#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p8c n TYR 3 N 0.00 0.00 1.25 -0.32 9.36 -1.26 -4.70 117.16 121.50 1p8c n TYR 3 Ca 0.00 0.00 0.14 0.00 3.32 0.00 0.00 57.90 61.36 1p8c n TYR 3 Cb 0.00 0.14 0.69 0.00 -0.63 0.00 0.00 39.34 39.54 1p8c n TYR 3 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1p8c n LYS 4 N -1.93 0.32 -0.02 2.98 5.02 -1.26 -1.81 118.16 121.45 1p8c n LYS 4 Ca 0.00 0.02 -0.18 0.00 -2.02 0.00 0.00 58.31 56.13 1p8c n LYS 4 Cb 0.07 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 33.44 1p8c n LYS 4 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1p8c n LYS 5 N -1.33 0.72 0.22 1.97 5.02 -1.26 -3.56 118.16 119.94 1p8c n LYS 5 Ca 0.12 0.25 -0.09 0.00 -2.02 0.00 0.00 58.31 56.57 1p8c n LYS 5 Cb 0.25 -1.70 -0.04 0.00 -0.02 0.00 0.00 35.03 33.51 1p8c n LYS 5 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 1p8c h PHE 6 N 0.05 -0.57 -0.39 2.13 3.57 -1.75 -1.61 116.94 118.36 1p8c h PHE 6 Ca -0.42 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.19 1p8c h PHE 6 Cb 2.03 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 40.94 1p8c h PHE 6 CO 0.05 -0.34 0.38 0.28 -2.23 0.00 0.00 178.31 176.45 1p8c h VAL 7 N -0.58 0.47 0.06 1.41 2.07 -1.56 -1.54 116.25 116.58 1p8c h VAL 7 Ca -0.06 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 1p8c h VAL 7 Cb 0.45 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1p8c h VAL 7 CO 0.08 0.00 -0.03 -0.08 0.02 0.00 0.00 177.57 177.56 1p8c h GLU 8 N 0.00 -0.07 -0.10 1.57 4.81 -1.56 -2.88 114.58 116.34 1p8c h GLU 8 Ca 0.19 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1p8c h GLU 8 Cb 0.94 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.34 1p8c h GLU 8 CO -0.00 0.42 0.07 0.00 -0.73 0.00 0.00 179.01 178.77 1p8c h ALA 9 N -0.42 0.13 -0.14 2.92 0.00 -1.07 -0.14 119.26 120.54 1p8c h ALA 9 Ca -0.01 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1p8c h ALA 9 Cb 0.53 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1p8c h ALA 9 CO 0.01 -0.38 -0.34 -0.09 0.00 0.00 0.00 179.25 178.46 1p8c h ARG 10 N 0.13 -0.31 -0.61 0.00 2.43 -1.44 0.82 114.38 115.41 1p8c h ARG 10 Ca 0.04 0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.35 1p8c h ARG 10 Cb -0.00 0.07 -0.09 0.00 -0.42 0.00 0.00 29.97 29.52 1p8c h ARG 10 CO -0.01 -0.21 0.07 -0.09 -1.51 0.00 0.00 179.97 178.23 1p8c h ARG 11 N -0.32 0.18 0.59 0.20 2.43 -1.37 0.74 114.38 116.83 1p8c h ARG 11 Ca 0.03 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.16 1p8c h ARG 11 Cb 0.41 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 29.92 1p8c h ARG 11 CO -0.31 0.12 -0.28 1.49 -1.51 0.00 0.00 179.97 179.48 1p8c h GLU 12 N 0.19 -0.76 -0.12 0.20 4.81 -0.10 -2.02 114.58 116.79 1p8c h GLU 12 Ca 0.32 0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.59 1p8c h GLU 12 Cb 0.50 0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 1p8c h GLU 12 CO -0.46 -0.46 0.04 -0.07 -0.73 0.00 0.00 179.01 177.34 1p8c h LEU 13 N -1.10 0.14 0.05 1.64 3.38 0.79 -0.30 115.31 119.90 1p8c h LEU 13 Ca -0.08 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1p8c h LEU 13 Cb 0.65 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1p8c h LEU 13 CO 0.13 0.14 -0.02 0.78 0.09 0.00 0.00 178.44 179.56 1p8c h ASN 14 N 0.16 -0.06 0.44 -0.43 4.21 0.61 0.12 115.58 120.64 1p8c h ASN 14 Ca 0.04 -0.08 -0.03 0.00 1.21 0.00 0.00 56.30 57.45 1p8c h ASN 14 Cb 0.05 0.01 -0.00 0.00 -1.12 0.00 0.00 38.32 37.26 1p8c h ASN 14 CO -0.00 0.04 -0.12 1.05 -1.29 0.00 0.00 177.43 177.11 1p8c h GLU 15 N -0.15 0.00 -0.16 0.81 4.11 -0.63 -1.84 114.58 116.71 1p8c h GLU 15 Ca -0.01 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.33 1p8c h GLU 15 Cb 0.13 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 1p8c h GLU 15 CO 0.01 0.12 -0.27 -0.22 0.07 0.00 0.00 179.01 178.73 1p8c h LYS 16 N 0.00 0.46 -0.65 1.06 3.64 -0.24 -0.45 116.57 120.39 1p8c h LYS 16 Ca -0.00 -0.28 -0.07 0.00 -1.27 0.00 0.00 60.65 59.02 1p8c h LYS 16 Cb 0.38 