#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r8y s ASP 2 N 0.00 6.35 -1.10 4.52 1.11 -1.26 -5.01 116.67 121.29 1r8y s ASP 2 Ca 0.00 -2.40 -0.08 0.00 0.18 0.00 0.00 52.55 50.26 1r8y s ASP 2 Cb 0.00 -2.15 0.28 0.00 1.07 0.00 0.00 42.92 42.12 1r8y s ASP 2 CO 0.00 -0.64 1.15 -1.54 1.18 0.00 0.00 175.17 175.32 1r8y n SER 3 N 4.35 5.57 -4.55 0.27 3.41 -1.26 -5.04 113.62 116.37 1r8y n SER 3 Ca 0.04 -3.10 -0.31 0.00 -0.26 0.00 0.00 58.87 55.23 1r8y n SER 3 Cb 0.44 -1.34 -0.04 0.00 -0.26 0.00 0.00 64.21 63.01 1r8y n SER 3 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1r8y s VAL 4 N -1.53 3.24 -0.73 -3.33 -7.23 -1.26 -4.90 120.40 104.66 1r8y s VAL 4 Ca 0.31 -0.01 -0.16 0.00 -1.81 0.00 0.00 61.98 60.31 1r8y s VAL 4 Cb -0.07 -3.59 -0.18 0.00 0.56 0.00 0.00 36.38 33.09 1r8y s VAL 4 CO -0.06 -0.57 1.93 -1.22 -0.31 0.00 0.00 175.10 174.87 1r8y n TYR 5 N 14.72 0.55 -1.83 2.82 4.02 -1.26 -4.97 117.16 131.20 1r8y n TYR 5 Ca 0.33 -0.05 -0.37 0.00 -0.01 0.00 0.00 57.90 57.80 1r8y n TYR 5 Cb 0.50 -1.64 0.06 0.00 -0.02 0.00 0.00 39.34 38.24 1r8y n TYR 5 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1r8y s ARG 6 N 7.44 2.71 0.03 -0.72 0.52 -1.26 -4.97 118.95 122.70 1r8y s ARG 6 Ca 0.76 2.00 -0.14 0.00 -0.52 0.00 0.00 55.73 57.82 1r8y s ARG 6 Cb -0.23 -1.89 -0.35 0.00 0.52 0.00 0.00 34.95 33.00 1r8y s ARG 6 CO 0.20 -1.46 0.98 1.15 0.02 0.00 0.00 175.30 176.19 1r8y h THR 7 N 0.69 1.27 -3.64 0.02 2.02 -2.06 -3.46 112.91 107.76 1r8y h THR 7 Ca -0.51 -2.72 -0.12 0.00 0.77 0.00 0.00 66.41 63.84 1r8y h THR 7 Cb 1.32 3.01 -0.18 0.00 -1.74 0.00 0.00 68.15 70.57 1r8y h THR 7 CO 0.54 0.82 -0.45 0.00 0.37 0.00 0.00 175.52 176.80 1r8y s ARG 8 N -2.60 0.64 0.66 6.66 1.70 -1.26 -5.15 118.95 119.60 1r8y s ARG 8 Ca -0.09 -0.65 -0.17 0.00 -0.47 0.00 0.00 55.73 54.35 1r8y s ARG 8 Cb 0.04 0.26 -0.06 0.00 -0.57 0.00 0.00 34.95 34.63 1r8y s ARG 8 CO 0.93 -0.17 0.56 0.43 -1.08 0.00 0.00 175.30 175.97 1r8y n SER 9 N 0.79 -1.01 -4.72 -2.89 7.64 -1.26 -4.91 113.62 107.27 1r8y n SER 9 Ca -0.19 0.65 -0.42 0.00 1.01 0.00 0.00 58.87 59.92 1r8y n SER 9 Cb 0.58 -1.21 -0.03 0.00 -1.01 0.00 0.00 64.21 62.54 1r8y n SER 9 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1r8y s LEU 10 N -0.02 4.37 0.00 -3.43 1.43 -1.26 -3.41 118.68 116.36 1r8y s LEU 10 Ca 0.67 2.49 0.00 0.00 -1.03 0.00 0.00 54.13 56.27 1r8y s LEU 10 Cb -0.38 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.25 1r8y s LEU 10 CO 0.56 -0.76 0.00 0.61 0.23 0.00 0.00 176.35 176.99 1r8y n GLY 11 N 3.65 0.56 3.96 -3.19 0.00 -1.26 -5.08 105.19 103.84 1r8y n GLY 11 Ca 0.13 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 1r8y n GLY 11 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r8y s VAL 12 N -2.26 3.17 0.14 1.61 -7.23 -1.22 -5.08 120.40 109.53 1r8y s VAL 12 Ca 0.00 -0.58 0.04 0.00 -1.81 0.00 0.00 61.98 59.64 1r8y s VAL 12 Cb 0.00 -3.19 -0.04 0.00 0.56 0.00 0.00 36.38 33.71 1r8y s VAL 12 CO 0.00 -0.13 -0.10 0.00 -0.31 0.00 0.00 175.10 174.55 1r8y s ALA 13 N -2.70 1.43 0.31 1.32 0.00 -1.26 -4.61 121.76 116.25 1r8y s ALA 13 Ca 0.54 -1.46 0.05 0.00 0.00 0.00 0.00 51.96 51.09 1r8y s ALA 13 Cb -0.10 0.04 -0.06 0.00 0.00 0.00 0.00 23.12 23.00 1r8y s ALA 13 CO 0.39 -0.08 0.01 0.00 0.00 0.00 0.00 175.76 176.07 1r8y s ALA 14 N -3.22 2.41 -0.05 0.00 0.00 -1.26 -5.09 121.76 114.55 1r8y s ALA 14 Ca 0.16 -2.02 -0.16 0.00 0.00 0.00 0.00 51.96 49.94 1r8y s ALA 14 Cb 0.02 0.45 -0.10 0.00 0.00 0.00 0.00 23.12 23.49 1r8y s ALA 14 CO 0.01 -0.21 0.64 0.93 0.00 0.00 0.00 175.76 177.13 1r8y h GLU 15 N 2.15 -0.33 -1.01 0.00 3.07 -2.01 -3.25 114.58 113.19 1r8y h GLU 15 Ca -0.41 0.02 0.24 0.00 -0.50 0.00 0.00 59.36 58.72 1r8y h GLU 15 Cb 1.24 0.08 -0.12 0.00 -0.84 0.00 0.00 28.75 29.11 1r8y h GLU 15 CO 0.70 -0.07 0.61 0.78 -1.40 0.00 0.00 179.01 179.63 1r8y h GLY 16 N -1.02 1.81 -4.56 -3.84 0.00 -2.08 -3.45 103.07 89.94 1r8y