#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p8r s PRO 7 N 0.00 3.14 -0.08 1.64 0.04 -1.26 -4.15 135.00 134.33 1p8r s PRO 7 Ca 0.00 -0.54 0.00 0.00 0.04 0.00 0.00 61.00 60.50 1p8r s PRO 7 Cb 0.00 -2.61 -0.03 0.00 0.04 0.00 0.00 34.50 31.90 1p8r s PRO 7 CO 0.00 -0.15 -0.06 0.42 0.04 0.00 0.00 177.00 177.25 1p8r s ILE 8 N -2.46 3.81 -0.20 0.56 -1.09 0.11 -1.27 121.20 120.66 1p8r s ILE 8 Ca 0.46 -0.43 0.01 0.00 -2.23 0.00 0.00 60.65 58.46 1p8r s ILE 8 Cb -0.10 -2.57 0.04 0.00 -1.58 0.00 0.00 42.46 38.25 1p8r s ILE 8 CO 0.37 0.59 -0.09 -0.70 -1.23 0.00 0.00 174.94 173.88 1p8r s GLU 9 N -0.76 1.88 0.06 2.79 2.56 0.05 -0.39 118.70 124.89 1p8r s GLU 9 Ca 0.12 -0.80 -0.24 0.00 0.00 0.00 0.00 54.97 54.04 1p8r s GLU 9 Cb -0.11 -2.37 -0.06 0.00 2.00 0.00 0.00 34.13 33.59 1p8r s GLU 9 CO 0.02 -0.45 0.73 0.42 -0.56 0.00 0.00 175.26 175.42 1p8r s ILE 10 N 1.44 4.69 -0.13 -3.70 1.09 0.12 -0.25 121.20 124.45 1p8r s ILE 10 Ca -0.01 1.57 -0.01 0.00 -1.10 0.00 0.00 60.65 61.09 1p8r s ILE 10 Cb -0.16 -4.08 0.04 0.00 -1.06 0.00 0.00 42.46 37.19 1p8r s ILE 10 CO -0.08 0.41 -0.03 -0.63 -0.10 0.00 0.00 174.94 174.51 1p8r s ILE 11 N -0.33 0.79 -0.04 2.92 1.01 0.14 -1.31 121.20 124.38 1p8r s ILE 11 Ca 0.36 -0.33 -0.29 0.00 0.00 0.00 0.00 60.65 60.40 1p8r s ILE 11 Cb -0.21 -0.98 -0.03 0.00 0.01 0.00 0.00 42.46 41.26 1p8r s ILE 11 CO 0.23 0.17 0.93 -0.83 0.00 0.00 0.00 174.94 175.44 1p8r s GLY 12 N 1.78 2.73 -0.56 6.18 0.00 0.40 -0.50 107.32 117.35 1p8r s GLY 12 Ca 0.03 0.42 0.07 0.00 0.00 0.00 0.00 44.72 45.23 1p8r s GLY 12 CO -0.07 1.64 0.74 0.00 0.00 0.00 0.00 173.10 175.41 1p8r n ALA 13 N 4.14 3.74 -1.86 3.20 0.00 0.42 -0.67 120.51 129.47 1p8r n ALA 13 Ca 0.05 -4.41 -0.33 0.00 0.00 0.00 0.00 53.44 48.75 1p8r n ALA 13 Cb 0.51 -0.85 -0.06 0.00 0.00 0.00 0.00 19.45 19.04 1p8r n ALA 13 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1p8r n PRO 14 N 0.73 1.69 -4.78 0.00 -0.04 -1.26 -0.22 135.00 131.12 1p8r n PRO 14 Ca 0.28 -2.37 -0.28 0.00 -0.04 0.00 0.00 63.50 61.09 1p8r n PRO 14 Cb 0.45 -3.51 -0.14 0.00 -0.04 0.00 0.00 33.50 30.25 1p8r n PRO 14 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1p8r s PHE 15 N 9.04 2.12 0.00 0.54 5.36 -1.26 -4.75 117.98 129.03 1p8r s PHE 15 Ca 0.65 -0.40 0.00 0.00 -0.96 0.00 0.00 56.93 56.22 1p8r s PHE 15 Cb 0.04 -1.26 0.00 0.00 -0.34 0.00 0.00 43.02 41.45 1p8r s PHE 15 CO 0.13 0.12 0.08 -1.13 -1.46 0.00 0.00 175.22 172.96 1p8r n SER 16 N 1.77 0.13 0.00 6.13 3.41 -1.26 -1.39 113.62 122.41 1p8r n SER 16 Ca -0.17 -1.00 0.08 0.00 -0.26 0.00 0.00 58.87 57.52 1p8r n SER 16 Cb 0.52 0.00 0.39 0.00 -0.26 0.00 0.00 64.21 64.87 1p8r n SER 16 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1p8r n LYS 17 N -0.00 0.16 0.00 4.33 4.01 -1.26 -2.41 118.16 122.99 1p8r n LYS 17 Ca 0.00 0.16 0.14 0.00 -0.51 0.00 0.00 58.31 58.09 1p8r n LYS 17 Cb 0.22 -1.50 0.65 0.00 -0.51 0.00 0.00 35.03 33.89 1p8r n LYS 17 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1p8r n GLY 18 N 0.13 -1.32 3.68 0.72 0.00 -1.26 -4.73 105.19 102.40 1p8r n GLY 18 Ca 0.07 -0.11 -0.11 0.00 0.00 0.00 0.00 46.02 45.86 1p8r n GLY 18 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1p8r s GLN 19 N -2.77 2.09 0.02 1.61 1.03 -1.01 -0.60 119.66 120.02 1p8r s GLN 19 Ca 0.20 -1.55 -0.09 0.00 0.04 0.00 0.00 55.36 53.96 1p8r s GLN 19 Cb 0.18 0.55 -0.31 0.00 0.03 0.00 0.00 33.01 33.46 1p8r s GLN 19 CO 0.46 -0.94 0.94 -1.00 -2.54 0.00 0.00 175.29 172.22 1p8r h PRO 20 N 2.05 0.39 -6.23 9.60 0.13 -1.90 -3.46 132.00 132.57 1p8r h PRO 20 Ca -0.30 -0.67 -0.56 0.00 -0.87 0.00 0.00 66.00 63.60 1p8r h PRO 20 Cb 1.25 0.25 -0.02 0.00 0.13 0.00 0.00 31.00 32.60 1p8r h PRO 20 CO 0.39 1.30 1.03 1.03 -0.23 0.00 0.00 178.00 181.53 1p8r s ARG 21 N -2.61 4.13 0.77 0.86 0.52 -1.26 -5.02 118.95 116.33 1p8r s ARG 21 Ca -0.09 1.92 -0.10 0.00 -0.52 0.00 0.00 55.73 56.93 1p8r s ARG 21 Cb 0.06 -3.92 0.07 0.00 0.52 0.00 0.00 34.95 31.67 1p8r s ARG 21 CO 0.90 -0.88 1.12 0.20 0.02 0.00 0.00 175.30 176.65 1p8r s GLY 22 N 3.04 1.62 0.00 -3.53 0.00 -1.26 -4.32 107.32 102.87 1p8r s GLY 22 Ca 0.67 -0.73 0.00 0.00 0.00 0.00 0.00 44.72 44.66 1p8r s GLY 22 CO 0.25 -0.27 0.00 0.61 0.00 0.00 0.00 173.10 173.68 1p8r n GLY 23 N -3.16 1.40 0.26 0.20 0.00 -1.26 -4.89 105.19 97.75 1p8r n GLY 23 Ca 0.08 -0.10 0.14 0.00 0.00 0.00 0.00 46.02 46.14 1p8r n GLY 23 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1p8r h VAL 24 N 0.00 0.34 0.00 1.61 2.07 -1.80 -1.03 116.25 117.44 1p8r h VAL 24 Ca 0.00 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 66.88 1p8r h VAL 24 Cb 0.00 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1p8r h VAL 24 CO 0.00 0.10 0.00 -1.84 0.02 0.00 0.00 177.57 175.85 1p8r n GLU 25 N -3.35 0.39 0.00 1.57 0.00 -1.26 -1.08 120.64 116.91 1p8r n GLU 25 Ca -0.01 0.07 0.12 0.00 0.00 0.00 0.00 57.16 57.34 1p8r n GLU 25 Cb 0.29 -1.50 0.18 0.00 0.00 0.00 0.00 31.44 30.42 1p8r n GLU 25 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1p8r n LYS 26 N -1.18 1.48 -0.14 3.44 5.02 -0.39 -4.40 118.16 121.99 1p8r n LYS 26 Ca 0.11 -1.12 -0.06 0.00 -2.02 0.00 0.00 58.31 55.22 1p8r n LYS 26 Cb 0.12 -1.48 0.03 0.00 -0.02 0.00 0.00 35.03 33.68 1p8r n LYS 26 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1p8r h GLY 27 N 4.83 0.61 0.46 0.72 0.00 -1.23 -1.03 103.07 107.43 1p8r h GLY 27 Ca 0.00 -0.16 0.06 0.00 0.00 0.00 0.00 47.33 47.22 1p8r h GLY 27 CO 0.00 0.12 -0.05 -2.55 0.00 0.00 0.00 176.54 174.06 1p8r h PRO 28 N 0.46 0.03 -0.56 4.80 0.11 -1.77 0.01 132.00 135.08 1p8r h PRO 28 Ca 0.19 -0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.20 1p8r h PRO 28 Cb 0.08 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.16 1p8r h PRO 28 CO -0.12 0.02 -0.03 0.00 -0.21 0.00 0.00 178.00 177.66 1p8r h ALA 29 N 1.28 0.90 -0.34 -0.75 0.00 -1.81 -0.31 119.26 118.24 1p8r h ALA 29 Ca 0.14 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1p8r h ALA 29 Cb 0.21 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1p8r h ALA 29 CO -0.28 0.65 0.15 0.00 0.00 0.00 0.00 179.25 179.77 1p8r h ALA 30 N 1.07 0.44 -0.99 0.00 0.00 -0.87 0.49 119.26 119.40 1p8r h ALA 30 Ca 0.16 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1p8r h ALA 30 Cb 0.56 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 1p8r h ALA 30 CO 0.03 0.02 0.65 -0.07 0.00 0.00 0.00 179.25 179.87 1p8r h LEU 31 N 0.41 1.07 -0.51 0.00 3.38 -0.69 -0.58 115.31 118.38 1p8r h LEU 31 Ca 0.11 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.91 1p8r h LEU 31 Cb 0.15 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1p8r h LEU 31 CO -0.01 0.72 -0.66 0.03 0.09 0.00 0.00 178.44 178.61 1p8r h ARG 32 N 1.23 0.35 -0.43 1.13 3.08 -0.46 -2.78 114.38 116.51 1p8r h ARG 32 Ca 0.40 -0.26 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 1p8r h ARG 32 Cb 0.03 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 1p8r h ARG 32 CO -0.13 0.89 0.24 -0.22 -1.07 0.00 0.00 179.97 179.68 1p8r h LYS 33 N 0.25 0.61 0.00 0.04 1.63 0.94 -0.91 116.57 119.13 1p8r h LYS 33 Ca -0.02 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.71 1p8r h LYS 33 Cb 1.20 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.71 1p8r h LYS 33 CO 0.11 0.48 0.00 0.00 -3.45 0.00 0.00 179.45 176.59 1p8r n ALA 34 N -2.26 1.42 -1.23 5.00 0.00 -0.32 -4.84 120.51 118.28 1p8r n ALA 34 Ca 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1p8r n ALA 34 Cb 0.08 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1p8r n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p8r n GLY 35 N -0.78 0.96 0.14 0.00 0.00 -0.35 -5.01 105.19 100.16 1p8r n GLY 35 Ca 0.03 -0.56 -0.07 0.00 0.00 0.00 0.00 46.02 45.41 1p8r n GLY 35 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1p8r h LEU 36 N 0.00 -0.29 -0.16 0.99 5.85 -1.63 -2.03 115.31 118.04 1p8r h LEU 36 Ca 0.00 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 1p8r h LEU 36 Cb 0.61 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 1p8r h LEU 36 CO 0.00 -0.10 0.09 0.58 -0.34 0.00 0.00 178.44 178.67 1p8r h VAL 37 N -0.01 1.09 -0.35 1.05 2.07 -1.86 -1.63 116.25 116.62 1p8r h VAL 37 Ca 0.14 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 67.44 1p8r h VAL 37 Cb 0.22 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1p8r h VAL 37 CO -0.31 0.09 0.16 -0.33 0.02 0.00 0.00 177.57 177.19 1p8r h GLU 38 N 0.16 0.32 0.00 1.57 3.07 -1.91 -1.59 114.58 116.19 1p8r h GLU 38 Ca 0.06 -0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 58.84 1p8r h GLU 38 Cb 0.06 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 1p8r h GLU 38 CO -0.01 0.21 -0.26 0.87 -1.40 0.00 0.00 179.01 178.42 1p8r h LYS 39 N 0.33 0.00 0.00 2.33 1.57 -1.30 -2.33 116.57 117.16 1p8r h LYS 39 Ca 0.15 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.81 1p8r h LYS 39 Cb 0.09 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 1p8r h LYS 39 CO -0.12 0.26 -0.58 -0.07 -0.57 0.00 0.00 179.45 178.37 1p8r h LEU 40 N 0.00 0.00 -0.16 2.94 3.38 -0.62 -2.59 115.31 118.26 1p8r h LEU 40 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1p8r h LEU 40 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1p8r h LEU 40 CO 0.03 0.58 0.00 0.29 0.09 0.00 0.00 178.44 179.43 1p8r n LYS 41 N -3.58 0.15 0.00 1.13 5.02 -0.66 -2.25 118.16 117.96 1p8r n LYS 41 Ca -0.00 0.21 0.16 0.00 -2.02 0.00 0.00 58.31 56.66 1p8r n LYS 41 Cb 0.64 -1.71 0.87 0.00 -0.02 0.00 0.00 35.03 34.81 1p8r n LYS 41 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1p8r n GLU 42 N -1.98 1.06 -2.99 1.97 1.02 -0.98 -4.84 120.64 113.91 1p8r n GLU 42 Ca 0.05 -0.14 -0.19 0.00 -0.02 0.00 0.00 57.16 56.86 1p8r n GLU 42 Cb 0.33 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 30.30 1p8r n GLU 42 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1p8r s THR 43 N -2.03 2.43 0.46 2.62 -4.23 -0.96 -5.00 115.64 108.93 1p8r s THR 43 Ca 0.45 -0.97 0.40 0.00 -1.18 0.00 0.00 61.69 60.40 1p8r s THR 43 Cb 0.22 -2.46 0.42 0.00 1.34 0.00 0.00 72.50 72.02 1p8r s THR 43 CO 0.37 0.00 2.23 1.05 -0.54 0.00 0.00 174.62 177.73 1p8r h GLU 44 N 0.28 0.00 -6.83 3.99 4.11 -1.85 -3.44 114.58 110.84 1p8r h GLU 44 Ca -0.34 0.00 -0.48 0.00 0.07 0.00 0.00 59.36 58.62 1p8r h GLU 44 Cb 1.28 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.51 1p8r h GLU 44 CO 0.42 0.00 0.20 0.71 0.07 0.00 0.00 179.01 180.42 1p8r s TYR 45 N -3.99 3.41 -0.04 2.06 1.51 -1.26 -5.00 117.35 114.04 1p8r s TYR 45 Ca -0.03 1.41 -0.21 0.00 -1.01 0.00 0.00 