#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p8c h ARG 11 N 0.00 0.17 0.06 5.56 -0.00 -2.06 1.37 114.38 119.48 1p8c h ARG 11 Ca 0.00 -0.01 -0.28 0.00 -0.00 0.00 0.00 59.98 59.69 1p8c h ARG 11 Cb 0.00 -0.04 0.02 0.00 -0.00 0.00 0.00 29.97 29.96 1p8c h ARG 11 CO 0.00 0.11 -1.14 1.49 -0.00 0.00 0.00 179.97 180.43 1p8c h GLU 12 N 0.17 0.62 -0.46 0.08 4.22 -2.06 -3.22 114.58 113.93 1p8c h GLU 12 Ca 0.71 -0.75 0.09 0.00 0.08 0.00 0.00 59.36 59.49 1p8c h GLU 12 Cb 2.25 0.23 -0.03 0.00 0.50 0.00 0.00 28.75 31.71 1p8c h GLU 12 CO -0.28 1.33 0.32 -0.07 -2.18 0.00 0.00 179.01 178.12 1p8c h LEU 13 N 0.31 0.23 -1.64 1.64 3.38 0.13 0.31 115.31 119.68 1p8c h LEU 13 Ca -0.15 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 1p8c h LEU 13 Cb 1.80 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.50 1p8c h LEU 13 CO 0.22 0.14 -0.15 0.78 0.09 0.00 0.00 178.44 179.52 1p8c h ASN 14 N 0.26 0.00 0.23 -0.43 2.35 -1.25 -0.24 115.58 116.50 1p8c h ASN 14 Ca 0.21 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.95 1p8c h ASN 14 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1p8c h ASN 14 CO -0.04 0.15 -0.11 -0.33 -1.65 0.00 0.00 177.43 175.45 1p8c h GLU 15 N 0.00 -0.30 -0.67 0.81 5.08 -0.50 -0.33 114.58 118.68 1p8c h GLU 15 Ca -0.00 0.02 0.19 0.00 -1.00 0.00 0.00 59.36 58.57 1p8c h GLU 15 Cb 0.48 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.77 1p8c h GLU 15 CO 0.02 0.03 0.54 0.87 -1.00 0.00 0.00 179.01 179.47 1p8c h LYS 16 N -0.96 0.00 0.00 2.33 1.57 -0.99 1.00 116.57 119.52 1p8c h LYS 16 Ca -0.03 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1p8c h LYS 16 Cb 0.47 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.78 1p8c h LYS 16 CO 0.05 0.00 -0.05 0.28 -0.57 0.00 0.00 179.45 179.17 1p8c h VAL 17 N 0.00 1.41 -0.60 0.50 2.07 -0.94 -2.05 116.25 116.65 1p8c h VAL 17 Ca 0.32 -2.08 -0.04 0.00 0.82 0.00 0.00 66.70 65.72 1p8c h VAL 17 Cb 1.40 2.69 -0.03 0.00 -1.52 0.00 0.00 31.29 33.83 1p8c h VAL 17 CO -0.00 0.48 0.21 -0.07 0.02 0.00 0.00 177.57 178.21 1p8c h LEU 18 N -1.00 0.81 0.73 2.57 3.38 -0.34 0.72 115.31 122.18 1p8c h LEU 18 Ca -0.01 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1p8c h LEU 18 Cb 0.82 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 1p8c h LEU 18 CO -0.01 0.74 -0.44 -1.28 0.09 0.00 0.00 178.44 177.55 1p8c h SER 19 N 0.86 -1.09 0.45 -0.43 0.87 0.92 -1.99 113.55 113.14 1p8c h SER 19 Ca 0.20 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.82 1p8c h SER 19 Cb 0.21 0.31 0.00 0.00 -0.44 0.00 0.00 62.40 62.48 1p8c h SER 19 CO -0.01 -0.68 0.00 0.54 -0.53 0.00 0.00 176.83 176.15 1p8c n ARG 20 N -5.19 0.31 0.00 2.24 5.12 -0.77 -4.84 116.66 113.52 1p8c n ARG 20 Ca -0.13 0.07 0.00 0.00 -1.93 0.00 0.00 57.85 55.86 1p8c n ARG 20 Cb 0.45 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.25 1p8c n ARG 20 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1p8c n GLY 21 N 0.67 -2.65 3.42 -0.13 0.00 0.25 -5.05 105.19 101.69 1p8c n GLY 21 Ca 0.11 -1.22 -0.22 0.00 0.00 0.00 0.00 46.02 44.68 1p8c n GLY 21 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p8c s THR 22 N 0.00 0.47 0.20 2.61 2.01 -1.26 -4.99 115.64 114.68 1p8c s THR 22 Ca 0.00 -2.00 -0.08 0.00 0.31 0.00 0.00 61.69 59.92 1p8c s THR 22 Cb 0.00 -2.46 0.10 0.00 0.01 0.00 0.00 72.50 70.15 1p8c s THR 22 CO 0.00 0.00 1.70 -0.07 -0.69 0.00 0.00 174.62 175.56 1p8c h LEU 23 N 2.01 1.05 -0.35 4.42 -0.00 -1.99 -2.57 115.31 117.88 1p8c h LEU 23 Ca -0.34 -0.25 -0.19 0.00 -0.00 0.00 0.00 57.88 57.11 1p8c h LEU 23 Cb 1.26 -0.28 -0.00 0.00 -0.00 0.00 0.00 40.66 41.64 1p8c h LEU 23 CO 0.53 1.04 -0.62 0.78 -0.00 0.00 0.00 178.44 180.17 1p8c h ASN 24 N 1.02 0.80 -0.78 -0.43 2.35 -1.98 -0.83 115.58 115.74 1p8c h ASN 24 Ca 0.20 -0.46 0.07 0.00 -0.55 0.00 0.00 56.30 55.56 1p8c h ASN 24 Cb 0.44 -0.23 -0.05 0.00 0.05 0.00 0.00 38.32 38.53 1p8c h ASN 24 CO 0.01 1.23 0.51 0.74 -1.65 0.00 0.00 177.43 178.27 1p8c h THR 25 N 0.52 1.02 -0.00 2.81 2.02 -1.89 0.20 112.91 117.59 1p8c h THR 25 Ca -0.01 -0.28 -0.17 0.00 0.77 0.00 0.00 66.41 66.72 1p8c h THR 25 Cb 1.21 0.13 0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1p8c h THR 25 CO 0.13 0.15 -0.68 0.11 0.37 0.00 0.00 175.52 175.60 1p8c h LYS 26 N 0.82 0.46 -0.51 6.66 1.57 -1.28 -2.16 116.57 122.12 1p8c h LYS 26 Ca 0.34 -0.49 -0.02 0.00 -1.87 0.00 0.00 60.65 58.61 1p8c h LYS 26 Cb 0.27 0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 1p8c h LYS 26 CO -0.12 1.14 0.25 0.00 -0.57 0.00 0.00 179.45 180.15 1p8c h ARG 27 N -0.02 0.72 -0.23 3.15 3.08 -0.42 -1.15 114.38 119.50 1p8c h ARG 27 Ca -0.08 -0.08 -0.11 0.00 0.07 0.00 0.00 59.98 59.78 1p8c h ARG 27 Cb 1.38 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 31.29 1p8c h ARG 27 CO 0.13 0.55 -0.27 0.35 -1.07 0.00 0.00 179.97 179.67 1p8c h PHE 28 N 0.72 0.72 0.00 3.04 3.57 -0.63 -2.87 116.94 121.50 1p8c h PHE 28 Ca 0.18 -0.23 -0.01 0.00 3.53 0.00 0.00 57.97 61.45 1p8c h PHE 28 Cb 0.07 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 38.66 1p8c h PHE 28 CO 0.01 0.94 -0.03 0.74 -2.23 0.00 0.00 178.31 177.74 1p8c h PHE 29 N 0.30 0.00 0.32 0.41 -1.00 -0.73 -2.33 116.94 113.91 1p8c h PHE 29 Ca 0.03 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.80 1p8c h PHE 29 Cb 0.84 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.40 1p8c h PHE 29 CO 0.08 0.03 -0.15 -0.91 -1.61 0.00 0.00 178.31 175.74 1p8c h ASN 30 N 0.00 -0.36 -0.61 2.17 -0.26 -1.07 -3.17 115.58 112.27 1p8c h ASN 30 Ca -0.00 -0.16 0.13 0.00 -0.56 0.00 0.00 56.30 55.71 1p8c h ASN 30 Cb 0.08 0.09 -0.11 0.00 -1.06 0.00 0.00 38.32 37.33 1p8c h ASN 30 CO 0.00 0.10 -0.04 -0.07 -1.06 0.00 0.00 177.43 176.37 1p8c h LEU 31 N -0.98 -0.35 -1.98 1.61 -0.00 -1.27 0.31 115.31 112.65 1p8c h LEU 31 Ca -0.04 0.16 0.00 0.00 -0.00 0.00 0.00 57.88 58.00 1p8c h LEU 31 Cb 0.50 0.30 0.00 0.00 -0.00 0.00 0.00 40.66 41.45 1p8c h LEU 31 CO 0.07 -0.14 0.19 -0.78 -0.00 0.00 0.00 178.44 177.78 1p8c h ASP 32 N 0.08 0.00 0.00 -0.43 3.58 -1.49 0.50 116.42 118.67 1p8c h ASP 32 Ca 0.32 0.00 -0.35 0.00 0.42 0.00 0.00 57.03 57.42 1p8c h ASP 32 Cb 0.51 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.50 1p8c h ASP 32 CO -0.55 0.00 -2.30 -0.24 -2.88 0.00 0.00 179.24 173.26 1p8c n SER 33 N -2.70 2.18 0.14 2.28 2.88 0.75 -4.60 113.62 114.55 1p8c n SER 33 Ca -0.02 -0.08 -0.07 0.00 -1.33 0.00 0.00 58.87 57.37 1p8c n SER 33 Cb 0.23 -0.40 -0.03 0.00 -0.75 0.00 0.00 64.21 63.26 1p8c n SER 33 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1p8c h ALA 34 N -0.09 -1.01 -0.07 -1.46 0.00 0.23 -2.91 119.26 113.95 1p8c h ALA 34 Ca -0.52 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.33 1p8c h ALA 34 Cb 1.76 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 19.85 1p8c h ALA 34 CO -0.11 -1.00 0.64 1.55 0.00 0.00 0.00 179.25 180.33 1p8c n VAL 35 N -3.31 0.00 -0.54 0.00 3.14 0.09 0.01 118.33 117.71 1p8c n VAL 35 Ca -0.05 0.64 0.09 0.00 -2.96 0.00 0.00 64.34 62.06 1p8c n VAL 35 Cb 0.17 -1.27 0.29 0.00 -1.06 0.00 0.00 33.84 31.97 1p8c n VAL 35 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 1p8c n TYR 36 N -1.83 1.08 -3.31 1.45 4.01 -1.10 -4.98 117.16 112.48 1p8c n TYR 36 Ca 0.02 -0.61 -0.30 0.00 -0.16 0.00 0.00 57.90 56.85 1p8c n TYR 36 Cb 0.66 -0.17 -0.04 0.00 -0.31 0.00 0.00 39.34 39.48 1p8c n TYR 36 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1p8c s ARG 37 N -1.69 3.70 0.42 -0.72 0.52 0.10 -4.79 118.95 116.50 1p8c s ARG 37 Ca 0.42 0.15 -0.24 0.00 -0.52 0.00 0.00 55.73 55.54 1p8c s ARG 37 Cb 0.27 -2.62 -0.11 0.00 0.52 0.00 0.00 34.95 33.02 1p8c s ARG 37 CO 0.21 0.22 0.97 -2.30 0.02 0.00 0.00 175.30 174.42 1p8c n PRO 38 N -0.72 1.27 0.00 3.54 -0.02 -1.26 -4.83 135.00 132.98 1p8c n PRO 38 Ca -0.01 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1p8c n PRO 38 Cb 0.53 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 1p8c n PRO 38 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1p8c n GLY 39 N 1.24 3.70 0.30 -1.23 0.00 -1.26 -4.95 105.19 102.99 1p8c n GLY 39 Ca 0.10 -0.18 0.03 0.00 0.00 0.00 0.00 46.02 45.96 1p8c n GLY 39 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1p8c h LYS 40 N 0.00 0.55 -6.16 1.61 1.63 -2.04 -3.40 116.57 108.76 1p8c h LYS 40 Ca 0.00 -0.06 -0.55 0.00 -0.85 0.00 0.00 60.65 59.19 1p8c h LYS 40 Cb 0.00 -0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 31.49 1p8c h LYS 40 CO 0.00 0.43 -0.36 -0.51 -3.45 0.00 0.00 179.45 175.55 1p8c s LEU 41 N -9.37 4.26 0.67 5.20 1.43 -1.26 -5.11 118.68 114.50 1p8c s LEU 41 Ca -0.08 0.39 -0.02 0.00 -1.03 0.00 0.00 54.13 53.39 1p8c s LEU 41 Cb 0.17 -3.14 0.08 0.00 0.03 0.00 0.00 46.19 43.33 1p8c s LEU 41 CO 0.74 0.01 0.94 1.51 0.23 0.00 0.00 176.35 179.78 1p8c s ASP 42 N -2.97 4.73 0.11 2.29 -4.77 -1.26 -4.59 116.67 110.20 1p8c s ASP 42 Ca 0.38 0.01 -0.17 0.00 -3.30 0.00 0.00 52.55 49.47 1p8c s ASP 42 Cb -0.11 -0.62 -0.05 0.00 -1.09 0.00 0.00 42.92 41.05 1p8c s ASP 42 CO 0.28 -1.59 1.57 -0.37 0.70 0.00 0.00 175.17 175.76 1p8c h VAL 43 N -0.40 1.24 -0.65 2.11 -1.51 -1.88 -2.04 116.25 113.13 1p8c h VAL 43 Ca -0.41 -0.87 0.11 0.00 -1.23 0.00 0.00 66.70 64.30 1p8c h VAL 43 Cb 1.29 1.17 -0.08 0.00 -2.13 0.00 0.00 31.29 31.54 1p8c h VAL 43 CO 0.50 0.29 0.23 0.50 -1.23 0.00 0.00 177.57 177.85 1p8c h LYS 44 N 0.38 0.39 -0.07 5.19 3.64 -1.94 0.35 116.57 124.50 1p8c h LYS 44 Ca 0.10 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1p8c h LYS 44 Cb 0.38 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1p8c h LYS 44 CO 0.01 0.26 0.00 1.15 -2.27 0.00 0.00 179.45 178.60 1p8c h THR 45 N 0.40 1.25 -0.96 1.00 2.02 -1.94 -2.16 112.91 112.52 1p8c h THR 45 Ca 0.34 -0.77 0.06 0.00 0.77 0.00 0.00 66.41 66.81 1p8c h THR 45 Cb 0.46 1.62 -0.06 0.00 -1.74 0.00 0.00 68.15 68.42 1p8c h THR 45 CO -0.35 0.21 0.61 0.11 0.37 0.00 0.00 175.52 176.48 1p8c h LYS 46 N -0.15 1.10 -0.06 6.66 1.57 -0.88 -0.42 116.57 124.39 1p8c h LYS 46 Ca 0.02 -0.07 -0.15 0.00 -1.87 0.00 0.00 60.65 58.58 1p8c h LYS 46 Cb 0.33 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 1p8c h LYS 46 CO 0.00 0.73 -0.65 0.93 -0.57 0.00 0.00 179.45 179.89 1p8c h GLU 47 N 1.13 0.24 0.00 3.15 4.39 -0.89 -1.66 114.58 120.94 1p8c h GLU 47 Ca 0.41 -0.18 -0.09 0.00 0.34 0.00 0.00 59.36 59.84 1p8c h GLU 47 Cb 0.13 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.80 1p8c h GLU 47 CO -0.16 0.80 -0.42 -0.07 -1.16 0.00 0.00 179.01 178.00 1p8c h LEU 48 N 0.17 0.00 -0.37 1.33 3.38 -0.66 -0.65 115.31 118.50 1p8c h LEU 48 Ca -0.01 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.77 1p8c h LEU 48 Cb 1.