h GLY 16 Ca -0.04 -0.30 -0.60 0.00 0.00 0.00 0.00 47.33 46.40 1r8y h GLY 16 CO 0.06 -0.21 -0.37 1.08 0.00 0.00 0.00 176.54 177.10 1r8y s LEU 17 N -10.25 4.31 0.52 3.11 1.43 -1.23 -5.08 118.68 111.49 1r8y s LEU 17 Ca -0.10 0.51 -0.21 0.00 -1.03 0.00 0.00 54.13 53.30 1r8y s LEU 17 Cb 0.27 -3.12 -0.06 0.00 0.03 0.00 0.00 46.19 43.31 1r8y s LEU 17 CO 0.80 0.12 1.16 -2.84 0.23 0.00 0.00 176.35 175.81 1r8y s PRO 18 N -2.46 3.45 0.64 1.29 0.02 -1.26 -4.62 135.00 132.06 1r8y s PRO 18 Ca 0.37 1.72 -0.17 0.00 0.02 0.00 0.00 61.00 62.94 1r8y s PRO 18 Cb -0.13 -2.15 -0.01 0.00 0.02 0.00 0.00 34.50 32.23 1r8y s PRO 18 CO 0.24 -0.79 1.16 -0.51 -0.33 0.00 0.00 177.00 176.77 1r8y s ASP 19 N -1.57 5.05 0.00 2.53 1.01 -1.26 -4.84 116.67 117.58 1r8y s ASP 19 Ca 0.70 2.20 0.00 0.00 0.71 0.00 0.00 52.55 56.16 1r8y s ASP 19 Cb -0.27 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.09 1r8y s ASP 19 CO 0.31 -1.68 0.00 0.00 0.21 0.00 0.00 175.17 174.01 1r8y n GLN 20 N -2.07 0.00 -0.18 8.23 1.13 -1.26 -1.26 117.38 121.97 1r8y n GLN 20 Ca 0.12 0.00 0.10 0.00 -1.94 0.00 0.00 57.00 55.28 1r8y n GLN 20 Cb 0.51 0.00 0.17 0.00 0.11 0.00 0.00 30.24 31.03 1r8y n GLN 20 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1r8y n TYR 21 N 0.00 0.26 0.29 1.08 4.01 -1.26 -4.85 117.16 116.69 1r8y n TYR 21 Ca 0.00 -0.97 0.16 0.00 -0.16 0.00 0.00 57.90 56.93 1r8y n TYR 21 Cb 0.00 -0.20 0.89 0.00 -0.31 0.00 0.00 39.34 39.72 1r8y n TYR 21 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1r8y h ALA 22 N 0.49 1.30 -0.69 -0.72 0.00 -1.51 -2.18 119.26 115.96 1r8y h ALA 22 Ca 0.00 -0.04 -0.42 0.00 0.00 0.00 0.00 54.91 54.45 1r8y h ALA 22 Cb 1.12 -0.01 -0.42 0.00 0.00 0.00 0.00 17.79 18.49 1r8y h ALA 22 CO 0.06 0.06 -0.95 -0.40 0.00 0.00 0.00 179.25 178.02 1r8y n ASP 23 N -3.58 3.38 -4.89 0.00 5.75 -1.26 -4.59 116.55 111.36 1r8y n ASP 23 Ca -0.02 -3.00 -0.29 0.00 -0.01 0.00 0.00 54.79 51.46 1r8y n ASP 23 Cb 0.15 -0.41 0.02 0.00 -1.03 0.00 0.00 41.12 39.85 1r8y n ASP 23 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1r8y s GLY 24 N -3.65 1.62 0.20 6.12 0.00 -0.82 -4.92 107.32 105.86 1r8y s GLY 24 Ca 0.40 -0.34 -0.23 0.00 0.00 0.00 0.00 44.72 44.55 1r8y s GLY 24 CO -0.01 -0.05 1.55 -2.09 0.00 0.00 0.00 173.10 172.50 1r8y h GLU 25 N -0.33 -0.03 -0.28 2.90 4.57 -1.96 -2.00 114.58 117.45 1r8y h GLU 25 Ca -0.45 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 57.62 1r8y h GLU 25 Cb 1.22 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.82 1r8y h GLU 25 CO 0.62 -0.02 -0.27 0.00 -1.18 0.00 0.00 179.01 178.16 1r8y h ALA 26 N 0.99 0.42 -0.60 2.92 0.00 -1.94 -2.66 119.26 118.38 1r8y h ALA 26 Ca 0.26 -0.40 0.06 0.00 0.00 0.00 0.00 54.91 54.84 1r8y h ALA 26 Cb 0.53 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 1r8y h ALA 26 CO -0.94 0.42 0.30 0.00 0.00 0.00 0.00 179.25 179.03 1r8y h ALA 27 N 0.70 0.79 -0.84 0.00 0.00 -1.79 0.36 119.26 118.49 1r8y h ALA 27 Ca 0.05 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1r8y h ALA 27 Cb 0.84 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 1r8y h ALA 27 CO 0.07 -0.05 0.55 0.07 0.00 0.00 0.00 179.25 179.88 1r8y h ARG 28 N 0.56 0.98 -0.01 0.00 0.11 -1.03 -1.62 114.38 113.38 1r8y h ARG 28 Ca 0.27 -0.06 -0.24 0.00 0.10 0.00 0.00 59.98 60.06 1r8y h ARG 28 Cb 0.21 -0.22 0.01 0.00 1.11 0.00 0.00 29.97 31.08 1r8y h ARG 28 CO -0.20 0.65 -0.96 0.28 0.10 0.00 0.00 179.97 179.83 1r8y h VAL 29 N 1.01 1.35 0.00 0.08 2.07 -1.23 -3.22 116.25 116.31 1r8y h VAL 29 Ca 0.34 -2.35 -0.02 0.00 0.82 0.00 0.00 66.70 65.49 1r8y h VAL 29 Cb 0.08 2.38 -0.00 0.00 -1.52 0.00 0.00 31.29 32.22 1r8y h VAL 29 CO -0.11 0.71 -0.10 -0.25 0.02 0.00 0.00 177.57 177.84 1r8y h TRP 30 N 0.30 0.00 -0.23 1.57 7.01 -0.28 -1.75 115.95 122.57 1r8y h TRP 30 Ca -0.09 0.00 -0.12 0.00 2.11 0.00 0.00 58.89 60.79 1r8y h TRP 30 Cb 1.60 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 