57.07 57.24 1p8r s TYR 45 Cb 0.12 -2.68 -0.05 0.00 -0.11 0.00 0.00 41.96 39.24 1p8r s TYR 45 CO 0.46 0.06 0.60 1.21 -1.11 0.00 0.00 175.55 176.77 1p8r s ASN 46 N -2.12 6.92 -0.13 2.29 3.84 -1.26 -4.74 114.94 119.75 1p8r s ASN 46 Ca 0.55 1.10 0.00 0.00 0.21 0.00 0.00 52.86 54.73 1p8r s ASN 46 Cb -0.11 -2.36 -0.01 0.00 -0.55 0.00 0.00 41.25 38.21 1p8r s ASN 46 CO 0.17 0.03 -0.15 -0.69 -2.79 0.00 0.00 177.10 173.67 1p8r s VAL 47 N 0.20 2.90 -0.00 -5.21 1.01 -1.26 0.05 120.40 118.08 1p8r s VAL 47 Ca 0.32 -0.72 0.08 0.00 0.00 0.00 0.00 61.98 61.66 1p8r s VAL 47 Cb -0.17 -2.20 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 1p8r s VAL 47 CO 0.16 0.53 -0.24 -0.60 0.00 0.00 0.00 175.10 174.95 1p8r s ARG 48 N 0.36 1.87 -0.30 2.72 3.52 0.47 -4.96 118.95 122.64 1p8r s ARG 48 Ca -0.12 -0.91 -0.00 0.00 -0.13 0.00 0.00 55.73 54.57 1p8r s ARG 48 Cb -0.16 -1.86 0.06 0.00 -1.56 0.00 0.00 34.95 31.42 1p8r s ARG 48 CO 0.06 0.50 -0.01 0.34 -0.81 0.00 0.00 175.30 175.38 1p8r s ASP 49 N -0.73 4.80 0.48 -2.12 -1.08 -1.26 -0.70 116.67 116.05 1p8r s ASP 49 Ca 0.10 -1.41 0.31 0.00 -0.52 0.00 0.00 52.55 51.03 1p8r s ASP 49 Cb -0.09 -1.68 1.27 0.00 -1.46 0.00 0.00 42.92 40.96 1p8r s ASP 49 CO -0.00 -0.27 1.92 -0.74 0.52 0.00 0.00 175.17 176.59 1p8r h HIS 50 N 7.92 0.00 0.00 -5.34 -0.00 -1.56 -3.48 115.15 112.69 1p8r h HIS 50 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.18 1p8r h HIS 50 Cb 1.05 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.46 1p8r h HIS 50 CO 0.61 0.00 0.00 0.41 -0.00 0.00 0.00 177.93 178.95 1p8r n GLY 51 N 0.04 -1.91 3.80 5.26 0.00 -1.25 -4.89 105.19 106.24 1p8r n GLY 51 Ca 0.01 -1.71 -0.37 0.00 0.00 0.00 0.00 46.02 43.95 1p8r n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1p8r s ASP 52 N -4.00 6.58 0.66 1.61 1.01 -1.26 -0.45 116.67 120.82 1p8r s ASP 52 Ca 0.00 0.69 -0.17 0.00 0.71 0.00 0.00 52.55 53.78 1p8r s ASP 52 Cb 0.00 -2.19 0.00 0.00 1.01 0.00 0.00 42.92 41.74 1p8r s ASP 52 CO 0.00 0.24 1.21 -0.76 0.21 0.00 0.00 175.17 176.07 1p8r s LEU 53 N -0.40 3.48 -0.41 1.23 1.43 0.16 -4.89 118.68 119.27 1p8r s LEU 53 Ca 0.19 2.37 -0.15 0.00 -1.03 0.00 0.00 54.13 55.52 1p8r s LEU 53 Cb -0.14 -4.59 0.03 0.00 0.03 0.00 0.00 46.19 41.51 1p8r s LEU 53 CO 0.08 -1.93 0.30 0.00 0.23 0.00 0.00 176.35 175.03 1p8r s ALA 54 N -1.79 3.47 -0.21 4.21 0.00 -1.26 -4.75 121.76 121.43 1p8r s ALA 54 Ca 0.76 -1.76 -0.17 0.00 0.00 0.00 0.00 51.96 50.79 1p8r s ALA 54 Cb -0.30 -2.88 -0.04 0.00 0.00 0.00 0.00 23.12 19.90 1p8r s ALA 54 CO 0.40 -1.48 0.44 -0.06 0.00 0.00 0.00 175.76 175.06 1p8r s PHE 55 N 1.67 3.36 -0.43 0.00 0.08 -1.26 -5.04 117.98 116.35 1p8r s PHE 55 Ca 0.05 0.65 -0.29 0.00 0.12 0.00 0.00 56.93 57.46 1p8r s PHE 55 Cb -0.20 -2.59 0.03 0.00 -0.57 0.00 0.00 43.02 39.69 1p8r s PHE 55 CO 0.09 -0.07 1.13 0.14 -0.10 0.00 0.00 175.22 176.41 1p8r s VAL 56 N 1.53 4.28 0.39 -0.44 -7.23 -1.26 -5.00 120.40 112.66 1p8r s VAL 56 Ca 0.20 1.36 -0.27 0.00 -1.81 0.00 0.00 61.98 61.47 1p8r s VAL 56 Cb -0.15 -4.54 -0.09 0.00 0.56 0.00 0.00 36.38 32.15 1p8r s VAL 56 CO 0.09 -0.86 1.31 -0.62 -0.31 0.00 0.00 175.10 174.71 1p8r s ASP 57 N 2.28 6.42 -0.38 4.85 -1.08 -1.26 -4.91 116.67 122.58 1p8r s ASP 57 Ca 0.48 2.68 -0.07 0.00 -0.52 0.00 0.00 52.55 55.12 1p8r s ASP 57 Cb -0.09 -2.64 0.07 0.00 -1.46 0.00 0.00 42.92 38.80 1p8r s ASP 57 CO 0.27 -0.78 0.18 -0.69 0.52 0.00 0.00 175.17 174.68 1p8r s VAL 58 N -1.23 3.87 0.04 1.11 1.01 -1.26 -5.03 120.40 118.91 1p8r s VAL 58 Ca 0.55 -1.40 -0.09 0.00 0.00 0.00 0.00 61.98 61.04 1p8r s VAL 58 Cb -0.39 -3.34 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 1p8r s VAL 58 CO 0.51 -0.40 1.15 -0.65 0.00 0.00 0.00 175.10 175.71 1p8r h PRO 59 N 8.27 -0.04 -2.99 2.72 0.11 -2.02 -3.17 132.00 134.88 1p8r h PRO 59 Ca -0.21 0.00 -0.73 0.00 0.11 0.00 0.00 66.00 65.17 1p8r h PRO 59 Cb 1.08 0.01 -0.10 0.00 0.11 0.00 0.00 31.00 32.09 1p8r h PRO 59 CO 0.68 -0.02 2.59 0.09 -0.21 0.00 0.00 178.00 181.13 1p8r n ASN 60 N -3.54 7.13 -4.18 -2.05 3.02 -1.26 -4.84 115.26 109.53 1p8r n ASN 60 Ca 0.00 -3.03 -0.44 0.00 -0.03 0.00 0.00 54.58 51.09 1p8r n ASN 60 Cb 0.08 -1.44 0.00 0.00 -0.61 0.00 0.00 39.78 37.81 1p8r n ASN 60 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1p8r n ASP 61 N 2.85 5.65 -4.80 6.41 -0.08 -1.20 -5.01 116.55 120.36 1p8r n ASP 61 Ca 0.58 -3.15 -0.34 0.00 -1.51 0.00 0.00 54.79 50.37 1p8r n ASP 61 Cb 0.28 -1.41 -0.06 0.00 2.34 0.00 0.00 41.12 42.28 1p8r n ASP 61 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1p8r s SER 62 N 0.64 6.83 0.24 1.67 0.01 -1.26 -4.35 113.70 117.49 1p8r s SER 62 Ca 0.35 1.82 -0.31 0.00 1.31 0.00 0.00 55.95 59.12 1p8r s SER 62 Cb -0.01 -2.56 -0.12 0.00 0.21 0.00 0.00 66.02 63.55 1p8r s SER 62 CO 0.01 -0.44 1.69 -2.65 0.41 0.00 0.00 173.24 172.26 1p8r n PRO 63 N -0.46 2.78 -2.76 12.44 -0.02 -1.26 -4.63 135.00 141.10 1p8r n PRO 63 Ca 0.06 1.00 -0.42 0.00 -2.02 0.00 0.00 63.50 62.12 1p8r n PRO 63 Cb 0.52 -2.83 -0.04 0.00 -0.02 0.00 0.00 33.50 31.14 1p8r n PRO 63 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1p8r s PHE 64 N 0.78 2.58 0.00 6.00 5.36 0.76 -4.76 117.98 128.70 1p8r s PHE 64 Ca 0.71 -0.29 0.00 0.00 -0.96 0.00 0.00 56.93 56.39 1p8r s PHE 64 Cb -0.50 -4.36 0.00 0.00 -0.34 0.00 0.00 43.02 37.83 1p8r s PHE 64 CO 0.38 -1.72 0.00 1.04 -1.46 0.00 0.00 175.22 173.46 1p8r n GLN 65 N 8.16 0.00 -0.10 10.12 6.02 -1.26 -0.98 117.38 139.34 1p8r n GLN 65 Ca -0.01 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.85 1p8r n GLN 65 Cb 0.47 0.00 -0.14 0.00 1.02 0.00 0.00 30.24 31.58 1p8r n GLN 65 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1p8r n ILE 66 N 0.00 1.46 -1.68 5.09 5.41 -1.26 -4.95 119.36 123.43 1p8r n ILE 66 Ca 0.00 -0.75 -0.47 0.00 1.00 0.00 0.00 62.75 62.53 1p8r n ILE 66 Cb 0.00 -0.87 -0.04 0.00 -0.71 0.00 0.00 39.64 38.02 1p8r n ILE 66 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1p8r n VAL 67 N -2.97 0.32 -3.85 1.39 0.31 -0.15 -4.10 118.33 109.28 1p8r n VAL 67 Ca -0.36 -0.06 -0.30 0.00 -0.01 0.00 0.00 64.34 63.61 1p8r n VAL 67 Cb 1.09 -1.76 -0.04 0.00 -0.91 0.00 0.00 33.84 32.22 1p8r n VAL 67 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1p8r s LYS 68 N 2.62 3.49 -1.62 5.55 1.02 -1.05 -0.17 119.74 129.57 1p8r s LYS 68 Ca 0.86 -0.38 -0.09 0.00 0.02 0.00 0.00 55.97 56.38 1p8r s LYS 68 Cb -0.66 -2.97 0.08 0.00 -0.52 0.00 0.00 37.83 33.76 1p8r s LYS 68 CO 0.44 0.55 0.39 0.09 -0.92 0.00 0.00 175.35 175.90 1p8r n ASN 69 N 0.04 -0.84 -0.23 2.83 3.02 -1.26 -4.74 115.26 114.08 1p8r n ASN 69 Ca -0.05 -1.15 -0.02 0.00 -0.03 0.00 0.00 54.58 53.33 1p8r n ASN 69 Cb 0.52 -2.19 0.18 0.00 -0.61 0.00 0.00 39.78 37.67 1p8r n ASN 69 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1p8r h PRO 70 N -1.55 1.03 0.03 3.52 0.13 -1.82 -2.18 132.00 131.17 1p8r h PRO 70 Ca -0.63 -0.13 -0.23 0.00 -0.87 0.00 0.00 66.00 64.15 1p8r h PRO 70 Cb 1.39 -0.20 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 1p8r h PRO 70 CO 0.74 0.78 -1.00 0.00 -0.23 0.00 0.00 178.00 178.29 1p8r h ARG 71 N 1.03 0.32 -0.03 0.86 3.08 -1.88 -1.46 114.38 116.30 1p8r h ARG 71 Ca 0.26 -0.38 -0.00 0.00 0.07 0.00 0.00 59.98 59.92 1p8r h ARG 71 Cb 0.06 0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.23 1p8r h ARG 71 CO -0.04 1.09 -0.00 0.77 -1.07 0.00 0.00 179.97 180.72 1p8r h SER 72 N 0.16 0.05 -0.66 7.04 0.02 -1.87 -1.26 113.55 117.03 1p8r h SER 72 Ca -0.08 -0.34 -0.01 0.00 -0.84 0.00 0.00 61.79 60.51 1p8r h SER 72 Cb 1.65 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 64.15 1p8r h SER 72 CO 0.16 0.38 0.36 0.58 -1.14 0.00 0.00 176.83 177.18 1p8r h VAL 73 N -0.29 1.21 0.00 2.27 2.07 -1.47 -0.90 116.25 119.14 1p8r h VAL 73 Ca 0.01 -0.52 -0.10 0.00 0.82 0.00 0.00 66.70 66.90 1p8r h VAL 73 Cb 0.36 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1p8r h VAL 73 CO 0.00 0.23 -0.49 1.23 0.02 0.00 0.00 177.57 178.56 1p8r h GLY 74 N 0.91 0.00 1.40 2.17 0.00 -1.24 -2.25 103.07 104.06 1p8r h GLY 74 Ca 0.23 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.26 1p8r h GLY 74 CO -0.04 0.00 -1.40 1.70 0.00 0.00 0.00 176.54 176.80 1p8r h LYS 75 N 0.00 0.38 -0.33 4.80 1.63 -0.99 -2.86 116.57 119.20 1p8r h LYS 75 Ca -0.00 -0.65 -0.13 0.00 -0.85 0.00 0.00 60.65 59.02 1p8r h LYS 75 Cb 0.96 0.24 -0.01 0.00 -0.60 0.00 0.00 32.23 32.82 1p8r h LYS 75 CO 0.06 1.30 -0.33 0.00 -3.45 0.00 0.00 179.45 177.03 1p8r h ALA 76 N 0.38 0.81 0.00 5.00 0.00 -1.14 -2.72 119.26 121.59 1p8r h ALA 76 Ca -0.21 -0.42 -0.12 0.00 0.00 0.00 0.00 54.91 54.17 1p8r h ALA 76 Cb 2.06 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.71 1p8r h ALA 76 CO 0.22 0.65 -0.56 -0.91 0.00 0.00 0.00 179.25 178.65 1p8r h ASN 77 N 0.61 0.00 0.23 0.00 2.35 -1.50 -2.52 115.58 114.74 1p8r h ASN 77 Ca 0.06 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.70 1p8r h ASN 77 Cb 0.85 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.21 1p8r h ASN 77 CO 0.07 0.56 -0.44 -0.08 -1.65 0.00 0.00 177.43 175.90 1p8r h GLU 78 N 0.00 0.27 -0.04 0.81 4.81 -1.32 -1.87 114.58 117.24 1p8r h GLU 78 Ca -0.01 -0.13 -0.04 0.00 -0.13 0.00 0.00 59.36 59.05 1p8r h GLU 78 Cb 1.14 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1p8r h GLU 78 CO 0.07 0.66 -0.12 0.37 -0.73 0.00 0.00 179.01 179.26 1p8r h GLN 79 N 0.22 0.14 -1.00 1.92 4.15 -1.32 -3.06 115.11 116.15 1p8r h GLN 79 Ca 0.02 -0.11 0.09 0.00 0.77 0.00 0.00 58.65 59.42 1p8r h GLN 79 Cb 0.86 0.02 -0.08 0.00 0.21 0.00 0.00 27.48 28.50 1p8r h GLN 79 CO 0.07 0.73 0.64 1.25 -1.93 0.00 0.00 178.83 179.59 1p8r h LEU 80 N -0.42 0.98 0.40 -2.39 5.85 -1.36 -1.59 115.31 116.79 1p8r h LEU 80 Ca -0.00 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 1p8r h LEU 80 Cb 0.75 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1p8r h LEU 80 CO 0.03 0.57 -0.19 0.00 -0.34 0.00 0.00 178.44 178.50 1p8r h ALA 81 N 1.50 -0.54 -0.85 1.25 0.00 -1.27 0.63 119.26 119.98 1p8r h ALA 81 Ca 0.47 -0.13 0.16 0.00 0.00 0.00 0.00 54.91 55.41 1p8r h ALA 81 Cb 0.34 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 1p8r h ALA 81 CO -0.22 -0.78 0.56 0.00 0.00 0.00 0.00 179.25 178.81 1p8r h ALA 82 N -0.00 2.02 0.17 0.00 0.00 -1.30 0.25 119.26 120.40 1p8r h ALA 82 Ca -0.06 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1p8r h ALA 82 Cb 0.44 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1p8r h ALA 82 CO 0.09 -0.26 -0.08 0.28 0.00 0.00 0.00 179.25 179.28 1p8r h VAL 83 N 0.53 0.82 -0.87 0.00 2.07 -0.98 -2.86 116.25 114.95 1p8r h VAL 83 Ca 0.43 -1.09 0.09 0.00 0.82 0.00 0.00 66.70 66.95 1p8r h VAL 83 Cb 0.88 1.37 -0.07 0.00 -1.52 0.00 0.00 31.29 31.95 1p8r h VAL 83 CO -0.17 0.21 0.52 0.58 0.02 0.00 0.00 177.57 178.73 1p8r h VAL 84 N -0.86 0.95 -0.27 2.57 2.07 -0.29 0.06 116.25 120.48 1p8r h VAL 84 Ca -0.02 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 1p8r h VAL 84 Cb 0.52 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 1p8r h VAL 84 CO 0.04 0.16 0.03 0.00 0.02 0.00 0.00 177.57 177.82 1p8r h ALA 85 N 1.46 1.55 -0.20 1.67 0.00 -0.61 0.16 119.26 123.29 1p8r h ALA 85 Ca 0.41 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 1p8r h ALA 85 Cb 0.34 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1p8r h ALA 85 CO -0.23 0.33 -0.09 1.49 0.00 0.00 0.00 179.25 180.75 1p8r h GLU 86 N 0.38 0.41 -0.02 0.00 4.57 -0.76 0.49 114.58 119.65 1p8r h GLU 86 Ca 0.09 -0.18 -0.17 0.00 -1.18 0.00 0.00 59.36 57.92 1p8r h GLU 86 Cb 0.22 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.78 1p8r h GLU 86 CO 0.00 0.70 -0.75 1.79 -1.18 0.00 0.00 179.01 179.57 1p8r h THR 87 N 0.11 1.47 -0.03 0.32 1.35 -1.05 -1.97 112.91 113.11 1p8r h THR 87 Ca 0.05 -2.38 -0.13 0.00 -0.55 0.00 0.00 66.41 63.39 1p8r h THR 87 Cb 0.57 2.29 -0.02 0.00 -1.73 0.00 0.00 68.15 69.26 1p8r h THR 87 CO 0.03 0.69 -0.56 1.56 -0.25 0.00 0.00 175.52 176.99 1p8r h GLN 88 N 0.10 0.09 0.00 4.72 1.08 -0.96 -1.21 115.11 118.93 1p8r h GLN 88 Ca -0.02 -0.06 -0.00 0.00 -1.45 0.00 0.00 58.65 57.11 1p8r h GLN 88 Cb 1.32 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 28.76 1p8r h GLN 88 CO 0.11 0.63 -0.02 -0.22 -0.95 0.00 0.00 178.83 178.39 1p8r h LYS 89 N 0.07 0.00 -0.56 1.46 3.64 -0.53 -1.95 116.57 118.70 1p8r h LYS 89 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1p8r h LYS 89 Cb 1.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1p8r h LYS 89 CO 0.08 0.02 0.00 0.09 -2.27 0.00 0.00 179.45 177.36 1p8r n ASN 90 N -3.12 4.80 -3.37 4.20 3.02 -0.70 -4.96 115.26 115.13 1p8r n ASN 90 Ca 0.00 -2.62 -0.19 0.00 -0.03 0.00 0.00 54.58 51.74 1p8r n ASN 90 Cb 0.30 -0.58 0.08 0.00 -0.61 0.00 0.00 39.78 38.97 1p8r n ASN 90 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p8r n GLY 91 N 0.73 -0.38 3.16 7.41 0.00 -0.73 -5.03 105.19 110.35 1p8r n GLY 91 Ca 0.25 0.13 -0.22 0.00 0.00 0.00 0.00 46.02 46.17 1p8r n GLY 91 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1p8r s THR 92 N -3.33 1.27 0.07 2.61 -4.23 -0.54 -4.41 115.64 107.08 1p8r s THR 92 Ca 0.21 -0.91 -0.30 0.00 -1.18 0.00 0.00 61.69 59.51 1p8r s THR 92 Cb -0.09 -1.10 -0.05 0.00 1.34 0.00 0.00 72.50 72.59 1p8r s THR 92 CO 0.70 0.18 1.14 -0.63 -0.54 0.00 0.00 174.62 175.46 1p8r s ILE 93 N -0.65 4.18 -0.08 2.99 1.01 -0.40 -4.05 121.20 124.20 1p8r s ILE 93 Ca 0.05 1.61 -0.12 0.00 0.00 0.00 0.00 60.65 62.18 1p8r s ILE 93 Cb -0.07 -4.03 -0.05 0.00 0.01 0.00 0.00 42.46 38.32 1p8r s ILE 93 CO 0.01 0.15 0.31 -0.94 0.00 0.00 0.00 174.94 174.46 1p8r s SER 94 N 0.86 6.60 -0.30 3.58 1.04 -1.12 -0.77 113.70 123.59 1p8r s SER 94 Ca 0.56 0.71 0.02 0.00 0.48 0.00 0.00 55.95 57.72 1p8r s SER 94 Cb -0.28 -2.18 0.09 0.00 0.10 0.00 0.00 66.02 63.74 1p8r s SER 94 CO 0.30 0.28 0.02 -0.69 0.98 0.00 0.00 173.24 174.13 1p8r s VAL 95 N -0.64 1.74 -0.18 5.02 1.01 0.65 -0.87 120.40 127.13 1p8r s VAL 95 Ca 0.20 -1.76 -0.16 0.00 0.00 0.00 0.00 61.98 60.26 1p8r s VAL 95 Cb -0.14 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 1p8r s VAL 95 CO 0.08 -0.43 0.38 -0.69 0.00 0.00 0.00 175.10 174.45 1p8r s VAL 96 N 1.22 5.22 -0.35 2.92 1.01 -0.10 0.23 120.40 130.55 1p8r s VAL 96 Ca 0.04 0.70 -0.13 0.00 0.00 0.00 0.00 61.98 62.60 1p8r s VAL 96 Cb -0.19 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.47 1p8r s VAL 96 CO -0.11 0.30 0.23 -0.76 0.00 0.00 0.00 175.10 174.76 1p8r s LEU 97 N 1.01 4.55 0.19 3.92 1.43 0.34 -1.78 118.68 128.34 1p8r s LEU 97 Ca 0.19 -0.51 -0.30 0.00 -1.03 0.00 0.00 54.13 52.48 1p8r s LEU 97 Cb -0.14 -2.12 -0.08 0.00 0.03 0.00 0.00 46.19 43.88 1p8r s LEU 97 CO 0.07 -0.26 1.08 -0.83 0.23 0.00 0.00 176.35 176.64 1p8r s GLY 98 N 1.70 2.91 0.00 -3.19 0.00 -0.31 -0.43 107.32 107.99 1p8r s GLY 98 Ca 0.06 0.80 0.00 0.00 0.00 0.00 0.00 44.72 45.58 1p8r s GLY 98 CO 0.10 1.59 0.00 0.61 0.00 0.00 0.00 173.10 175.40 1p8r n GLY 99 N 1.90 0.00 3.88 0.20 0.00 0.70 -3.91 105.19 107.94 1p8r n GLY 99 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1p8r n GLY 99 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1p8r s ASP 100 N -0.28 6.15 0.00 1.61 1.47 -0.49 -2.27 116.67 122.86 1p8r s ASP 100 Ca 0.00 1.33 0.00 0.00 1.18 0.00 0.00 52.55 55.06 1p8r s ASP 100 Cb 0.00 -2.39 0.00 0.00 -0.34 0.00 0.00 42.92 40.19 1p8r s ASP 100 CO 0.00 -0.89 0.45 1.21 0.68 0.00 0.00 175.17 176.62 1p8r n GLU 101 N -2.72 0.61 0.10 2.11 2.13 -1.26 -2.77 120.64 118.83 1p8r n GLU 101 Ca 0.06 0.00 0.13 0.00 0.66 0.00 0.00 57.16 58.00 1p8r n GLU 101 Cb 0.54 -1.16 0.44 0.00 0.27 0.00 0.00 31.44 31.54 1p8r n GLU 101 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1p8r n SER 102 N -0.14 0.68 0.00 4.31 3.41 -1.26 -2.29 113.62 118.33 1p8r n SER 102 Ca 0.00 0.58 0.14 0.00 -0.26 0.00 0.00 58.87 59.34 1p8r n SER 102 Cb 0.08 -0.76 0.67 0.00 -0.26 0.00 0.00 64.21 63.94 1p8r n SER 102 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1p8r n MET 103 N -2.16 0.18 0.12 4.33 2.81 -1.12 -3.21 117.12 118.07 1p8r n MET 103 Ca 0.05 0.00 0.01 0.00 -1.81 0.00 0.00 57.70 55.95 1p8r n MET 103 Cb 0.38 -1.50 0.32 0.00 -0.71 0.00 0.00 33.22 31.70 1p8r n MET 103 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1p8r h ALA 104 N 3.17 1.33 0.14 3.04 0.00 -1.72 -0.98 119.26 124.24 1p8r h ALA 104 Ca 0.00 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.62 1p8r h ALA 104 Cb 0.41 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1p8r h ALA 104 CO 0.00 0.46 -0.34 0.82 0.00 0.00 0.00 179.25 180.19 1p8r h ILE 105 N 0.19 0.28 -0.47 0.00 2.04 -1.76 -0.06 117.51 117.74 1p8r h ILE 105 Ca 0.03 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.79 1p8r h ILE 105 Cb 0.58 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1p8r h ILE 105 CO 0.04 0.00 -0.10 1.23 0.00 0.00 0.00 178.15 179.32 1p8r h GLY 106 N -0.58 0.91 0.89 5.37 0.00 -1.66 -1.48 103.07 106.52 1p8r h GLY 106 Ca 0.03 -0.70 -0.02 0.00 0.00 0.00 0.00 47.33 46.64 1p8r h GLY 106 CO -0.19 0.64 -0.16 0.23 0.00 0.00 0.00 176.54 177.06 1p8r h SER 107 N 0.76 -0.39 -0.23 0.19 0.87 -0.86 -2.18 113.55 111.72 1p8r h SER 107 Ca 0.13 -0.06 -0.08 0.00 -1.23 0.00 0.00 61.79 60.55 1p8r h SER 107 Cb 0.61 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.65 1p8r h SER 107 CO 0.04 -0.18 -0.12 0.40 -0.53 0.00 0.00 176.83 176.44 1p8r h ILE 108 N -0.58 1.24 -0.02 2.23 2.04 -1.05 -2.55 117.51 118.83 1p8r h ILE 108 Ca -0.05 -1.09 -0.00 0.00 1.00 0.00 0.00 64.86 64.72 1p8r h ILE 108 Cb 0.42 1.10 -0.00 0.00 -0.74 0.00 0.00 36.82 37.60 1p8r h ILE 108 CO 0.08 0.36 0.00 0.28 0.00 0.00 0.00 178.15 178.88 1p8r h SER 109 N 0.57 0.03 -0.35 1.72 0.02 -1.21 0.94 113.55 115.27 1p8r h SER 109 Ca 0.10 -0.24 -0.10 0.00 -0.84 0.00 0.00 61.79 60.72 1p8r h SER 109 Cb 0.54 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.05 1p8r h SER 109 CO 0.03 0.26 -0.13 1.23 -1.14 0.00 0.00 176.83 177.08 1p8r h GLY 110 N -0.20 0.86 0.93 -3.77 0.00 -1.42 -2.88 103.07 96.59 1p8r h GLY 110 Ca 0.01 -0.67 -0.02 0.00 0.00 0.00 0.00 47.33 46.64 1p8r h GLY 110 CO 0.00 0.62 0.14 0.84 0.00 0.00 0.00 176.54 178.14 1p8r h HIS 111 N 0.72 0.56 0.00 5.60 6.17 -1.34 -2.51 115.15 124.35 1p8r h HIS 111 Ca 0.12 -0.04 0.00 0.00 0.71 0.00 0.00 60.37 61.15 1p8r h HIS 111 Cb 0.62 -0.17 0.00 0.00 2.52 0.00 0.00 27.41 30.39 1p8r h HIS 111 CO 0.03 0.52 0.00 0.00 0.71 0.00 0.00 177.93 179.19 1p8r n ALA 112 N -2.30 1.53 0.07 5.26 0.00 0.31 -1.72 120.51 123.67 1p8r n ALA 112 Ca -0.01 -0.04 -0.11 0.00 0.00 0.00 0.00 53.44 53.29 1p8r n ALA 112 Cb 0.14 -1.18 -0.01 0.00 0.00 0.00 0.00 19.45 18.40 1p8r n ALA 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p8r h ARG 113 N 0.00 0.32 0.05 0.00 3.08 -1.24 -2.25 114.38 114.34 1p8r h ARG 113 Ca 0.00 -0.32 -0.36 0.00 0.07 0.00 0.00 59.98 59.37 1p8r h ARG 113 Cb 0.19 0.09 -0.05 0.00 0.08 0.00 0.00 29.97 30.28 1p8r h ARG 113 CO 0.00 1.01 -2.11 0.28 -1.07 0.00 0.00 179.97 178.08 1p8r n VAL 114 N -3.74 1.62 -3.24 2.04 0.31 -0.97 -4.58 118.33 109.77 1p8r n VAL 114 Ca -0.05 -0.70 -0.25 0.00 -0.01 0.00 0.00 64.34 63.33 1p8r n VAL 114 Cb 0.79 -1.31 -0.06 0.00 -0.91 0.00 0.00 33.84 32.34 1p8r n VAL 114 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1p8r n HIS 115 N -3.22 2.52 0.00 3.52 8.25 -0.70 -4.93 115.22 120.65 1p8r n HIS 115 Ca -0.32 -3.96 0.00 0.00 -0.26 0.00 0.00 57.72 53.18 1p8r n HIS 115 Cb 1.05 -0.48 0.00 0.00 1.12 0.00 0.00 29.99 31.68 1p8r n HIS 115 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1p8r n PRO 116 N 0.65 0.00 0.00 -0.41 -0.04 -0.85 -1.46 135.00 132.89 1p8r n PRO 116 Ca 0.28 0.15 0.11 0.00 -0.04 0.00 0.00 63.50 64.00 1p8r n PRO 116 Cb 0.46 -1.53 0.08 0.00 -0.04 0.00 0.00 33.50 32.47 1p8r n PRO 116 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1p8r n ASP 117 N -1.11 2.75 -4.63 3.54 5.75 -1.26 -4.99 116.55 116.60 1p8r n ASP 117 Ca 0.00 -1.87 -0.32 0.00 -0.01 0.00 0.00 54.79 52.58 1p8r n ASP 117 Cb 0.03 0.04 0.14 0.00 -1.03 0.00 0.00 41.12 40.30 1p8r n ASP 117 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1p8r n LEU 118 N 1.12 3.08 -4.67 -2.12 -0.00 -0.54 -4.67 117.00 109.20 1p8r n LEU 118 Ca 0.12 0.48 -0.25 0.00 -0.00 0.00 0.00 56.01 56.36 1p8r n LEU 118 Cb 0.54 -1.44 -0.08 0.00 -0.00 0.00 0.00 43.42 42.44 1p8r n LEU 118 CO 0.15 -2.26 -0.25 0.00 -0.00 0.00 0.00 177.39 175.03 1p8r s VAL 120 N -2.54 1.29 -0.32 0.00 1.01 0.31 -1.38 120.40 118.77 1p8r s VAL 120 Ca 0.37 -0.58 -0.05 0.00 0.00 0.00 0.00 61.98 61.72 1p8r s VAL 120 Cb 0.01 -1.16 0.04 0.00 0.00 0.00 0.00 36.38 35.27 1p8r s VAL 120 CO 0.20 0.39 0.06 -0.63 0.00 0.00 0.00 175.10 175.12 1p8r s ILE 121 N 0.55 3.50 -0.64 2.22 1.01 -0.07 -0.54 121.20 127.24 1p8r s ILE 121 Ca -0.14 -1.15 -0.11 0.00 0.00 0.00 0.00 60.65 59.25 1p8r s ILE 121 Cb -0.16 -2.96 0.16 0.00 0.01 0.00 0.00 42.46 39.52 1p8r s ILE 121 CO 0.04 -0.10 0.53 0.86 0.00 0.00 0.00 174.94 176.27 1p8r s TRP 122 N 1.36 3.51 -0.32 3.97 -0.11 0.56 -1.34 118.94 126.58 1p8r s TRP 122 Ca -0.02 -2.01 -0.26 0.00 1.22 0.00 0.00 56.10 55.03 1p8r s TRP 122 Cb -0.19 -3.59 0.01 0.00 -1.50 0.00 0.00 33.47 28.20 