.26 -5.02 116.66 112.15 2wse n ARG 28 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.10 2wse n ARG 28 Cb 0.37 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.78 2wse n ARG 28 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 2wse n GLU 29 N 0.00 0.00 -0.66 2.89 -0.58 -1.26 -5.18 120.64 115.84 2wse n GLU 29 Ca 0.00 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.45 2wse n GLU 29 Cb 0.00 0.00 0.25 0.00 -0.57 0.00 0.00 31.44 31.12 2wse n GLU 29 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2wse s ASN 30 N -0.15 0.48 0.36 1.62 6.03 -1.26 -4.88 114.94 117.14 2wse s ASN 30 Ca 0.00 1.10 -0.07 0.00 -1.03 0.00 0.00 52.86 52.86 2wse s ASN 30 Cb 0.00 -1.66 -0.06 0.00 -3.03 0.00 0.00 41.25 36.50 2wse s ASN 30 CO 0.00 -4.45 -0.25 0.23 -2.03 0.00 0.00 177.10 170.60 2wse n MET 31 N -5.04 0.00 -4.18 3.55 2.81 -1.26 -4.16 117.12 108.83 2wse n MET 31 Ca 0.08 0.00 -0.35 0.00 -1.81 0.00 0.00 57.70 55.62 2wse n MET 31 Cb 0.57 -0.42 -0.02 0.00 -0.71 0.00 0.00 33.22 32.65 2wse n MET 31 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2wse n ALA 32 N -0.92 -1.32 -2.48 3.04 0.00 -1.26 0.34 120.51 117.91 2wse n ALA 32 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2wse n ALA 32 Cb 0.22 -3.44 -0.01 0.00 0.00 0.00 0.00 19.45 16.22 2wse n ALA 32 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2wse n LYS 33 N -4.42 -0.99 -1.38 0.00 4.01 -1.26 -1.90 118.16 112.22 2wse n LYS 33 Ca 0.04 0.01 0.00 0.00 -0.51 0.00 0.00 58.31 57.85 2wse n LYS 33 Cb 0.51 -0.33 0.00 0.00 -0.51 0.00 0.00 35.03 34.70 2wse n LYS 33 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2wse n GLN 34 N -1.21 0.00 -0.17 1.97 0.00 1.02 -4.28 117.38 114.71 2wse n GLN 34 Ca -0.02 0.00 -0.05 0.00 0.00 0.00 0.00 57.00 56.92 2wse n GLN 34 Cb 0.06 -0.46 -0.02 0.00 0.00 0.00 0.00 30.24 29.82 2wse n GLN 34 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 2wse n VAL 35 N 0.49 0.00 0.09 -0.39 0.31 -0.80 -4.75 118.33 113.28 2wse n VAL 35 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.29 2wse n VAL 35 Cb 0.00 -0.06 -0.02 0.00 -0.91 0.00 0.00 33.84 32.85 2wse n VAL 35 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2wse h PRO 36 N 1.34 -0.23 0.00 5.55 0.11 -1.74 -3.47 132.00 133.56 2wse h PRO 36 Ca -0.01 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.12 2wse h PRO 36 Cb 0.16 0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.32 2wse h PRO 36 CO 0.16 -0.15 -0.06 0.39 -0.21 0.00 0.00 178.00 178.12 2wse n GLU 37 N -2.98 0.17 0.00 1.05 -0.58 -1.26 -4.89 120.64 112.14 2wse n GLU 37 Ca -0.03 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.71 2wse n GLU 37 Cb 0.09 -0.53 0.00 0.00 -0.57 0.00 0.00 31.44 30.43 2wse n GLU 37 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2wse n GLN 38 N -0.92 0.00 -4.25 3.49 6.02 -1.26 -3.51 117.38 116.95 2wse n GLN 38 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.64 2wse n GLN 38 Cb 0.03 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.19 2wse n GLN 38 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2wse s ASN 39 N 0.00 5.29 0.23 1.08 0.01 -1.26 -4.16 114.94 116.12 2wse s ASN 39 Ca 0.00 0.07 0.00 0.00 -0.71 0.00 0.00 52.86 