#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ein n SER 2 N 0.00 0.35 0.00 0.00 2.88 -1.26 -5.11 113.62 110.48 2ein n SER 2 Ca 0.00 -0.77 0.00 0.00 -1.33 0.00 0.00 58.87 56.77 2ein n SER 2 Cb 0.00 0.15 0.00 0.00 -0.75 0.00 0.00 64.21 63.61 2ein n SER 2 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ein n ALA 3 N -0.15 0.00 0.00 -1.46 0.00 -1.26 -4.46 120.51 113.18 2ein n ALA 3 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ein n ALA 3 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.54 2ein n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ein n ALA 4 N 2.58 0.00 -2.93 0.00 0.00 -1.26 -5.14 120.51 113.76 2ein n ALA 4 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ein n ALA 4 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2ein n ALA 4 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2ein n LYS 5 N 0.00 0.00 0.02 0.00 5.02 -1.26 -5.16 118.16 116.78 2ein n LYS 5 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2ein n LYS 5 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2ein n LYS 5 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ein n GLY 6 N 5.00 -0.79 0.00 0.72 0.00 -1.26 -5.13 105.19 103.73 2ein n GLY 6 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.30 2ein n GLY 6 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ein n ASP 7 N -2.57 0.00 0.00 1.61 -0.08 -1.26 -4.72 116.55 109.53 2ein n ASP 7 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2ein n ASP 7 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2ein n ASP 7 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 2ein n HIS 8 N 0.00 0.00 -0.21 -0.67 8.25 -1.26 -4.57 115.22 116.76 2ein n HIS 8 Ca 0.00 0.00 0.23 0.00 -0.26 0.00 0.00 57.72 57.69 2ein n HIS 8 Cb 0.00 -0.27 0.60 0.00 1.12 0.00 0.00 29.99 31.44 2ein n HIS 8 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2ein h GLY 9 N 0.00 0.51 0.00 -1.41 0.00 -2.08 -3.51 103.07 96.59 2ein h GLY 9 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.22 2ein h GLY 9 CO 0.00 -0.01 0.00 0.61 0.00 0.00 0.00 176.54 177.14 2ein n GLY 10 N -1.60 1.77 0.00 4.60 0.00 -1.26 -5.32 105.19 103.38 2ein n GLY 10 Ca 0.19 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.41 2ein n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ein n GLY 12 N 0.00 0.27 0.31 -0.02 0.00 -1.26 -4.91 105.19 99.58 2ein n GLY 12 Ca 0.00 -1.82 0.08 0.00 0.00 0.00 0.00 46.02 44.28 2ein n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ein h ALA 13 N 0.00 1.31 -0.63 4.61 0.00 -2.06 -1.96 119.26 120.53 2ein h ALA 13 Ca 0.00 0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.04 2ein h ALA 13 Cb 0.00 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 