1p8r s TRP 122 CO 0.01 -0.96 0.94 0.08 -4.62 0.00 0.00 176.95 172.40 1p8r s VAL 123 N 0.68 4.63 -0.08 5.86 1.01 -0.89 -1.92 120.40 129.70 1p8r s VAL 123 Ca 0.12 1.46 -0.31 0.00 0.00 0.00 0.00 61.98 63.24 1p8r s VAL 123 Cb -0.20 -4.30 0.12 0.00 0.00 0.00 0.00 36.38 32.00 1p8r s VAL 123 CO -0.04 -0.39 1.04 -0.62 0.00 0.00 0.00 175.10 175.09 1p8r s ASP 124 N 1.66 -0.25 0.14 3.32 3.68 -0.26 -0.71 116.67 124.24 1p8r s ASP 124 Ca 0.39 -0.02 0.24 0.00 2.13 0.00 0.00 52.55 55.30 1p8r s ASP 124 Cb -0.13 0.28 0.32 0.00 -1.45 0.00 0.00 42.92 41.94 1p8r s ASP 124 CO 0.14 -0.46 1.31 0.00 0.13 0.00 0.00 175.17 176.29 1p8r h ALA 125 N 2.00 0.59 -3.91 3.66 0.00 -1.74 -1.96 119.26 117.90 1p8r h ALA 125 Ca -0.17 0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.07 1p8r h ALA 125 Cb 1.21 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.77 1p8r h ALA 125 CO 0.27 0.00 -0.86 -1.01 0.00 0.00 0.00 179.25 177.65 1p8r s HIS 126 N -3.19 2.22 0.11 0.00 3.76 -1.26 -1.58 115.29 115.35 1p8r s HIS 126 Ca 0.06 -0.39 0.09 0.00 -0.15 0.00 0.00 55.06 54.67 1p8r s HIS 126 Cb 0.13 -1.22 -0.06 0.00 1.11 0.00 0.00 32.58 32.54 1p8r s HIS 126 CO 0.72 0.30 1.36 1.79 -0.85 0.00 0.00 174.74 178.06 1p8r h THR 127 N 3.95 1.55 -6.00 1.30 1.35 -1.89 -3.48 112.91 109.69 1p8r h THR 127 Ca -0.50 -3.03 -0.43 0.00 -0.55 0.00 0.00 66.41 61.90 1p8r h THR 127 Cb 1.17 2.66 0.06 0.00 -1.73 0.00 0.00 68.15 70.31 1p8r h THR 127 CO 0.40 0.85 -0.71 0.47 -0.25 0.00 0.00 175.52 176.27 1p8r n ASP 128 N -3.41 -5.70 -0.71 5.36 10.43 -1.26 -4.77 116.55 116.49 1p8r n ASP 128 Ca 0.00 -0.63 0.04 0.00 2.57 0.00 0.00 54.79 56.76 1p8r n ASP 128 Cb 0.85 -4.51 0.20 0.00 1.84 0.00 0.00 41.12 39.50 1p8r n ASP 128 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1p8r n ILE 129 N -4.85 2.27 -2.62 0.53 3.06 -1.23 -2.55 119.36 113.97 1p8r n ILE 129 Ca 0.02 -2.92 -0.37 0.00 -2.50 0.00 0.00 62.75 56.99 1p8r n ILE 129 Cb 0.55 -0.26 -0.05 0.00 0.54 0.00 0.00 39.64 40.41 1p8r n ILE 129 CO 0.00 0.00 0.00 0.20 -2.50 0.00 0.00 176.55 174.25 1p8r s ASN 130 N -2.93 6.96 0.26 9.51 0.01 -1.00 -4.62 114.94 123.13 1p8r s ASN 130 Ca 0.39 1.97 0.06 0.00 -0.71 0.00 0.00 52.86 54.58 1p8r s ASN 130 Cb 0.37 -2.58 -0.03 0.00 0.41 0.00 0.00 41.25 39.41 1p8r s ASN 130 CO -0.03 -0.34 0.31 0.42 -1.51 0.00 0.00 177.10 175.94 1p8r s THR 131 N -1.65 4.80 0.44 1.60 -4.23 -1.26 -4.24 115.64 111.09 1p8r s THR 131 Ca 0.55 -1.16 0.12 0.00 -1.18 0.00 0.00 61.69 60.03 1p8r s THR 131 Cb -0.21 -3.63 0.12 0.00 1.34 0.00 0.00 72.50 70.12 1p8r s THR 131 CO 0.26 -0.32 1.30 -0.65 -0.54 0.00 0.00 174.62 174.68 1p8r h PRO 132 N 1.27 0.00 0.00 3.99 0.11 -1.95 0.38 132.00 135.80 1p8r h PRO 132 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1p8r h PRO 132 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1p8r h PRO 132 CO 0.60 0.00 -1.48 1.28 -0.21 0.00 0.00 178.00 178.19 1p8r n LEU 133 N -2.36 0.48 -0.06 2.35 4.77 -1.26 -4.49 117.00 116.43 1p8r n LEU 133 Ca -0.01 -0.25 -0.03 0.00 -0.03 0.00 0.00 56.01 55.70 1p8r n LEU 133 Cb 0.60 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.55 1p8r n LEU 133 CO 0.05 0.12 -0.94 0.35 -1.33 0.00 0.00 177.39 175.65 1p8r n THR 134 N -1.87 0.77 -1.68 -5.08 -2.24 0.12 -4.98 114.28 99.33 1p8r n THR 134 Ca -0.00 -0.61 -0.46 0.00 -2.27 0.00 0.00 64.05 60.70 1p8r n THR 134 Cb 0.44 -0.35 -0.04 0.00 -2.10 0.00 0.00 70.33 68.28 1p8r n THR 134 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1p8r n THR 135 N -2.46 0.34 0.14 4.28 5.66 -0.54 -4.87 114.28 116.83 1p8r n THR 135 Ca -0.19 -0.06 0.01 0.00 -3.05 0.00 0.00 64.05 60.76 1p8r n THR 135 Cb 0.86 -1.79 0.13 0.00 -1.55 0.00 0.00 70.33 67.98 1p8r n THR 135 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 1p8r h SER 136 N 7.90 0.00 -1.30 1.09 4.64 -1.93 -3.44 113.55 120.51 1p8r h SER 136 Ca -0.47 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.24 1p8r h SER 136 Cb 1.26 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.24 1p8r h SER 136 CO 0.92 0.58 -0.52 -0.94 -0.87 0.00 0.00 176.83 176.00 1p8r s SER 137 N -6.57 4.18 -0.06 4.97 1.04 -1.26 -5.04 113.70 110.96 1p8r s SER 137 Ca 0.01 -1.31 0.21 0.00 0.48 0.00 0.00 55.95 55.34 1p8r s SER 137 Cb 0.10 -0.19 0.69 0.00 0.10 0.00 0.00 66.02 66.73 1p8r s SER 137 CO 0.74 -0.61 1.59 0.61 0.98 0.00 0.00 173.24 176.56 1p8r n GLY 138 N -1.18 2.60 3.64 7.32 0.00 -1.26 -4.89 105.19 111.42 1p8r n GLY 138 Ca -0.06 -0.83 -0.43 0.00 0.00 0.00 0.00 46.02 44.70 1p8r n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1p8r s ASN 139 N -0.95 6.46 0.00 1.61 0.01 -1.26 -2.53 114.94 118.27 1p8r s ASN 139 Ca 0.51 2.01 0.22 0.00 -0.71 0.00 0.00 52.86 54.88 1p8r s ASN 139 Cb 0.30 -2.53 1.07 0.00 0.41 0.00 0.00 41.25 40.50 1p8r s ASN 139 CO 0.30 -1.14 1.69 0.18 -1.51 0.00 0.00 177.10 176.62 1p8r n LEU 140 N 7.99 0.00 0.00 0.60 4.77 -0.78 -2.56 117.00 127.03 1p8r n LEU 140 Ca 0.19 0.30 0.13 0.00 -0.03 0.00 0.00 56.01 56.60 1p8r n LEU 140 Cb 0.44 -0.30 0.65 0.00 -2.33 0.00 0.00 43.42 41.87 1p8r n LEU 140 CO 0.64 -0.09 0.93 0.00 -1.33 0.00 0.00 177.39 177.54 1p8r n HIS 141 N -1.30 0.00 -1.16 -1.77 1.44 0.23 -2.66 115.22 110.00 1p8r n HIS 141 Ca 0.10 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.87 1p8r n HIS 141 Cb 0.18 -0.28 0.20 0.00 0.12 0.00 0.00 29.99 30.21 1p8r n HIS 141 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1p8r n GLY 142 N 0.91 4.58 0.00 -1.39 0.00 -1.06 -4.57 105.19 103.67 1p8r n GLY 142 Ca 0.12 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 45.01 1p8r n GLY 142 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1p8r n GLN 143 N -0.99 0.03 -0.13 1.61 6.02 -1.09 -2.38 117.38 120.45 1p8r n GLN 143 Ca 0.22 -0.23 -0.11 0.00 -0.01 0.00 0.00 57.00 56.86 1p8r n GLN 143 Cb 0.82 -0.55 -0.06 0.00 1.02 0.00 0.00 30.24 31.46 1p8r n GLN 143 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 1p8r h PRO 144 N 0.00 -0.34 -0.93 -1.09 0.11 -1.59 -1.50 132.00 126.66 1p8r h PRO 144 Ca 0.00 0.02 0.17 0.00 0.11 0.00 0.00 66.00 66.31 1p8r h PRO 144 Cb 0.61 0.08 -0.08 0.00 0.11 0.00 0.00 31.00 31.72 1p8r h PRO 144 CO 0.00 -0.23 0.60 0.28 -0.21 0.00 0.00 178.00 178.44 1p8r h VAL 145 N -0.35 0.76 -0.25 3.15 2.07 -1.79 -0.87 116.25 118.96 1p8r h VAL 145 Ca 0.12 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 1p8r h VAL 145 Cb 0.59 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1p8r h VAL 145 CO -0.58 0.12 0.07 0.00 0.02 0.00 0.00 177.57 177.19 1p8r h ALA 146 N 1.61 1.65 0.00 1.67 0.00 -1.42 -1.67 119.26 121.10 1p8r h ALA 146 Ca 0.49 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1p8r h ALA 146 Cb 0.89 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1p8r h ALA 146 CO -0.24 0.27 -0.01 0.74 0.00 0.00 0.00 179.25 180.00 1p8r h PHE 147 N 0.36 0.00 0.00 0.00 -1.00 -1.06 -3.34 116.94 111.90 1p8r h PHE 147 Ca 0.09 0.00 -0.30 0.00 2.81 0.00 0.00 57.97 60.57 1p8r h PHE 147 Cb 0.13 0.00 -0.06 0.00 3.61 0.00 0.00 35.95 39.64 1p8r h PHE 147 CO 0.00 0.00 -2.25 1.28 -1.61 0.00 0.00 178.31 175.73 1p8r n LEU 148 N -2.39 0.08 -4.66 1.54 4.77 -0.78 -4.21 117.00 111.36 1p8r n LEU 148 Ca 0.05 0.04 -0.43 0.00 -0.03 0.00 0.00 56.01 55.64 1p8r n LEU 148 Cb 0.45 0.39 -0.02 0.00 -2.33 0.00 0.00 43.42 41.90 1p8r n LEU 148 CO 0.31 0.40 1.26 -0.76 -1.33 0.00 0.00 177.39 177.27 1p8r s LEU 149 N -5.37 4.22 0.27 2.23 1.43 -0.70 -1.38 118.68 119.37 1p8r s LEU 149 Ca -0.09 1.95 -0.01 0.00 -1.03 0.00 0.00 54.13 54.95 1p8r s LEU 149 Cb 0.08 -3.54 0.47 0.00 0.03 0.00 0.00 46.19 43.23 1p8r s LEU 149 CO 0.84 -0.90 1.85 0.11 0.23 0.00 0.00 176.35 178.49 1p8r h LYS 150 N 9.14 1.02 0.00 1.70 1.57 -1.19 -1.60 116.57 127.20 1p8r h LYS 150 Ca -0.34 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.38 1p8r h LYS 150 Cb 1.15 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 33.22 1p8r h LYS 150 CO 0.97 0.67 -0.02 0.93 -0.57 0.00 0.00 179.45 181.43 1p8r h GLU 151 N 1.05 0.00 -0.01 3.15 3.07 -1.91 -1.72 114.58 118.20 1p8r h GLU 151 Ca 0.46 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.32 1p8r h GLU 151 Cb 0.34 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.25 1p8r h GLU 151 CO -0.22 0.02 -0.04 1.28 -1.40 0.00 0.00 179.01 178.64 1p8r n LEU 152 N -4.51 1.30 -4.69 1.33 4.32 -0.61 -4.88 117.00 109.26 1p8r n LEU 152 Ca -0.03 -0.41 -0.49 0.00 -0.02 0.00 0.00 56.01 55.05 1p8r n LEU 152 Cb 0.10 -0.02 -0.05 0.00 -1.62 0.00 0.00 43.42 41.83 1p8r n LEU 152 CO 0.34 0.22 1.47 1.17 -1.22 0.00 0.00 177.39 179.38 1p8r n LYS 153 N -0.06 2.07 -1.06 3.23 4.81 -0.65 -0.85 118.16 125.65 1p8r n LYS 153 Ca 0.18 0.76 -0.02 0.00 -0.87 0.00 0.00 58.31 58.36 1p8r n LYS 153 Cb 0.34 -2.59 -0.01 0.00 0.02 0.00 0.00 35.03 32.79 1p8r n LYS 153 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1p8r n GLY 154 N 4.38 0.54 0.18 3.14 0.00 -1.26 -4.89 105.19 107.29 1p8r n GLY 154 Ca 0.23 -0.39 0.13 0.00 0.00 0.00 0.00 46.02 45.99 1p8r n GLY 154 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1p8r n LYS 155 N -2.48 0.68 -3.84 1.61 4.76 -0.03 -4.86 118.16 114.00 1p8r n LYS 155 Ca -0.02 -0.36 -0.11 0.00 -2.87 0.00 0.00 58.31 54.95 1p8r n LYS 155 Cb 0.12 -1.49 -0.09 0.00 -1.84 0.00 0.00 35.03 31.74 1p8r n LYS 155 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 1p8r s PHE 156 N -2.57 0.02 0.65 2.13 -0.71 -1.26 -5.00 117.98 111.24 1p8r s PHE 156 Ca 0.23 -0.19 -0.18 0.00 -1.04 0.00 0.00 56.93 55.75 1p8r s PHE 156 Cb 0.19 -0.02 -0.01 0.00 -1.21 0.00 0.00 43.02 41.97 1p8r s PHE 156 CO 0.53 -0.40 1.25 -0.35 -1.34 0.00 0.00 175.22 174.91 1p8r n PRO 157 N 0.86 1.06 -1.86 1.99 -0.04 -1.26 -4.90 135.00 130.85 1p8r n PRO 157 Ca -0.20 0.42 -0.42 0.00 -0.04 0.00 0.00 63.50 63.26 1p8r n PRO 157 Cb 0.58 -2.48 -0.03 0.00 -0.04 0.00 0.00 33.50 31.53 1p8r n PRO 157 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1p8r s ASP 158 N -1.38 6.56 -0.15 3.54 1.01 -1.26 -4.98 116.67 120.01 1p8r s ASP 158 Ca 0.82 2.49 -0.18 0.00 0.71 0.00 0.00 52.55 56.39 1p8r s ASP 158 Cb -0.38 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 40.96 1p8r s ASP 158 CO 0.41 -0.95 0.49 -0.69 0.21 0.00 0.00 175.17 174.63 1p8r s VAL 159 N 3.51 5.16 0.02 -1.27 1.01 -1.26 -5.02 120.40 122.55 1p8r s VAL 159 Ca 0.78 0.94 -0.36 0.00 0.00 0.00 0.00 61.98 63.34 1p8r s VAL 159 Cb -0.39 -3.82 -0.15 0.00 0.00 0.00 0.00 36.38 32.01 1p8r s VAL 159 CO 0.34 0.27 1.52 -2.65 0.00 0.00 0.00 175.10 174.58 1p8r n PRO 160 N 4.12 1.49 0.00 2.72 -0.02 -1.26 -2.00 135.00 140.05 1p8r n PRO 160 