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 1p8c h LEU 48 CO 0.10 0.42 -0.68 0.24 0.09 0.00 0.00 178.44 178.61 1p8c h MET 49 N 0.00 0.57 -0.28 1.13 2.86 -0.77 -1.00 114.93 117.43 1p8c h MET 49 Ca -0.00 -0.43 -0.09 0.00 -2.06 0.00 0.00 59.70 57.12 1p8c h MET 49 Cb 0.85 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.57 1p8c h MET 49 CO 0.05 1.05 -0.19 0.78 1.06 0.00 0.00 176.91 179.66 1p8c h GLY 50 N 1.01 0.55 0.93 8.32 0.00 -0.77 -0.30 103.07 112.81 1p8c h GLY 50 Ca -0.02 -0.42 -0.03 0.00 0.00 0.00 0.00 47.33 46.85 1p8c h GLY 50 CO 0.13 0.39 0.12 -2.00 0.00 0.00 0.00 176.54 175.17 1p8c h LEU 51 N 0.46 0.54 0.35 3.11 5.85 -0.78 -1.32 115.31 123.52 1p8c h LEU 51 Ca 0.08 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 1p8c h LEU 51 Cb 0.60 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1p8c h LEU 51 CO 0.04 0.60 -0.26 0.58 -0.34 0.00 0.00 178.44 179.06 1p8c h VAL 52 N 0.45 0.00 -0.73 1.05 2.07 -0.52 -0.40 116.25 118.16 1p8c h VAL 52 Ca 0.12 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.80 1p8c h VAL 52 Cb 0.25 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 29.91 1p8c h VAL 52 CO -0.00 0.00 0.08 0.00 0.02 0.00 0.00 177.57 177.67 1p8c h ALA 53 N -1.44 0.85 0.00 1.67 0.00 -1.08 0.20 119.26 119.46 1p8c h ALA 53 Ca -0.05 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1p8c h ALA 53 Cb 0.48 0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1p8c h ALA 53 CO 0.02 -0.39 -0.08 0.77 0.00 0.00 0.00 179.25 179.56 1p8c h SER 54 N 0.17 0.00 0.15 0.00 0.02 -1.11 -1.01 113.55 111.77 1p8c h SER 54 Ca 0.41 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 61.05 1p8c h SER 54 Cb 0.71 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.25 1p8c h SER 54 CO -0.58 0.08 -1.57 0.74 -1.14 0.00 0.00 176.83 174.36 1p8c h THR 55 N 0.00 0.99 0.00 -2.27 2.02 0.11 -1.80 112.91 111.96 1p8c h THR 55 Ca -0.00 -2.45 -0.08 0.00 0.77 0.00 0.00 66.41 64.65 1p8c h THR 55 Cb 0.48 2.74 -0.01 0.00 -1.74 0.00 0.00 68.15 69.63 1p8c h THR 55 CO 0.01 0.78 -0.39 -0.37 0.37 0.00 0.00 175.52 175.92 1p8c h VAL 56 N -0.11 1.03 -0.00 3.16 -1.51 -0.95 -1.80 116.25 116.07 1p8c h VAL 56 Ca -0.32 -1.46 0.00 0.00 -1.23 0.00 0.00 66.70 63.69 1p8c h VAL 56 Cb 1.92 1.84 0.00 0.00 -2.13 0.00 0.00 31.29 32.92 1p8c h VAL 56 CO 0.12 0.38 -0.33 0.18 -1.23 0.00 0.00 177.57 176.69 1p8c n LEU 57 N -3.72 0.63 -3.34 4.19 4.77 -0.40 -4.89 117.00 114.24 1p8c n LEU 57 Ca -0.01 -0.05 -0.16 0.00 -0.03 0.00 0.00 56.01 55.76 1p8c n LEU 57 Cb 0.47 -0.22 0.08 0.00 -2.33 0.00 0.00 43.42 41.43 1p8c n LEU 57 CO 0.37 0.13 0.07 0.54 -1.33 0.00 0.00 177.39 177.18 1p8c n ARG 58 N -1.14 -4.55 -3.89 3.23 1.74 -0.68 -5.01 116.66 106.36 1p8c n ARG 58 Ca 0.09 0.86 -0.35 0.00 -0.77 0.00 0.00 57.85 57.68 1p8c n ARG 58 Cb 0.33 -5.85 -0.13 0.00 -1.02 0.00 0.00 32.46 25.79 1p8c n ARG 58 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1p8c h ASP 60 N 8.02 1.00 -0.55 0.00 3.32 -1.95 -0.08 116.42 126.17 1p8c h ASP 60 Ca -0.21 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 56.64 1p8c h ASP 60 Cb 1.06 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.33 1p8c h ASP 60 CO 0.54 0.92 0.31 0.44 -1.72 0.00 0.00 179.24 179.74 1p8c h ASP 61 N 1.01 0.67 -0.57 6.45 3.32 -1.97 0.15 116.42 125.49 1p8c h ASP 61 Ca 0.23 -0.08 -0.10 0.00 0.02 0.00 0.00 57.03 57.10 1p8c h ASP 61 Cb 0.26 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1p8c h ASP 61 CO -0.01 0.55 -0.02 0.00 -1.72 0.00 0.00 179.24 178.05 1p8c h ILE 63 N 0.94 0.79 -0.19 0.00 2.04 -0.41 -1.83 117.51 118.85 1p8c h ILE 63 Ca 0.17 -0.32 0.05 0.00 1.00 0.00 0.00 64.86 65.75 1p8c h ILE 63 Cb 0.56 0.98 -0.06 0.00 -0.74 0.00 0.00 36.82 37.57 1p8c h ILE 63 CO 0.03 0.07 -0.18 0.03 0.00 0.00 0.00 178.15 178.11 1p8c h ARG 64 N -0.51 -0.19 -0.58 2.37 3.08 -0.72 0.33 114.38 118.17 1p8c h ARG 64 Ca -0.03 0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.10 1p8c h ARG 64 Cb 0.38 0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.41 1p8c h ARG 64 CO 0.06 -0.13 0.26 -0.92 -1.07 0.00 0.00 179.97 178.17 1p8c h TYR 65 N -0.20 0.47 0.00 3.04 3.20 -1.38 -0.95 116.97 121.15 1p8c h TYR 65 Ca 0.12 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.94 1p8c h TYR 65 