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.20 1p8c h LYS 16 CO 0.02 0.88 0.13 0.28 -2.27 0.00 0.00 179.45 178.48 1p8c h VAL 17 N 0.09 1.26 -0.21 2.00 2.07 -0.20 -1.98 116.25 119.28 1p8c h VAL 17 Ca 0.01 -1.00 -0.05 0.00 0.82 0.00 0.00 66.70 66.48 1p8c h VAL 17 Cb 0.85 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 1p8c h VAL 17 CO 0.06 0.38 -0.08 -0.07 0.02 0.00 0.00 177.57 177.88 1p8c h LEU 18 N 0.99 0.43 -0.10 2.57 3.38 -1.38 -1.82 115.31 119.38 1p8c h LEU 18 Ca 0.20 -0.39 0.02 0.00 0.09 0.00 0.00 57.88 57.80 1p8c h LEU 18 Cb 0.41 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1p8c h LEU 18 CO 0.01 0.72 -0.25 -1.28 0.09 0.00 0.00 178.44 177.73 1p8c h SER 19 N 0.13 -0.80 -0.02 -0.43 0.87 -0.87 -1.77 113.55 110.66 1p8c h SER 19 Ca 0.05 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1p8c h SER 19 Cb 0.55 0.32 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 1p8c h SER 19 CO 0.03 -0.20 0.00 0.54 -0.53 0.00 0.00 176.83 176.66 1p8c n ARG 20 N -3.87 1.05 0.00 2.24 1.74 -0.76 -4.85 116.66 112.21 1p8c n ARG 20 Ca -0.02 -0.08 0.00 0.00 -0.77 0.00 0.00 57.85 56.98 1p8c n ARG 20 Cb 0.16 -1.02 0.00 0.00 -1.02 0.00 0.00 32.46 30.58 1p8c n ARG 20 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1p8c n GLY 21 N 0.53 1.88 3.27 -0.13 0.00 -0.66 -5.06 105.19 105.01 1p8c n GLY 21 Ca 0.01 -1.86 -0.15 0.00 0.00 0.00 0.00 46.02 44.02 1p8c n GLY 21 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1p8c s THR 22 N 3.32 0.19 0.55 2.61 -4.23 -1.26 -5.00 115.64 111.81 1p8c s THR 22 Ca 0.00 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 58.76 1p8c s THR 22 Cb 0.00 -2.53 0.37 0.00 1.34 0.00 0.00 72.50 71.68 1p8c s THR 22 CO 0.00 0.00 2.04 0.25 -0.54 0.00 0.00 174.62 176.37 1p8c h LEU 23 N 2.42 0.00 -0.06 4.79 6.46 -1.98 0.12 115.31 127.07 1p8c h LEU 23 Ca -0.35 0.00 -0.15 0.00 -0.12 0.00 0.00 57.88 57.27 1p8c h LEU 23 Cb 1.25 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 41.19 1p8c h LEU 23 CO 0.52 0.00 -0.54 0.78 -0.62 0.00 0.00 178.44 178.58 1p8c h ASN 24 N 0.00 0.58 0.43 1.25 2.35 -1.97 0.36 115.58 118.56 1p8c h ASN 24 Ca 0.17 -0.69 -0.01 0.00 -0.55 0.00 0.00 56.30 55.22 1p8c h ASN 24 Cb 0.75 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.92 1p8c h ASN 24 CO -0.00 1.18 -0.49 0.74 -1.65 0.00 0.00 177.43 177.21 1p8c h THR 25 N 0.02 0.00 -0.60 2.81 2.02 -1.26 0.63 112.91 116.53 1p8c h THR 25 Ca -0.05 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.25 1p8c h THR 25 Cb 1.21 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 67.51 1p8c h THR 25 CO 0.11 0.00 -0.12 0.11 0.37 0.00 0.00 175.52 175.99 1p8c h LYS 26 N -0.93 0.02 -0.07 6.66 1.57 -0.92 0.90 116.57 123.81 1p8c h LYS 26 Ca -0.05 -0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.68 1p8c h LYS 26 Cb 0.83 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 1p8c h LYS 26 CO -0.10 0.01 -0.19 0.00 -0.57 0.00 0.00 179.45 178.61 1p8c h ARG 27 N 0.02 0.11 -0.06 3.15 3.08 0.13 -1.88 114.38 118.92 1p8c h ARG 27 Ca 0.30 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.30 1p8c h ARG 27 Cb 0.46 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.49 1p8c h ARG 27 CO -0.60 0.30 -0.04 0.35 -1.07 0.00 0.00 179.97 178.91 1p8c h PHE 28 N 0.10 0.16 -0.35 3.04 3.57 0.15 -2.35 116.94 121.26 1p8c h PHE 28 Ca 0.02 -0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.52 1p8c h PHE 28 Cb 0.40 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.07 1p8c h PHE 28 CO 0.00 0.53 0.13 0.74 -2.23 0.00 0.00 178.31 177.48 1p8c h PHE 29 N -0.26 0.24 -0.96 0.41 -1.00 -0.99 -1.09 116.94 113.29 1p8c h PHE 29 Ca 0.01 0.02 0.14 0.00 2.81 0.00 0.00 57.97 60.95 1p8c h PHE 29 Cb 0.49 -0.05 -0.09 0.00 3.61 0.00 0.00 35.95 39.90 1p8c h PHE 29 CO 0.07 0.10 0.57 -0.91 -1.61 0.00 0.00 178.31 176.54 1p8c h ASN 30 N 0.28 0.79 0.44 2.17 -0.26 -1.31 0.25 115.58 117.95 1p8c h ASN 30 Ca 0.16 0.07 -0.10 0.00 -0.56 0.00 0.00 56.30 55.87 1p8c h ASN 30 Cb 0.12 -0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 