Ca -0.06 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 1p8r n PRO 160 Cb 0.51 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 1p8r n PRO 160 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1p8r n GLY 161 N 3.21 2.59 0.88 -1.23 0.00 -1.26 -3.40 105.19 105.99 1p8r n GLY 161 Ca 0.20 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.23 1p8r n GLY 161 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1p8r n PHE 162 N -1.52 0.66 0.07 1.61 3.01 -0.85 -4.03 117.46 116.41 1p8r n PHE 162 Ca 0.00 -1.46 -0.01 0.00 1.01 0.00 0.00 57.45 56.99 1p8r n PHE 162 Cb 0.00 -0.38 0.29 0.00 -0.01 0.00 0.00 39.48 39.38 1p8r n PHE 162 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1p8r h SER 163 N 0.99 0.34 0.23 4.37 4.64 -1.92 -1.99 113.55 120.21 1p8r h SER 163 Ca 0.12 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1p8r h SER 163 Cb 1.39 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1p8r h SER 163 CO 0.23 0.56 0.00 -2.67 -0.87 0.00 0.00 176.83 174.08 1p8r n TRP 164 N -4.18 0.28 -2.92 4.77 4.27 -1.26 -4.73 117.44 113.67 1p8r n TRP 164 Ca -0.00 0.13 -0.38 0.00 -3.89 0.00 0.00 57.50 53.35 1p8r n TRP 164 Cb 0.35 -0.71 -0.06 0.00 -1.36 0.00 0.00 31.31 29.53 1p8r n TRP 164 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 1p8r s VAL 165 N -3.17 4.32 -0.17 -1.67 1.01 -0.75 -5.06 120.40 114.92 1p8r s VAL 165 Ca 0.02 1.72 -0.04 0.00 0.00 0.00 0.00 61.98 63.68 1p8r s VAL 165 Cb 0.05 -4.09 0.08 0.00 0.00 0.00 0.00 36.38 32.42 1p8r s VAL 165 CO 0.16 0.36 0.20 0.42 0.00 0.00 0.00 175.10 176.25 1p8r s THR 166 N -1.34 -0.30 -0.35 3.92 -4.23 -1.26 -5.10 115.64 106.97 1p8r s THR 166 Ca 0.42 0.02 -0.40 0.00 -1.18 0.00 0.00 61.69 60.54 1p8r s THR 166 Cb -0.21 -0.56 -0.18 0.00 1.34 0.00 0.00 72.50 72.89 1p8r s THR 166 CO 0.26 -0.10 1.32 -2.65 -0.54 0.00 0.00 174.62 172.91 1p8r n PRO 167 N 5.32 0.00 -0.01 3.99 -0.02 -1.26 -4.87 135.00 138.15 1p8r n PRO 167 Ca -0.05 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.50 1p8r n PRO 167 Cb 0.50 -1.33 -0.11 0.00 -0.02 0.00 0.00 33.50 32.54 1p8r n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1p8r s ILE 169 N -2.88 1.51 0.23 0.00 -4.36 -1.07 -4.97 121.20 109.67 1p8r s ILE 169 Ca -0.04 -1.49 0.06 0.00 -0.26 0.00 0.00 60.65 58.92 1p8r s ILE 169 Cb 0.09 -1.41 -0.03 0.00 1.25 0.00 0.00 42.46 42.36 1p8r s ILE 169 CO 0.59 -0.13 0.26 -0.94 0.24 0.00 0.00 174.94 174.96 1p8r s SER 170 N -1.90 5.92 0.59 4.36 1.04 -1.26 -0.71 113.70 121.74 1p8r s SER 170 Ca 0.04 -0.07 0.33 0.00 0.48 0.00 0.00 55.95 56.73 1p8r s SER 170 Cb -0.10 -1.64 1.27 0.00 0.10 0.00 0.00 66.02 65.65 1p8r s SER 170 CO 0.04 -0.03 1.54 0.00 0.98 0.00 0.00 173.24 175.76 1p8r h ALA 171 N 1.53 2.99 0.00 5.32 0.00 -1.96 0.37 119.26 127.51 1p8r h ALA 171 Ca -0.50 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1p8r h ALA 171 Cb 1.23 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1p8r h ALA 171 CO 0.62 -1.63 -0.04 1.63 0.00 0.00 0.00 179.25 179.83 1p8r n LYS 172 N -3.57 0.16 -0.22 0.00 4.01 -1.26 -3.71 118.16 113.57 1p8r n LYS 172 Ca 0.24 0.13 0.12 0.00 -0.51 0.00 0.00 58.31 58.29 1p8r n LYS 172 Cb 1.41 -1.68 0.24 0.00 -0.51 0.00 0.00 35.03 34.49 1p8r n LYS 172 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1p8r n ASP 173 N -1.96 3.49 -4.24 4.39 8.00 0.13 -4.92 116.55 121.44 1p8r n ASP 173 Ca 0.06 -1.99 -0.26 0.00 0.71 0.00 0.00 54.79 53.31 1p8r n ASP 173 Cb 0.40 -0.29 -0.15 0.00 -0.02 0.00 0.00 41.12 41.06 1p8r n ASP 173 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1p8r s ILE 174 N -1.42 1.64 -0.05 0.53 2.07 -1.24 0.11 121.20 122.84 1p8r s ILE 174 Ca 0.40 -1.09 0.01 0.00 -1.41 0.00 0.00 60.65 58.57 1p8r s ILE 174 Cb 0.23 -1.40 0.02 0.00 0.13 0.00 0.00 42.46 41.44 1p8r s ILE 174 CO 0.32 0.28 -0.04 -0.69 -1.91 0.00 0.00 174.94 172.90 1p8r s VAL 175 N -0.69 0.53 0.09 4.00 1.01 0.30 -3.82 120.40 121.82 1p8r s VAL 175 Ca 0.07 -0.11 -0.04 0.00 0.00 0.00 0.00 61.98 61.90 1p8r s VAL 175 Cb -0.08 -0.56 -0.05 0.00 0.00 0.00 0.00 36.38 35.69 1p8r s VAL 175 CO 0.01 0.23 0.31 -0.31 0.00 0.00 0.00 175.10 175.33 1p8r s TYR 176 N 0.95 3.51 -0.10 5.22 2.02 -0.76 -0.32 117.35 127.87 1p8r s TYR 176 Ca -0.11 0.48 -0.04 0.00 -0.37 0.00 0.00 57.07 57.03 1p8r s TYR 176 Cb -0.14 -1.94 0.05 0.00 -0.40 0.00 0.00 41.96 39.53 1p8r s TYR 176 CO -0.00 0.52 0.20 0.42 -1.57 0.00 0.00 175.55 175.11 1p8r s ILE 177 N -1.54 -0.25 0.00 2.71 1.01 -0.81 -0.63 121.20 121.69 1p8r s ILE 177 Ca 0.36 0.29 0.00 0.00 0.00 0.00 0.00 60.65 61.30 1p8r s ILE 177 Cb -0.13 -0.34 0.00 0.00 0.01 0.00 0.00 42.46 42.00 1p8r s ILE 177 CO 0.24 0.12 0.00 0.61 0.00 0.00 0.00 174.94 175.91 1p8r n GLY 178 N 5.05 0.76 3.52 6.18 0.00 -0.67 -1.10 105.19 118.93 1p8r n GLY 178 Ca -0.11 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.42 1p8r n GLY 178 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1p8r n LEU 179 N 0.00 0.65 0.00 0.99 4.77 -0.74 -4.23 117.00 118.45 1p8r n LEU 179 Ca 0.00 1.15 0.00 0.00 -0.03 0.00 0.00 56.01 57.13 1p8r n LEU 179 Cb 0.00 -1.12 0.00 0.00 -2.33 0.00 0.00 43.42 39.97 1p8r n LEU 179 CO 0.00 -1.82 0.00 -2.11 -1.33 0.00 0.00 177.39 172.13 1p8r n ARG 180 N 1.39 0.00 -3.11 3.23 1.85 -0.62 -0.29 116.66 119.11 1p8r n ARG 180 Ca 0.16 0.00 -0.19 0.00 -1.00 0.00 0.00 57.85 56.82 1p8r n ARG 180 Cb 0.23 0.00 -0.05 0.00 -1.05 0.00 0.00 32.46 31.59 1p8r n ARG 180 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1p8r n ASP 181 N 0.00 -1.17 -4.58 2.89 2.03 -0.66 -5.05 116.55 110.01 1p8r n ASP 181 Ca 0.00 -2.73 -0.34 0.00 0.52 0.00 0.00 54.79 52.24 1p8r n ASP 181 Cb 0.30 0.20 -0.11 0.00 -0.72 0.00 0.00 41.12 40.79 1p8r n ASP 181 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1p8r s VAL 182 N -0.11 3.90 0.43 5.18 1.01 -1.26 -4.53 120.40 125.02 1p8r s VAL 182 Ca 0.33 -0.39 -0.15 0.00 0.00 0.00 0.00 61.98 61.77 1p8r s VAL 182 Cb 0.11 -2.64 -0.08 0.00 0.00 0.00 0.00 36.38 33.77 1p8r s VAL 182 CO -0.15 0.57 0.87 -1.81 0.00 0.00 0.00 175.10 174.57 1p8r s ASP 183 N -0.46 6.66 0.29 3.32 1.01 -1.26 -4.84 116.67 121.39 1p8r s ASP 183 Ca 0.07 1.39 0.03 0.00 0.71 0.00 0.00 52.55 54.75 1p8r s ASP 183 Cb -0.12 -2.43 0.71 0.00 1.01 0.00 0.00 42.92 42.09 1p8r s ASP 183 CO 0.02 -0.43 1.68 -0.65 0.21 0.00 0.00 175.17 176.01 1p8r h PRO 184 N 1.40 0.34 -0.00 8.23 0.11 -1.98 0.43 132.00 140.52 1p8r h PRO 184 Ca -0.47 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 1p8r h PRO 184 Cb 1.18 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1p8r h PRO 184 CO 0.63 0.22 -0.00 0.78 -0.21 0.00 0.00 178.00 179.42 1p8r h GLY 185 N 0.35 0.00 0.58 -0.55 0.00 -1.94 -0.70 103.07 100.81 1p8r h GLY 185 Ca 0.55 -0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.96 1p8r h GLY 185 CO -0.55 0.00 0.38 0.83 0.00 0.00 0.00 176.54 177.20 1p8r h GLU 186 N -0.35 0.66 -0.32 4.80 5.08 -1.48 0.15 114.58 123.12 1p8r h GLU 186 Ca 0.00 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 1p8r h GLU 186 Cb 0.35 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 1p8r h GLU 186 CO 0.00 0.44 -0.15 1.25 -1.00 0.00 0.00 179.01 179.55 1p8r h HIS 187 N 0.68 0.61 -0.33 4.33 2.76 -0.09 -1.06 115.15 122.05 1p8r h HIS 187 Ca 0.33 -0.10 -0.10 0.00 -2.20 0.00 0.00 60.37 58.30 1p8r h HIS 187 Cb 0.28 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 29.07 1p8r h HIS 187 CO -0.09 0.68 -0.19 -0.92 -1.30 0.00 0.00 177.93 176.12 1p8r h TYR 188 N 0.51 0.82 0.08 5.26 3.20 -0.15 -2.42 116.97 124.27 1p8r h TYR 188 Ca 0.09 -0.21 0.01 0.00 3.14 0.00 0.00 58.73 61.76 1p8r h TYR 188 Cb 0.55 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 1p8r h TYR 188 CO 0.02 0.93 -0.12 0.82 -1.64 0.00 0.00 178.16 178.17 1p8r h ILE 189 N 0.47 0.73 -0.13 1.81 2.04 -0.34 -1.42 117.51 120.68 1p8r h ILE 189 Ca 0.07 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.85 1p8r h ILE 189 Cb 0.73 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 1p8r h ILE 189 CO 0.05 0.00 -0.29 0.16 0.00 0.00 0.00 178.15 178.07 1p8r h ILE 190 N -0.24 1.26 0.00 -0.67 3.07 -1.22 -0.45 117.51 119.26 1p8r h ILE 190 Ca 0.01 -1.22 -0.14 0.00 1.55 0.00 0.00 64.86 65.07 1p8r h ILE 190 Cb 0.25 1.49 -0.02 0.00 -0.27 0.00 0.00 36.82 38.26 1p8r h ILE 190 CO -0.05 0.37 -0.67 0.11 -1.05 0.00 0.00 178.15 176.86 1p8r h LYS 191 N 0.21 0.00 0.07 0.16 1.79 -1.31 0.66 116.57 118.15 1p8r h LYS 191 Ca 0.03 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 58.30 1p8r h LYS 191 Cb 0.63 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.28 1p8r h LYS 191 CO 0.05 0.67 -1.01 1.15 -1.08 0.00 0.00 179.45 179.22 1p8r h THR 192 N 0.00 1.23 0.00 -0.16 2.02 -1.12 -3.30 112.91 111.58 1p8r h THR 192 Ca -0.01 -2.37 0.00 0.00 0.77 0.00 0.00 66.41 64.80 1p8r h THR 192 Cb 1.41 2.83 0.00 0.00 -1.74 0.00 0.00 68.15 70.65 1p8r h THR 192 CO 0.09 0.61 0.00 -0.07 0.37 0.00 0.00 175.52 176.52 1p8r h LEU 193 N -0.58 0.00 -1.37 2.58 4.07 -1.19 -3.47 115.31 115.34 1p8r h LEU 193 Ca -0.23 0.00 -0.23 0.00 0.08 0.00 0.00 57.88 57.50 1p8r h LEU 193 Cb 1.51 0.00 0.10 0.00 1.08 0.00 0.00 40.66 43.35 1p8r h LEU 193 CO 0.01 0.00 -0.47 0.61 -1.08 0.00 0.00 178.44 177.51 1p8r n GLY 194 N 0.71 -0.05 3.75 0.83 0.00 -0.11 -4.88 105.19 105.44 1p8r n GLY 194 Ca 0.04 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 1p8r n GLY 194 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p8r s ILE 195 N -3.22 3.80 0.04 -0.61 1.01 0.04 -4.87 121.20 117.40 1p8r s ILE 195 Ca 0.18 1.67 -0.30 0.00 0.00 0.00 0.00 60.65 62.19 1p8r s ILE 195 Cb -0.08 -4.06 -0.05 0.00 0.01 0.00 0.00 42.46 38.28 1p8r s ILE 195 CO 0.47 0.34 1.19 -0.75 0.00 0.00 0.00 174.94 176.19 1p8r s LYS 196 N -0.81 4.43 -0.03 2.79 2.47 -1.25 -4.88 119.74 122.46 1p8r s LYS 196 Ca 0.46 1.74 -0.14 0.00 -1.56 0.00 0.00 55.97 56.48 1p8r s LYS 196 Cb -0.29 -3.38 0.02 0.00 -1.46 0.00 0.00 37.83 32.72 1p8r s LYS 196 CO 0.36 -0.27 0.30 1.52 0.16 0.00 0.00 175.35 177.42 1p8r s TYR 197 N 1.21 -0.19 -0.54 4.03 -0.85 -1.26 -1.82 117.35 117.92 1p8r s TYR 197 Ca 0.58 0.31 0.04 0.00 -0.52 0.00 0.00 57.07 57.48 1p8r s TYR 197 Cb -0.28 0.09 0.14 0.00 0.38 0.00 0.00 41.96 42.29 1p8r s TYR 197 CO 0.28 -0.35 0.32 -0.06 -1.52 0.00 0.00 175.55 174.22 1p8r s PHE 198 N -1.14 2.87 1.14 -3.49 0.40 0.19 -4.92 117.98 113.03 1p8r s PHE 198 Ca -0.12 -2.98 -0.17 0.00 -0.60 0.00 0.00 56.93 53.05 1p8r s PHE 198 Cb -0.05 -2.46 0.26 0.00 0.51 0.00 0.00 43.02 41.28 1p8r s PHE 198 CO 0.04 -0.71 1.11 -1.54 0.70 0.00 0.00 175.22 174.82 1p8r s SER 199 N -0.41 1.42 0.39 1.36 1.04 -1.26 -1.67 113.70 114.57 1p8r s SER 199 Ca 0.20 0.75 0.11 0.00 0.48 0.00 0.00 55.95 57.49 1p8r s SER 199 Cb -0.19 -1.10 0.90 0.00 0.10 0.00 0.00 66.02 65.74 1p8r s SER 199 CO -0.05 -3.83 1.91 0.24 0.98 0.00 0.00 173.24 172.49 1p8r h MET 200 N -2.38 0.57 0.00 4.02 2.86 -0.83 0.80 114.93 119.97 1p8r h MET 200 Ca -0.47 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.11 1p8r h MET 200 Cb 1.30 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.83 1p8r h MET 200 CO 0.41 0.38 -0.11 0.00 1.06 0.00 0.00 176.91 178.64 1p8r h THR 201 N 0.59 0.45 0.00 2.22 1.03 -1.90 -0.62 112.91 114.68 1p8r h THR 201 Ca 0.39 -0.56 -0.12 0.00 -0.01 0.00 0.00 66.41 66.11 1p8r h THR 201 Cb 0.68 1.39 -0.02 0.00 -1.07 0.00 0.00 68.15 69.13 1p8r h THR 201 CO -0.15 0.11 -0.86 -0.33 -0.01 0.00 0.00 175.52 174.28 1p8r h GLU 202 N 0.00 0.00 0.01 0.00 3.07 -1.16 -2.54 114.58 113.96 1p8r h GLU 202 Ca -0.00 0.00 -0.20 0.00 -0.50 0.00 0.00 59.36 58.66 1p8r h GLU 202 Cb 0.38 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.27 1p8r h GLU 202 CO 0.01 0.37 -0.90 0.28 -1.40 0.00 0.00 179.01 177.37 1p8r h VAL 203 N 0.00 1.55 -0.01 3.13 2.07 -0.92 -0.22 116.25 121.85 1p8r h VAL 203 Ca -0.06 -2.80 -0.16 0.00 0.82 0.00 0.00 66.70 64.50 1p8r h VAL 203 Cb 1.42 2.56 -0.02 0.00 -1.52 0.00 0.00 31.29 33.73 1p8r h VAL 203 CO 0.05 0.81 -0.74 0.44 0.02 0.00 0.00 177.57 178.15 1p8r h ASP 204 N 0.06 0.08 0.15 0.57 3.32 -1.15 -0.52 116.42 118.93 1p8r h ASP 204 Ca -0.04 -0.06 -0.28 0.00 0.02 0.00 0.00 57.03 56.68 1p8r h ASP 204 Cb 1.56 -0.02 0.01 0.00 0.22 0.00 0.00 39.33 41.10 1p8r h ASP 204 CO 0.13 0.78 -1.33 0.50 -1.72 0.00 0.00 179.24 177.60 1p8r h LYS 205 N 0.04 0.33 0.03 3.56 3.11 -1.38 -3.40 116.57 118.86 1p8r h LYS 205 Ca -0.01 -0.56 -0.35 0.00 -2.81 0.00 0.00 60.65 56.92 1p8r h LYS 205 Cb 1.30 0.21 -0.05 0.00 -1.00 0.00 0.00 32.23 32.69 1p8r h LYS 205 CO 0.10 1.27 -2.09 1.28 -2.81 0.00 0.00 179.45 177.20 1p8r n LEU 206 N -3.89 1.52 0.00 5.20 4.77 -0.10 -5.09 117.00 119.40 1p8r n LEU 206 Ca -0.21 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 1p8r n LEU 206 Cb 0.94 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 1p8r n LEU 206 CO 0.48 0.64 0.00 0.61 -1.33 0.00 0.00 177.39 177.78 1p8r n GLY 207 N 1.85 1.09 0.25 -0.72 0.00 -0.20 -4.37 105.19 103.08 1p8r n GLY 207 Ca -0.30 -1.61 0.11 0.00 0.00 0.00 0.00 46.02 44.21 1p8r n GLY 207 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1p8r h ILE 208 N 0.00 0.73 -0.02 -0.61 6.09 -1.93 -2.20 117.51 119.57 1p8r h ILE 208 Ca 0.00 -0.52 -0.00 0.00 -1.37 0.00 0.00 64.86 62.97 1p8r h ILE 208 Cb 0.00 1.31 -0.00 0.00 0.47 0.00 0.00 36.82 38.60 1p8r h ILE 208 CO 0.00 0.13 -0.01 1.23 -3.07 0.00 0.00 178.15 176.43 1p8r h GLY 209 N 0.68 0.04 2.00 8.18 0.00 -1.96 -2.27 103.07 109.74 1p8r h GLY 209 Ca -0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 1p8r h GLY 209 CO 0.02 0.03 -0.05 1.70 0.00 0.00 0.00 176.54 178.24 1p8r h LYS 210 N -0.34 0.00 -0.04 4.80 1.63 -1.72 -2.43 116.57 118.48 1p8r h LYS 210 Ca 0.00 0.00 -0.15 0.00 -0.85 0.00 0.00 60.65 59.65 1p8r h LYS 210 Cb 0.40 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.04 1p8r h LYS 210 CO 0.00 0.05 -0.57 0.28 -3.45 0.00 0.00 179.45 175.76 1p8r h VAL 211 N 0.00 1.40 -0.31 2.00 2.07 -1.21 -2.46 116.25 117.74 1p8r h VAL 211 Ca -0.00 -1.98 -0.12 0.00 0.82 0.00 0.00 66.70 65.42 1p8r h VAL 211 Cb 0.42 2.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.62 1p8r h VAL 211 CO 0.01 0.58 -0.32 0.24 0.02 0.00 0.00 177.57 178.10 1p8r h MET 212 N -0.01 0.66 -0.26 1.57 2.86 -1.21 0.36 114.93 118.91 1p8r h MET 212 Ca -0.06 -0.30 -0.00 0.00 -2.06 0.00 0.00 59.70 57.28 1p8r h MET 212 Cb 1.25 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.89 1p8r h MET 212 CO 0.11 0.89 0.15 1.49 1.06 0.00 0.00 176.91 180.62 1p8r h GLU 213 N 0.56 0.35 0.00 1.72 4.81 -1.49 0.33 114.58 120.86 1p8r h GLU 213 Ca 0.06 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.21 1p8r h GLU 213 Cb 0.82 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.12 1p8r h GLU 213 CO 0.07 0.28 -0.25 0.93 -0.73 0.00 0.00 179.01 179.31 1p8r h GLU 214 N 0.32 0.00 -0.09 1.92 5.08 -1.28 -2.02 114.58 118.51 1p8r h GLU 214 Ca 0.09 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.34 1p8r h GLU 214 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1p8r h GLU 214 CO -0.02 0.25 -0.39 1.15 -1.00 0.00 0.00 179.01 179.01 1p8r h THR 215 N 0.00 1.40 -0.42 1.13 2.02 -0.36 -2.82 112.91 113.85 1p8r h THR 215 Ca -0.00 -1.75 -0.11 0.00 0.77 0.00 0.00 66.41 65.32 1p8r h THR 215 Cb 0.83 2.24 -0.01 0.00 -1.74 0.00 0.00 68.15 69.47 1p8r h THR 215 CO 0.03 0.51 -0.17 -0.26 0.37 0.00 0.00 175.52 176.00 1p8r h PHE 216 N -0.03 0.99 0.00 3.16 0.04 -0.80 -1.82 116.94 118.48 1p8r h PHE 216 Ca -0.02 -0.24 -0.05 0.00 2.80 0.00 0.00 57.97 60.47 1p8r h PHE 216 Cb 1.03 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.94 1p8r h PHE 216 CO 0.12 1.00 -0.22 0.66 -0.60 0.00 0.00 178.31 179.28 1p8r h SER 217 N 0.68 0.00 0.10 2.17 4.64 -1.47 0.53 113.55 120.21 1p8r h SER 217 Ca 0.10 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.13 1p8r h SER 217 Cb 0.73 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.85 1p8r h SER 217 CO 0.06 0.22 -1.20 0.22 -0.87 0.00 0.00 176.83 175.26 1p8r h TYR 218 N 0.00 1.00 0.08 4.77 3.20 -1.34 -2.34 116.97 122.35 1p8r h TYR 218 Ca -0.00 -0.62 -0.34 0.00 3.14 0.00 0.00 58.73 60.91 1p8r h TYR 218 Cb 0.74 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.89 1p8r h TYR 218 CO 0.00 1.46 -1.91 1.28 -1.64 0.00 0.00 178.16 177.35 1p8r n LEU 219 N -3.82 2.04 -0.66 2.82 4.77 -0.70 -4.44 117.00 117.01 1p8r n LEU 219 Ca -0.13 0.27 0.06 0.00 -0.03 0.00 0.00 56.01 56.18 1p8r n LEU 219 Cb 0.96 -0.68 0.14 0.00 -2.33 0.00 0.00 43.42 41.51 1p8r n LEU 219 CO 0.57 0.70 0.59 0.18 -1.33 0.00 0.00 177.39 178.10 1p8r n LEU 220 N -3.33 2.74 -0.26 2.23 4.77 0.18 -4.68 117.00 118.65 1p8r n LEU 220 Ca -0.27 -1.69 -0.03 0.00 -0.03 0.00 0.00 56.01 53.99 1p8r n LEU 220 Cb 1.05 -0.18 0.09 0.00 -2.33 0.00 0.00 43.42 42.04 1p8r n LEU 220 CO 0.44 0.65 1.15 1.23 -1.33 0.00 0.00 177.39 179.52 1p8r h GLY 221 N 2.35 1.05 0.57 -0.72 0.00 -1.40 -3.23 103.07 101.69 1p8r h GLY 221 Ca 0.00 -0.34 -0.17 0.00 0.00 0.00 0.00 47.33 46.82 1p8r h GLY 221 CO 0.00 0.28 -0.79 -0.09 0.00 0.00 0.00 176.54 175.94 1p8r h ARG 222 N 0.88 0.25 -2.56 4.80 2.43 -1.83 -3.48 114.38 114.87 1p8r h ARG 222 Ca 0.29 -0.42 -0.10 0.00 -0.81 0.00 0.00 59.98 58.94 1p8r h ARG 222 Cb 0.03 0.16 -0.24 0.00 -0.42 0.00 0.00 29.97 29.51 1p8r h ARG 222 CO -0.12 1.20 -0.16 0.15 -1.51 0.00 0.00 179.97 179.54 1p8r s LYS 223 N -2.41 0.55 0.14 0.20 1.02 -1.22 -5.13 119.74 112.89 1p8r s LYS 223 Ca -0.15 0.70 -0.31 0.00 0.02 0.00 0.00 55.97 56.23 1p8r s LYS 223 Cb 0.01 0.24 -0.08 0.00 -0.52 0.00 0.00 37.83 37.48 1p8r s LYS 223 CO 0.80 -0.08 1.31 0.15 -0.92 0.00 0.00 175.35 176.61 1p8r s LYS 224 N 0.44 4.38 0.19 1.68 3.01 -1.26 -4.58 119.74 123.60 1p8r s LYS 224 Ca -0.01 1.99 -0.08 0.00 -1.01 0.00 0.00 55.97 56.86 1p8r s LYS 224 Cb -0.04 -3.25 -0.02 0.00 -1.01 0.00 0.00 37.83 33.52 1p8r s LYS 224 CO -0.02 -0.30 0.28 -0.98 0.51 0.00 0.00 175.35 174.84 1p8r s ARG 225 N 0.54 1.25 0.35 1.68 1.70 -1.26 -5.13 118.95 118.07 1p8r s ARG 225 Ca 0.60 -1.31 -0.28 0.00 -0.47 0.00 0.00 55.73 54.26 1p8r s ARG 225 Cb -0.35 0.37 -0.12 0.00 -0.57 0.00 0.00 34.95 34.28 1p8r s ARG 225 CO 0.33 -0.46 1.44 -2.30 -1.08 0.00 0.00 175.30 173.24 1p8r n PRO 226 N -0.26 2.50 -4.15 3.89 -0.02 -1.26 -4.84 135.00 130.87 1p8r n PRO 226 Ca -0.04 0.88 -0.34 0.00 -2.02 0.00 0.00 63.50 61.98 1p8r n PRO 226 Cb 0.63 -2.57 -0.08 0.00 -0.02 0.00 0.00 33.50 31.46 1p8r n PRO 226 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1p8r s ILE 227 N -0.92 4.74 -0.20 4.25 1.01 0.11 -1.57 121.20 128.62 1p8r s ILE 227 Ca 0.56 -0.25 0.01 0.00 0.00 0.00 0.00 60.65 60.97 1p8r s ILE 227 Cb -0.51 -3.09 0.05 0.00 0.01 0.00 0.00 42.46 38.91 1p8r s ILE 227 CO 0.61 0.48 -0.08 -2.28 0.00 0.00 0.00 174.94 173.67 1p8r s HIS 228 N -1.07 2.25 -0.29 3.97 5.65 -0.48 -0.65 115.29 124.67 1p8r s HIS 228 Ca 0.18 -1.52 -0.09 0.00 0.25 0.00 0.00 55.06 53.88 1p8r s HIS 228 Cb -0.12 -1.55 -0.02 0.00 -1.18 0.00 0.00 32.58 29.71 1p8r s HIS 228 CO 0.08 -0.72 0.14 -1.17 -0.65 0.00 0.00 174.74 172.42 1p8r s LEU 229 N 1.45 3.95 -0.48 8.88 2.96 -0.36 -0.89 118.68 134.19 1p8r s LEU 229 Ca -0.02 -0.35 -0.10 0.00 -0.22 0.00 0.00 54.13 53.45 1p8r s LEU 229 Cb -0.17 -2.01 0.12 0.00 0.50 0.00 0.00 46.19 44.63 1p8r s LEU 229 CO -0.08 -0.13 0.36 -0.44 -1.32 0.00 0.00 176.35 174.74 1p8r s SER 230 N 1.65 5.73 -0.25 3.68 0.01 -0.45 -0.71 113.70 123.36 1p8r s SER 230 Ca 0.06 -1.91 -0.15 0.00 1.31 0.00 0.00 55.95 55.26 1p8r s SER 230 Cb -0.16 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 64.00 1p8r s SER 230 CO 0.07 -0.70 0.35 0.12 0.41 0.00 0.00 173.24 173.48 1p8r s PHE 231 N 1.37 3.28 -0.37 2.43 2.19 -0.34 -2.09 117.98 124.44 1p8r s PHE 231 Ca 0.06 0.43 -0.13 0.00 0.33 0.00 0.00 56.93 57.62 1p8r s PHE 231 Cb -0.26 -2.53 0.01 0.00 -1.31 0.00 0.00 43.02 38.93 1p8r s PHE 231 CO -0.01 -0.15 0.24 0.34 1.83 0.00 0.00 175.22 177.48 1p8r s ASP 232 N 1.46 5.94 0.55 6.13 -1.08 0.11 -1.73 116.67 128.04 1p8r s ASP 232 Ca 0.15 -0.75 0.48 0.00 -0.52 0.00 0.00 52.55 51.91 1p8r s ASP 232 Cb -0.15 -2.10 1.71 0.00 -1.46 0.00 0.00 42.92 40.91 1p8r s ASP 232 CO 0.09 -0.35 1.59 0.58 0.52 0.00 0.00 175.17 177.60 1p8r h VAL 233 N 5.66 0.04 -0.06 1.11 2.07 -1.71 0.73 116.25 124.08 1p8r h VAL 233 Ca -0.28 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1p8r h VAL 233 Cb 1.13 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1p8r h VAL 233 CO 0.68 0.00 0.00 -0.90 0.02 0.00 0.00 177.57 177.37 1p8r n ASP 234 N -4.03 1.03 0.14 0.57 5.68 -1.26 -3.03 116.55 115.65 1p8r n ASP 234 Ca 0.43 -2.05 0.03 0.00 -0.50 0.00 0.00 54.79 52.70 1p8r n ASP 234 Cb 1.92 -0.32 0.03 0.00 -1.14 0.00 0.00 41.12 41.61 1p8r n ASP 234 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1p8r h GLY 235 N 5.29 0.00 -3.59 6.12 0.00 0.22 -3.35 103.07 107.76 1p8r h GLY 235 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 1p8r h GLY 235 CO 0.03 0.00 -0.18 1.08 0.00 0.00 0.00 176.54 177.47 1p8r s LEU 236 N -6.41 4.15 0.43 3.11 1.43 -1.17 -2.13 118.68 118.10 1p8r s LEU 236 Ca 0.04 0.74 -0.25 0.00 -1.03 0.00 0.00 54.13 53.63 1p8r s LEU 236 Cb 0.07 -3.52 -0.09 0.00 0.03 0.00 0.00 46.19 42.68 1p8r s LEU 236 CO 0.74 -0.09 1.24 -0.67 0.23 0.00 0.00 176.35 177.80 1p8r n ASP 237 N -0.44 2.38 0.00 2.29 -0.08 0.12 -4.59 116.55 116.24 1p8r n ASP 237 Ca -0.01 1.09 0.00 0.00 -1.51 0.00 0.00 54.79 54.35 1p8r n ASP 237 Cb 0.53 -1.49 0.00 0.00 2.34 0.00 0.00 41.12 42.50 1p8r n ASP 237 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1p8r n PRO 238 N -0.03 0.00 0.10 -0.67 -0.02 -1.26 0.27 135.00 133.39 1p8r n PRO 238 Ca 0.07 0.11 0.12 0.00 -2.02 0.00 0.00 63.50 61.78 1p8r n PRO 238 Cb 0.40 -1.53 0.17 0.00 -0.02 0.00 0.00 33.50 32.52 1p8r n PRO 238 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1p8r h VAL 239 N 0.00 0.00 0.00 -1.45 2.07 -1.96 -3.22 116.25 111.70 1p8r h VAL 239 Ca 0.00 -0.67 -0.20 0.00 0.82 0.00 0.00 66.70 66.65 1p8r h VAL 239 Cb 0.06 1.