2ein h ALA 13 CO 0.00 -0.14 0.39 -0.09 0.00 0.00 0.00 179.25 179.40 2ein h ARG 14 N 0.57 0.74 0.07 0.00 2.43 -1.99 -1.39 114.38 114.82 2ein h ARG 14 Ca 0.48 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.62 2ein h ARG 14 Cb 0.73 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 2ein h ARG 14 CO -0.40 0.49 -0.15 1.15 -1.51 0.00 0.00 179.97 179.55 2ein h THR 15 N 0.76 0.65 0.00 0.20 2.02 -1.71 -1.25 112.91 113.58 2ein h THR 15 Ca 0.25 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.43 2ein h THR 15 Cb 0.01 0.65 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 2ein h THR 15 CO -0.10 0.00 -0.01 -0.50 0.37 0.00 0.00 175.52 175.28 2ein h TRP 16 N -0.29 0.00 0.18 3.16 4.06 -1.20 -0.39 115.95 121.47 2ein h TRP 16 Ca 0.03 0.00 -0.31 0.00 2.06 0.00 0.00 58.89 60.67 2ein h TRP 16 Cb 0.31 0.00 0.02 0.00 -1.00 0.00 0.00 29.16 28.49 2ein h TRP 16 CO -0.17 0.01 -1.45 -0.09 -3.56 0.00 0.00 178.44 173.19 2ein h ARG 17 N 0.00 0.38 -0.17 0.49 2.43 -0.82 -2.06 114.38 114.64 2ein h ARG 17 Ca -0.00 -0.65 0.03 0.00 -0.81 0.00 0.00 59.98 58.56 2ein h ARG 17 Cb 0.24 0.24 -0.03 0.00 -0.42 0.00 0.00 29.97 30.00 2ein h ARG 17 CO 0.00 1.29 -0.05 0.35 -1.51 0.00 0.00 179.97 180.06 2ein h PHE 18 N 0.10 -0.10 -0.73 2.20 -0.00 -0.09 -0.73 116.94 117.60 2ein h PHE 18 Ca -0.22 0.02 -0.04 0.00 -0.00 0.00 0.00 57.97 57.72 2ein h PHE 18 Cb 2.07 0.07 -0.03 0.00 -0.00 0.00 0.00 35.95 38.06 2ein h PHE 18 CO 0.09 -0.08 0.31 -0.07 -0.00 0.00 0.00 178.31 178.56 2ein h LEU 19 N -0.01 0.97 -0.21 0.59 3.38 -1.13 0.21 115.31 119.12 2ein h LEU 19 Ca 0.08 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 57.94 2ein h LEU 19 Cb 0.13 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2ein h LEU 19 CO -0.18 0.85 0.07 0.74 0.09 0.00 0.00 178.44 180.01 2ein h THR 20 N 1.04 0.95 0.00 0.22 2.02 -0.55 -1.18 112.91 115.41 2ein h THR 20 Ca 0.25 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.37 2ein h THR 20 Cb 0.17 0.77 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 2ein h THR 20 CO -0.02 0.03 -0.89 0.49 0.37 0.00 0.00 175.52 175.49 2ein n PHE 21 N -5.04 0.75 -0.15 3.16 0.99 -0.37 -0.73 117.46 116.06 2ein n PHE 21 Ca -0.03 0.22 0.05 0.00 -0.00 0.00 0.00 57.45 57.69 2ein n PHE 21 Cb 0.08 -0.80 0.13 0.00 -1.00 0.00 0.00 39.48 37.88 2ein n PHE 21 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2ein n GLY 22 N 1.25 2.81 1.78 1.37 0.00 0.74 -4.50 105.19 108.63 2ein n GLY 22 Ca 0.01 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2ein n GLY 22 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2ein n LEU 23 N 0.34 0.00 0.05 0.99 7.94 -0.71 -4.87 117.00 120.74 2ein n LEU 23 Ca 0.10 0.00 -0.13 0.00 -1.11 0.00 