#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y6p h LEU 2 N 0.00 0.18 -1.59 0.00 5.85 -1.24 -0.18 115.31 118.33 1y6p h LEU 2 Ca 0.00 0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.77 1y6p h LEU 2 Cb 0.00 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1y6p h LEU 2 CO 0.00 0.10 -0.19 4.11 -0.34 0.00 0.00 178.44 182.12 1y6p h TRP 3 N 0.38 0.02 -0.36 1.25 5.08 -2.00 -2.02 115.95 118.30 1y6p h TRP 3 Ca 0.33 -0.00 -0.17 0.00 1.08 0.00 0.00 58.89 60.13 1y6p h TRP 3 Cb 0.44 -0.01 -0.00 0.00 -3.00 0.00 0.00 29.16 26.59 1y6p h TRP 3 CO -0.19 0.21 -0.42 1.96 -1.28 0.00 0.00 178.44 178.72 1y6p h GLN 4 N 0.02 0.92 -0.58 0.12 4.20 -1.48 -2.13 115.11 116.19 1y6p h GLN 4 Ca 0.00 -0.51 0.04 0.00 0.06 0.00 0.00 58.65 58.25 1y6p h GLN 4 Cb 0.35 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 28.11 1y6p h GLN 4 CO 0.02 1.16 0.32 0.35 -0.67 0.00 0.00 178.83 180.01 1y6p h PHE 5 N 0.74 0.59 -0.15 2.96 3.57 -0.57 0.08 116.94 124.16 1y6p h PHE 5 Ca 0.05 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 1y6p h PHE 5 Cb 1.02 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.57 1y6p h PHE 5 CO 0.06 0.30 -0.06 0.00 -2.23 0.00 0.00 178.31 176.39 1y6p h ARG 6 N 0.61 0.22 -0.36 1.11 3.08 -1.26 -1.23 114.38 116.55 1y6p h ARG 6 Ca 0.25 -0.04 -0.13 0.00 0.07 0.00 0.00 59.98 60.13 1y6p h ARG 6 Cb 0.11 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 1y6p h ARG 6 CO -0.15 0.30 -0.30 0.77 -1.07 0.00 0.00 179.97 179.52 1y6p h SER 7 N 0.21 0.81 -0.74 7.04 0.02 -0.37 -1.72 113.55 118.79 1y6p h SER 7 Ca 0.05 -0.32 -0.04 0.00 -0.84 0.00 0.00 61.79 60.64 1y6p h SER 7 Cb 0.25 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 1y6p h SER 7 CO 0.01 1.05 0.33 -0.07 -1.14 0.00 0.00 176.83 177.01 1y6p h LEU 8 N 0.66 1.01 -0.30 5.07 3.38 0.05 -0.24 115.31 124.94 1y6p h LEU 8 Ca 0.08 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1y6p h LEU 8 Cb 0.83 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1y6p h LEU 8 CO 0.07 0.87 0.10 0.40 0.09 0.00 0.00 178.44 179.98 1y6p h ILE 9 N 1.09 1.19 -0.78 1.22 2.04 -1.02 -1.67 117.51 119.58 1y6p h ILE 9 Ca 0.26 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.51 1y6p h ILE 9 Cb 0.16 1.03 -0.04 0.00 -0.74 0.00 0.00 36.82 37.23 1y6p h ILE 9 CO -0.03 0.21 0.49 0.50 0.00 0.00 0.00 178.15 179.32 1y6p h LYS 10 N 0.33 1.03 0.66 2.37 3.11 -0.78 0.30 116.57 123.59 1y6p h LYS 10 Ca 0.10 -0.07 -0.03 0.00 -2.81 0.00 0.00 60.65 57.83 1y6p h LYS 10 Cb 0.22 -0.23 0.01 0.00 -1.00 0.00 0.00 32.23 31.23 1y6p h LYS 10 CO -0.01 0.70 -0.32 0.00 -2.81 0.00 0.00 179.45 177.02 1y6p h ALA 12 N -0.54 1.22 -2.50 0.00 0.00 -1.06 -3.33 119.26 113.04 1y6p h ALA 12 Ca -0.09 -0.42 -0.60 0.00 0.00 0.00 0.00 54.91 53.81 1y6p h ALA 12 Cb 0.69 -0.08 -0.40 0.00 0.00 0.00 0.00 17.79 18.00 1y6p h ALA 12 CO 0.14 0.57 -0.78 -0.89 0.00 0.00 0.00 179.25 178.29 1y6p n ILE 13 N -4.00 0.59 0.25 0.00 5.41 0.10 -4.93 119.36 116.78 1y6p n ILE 13 Ca -0.02 -4.39 0.15 0.00 1.00 0.00 0.00 62.75 59.49 1y6p n ILE 13 Cb 0.48 -1.98 0.84 0.00 -0.71 0.00 0.00 39.64 38.27 1y6p n ILE 13 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1y6p h PRO 14 N 4.95 0.00 -0.48 0.38 0.11 -1.40 -1.49 132.00 134.07 1y6p h PRO 14 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1y6p h PRO 14 Cb 0.80 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.91 1y6p h PRO 14 CO 0.60 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.80 1y6p n GLY 15 N -1.39 0.23 3.44 -0.55 0.00 -1.26 -4.87 105.19 100.79 1y6p n GLY 15 Ca -0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 1y6p n GLY 15 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y6p s SER 16 N -0.53 2.22 -0.48 1.61 1.04 -0.56 -5.10 113.70 111.91 1y6p s SER 16 Ca 0.00 -1.42 0.03 0.00 0.48 0.00 0.00 55.95 55.05 1y6p s SER 16 Cb 0.00 0.03 0.13 0.00 0.10 0.00 0.00 66.02 66.28 1y6p s SER 16 CO 0.00 -0.67 0.23 -2.28 0.98 0.00 0.00 173.24 171.50 1y6p s HIS 17 N -3.36 