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 1p8r h VAL 239 CO 0.00 0.00 -1.70 0.49 0.02 0.00 0.00 177.57 176.38 1p8r n PHE 240 N -2.39 0.00 -3.34 1.57 3.72 0.14 -4.83 117.46 112.33 1p8r n PHE 240 Ca 0.03 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.16 1p8r n PHE 240 Cb 0.47 -0.46 -0.07 0.00 -0.94 0.00 0.00 39.48 38.48 1p8r n PHE 240 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1p8r n THR 241 N -3.20 2.09 -0.12 4.37 -2.24 -0.96 -3.79 114.28 110.43 1p8r n THR 241 Ca -0.23 -5.13 -0.06 0.00 -2.27 0.00 0.00 64.05 56.36 1p8r n THR 241 Cb 0.70 -1.99 0.02 0.00 -2.10 0.00 0.00 70.33 66.97 1p8r n THR 241 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1p8r h PRO 242 N 4.01 0.31 -4.32 -0.78 0.11 -1.76 -3.36 132.00 126.22 1p8r h PRO 242 Ca 0.18 -0.02 -0.66 0.00 0.11 0.00 0.00 66.00 65.61 1p8r h PRO 242 Cb 0.67 -0.07 0.03 0.00 0.11 0.00 0.00 31.00 31.74 1p8r h PRO 242 CO 0.79 0.21 2.53 0.00 -0.21 0.00 0.00 178.00 181.32 1p8r n ALA 243 N -2.33 3.95 -2.92 -0.75 0.00 -1.26 -4.67 120.51 112.53 1p8r n ALA 243 Ca 0.02 -3.43 -0.11 0.00 0.00 0.00 0.00 53.44 49.92 1p8r n ALA 243 Cb 0.13 -3.60 -0.12 0.00 0.00 0.00 0.00 19.45 15.86 1p8r n ALA 243 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1p8r s THR 244 N 4.48 0.14 0.30 0.00 2.01 -1.26 -2.05 115.64 119.27 1p8r s THR 244 Ca 0.54 -0.61 0.01 0.00 0.31 0.00 0.00 61.69 61.94 1p8r s THR 244 Cb 0.14 -0.23 0.17 0.00 0.01 0.00 0.00 72.50 72.60 1p8r s THR 244 CO 0.06 -0.30 1.87 1.23 -0.69 0.00 0.00 174.62 176.79 1p8r h GLY 245 N 5.17 0.82 -6.37 4.40 0.00 -1.89 -3.36 103.07 101.83 1p8r h GLY 245 Ca -0.30 -0.44 -0.59 0.00 0.00 0.00 0.00 47.33 46.00 1p8r h GLY 245 CO 0.45 0.42 -0.81 2.41 0.00 0.00 0.00 176.54 179.00 1p8r n THR 246 N -4.30 0.65 -2.57 4.70 -1.04 -1.26 -5.10 114.28 105.35 1p8r n THR 246 Ca 0.04 -4.45 -0.40 0.00 -2.04 0.00 0.00 64.05 57.20 1p8r n THR 246 Cb 0.20 -1.99 -0.05 0.00 -1.82 0.00 0.00 70.33 66.67 1p8r n THR 246 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1p8r s PRO 247 N -1.39 4.67 -0.06 -2.82 0.04 -1.26 -4.93 135.00 129.25 1p8r s PRO 247 Ca 0.34 1.68 0.01 0.00 0.04 0.00 0.00 61.00 63.06 1p8r s PRO 247 Cb 0.09 -3.16 0.02 0.00 0.04 0.00 0.00 34.50 31.49 1p8r s PRO 247 CO -0.11 0.28 -0.06 0.08 0.04 0.00 0.00 177.00 177.23 1p8r s VAL 248 N -1.21 0.70 0.66 -0.36 1.01 -1.26 -5.07 120.40 114.87 1p8r s VAL 248 Ca 0.44 -0.19 -0.16 0.00 0.00 0.00 0.00 61.98 62.08 1p8r s VAL 248 Cb -0.29 -0.72 0.00 0.00 0.00 0.00 0.00 36.38 35.38 1p8r s VAL 248 CO 0.37 0.27 1.14 0.68 0.00 0.00 0.00 175.10 177.57 1p8r s VAL 249 N 1.06 2.95 -0.31 2.92 -7.23 -1.26 -4.17 120.40 114.37 1p8r s VAL 249 Ca -0.08 0.47 -0.01 0.00 -1.81 0.00 0.00 61.98 60.55 1p8r s VAL 249 Cb -0.14 -3.02 0.00 0.00 0.56 0.00 0.00 36.38 33.78 1p8r s VAL 249 CO -0.01 -0.25 0.26 0.61 -0.31 0.00 0.00 175.10 175.41 1p8r n GLY 250 N -0.15 0.38 0.00 2.32 0.00 -1.26 -5.06 105.19 101.42 1p8r n GLY 250 Ca 0.11 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1p8r n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p8r n GLY 251 N -0.97 2.50 3.78 -0.02 0.00 -1.26 -4.97 105.19 104.25 1p8r n GLY 251 Ca -0.04 -2.03 -0.36 0.00 0.00 0.00 0.00 46.02 43.59 1p8r n GLY 251 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p8r s LEU 252 N 0.00 3.86 0.64 0.99 1.43 -0.90 -4.36 118.68 120.34 1p8r s LEU 252 Ca 0.00 2.17 -0.04 0.00 -1.03 0.00 0.00 54.13 55.23 1p8r s LEU 252 Cb 0.00 -4.46 0.05 0.00 0.03 0.00 0.00 46.19 41.81 1p8r s LEU 252 CO 0.00 -1.02 0.92 -0.94 0.23 0.00 0.00 176.35 175.54 1p8r s SER 253 N -1.67 5.04 0.13 2.29 1.04 -1.26 0.14 113.70 119.41 1p8r s SER 253 Ca 0.68 0.32 -0.19 0.00 0.48 0.00 0.00 55.95 57.25 1p8r s SER 253 Cb -0.24 -1.08 -0.01 0.00 0.10 0.00 0.00 66.02 64.78 1p8r s SER 253 CO 0.28 -1.40 1.73 0.22 0.98 0.00 0.00 173.24 175.06 1p8r h TYR 254 N -0.33 0.06 -0.08 5.02 3.20 -1.96 -0.91 116.97 121.98 1p8r h TYR 254 Ca -0.44 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.46 1p8r h TYR 254 Cb 1.30 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.57 1p8r h TYR 254 CO 0.36 0.01 0.01 0.00 -1.64 0.00 0.00 178.16 176.91 1p8r h ARG 255 N 0.13 0.05 -0.30 1.82 3.08 -1.99 -1.21 114.38 115.96 1p8r h ARG 255 Ca 0.11 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 1p8r h ARG 255 Cb 0.11 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 1p8r h ARG 255 CO -0.15 0.03 0.13 0.93 -1.07 0.00 0.00 179.97 179.84 1p8r h GLU 256 N 0.05 0.41 0.00 0.04 5.08 -1.88 0.17 114.58 118.44 1p8r h GLU 256 Ca 0.03 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1p8r h GLU 256 Cb 0.03 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1p8r h GLU 256 CO -0.04 0.34 -0.00 0.78 -1.00 0.00 0.00 179.01 179.09 1p8r h GLY 257 N 0.55 -0.00 2.00 -3.84 0.00 -0.75 -1.94 103.07 99.09 1p8r h GLY 257 Ca 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.41 1p8r h GLY 257 CO -0.01 -0.00 -0.15 1.41 0.00 0.00 0.00 176.54 177.79 1p8r h LEU 258 N -0.40 0.00 -0.38 3.11 3.38 -0.88 -2.41 115.31 117.73 1p8r h LEU 258 Ca -0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1p8r h LEU 258 Cb 0.40 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1p8r h LEU 258 CO 0.00 0.15 -0.25 0.22 0.09 0.00 0.00 178.44 178.65 1p8r h TYR 259 N 0.00 0.98 -0.37 1.13 3.20 -0.46 -0.98 116.97 120.46 1p8r h TYR 259 Ca -0.00 -0.26 -0.01 0.00 3.14 0.00 0.00 58.73 61.59 1p8r h TYR 259 Cb 0.28 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 1p8r h TYR 259 CO 0.00 1.04 0.19 0.82 -1.64 0.00 0.00 178.16 178.57 1p8r h ILE 260 N 0.64 1.16 -0.03 1.81 2.04 -0.87 -1.53 117.51 120.73 1p8r h ILE 260 Ca 0.08 -0.44 -0.12 0.00 1.00 0.00 0.00 64.86 65.37 1p8r h ILE 260 Cb 0.81 0.77 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 1p8r h ILE 260 CO 0.07 0.17 -0.55 0.71 0.00 0.00 0.00 178.15 178.55 1p8r h THR 261 N 0.47 1.39 -0.05 -0.27 1.35 -1.45 -1.75 112.91 112.60 1p8r h THR 261 Ca 0.13 -1.88 -0.15 0.00 -0.55 0.00 0.00 66.41 63.96 1p8r h THR 261 Cb 0.10 1.99 -0.01 0.00 -1.73 0.00 0.00 68.15 68.49 1p8r h THR 261 CO -0.02 0.54 -0.65 -0.33 -0.25 0.00 0.00 175.52 174.82 1p8r h GLU 262 N 0.06 0.19 0.00 4.72 5.08 -1.00 -1.13 114.58 122.50 1p8r h GLU 262 Ca -0.00 -0.15 -0.21 0.00 -1.00 0.00 0.00 59.36 58.00 1p8r h GLU 262 Cb 0.99 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 1p8r h GLU 262 CO 0.08 0.78 -0.91 0.93 -1.00 0.00 0.00 179.01 178.89 1p8r h GLU 263 N 0.14 0.28 -0.07 2.33 4.39 -1.06 -2.32 114.58 118.27 1p8r h GLU 263 Ca -0.01 -0.31 -0.16 0.00 0.34 0.00 0.00 59.36 59.22 1p8r h GLU 263 Cb 1.17 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.90 1p8r h GLU 263 CO 0.10 1.01 -0.65 0.82 -1.16 0.00 0.00 179.01 179.13 1p8r h ILE 264 N 0.16 1.39 0.49 3.13 2.04 -1.25 -2.79 117.51 120.68 1p8r h ILE 264 Ca -0.06 -2.06 -0.02 0.00 1.00 0.00 0.00 64.86 63.71 1p8r h ILE 264 Cb 1.54 2.05 0.00 0.00 -0.74 0.00 0.00 36.82 39.68 1p8r h ILE 264 CO 0.15 0.61 -0.23 0.22 0.00 0.00 0.00 178.15 178.89 1p8r h TYR 265 N 0.21 -0.61 -0.14 1.37 3.20 -1.14 -2.97 116.97 116.90 1p8r h TYR 265 Ca -0.01 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.88 1p8r h TYR 265 Cb 1.19 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 39.65 1p8r h TYR 265 CO 0.03 -0.31 0.31 0.87 -1.64 0.00 0.00 178.16 177.42 1p8r h LYS 266 N -0.82 0.00 0.00 1.82 1.57 -1.38 0.11 116.57 117.88 1p8r h LYS 266 Ca -0.07 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1p8r h LYS 266 Cb 0.57 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 1p8r h LYS 266 CO 0.11 0.00 -0.00 1.79 -0.57 0.00 0.00 179.45 180.78 1p8r h THR 267 N 0.00 0.00 0.00 -0.16 1.35 -1.32 -3.46 112.91 109.32 1p8r h THR 267 Ca 0.07 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 65.32 1p8r h THR 267 Cb 0.68 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.70 1p8r h THR 267 CO -0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1p8r n GLY 268 N 0.23 0.33 0.93 5.82 0.00 0.40 -4.87 105.19 108.03 1p8r n GLY 268 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.14 1p8r n GLY 268 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1p8r n LEU 269 N 0.00 2.96 -4.69 0.99 4.77 -1.26 -4.98 117.00 114.79 1p8r n LEU 269 Ca 0.00 -1.14 -0.43 0.00 -0.03 0.00 0.00 56.01 54.41 1p8r n LEU 269 Cb 0.17 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.16 1p8r n LEU 269 CO 0.00 0.55 1.43 -0.11 -1.33 0.00 0.00 177.39 177.93 1p8r n LEU 270 N 1.27 3.90 0.00 2.23 7.94 -1.26 -0.71 117.00 130.36 1p8r n LEU 270 Ca 0.14 1.01 0.00 0.00 -1.11 0.00 0.00 56.01 56.05 1p8r n LEU 270 Cb 0.55 -1.53 0.00 0.00 0.53 0.00 0.00 43.42 42.98 1p8r n LEU 270 CO 0.14 0.12 -0.42 -0.24 -1.11 0.00 0.00 177.39 175.87 1p8r n SER 271 N 5.17 4.05 -3.94 1.96 2.88 0.17 -4.82 113.62 119.10 1p8r n SER 271 Ca 0.18 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.59 1p8r n SER 271 Cb 0.35 0.34 -0.13 0.00 -0.75 0.00 0.00 64.21 64.02 1p8r n SER 271 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1p8r s GLY 272 N -2.90 0.19 -0.01 0.46 0.00 -0.88 -2.78 107.32 101.40 1p8r s GLY 272 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 44.72 44.46 1p8r s GLY 272 CO 0.00 -0.27 0.01 -2.27 0.00 0.00 0.00 173.10 170.57 1p8r s LEU 273 N -0.46 1.72 -0.03 0.66 0.20 -0.05 -1.22 118.68 119.50 1p8r s LEU 273 Ca -0.03 0.01 0.05 0.00 0.69 0.00 0.00 54.13 54.85 1p8r s LEU 273 Cb -0.03 -0.02 -0.01 0.00 -0.43 0.00 0.00 46.19 45.70 1p8r s LEU 273 CO -0.00 -0.04 -0.17 -1.81 -0.29 0.00 0.00 176.35 174.04 1p8r s ASP 274 N 0.33 2.13 -0.51 3.68 1.01 0.11 -0.93 116.67 122.48 1p8r s ASP 274 Ca -0.03 -0.34 0.04 0.00 0.71 0.00 0.00 52.55 52.93 1p8r s ASP 274 Cb -0.04 -0.50 0.14 0.00 1.01 0.00 0.00 42.92 43.53 1p8r