52.22 2wse s ASN 39 Cb 0.00 -1.73 0.00 0.00 0.41 0.00 0.00 41.25 39.93 2wse s ASN 39 CO 0.00 0.26 0.00 0.61 -1.51 0.00 0.00 177.10 176.46 2wse n GLY 40 N 2.92 -2.07 3.14 0.66 0.00 -1.26 -5.09 105.19 103.49 2wse n GLY 40 Ca -0.18 -1.31 0.01 0.00 0.00 0.00 0.00 46.02 44.55 2wse n GLY 40 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2wse s MET 41 N -2.31 0.70 0.00 1.61 -1.94 -1.23 -4.88 119.30 111.25 2wse s MET 41 Ca 0.00 -0.16 0.00 0.00 -1.71 0.00 0.00 55.69 53.82 2wse s MET 41 Cb 0.00 0.10 0.00 0.00 2.01 0.00 0.00 34.83 36.94 2wse s MET 41 CO 0.00 -1.03 0.00 0.45 -0.01 0.00 0.00 175.02 174.43 2wse n SER 42 N 4.42 0.00 -4.53 3.03 2.88 -1.25 -4.60 113.62 113.56 2wse n SER 42 Ca 0.10 0.37 -0.46 0.00 -1.33 0.00 0.00 58.87 57.54 2wse n SER 42 Cb 0.58 -0.60 -0.05 0.00 -0.75 0.00 0.00 64.21 63.39 2wse n SER 42 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2wse n HIS 43 N 0.15 1.80 -0.89 0.66 8.25 -1.26 -4.67 115.22 119.26 2wse n HIS 43 Ca 0.00 0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 2wse n HIS 43 Cb 0.00 -2.64 0.00 0.00 1.12 0.00 0.00 29.99 28.47 2wse n HIS 43 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2wse n PHE 44 N 11.05 0.00 0.00 4.41 -0.00 -1.26 -4.48 117.46 127.18 2wse n PHE 44 Ca 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.80 2wse n PHE 44 Cb 0.36 -1.83 0.00 0.00 -0.00 0.00 0.00 39.48 38.01 2wse n PHE 44 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.76 174.85 2wse n GLU 45 N 0.84 0.00 0.00 -4.13 2.13 -1.26 -4.95 120.64 113.27 2wse n GLU 45 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2wse n GLU 45 Cb 0.44 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.15 2wse n GLU 45 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2wse n ALA 46 N 10.25 0.00 0.11 4.31 0.00 -1.26 -4.85 120.51 129.08 2wse n ALA 46 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 2wse n ALA 46 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 2wse n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wse n GLY 47 N -1.17 0.74 0.00 0.00 0.00 -1.26 -4.97 105.19 98.54 2wse n GLY 47 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2wse n GLY 47 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2wse n ASP 48 N -1.07 1.09 -0.94 1.61 5.75 -1.26 -5.20 116.55 116.53 2wse n ASP 48 Ca 0.00 -0.76 0.00 0.00 -0.01 0.00 0.00 54.79 54.02 2wse n ASP 48 Cb 0.04 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.13 2wse n ASP 48 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 2wse n THR 49 N 0.00 0.00 0.00 2.12 5.66 -1.26 -5.19 114.28 115.61 2wse n THR 49 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2wse n THR 49 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 2wse n THR 49 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 175.07 169.91 2wse n ARG 50 N 0.00 1.17 -3.11 1.09 1.85 -1.26 -4.93 116.66 111.46 2wse n ARG 50 Ca 0.00 0.00 -0.25 0.00 -1.00 0.00 0.00 57.85 56.60 2wse n ARG 50 Cb 0.00 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.40 2wse n ARG 50 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2wse s ALA 51 N -2.04 3.62 0.10 2.89 0.00 -1.26 -5.14 121.76 119.93 2wse s ALA 51 Ca 0.00 