0.00 56.01 54.86 2ein n LEU 23 Cb 0.40 0.21 -0.08 0.00 0.53 0.00 0.00 43.42 44.47 2ein n LEU 23 CO 0.07 -0.44 0.51 0.00 -1.11 0.00 0.00 177.39 176.41 2ein h ALA 24 N 0.05 -0.89 -0.70 1.96 0.00 -1.30 0.17 119.26 118.55 2ein h ALA 24 Ca 0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2ein h ALA 24 Cb 0.00 0.88 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 2ein h ALA 24 CO 0.00 -1.02 0.28 -0.07 0.00 0.00 0.00 179.25 178.44 2ein h LEU 25 N -0.58 0.94 -0.77 0.00 3.38 -1.16 -2.13 115.31 115.00 2ein h LEU 25 Ca 0.01 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 2ein h LEU 25 Cb 0.61 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2ein h LEU 25 CO -0.30 0.84 0.31 -0.65 0.09 0.00 0.00 178.44 178.74 2ein h PRO 26 N 1.01 1.14 -0.39 1.13 0.11 -1.66 -0.84 132.00 132.51 2ein h PRO 26 Ca 0.24 -0.20 0.07 0.00 0.11 0.00 0.00 66.00 66.22 2ein h PRO 26 Cb 0.19 -0.19 -0.07 0.00 0.11 0.00 0.00 31.00 31.04 2ein h PRO 26 CO -0.02 0.92 -0.03 0.77 -0.21 0.00 0.00 178.00 179.43 2ein h SER 27 N 1.10 -0.22 0.16 -2.05 0.02 -0.06 0.48 113.55 112.99 2ein h SER 27 Ca 0.26 0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 61.29 2ein h SER 27 Cb 0.20 0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.92 2ein h SER 27 CO -0.02 -0.07 -0.07 0.58 -1.14 0.00 0.00 176.83 176.11 2ein h VAL 28 N 0.07 0.63 0.12 2.27 2.07 -1.14 -0.87 116.25 119.40 2ein h VAL 28 Ca 0.19 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 2ein h VAL 28 Cb 0.27 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 2ein h VAL 28 CO -0.34 0.06 -0.06 0.00 0.02 0.00 0.00 177.57 177.26 2ein h ALA 29 N 1.93 -0.16 0.21 1.67 0.00 0.14 -2.19 119.26 120.87 2ein h ALA 29 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2ein h ALA 29 Cb 0.16 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2ein h ALA 29 CO 0.01 -0.33 -0.21 -0.07 0.00 0.00 0.00 179.25 178.65 2ein h LEU 30 N -0.69 -0.57 -2.13 0.00 3.38 -0.74 -0.62 115.31 113.93 2ein h LEU 30 Ca -0.02 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.06 2ein h LEU 30 Cb 0.52 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2ein h LEU 30 CO 0.03 -0.32 0.16 0.00 0.09 0.00 0.00 178.44 178.40 2ein h THR 32 N 0.00 1.50 0.66 0.00 2.02 -0.94 -1.54 112.91 114.62 2ein h THR 32 Ca 0.09 -3.01 -0.03 0.00 0.77 0.00 0.00 66.41 64.22 2ein h THR 32 Cb 0.41 2.88 0.01 0.00 -1.74 0.00 0.00 68.15 69.70 2ein h THR 32 CO -0.00 0.88 -0.32 0.25 0.37 0.00 0.00 175.52 176.70 2ein h LEU 33 N 0.08 -0.75 -0.45 2.58 7.12 0.62 -0.48 115.31 124.03 2ein h LEU 33 Ca -0.12 0.03 0.09 0.00 0.13 0.00 0.00 57.88 58.01 2ein h LEU 33 Cb 1.91 0.19 -0.08 0.00 -0.53 0.00 0.00 40.66 42.15 2ein h LEU 33 CO 0.19 -0.50 -0.06 -1.13 -0.13 0.00 0.00 178.44 176.82 2ein h ASN 34 N -0.97 -0.31 -0.60 1.25 -0.73 -0.62 -2.19 115.58 111.41 2ein h ASN 34 Ca -0.09 0.12 -0.01 0.00 1.87 0.00 0.00 56.30 58.19 2ein h ASN 34 Cb 0.68 0.24 -0.03 0.00 0.27 0.00 0.00 38.32 39.48 2ein h ASN 34 CO 0.15 -0.11 0.34 -1.28 -0.37 0.00 0.00 177.43 176.16 2ein h SER 35 N 0.05 0.75 -0.60 1.15 0.87 -1.25 -2.22 113.55 112.30 2ein h SER 35 Ca 0.22 -0.09 -0.35 0.00 -1.23 0.00 0.00 61.79 60.34 2ein h SER 35 Cb 0.34 -0.19 -0.13 0.00 -0.44 0.00 0.00 62.40 61.98 2ein h SER 35 CO -0.42 0.62 0.13 0.79 -0.53 0.00 0.00 176.83 177.42 2ein n TRP 36 N -4.58 1.01 0.18 2.24 5.03 -0.19 -2.80 117.44 118.33 2ein n TRP 36 Ca 0.04 -1.76 0.00 0.00 3.03 0.00 0.00 57.50 58.81 2ein n TRP 36 Cb 0.08 -1.34 0.00 0.00 -1.03 0.00 0.00 31.31 29.02 2ein n TRP 36 CO 0.00 0.00 0.00 -0.11 -0.03 0.00 0.00 177.69 177.55 2ein n LEU 37 N 1.34 -1.98 0.00 -0.99 7.94 -1.05 -4.86 117.00 117.40 2ein n LEU 37 Ca 0.42 0.66 0.07 0.00 -1.11 0.00 0.00 56.01 56.05 2ein n LEU 37 Cb 0.66 1.98 0.43 0.00 0.53 0.00 0.00 43.42 47.03 2ein n LEU 37 CO 0.25 -0.29 0.66 1.41 -1.11 0.00 0.00 177.39 178.32 2ein n HIS 38 N -3.41 0.00 0.00 1.96 8.25 -0.86 -4.60 115.22 116.56 2ein n HIS 38 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2ein n HIS 38 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2ein n HIS 38 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2ein n SER 39 N -0.86 0.00 -1.47 0.41 3.41 -1.12 -5.03 113.62 108.96 2ein n SER 39 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 2ein n SER 39 Cb 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 2ein n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ein n GLY 40 N 0.75 -4.70 3.55 5.00 0.00 -1.26 -4.76 105.19 103.76 2ein n GLY 40 Ca 0.00 -0.53 -0.35 0.00 0.00 0.00 0.00 46.02 45.13 2ein n GLY 40 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2ein n HIS 41 N 0.41 1.42 -2.12 1.61 8.25 -1.26 -4.94 115.22 118.59 2ein n HIS 41 Ca 0.00 0.12 -0.42 0.00 -0.26 0.00 0.00 57.72 57.16 2ein n HIS 41 Cb 0.00 -2.64 -0.03 0.00 1.12 0.00 0.00 29.99 28.44 2ein n HIS 41 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2ein s ARG 42 N 8.32 4.29 -0.46 -0.41 0.52 -1.26 -4.88 118.95 125.07 2ein s ARG 42 Ca 0.98 2.12 -0.42 0.00 -0.52 0.00 0.00 55.73 57.89 2ein s ARG 42 Cb -0.17 -3.34 -0.17 0.00 0.52 0.00 0.00 34.95 31.79 2ein s ARG 42 CO 0.26 -0.52 2.13 -1.91 0.02 0.00 0.00 175.30 175.28 2ein n GLU 43 N 4.41 0.28 -1.74 3.54 2.13 -1.26 -4.83 120.64 123.17 2ein n GLU 43 Ca 0.13 0.08 -0.42 0.00 0.66 0.00 0.00 57.16 57.60 2ein n GLU 43 Cb 0.42 -1.74 -0.03 0.00 0.27 0.00 0.00 31.44 30.36 2ein n GLU 43 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 