2.97 0.18 5.02 2.46 -1.26 -4.88 115.29 116.41 1y6p s HIS 17 Ca 0.35 -2.97 -0.05 0.00 0.47 0.00 0.00 55.06 52.87 1y6p s HIS 17 Cb 0.08 -2.61 0.31 0.00 -0.13 0.00 0.00 32.58 30.22 1y6p s HIS 17 CO 0.15 -0.78 1.01 -2.30 -2.47 0.00 0.00 174.74 170.35 1y6p n PRO 18 N 3.38 -0.06 0.16 2.88 -0.02 -1.26 -0.52 135.00 139.56 1y6p n PRO 18 Ca 0.05 1.00 -0.11 0.00 -2.02 0.00 0.00 63.50 62.42 1y6p n PRO 18 Cb 0.34 -1.51 -0.07 0.00 -0.02 0.00 0.00 33.50 32.25 1y6p n PRO 18 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1y6p h LEU 19 N 0.00 -0.38 -1.19 2.45 5.85 -1.94 -0.04 115.31 120.06 1y6p h LEU 19 Ca 0.32 -0.16 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 1y6p h LEU 19 Cb 0.49 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 1y6p h LEU 19 CO -0.66 0.06 -0.05 -0.07 -0.34 0.00 0.00 178.44 177.38 1y6p h LEU 20 N -0.95 0.48 0.00 2.25 3.38 -1.76 -3.05 115.31 115.66 1y6p h LEU 20 Ca -0.05 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.68 1y6p h LEU 20 Cb 0.52 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1y6p h LEU 20 CO 0.08 0.58 -0.86 0.44 0.09 0.00 0.00 178.44 178.77 1y6p h ASP 21 N 0.48 0.00 -0.62 -0.43 3.32 -0.87 -3.41 116.42 114.89 1y6p h ASP 21 Ca 0.10 -0.53 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1y6p h ASP 21 Cb 0.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.94 1y6p h ASP 21 CO 0.02 1.26 0.00 0.49 -1.72 0.00 0.00 179.24 179.29 1y6p n PHE 22 N -4.51 1.48 -5.13 4.55 3.72 -0.03 -4.78 117.46 112.77 1y6p n PHE 22 Ca -0.23 -0.58 -0.32 0.00 -0.05 0.00 0.00 57.45 56.27 1y6p n PHE 22 Cb 0.56 -0.26 -0.15 0.00 -0.94 0.00 0.00 39.48 38.69 1y6p n PHE 22 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1y6p s ASN 23 N -0.86 3.46 -1.01 4.37 3.84 -1.15 -3.95 114.94 119.64 1y6p s ASN 23 Ca 0.49 -0.36 -0.01 0.00 0.21 0.00 0.00 52.86 53.19 1y6p s ASN 23 Cb 0.32 -0.60 -0.01 0.00 -0.55 0.00 0.00 41.25 40.41 1y6p s ASN 23 CO 0.23 0.32 0.85 0.59 -2.79 0.00 0.00 177.10 176.30 1y6p n ASN 24 N 2.44 -2.86 -4.04 -4.21 5.03 0.64 -4.83 115.26 107.44 1y6p n ASN 24 Ca -0.17 -0.55 -0.21 0.00 0.87 0.00 0.00 54.58 54.52 1y6p n ASN 24 Cb 0.52 -4.52 -0.15 0.00 -1.02 0.00 0.00 39.78 34.60 1y6p n ASN 24 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1y6p s TYR 25 N -3.32 1.09 0.00 3.10 6.14 -0.60 0.70 117.35 124.46 1y6p s TYR 25 Ca 0.08 -0.26 0.00 0.00 0.64 0.00 0.00 57.07 57.54 1y6p s TYR 25 Cb -0.01 -0.74 0.00 0.00 0.42 0.00 0.00 41.96 41.63 1y6p s TYR 25 CO 0.63 -0.08 0.00 0.41 0.64 0.00 0.00 175.55 177.15 1y6p n GLY 26 N 3.10 0.91 0.03 8.97 0.00 0.39 -1.84 105.19 116.75 1y6p n GLY 26 Ca -0.17 -0.69 0.11 0.00 0.00 0.00 0.00 46.02 45.28 1y6p n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y6p n TYR 28 N -2.03 0.00 -2.47 0.00 4.02 -1.25 -2.96 117.16 112.47 1y6p n TYR 28 Ca 0.01 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.50 1y6p n TYR 28 Cb 0.46 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.75 1y6p n TYR 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1y6p n GLY 30 N 5.70 -0.11 3.60 0.00 0.00 -1.25 -0.26 105.19 112.86 1y6p n GLY 30 Ca 0.11 -1.64 -0.43 0.00 0.00 0.00 0.00 46.02 44.07 1y6p n GLY 30 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y6p s LEU 31 N 0.00 3.46 0.00 0.99 1.43 -1.26 -4.74 118.68 118.55 1y6p s LEU 31 Ca 0.00 1.59 0.00 0.00 -1.03 0.00 0.00 54.13 54.69 1y6p s LEU 31 Cb 0.00 -3.45 0.00 0.00 0.03 0.00 0.00 46.19 42.77 1y6p s LEU 31 CO 0.00 -1.91 0.00 0.61 0.23 0.00 0.00 176.35 175.28 1y6p n GLY 32 N 5.64 -1.49 0.00 -3.19 0.00 -1.26 -5.05 105.19 99.84 1y6p n GLY 32 Ca 0.27 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1y6p n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y6p n GLY 33 N -2.07 0.08 3.61 -0.02 0.00 -1.26 -4.62 105.19 100.90 1y6p n GLY 33 Ca 0.00 -0.89 -0.09 0.00 0.00 0.00 0.00 46.02 45.04 1y6p n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y6p s SER 34 N 0.00 -0.07 0.06 1.61 1.04 -1.16 -4.87 113.70 