37.29 1p8c h ASN 30 CO -0.15 0.37 -0.45 0.25 -1.06 0.00 0.00 177.43 176.38 1p8c h LEU 31 N 0.84 0.01 -1.33 1.61 5.85 -0.77 0.12 115.31 121.65 1p8c h LEU 31 Ca 0.50 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 59.16 1p8c h LEU 31 Cb 0.62 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1p8c h LEU 31 CO -0.31 0.46 -0.20 -0.78 -0.34 0.00 0.00 178.44 177.27 1p8c h ASP 32 N 0.01 0.20 0.08 1.25 3.58 0.70 -2.19 116.42 120.05 1p8c h ASP 32 Ca -0.00 -0.05 -0.31 0.00 0.42 0.00 0.00 57.03 57.09 1p8c h ASP 32 Cb 0.80 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.78 1p8c h ASP 32 CO 0.06 0.41 -1.69 0.77 -2.88 0.00 0.00 179.24 175.91 1p8c h SER 33 N 0.19 0.26 -1.03 2.28 4.64 -1.06 -3.38 113.55 115.45 1p8c h SER 33 Ca 0.04 -0.78 0.26 0.00 -0.47 0.00 0.00 61.79 60.84 1p8c h SER 33 Cb 0.46 -0.09 -0.08 0.00 -0.31 0.00 0.00 62.40 62.38 1p8c h SER 33 CO 0.03 1.71 0.67 0.00 -0.87 0.00 0.00 176.83 178.37 1p8c h ALA 34 N -0.15 2.31 0.00 5.18 0.00 -0.66 -1.45 119.26 124.50 1p8c h ALA 34 Ca -0.39 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1p8c h ALA 34 Cb 1.75 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.56 1p8c h ALA 34 CO -0.02 -0.69 0.00 1.55 0.00 0.00 0.00 179.25 180.08 1p8c n VAL 35 N -4.57 0.24 0.41 0.00 3.14 -0.83 -2.60 118.33 114.12 1p8c n VAL 35 Ca 0.24 0.06 0.09 0.00 -2.96 0.00 0.00 64.34 61.77 1p8c n VAL 35 Cb 0.88 -0.72 0.12 0.00 -1.06 0.00 0.00 33.84 33.06 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 -1.18 0.22 -2.73 1.45 4.01 -0.54 -5.00 117.16 113.39 1p8c n TYR 36 Ca 0.12 -0.15 -0.35 0.00 -0.16 0.00 0.00 57.90 57.36 1p8c n TYR 36 Cb 0.13 -0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.10 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 -1.30 4.22 0.25 -0.72 0.52 -1.07 -4.77 118.95 116.09 1p8c s ARG 37 Ca 0.25 1.26 -0.29 0.00 -0.52 0.00 0.00 55.73 56.43 1p8c s ARG 37 Cb 0.16 -2.35 -0.15 0.00 0.52 0.00 0.00 34.95 33.13 1p8c s ARG 37 CO 0.22 -0.05 0.89 -2.30 0.02 0.00 0.00 175.30 174.09 1p8c n PRO 38 N -0.36 0.96 0.00 3.54 -0.02 -1.26 -4.90 135.00 132.96 1p8c n PRO 38 Ca 0.06 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 1p8c n PRO 38 Cb 0.52 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 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 1.51 4.09 0.10 -1.23 0.00 -1.26 -4.94 105.19 103.46 1p8c n GLY 39 Ca 0.12 -0.77 0.05 0.00 0.00 0.00 0.00 46.02 45.42 1p8c n GLY 39 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1p8c n LYS 40 N 0.00 0.06 -5.25 1.61 4.01 -1.26 -4.29 118.16 113.04 1p8c n LYS 40 Ca 0.00 0.50 -0.31 0.00 -0.51 0.00 0.00 58.31 57.99 1p8c n LYS 40 Cb 0.00 -1.89 -0.16 0.00 -0.51 0.00 0.00 35.03 32.47 1p8c n LYS 40 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1p8c s LEU 41 N -3.64 2.14 0.96 -0.35 1.43 -1.26 -5.13 118.68 112.83 1p8c s LEU 41 Ca -0.01 -0.45 -0.12 0.00 -1.03 0.00 0.00 54.13 52.52 1p8c s LEU 41 Cb 0.03 -1.37 0.09 0.00 0.03 0.00 0.00 46.19 44.97 1p8c s LEU 41 CO 0.09 0.31 0.66 0.47 0.23 0.00 0.00 176.35 178.10 1p8c n ASP 42 N 2.52 -1.28 0.17 2.29 8.00 -1.26 -4.62 116.55 122.37 1p8c n ASP 42 Ca -0.16 0.30 0.06 0.00 0.71 0.00 0.00 54.79 55.70 1p8c n ASP 42 Cb 0.51 -1.28 0.11 0.00 -0.02 0.00 0.00 41.12 40.44 1p8c n ASP 42 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 1p8c h VAL 43 N -1.77 0.59 -0.12 2.53 3.04 -1.90 -1.90 116.25 116.72 1p8c h VAL 43 Ca -0.45 -1.77 -0.15 0.00 -1.01 0.00 0.00 66.70 63.32 1p8c h VAL 43 Cb 1.29 2.24 -0.01 0.00 -2.01 0.00 0.00 31.29 32.80 1p8c h VAL 43 CO 0.37 0.33 -0.57 0.50 -1.01 0.00 0.00 177.57 177.19 1p8c h LYS 44 N 0.00 0.38 -0.12 4.17 3.64 -1.91 -1.17 116.57 121.56 1p8c h LYS 44 Ca -0.00 -0.25 -0.23 0.00 -1.27 0.00 0.00 60.65 58.90 1p8c h LYS 44 Cb 1.21 0.03 0.01 0.00 -0.41 0.00 0.00 32.23 33.08 1p8c h LYS 44 CO 0.04 0.85 -0.81 1.15 -2.27 0.00 0.00 179.45 178.41 1p8c h THR 45 N 0.29 1.28 -0.68 1.00 2.02 -1.89 -1.96 112.91 112.97 1p8c h THR 45 Ca 0.00 -2.01 -0.01 0.00 0.77 0.00 0.00 