28.66 1r8y h TRP 30 CO 0.08 0.10 -0.31 1.96 -2.79 0.00 0.00 178.44 177.48 1r8y h GLN 31 N 0.00 0.62 -0.95 2.65 4.20 -1.33 -1.20 115.11 119.11 1r8y h GLN 31 Ca -0.00 -0.36 0.18 0.00 0.06 0.00 0.00 58.65 58.53 1r8y h GLN 31 Cb 0.21 0.03 -0.10 0.00 0.30 0.00 0.00 27.48 27.91 1r8y h GLN 31 CO 0.01 0.96 0.54 -0.07 -0.67 0.00 0.00 178.83 179.60 1r8y h LEU 32 N 0.32 0.67 0.20 1.46 3.38 -1.45 -0.46 115.31 119.41 1r8y h LEU 32 Ca 0.03 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1r8y h LEU 32 Cb 0.89 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1r8y h LEU 32 CO 0.07 0.24 -0.09 0.22 0.09 0.00 0.00 178.44 178.97 1r8y h TYR 33 N 0.69 -0.24 0.00 1.13 3.20 -0.84 -1.86 116.97 119.04 1r8y h TYR 33 Ca 0.54 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.40 1r8y h TYR 33 Cb 0.83 0.08 0.00 0.00 1.54 0.00 0.00 36.73 39.18 1r8y h TYR 33 CO -0.04 0.13 0.00 -0.84 -1.64 0.00 0.00 178.16 175.77 1r8y h ILE 34 N -0.68 0.00 0.00 1.81 3.07 -0.95 -2.49 117.51 118.27 1r8y h ILE 34 Ca -0.03 -0.23 -0.06 0.00 1.55 0.00 0.00 64.86 66.09 1r8y h ILE 34 Cb 0.48 0.99 -0.01 0.00 -0.27 0.00 0.00 36.82 38.01 1r8y h ILE 34 CO 0.04 0.00 -0.95 1.23 -1.05 0.00 0.00 178.15 177.42 1r8y h GLY 35 N 1.65 0.00 -4.91 0.16 0.00 -0.90 -3.40 103.07 95.68 1r8y h GLY 35 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.07 1r8y h GLY 35 CO 0.00 0.00 1.38 2.09 0.00 0.00 0.00 176.54 180.01 1r8y n ASP 36 N -2.85 4.27 -1.20 0.19 3.85 -0.72 -3.92 116.55 116.17 1r8y n ASP 36 Ca -0.02 -2.22 0.11 0.00 -0.71 0.00 0.00 54.79 51.95 1r8y n ASP 36 Cb 0.65 -1.00 0.27 0.00 -1.35 0.00 0.00 41.12 39.69 1r8y n ASP 36 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 1r8y n THR 37 N 3.43 0.83 0.70 2.12 -2.24 -1.26 -4.54 114.28 113.32 1r8y n THR 37 Ca 0.37 -0.92 0.07 0.00 -2.27 0.00 0.00 64.05 61.30 1r8y n THR 37 Cb 0.34 0.66 0.35 0.00 -2.10 0.00 0.00 70.33 69.59 1r8y n THR 37 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1r8y n ARG 38 N 1.46 0.27 -3.32 -0.78 5.12 -1.25 -3.93 116.66 114.23 1r8y n ARG 38 Ca 0.21 0.11 -0.11 0.00 -1.93 0.00 0.00 57.85 56.13 1r8y n ARG 38 Cb 0.59 -1.50 -0.06 0.00 -1.16 0.00 0.00 32.46 30.33 1r8y n ARG 38 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1r8y s SER 39 N -2.37 0.50 0.14 0.55 1.04 -1.26 -5.13 113.70 107.17 1r8y s SER 39 Ca 0.15 -0.91 -0.31 0.00 0.48 0.00 0.00 55.95 55.36 1r8y s SER 39 Cb 0.09 0.98 -0.09 0.00 0.10 0.00 0.00 66.02 67.10 1r8y s SER 39 CO 0.18 -0.30 1.47 -0.60 0.98 0.00 0.00 173.24 174.97 1r8y s ARG 40 N 2.02 4.27 0.27 4.02 3.52 -1.25 -2.91 118.95 128.89 1r8y s ARG 40 Ca 0.13 2.21 -0.30 0.00 -0.13 0.00 0.00 55.73 57.64 1r8y s ARG 40 Cb -0.12 -3.20 -0.11 0.00 -1.56 0.00 0.00 34.95 29.96 1r8y s ARG 40 CO -0.17 -0.51 1.50 0.95 -0.81 0.00 0.00 175.30 176.26 1r8y s THR 41 N 1.09 2.42 0.22 4.11 -4.23 0.99 -4.90 115.64 115.34 1r8y s THR 41 Ca 0.67 0.35 -0.08 0.00 -1.18 0.00 0.00 61.69 61.45 1r8y s THR 41 Cb -0.40 -3.22 0.19 0.00 1.34 0.00 0.00 72.50 70.40 1r8y s THR 41 CO 0.31 0.06 1.87 0.00 -0.54 0.00 0.00 174.62 176.31 1r8y h ALA 42 N 4.98 1.08 -0.61 3.99 0.00 -1.92 -2.03 119.26 124.75 1r8y h ALA 42 Ca -0.46 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.40 1r8y h ALA 42 Cb 1.22 -0.34 -0.07 0.00 0.00 0.00 0.00 17.79 18.60 1r8y h ALA 42 CO 0.79 0.54 -0.36 0.39 0.00 0.00 0.00 179.25 180.61 1r8y n GLU 43 N -4.43 -0.27 0.13 0.00 -0.58 -1.26 -1.25 120.64 112.98 1r8y n GLU 43 Ca 0.09 1.00 -0.14 0.00 -0.42 0.00 0.00 57.16 57.69 1r8y n GLU 43 Cb 0.06 -1.48 -0.08 0.00 -0.57 0.00 0.00 31.44 29.37 1r8y n GLU 43 CO 0.00 0.00 0.00 -0.92 -0.48 0.00 0.00 177.13 175.73 1r8y h TYR 44 N 0.00 -0.29 -0.63 -0.32 3.20 -1.68 -2.51 116.97 114.74 1r8y h TYR 44 Ca 0.10 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.07 1r8y h TYR 44 Cb 0.25 0.10 -0.12 0.00 1.54 0.00 0.00 36.73 38.50 1r8y h TYR 44 CO -0.71 -0.03 -0.32 -0.22 -1.64 