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.19 2wse s ALA 51 Cb 0.00 -2.25 -0.04 0.00 0.00 0.00 0.00 23.12 20.83 2wse s ALA 51 CO 0.00 -0.17 -0.10 -1.59 0.00 0.00 0.00 175.76 173.90 2wse s LYS 52 N -4.47 0.85 -0.29 0.00 0.00 -1.26 -5.13 119.74 109.43 2wse s LYS 52 Ca 0.43 -1.15 0.01 0.00 0.00 0.00 0.00 55.97 55.27 2wse s LYS 52 Cb -0.10 -0.56 0.20 0.00 0.00 0.00 0.00 37.83 37.36 2wse s LYS 52 CO 0.39 0.09 0.68 -1.83 0.00 0.00 0.00 175.35 174.68 2wse s GLU 53 N -2.71 0.48 0.43 1.78 -1.05 -1.26 -4.95 118.70 111.42 2wse s GLU 53 Ca 0.05 0.55 0.29 0.00 -0.15 0.00 0.00 54.97 55.71 2wse s GLU 53 Cb -0.03 0.27 1.57 0.00 -0.44 0.00 0.00 34.13 35.49 2wse s GLU 53 CO 0.00 -0.83 1.88 -0.92 0.95 0.00 0.00 175.26 176.35 2wse h TYR 54 N 7.88 0.00 -2.62 4.83 3.20 -2.08 -3.33 116.97 124.86 2wse h TYR 54 Ca -0.06 0.00 -0.72 0.00 3.14 0.00 0.00 58.73 61.09 2wse h TYR 54 Cb 1.18 0.00 -0.34 0.00 1.54 0.00 0.00 36.73 39.11 2wse h TYR 54 CO 0.17 0.00 0.20 0.28 -1.64 0.00 0.00 178.16 177.17 2wse n VAL 55 N -2.52 4.08 -2.68 1.81 0.31 -1.26 -4.60 118.33 113.47 2wse n VAL 55 Ca -0.02 -5.64 -0.05 0.00 -0.01 0.00 0.00 64.34 58.63 2wse n VAL 55 Cb 0.06 -2.09 0.10 0.00 -0.91 0.00 0.00 33.84 31.00 2wse n VAL 55 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2wse n SER 56 N 1.13 -1.54 -1.96 4.52 2.88 -1.25 -5.03 113.62 112.37 2wse n SER 56 Ca 0.28 -2.26 -0.23 0.00 -1.33 0.00 0.00 58.87 55.33 2wse n SER 56 Cb 0.36 1.24 0.04 0.00 -0.75 0.00 0.00 64.21 65.10 2wse n SER 56 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 2wse n LEU 57 N 0.74 5.00 0.00 2.46 0.00 -1.26 -4.94 117.00 119.00 2wse n LEU 57 Ca -0.01 -4.67 0.00 0.00 0.00 0.00 0.00 56.01 51.33 2wse n LEU 57 Cb 0.73 -0.40 0.00 0.00 0.00 0.00 0.00 43.42 43.75 2wse n LEU 57 CO -0.08 2.02 0.00 0.18 0.00 0.00 0.00 177.39 179.52 2wse n LEU 58 N -0.75 0.00 0.00 -1.96 4.32 -1.26 -4.75 117.00 112.60 2wse n LEU 58 Ca 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.43 2wse n LEU 58 Cb 0.94 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.74 2wse n LEU 58 CO 0.40 0.00 0.00 0.29 -1.22 0.00 0.00 177.39 176.86 2wse n LYS 59 N 0.00 0.00 0.00 3.23 4.76 -1.26 -1.03 118.16 123.86 2wse n LYS 59 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2wse n LYS 59 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2wse n LYS 59 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2wse n SER 60 N 0.00 0.31 0.00 4.39 2.88 -1.26 -4.62 113.62 115.32 2wse n SER 60 Ca 0.00 -1.06 0.00 0.00 -1.33 0.00 0.00 58.87 56.48 2wse n SER 60 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2wse n SER 60 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2wse n ASN 61 N -0.03 0.00 -0.09 -3.46 5.03 -0.20 -1.33 115.26 115.18 2wse n ASN 61 Ca 0.00 0.00 -0.11 0.00 0.87 0.00 0.00 54.58 55.34 2wse n ASN 61 Cb 0.24 0.00 -0.04 0.00 -1.02 0.00 0.00 39.78 38.96 2wse n ASN 61 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 2wse n ASP 62 N -2.64 1.92 0.00 6.41 8.00 -1.26 -4.30 116.55 124.69 2wse n ASP 62 Ca 0.00 0.37 0.00 0.00 0.71 0.00 0.00 54.79 55.87 2wse n ASP 62 Cb 0.00 -0.77 0.00 0.00 -0.02 0.00 0.00 41.12 40.33 2wse n ASP 62 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 