110.32 1y6p s SER 34 Ca 0.00 -0.93 0.00 0.00 0.48 0.00 0.00 55.95 55.50 1y6p s SER 34 Cb 0.00 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.72 1y6p s SER 34 CO 0.00 -1.17 0.00 0.61 0.98 0.00 0.00 173.24 173.66 1y6p n GLY 35 N -0.39 -1.37 3.72 7.32 0.00 -0.55 -4.68 105.19 109.23 1y6p n GLY 35 Ca -0.02 -1.28 -0.35 0.00 0.00 0.00 0.00 46.02 44.37 1y6p n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y6p s THR 36 N 0.00 5.39 0.36 2.61 2.01 -1.26 -4.27 115.64 120.47 1y6p s THR 36 Ca 0.00 0.25 -0.26 0.00 0.31 0.00 0.00 61.69 61.99 1y6p s THR 36 Cb 0.00 -3.50 -0.12 0.00 0.01 0.00 0.00 72.50 68.89 1y6p s THR 36 CO 0.00 0.42 0.99 -2.65 -0.69 0.00 0.00 174.62 172.69 1y6p n PRO 37 N 3.59 1.34 0.12 4.92 -0.02 -1.26 -4.82 135.00 138.86 1y6p n PRO 37 Ca -0.15 0.47 0.03 0.00 -2.02 0.00 0.00 63.50 61.83 1y6p n PRO 37 Cb 0.52 -1.93 0.01 0.00 -0.02 0.00 0.00 33.50 32.08 1y6p n PRO 37 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1y6p h VAL 38 N 1.74 0.69 -2.53 -1.45 -1.51 -1.96 -3.48 116.25 107.75 1y6p h VAL 38 Ca -0.42 -2.04 0.10 0.00 -1.23 0.00 0.00 66.70 63.11 1y6p h VAL 38 Cb 1.34 2.27 -0.02 0.00 -2.13 0.00 0.00 31.29 32.75 1y6p h VAL 38 CO 0.58 0.39 0.45 -0.90 -1.23 0.00 0.00 177.57 176.87 1y6p n ASP 39 N -3.11 -1.63 -0.23 4.19 3.85 -1.26 -5.02 116.55 113.34 1y6p n ASP 39 Ca -0.01 -1.93 0.03 0.00 -0.71 0.00 0.00 54.79 52.17 1y6p n ASP 39 Cb 0.74 2.67 0.15 0.00 -1.35 0.00 0.00 41.12 43.33 1y6p n ASP 39 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 1y6p h GLU 40 N 0.00 0.28 -0.59 0.11 4.81 -1.94 0.29 114.58 117.54 1y6p h GLU 40 Ca -0.25 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 58.88 1y6p h GLU 40 Cb 1.05 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.35 1y6p h GLU 40 CO 0.33 0.19 0.05 1.25 -0.73 0.00 0.00 179.01 180.10 1y6p h LEU 41 N 0.29 0.94 -1.00 1.64 5.85 -1.92 -1.33 115.31 119.79 1y6p h LEU 41 Ca 0.37 -0.23 -0.07 0.00 0.84 0.00 0.00 57.88 58.79 1y6p h LEU 41 Cb 0.58 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 1y6p h LEU 41 CO -0.45 0.97 -0.02 -0.78 -0.34 0.00 0.00 178.44 177.83 1y6p h ASP 42 N 0.91 0.67 -0.20 1.25 3.58 -1.46 -1.86 116.42 119.32 1y6p h ASP 42 Ca 0.18 -0.16 -0.08 0.00 0.42 0.00 0.00 57.03 57.39 1y6p h ASP 42 Cb 0.46 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.31 1y6p h ASP 42 CO 0.02 0.76 -0.13 0.03 -2.88 0.00 0.00 179.24 177.04 1y6p h ARG 43 N 0.66 0.59 -0.57 0.28 3.08 0.25 -1.22 114.38 117.44 1y6p h ARG 43 Ca 0.13 -0.18 0.03 0.00 0.07 0.00 0.00 59.98 60.03 1y6p h ARG 43 Cb 0.43 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.39 1y6p h ARG 43 CO 0.02 0.70 0.34 0.00 -1.07 0.00 0.00 179.97 179.96 1y6p h GLU 46 N 0.47 0.13 -0.35 0.00 4.81 -0.62 -2.27 114.58 116.75 1y6p h GLU 46 Ca 0.07 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 1y6p h GLU 46 Cb 0.65 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.97 1y6p h GLU 46 CO 0.05 0.41 0.01 1.15 -0.73 0.00 0.00 179.01 179.90 1y6p h THR 47 N -0.16 0.75 -0.68 0.32 2.02 -0.72 -1.55 112.91 112.89 1y6p h THR 47 Ca 0.02 -0.04 0.12 0.00 0.77 0.00 0.00 66.41 67.29 1y6p h THR 47 Cb 0.35 0.63 -0.09 0.00 -1.74 0.00 0.00 68.15 67.31 1y6p h THR 47 CO 0.00 0.02 0.23 -0.74 0.37 0.00 0.00 175.52 175.40 1y6p h HIS 48 N 0.11 0.38 -0.70 3.16 -0.00 -0.89 0.10 115.15 117.31 1y6p h HIS 48 Ca 0.17 0.04 -0.04 0.00 -0.00 0.00 0.00 60.37 60.53 1y6p h HIS 48 Cb 0.23 -0.07 -0.03 0.00 -0.00 0.00 0.00 27.41 27.54 1y6p h HIS 48 CO -0.24 0.03 0.28 0.22 -0.00 0.00 0.00 177.93 178.22 1y6p h ASP 49 N 0.37 0.96 0.65 3.26 1.82 -0.73 -1.23 116.42 121.51 1y6p h ASP 49 Ca 0.36 -0.17 -0.03 0.00 -0.39 0.00 0.00 57.03 56.81 1y6p h ASP 49 Cb 0.53 -0.25 -0.00 0.00 0.68 0.00 0.00 39.33 40.29 1y6p h ASP 49 CO -0.39 0.87 -0.12 0.00 -1.61 0.00 0.00 179.24 177.99 1y6p h TYR 52 N 0.63 0.26 -0.13 0.00 -1.99 -0.59 -0.64 116.97 114.51 1y6p h TYR 52 Ca 0.03 -0.04 -0.02 0.00 2.00 0.00 0.00 58.73 60.69 1y6p h TYR 52 