0.00 0.00 178.16 175.24 1r8y h LYS 45 N -0.52 -0.13 -0.61 1.82 3.64 -0.97 -0.92 116.57 118.89 1r8y h LYS 45 Ca -0.03 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 1r8y h LYS 45 Cb 0.39 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 1r8y h LYS 45 CO 0.05 -0.09 0.31 0.00 -2.27 0.00 0.00 179.45 177.46 1r8y h ALA 46 N 1.09 0.78 0.64 5.00 0.00 -1.15 -2.38 119.26 123.24 1r8y h ALA 46 Ca 0.25 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1r8y h ALA 46 Cb 0.55 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.11 1r8y h ALA 46 CO -0.71 0.32 -0.31 2.35 0.00 0.00 0.00 179.25 180.90 1r8y h TRP 47 N 0.82 -0.80 -0.41 0.00 7.01 -0.75 -0.82 115.95 121.01 1r8y h TRP 47 Ca 0.21 -0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.22 1r8y h TRP 47 Cb 0.08 0.26 -0.03 0.00 -2.10 0.00 0.00 29.16 27.37 1r8y h TRP 47 CO -0.01 -0.45 0.21 1.25 -2.79 0.00 0.00 178.44 176.65 1r8y h LEU 48 N -1.06 0.31 -1.10 0.65 5.85 -1.24 0.23 115.31 118.96 1r8y h LEU 48 Ca -0.09 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.59 1r8y h LEU 48 Cb 0.70 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 1r8y h LEU 48 CO 0.14 0.23 -0.01 -0.07 -0.34 0.00 0.00 178.44 178.39 1r8y h LEU 49 N 0.42 0.58 0.72 2.25 3.38 -1.52 -1.62 115.31 119.53 1r8y h LEU 49 Ca 0.17 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1r8y h LEU 49 Cb 0.07 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 40.67 1r8y h LEU 49 CO -0.11 0.66 -0.35 1.23 0.09 0.00 0.00 178.44 179.96 1r8y h GLY 50 N 0.90 -1.01 0.12 0.83 0.00 0.28 -2.68 103.07 101.51 1r8y h GLY 50 Ca 0.12 0.38 0.01 0.00 0.00 0.00 0.00 47.33 47.83 1r8y h GLY 50 CO 0.01 -0.37 -0.40 -2.00 0.00 0.00 0.00 176.54 173.78 1r8y h LEU 51 N -1.05 -1.21 -0.72 3.11 5.85 -0.46 0.26 115.31 121.09 1r8y h LEU 51 Ca -0.10 0.12 0.16 0.00 0.84 0.00 0.00 57.88 58.91 1r8y h LEU 51 Cb 0.76 0.44 -0.13 0.00 0.37 0.00 0.00 40.66 42.11 1r8y h LEU 51 CO 0.16 -0.43 -0.01 -0.07 -0.34 0.00 0.00 178.44 177.75 1r8y h LEU 52 N -0.59 -0.36 -0.08 2.25 3.38 -1.37 -0.34 115.31 118.20 1r8y h LEU 52 Ca -0.01 0.19 -0.25 0.00 0.09 0.00 0.00 57.88 57.90 1r8y h LEU 52 Cb 0.59 0.34 0.01 0.00 0.09 0.00 0.00 40.66 41.69 1r8y h LEU 52 CO -0.21 -0.17 -0.95 0.03 0.09 0.00 0.00 178.44 177.23 1r8y h ARG 53 N 0.10 0.67 0.00 1.13 3.08 -1.34 0.67 114.38 118.69 1r8y h ARG 53 Ca 0.39 -0.67 -0.02 0.00 0.07 0.00 0.00 59.98 59.76 1r8y h ARG 53 Cb 0.67 0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.89 1r8y h ARG 53 CO -0.64 1.26 -0.07 -0.56 -1.07 0.00 0.00 179.97 178.89 1r8y h GLN 54 N 0.40 0.00 -0.54 0.04 3.07 -0.39 -1.90 115.11 115.80 1r8y h GLN 54 Ca -0.10 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.64 1r8y h GLN 54 Cb 1.59 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.15 1r8y h GLN 54 CO 0.18 0.07 0.00 0.72 0.09 0.00 0.00 178.83 179.90 1r8y n HIS 55 N -4.31 0.79 -2.30 0.06 8.25 -0.19 -4.96 115.22 112.56 1r8y n HIS 55 Ca -0.03 -0.36 -0.20 0.00 -0.26 0.00 0.00 57.72 56.87 1r8y n HIS 55 Cb 0.15 -0.05 -0.02 0.00 1.12 0.00 0.00 29.99 31.20 1r8y n HIS 55 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1r8y n GLY 56 N 1.21 -0.21 3.80 -1.41 0.00 -0.71 -4.98 105.19 102.88 1r8y n GLY 56 Ca 0.17 -0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 1r8y n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r8y n HIS 58 N -0.15 0.00 -3.22 0.00 -0.00 -1.26 -4.72 115.22 105.86 1r8y n HIS 58 Ca 0.05 0.00 -0.42 0.00 0.46 0.00 0.00 57.72 57.81 1r8y n HIS 58 Cb 0.52 0.24 -0.08 0.00 -0.12 0.00 0.00 29.99 30.55 1r8y n HIS 58 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1r8y s ARG 59 N -1.52 3.43 0.02 1.57 0.52 -1.26 -1.90 118.95 119.82 1r8y s ARG 59 Ca 0.00 -0.34 0.09 0.00 -0.52 0.00 0.00 55.73 54.96 1r8y s ARG 59 Cb 0.00 -3.88 -0.03 0.00 0.52 0.00 0.00 34.95 31.57 1r8y s ARG 59 CO 0.00 -0.78 -0.26 0.08 0.02 0.00 0.00 175.30 174.36 1r8y s VAL 60 