66.41 65.16 1p8c h THR 45 Cb 1.09 2.07 -0.03 0.00 -1.74 0.00 0.00 68.15 69.54 1p8c h THR 45 CO 0.10 0.63 0.39 0.11 0.37 0.00 0.00 175.52 177.12 1p8c h LYS 46 N 0.49 0.94 -0.02 6.66 6.56 -1.24 -1.46 116.57 128.50 1p8c h LYS 46 Ca -0.07 -0.10 -0.18 0.00 -1.06 0.00 0.00 60.65 59.24 1p8c h LYS 46 Cb 1.45 -0.19 -0.01 0.00 -0.57 0.00 0.00 32.23 32.91 1p8c h LYS 46 CO 0.17 0.69 -0.81 0.93 -2.06 0.00 0.00 179.45 178.37 1p8c h GLU 47 N 0.93 0.22 -0.19 3.15 4.39 -1.22 -2.19 114.58 119.67 1p8c h GLU 47 Ca 0.24 -0.21 -0.11 0.00 0.34 0.00 0.00 59.36 59.62 1p8c h GLU 47 Cb 0.01 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.70 1p8c h GLU 47 CO -0.04 0.91 -0.37 -0.07 -1.16 0.00 0.00 179.01 178.28 1p8c h LEU 48 N 0.13 0.43 -1.00 1.33 3.38 -1.12 0.41 115.31 118.86 1p8c h LEU 48 Ca -0.03 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.69 1p8c h LEU 48 Cb 1.40 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.02 1p8c h LEU 48 CO 0.12 0.76 -0.05 0.24 0.09 0.00 0.00 178.44 179.61 1p8c h MET 49 N 0.35 0.66 -0.74 1.13 2.86 -1.11 0.37 114.93 118.45 1p8c h MET 49 Ca 0.04 -0.18 -0.06 0.00 -2.06 0.00 0.00 59.70 57.44 1p8c h MET 49 Cb 0.81 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.36 1p8c h MET 49 CO 0.07 0.72 0.24 0.78 1.06 0.00 0.00 176.91 179.77 1p8c h GLY 50 N 0.94 1.23 0.97 8.32 0.00 -0.62 -1.49 103.07 112.42 1p8c h GLY 50 Ca 0.12 -0.72 -0.00 0.00 0.00 0.00 0.00 47.33 46.73 1p8c h GLY 50 CO 0.02 0.67 0.02 -2.00 0.00 0.00 0.00 176.54 175.25 1p8c h LEU 51 N 1.10 0.03 -0.17 3.11 5.85 0.99 -0.67 115.31 125.55 1p8c h LEU 51 Ca 0.24 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.95 1p8c h LEU 51 Cb 0.30 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1p8c h LEU 51 CO -0.01 0.05 0.02 0.58 -0.34 0.00 0.00 178.44 178.74 1p8c h VAL 52 N 0.00 0.91 -0.49 1.05 2.07 -0.79 -1.39 116.25 117.61 1p8c h VAL 52 Ca 0.01 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1p8c h VAL 52 Cb 0.03 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1p8c h VAL 52 CO -0.00 0.01 0.31 0.00 0.02 0.00 0.00 177.57 177.92 1p8c h ALA 53 N 1.13 0.62 0.00 1.67 0.00 -1.13 -1.06 119.26 120.49 1p8c h ALA 53 Ca 0.08 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1p8c h ALA 53 Cb 0.08 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1p8c h ALA 53 CO -0.11 0.08 -0.05 0.77 0.00 0.00 0.00 179.25 179.94 1p8c h SER 54 N 0.66 0.00 0.00 0.00 0.02 -0.93 -2.45 113.55 110.85 1p8c h SER 54 Ca 0.18 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.04 1p8c h SER 54 Cb -0.05 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 1p8c h SER 54 CO -0.04 0.05 -0.47 0.74 -1.14 0.00 0.00 176.83 175.97 1p8c h THR 55 N 0.00 1.44 -0.02 -2.27 2.02 -0.61 -1.83 112.91 111.64 1p8c h THR 55 Ca -0.00 -2.26 0.00 0.00 0.77 0.00 0.00 66.41 64.92 1p8c h THR 55 Cb 0.56 2.90 -0.00 0.00 -1.74 0.00 0.00 68.15 69.87 1p8c h THR 55 CO 0.01 0.49 0.02 -0.37 0.37 0.00 0.00 175.52 176.03 1p8c h VAL 56 N -1.00 0.71 -0.07 3.16 -1.51 -1.21 -0.54 116.25 115.78 1p8c h VAL 56 Ca -0.13 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.34 1p8c h VAL 56 Cb 1.10 0.99 0.00 0.00 -2.13 0.00 0.00 31.29 31.25 1p8c h VAL 56 CO -0.08 0.00 0.00 0.18 -1.23 0.00 0.00 177.57 176.44 1p8c n LEU 57 N -4.12 1.81 -3.64 4.19 4.77 -0.93 -4.89 117.00 114.20 1p8c n LEU 57 Ca -0.03 -0.65 -0.26 0.00 -0.03 0.00 0.00 56.01 55.04 1p8c n LEU 57 Cb 0.10 -0.04 0.04 0.00 -2.33 0.00 0.00 43.42 41.20 1p8c n LEU 57 CO 0.30 0.33 -0.07 0.54 -1.33 0.00 0.00 177.39 177.16 1p8c n ARG 58 N 0.41 -2.46 -3.99 3.23 1.74 -0.21 -4.98 116.66 110.39 1p8c n ARG 58 Ca 0.18 0.56 -0.33 0.00 -0.77 0.00 0.00 57.85 57.48 1p8c n ARG 58 Cb 0.39 -4.69 -0.14 0.00 -1.02 0.00 0.00 32.46 27.00 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 7.82 -0.06 -0.56 0.00 3.32 -1.94 -0.47 116.42 124.54 1p8c h ASP 60 Ca -0.16 0.01 0.01 0.00 0.02 0.00 0.00 57.03 56.92 1p8c h ASP 60 Cb 1.04 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 40.60 1p8c h ASP 60 