Cb 1.07 -0.07 -0.00 0.00 2.00 0.00 0.00 36.73 39.73 1y6p h TYR 52 CO 0.07 0.43 -0.01 -0.09 -0.00 0.00 0.00 178.16 178.57 1y6p h ARG 53 N 0.22 0.24 -0.90 4.88 2.43 -0.96 -2.63 114.38 117.66 1y6p h ARG 53 Ca 0.04 -0.08 0.06 0.00 -0.81 0.00 0.00 59.98 59.19 1y6p h ARG 53 Cb 0.48 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.95 1y6p h ARG 53 CO 0.03 0.50 0.57 -0.44 -1.51 0.00 0.00 179.97 179.12 1y6p h ASP 54 N -0.04 0.90 -0.56 -3.80 3.45 -0.79 -2.31 116.42 113.27 1y6p h ASP 54 Ca 0.04 0.02 0.07 0.00 0.43 0.00 0.00 57.03 57.58 1y6p h ASP 54 Cb 0.40 -0.17 -0.06 0.00 -0.56 0.00 0.00 39.33 38.94 1y6p h ASP 54 CO 0.01 0.57 0.25 0.00 -1.57 0.00 0.00 179.24 178.50 1y6p h ALA 55 N 1.42 0.72 0.00 3.45 0.00 -0.88 -0.60 119.26 123.37 1y6p h ALA 55 Ca 0.39 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1y6p h ALA 55 Cb 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1y6p h ALA 55 CO -0.17 -0.12 0.00 1.63 0.00 0.00 0.00 179.25 180.58 1y6p n LYS 56 N -4.92 0.00 0.00 0.00 5.02 -0.87 -1.27 118.16 116.11 1y6p n LYS 56 Ca 0.06 0.38 0.11 0.00 -2.02 0.00 0.00 58.31 56.85 1y6p n LYS 56 Cb 0.19 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.72 1y6p n LYS 56 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1y6p n ASN 57 N -1.51 2.15 -4.77 4.39 5.03 -0.25 -4.29 115.26 116.03 1y6p n ASN 57 Ca 0.02 -1.58 -0.38 0.00 0.87 0.00 0.00 54.58 53.51 1y6p n ASN 57 Cb 0.08 0.38 -0.03 0.00 -1.02 0.00 0.00 39.78 39.20 1y6p n ASN 57 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1y6p s LEU 58 N -2.30 4.23 0.12 3.41 1.43 -0.40 -4.87 118.68 120.30 1y6p s LEU 58 Ca 0.19 2.29 -0.27 0.00 -1.03 0.00 0.00 54.13 55.31 1y6p s LEU 58 Cb 0.18 -4.00 -0.05 0.00 0.03 0.00 0.00 46.19 42.35 1y6p s LEU 58 CO 0.49 -0.57 1.62 -0.78 0.23 0.00 0.00 176.35 177.34 1y6p h ASP 59 N 2.77 -0.92 -0.01 2.29 3.58 -1.92 0.23 116.42 122.43 1y6p h ASP 59 Ca -0.48 0.12 0.02 0.00 0.42 0.00 0.00 57.03 57.11 1y6p h ASP 59 Cb 1.23 0.37 -0.02 0.00 1.72 0.00 0.00 39.33 42.63 1y6p h ASP 59 CO 0.63 -0.37 -0.10 0.77 -2.88 0.00 0.00 179.24 177.29 1y6p h SER 60 N -0.45 -0.30 -0.78 2.28 4.64 -1.94 -2.05 113.55 114.94 1y6p h SER 60 Ca 0.06 0.05 0.01 0.00 -0.47 0.00 0.00 61.79 61.44 1y6p h SER 60 Cb 0.54 0.13 -0.04 0.00 -0.31 0.00 0.00 62.40 62.73 1y6p h SER 60 CO -0.26 -0.15 0.52 0.00 -0.87 0.00 0.00 176.83 176.06 1y6p h LYS 62 N 1.04 -0.56 -0.60 0.00 1.57 -0.17 0.22 116.57 118.08 1y6p h LYS 62 Ca 0.29 0.04 0.10 0.00 -1.87 0.00 0.00 60.65 59.21 1y6p h LYS 62 Cb -0.10 0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.30 1y6p h LYS 62 CO -0.07 -0.37 0.40 0.35 -0.57 0.00 0.00 179.45 179.19 1y6p h PHE 63 N -0.58 0.42 0.00 -1.35 3.04 -1.18 0.30 116.94 117.60 1y6p h PHE 63 Ca 0.03 0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.99 1y6p h PHE 63 Cb 0.61 -0.14 0.00 0.00 2.56 0.00 0.00 35.95 38.98 1y6p h PHE 63 CO -0.31 0.20 -0.25 -0.07 -2.02 0.00 0.00 178.31 175.86 1y6p h LEU 64 N 0.40 0.00 -0.70 0.59 3.38 -0.59 -3.46 115.31 114.93 1y6p h LEU 64 Ca 0.28 -0.02 -0.46 0.00 0.09 0.00 0.00 57.88 57.77 1y6p h LEU 64 Cb 0.55 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1y6p h LEU 64 CO -0.07 0.01 -0.72 0.52 0.09 0.00 0.00 178.44 178.26 1y6p n VAL 65 N -2.74 -1.97 -2.27 1.22 0.31 0.69 -4.87 118.33 108.69 1y6p n VAL 65 Ca 0.03 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 63.96 1y6p n VAL 65 Cb 0.50 -2.85 -0.03 0.00 -0.91 0.00 0.00 33.84 30.56 1y6p n VAL 65 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1y6p s ASP 66 N -3.21 6.89 -0.40 4.52 1.11 -1.10 -5.02 116.67 119.47 1y6p s ASP 66 Ca 0.62 2.49 -0.14 0.00 0.18 0.00 0.00 52.55 55.69 1y6p s ASP 66 Cb -0.31 -2.64 0.02 0.00 1.07 0.00 0.00 42.92 41.07 1y6p s ASP 66 CO 0.76 -0.43 0.28 0.21 1.18 0.00 0.00 175.17 177.18 1y6p s ASN 67 N -0.74 6.04 0.32 0.27 3.84 -1.26 -4.93 114.94 118.48 1y6p s ASN 67 Ca 0.49 -0.93 0.10 0.00 0.21 0.00 0.00 52.86 52.73 1y6p s ASN 67 Cb -0.35 -2.13 0.91 0.00 -0.55 0.00 0.00 41.25 39.13 1y6p s ASN 67 CO 0.46 -0.44 1.72 -0.65 -2.79 0.00 0.00 177.10 175.40 1y6p h PRO 68 N 8.59 0.52 0.00 0.43 0.11 -1.93 0.34 132.00 140.06 1y6p h PRO 68 Ca -0.27 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 1y6p h PRO 68 Cb 1.12 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 1y6p h PRO 68 CO 0.72 0.34 -0.13 1.88 -0.21 0.00 0.00 178.00 180.60 1y6p h TYR 69 N 0.54 0.00 -0.00 0.65 0.05 -1.94 -3.28 116.97 112.98 1y6p h TYR 69 Ca 0.66 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.44 1y6p h TYR 69 Cb 1.29 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.03 1y6p h TYR 69 CO -0.01 0.13 -0.08 0.25 -1.05 0.00 0.00 178.16 177.40 1y6p n THR 70 N -3.34 0.00 -2.24 -2.88 -2.24 -0.30 -0.87 114.28 102.41 1y6p n THR 70 Ca -0.00 -0.46 -0.42 0.00 -2.27 0.00 0.00 64.05 60.89 1y6p n THR 70 Cb 0.34 1.00 -0.03 0.00 -2.10 0.00 0.00 70.33 69.55 1y6p n THR 70 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1y6p s GLU 71 N -1.09 4.24 0.08 -0.78 2.56 0.10 -4.69 118.70 119.13 1y6p s GLU 71 Ca 0.01 1.91 -0.14 0.00 0.00 0.00 0.00 54.97 56.74 1y6p s GLU 71 Cb 0.01 -3.76 -0.06 0.00 2.00 0.00 0.00 34.13 32.32 1y6p s GLU 71 CO 0.07 -0.69 0.48 -1.12 -0.56 0.00 0.00 175.26 173.44 1y6p s SER 72 N 2.31 6.81 0.34 -1.70 0.01 -1.26 0.19 113.70 120.41 1y6p s SER 72 Ca 0.63 1.01 0.04 0.00 1.31 0.00 0.00 55.95 58.93 1y6p s SER 72 Cb -0.28 -2.26 -0.04 0.00 0.21 0.00 0.00 66.02 63.65 1y6p s SER 72 CO 0.23 0.20 0.13 -0.72 0.41 0.00 0.00 173.24 173.49 1y6p s TYR 73 N -1.30 1.72 -0.16 2.43 -0.85 -1.26 -4.86 117.35 113.07 1y6p s TYR 73 Ca 0.32 -1.28 -0.05 0.00 -0.52 0.00 0.00 57.07 55.54 1y6p s TYR 73 Cb -0.16 -1.03 -0.03 0.00 0.38 0.00 0.00 41.96 41.12 1y6p s TYR 73 CO 0.17 -0.37 0.00 -1.12 -1.52 0.00 0.00 175.55 172.72 1y6p s SER 74 N -3.47 5.15 0.15 -0.18 0.01 -1.26 -4.97 113.70 109.12 1y6p s SER 74 Ca 0.32 -0.03 -0.10 0.00 1.31 0.00 0.00 55.95 57.45 1y6p s SER 74 Cb 0.05 -1.82 -0.00 0.00 0.21 0.00 0.00 66.02 64.45 1y6p s SER 74 CO 0.16 0.19 0.30 -0.72 0.41 0.00 0.00 173.24 173.59 1y6p s TYR 75 N 0.24 0.26 -0.00 2.43 1.13 -1.26 -0.79 117.35 119.36 1y6p s TYR 75 Ca -0.00 -0.63 -0.06 0.00 -1.41 0.00 0.00 57.07 54.96 1y6p s TYR 75 Cb -0.13 0.01 0.00 0.00 -1.10 0.00 0.00 41.96 40.74 1y6p s TYR 75 CO 0.02 -0.71 0.12 -1.54 -2.51 0.00 0.00 175.55 170.92 1y6p s SER 76 N -2.93 0.03 -0.07 -0.18 1.04 -0.23 -4.90 113.70 106.45 1y6p s SER 76 Ca 0.13 -0.17 0.03 0.00 0.48 0.00 0.00 55.95 56.42 1y6p s SER 76 Cb 0.03 0.20 -0.02 0.00 0.10 0.00 0.00 66.02 66.33 1y6p s SER 76 CO -0.03 -0.32 -0.14 0.00 0.98 0.00 0.00 173.24 173.73 1y6p s SER 78 N -0.40 2.34 -1.14 0.00 0.15 0.15 -4.95 113.70 109.86 1y6p s SER 78 Ca 0.04 -0.80 -0.20 0.00 0.70 0.00 0.00 55.95 55.70 1y6p s SER 78 Cb -0.12 0.08 -0.01 0.00 -1.71 0.00 0.00 66.02 64.26 1y6p s SER 78 CO 0.02 -0.39 0.80 0.59 1.20 0.00 0.00 173.24 175.46 1y6p n ASN 79 N 5.29 -5.33 0.00 5.45 4.13 -1.26 -1.51 115.26 122.03 1y6p n ASN 79 Ca -0.05 -1.00 0.00 0.00 1.68 0.00 0.00 54.58 55.21 1y6p n ASN 79 Cb 0.46 -3.48 0.00 0.00 -1.54 0.00 0.00 39.78 35.22 1y6p n ASN 79 CO 0.00 0.00 0.00 0.41 0.28 0.00 0.00 177.26 177.95 1y6p n THR 80 N -4.14 0.00 -3.96 3.41 -1.04 -1.25 -4.98 114.28 102.31 1y6p n THR 80 Ca -0.09 0.00 -0.35 0.00 -2.04 0.00 0.00 64.05 61.57 1y6p n THR 80 Cb 0.59 -0.06 -0.10 0.00 -1.82 0.00 0.00 70.33 68.95 1y6p n THR 80 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1y6p s GLU 81 N -0.11 3.92 -0.03 -2.82 -6.30 -0.57 -4.12 118.70 108.67 1y6p s GLU 81 Ca 0.00 -0.37 -0.10 0.00 -2.50 0.00 0.00 54.97 52.00 1y6p s GLU 81 Cb 0.00 -3.24 -0.05 0.00 0.00 0.00 0.00 34.13 30.84 1y6p s GLU 81 CO 0.00 0.18 0.29 0.42 0.02 0.00 0.00 175.26 176.18 1y6p s ILE 82 N 0.62 5.24 -0.05 -3.70 1.01 -1.26 -0.67 121.20 122.38 1y6p s ILE 82 Ca 0.03 0.46 -0.01 0.00 0.00 0.00 0.00 60.65 61.13 1y6p s ILE 82 Cb -0.13 -3.58 0.03 0.00 0.01 0.00 0.00 42.46 38.79 1y6p s ILE 82 CO 0.01 0.52 