2ein s ARG 44 N 5.94 4.14 0.90 5.31 1.70 -1.26 -4.96 118.95 130.72 2ein s ARG 44 Ca 1.17 2.57 -0.11 0.00 -0.47 0.00 0.00 55.73 58.89 2ein s ARG 44 Cb -1.34 -3.57 0.13 0.00 -0.57 0.00 0.00 34.95 29.60 2ein s ARG 44 CO 0.62 -0.83 1.10 -0.35 -1.08 0.00 0.00 175.30 174.76 2ein n PRO 45 N 5.60 -0.36 -2.13 3.89 -0.04 -1.26 -4.97 135.00 135.73 2ein n PRO 45 Ca 0.17 -0.04 -0.41 0.00 -0.04 0.00 0.00 63.50 63.19 2ein n PRO 45 Cb 0.38 -2.35 -0.03 0.00 -0.04 0.00 0.00 33.50 31.47 2ein n PRO 45 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ein s ALA 46 N -2.54 3.56 0.28 0.55 0.00 -1.26 -4.98 121.76 117.37 2ein s ALA 46 Ca 0.67 1.21 -0.29 0.00 0.00 0.00 0.00 51.96 53.55 2ein s ALA 46 Cb -0.24 -3.51 -0.10 0.00 0.00 0.00 0.00 23.12 19.28 2ein s ALA 46 CO 0.58 -0.62 1.24 0.12 0.00 0.00 0.00 175.76 177.08 2ein s PHE 47 N -0.11 3.27 -0.12 0.00 5.99 -1.26 -5.04 117.98 120.70 2ein s PHE 47 Ca 0.56 1.45 -0.04 0.00 0.00 0.00 0.00 56.93 58.91 2ein s PHE 47 Cb -0.39 -3.54 0.06 0.00 0.00 0.00 0.00 43.02 39.15 2ein s PHE 47 CO 0.42 -1.47 0.14 0.42 -0.00 0.00 0.00 175.22 174.73 2ein s ILE 48 N -0.79 -0.20 -0.09 3.12 1.01 -1.26 -5.05 121.20 117.94 2ein s ILE 48 Ca 0.50 0.13 -0.01 0.00 0.00 0.00 0.00 60.65 61.27 2ein s ILE 48 Cb -0.36 -0.42 -0.01 0.00 0.01 0.00 0.00 42.46 41.67 2ein s ILE 48 CO 0.45 -0.03 1.04 -2.65 0.00 0.00 0.00 174.94 173.75 2ein n PRO 49 N 5.31 0.27 -1.90 2.79 -0.02 -1.26 -4.88 135.00 135.30 2ein n PRO 49 Ca -0.05 -0.46 -0.41 0.00 -2.02 0.00 0.00 63.50 60.55 2ein n PRO 49 Cb 0.50 -1.90 -0.01 0.00 -0.02 0.00 0.00 33.50 32.06 2ein n PRO 49 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2ein s TYR 50 N 4.14 2.80 -0.74 6.00 2.02 -1.26 -4.91 117.35 125.39 2ein s TYR 50 Ca 0.06 1.10 0.25 0.00 -0.37 0.00 0.00 57.07 58.12 2ein s TYR 50 Cb 0.02 -3.93 0.91 0.00 -0.40 0.00 0.00 41.96 38.56 2ein s TYR 50 CO -0.00 -2.84 1.77 0.72 -1.57 0.00 0.00 175.55 173.63 2ein n HIS 51 N 1.26 0.68 0.91 2.71 8.25 -1.26 -3.70 115.22 124.08 2ein n HIS 51 Ca 0.03 0.22 0.12 0.00 -0.26 0.00 0.00 57.72 57.83 2ein n HIS 51 Cb 0.39 -0.85 0.23 0.00 1.12 0.00 0.00 29.99 30.88 2ein n HIS 51 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2ein n HIS 52 N -2.08 0.16 -4.41 4.41 1.44 -1.26 -4.89 115.22 108.59 2ein n HIS 52 Ca 0.05 -0.08 -0.18 0.00 -2.01 0.00 0.00 57.72 55.50 2ein n HIS 52 Cb 0.35 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.43 2ein n HIS 52 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2ein n LEU 53 N 1.11 0.00 -3.52 2.39 4.77 -1.24 -4.79 117.00 115.71 2ein n LEU 53 Ca 0.16 -1.82 -0.28 0.00 -0.03 0.00 0.00 56.01 54.05 2ein n LEU 53 Cb 0.54 0.26 -0.05 0.00 -2.33 0.00 0.00 43.42 41.83 2ein n LEU 53 CO 