CO 0.51 -0.03 0.36 0.44 -1.72 0.00 0.00 179.24 178.81 1p8c h ASP 61 N -0.02 0.62 -0.37 6.45 5.19 -1.98 0.51 116.42 126.83 1p8c h ASP 61 Ca 0.02 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.41 1p8c h ASP 61 Cb 0.05 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.39 1p8c h ASP 61 CO -0.05 0.44 0.21 0.00 -3.12 0.00 0.00 179.24 176.72 1p8c h ILE 63 N 0.54 0.75 0.01 0.00 2.04 0.11 -1.88 117.51 119.09 1p8c h ILE 63 Ca 0.14 -0.76 0.03 0.00 1.00 0.00 0.00 64.86 65.27 1p8c h ILE 63 Cb 0.03 1.14 -0.05 0.00 -0.74 0.00 0.00 36.82 37.21 1p8c h ILE 63 CO -0.02 0.15 -0.29 0.03 0.00 0.00 0.00 178.15 178.02 1p8c h ARG 64 N -0.78 -0.43 -0.51 2.37 3.08 -0.74 -0.88 114.38 116.49 1p8c h ARG 64 Ca -0.03 0.03 0.10 0.00 0.07 0.00 0.00 59.98 60.15 1p8c h ARG 64 Cb 0.50 0.10 -0.10 0.00 0.08 0.00 0.00 29.97 30.55 1p8c h ARG 64 CO 0.06 -0.29 -0.14 -0.92 -1.07 0.00 0.00 179.97 177.61 1p8c h TYR 65 N -0.45 -0.31 0.00 3.04 3.20 -1.19 0.17 116.97 121.43 1p8c h TYR 65 Ca 0.06 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.98 1p8c h TYR 65 Cb 0.53 0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.01 1p8c h TYR 65 CO -0.31 -0.23 0.00 0.45 -1.64 0.00 0.00 178.16 176.42 1p8c h HIS 66 N -0.02 0.00 0.01 -3.82 3.86 -0.93 -2.75 115.15 111.51 1p8c h HIS 66 Ca 0.25 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.46 1p8c h HIS 66 Cb 0.39 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.86 1p8c h HIS 66 CO -0.44 0.00 -0.00 -0.07 0.86 0.00 0.00 177.93 178.27 1p8c h LEU 67 N 0.00 -0.01 -1.29 2.43 3.38 0.75 -1.89 115.31 118.68 1p8c h LEU 67 Ca 0.00 -0.80 0.12 0.00 0.09 0.00 0.00 57.88 57.29 1p8c h LEU 67 Cb 0.37 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.06 1p8c h LEU 67 CO 0.00 0.82 0.56 -0.37 0.09 0.00 0.00 178.44 179.54 1p8c h VAL 68 N -0.87 0.90 -0.58 1.22 -1.51 -1.27 0.17 116.25 114.30 1p8c h VAL 68 Ca -0.00 -0.26 -0.09 0.00 -1.23 0.00 0.00 66.70 65.12 1p8c h VAL 68 Cb 0.81 0.09 -0.02 0.00 -2.13 0.00 0.00 31.29 30.04 1p8c h VAL 68 CO 0.00 0.14 0.02 0.03 -1.23 0.00 0.00 177.57 176.53 1p8c h ARG 69 N 0.75 1.01 -0.29 5.19 2.47 -1.50 0.78 114.38 122.79 1p8c h ARG 69 Ca 0.41 -0.31 -0.10 0.00 -1.26 0.00 0.00 59.98 58.72 1p8c h ARG 69 Cb 0.56 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.77 1p8c h ARG 69 CO -0.18 0.99 -0.25 0.00 0.56 0.00 0.00 179.97 181.09 1p8c h VAL 71 N 0.50 0.95 -0.94 0.00 2.07 -0.50 0.21 116.25 118.54 1p8c h VAL 71 Ca 0.07 -1.10 0.27 0.00 0.82 0.00 0.00 66.70 66.76 1p8c h VAL 71 Cb 0.71 1.56 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 1p8c h VAL 71 CO 0.05 0.23 0.74 1.56 0.02 0.00 0.00 177.57 180.17 1p8c h GLN 72 N -0.79 0.00 -0.79 1.57 4.20 0.77 0.61 115.11 120.68 1p8c h GLN 72 Ca -0.02 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.43 1p8c h GLN 72 Cb 0.53 0.00 -0.16 0.00 0.30 0.00 0.00 27.48 28.16 1p8c h GLN 72 CO 0.03 0.00 0.33 -1.91 -0.67 0.00 0.00 178.83 176.62 1p8c n GLU 73 N -4.06 3.56 -3.37 1.46 4.07 0.06 -4.93 120.64 117.42 1p8c n GLU 73 Ca 0.20 -3.09 -0.24 0.00 -0.06 0.00 0.00 57.16 53.97 1p8c n GLU 73 Cb 1.06 -2.22 0.05 0.00 -0.06 0.00 0.00 31.44 30.26 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 -0.29 -0.53 3.80 8.31 0.00 0.21 -4.79 105.19 111.91 1p8c n GLY 74 Ca 0.44 0.18 -0.36 0.00 0.00 0.00 0.00 46.02 46.28 1p8c n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p8c s ALA 75 N -3.23 3.31 0.12 4.61 0.00 0.72 -5.02 121.76 122.28 1p8c s ALA 75 Ca 0.46 0.31 -0.07 0.00 0.00 0.00 0.00 51.96 52.66 1p8c s ALA 75 Cb -0.21 -2.98 -0.06 0.00 0.00 0.00 0.00 23.12 19.87 1p8c s ALA 75 CO 0.57 0.26 0.40 -1.54 0.00 0.00 0.00 175.76 175.45 1p8c s SER 76 N -1.68 6.56 0.53 0.00 1.04 -1.26 -4.65 113.70 114.24 1p8c s SER 76 Ca 0.47 0.70 0.38 0.00 0.48 0.00 0.00 55.95 57.98 1p8c s SER 76 Cb -0.17 -2.14 1.56 0.00 0.10 0.00 0.00 66.02 65.38 1p8c s SER 76 CO 0.22 0.09 1.73 0.44 0.98 0.00 0.00 173.24 176.70 1p8c h ASP 77 N 3.17 0.05 -0.19 7.02 5.19 -1.98 0.50 116.42 130.17 1p8c h ASP 77 Ca -0.47 0.02 -0.11 0.00 -0.62 0.00 0.00 57.03 55.85 1p8c h ASP 77 Cb 1.18 0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.70 1p8c h ASP 77 CO 0.70 -0.01 -0.29 -0.33 -3.12 0.00 0.00 179.24 176.19 1p8c h GLU 78 N 0.04 0.54 -0.59 3.56 5.08 -1.99 -1.42 114.58 119.80 1p8c h GLU 78 Ca 0.68 -0.32 -0.04 0.00 -1.00 0.00 0.00 59.36 58.68 1p8c h GLU 78 Cb 2.62 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 31.87 1p8c h GLU 78 CO -0.06 0.92 0.19 0.93 -1.00 0.00 0.00 179.01 180.00 1p8c h GLU 79 N 0.20 0.90 -0.18 2.33 5.08 -0.47 -1.76 114.58 120.68 1p8c h GLU 79 Ca 0.02 -0.19 0.03 0.00 -1.00 0.00 0.00 59.36 58.22 1p8c h GLU 79 Cb 0.87 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 1p8c h GLU 79 CO 0.07 0.80 -0.03 0.82 -1.00 0.00 0.00 179.01 179.67 1p8c h ILE 80 N 0.82 0.84 0.00 3.13 2.04 -0.93 -2.50 117.51 120.91 1p8c h ILE 80 Ca 0.19 -0.01 -0.07 0.00 1.00 0.00 0.00 64.86 65.97 1p8c h ILE 80 Cb 0.27 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 1p8c h ILE 80 CO -0.01 0.00 -0.34 -0.26 0.00 0.00 0.00 178.15 177.55 1p8c h PHE 81 N 0.02 0.00 0.00 1.37 -1.00 -1.09 -0.37 116.94 115.87 1p8c h PHE 81 Ca 0.09 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.82 1p8c h PHE 81 Cb 0.12 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.68 1p8c h PHE 81 CO -0.19 0.34 -0.21 0.93 -1.61 0.00 0.00 178.31 177.57 1p8c h GLU 82 N 0.00 0.00 0.14 1.51 5.08 -0.90 0.17 114.58 120.58 1p8c h GLU 82 Ca -0.00 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.10 1p8c h GLU 82 Cb 0.68 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.94 1p8c h GLU 82 CO 0.04 0.21 -1.24 0.00 -1.00 0.00 0.00 179.01 177.02 1p8c h ALA 83 N 1.79 0.06 -0.67 3.43 0.00 -0.89 -3.28 119.26 119.70 1p8c h ALA 83 Ca -0.00 -0.94 -0.05 0.00 0.00 0.00 0.00 54.91 53.92 1p8c h ALA 83 Cb 0.56 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 1p8c h ALA 83 CO 0.03 0.68 0.22 -0.07 0.00 0.00 0.00 179.25 180.10 1p8c h LEU 84 N -0.27 0.94 -2.01 0.00 3.38 -0.93 -1.27 115.31 115.15 1p8c h LEU 84 Ca -0.25 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.56 1p8c h LEU 84 Cb 1.77 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 42.28 1p8c h LEU 84 CO 0.11 0.87 -0.01 0.44 0.09 0.00 0.00 178.44 179.94 1p8c h ASP 85 N 0.98 0.00 0.14 -0.43 3.32 -1.09 0.49 116.42 119.82 1p8c h ASP 85 Ca 0.22 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 57.07 1p8c h ASP 85 Cb 0.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 1p8c h ASP 85 CO -0.01 0.01 -0.77 0.40 -1.72 0.00 0.00 179.24 177.15 1p8c h ILE 86 N 0.00 1.35 -0.07 0.35 2.04 -1.31 -1.63 117.51 118.24 1p8c h ILE 86 Ca -0.00 -2.12 -0.22 0.00 1.00 0.00 0.00 64.86 63.52 1p8c h ILE 86 Cb 0.02 2.11 0.00 0.00 -0.74 0.00 0.00 36.82 38.21 1p8c h ILE 86 CO 0.00 0.65 -0.84 0.00 0.00 0.00 0.00 178.15 177.96 1p8c h ALA 87 N 0.79 0.40 -0.59 1.87 0.00 -0.62 -1.39 119.26 119.73 1p8c h ALA 87 Ca -0.04 -0.64 -0.06 0.00 0.00 0.00 0.00 54.91 54.16 1p8c h ALA 87 Cb 1.37 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 1p8c h ALA 87 CO 0.14 0.75 0.13 1.25 0.00 0.00 0.00 179.25 181.52 1p8c h LEU 88 N 0.35 0.90 -0.02 0.00 6.46 -0.05 0.17 115.31 123.13 1p8c h LEU 88 Ca -0.06 -0.24 -0.02 0.00 -0.12 0.00 0.00 57.88 57.44 1p8c h LEU 88 Cb 1.46 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 41.15 1p8c h LEU 88 CO 0.16 0.91 -0.07 0.58 -0.62 0.00 0.00 178.44 179.39 1p8c h VAL 89 N 0.85 1.49 -0.71 1.05 2.07 -1.31 -1.20 116.25 118.50 1p8c h VAL 89 Ca 0.18 -1.56 -0.07 0.00 0.82 0.00 0.00 66.70 66.07 1p8c h VAL 89 Cb 0.36 2.49 -0.03 0.00 -1.52 0.00 0.00 31.29 32.59 1p8c h VAL 89 CO 0.00 0.42 0.17 0.58 0.02 0.00 0.00 177.57 178.76 1p8c h VAL 90 N -0.52 1.26 -0.00 2.57 2.07 -1.26 -3.17 116.25 117.19 1p8c h VAL 90 Ca -0.00 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 66.54 1p8c h VAL 90 Cb 0.72 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1p8c h VAL 90 CO 0.02 0.38 -0.16 0.61 0.02 0.00 0.00 177.57 178.43 1p8c n GLY 91 N -0.66 -0.84 