Cb 0.37 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 1p8c h TYR 65 CO -0.32 0.18 -0.37 0.45 -1.64 0.00 0.00 178.16 176.47 1p8c h HIS 66 N 0.49 0.00 -0.14 -3.82 3.86 -0.52 -2.38 115.15 112.64 1p8c h HIS 66 Ca 0.28 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.46 1p8c h HIS 66 Cb 0.26 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.73 1p8c h HIS 66 CO -0.13 0.37 -0.01 -0.07 0.86 0.00 0.00 177.93 178.95 1p8c h LEU 67 N 0.00 0.25 -0.06 2.43 3.38 0.90 -1.15 115.31 121.06 1p8c h LEU 67 Ca -0.00 -0.33 0.03 0.00 0.09 0.00 0.00 57.88 57.66 1p8c h LEU 67 Cb 0.78 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 1p8c h LEU 67 CO 0.05 0.52 -0.10 -0.37 0.09 0.00 0.00 178.44 178.63 1p8c h VAL 68 N -0.03 0.73 -0.77 1.22 -1.51 -1.14 0.28 116.25 115.03 1p8c h VAL 68 Ca 0.04 0.00 0.09 0.00 -1.23 0.00 0.00 66.70 65.60 1p8c h VAL 68 Cb 0.40 0.73 -0.07 0.00 -2.13 0.00 0.00 31.29 30.22 1p8c h VAL 68 CO 0.01 0.00 0.42 0.03 -1.23 0.00 0.00 177.57 176.80 1p8c h ARG 69 N -0.14 0.69 0.35 5.19 3.08 -1.36 0.58 114.38 122.77 1p8c h ARG 69 Ca 0.06 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 1p8c h ARG 69 Cb 0.23 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1p8c h ARG 69 CO -0.15 0.46 -0.17 0.00 -1.07 0.00 0.00 179.97 179.04 1p8c h VAL 71 N -0.63 0.65 0.00 0.00 2.07 0.07 0.21 116.25 118.62 1p8c h VAL 71 Ca -0.05 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1p8c h VAL 71 Cb 0.46 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1p8c h VAL 71 CO 0.08 0.02 0.00 0.00 0.02 0.00 0.00 177.57 177.69 1p8c n GLN 72 N -5.22 0.45 -0.18 1.57 10.64 0.20 -2.86 117.38 121.97 1p8c n GLN 72 Ca 0.04 0.05 0.06 0.00 -1.83 0.00 0.00 57.00 55.32 1p8c n GLN 72 Cb 0.23 -1.50 0.16 0.00 -0.86 0.00 0.00 30.24 28.28 1p8c n GLN 72 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32 1p8c n GLU 73 N -1.17 2.67 0.00 2.61 4.07 0.87 -4.99 120.64 124.70 1p8c n GLU 73 Ca 0.12 -2.05 0.00 0.00 -0.06 0.00 0.00 57.16 55.17 1p8c n GLU 73 Cb 0.13 -1.30 0.00 0.00 -0.06 0.00 0.00 31.44 30.21 1p8c n GLU 73 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1p8c n GLY 74 N 0.67 3.18 2.15 8.31 0.00 -1.06 -4.67 105.19 113.78 1p8c n GLY 74 Ca 0.13 -0.91 -0.33 0.00 0.00 0.00 0.00 46.02 44.90 1p8c n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p8c n ALA 75 N 0.00 -2.32 -2.93 4.61 0.00 -1.14 -4.95 120.51 113.77 1p8c n ALA 75 Ca 0.00 0.32 -0.22 0.00 0.00 0.00 0.00 53.44 53.55 1p8c n ALA 75 Cb 0.00 -1.05 -0.03 0.00 0.00 0.00 0.00 19.45 18.37 1p8c n ALA 75 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1p8c s SER 76 N -0.31 6.13 0.38 0.00 1.04 -1.26 -4.49 113.70 115.19 1p8c s SER 76 Ca 0.48 0.01 0.17 0.00 0.48 0.00 0.00 55.95 57.10 1p8c s SER 76 Cb -0.69 -1.76 1.08 0.00 0.10 0.00 0.00 66.02 64.76 1p8c s SER 76 CO 0.35 -0.05 1.75 0.44 0.98 0.00 0.00 173.24 176.72 1p8c h ASP 77 N 1.39 0.48 0.16 7.02 5.19 -1.97 0.17 116.42 128.85 1p8c h ASP 77 Ca -0.51 0.10 0.01 0.00 -0.62 0.00 0.00 57.03 56.01 1p8c h ASP 77 Cb 1.23 0.02 -0.02 0.00 0.18 0.00 0.00 39.33 40.74 1p8c h ASP 77 CO 0.62 0.07 -0.18 -0.33 -3.12 0.00 0.00 179.24 176.30 1p8c h GLU 78 N 0.41 -0.37 -0.33 3.56 3.07 -1.99 0.44 114.58 119.37 1p8c h GLU 78 Ca 0.62 0.03 -0.08 0.00 -0.50 0.00 0.00 59.36 59.43 1p8c h GLU 78 Cb 1.52 0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 29.50 1p8c h GLU 78 CO -0.34 -0.25 -0.12 0.93 -1.40 0.00 0.00 179.01 177.84 1p8c h GLU 79 N -0.38 0.57 -0.45 2.33 5.08 -1.25 -2.07 114.58 118.41 1p8c h GLU 79 Ca 0.01 -0.17 -0.12 0.00 -1.00 0.00 0.00 59.36 58.08 1p8c h GLU 79 Cb 0.37 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1p8c h GLU 79 CO -0.06 0.68 -0.19 0.82 -1.00 0.00 0.00 