0.15 -0.26 -0.10 0.54 -1.33 0.00 0.00 177.39 176.39 2ein n ARG 54 N -0.70 -0.94 -1.58 3.23 3.00 -1.26 -4.84 116.66 113.57 2ein n ARG 54 Ca -0.11 0.09 -0.38 0.00 -0.01 0.00 0.00 57.85 57.44 2ein n ARG 54 Cb 0.36 -3.36 0.04 0.00 0.00 0.00 0.00 32.46 29.51 2ein n ARG 54 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 2ein n ILE 55 N -2.93 3.16 -3.03 0.55 2.08 -1.26 -4.65 119.36 113.28 2ein n ILE 55 Ca 0.08 -0.50 -0.14 0.00 0.56 0.00 0.00 62.75 62.75 2ein n ILE 55 Cb 0.32 -1.05 -0.04 0.00 -0.75 0.00 0.00 39.64 38.13 2ein n ILE 55 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 2ein n ARG 56 N -0.60 0.39 0.02 0.38 5.12 -1.26 -4.99 116.66 115.73 2ein n ARG 56 Ca 0.12 -2.52 0.12 0.00 -1.93 0.00 0.00 57.85 53.64 2ein n ARG 56 Cb 0.46 -1.55 0.19 0.00 -1.16 0.00 0.00 32.46 30.39 2ein n ARG 56 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 2ein n THR 57 N 2.87 0.12 -3.64 0.55 -2.24 -1.26 -4.88 114.28 105.80 2ein n THR 57 Ca 0.23 -0.11 -0.09 0.00 -2.27 0.00 0.00 64.05 61.81 2ein n THR 57 Cb 0.53 0.16 -0.07 0.00 -2.10 0.00 0.00 70.33 68.84 2ein n THR 57 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2ein s LYS 58 N -3.07 0.62 0.36 -0.78 2.20 -1.26 -5.14 119.74 112.66 2ein s LYS 58 Ca 0.09 0.84 -0.28 0.00 -0.36 0.00 0.00 55.97 56.25 2ein s LYS 58 Cb 0.16 0.25 -0.11 0.00 -1.51 0.00 0.00 37.83 36.62 2ein s LYS 58 CO 0.72 -0.09 1.49 -1.25 -0.36 0.00 0.00 175.35 175.87 2ein s PRO 59 N 0.71 4.13 0.44 4.03 0.04 -1.26 -4.94 135.00 138.14 2ein s PRO 59 Ca -0.02 2.55 -0.26 0.00 0.04 0.00 0.00 61.00 63.31 2ein s PRO 59 Cb -0.05 -2.99 -0.09 0.00 0.04 0.00 0.00 34.50 31.42 2ein s PRO 59 CO -0.08 -0.53 1.43 -0.06 0.04 0.00 0.00 177.00 177.80 2ein s PHE 60 N -0.91 2.50 -1.61 0.56 2.99 -0.70 -4.87 117.98 115.94 2ein s PHE 60 Ca 0.54 1.26 0.00 0.00 0.00 0.00 0.00 56.93 58.74 2ein s PHE 60 Cb -0.46 -3.91 0.00 0.00 0.00 0.00 0.00 43.02 38.64 2ein s PHE 60 CO 0.60 -2.88 0.42 0.43 -0.00 0.00 0.00 175.22 173.79 2ein n SER 61 N -0.09 0.21 -4.18 1.36 7.64 -1.26 -4.01 113.62 113.29 2ein n SER 61 Ca 0.04 -1.05 -0.11 0.00 1.01 0.00 0.00 58.87 58.76 2ein n SER 61 Cb 0.42 -0.10 -0.10 0.00 -1.01 0.00 0.00 64.21 63.41 2ein n SER 61 CO 0.00 0.00 0.00 -1.66 -3.01 0.00 0.00 175.04 170.37 2ein s TRP 62 N -1.61 1.01 0.00 1.43 -2.14 -1.26 -5.04 118.94 111.33 2ein s TRP 62 Ca 0.00 -1.23 0.00 0.00 2.66 0.00 0.00 56.10 57.53 2ein s TRP 62 Cb 0.00 -0.55 0.00 0.00 -3.10 0.00 0.00 33.47 29.82 2ein s TRP 62 CO 0.00 -0.49 0.00 0.41 -2.66 0.00 0.00 176.95 174.21 2ein n GLY 63 N -0.17 2.94 1.54 3.67 0.00 -1.26 -1.66 105.19 110.25 2ein n GLY 63 Ca -0.04 -0.18 0.07 0.00 0.00 0.00 0.00 46.02 45.86 2ein n GLY 63 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ein