0.05 2.17 0.00 0.60 -5.06 105.19 101.45 1p8c n GLY 91 Ca 0.05 -0.31 0.01 0.00 0.00 0.00 0.00 46.02 45.77 1p8c n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p8c n GLY 92 N 1.30 -1.43 0.16 -0.02 0.00 -0.45 -4.44 105.19 100.31 1p8c n GLY 92 Ca 0.13 -1.52 0.13 0.00 0.00 0.00 0.00 46.02 44.77 1p8c n GLY 92 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1p8c h SER 93 N -0.04 0.00 0.42 1.61 4.64 -1.93 -2.76 113.55 115.49 1p8c h SER 93 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1p8c h SER 93 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1p8c h SER 93 CO 0.00 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.26 1p8c n ILE 94 N -2.44 1.14 0.08 0.95 -6.64 -1.26 -1.71 119.36 109.49 1p8c n ILE 94 Ca 0.02 0.34 0.02 0.00 -1.77 0.00 0.00 62.75 61.36 1p8c n ILE 94 Cb 0.25 -1.22 -0.03 0.00 -1.44 0.00 0.00 39.64 37.21 1p8c n ILE 94 CO 0.00 0.00 0.00 1.62 -1.77 0.00 0.00 176.55 176.40 1p8c h VAL 95 N 0.00 0.59 -0.95 7.28 3.04 -1.70 -3.37 116.25 121.13 1p8c h VAL 95 Ca 0.00 -1.98 0.29 0.00 -1.01 0.00 0.00 66.70 64.00 1p8c h VAL 95 Cb 0.21 2.14 -0.15 0.00 -2.01 0.00 0.00 31.29 31.48 1p8c h VAL 95 CO 0.00 0.34 0.40 0.40 -1.01 0.00 0.00 177.57 177.70 1p8c h ILE 96 N 0.00 0.28 -0.49 3.17 2.04 -1.51 0.69 117.51 121.69 1p8c h ILE 96 Ca -0.08 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 1p8c h ILE 96 Cb 1.45 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1p8c h ILE 96 CO 0.05 0.05 0.17 -0.65 0.00 0.00 0.00 178.15 177.76 1p8c h PRO 97 N 0.25 0.71 -0.21 2.37 0.11 -1.75 -1.31 132.00 132.16 1p8c h PRO 97 Ca 0.66 -0.11 -0.10 0.00 0.11 0.00 0.00 66.00 66.55 1p8c h PRO 97 Cb 1.44 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.41 1p8c h PRO 97 CO -0.65 0.61 -0.31 0.45 -0.21 0.00 0.00 178.00 177.89 1p8c h HIS 98 N 0.70 0.48 -0.66 0.65 3.86 0.09 -2.16 115.15 118.11 1p8c h HIS 98 Ca 0.17 -0.11 -0.04 0.00 -1.16 0.00 0.00 60.37 59.23 1p8c h HIS 98 Cb 0.19 -0.11 -0.03 0.00 1.06 0.00 0.00 27.41 28.51 1p8c h HIS 98 CO 0.01 0.69 0.27 1.25 0.86 0.00 0.00 177.93 181.01 1p8c h LEU 99 N 0.37 0.88 0.31 2.43 5.85 -0.47 -1.40 115.31 123.28 1p8c h LEU 99 Ca 0.05 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1p8c h LEU 99 Cb 0.72 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.52 1p8c h LEU 99 CO 0.06 0.78 -0.18 0.03 -0.34 0.00 0.00 178.44 178.79 1p8c h ARG 100 N 0.95 -0.45 -0.65 1.25 3.08 -0.60 -2.49 114.38 115.46 1p8c h ARG 100 Ca 0.22 0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.30 1p8c h ARG 100 Cb 0.17 0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.30 1p8c h ARG 100 CO -0.02 -0.30 0.38 0.00 -1.07 0.00 0.00 179.97 178.96 1p8c h ARG 101 N -0.47 0.89 -0.00 0.04 3.08 -1.33 -2.36 114.38 114.23 1p8c h ARG 101 Ca -0.03 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1p8c h ARG 101 Cb 0.38 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 1p8c h ARG 101 CO 0.04 0.64 0.00 0.00 -1.07 0.00 0.00 179.97 179.59 1p8c h ALA 102 N 1.19 1.57 0.11 0.04 0.00 -1.13 -1.92 119.26 119.12 1p8c h ALA 102 Ca 0.23 -0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.93 1p8c h ALA 102 Cb -0.01 0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.81 1p8c h ALA 102 CO -0.04 -0.01 -0.91 0.28 0.00 0.00 0.00 179.25 178.57 1p8c h VAL 103 N 0.00 1.42 0.00 0.00 2.07 -0.96 -0.57 116.25 118.20 1p8c h VAL 103 Ca 0.00 -2.40 0.00 0.00 0.82 0.00 0.00 66.70 65.12 1p8c h VAL 103 Cb 0.01 2.90 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 1p8c h VAL 103 CO -0.00 0.70 0.00 0.61 0.02 0.00 0.00 177.57 178.90 1p8c n GLY 104 N 1.43 -1.23 0.14 2.17 0.00 -0.92 -2.11 105.19 104.67 1p8c n GLY 104 Ca -0.13 0.07 -0.21 0.00 0.00 0.00 0.00 46.02 45.75 1p8c n GLY 104 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1p8c n PHE 105 N -2.14 1.04 -0.02 1.61 7.35 -0.77 -3.24 117.46 121.29 1p8c n PHE 105 Ca 0.02 0.23 0.01 0.00 -0.76 0.00 0.00 57.45 56.95 1p8c n PHE 105 Cb 0.22 -1.13 0.34 0.00 0.35 0.00 0.00 39.48 39.25 1p8c n PHE 105 