N 2.45 2.12 -0.16 3.52 1.01 -0.39 -0.62 120.40 128.33 1r8y s VAL 60 Ca 0.18 -1.30 0.01 0.00 0.00 0.00 0.00 61.98 60.88 1r8y s VAL 60 Cb -0.15 -1.79 0.02 0.00 0.00 0.00 0.00 36.38 34.45 1r8y s VAL 60 CO 0.15 0.44 -0.18 -0.22 0.00 0.00 0.00 175.10 175.28 1r8y s LEU 61 N -1.04 1.99 -0.38 3.92 2.96 -0.69 -1.17 118.68 124.27 1r8y s LEU 61 Ca 0.11 -0.59 -0.11 0.00 -0.22 0.00 0.00 54.13 53.33 1r8y s LEU 61 Cb -0.10 -1.37 0.04 0.00 0.50 0.00 0.00 46.19 45.25 1r8y s LEU 61 CO 0.01 -0.00 0.21 -0.62 -1.32 0.00 0.00 176.35 174.63 1r8y s ASP 62 N 1.26 5.71 0.00 3.68 -1.08 -0.32 -0.55 116.67 125.37 1r8y s ASP 62 Ca 0.03 -1.07 0.24 0.00 -0.52 0.00 0.00 52.55 51.22 1r8y s ASP 62 Cb -0.13 -2.01 0.36 0.00 -1.46 0.00 0.00 42.92 39.67 1r8y s ASP 62 CO -0.10 -0.41 1.36 1.33 0.52 0.00 0.00 175.17 177.87 1r8y n VAL 63 N 4.98 0.32 -3.16 1.11 0.24 -0.92 -1.30 118.33 119.60 1r8y n VAL 63 Ca -0.12 -0.65 -0.21 0.00 -2.04 0.00 0.00 64.34 61.32 1r8y n VAL 63 Cb 0.45 1.15 -0.04 0.00 -1.47 0.00 0.00 33.84 33.93 1r8y n VAL 63 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1r8y n ALA 64 N 1.42 2.53 -0.12 2.33 0.00 -1.23 -4.63 120.51 120.81 1r8y n ALA 64 Ca 0.18 -3.64 -0.11 0.00 0.00 0.00 0.00 53.44 49.87 1r8y n ALA 64 Cb 0.60 -0.88 -0.06 0.00 0.00 0.00 0.00 19.45 19.11 1r8y n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r8y n GLY 66 N -1.41 1.62 0.02 0.00 0.00 -1.26 -2.34 105.19 101.81 1r8y n GLY 66 Ca -0.01 -0.62 0.08 0.00 0.00 0.00 0.00 46.02 45.47 1r8y n GLY 66 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1r8y n THR 67 N 0.00 0.01 -1.25 2.61 -2.24 -1.26 -3.82 114.28 108.33 1r8y n THR 67 Ca 0.00 -0.01 -0.07 0.00 -2.27 0.00 0.00 64.05 61.70 1r8y n THR 67 Cb 0.00 -0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 67.97 1r8y n THR 67 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r8y n GLY 68 N 0.77 0.86 0.26 3.38 0.00 -0.99 -2.99 105.19 106.47 1r8y n GLY 68 Ca 0.12 -0.73 -0.01 0.00 0.00 0.00 0.00 46.02 45.40 1r8y n GLY 68 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1r8y h VAL 69 N 0.00 1.22 -0.09 1.61 -1.51 -1.90 -0.30 116.25 115.28 1r8y h VAL 69 Ca -0.14 -0.93 -0.06 0.00 -1.23 0.00 0.00 66.70 64.34 1r8y h VAL 69 Cb 0.48 1.07 0.00 0.00 -2.13 0.00 0.00 31.29 30.72 1r8y h VAL 69 CO 0.20 0.31 -0.17 0.44 -1.23 0.00 0.00 177.57 177.12 1r8y h ASP 70 N 0.48 0.31 -0.95 4.19 3.32 -1.93 -2.89 116.42 118.94 1r8y h ASP 70 Ca 0.09 -0.56 0.15 0.00 0.02 0.00 0.00 57.03 56.73 1r8y h ASP 70 Cb 0.43 -0.09 -0.09 0.00 0.22 0.00 0.00 39.33 39.80 1r8y h ASP 70 CO 0.02 0.81 0.56 0.28 -1.72 0.00 0.00 179.24 179.19 1r8y h SER 71 N -0.19 0.75 -0.73 6.45 0.02 -1.84 -1.69 113.55 116.33 1r8y h SER 71 Ca 0.00 0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 61.00 1r8y h SER 71 Cb 0.76 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 63.21 1r8y h SER 71 CO 0.04 0.33 0.35 0.40 -1.14 0.00 0.00 176.83 176.81 1r8y h ILE 72 N 0.79 1.24 -0.65 3.27 2.04 -1.03 0.36 117.51 123.52 1r8y h ILE 72 Ca 0.51 -0.68 -0.05 0.00 1.00 0.00 0.00 64.86 65.64 1r8y h ILE 72 Cb 0.68 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 1r8y h ILE 72 CO -0.33 0.29 0.22 -0.03 0.00 0.00 0.00 178.15 178.29 1r8y h MET 73 N 1.07 0.99 0.01 2.37 4.05 -1.12 -0.26 114.93 122.04 1r8y h MET 73 Ca 0.26 -0.19 -0.00 0.00 -0.28 0.00 0.00 59.70 59.49 1r8y h MET 73 Cb 0.12 -0.16 0.00 0.00 -0.80 0.00 0.00 31.60 30.77 1r8y h MET 73 CO -0.03 0.84 -0.01 -0.07 0.23 0.00 0.00 176.91 177.87 1r8y h LEU 74 N 0.96 -0.01 -0.53 3.39 3.38 -0.60 -2.57 115.31 119.33 1r8y h LEU 74 Ca 0.22 -0.64 0.06 0.00 0.09 0.00 0.00 57.88 57.61 1r8y h LEU 74 Cb 0.25 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.91 1r8y h LEU 74 CO -0.01 0.64 -0.53 0.58 0.09 0.00 0.00 178.44 179.21 1r8y h VAL 75 N -0.68 0.02 -0.82 1.22 2.07 -0.29 -1.74 116.25 116.03 1r8y h VAL 75 Ca -0.00 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.67 