179.01 179.26 1p8c h ILE 80 N 0.53 1.27 -0.08 3.13 2.04 -0.22 -1.95 117.51 122.22 1p8c h ILE 80 Ca 0.10 -1.32 -0.17 0.00 1.00 0.00 0.00 64.86 64.47 1p8c h ILE 80 Cb 0.51 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 1p8c h ILE 80 CO 0.03 0.45 -0.67 -0.26 0.00 0.00 0.00 178.15 177.70 1p8c h PHE 81 N 0.77 0.43 0.00 1.37 -1.00 0.10 -0.46 116.94 118.16 1p8c h PHE 81 Ca 0.11 -0.18 -0.03 0.00 2.81 0.00 0.00 57.97 60.68 1p8c h PHE 81 Cb 0.72 -0.07 -0.00 0.00 3.61 0.00 0.00 35.95 40.21 1p8c h PHE 81 CO 0.04 0.90 -0.14 0.93 -1.61 0.00 0.00 178.31 178.42 1p8c h GLU 82 N 0.23 0.00 0.04 1.51 5.08 -1.18 0.56 114.58 120.82 1p8c h GLU 82 Ca -0.02 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.17 1p8c h GLU 82 Cb 1.21 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.47 1p8c h GLU 82 CO 0.11 0.14 -0.68 0.00 -1.00 0.00 0.00 179.01 177.58 1p8c h ALA 83 N 1.86 0.03 -0.73 3.43 0.00 -0.96 -3.25 119.26 119.64 1p8c h ALA 83 Ca -0.00 -0.61 -0.01 0.00 0.00 0.00 0.00 54.91 54.29 1p8c h ALA 83 Cb 0.26 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1p8c h ALA 83 CO 0.02 0.37 0.42 -0.07 0.00 0.00 0.00 179.25 179.99 1p8c h LEU 84 N -0.15 0.89 -1.36 0.00 3.38 -0.32 -2.19 115.31 115.56 1p8c h LEU 84 Ca -0.10 -0.08 0.05 0.00 0.09 0.00 0.00 57.88 57.85 1p8c h LEU 84 Cb 1.42 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.90 1p8c h LEU 84 CO 0.13 0.71 0.48 0.44 0.09 0.00 0.00 178.44 180.29 1p8c h ASP 85 N 1.00 0.70 -0.41 -0.43 3.32 -1.01 0.25 116.42 119.85 1p8c h ASP 85 Ca 0.26 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.30 1p8c h ASP 85 Cb 0.00 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1p8c h ASP 85 CO -0.05 0.46 0.20 0.40 -1.72 0.00 0.00 179.24 178.53 1p8c h ILE 86 N 0.80 1.17 -0.76 0.35 2.04 -1.43 -2.00 117.51 117.67 1p8c h ILE 86 Ca 0.31 -0.48 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 1p8c h ILE 86 Cb 0.20 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 1p8c h ILE 86 CO -0.10 0.18 0.45 0.00 0.00 0.00 0.00 178.15 178.69 1p8c h ALA 87 N 1.05 0.97 -0.17 1.87 0.00 -0.64 -1.30 119.26 121.04 1p8c h ALA 87 Ca 0.14 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1p8c h ALA 87 Cb 0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1p8c h ALA 87 CO -0.02 0.45 0.08 1.25 0.00 0.00 0.00 179.25 181.01 1p8c h LEU 88 N 1.04 0.11 -0.25 0.00 6.46 -0.32 0.19 115.31 122.55 1p8c h LEU 88 Ca 0.27 0.01 -0.08 0.00 -0.12 0.00 0.00 57.88 57.96 1p8c h LEU 88 Cb -0.02 -0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 39.89 1p8c h LEU 88 CO -0.05 0.09 -0.16 0.58 -0.62 0.00 0.00 178.44 178.28 1p8c h VAL 89 N 0.17 1.31 0.02 1.05 2.07 -1.18 0.32 116.25 120.01 1p8c h VAL 89 Ca 0.07 -1.27 -0.00 0.00 0.82 0.00 0.00 66.70 66.32 1p8c h VAL 89 Cb 0.02 1.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1p8c h VAL 89 CO -0.06 0.39 -0.01 0.58 0.02 0.00 0.00 177.57 178.50 1p8c h VAL 90 N 0.26 1.38 0.00 2.57 2.07 -1.21 -3.28 116.25 118.04 1p8c h VAL 90 Ca 0.05 -1.31 -0.08 0.00 0.82 0.00 0.00 66.70 66.18 1p8c h VAL 90 Cb 0.68 2.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.69 1p8c h VAL 90 CO 0.04 0.33 -0.37 1.23 0.02 0.00 0.00 177.57 178.82 1p8c h GLY 91 N -0.61 0.00 0.00 2.17 0.00 -0.69 -3.50 103.07 100.44 1p8c h GLY 91 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1p8c h GLY 91 CO 0.01 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.16 1p8c n GLY 92 N -0.03 -0.25 0.31 4.60 0.00 0.11 -4.56 105.19 105.37 1p8c n GLY 92 Ca -0.01 -1.86 0.20 0.00 0.00 0.00 0.00 46.02 44.36 1p8c n GLY 92 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1p8c h SER 93 N 0.00 0.00 0.65 1.61 0.87 -1.92 -2.27 113.55 112.49 1p8c h SER 93 