n ASP 64 N 2.18 4.55 0.00 1.61 5.75 -1.26 -4.91 116.55 124.47 2ein n ASP 64 Ca 0.00 -2.60 0.00 0.00 -0.01 0.00 0.00 54.79 52.18 2ein n ASP 64 Cb 0.00 -0.60 0.00 0.00 -1.03 0.00 0.00 41.12 39.49 2ein n ASP 64 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ein n GLY 65 N 0.73 0.41 0.00 6.12 0.00 -0.66 -4.82 105.19 106.97 2ein n GLY 65 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2ein n GLY 65 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ein n ASN 66 N -0.21 0.52 -4.67 1.61 5.15 -1.26 -1.73 115.26 114.67 2ein n ASN 66 Ca 0.00 -0.76 -0.35 0.00 -0.60 0.00 0.00 54.58 52.87 2ein n ASN 66 Cb 0.10 0.48 -0.09 0.00 -0.53 0.00 0.00 39.78 39.74 2ein n ASN 66 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 2ein s HIS 67 N -0.48 3.26 0.94 1.20 3.76 -1.26 -4.84 115.29 117.87 2ein s HIS 67 Ca 0.00 0.13 -0.11 0.00 -0.15 0.00 0.00 55.06 54.93 2ein s HIS 67 Cb 0.00 -1.98 0.16 0.00 1.11 0.00 0.00 32.58 31.86 2ein s HIS 67 CO 0.00 0.29 1.10 0.95 -0.85 0.00 0.00 174.74 176.23 2ein s THR 68 N -0.11 2.41 0.13 1.30 -4.23 -1.26 -4.92 115.64 108.96 2ein s THR 68 Ca 0.06 0.13 -0.26 0.00 -1.18 0.00 0.00 61.69 60.44 2ein s THR 68 Cb -0.12 -2.36 -0.04 0.00 1.34 0.00 0.00 72.50 71.32 2ein s THR 68 CO 0.01 -0.17 1.61 0.15 -0.54 0.00 0.00 174.62 175.68 2ein h PHE 69 N -1.84 -0.87 -1.94 3.99 3.04 -2.00 -2.53 116.94 114.79 2ein h PHE 69 Ca -0.49 0.03 -0.75 0.00 3.98 0.00 0.00 57.97 60.74 2ein h PHE 69 Cb 1.28 0.39 -0.28 0.00 2.56 0.00 0.00 35.95 39.90 2ein h PHE 69 CO 0.44 -0.40 0.90 1.19 -2.02 0.00 0.00 178.31 178.43 2ein n PHE 70 N -5.41 3.02 -1.83 0.41 3.01 -1.26 -5.01 117.46 110.39 2ein n PHE 70 Ca -0.04 -2.40 -0.42 0.00 1.01 0.00 0.00 57.45 55.60 2ein n PHE 70 Cb 0.32 -1.09 -0.03 0.00 -0.01 0.00 0.00 39.48 38.67 2ein n PHE 70 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 2ein s HIS 71 N -4.03 2.43 -0.29 1.38 2.46 -0.95 -4.99 115.29 111.29 2ein s HIS 71 Ca 0.52 0.23 -0.02 0.00 0.47 0.00 0.00 55.06 56.26 2ein s HIS 71 Cb 0.44 -4.05 0.05 0.00 -0.13 0.00 0.00 32.58 28.88 2ein s HIS 71 CO -0.39 -4.23 -0.01 1.21 -2.47 0.00 0.00 174.74 168.84 2ein s ASN 72 N 2.29 4.80 0.26 9.88 3.84 -1.26 -5.01 114.94 129.73 2ein s ASN 72 Ca 0.76 -1.22 -0.03 0.00 0.21 0.00 0.00 52.86 52.59 2ein s ASN 72 Cb -0.43 -1.70 0.43 0.00 -0.55 0.00 0.00 41.25 38.99 2ein s ASN 72 CO 0.34 -0.24 1.84 -0.65 -2.79 0.00 0.00 177.10 175.60 2ein h PRO 73 N 7.99 0.92 -0.21 0.43 0.11 -1.94 0.71 132.00 140.01 2ein h PRO 73 Ca -0.23 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 65.85 2ein h PRO 73 Cb 1.07 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 2ein h PRO 73 CO 0.53 0.61 0.14 -0.09 -0.21 0.00 