0.01 -0.89 0.00 0.00 0.00 174.94 174.59 1y6p s THR 83 N -1.14 0.27 -0.35 2.92 2.01 -0.52 -5.01 115.64 113.82 1y6p s THR 83 Ca 0.23 0.15 -0.20 0.00 0.31 0.00 0.00 61.69 62.17 1y6p s THR 83 Cb -0.14 -0.42 -0.00 0.00 0.01 0.00 0.00 72.50 71.95 1y6p s THR 83 CO 0.12 0.22 0.61 0.00 -0.69 0.00 0.00 174.62 174.88 1y6p n ASN 85 N 5.97 1.94 0.00 0.00 4.05 0.03 -4.80 115.26 122.45 1y6p n ASN 85 Ca -0.02 1.10 0.05 0.00 0.45 0.00 0.00 54.58 56.17 1y6p n ASN 85 Cb 0.49 -1.16 0.29 0.00 1.23 0.00 0.00 39.78 40.63 1y6p n ASN 85 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 1y6p n SER 86 N 3.75 0.00 -0.44 1.20 3.41 -1.26 -1.86 113.62 118.42 1y6p n SER 86 Ca 0.22 0.01 0.13 0.00 -0.26 0.00 0.00 58.87 58.96 1y6p n SER 86 Cb 0.16 -0.21 0.34 0.00 -0.26 0.00 0.00 64.21 64.23 1y6p n SER 86 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1y6p n LYS 87 N -1.21 1.33 -1.87 4.33 5.02 -1.26 -4.90 118.16 119.60 1y6p n LYS 87 Ca 0.06 -0.89 -0.35 0.00 -2.02 0.00 0.00 58.31 55.12 1y6p n LYS 87 Cb 0.08 -1.48 0.04 0.00 -0.02 0.00 0.00 35.03 33.65 1y6p n LYS 87 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1y6p s ASN 88 N -2.28 5.05 0.73 4.39 0.02 -0.78 -4.99 114.94 117.08 1y6p s ASN 88 Ca 0.28 2.25 -0.11 0.00 -1.02 0.00 0.00 52.86 54.26 1y6p s ASN 88 Cb 0.20 -2.58 0.03 0.00 0.02 0.00 0.00 41.25 38.92 1y6p s ASN 88 CO 0.44 -1.68 1.08 0.54 0.02 0.00 0.00 177.10 177.50 1y6p s ASN 89 N -1.97 5.13 0.30 -1.22 2.20 -1.26 -4.63 114.94 113.50 1y6p s ASN 89 Ca 0.73 1.32 0.06 0.00 -0.94 0.00 0.00 52.86 54.03 1y6p s ASN 89 Cb -0.26 -2.13 0.82 0.00 -2.00 0.00 0.00 41.25 37.67 1y6p s ASN 89 CO 0.37 -1.56 1.65 0.00 -2.94 0.00 0.00 177.10 174.62 1y6p h ALA 90 N -0.81 1.47 -0.12 3.54 0.00 -1.97 0.36 119.26 121.74 1y6p h ALA 90 Ca -0.45 0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1y6p h ALA 90 Cb 1.24 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 19.30 1y6p h ALA 90 CO 0.60 -0.49 -0.05 0.00 0.00 0.00 0.00 179.25 179.32 1y6p h GLU 92 N -0.09 1.11 -0.16 0.00 5.08 -1.57 -1.83 114.58 117.11 1y6p h GLU 92 Ca 0.03 -0.09 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 1y6p h GLU 92 Cb 0.49 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1y6p h GLU 92 CO 0.02 0.77 -0.27 0.00 -1.00 0.00 0.00 179.01 178.52 1y6p h ALA 93 N 1.43 1.23 -0.12 3.43 0.00 -0.21 -0.48 119.26 124.54 1y6p h ALA 93 Ca 0.30 -0.33 -0.23 0.00 0.00 0.00 0.00 54.91 54.65 1y6p h ALA 93 Cb -0.06 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.64 1y6p h ALA 93 CO -0.06 0.51 -0.84 0.35 0.00 0.00 0.00 179.25 179.21 1y6p h PHE 94 N 0.27 1.07 -0.30 0.00 3.04 -0.64 -2.51 116.94 117.88 1y6p h PHE 94 Ca 0.04 -0.50 -0.03 0.00 3.98 0.00 0.00 57.97 61.46 1y6p h PHE 94 Cb 0.63 -0.15 -0.01 0.00 2.56 0.00 0.00 35.95 38.97 1y6p h PHE 94 CO 0.01 1.34 0.08 0.82 -2.02 0.00 0.00 178.31 178.54 1y6p h ILE 95 N 0.50 1.21 -0.63 1.41 2.04 -1.13 -1.47 117.51 119.44 1y6p h ILE 95 Ca -0.07 -0.69 0.02 0.00 1.00 0.00 0.00 64.86 65.11 1y6p h ILE 95 Cb 1.48 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 38.62 1y6p h ILE 95 CO 0.17 0.23 0.41 0.00 0.00 0.00 0.00 178.15 178.96 1y6p h ASN 97 N 0.82 0.59 0.20 0.00 -1.24 -1.22 0.17 115.58 114.89 1y6p h ASN 97 Ca 0.24 -0.06 -0.01 0.00 0.71 0.00 0.00 56.30 57.19 1y6p h ASN 97 Cb -0.05 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 38.85 1y6p h ASN 97 CO -0.07 0.52 -0.10 0.00 -1.29 0.00 0.00 177.43 176.49 1y6p h ASP 99 N -0.33 0.95 -0.47 0.00 5.19 -0.83 -0.68 116.42 120.25 1y6p h ASP 99 Ca -0.03 -0.02 -0.03 0.00 -0.62 0.00 0.00 57.03 56.34 1y6p h ASP 99 Cb 0.25 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 39.51 1y6p h ASP 99 CO 0.05 0.68 0.19 -0.09 -3.12 0.00 0.00 179.24 176.95 1y6p h ARG 100 N 1.12 0.69 -0.76 3.56 2.43 -0.38 0.44 114.38 121.48 1y6p h ARG 100 Ca 0.31 -0.12 -0.05 0.00 -0.81 0.00 0.00 59.98 59.31 1y6p h ARG 100 Cb -0.10 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.30 1y6p h ARG 100 CO -0.08 0.62 0.26 -0.91 -1.51 0.00 0.00 179.97 178.35 1y6p h ASN 101 N 0.61 1.08 0.47 -3.80 2.35 -0.37 -2.09 115.58 113.83 1y6p h ASN 101 Ca 0.16 -0.19 -0.02 0.00 -0.55 0.00 0.00 56.30 55.69 1y6p h ASN 101 Cb 0.18 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.27 1y6p h ASN 101 CO -0.01 0.99 -0.23 0.00 -1.65 0.00 0.00 177.43 176.53 1y6p h ALA 102 N 1.16 -0.63 -0.79 -0.83 0.00 -0.76 -1.39 119.26 116.01 1y6p h ALA 102 Ca 0.25 -0.17 0.14 0.00 0.00 0.00 0.00 54.91 55.13 1y6p h ALA 102 Cb 0.28 0.24 -0.09 0.00 0.00 0.00 0.00 17.79 18.22 1y6p h ALA 102 CO -0.01 -0.78 0.36 0.00 0.00 0.00 0.00 179.25 178.82 1y6p h ALA 103 N -0.32 1.16 -0.53 0.00 0.00 -0.82 0.87 119.26 119.61 1y6p h ALA 103 Ca -0.06 0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1y6p h ALA 103 Cb 0.55 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1y6p h ALA 103 CO 0.11 -0.15 -0.03 0.82 0.00 0.00 0.00 179.25 179.99 1y6p h ILE 104 N 0.53 1.26 -0.58 0.00 2.04 -1.29 -1.93 117.51 117.53 1y6p h ILE 104 Ca 0.43 -1.13 -0.06 0.00 1.00 0.00 0.00 64.86 65.11 1y6p h ILE 104 Cb 0.64 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 1y6p h ILE 104 CO -0.38 0.40 0.14 0.00 0.00 0.00 0.00 178.15 178.31 1y6p h PHE 106 N 0.83 -0.28 -0.19 0.00 -1.00 -0.62 -1.35 116.94 114.33 1y6p h PHE 106 Ca 0.18 0.00 0.06 0.00 2.81 0.00 0.00 57.97 61.02 1y6p h PHE 106 Cb 0.35 0.11 -0.01 0.00 3.61 0.00 0.00 35.95 40.01 1y6p h PHE 106 CO 0.02 -0.17 0.23 0.66 -1.61 0.00 0.00 178.31 177.45 1y6p h SER 107 N -0.23 0.00 0.39 2.17 4.64 -1.11 -1.95 113.55 117.46 1y6p h SER 107 Ca 0.02 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.02 1y6p h SER 107 Cb 0.23 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.28 1y6p h SER 107 CO -0.05 0.00 -1.82 0.29 -0.87 0.00 0.00 176.83 174.38 1y6p n LYS 108 N -3.73 0.66 -2.32 4.77 5.02 -0.88 -4.94 118.16 116.74 1y6p n LYS 108 Ca 0.02 0.27 -0.38 0.00 -2.02 0.00 0.00 58.31 56.20 1y6p n LYS 108 Cb 0.35 -1.76 -0.02 0.00 -0.02 0.00 0.00 35.03 33.59 1y6p n LYS 108 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1y6p s ALA 109 N -2.58 3.09 0.36 7.82 0.00 -0.56 -5.01 121.76 124.88 1y6p s ALA 109 Ca -0.09 0.92 -0.26 0.00 0.00 0.00 0.00 51.96 52.54 1y6p s ALA 109 Cb 0.08 -3.37 -0.09 0.00 0.00 0.00 0.00 23.12 19.74 1y6p s ALA 109 CO 0.81 -0.52 1.09 -2.14 0.00 0.00 0.00 175.76 175.01 1y6p s PRO 110 N -2.44 4.28 -0.27 0.00 0.02 -1.26 -4.94 135.00 130.39 1y6p s PRO 110 Ca 0.59 1.68 -0.12 0.00 0.02 0.00 0.00 61.00 63.17 1y6p s PRO 110 Cb -0.29 -2.77 -0.05 0.00 0.02 0.00 0.00 34.50 31.42 1y6p s PRO 110 CO 0.36 -0.08 0.23 -0.47 -0.33 0.00 0.00 177.00 176.71 1y6p s TYR 111 N -1.45 3.25 -0.53 6.54 6.14 -1.26 -4.58 117.35 125.46 1y6p s TYR 111 Ca 0.54 0.21 -0.05 0.00 0.64 0.00 0.00 57.07 58.41 1y6p s TYR 111 Cb -0.27 -2.40 0.14 0.00 0.42 0.00 0.00 41.96 39.84 1y6p s TYR 111 CO 0.34 -0.13 0.36 -0.80 0.64 0.00 0.00 175.55 175.96 1y6p s ASN 112 N 1.59 5.45 0.36 4.32 0.01 -1.26 -4.97 114.94 120.43 1y6p s ASN 112 Ca 0.09 -2.35 0.19 0.00 -0.71 0.00 0.00 52.86 50.08 1y6p s ASN 112 Cb -0.15 -1.90 1.06 0.00 0.41 0.00 0.00 41.25 40.66 1y6p s ASN 112 CO 0.10 -0.52 1.55 0.07 -1.51 0.00 0.00 177.10 176.79 1y6p h LYS 113 N 7.75 0.00 -0.00 -0.60 2.10 -2.01 -1.10 116.57 122.72 1y6p h LYS 113 Ca -0.09 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.56 1y6p h LYS 113 Cb 1.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.35 1y6p h LYS 113 CO 0.75 0.00 -0.10 -0.85 -2.00 0.00 0.00 179.45 177.25 1y6p n GLU 114 N -2.24 0.37 0.00 0.07 0.00 -1.26 -3.05 120.64 114.54 1y6p n GLU 114 Ca -0.01 -0.09 0.13 0.00 0.00 0.00 0.00 57.16 57.19 1y6p n GLU 114 Cb 0.18 -1.50 0.41 0.00 0.00 0.00 0.00 31.44 30.53 1y6p n GLU 114 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1y6p n HIS 115 N -1.24 0.00 -2.08 -1.84 8.25 -0.41 -4.91 115.22 112.99 1y6p n HIS 115 Ca 0.12 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.19 1y6p n HIS 115 Cb 0.29 -0.15 -0.00 