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1p8c h SER 93 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1p8c h SER 93 CO 0.00 0.00 0.00 2.30 -0.53 0.00 0.00 176.83 178.60 1p8c n ILE 94 N -2.92 0.87 0.64 2.23 -6.64 -1.26 -2.04 119.36 110.23 1p8c n ILE 94 Ca -0.03 0.27 0.13 0.00 -1.77 0.00 0.00 62.75 61.35 1p8c n ILE 94 Cb 0.10 -1.19 0.32 0.00 -1.44 0.00 0.00 39.64 37.43 1p8c n ILE 94 CO 0.00 0.00 0.00 1.33 -1.77 0.00 0.00 176.55 176.11 1p8c n VAL 95 N -2.17 0.45 -0.34 7.28 0.24 -0.85 -4.14 118.33 118.80 1p8c n VAL 95 Ca 0.02 -0.26 0.15 0.00 -2.04 0.00 0.00 64.34 62.22 1p8c n VAL 95 Cb 0.21 -0.37 0.37 0.00 -1.47 0.00 0.00 33.84 32.58 1p8c n VAL 95 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 1p8c h ILE 96 N 0.00 0.65 -0.47 1.34 2.04 -1.59 0.20 117.51 119.67 1p8c h ILE 96 Ca 0.00 -0.23 -0.09 0.00 1.00 0.00 0.00 64.86 65.54 1p8c h ILE 96 Cb 0.72 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1p8c h ILE 96 CO 0.00 0.12 -0.06 -0.65 0.00 0.00 0.00 178.15 177.56 1p8c h PRO 97 N 0.66 0.83 0.00 2.37 0.11 -1.80 -0.50 132.00 133.67 1p8c h PRO 97 Ca 0.58 -0.26 0.00 0.00 0.11 0.00 0.00 66.00 66.44 1p8c h PRO 97 Cb 1.05 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1p8c h PRO 97 CO -0.37 0.87 0.00 0.45 -0.21 0.00 0.00 178.00 178.74 1p8c h HIS 98 N 0.76 0.00 -0.05 0.65 3.86 -1.24 -2.45 115.15 116.68 1p8c h HIS 98 Ca 0.13 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.21 1p8c h HIS 98 Cb 0.55 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.02 1p8c h HIS 98 CO 0.03 0.00 -0.49 1.25 0.86 0.00 0.00 177.93 179.58 1p8c h LEU 99 N 0.00 0.51 -0.00 2.43 5.85 0.11 -2.55 115.31 121.67 1p8c h LEU 99 Ca 0.00 -0.70 0.00 0.00 0.84 0.00 0.00 57.88 58.02 1p8c h LEU 99 Cb 0.68 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 1p8c h LEU 99 CO 0.00 1.13 -0.03 0.03 -0.34 0.00 0.00 178.44 179.23 1p8c h ARG 100 N -0.07 -0.04 0.00 1.25 3.08 -0.74 -0.42 114.38 117.44 1p8c h ARG 100 Ca -0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1p8c h ARG 100 Cb 1.16 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.22 1p8c h ARG 100 CO 0.10 -0.03 0.30 0.00 -1.07 0.00 0.00 179.97 179.28 1p8c h ARG 101 N -0.04 0.00 0.09 0.04 3.08 -1.55 -0.14 114.38 115.86 1p8c h ARG 101 Ca 0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 1p8c h ARG 101 Cb 0.04 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.10 1p8c h ARG 101 CO -0.02 0.00 -0.61 0.00 -1.07 0.00 0.00 179.97 178.27 1p8c h ALA 102 N 1.32 -0.03 -0.33 0.04 0.00 -0.73 -2.73 119.26 116.81 1p8c h ALA 102 Ca 0.00 -0.68 -0.00 0.00 0.00 0.00 0.00 54.91 54.23 1p8c h ALA 102 Cb 0.61 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1p8c h ALA 102 CO 0.00 0.30 0.19 0.28 0.00 0.00 0.00 179.25 180.02 1p8c h VAL 103 N -0.59 1.12 -0.30 0.00 2.07 0.46 0.82 116.25 119.83 1p8c h VAL 103 Ca -0.11 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.08 1p8c h VAL 103 Cb 1.44 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.92 1p8c h VAL 103 CO 0.09 0.12 0.08 1.23 0.02 0.00 0.00 177.57 179.10 1p8c h GLY 104 N 0.42 0.47 0.81 2.17 0.00 -1.33 -2.65 103.07 102.95 1p8c h GLY 104 Ca 0.12 -0.23 -0.12 0.00 0.00 0.00 0.00 47.33 47.10 1p8c h GLY 104 CO -0.02 0.22 -0.39 -2.75 0.00 0.00 0.00 176.54 173.60 1p8c h PHE 105 N 0.43 0.61 0.15 5.60 3.57 -1.09 -3.16 116.94 123.05 1p8c h PHE 105 Ca 0.10 -0.25 0.02 0.00 3.53 0.00 0.00 57.97 61.37 1p8c h PHE 105 Cb 0.17 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 1p8c h PHE 105 CO 0.01 1.00 -0.29 1.25 -2.23 0.00 0.00 178.31 178.04 1p8c h LEU 106 N 0.04 -0.82 0.00 0.59 5.85 -0.52 -0.66 115.31 119.79 1p8c h LEU 106 Ca -0.02 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1p8c