2wse n PRO 63 N -4.46 0.00 0.00 -0.24 -0.02 -0.44 -3.88 135.00 125.97 2wse n PRO 63 Ca -0.18 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.38 2wse n PRO 63 Cb 0.53 -0.83 0.00 0.00 -0.02 0.00 0.00 33.50 33.18 2wse n PRO 63 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2wse n VAL 64 N -0.41 0.62 1.47 -1.45 0.31 -0.82 -2.01 118.33 116.04 2wse n VAL 64 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 64.34 64.47 2wse n VAL 64 Cb 0.00 -0.81 0.59 0.00 -0.91 0.00 0.00 33.84 32.71 2wse n VAL 64 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wse n GLY 65 N 0.31 -0.70 0.17 2.92 0.00 -1.22 -3.18 105.19 103.48 2wse n GLY 65 Ca 0.00 -0.32 -0.20 0.00 0.00 0.00 0.00 46.02 45.50 2wse n GLY 65 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2wse h PHE 66 N 0.96 0.85 -0.61 1.61 3.57 -1.63 -3.39 116.94 118.32 2wse h PHE 66 Ca 0.00 -0.49 0.24 0.00 3.53 0.00 0.00 57.97 61.25 2wse h PHE 66 Cb 0.37 -0.09 -0.11 0.00 2.79 0.00 0.00 35.95 38.91 2wse h PHE 66 CO 0.00 1.33 0.27 -1.71 -2.23 0.00 0.00 178.31 175.97 2wse n ASN 67 N -3.99 0.16 -0.08 0.41 2.85 -1.19 0.13 115.26 113.54 2wse n ASN 67 Ca -0.12 1.01 -0.10 0.00 -0.11 0.00 0.00 54.58 55.26 2wse n ASN 67 Cb 0.83 -0.47 -0.07 0.00 1.24 0.00 0.00 39.78 41.31 2wse n ASN 67 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 2wse h ILE 68 N 0.00 0.00 0.00 -1.44 5.03 -1.76 -2.76 117.51 116.58 2wse h ILE 68 Ca 0.49 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 65.23 2wse h ILE 68 Cb 1.25 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 35.04 2wse h ILE 68 CO -0.48 0.00 0.00 0.55 -0.68 0.00 0.00 178.15 177.54 2wse n VAL 69 N -4.60 0.97 0.00 1.67 3.14 0.34 -1.95 118.33 117.90 2wse n VAL 69 Ca -0.03 0.24 0.00 0.00 -2.96 0.00 0.00 64.34 61.59 2wse n VAL 69 Cb 0.25 -1.09 0.00 0.00 -1.06 0.00 0.00 33.84 31.94 2wse n VAL 69 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 2wse n ASP 70 N -1.35 0.00 -0.24 6.55 8.00 -1.04 -0.52 116.55 127.95 2wse n ASP 70 Ca 0.04 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.51 2wse n ASP 70 Cb 0.08 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.18 2wse n ASP 70 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 2wse n VAL 71 N 0.00 -0.35 -0.19 2.53 3.14 -1.26 -1.71 118.33 120.49 2wse n VAL 71 Ca 0.00 1.42 0.21 0.00 -2.96 0.00 0.00 64.34 63.01 2wse n VAL 71 Cb 0.00 -1.84 0.57 0.00 -1.06 0.00 0.00 33.84 31.51 2wse n VAL 71 CO 0.00 0.00 0.00 0.25 -6.46 0.00 0.00 176.83 170.62 2wse h LEU 72 N 0.00 0.27 0.00 6.55 6.46 -1.55 -0.49 115.31 126.55 2wse h LEU 72 Ca 0.17 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.96 2wse h LEU 72 Cb 0.33 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.23 2wse h LEU 72 CO -0.59 0.12 0.00 0.00 -0.62 0.00 0.00 178.44 177.35 2wse n ALA 73 N -2.57 0.00 0.00 1.25 0.00 0.32 -4.49 120.51 115.02 2wse n ALA 73 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2wse n ALA 73 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.17 2wse n ALA 73 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2wse n TRP 74 N 0.00 0.00 -1.01 0.00 8.01 -1.26 -1.52 117.44 121.66 2wse n TRP 74 Ca 0.00 0.00 -0.00 0.00 -1.31 0.00 