0.00 1.12 0.00 0.00 29.99 31.25 1y6p n HIS 115 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1y6p s LYS 116 N -2.54 3.84 -1.26 -0.41 1.02 -1.17 -0.46 119.74 118.75 1y6p s LYS 116 Ca 0.24 2.07 -0.31 0.00 0.02 0.00 0.00 55.97 57.99 1y6p s LYS 116 Cb 0.19 -2.63 0.04 0.00 -0.52 0.00 0.00 37.83 34.92 1y6p s LYS 116 CO 0.53 -0.57 0.60 0.09 -0.92 0.00 0.00 175.35 175.07 1y6p n ASN 117 N -0.13 -3.50 -4.83 2.83 3.02 0.22 -4.87 115.26 108.00 1y6p n ASN 117 Ca 0.05 -1.31 -0.31 0.00 -0.03 0.00 0.00 54.58 52.98 1y6p n ASN 117 Cb 0.45 -1.62 0.04 0.00 -0.61 0.00 0.00 39.78 38.04 1y6p n ASN 117 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1y6p s LEU 118 N -7.49 3.15 -0.86 3.41 1.43 -1.25 -4.96 118.68 112.11 1y6p s LEU 118 Ca 0.44 1.59 -0.22 0.00 -1.03 0.00 0.00 54.13 54.91 1y6p s LEU 118 Cb -0.24 -4.49 0.09 0.00 0.03 0.00 0.00 46.19 41.57 1y6p s LEU 118 CO 0.98 -1.35 1.18 -0.62 0.23 0.00 0.00 176.35 176.77 1y6p s ASP 119 N -3.84 6.43 0.59 2.29 3.68 -1.26 -4.86 116.67 119.69 1y6p s ASP 119 Ca 0.58 -1.47 0.30 0.00 2.13 0.00 0.00 52.55 54.09 1y6p s ASP 119 Cb -0.14 -2.46 1.35 0.00 -1.45 0.00 0.00 42.92 40.22 1y6p s ASP 119 CO 0.55 -1.34 1.71 0.71 0.13 0.00 0.00 175.17 176.92 1y6p h THR 120 N 6.12 0.26 0.00 1.71 1.35 -1.92 0.47 112.91 120.89 1y6p h THR 120 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.87 1y6p h THR 120 Cb 1.04 0.40 0.00 0.00 -1.73 0.00 0.00 68.15 67.85 1y6p h THR 120 CO 1.22 0.00 -0.10 0.29 -0.25 0.00 0.00 175.52 176.68 1y6p n LYS 121 N -3.66 0.13 -0.72 4.72 5.02 -1.26 -1.83 118.16 120.57 1y6p n LYS 121 Ca 0.16 0.09 0.04 0.00 -2.02 0.00 0.00 58.31 56.58 1y6p n LYS 121 Cb 1.03 -1.63 0.07 0.00 -0.02 0.00 0.00 35.03 34.49 1y6p n LYS 121 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1y6p n LYS 122 N -1.85 0.56 0.00 1.97 0.00 0.16 -4.72 118.16 114.29 1y6p n LYS 122 Ca 0.06 -2.04 0.00 0.00 0.00 0.00 0.00 58.31 56.33 1y6p n LYS 122 Cb 0.38 -0.77 0.00 0.00 0.00 0.00 0.00 35.03 34.64 1y6p n LYS 122 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1y6p n TYR 123 N -0.36 0.00 -0.67 5.64 4.01 -0.80 -4.94 117.16 120.03 1y6p n TYR 123 Ca 0.09 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.83 1y6p n TYR 123 Cb 0.81 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.85 1y6p n TYR 123 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1y6p s LYS 125 N -0.61 4.17 0.00 0.00 -2.85 -1.12 -1.49 119.74 117.84 1y6p s LYS 125 Ca 0.02 2.21 0.00 0.00 -1.00 0.00 0.00 55.97 57.20 1y6p s LYS 125 Cb 0.02 -2.93 0.00 0.00 -2.06 0.00 0.00 37.83 32.86 1y6p s LYS 125 CO 0.00 -0.34 0.00 0.41 0.10 0.00 0.00 175.35 175.52 1y6p n GLY 126 N 0.71 0.28 3.94 0.59 0.00 -1.26 -4.37 105.19 105.09 1y6p n GLY 126 Ca 0.02 -2.30 -0.22 0.00 0.00 0.00 0.00 46.02 43.52 1y6p n GLY 126 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y6p s GLU 127 N -0.14 3.37 0.64 1.61 2.02 -1.26 -3.16 118.70 121.78 1y6p s GLU 127 Ca 0.00 -0.76 -0.17 0.00 0.02 0.00 0.00 54.97 54.06 1y6p s GLU 127 Cb 0.00 -2.86 -0.01 0.00 0.10 0.00 0.00 34.13 31.36 1y6p s GLU 127 CO 0.00 0.45 1.17 0.45 0.02 0.00 0.00 175.26 177.34 1y6p s SER 128 N -3.80 5.00 0.14 -0.19 0.15 -1.26 -3.82 113.70 109.92 1y6p s SER 128 Ca 0.34 2.24 -0.09 0.00 0.70 0.00 0.00 55.95 59.13 1y6p s SER 128 Cb -0.09 -2.58 -0.05 0.00 -1.71 0.00 0.00 66.02 61.59 1y6p s SER 128 CO 0.28 -1.71 1.41 -0.78 1.20 0.00 0.00 173.24 173.64 1y6p h ASP 129 N 0.40 0.88 -3.59 5.45 -0.00 -2.00 -3.44 116.42 114.13 1y6p h ASP 129 Ca -0.49 -0.50 -0.46 0.00 -0.00 0.00 0.00 57.03 55.59 1y6p h ASP 129 Cb 1.28 -0.25 -0.33 0.00 -0.00 0.00 0.00 39.33 40.03 1y6p h ASP 129 CO 0.54 1.28 -0.80 -1.59 -0.00 0.00 0.00 179.24 178.67 1y6p s LYS 130 N -4.01 1.23 0.00 0.28 -2.85 -1.26 -5.22 119.74 107.91 1y6p s LYS 130 Ca -0.10 -0.31 0.00 0.00 -1.00 0.00 0.00 55.97 54.57 1y6p s LYS 130 Cb 0.10 -1.09 0.00 0.00 -2.06 0.00 0.00 37.83 34.78 1y6p s LYS 130 CO 0.88 0.04 0.00 0.00 0.10 0.00 0.00 175.35 176.37