1r8y h VAL 75 Cb 0.65 0.02 -0.10 0.00 -1.52 0.00 0.00 31.29 30.34 1r8y h VAL 75 CO 0.00 0.00 0.38 -0.33 0.02 0.00 0.00 177.57 177.64 1r8y h GLU 76 N -0.31 0.52 0.00 1.57 5.08 -1.09 -0.31 114.58 120.04 1r8y h GLU 76 Ca 0.11 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1r8y h GLU 76 Cb 0.56 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1r8y h GLU 76 CO -0.67 0.34 0.00 0.39 -1.00 0.00 0.00 179.01 178.08 1r8y n GLU 77 N -4.94 0.81 -0.38 2.33 -0.58 -0.69 -4.86 120.64 112.34 1r8y n GLU 77 Ca 0.17 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.91 1r8y n GLU 77 Cb 0.45 -1.09 0.00 0.00 -0.57 0.00 0.00 31.44 30.24 1r8y n GLU 77 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1r8y n GLY 78 N 0.37 0.73 3.75 0.62 0.00 -0.13 -5.06 105.19 105.46 1r8y n GLY 78 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1r8y n GLY 78 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r8y s PHE 79 N -2.52 2.49 -0.28 1.61 0.08 -0.96 -5.02 117.98 113.37 1r8y s PHE 79 Ca 0.00 1.28 -0.08 0.00 0.12 0.00 0.00 56.93 58.25 1r8y s PHE 79 Cb 0.00 -3.13 -0.01 0.00 -0.57 0.00 0.00 43.02 39.31 1r8y s PHE 79 CO 0.00 -2.14 0.11 0.45 -0.10 0.00 0.00 175.22 173.54 1r8y s SER 80 N -3.53 5.32 -0.07 1.36 0.15 -0.80 -4.51 113.70 111.62 1r8y s SER 80 Ca 0.62 -0.41 0.02 0.00 0.70 0.00 0.00 55.95 56.89 1r8y s SER 80 Cb -0.17 -1.95 0.01 0.00 -1.71 0.00 0.00 66.02 62.20 1r8y s SER 80 CO 0.56 -0.12 -0.13 0.54 1.20 0.00 0.00 173.24 175.29 1r8y s VAL 81 N 1.60 1.20 -0.18 4.45 0.11 -1.26 -1.26 120.40 125.05 1r8y s VAL 81 Ca 0.05 -0.51 -0.07 0.00 -2.93 0.00 0.00 61.98 58.52 1r8y s VAL 81 Cb -0.16 -1.10 -0.04 0.00 -1.53 0.00 0.00 36.38 33.55 1r8y s VAL 81 CO 0.05 0.37 0.05 -0.32 -3.33 0.00 0.00 175.10 171.92 1r8y s MET 82 N 0.70 3.95 -0.13 1.54 1.75 -0.31 -2.33 119.30 124.47 1r8y s MET 82 Ca -0.14 -0.36 0.03 0.00 -1.25 0.00 0.00 55.69 53.97 1r8y s MET 82 Cb -0.16 -3.19 0.01 0.00 2.84 0.00 0.00 34.83 34.33 1r8y s MET 82 CO 0.03 0.26 -0.21 -1.12 -0.65 0.00 0.00 175.02 173.33 1r8y s SER 83 N 0.39 3.00 0.20 1.11 0.01 0.54 -1.18 113.70 117.78 1r8y s SER 83 Ca 0.02 -0.57 0.09 0.00 1.31 0.00 0.00 55.95 56.80 1r8y s SER 83 Cb -0.13 -1.38 -0.05 0.00 0.21 0.00 0.00 66.02 64.68 1r8y s SER 83 CO 0.00 0.08 -0.17 0.68 0.41 0.00 0.00 173.24 174.25 1r8y s VAL 84 N 0.76 1.91 0.23 3.43 -7.23 -0.42 -1.88 120.40 117.20 1r8y s VAL 84 Ca -0.09 -2.13 -0.16 0.00 -1.81 0.00 0.00 61.98 57.79 1r8y s VAL 84 Cb -0.16 -2.02 0.01 0.00 0.56 0.00 0.00 36.38 34.78 1r8y s VAL 84 CO 0.00 -0.45 0.53 -0.62 -0.31 0.00 0.00 175.10 174.26 1r8y s ASP 85 N -3.09 -0.17 0.00 4.85 -1.08 -1.14 -1.24 116.67 114.79 1r8y s ASP 85 Ca 0.21 -0.72 0.20 0.00 -0.52 0.00 0.00 52.55 51.72 1r8y s ASP 85 Cb -0.03 0.61 -0.13 0.00 -1.46 0.00 0.00 42.92 41.90 1r8y s ASP 85 CO 0.08 -1.14 0.90 0.00 0.52 0.00 0.00 175.17 175.53 1r8y n ALA 86 N -0.38 4.10 -2.53 3.66 0.00 -1.02 -0.01 120.51 124.33 1r8y n ALA 86 Ca -0.05 -0.57 -0.41 0.00 0.00 0.00 0.00 53.44 52.40 1r8y n ALA 86 Cb 0.61 -0.71 -0.09 0.00 0.00 0.00 0.00 19.45 19.26 1r8y n ALA 86 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1r8y s SER 87 N -2.62 6.18 0.23 0.00 0.15 -1.26 -4.94 113.70 111.44 1r8y s SER 87 Ca 0.11 -0.35 -0.03 0.00 0.70 0.00 0.00 55.95 56.39 1r8y s SER 87 Cb 0.15 -2.20 0.25 0.00 -1.71 0.00 0.00 66.02 62.51 1r8y s SER 87 CO 0.69 -0.40 1.66 0.44 1.20 0.00 0.00 173.24 176.83 1r8y h ASP 88 N 8.53 0.71 -0.44 5.45 3.32 -1.98 0.34 116.42 132.35 1r8y h ASP 88 Ca -0.29 -0.25 -0.03 0.00 0.02 0.00 0.00 57.03 56.48 1r8y h ASP 88 Cb 1.14 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.47 1r8y h ASP 88 CO 0.72 0.92 0.18 0.11 -1.72 0.00 0.00 179.24 179.44 1r8y h LYS 89 N 0.62 0.72 0.09 3.56 1.57 -2.01 -1.31 116.57 119.81 1r8y h LYS 89 Ca 0.09 -0.11 -0.25 0.00 -1.87 0.00 0.00 60.65 58.51 1r8y h LYS 89 Cb 0.70 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 