h LEU 106 Cb 1.02 0.31 0.00 0.00 0.37 0.00 0.00 40.66 42.35 1p8c h LEU 106 CO 0.08 -0.39 0.00 -1.84 -0.34 0.00 0.00 178.44 175.95 1p8c n GLU 107 N -5.40 0.02 0.16 1.25 0.28 -1.04 0.05 120.64 115.96 1p8c n GLU 107 Ca -0.07 0.31 0.12 0.00 -0.16 0.00 0.00 57.16 57.36 1p8c n GLU 107 Cb 0.31 -1.50 0.16 0.00 1.43 0.00 0.00 31.44 31.84 1p8c n GLU 107 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 1p8c h GLU 108 N 0.00 0.00 0.00 3.44 4.81 -1.09 -1.51 114.58 120.23 1p8c h GLU 108 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1p8c h GLU 108 Cb 0.15 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.53 1p8c h GLU 108 CO 0.00 0.00 -0.79 1.28 -0.73 0.00 0.00 179.01 178.77 1p8c n LEU 109 N -2.79 0.79 -0.01 1.64 4.77 0.11 -3.73 117.00 117.79 1p8c n LEU 109 Ca 0.03 -0.29 0.10 0.00 -0.03 0.00 0.00 56.01 55.82 1p8c n LEU 109 Cb 0.51 -0.10 -0.15 0.00 -2.33 0.00 0.00 43.42 41.35 1p8c n LEU 109 CO 0.35 0.20 -0.63 0.54 -1.33 0.00 0.00 177.39 176.52 1p8c n ARG 110 N -1.50 0.58 -1.20 3.23 5.12 -0.97 -1.45 116.66 120.48 1p8c n ARG 110 Ca 0.05 -0.16 -0.23 0.00 -1.93 0.00 0.00 57.85 55.58 1p8c n ARG 110 Cb 0.33 -1.49 0.18 0.00 -1.16 0.00 0.00 32.46 30.33 1p8c n ARG 110 CO 0.00 0.00 0.00 -1.91 -1.93 0.00 0.00 177.63 173.79 1p8c n GLU 111 N -2.10 2.31 0.07 5.56 4.07 -0.58 -3.48 120.64 126.48 1p8c n GLU 111 Ca -0.03 -2.95 0.00 0.00 -0.06 0.00 0.00 57.16 54.12 1p8c n GLU 111 Cb 0.51 -2.16 0.00 0.00 -0.06 0.00 0.00 31.44 29.73 1p8c n GLU 111 CO 0.00 0.00 0.00 -0.12 -0.06 0.00 0.00 177.13 176.95 1p8c n MET 112 N -1.06 0.00 0.27 5.31 1.56 -1.24 -4.83 117.12 117.12 1p8c n MET 112 Ca 0.58 0.00 0.14 0.00 -0.27 0.00 0.00 57.70 58.15 1p8c n MET 112 Cb 1.64 0.00 0.76 0.00 2.15 0.00 0.00 33.22 37.77 1p8c n MET 112 CO 0.00 0.00 0.00 1.05 -0.73 0.00 0.00 175.97 176.29 1p8c h GLU 113 N 0.00 0.00 -0.29 2.12 4.11 -1.43 -1.98 114.58 117.11 1p8c h GLU 113 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 1p8c h GLU 113 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1p8c h GLU 113 CO 0.00 0.10 0.14 -0.22 0.07 0.00 0.00 179.01 179.09 1p8c h LYS 114 N 0.00 0.42 -1.50 1.06 1.63 -1.78 -2.18 116.57 114.22 1p8c h LYS 114 Ca -0.00 -0.06 -0.14 0.00 -0.85 0.00 0.00 60.65 59.59 1p8c h LYS 114 Cb 0.36 -0.07 -0.07 0.00 -0.60 0.00 0.00 32.23 31.84 1p8c h LYS 114 CO 0.01 0.40 0.19 0.09 -3.45 0.00 0.00 179.45 176.69 1p8c n ASN 115 N -4.78 4.94 -3.06 4.20 4.13 -0.75 -4.90 115.26 115.04 1p8c n ASN 115 Ca -0.02 -2.60 -0.00 0.00 1.68 0.00 0.00 54.58 53.63 1p8c n ASN 115 Cb 0.10 -0.91 -0.00 0.00 -1.54 0.00 0.00 39.78 37.43 1p8c n ASN 115 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1p8c n GLY 116 N 0.65 -0.68 3.35 7.41 0.00 -0.82 -5.03 105.19 110.07 1p8c n GLY 116 Ca 0.14 0.18 -0.12 0.00 0.00 0.00 0.00 46.02 46.22 1p8c n GLY 116 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1p8c s GLU 117 N -0.50 0.51 0.81 1.61 2.12 -1.24 -4.99 118.70 117.02 1p8c s GLU 117 Ca -0.02 0.73 -0.13 0.00 0.36 0.00 0.00 54.97 55.91 1p8c s GLU 117 Cb 0.00 0.17 0.09 0.00 0.26 0.00 0.00 34.13 34.65 1p8c s GLU 117 CO 0.11 -0.10 1.20 0.99 -0.54 0.00 0.00 175.26 176.92 1p8c s THR 118 N 0.70 2.04 -0.15 -1.70 2.01 -1.26 -4.67 115.64 112.61 1p8c s THR 118 Ca -0.04 0.02 -0.04 0.00 0.31 0.00 0.00 61.69 61.94 1p8c s THR 118 Cb -0.05 -2.40 0.06 0.00 0.01 0.00 0.00 72.50 70.12 1p8c s THR 118 CO -0.05 -0.01 0.08 -0.63 -0.69 0.00 0.00 174.62 173.32 1p8c s ILE 119 N -2.18 -0.03 -1.67 1.82 1.01 -1.26 -5.04 121.20 113.86 1p8c s ILE 119 Ca 0.73 -0.11 0.00 0.00 0.00 0.00 0.00 60.65 61.27 1p8c s ILE 119 Cb -0.28 -0.55 0.00 0.00 0.01 0.00 0.00 42.46 41.63 1p8c s ILE 119 CO 0.51 -0.20 0.42 -0.24 0.00 0.00 0.00 174.94 175.43