0.00 178.00 178.99 2ein h ARG 74 N 0.95 0.18 0.00 1.05 1.12 -1.96 -3.34 114.38 112.38 2ein h ARG 74 Ca 0.43 -0.01 0.00 0.00 -1.11 0.00 0.00 59.98 59.28 2ein h ARG 74 Cb 0.32 -0.04 0.00 0.00 -0.01 0.00 0.00 29.97 30.24 2ein h ARG 74 CO -0.22 0.12 0.00 1.33 -3.11 0.00 0.00 179.97 178.09 2ein n VAL 75 N -4.50 0.00 -3.66 0.20 0.24 -0.78 -4.89 118.33 104.94 2ein n VAL 75 Ca 0.01 -0.26 -0.39 0.00 -2.04 0.00 0.00 64.34 61.65 2ein n VAL 75 Cb 0.15 1.05 -0.11 0.00 -1.47 0.00 0.00 33.84 33.47 2ein n VAL 75 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2ein s ASN 76 N -0.47 5.51 0.60 -1.34 0.02 0.24 -5.01 114.94 114.48 2ein s ASN 76 Ca 0.00 -1.57 -0.14 0.00 -1.02 0.00 0.00 52.86 50.14 2ein s ASN 76 Cb 0.00 -1.94 -0.04 0.00 0.02 0.00 0.00 41.25 39.29 2ein s ASN 76 CO 0.00 -0.51 1.03 -2.16 0.02 0.00 0.00 177.10 175.47 2ein s PRO 77 N 1.36 3.50 0.64 -0.60 0.04 -1.26 -4.62 135.00 134.07 2ein s PRO 77 Ca 0.03 0.95 -0.04 0.00 0.04 0.00 0.00 61.00 61.98 2ein s PRO 77 Cb -0.23 -2.07 0.05 0.00 0.04 0.00 0.00 34.50 32.29 2ein s PRO 77 CO 0.01 -0.65 0.92 -0.51 0.04 0.00 0.00 177.00 176.81 2ein s LEU 78 N -4.79 3.02 0.61 -3.56 1.43 -0.88 -4.85 118.68 109.65 2ein s LEU 78 Ca 0.59 0.32 0.28 0.00 -1.03 0.00 0.00 54.13 54.29 2ein s LEU 78 Cb -0.12 -3.07 1.45 0.00 0.03 0.00 0.00 46.19 44.48 2ein s LEU 78 CO 0.44 -1.38 1.86 -0.65 0.23 0.00 0.00 176.35 176.84 2ein h PRO 79 N -0.32 0.00 -0.54 1.29 0.11 -1.88 0.36 132.00 131.01 2ein h PRO 79 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2ein h PRO 79 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2ein h PRO 79 CO 0.58 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.62 2ein n THR 80 N -3.48 2.26 0.00 -1.15 -2.24 -1.26 -4.89 114.28 103.52 2ein n THR 80 Ca 0.06 -1.39 0.00 0.00 -2.27 0.00 0.00 64.05 60.45 2ein n THR 80 Cb 0.65 -0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 2ein n THR 80 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ein n GLY 81 N 0.63 1.06 3.56 3.38 0.00 0.13 -5.04 105.19 108.91 2ein n GLY 81 Ca 0.25 -2.05 -0.36 0.00 0.00 0.00 0.00 46.02 43.87 2ein n GLY 81 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2ein n TYR 82 N 1.21 0.15 -2.20 1.61 4.01 -1.26 -2.08 117.16 118.60 2ein n TYR 82 Ca 0.00 0.38 -0.27 0.00 -0.16 0.00 0.00 57.90 57.85 2ein n TYR 82 Cb 0.00 -2.02 0.05 0.00 -0.31 0.00 0.00 39.34 37.06 2ein n TYR 82 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2ein s GLU 83 N -3.10 2.64 0.00 -0.72 2.02 -1.26 -4.87 118.70 113.40 2ein s GLU 83 Ca 0.71 0.03 0.01 0.00 0.02 0.00 0.00 54.97 55.74 2ein s GLU 83 Cb -0.35 -2.17 0.08 0.00 0.10 0.00 0.00 34.13 31.79 2ein s GLU 83 CO 0.53 -0.98 0.57 1.63 0.02 0.00 0.00 175.26 177.02