1r8y h LYS 89 CO 0.05 0.61 -1.32 0.52 -0.57 0.00 0.00 179.45 178.74 1r8y h MET 90 N 0.71 0.19 -0.68 3.15 2.86 -1.83 -3.33 114.93 116.00 1r8y h MET 90 Ca 0.17 -0.32 0.18 0.00 -2.06 0.00 0.00 59.70 57.66 1r8y h MET 90 Cb 0.17 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.92 1r8y h MET 90 CO -0.01 1.15 0.48 -0.07 1.06 0.00 0.00 176.91 179.52 1r8y h LEU 91 N -0.44 0.11 -0.91 1.22 3.38 -0.85 -0.89 115.31 116.93 1r8y h LEU 91 Ca -0.30 0.01 0.18 0.00 0.09 0.00 0.00 57.88 57.86 1r8y h LEU 91 Cb 1.65 -0.01 -0.17 0.00 0.09 0.00 0.00 40.66 42.22 1r8y h LEU 91 CO 0.01 0.05 -0.26 0.50 0.09 0.00 0.00 178.44 178.83 1r8y h LYS 92 N 0.11 -0.01 0.00 1.13 3.64 -1.34 0.11 116.57 120.22 1r8y h LYS 92 Ca 0.33 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.58 1r8y h LYS 92 Cb 1.14 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.94 1r8y h LYS 92 CO -0.04 -0.01 -0.63 1.88 -2.27 0.00 0.00 179.45 178.39 1r8y h TYR 93 N -0.01 0.00 -0.16 1.91 0.05 -1.35 -0.46 116.97 116.96 1r8y h TYR 93 Ca 0.42 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 59.08 1r8y h TYR 93 Cb 0.65 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.40 1r8y h TYR 93 CO -0.74 0.63 -0.33 0.00 -1.05 0.00 0.00 178.16 176.66 1r8y h ALA 94 N 1.37 0.25 -0.23 3.88 0.00 -1.01 -2.82 119.26 120.71 1r8y h ALA 94 Ca -0.01 -0.43 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 1r8y h ALA 94 Cb 1.14 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1r8y h ALA 94 CO 0.08 0.30 -0.22 -0.07 0.00 0.00 0.00 179.25 179.35 1r8y h LEU 95 N 0.14 0.42 -0.75 0.00 3.38 -0.64 -1.41 115.31 116.45 1r8y h LEU 95 Ca 0.00 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1r8y h LEU 95 Cb 0.93 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 1r8y h LEU 95 CO 0.07 0.65 -0.28 0.50 0.09 0.00 0.00 178.44 179.47 1r8y h LYS 96 N 0.38 0.64 -0.11 1.13 3.64 -1.11 -1.66 116.57 119.48 1r8y h LYS 96 Ca 0.06 -0.27 -0.16 0.00 -1.27 0.00 0.00 60.65 59.01 1r8y h LYS 96 Cb 0.60 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.40 1r8y h LYS 96 CO 0.04 0.85 -0.56 1.49 -2.27 0.00 0.00 179.45 179.00 1r8y h GLU 97 N 0.55 0.57 -0.14 1.90 4.57 -1.21 -1.91 114.58 118.90 1r8y h GLU 97 Ca 0.07 -0.47 0.03 0.00 -1.18 0.00 0.00 59.36 57.81 1r8y h GLU 97 Cb 0.77 0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 29.43 1r8y h GLU 97 CO 0.06 1.09 -0.06 -0.09 -1.18 0.00 0.00 179.01 178.84 1r8y h ARG 98 N 0.18 -0.04 -0.99 1.92 2.43 -1.13 -1.62 114.38 115.14 1r8y h ARG 98 Ca -0.04 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.16 1r8y h ARG 98 Cb 1.21 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.71 1r8y h ARG 98 CO 0.12 -0.02 0.66 2.35 -1.51 0.00 0.00 179.97 181.56 1r8y h TRP 99 N -0.04 1.23 -0.39 2.20 2.91 -1.30 -1.62 115.95 118.95 1r8y h TRP 99 Ca 0.07 0.03 -0.03 0.00 1.13 0.00 0.00 58.89 60.09 1r8y h TRP 99 Cb 0.15 -0.42 -0.02 0.00 -0.51 0.00 0.00 29.16 28.36 1r8y h TRP 99 CO -0.19 0.74 0.11 -0.91 -1.03 0.00 0.00 178.44 177.16 1r8y h ASN 100 N 1.30 0.51 -0.75 2.65 2.35 -0.90 -2.66 115.58 118.09 1r8y h ASN 100 Ca 0.38 -0.07 -0.37 0.00 -0.55 0.00 0.00 56.30 55.69 1r8y h ASN 100 Cb -0.08 -0.13 -0.22 0.00 0.05 0.00 0.00 38.32 37.94 1r8y h ASN 100 CO -0.10 0.50 0.37 0.54 -1.65 0.00 0.00 177.43 177.09 1r8y n ARG 101 N -4.34 2.23 0.24 0.81 1.74 -0.65 -4.75 116.66 111.93 1r8y n ARG 101 Ca 0.02 -3.08 0.11 0.00 -0.77 0.00 0.00 57.85 54.14 1r8y n ARG 101 Cb 0.18 -2.05 0.58 0.00 -1.02 0.00 0.00 32.46 30.14 1r8y n ARG 101 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 1r8y h ARG 102 N 1.14 0.00 0.00 5.56 0.11 -0.95 -2.68 114.38 117.56 1r8y h ARG 102 Ca 0.46 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.54 1r8y h ARG 102 Cb 2.40 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 33.48 1r8y h ARG 102 CO 0.82 0.19 -0.02 0.87 0.10 0.00 0.00 179.97 181.93 1r8y h LYS 103 N 0.00 0.00 -6.32 0.08 