0.00 57.50 56.19 2wse n TRP 74 Cb 0.00 0.00 0.34 0.00 -2.01 0.00 0.00 31.31 29.64 2wse n TRP 74 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2wse n GLY 75 N 0.00 3.51 0.96 6.99 0.00 -0.25 -3.62 105.19 112.77 2wse n GLY 75 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.03 2wse n GLY 75 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2wse n SER 76 N 0.05 0.00 0.04 1.61 7.64 -0.58 -4.39 113.62 117.99 2wse n SER 76 Ca 0.35 0.00 0.11 0.00 1.01 0.00 0.00 58.87 60.34 2wse n SER 76 Cb 1.29 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 64.50 2wse n SER 76 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wse n ILE 77 N -1.92 0.23 -1.46 0.44 3.06 -1.26 -4.12 119.36 114.33 2wse n ILE 77 Ca 0.00 -0.31 -0.28 0.00 -2.50 0.00 0.00 62.75 59.66 2wse n ILE 77 Cb 0.00 0.09 0.09 0.00 0.54 0.00 0.00 39.64 40.37 2wse n ILE 77 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2wse n GLY 78 N 1.33 5.69 2.97 4.50 0.00 -1.26 -4.99 105.19 113.43 2wse n GLY 78 Ca 0.01 -2.09 -0.13 0.00 0.00 0.00 0.00 46.02 43.81 2wse n GLY 78 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2wse n HIS 79 N -0.93 -3.34 -0.08 1.61 1.44 -1.26 -4.71 115.22 107.95 2wse n HIS 79 Ca 0.56 1.36 -0.03 0.00 -2.01 0.00 0.00 57.72 57.60 2wse n HIS 79 Cb 0.91 -3.63 -0.01 0.00 0.12 0.00 0.00 29.99 27.38 2wse n HIS 79 CO 0.00 0.00 0.00 0.44 -2.81 0.00 0.00 176.34 173.97 2wse n ILE 80 N -0.21 0.00 -1.93 0.61 -6.64 -1.24 -3.76 119.36 106.19 2wse n ILE 80 Ca 0.07 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 61.05 2wse n ILE 80 Cb 0.48 -0.03 0.00 0.00 -1.44 0.00 0.00 39.64 38.65 2wse n ILE 80 CO 0.00 0.00 0.00 1.33 -1.77 0.00 0.00 176.55 176.11 2wse n VAL 81 N 0.25 -0.79 0.63 7.28 0.24 -1.26 -4.84 118.33 119.83 2wse n VAL 81 Ca 0.02 0.10 0.12 0.00 -2.04 0.00 0.00 64.34 62.54 2wse n VAL 81 Cb -0.00 -1.60 0.21 0.00 -1.47 0.00 0.00 33.84 30.98 2wse n VAL 81 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wse n ALA 82 N 1.62 2.90 -0.47 2.33 0.00 -1.25 -4.39 120.51 121.25 2wse n ALA 82 Ca 0.00 -0.23 -0.12 0.00 0.00 0.00 0.00 53.44 53.09 2wse n ALA 82 Cb 0.10 -1.21 0.05 0.00 0.00 0.00 0.00 19.45 18.39 2wse n ALA 82 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2wse n TYR 83 N -2.05 1.27 0.00 0.00 0.18 -1.26 -4.85 117.16 110.44 2wse n TYR 83 Ca 0.04 -1.52 0.00 0.00 1.88 0.00 0.00 57.90 58.30 2wse n TYR 83 Cb 0.43 -0.75 0.00 0.00 -0.38 0.00 0.00 39.34 38.64 2wse n TYR 83 CO 0.00 0.00 0.00 0.98 -2.08 0.00 0.00 176.86 175.76 2wse n TYR 84 N 0.27 0.00 -1.88 -3.48 -0.00 -1.26 -5.03 117.16 105.78 2wse n TYR 84 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 58.15 2wse n TYR 84 Cb 0.72 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 40.06 2wse n TYR 84 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.86 175.97 2wse n ILE 85 N 0.00 -6.55 0.00 2.97 2.08 -1.26 -5.07 119.36 111.53 2wse n ILE 85 Ca 0.00 2.23 0.00 0.00 0.56 0.00 0.00 62.75 65.54 2wse n ILE 85 Cb 0.00 -3.22 0.00 0.00 -0.75 0.00 0.00 39.64 35.67 2wse n ILE 85 CO 0.00 0.00 0.00 -0.11 0.56 0.00 0.00 176.55 177.00 2wse n LEU 86 N 1.03 0.00 -0.45 1.39 7.94 -1.26 -5.06 117.00 120.59 2wse n LEU 86 