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 1p8c h LEU 106 N -0.00 0.52 0.00 -2.13 5.85 -0.76 -2.07 115.31 116.72 1p8c h LEU 106 Ca -0.45 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.19 1p8c h LEU 106 Cb 1.98 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.87 1p8c h LEU 106 CO 0.04 0.49 -0.50 1.05 -0.34 0.00 0.00 178.44 179.19 1p8c h GLU 107 N 0.57 0.00 -0.45 1.25 4.11 -1.59 -2.08 114.58 116.40 1p8c h GLU 107 Ca 0.14 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.45 1p8c h GLU 107 Cb 0.14 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1p8c h GLU 107 CO -0.01 0.06 -0.21 1.49 0.07 0.00 0.00 179.01 180.40 1p8c h GLU 108 N 0.00 0.90 -0.38 1.06 4.81 -1.36 -1.45 114.58 118.16 1p8c h GLU 108 Ca -0.01 -0.37 -0.11 0.00 -0.13 0.00 0.00 59.36 58.74 1p8c h GLU 108 Cb 1.06 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 1p8c h GLU 108 CO 0.01 1.02 -0.21 -0.07 -0.73 0.00 0.00 179.01 179.03 1p8c h LEU 109 N 0.78 0.84 -1.54 1.64 3.38 -1.37 -0.12 115.31 118.91 1p8c h LEU 109 Ca 0.11 -0.41 0.01 0.00 0.09 0.00 0.00 57.88 57.67 1p8c h LEU 109 Cb 0.76 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1p8c h LEU 109 CO 0.06 1.07 0.31 0.03 0.09 0.00 0.00 178.44 180.01 1p8c h ARG 110 N 0.61 0.61 -0.00 1.13 2.47 -1.19 0.33 114.38 118.34 1p8c h ARG 110 Ca 0.08 -0.04 -0.17 0.00 -1.26 0.00 0.00 59.98 58.59 1p8c h ARG 110 Cb 0.77 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.93 1p8c h ARG 110 CO 0.06 0.41 -0.81 1.49 0.56 0.00 0.00 179.97 181.68 1p8c h GLU 111 N 0.63 0.04 -0.05 0.04 4.81 -1.01 -0.58 114.58 118.46 1p8c h GLU 111 Ca 0.17 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 1p8c h GLU 111 Cb -0.06 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.33 1p8c h GLU 111 CO -0.04 0.82 -0.05 0.52 -0.73 0.00 0.00 179.01 179.54 1p8c h MET 112 N 0.02 0.12 0.00 1.92 2.86 0.61 -2.69 114.93 117.77 1p8c h MET 112 Ca -0.01 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 57.51 1p8c h MET 112 Cb 1.42 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.08 1p8c h MET 112 CO 0.11 0.57 -0.26 1.05 1.06 0.00 0.00 176.91 179.44 1p8c h GLU 113 N -0.32 0.00 -0.43 1.72 4.11 -0.37 0.84 114.58 120.13 1p8c h GLU 113 Ca 0.01 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.35 1p8c h GLU 113 Cb 0.54 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 1p8c h GLU 113 CO 0.01 0.26 -0.11 1.57 0.07 0.00 0.00 179.01 180.81 1p8c h LYS 114 N 0.00 0.78 -1.02 1.06 2.10 -0.97 -0.80 116.57 117.72 1p8c h LYS 114 Ca -0.00 -0.26 -0.27 0.00 -2.00 0.00 0.00 60.65 58.13 1p8c h LYS 114 Cb 0.59 -0.07 -0.16 0.00 -0.90 0.00 0.00 32.23 31.69 1p8c h LYS 114 CO 0.03 0.85 0.34 0.09 -2.00 0.00 0.00 179.45 178.77 1p8c n ASN 115 N -4.17 3.49 -3.77 7.07 4.13 -0.93 -4.88 115.26 116.21 1p8c n ASN 115 Ca 0.01 -2.83 -0.28 0.00 1.68 0.00 0.00 54.58 53.16 1p8c n ASN 115 Cb 0.36 -0.69 -0.03 0.00 -1.54 0.00 0.00 39.78 37.89 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 -0.31 -0.45 3.84 7.41 0.00 -0.31 -4.94 105.19 110.43 1p8c n GLY 116 Ca 0.30 0.08 -0.35 0.00 0.00 0.00 0.00 46.02 46.06 1p8c n GLY 116 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1p8c s GLU 117 N -6.42 4.04 0.02 1.61 2.02 0.25 -4.99 118.70 115.22 1p8c s GLU 117 Ca 0.55 0.60 -0.30 0.00 0.02 0.00 0.00 54.97 55.83 1p8c s GLU 117 Cb -0.31 -2.83 -0.06 0.00 0.10 0.00 0.00 34.13 31.04 1p8c s GLU 117 CO 0.67 0.40 1.47 0.99 0.02 0.00 0.00 175.26 178.81 1p8c s THR 118 N -1.58 3.54 -0.37 3.63 2.01 -1.26 -4.34 115.64 117.26 1p8c s THR 118 Ca 0.42 0.94 0.02 0.00 0.31 0.00 0.00 61.69 63.38 1p8c s THR 118 Cb -0.14 -3.60 0.10 0.00 0.01 0.00 0.00 72.50 68.87 1p8c s THR 118 CO 0.20 -0.00 0.11 0.27 -0.69 0.00 0.00 174.62 174.50 1p8c s ILE 119 N 2.48 2.64 0.00 1.82 -4.36 -1.26 -5.06 121.20 117.46 1p8c s ILE 119 Ca 0.66 -2.27 0.00 0.00 -0.26 0.00 0.00 60.65 58.78 1p8c s ILE 119 Cb -0.33 -2.89 0.00 0.00 1.25 0.00 0.00 42.46 40.48 1p8c s ILE 119 CO 0.28 -0.64 0.25 -1.54 0.24 0.00 0.00 174.94 173.53