s ASP 274 CO -0.01 0.17 0.28 -0.63 0.21 0.00 0.00 175.17 175.19 1p8r s ILE 275 N -0.08 2.25 0.41 0.77 -1.09 -0.73 -1.20 121.20 121.51 1p8r s ILE 275 Ca -0.01 -3.19 0.08 0.00 -2.23 0.00 0.00 60.65 55.30 1p8r s ILE 275 Cb -0.10 -2.55 -0.01 0.00 -1.58 0.00 0.00 42.46 38.21 1p8r s ILE 275 CO 0.01 -0.85 0.42 -0.04 -1.23 0.00 0.00 174.94 173.25 1p8r s MET 276 N -0.22 2.64 -1.80 2.79 -1.94 -0.70 -1.16 119.30 118.91 1p8r s MET 276 Ca 0.18 -1.43 0.00 0.00 -1.71 0.00 0.00 55.69 52.73 1p8r s MET 276 Cb -0.23 -2.49 0.00 0.00 2.01 0.00 0.00 34.83 34.12 1p8r s MET 276 CO -0.02 -0.19 0.00 0.39 -0.01 0.00 0.00 175.02 175.19 1p8r n GLU 277 N -1.62 -1.30 -3.06 2.03 -0.58 -0.96 -2.06 120.64 113.09 1p8r n GLU 277 Ca 0.04 1.06 -0.41 0.00 -0.42 0.00 0.00 57.16 57.43 1p8r n GLU 277 Cb 0.61 -5.39 -0.06 0.00 -0.57 0.00 0.00 31.44 26.03 1p8r n GLU 277 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1p8r s VAL 278 N -2.74 4.90 -0.36 2.62 1.01 -1.26 -4.34 120.40 120.24 1p8r s VAL 278 Ca 0.00 1.00 0.01 0.00 0.00 0.00 0.00 61.98 62.99 1p8r s VAL 278 Cb 0.00 -4.03 0.10 0.00 0.00 0.00 0.00 36.38 32.45 1p8r s VAL 278 CO 0.00 -0.14 0.10 0.21 0.00 0.00 0.00 175.10 175.26 1p8r s ASN 279 N 1.60 4.95 0.00 3.32 3.84 -0.87 -3.97 114.94 123.82 1p8r s ASN 279 Ca 0.27 -1.98 0.00 0.00 0.21 0.00 0.00 52.86 51.36 1p8r s ASN 279 Cb -0.15 -1.71 0.00 0.00 -0.55 0.00 0.00 41.25 38.84 1p8r s ASN 279 CO 0.11 -0.42 0.90 -2.65 -2.79 0.00 0.00 177.10 172.25 1p8r n PRO 280 N 4.43 0.00 -0.42 0.43 -0.02 -1.26 -1.53 135.00 136.64 1p8r n PRO 280 Ca -0.01 0.40 0.07 0.00 -2.02 0.00 0.00 63.50 61.94 1p8r n PRO 280 Cb 0.42 -1.59 0.22 0.00 -0.02 0.00 0.00 33.50 32.53 1p8r n PRO 280 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1p8r n THR 281 N -1.40 2.24 0.15 3.45 -2.24 -1.26 -4.75 114.28 110.47 1p8r n THR 281 Ca 0.00 -2.13 0.02 0.00 -2.27 0.00 0.00 64.05 59.67 1p8r n THR 281 Cb 0.09 -0.26 0.02 0.00 -2.10 0.00 0.00 70.33 68.08 1p8r n THR 281 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1p8r n LEU 282 N -0.83 1.42 0.00 3.22 4.77 -0.58 -5.05 117.00 119.95 1p8r n LEU 282 Ca 0.22 -1.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.12 1p8r n LEU 282 Cb 0.85 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.94 1p8r n LEU 282 CO 0.12 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1p8r n GLY 283 N 0.20 -1.46 0.05 -0.72 0.00 -1.26 -4.55 105.19 97.46 1p8r n GLY 283 Ca 0.02 -1.60 0.01 0.00 0.00 0.00 0.00 46.02 44.45 1p8r n GLY 283 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1p8r n LYS 284 N -0.99 0.71 -4.13 1.61 5.02 -1.26 -5.00 118.16 114.12 1p8r n LYS 284 Ca 0.00 -0.10 -0.10 0.00 -2.02 0.00 0.00 58.31 56.09 1p8r n LYS 284 Cb 0.00 -1.51 -0.10 0.00 -0.02 0.00 0.00 35.03 33.41 1p8r n LYS 284 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1p8r s THR 285 N -2.98 0.09 0.48 -0.18 -4.23 -1.26 -5.04 115.64 102.52 1p8r s THR 285 Ca -0.09 -1.86 0.18 0.00 -1.18 0.00 0.00 61.69 58.75 1p8r s THR 285 Cb 0.10 -2.05 0.24 0.00 1.34 0.00 0.00 72.50 72.13 1p8r s THR 285 CO 0.85 -0.41 2.08 -0.65 -0.54 0.00 0.00 174.62 175.94 1p8r h PRO 286 N 2.81 0.00 -0.16 3.99 0.11 -2.00 -2.16 132.00 134.60 1p8r h PRO 286 Ca -0.35 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.64 1p8r h PRO 286 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1p8r h PRO 286 CO 0.57 0.11 -0.45 1.05 -0.21 0.00 0.00 178.00 179.07 1p8r h GLU 287 N 0.00 0.39 -0.31 1.05 -0.00 -1.98 -1.38 114.58 112.34 1p8r h GLU 287 Ca -0.00 -0.21 -0.06 0.00 -0.00 0.00 0.00 59.36 59.10 1p8r h GLU 287 Cb 0.20 0.01 -0.02 0.00 -0.00 0.00 0.00 28.75 28.94 1p8r h GLU 287 CO 0.01 0.76 -0.05 0.93 -0.00 0.00 0.00 179.01 180.67 1p8r h GLU 288 N 0.32 0.50 0.18 1.06 5.08 -1.80 0.28 114.58 120.20 1p8r h GLU 288 Ca 0.02 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1p8r h GLU 288 Cb 0.92 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.10 1p8r h GLU 288 CO 0.08 0.57 -0.09 0.28 -1.00 0.00 0.00 179.01 178.85 1p8r h VAL 289 N 0.48 0.87 -0.97 3.13 2.07 -1.43 -1.65 116.25 118.75 1p8r h VAL 289 Ca 0.10 -1.01 0.12 0.00 0.82 0.00 0.00 66.70 66.72 1p8r h VAL 289 Cb 0.39 1.41 -0.08 0.00 -1.52 0.00 0.00 31.29 31.49 1p8r h VAL 289 CO 0.02 0.21 0.62 0.74 0.02 0.00 0.00 177.57 179.17 1p8r h THR 290 N -0.80 0.92 -0.05 2.57 2.02 -1.07 0.76 112.91 117.27 1p8r h THR 290 Ca -0.02 -0.32 -0.00 0.00 0.77 0.00 0.00 66.41 66.83 1p8r h THR 290 Cb 0.52 -0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 66.83 1p8r h THR 290 CO 0.04 0.17 0.02 -0.09 0.37 0.00 0.00 175.52 176.03 1p8r h ARG 291 N 0.94 0.07 -0.17 6.66 2.43 -0.45 0.11 114.38 123.96 1p8r h ARG 291 Ca 0.48 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.64 1p8r h ARG 291 Cb 0.50 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1p8r h ARG 291 CO -0.24 0.18 0.11 1.15 -1.51 0.00 0.00 179.97 179.66 1p8r h THR 292 N -0.06 1.05 0.03 0.20 2.02 -0.27 -2.16 112.91 113.73 1p8r h THR 292 Ca 0.02 -0.11 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 1p8r h THR 292 Cb 0.13 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 67.36 1p8r h THR 292 CO -0.00 0.05 -0.01 0.58 0.37 0.00 0.00 175.52 176.50 1p8r h VAL 293 N 0.23 1.15 -0.76 3.16 2.07 -0.84 -1.89 116.25 119.36 1p8r h VAL 293 Ca 0.06 -0.58 0.03 0.00 0.82 0.00 0.00 66.70 67.03 1p8r h VAL 293 Cb -0.01 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 1p8r h VAL 293 CO -0.01 0.15 0.50 0.78 0.02 0.00 0.00 177.57 179.01 1p8r h ASN 294 N -0.30 0.81 0.46 0.57 2.35 -0.77 -0.39 115.58 118.32 1p8r h ASN 294 Ca -0.00 -0.01 -0.13 0.00 -0.55 0.00 0.00 56.30 55.60 1p8r h ASN 294 Cb 0.28 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 1p8r h ASN 294 CO 0.01 0.56 -0.59 0.71 -1.65 0.00 0.00 177.43 176.47 1p8r h THR 295 N 0.94 1.40 -0.55 2.81 1.35 -1.33 -0.80 112.91 116.73 1p8r h THR 295 Ca 0.30 -1.98 -0.07 0.00 -0.55 0.00 0.00 66.41 64.11 1p8r h THR 295 Cb 0.03 2.03 -0.02 0.00 -1.73 0.00 0.00 68.15 68.46 1p8r h THR 295 CO -0.08 0.58 0.06 0.00 -0.25 0.00 0.00 175.52 175.83 1p8r h ALA 296 N 1.29 0.73 -0.36 6.62 0.00 -0.34 -1.62 119.26 125.58 1p8r h ALA 296 Ca -0.01 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 1p8r h ALA 296 Cb 1.07 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1p8r h ALA 296 CO 0.09 0.50 -0.25 0.28 0.00 0.00 0.00 179.25 179.86 1p8r h VAL 297 N 0.81 1.27 -0.94 0.00 2.07 -0.92 -2.17 116.25 116.37 1p8r h VAL 297 Ca 0.16 -1.37 -0.00 0.00 0.82 0.00 0.00 66.70 66.32 1p8r h VAL 297 Cb 0.45 1.27 -0.05 0.00 -1.52 0.00 0.00 31.29 31.44 1p8r h VAL 297 CO 0.02 0.45 0.59 0.00 0.02 0.00 0.00 177.57 178.64 1p8r h ALA 298 N 1.08 1.26 -0.27 1.67 0.00 -0.80 -0.69 119.26 121.51 1p8r h ALA 298 Ca 0.08 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 1p8r h ALA 298 Cb 0.76 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1p8r h ALA 298 CO 0.06 0.65 -0.53 -0.07 0.00 0.00 0.00 179.25 179.36 1p8r h LEU 299 N 1.29 0.87 -0.59 0.00 3.38 -1.06 -0.97 115.31 118.23 1p8r h LEU 299 Ca 0.34 -0.46 -0.09 0.00 0.09 0.00 0.00 57.88 57.76 1p8r h LEU 299 Cb -0.09 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 1p8r h LEU 299 CO -0.07 1.23 -0.00 0.74 0.09 0.00 0.00 178.44 180.43 1p8r h THR 300 N 0.61 1.27 -0.23 0.22 2.02 -1.02 -1.66 112.91 114.12 1p8r h THR 300 Ca 0.02 -1.14 -0.11 0.00 0.77 0.00 0.00 66.41 65.95 1p8r h THR 300 Cb 1.11 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 68.35 1p8r h THR 300 CO 0.11 0.41 -0.30 -0.07 0.37 0.00 0.00 175.52 176.04 1p8r h LEU 301 N 0.93 0.48 -0.96 2.58 3.38 -1.07 -2.66 115.31 117.99 1p8r h LEU 301 Ca 0.17 -0.18 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1p8r h LEU 301 Cb 0.55 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1p8r h LEU 301 CO 0.03 0.77 -0.26 -1.28 0.09 0.00 0.00 178.44 177.79 1p8r h SER 302 N 0.41 0.46 0.72 -0.43 0.87 -0.94 -1.56 113.55 113.07 1p8r h SER 302 Ca 0.05 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1p8r h SER 302 Cb 0.74 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 1p8r h SER 302 CO 0.06 0.71 0.00 0.00 -0.53 0.00 0.00 176.83 177.07 1p8r n PHE 304 N -2.63 0.53 0.00 0.00 3.72 -0.64 -4.52 117.46 113.93 1p8r n PHE 304 Ca 0.01 -1.19 0.00 0.00 -0.05 0.00 0.00 57.45 56.22 1p8r n PHE 304 Cb 0.23 -0.29 0.00 0.00 -0.94 0.00 0.00 39.48 38.47 1p8r n PHE 304 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1p8r n GLY 305 N -1.05 1.39 3.60 1.37 0.00 -1.10 -4.64 105.19 104.76 1p8r n GLY 305 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 1p8r n GLY 305 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p8r s THR 306 N -1.40 3.53 0.07 2.61 2.01 -0.90 -4.98 115.64 116.58 1p8r s THR 306 Ca 0.00 0.54 0.01 0.00 0.31 0.00 0.00 61.69 62.56 1p8r s THR 306 Cb 0.00 -3.70 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 1p8r s THR 306 CO 0.00 -0.44 0.16 -0.54 -0.69 0.00 0.00 174.62 173.12 1p8r s LYS 307 N 5.51 3.22 0.45 4.92 1.02 -1.26 -4.38 119.74 129.22 1p8r s LYS 307 Ca 0.78 -0.55 0.27 0.00 0.02 0.00 0.00 55.97 56.48 1p8r s LYS 307 Cb -0.22 -2.91 0.78 0.00 -0.52 0.00 0.00 37.83 34.96 1p8r s LYS 307 CO 0.33 0.59 1.76 0.00 -0.92 0.00 0.00 175.35 177.11 1p8r h ARG 308 N 3.10 0.00 0.00 1.68 3.08 -1.98 -2.76 114.38 117.49 1p8r h ARG 308 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1p8r h ARG 308 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.21 1p8r h ARG 308 CO 0.71 0.00 0.00 -0.85 -1.07 0.00 0.00 179.97 178.76 1p8r n GLU 309 N -2.99 0.17 0.00 0.04 0.28 -1.26 -5.00 120.64 111.87 1p8r n GLU 309 Ca 0.03 0.22 0.00 0.00 -0.16 0.00 0.00 57.16 57.24 1p8r n GLU 309 Cb 0.43 -1.73 0.00 0.00 1.43 0.00 0.00 31.44 31.57 1p8r n GLU 309 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1p8r n GLY 310 N 0.96 1.77 3.39 -1.84 0.00 -1.04 -5.12 105.19 103.30 1p8r n GLY 310 Ca 0.05 -2.23 -0.15 0.00 0.00 0.00 0.00 46.02 43.69 1p8r n GLY 310 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1p8r s ASN 311 N 0.00 -0.44 0.12 1.61 0.01 -1.26 -4.43 114.94 110.55 1p8r s ASN 311 Ca 0.00 0.29 -0.16 0.00 -0.71 0.00 0.00 52.86 52.28 1p8r s ASN 311 Cb 0.00 0.46 0.03 0.00 0.41 0.00 0.00 41.25 42.16 1p8r s ASN 311 CO 0.00 -0.63 0.40 -1.38 -1.51 0.00 0.00 177.10 173.97 1p8r s HIS 312 N -1.91 -0.20 -2.34 2.20 -3.43 -1.26 -5.14 115.29 103.21 1p8r s HIS 312 Ca -0.08 -0.09 0.29 0.00 -0.80 0.00 0.00 55.06 54.37 1p8r s HIS 312 Cb -0.01 0.25 1.32 0.00 -1.43 0.00 0.00 32.58 32.70 1p8r s HIS 312 CO 0.02 -0.69 1.90 1.63 -2.00 0.00 0.00 174.74 175.60