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2wse n LEU 86 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 2wse n LEU 86 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.39 176.28 2wse n ALA 87 N 0.00 -0.78 -3.95 1.96 0.00 -1.26 -5.13 120.51 111.36 2wse n ALA 87 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 2wse n ALA 87 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.30 2wse n ALA 87 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2wse s THR 88 N -0.88 1.63 0.00 0.00 2.01 -1.26 -4.81 115.64 112.34 2wse s THR 88 Ca 0.00 -1.39 0.00 0.00 0.31 0.00 0.00 61.69 60.61 2wse s THR 88 Cb 0.00 -1.93 0.00 0.00 0.01 0.00 0.00 72.50 70.58 2wse s THR 88 CO 0.00 -0.18 0.00 0.00 -0.69 0.00 0.00 174.62 173.75 2wse n ALA 89 N 4.61 0.00 -3.36 7.40 0.00 -1.26 -4.89 120.51 123.02 2wse n ALA 89 Ca -0.10 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 52.88 2wse n ALA 89 Cb 0.43 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.86 2wse n ALA 89 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2wse s SER 90 N -0.41 6.62 0.00 0.00 1.04 -1.26 -4.92 113.70 114.77 2wse s SER 90 Ca 0.00 -2.65 0.00 0.00 0.48 0.00 0.00 55.95 53.78 2wse s SER 90 Cb 0.00 -2.18 0.00 0.00 0.10 0.00 0.00 66.02 63.94 2wse s SER 90 CO 0.00 -0.57 0.59 -3.20 0.98 0.00 0.00 173.24 171.03 2wse n ASN 91 N 4.01 0.00 0.00 7.02 4.05 -1.26 -5.04 115.26 124.04 2wse n ASN 91 Ca 0.12 0.59 0.00 0.00 0.45 0.00 0.00 54.58 55.73 2wse n ASN 91 Cb 0.46 -0.24 0.00 0.00 1.23 0.00 0.00 39.78 41.23 2wse n ASN 91 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2wse n GLY 92 N -0.95 0.67 0.00 8.20 0.00 -1.26 -4.30 105.19 107.54 2wse n GLY 92 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.72 2wse n GLY 92 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wse n TYR 93 N 0.00 0.00 0.00 1.61 4.02 -1.26 -4.85 117.16 116.68 2wse n TYR 93 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2wse n TYR 93 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 2wse n TYR 93 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2wse n ASP 94 N 0.00 0.00 -4.71 7.72 9.92 -1.26 -5.12 116.55 123.10 2wse n ASP 94 Ca 0.00 0.00 -0.41 0.00 -0.53 0.00 0.00 54.79 53.85 2wse n ASP 94 Cb 0.00 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 40.44 2wse n ASP 94 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 2wse s PRO 95 N -0.01 4.44 -0.73 -0.24 0.04 -1.26 -4.84 135.00 132.40 2wse s PRO 95 Ca 0.00 1.03 -0.32 0.00 0.04 0.00 0.00 61.00 61.75 2wse s PRO 95 Cb 0.00 -3.47 -0.16 0.00 0.04 0.00 0.00 34.50 30.90 2wse s PRO 95 CO 0.00 -0.03 2.50 0.45 0.04 0.00 0.00 177.00 179.96 2wse n SER 96 N 4.06 1.11 0.00 6.66 2.88 -1.26 -4.71 113.62 122.37 2wse n SER 96 Ca 0.01 0.09 0.02 0.00 -1.33 0.00 0.00 58.87 57.67 2wse n SER 96 Cb 0.51 -1.13 0.14 0.00 -0.75 0.00 0.00 64.21 62.98 2wse n SER 96 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2wse n PHE 97 N 11.46 0.00 -0.14 0.66 3.72 -1.26 -5.24 117.46 126.66 2wse n PHE 97 Ca 0.54 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.94 2wse n PHE 97 Cb 0.18 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.72 2wse n PHE 97 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05