6.56 -1.85 -3.39 116.57 111.64 1r8y h LYS 103 Ca -0.00 0.00 -0.55 0.00 -1.06 0.00 0.00 60.65 59.04 1r8y h LYS 103 Cb 0.56 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.21 1r8y h LYS 103 CO 0.02 0.00 0.76 -1.21 -2.06 0.00 0.00 179.45 176.96 1r8y s GLU 104 N -3.21 4.32 0.11 3.15 2.02 -1.01 -4.95 118.70 119.13 1r8y s GLU 104 Ca 0.07 1.77 -0.15 0.00 0.02 0.00 0.00 54.97 56.68 1r8y s GLU 104 Cb 0.05 -3.58 -0.05 0.00 0.10 0.00 0.00 34.13 30.65 1r8y s GLU 104 CO 0.67 -0.51 1.51 -1.35 0.02 0.00 0.00 175.26 175.61 1r8y h PRO 105 N 7.64 0.68 -0.85 0.39 0.11 -1.87 -2.31 132.00 135.79 1r8y h PRO 105 Ca -0.35 -0.26 0.22 0.00 0.11 0.00 0.00 66.00 65.72 1r8y h PRO 105 Cb 1.16 -0.04 -0.14 0.00 0.11 0.00 0.00 31.00 32.10 1r8y h PRO 105 CO 0.89 0.85 0.20 0.66 -0.21 0.00 0.00 178.00 180.40 1r8y h SER 106 N 0.47 -0.04 0.72 -2.05 4.64 -1.94 0.14 113.55 115.49 1r8y h SER 106 Ca 0.09 0.19 -0.10 0.00 -0.47 0.00 0.00 61.79 61.50 1r8y h SER 106 Cb 0.60 0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.95 1r8y h SER 106 CO 0.04 -0.14 -0.48 -0.26 -0.87 0.00 0.00 176.83 175.12 1r8y h PHE 107 N 0.21 0.00 0.00 4.77 0.04 -1.71 -2.25 116.94 118.00 1r8y h PHE 107 Ca 0.52 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.27 1r8y h PHE 107 Cb 1.02 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.17 1r8y h PHE 107 CO -0.28 0.48 -0.10 0.22 -0.60 0.00 0.00 178.31 178.02 1r8y h ASP 108 N 0.00 0.00 -0.50 2.17 3.58 -0.24 -2.63 116.42 118.80 1r8y h ASP 108 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1r8y h ASP 108 Cb 0.97 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.02 1r8y h ASP 108 CO 0.06 0.10 0.00 0.59 -2.88 0.00 0.00 179.24 177.11 1r8y n ASN 109 N -3.68 4.91 -4.72 2.28 3.02 -0.86 -4.91 115.26 111.31 1r8y n ASN 109 Ca -0.02 -2.81 -0.39 0.00 -0.03 0.00 0.00 54.58 51.33 1r8y n ASN 109 Cb 0.22 -0.60 -0.05 0.00 -0.61 0.00 0.00 39.78 38.73 1r8y n ASN 109 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 1r8y s TRP 110 N -2.51 3.55 -0.23 3.10 -0.00 -0.99 -4.61 118.94 117.24 1r8y s TRP 110 Ca 0.49 1.05 -0.07 0.00 -0.00 0.00 0.00 56.10 57.57 1r8y s TRP 110 Cb 0.37 -2.65 -0.03 0.00 -0.00 0.00 0.00 33.47 31.16 1r8y s TRP 110 CO 0.16 0.15 0.06 0.08 -0.00 0.00 0.00 176.95 177.40 1r8y s VAL 111 N 0.62 4.34 -0.11 5.86 1.01 -0.98 -5.03 120.40 126.10 1r8y s VAL 111 Ca 0.31 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.15 1r8y s VAL 111 Cb -0.16 -3.01 0.01 0.00 0.00 0.00 0.00 36.38 33.21 1r8y s VAL 111 CO 0.14 0.37 -0.22 -0.63 0.00 0.00 0.00 175.10 174.75 1r8y s ILE 112 N 1.36 1.98 0.12 2.22 1.01 -1.26 -0.34 121.20 126.30 1r8y s ILE 112 Ca 0.05 -0.96 -0.18 0.00 0.00 0.00 0.00 60.65 59.56 1r8y s ILE 112 Cb -0.15 -1.73 0.04 0.00 0.01 0.00 0.00 42.46 40.63 1r8y s ILE 112 CO 0.03 0.54 0.45 -0.70 0.00 0.00 0.00 174.94 175.26 1r8y s GLU 113 N 0.57 1.10 0.07 2.79 2.56 -0.79 -5.01 118.70 119.99 1r8y s GLU 113 Ca -0.14 -0.59 -0.19 0.00 0.00 0.00 0.00 54.97 54.05 1r8y s GLU 113 Cb -0.17 0.49 -0.07 0.00 2.00 0.00 0.00 34.13 36.39 1r8y s GLU 113 CO 0.04 -0.43 0.55 -1.21 -0.56 0.00 0.00 175.26 173.65 1r8y s GLU 114 N -3.58 4.16 -0.25 4.30 2.02 -1.26 -2.90 118.70 121.19 1r8y s GLU 114 Ca 0.01 0.69 -0.26 0.00 0.02 0.00 0.00 54.97 55.43 1r8y s GLU 114 Cb 0.01 -3.21 0.10 0.00 0.10 0.00 0.00 34.13 31.13 1r8y s GLU 114 CO -0.11 0.63 0.89 0.00 0.02 0.00 0.00 175.26 176.70 1r8y s ALA 115 N -1.13 -1.89 -0.13 5.21 0.00 0.98 -4.83 121.76 119.97 1r8y s ALA 115 Ca 0.29 1.86 -0.02 0.00 0.00 0.00 0.00 51.96 54.09 1r8y s ALA 115 Cb -0.19 -1.16 -0.02 0.00 0.00 0.00 0.00 23.12 21.74 1r8y s ALA 115 CO 0.18 -0.29 -0.08 1.21 0.00 0.00 0.00 175.76 176.79 1r8y s ASN 116 N 0.04 4.50 0.31 0.00 3.84 -1.26 -2.45 114.94 119.92 1r8y s ASN 116 Ca 0.00 -0.18 0.06 0.00 0.21 0.00 0.00 52.86 52.96 1r8y s ASN 116 Cb -0.04 -1.60 0.74 0.00 -0.55 0.00 0.00 41.25 39.80 1r8y s ASN 116 CO -0.02 0.20 1.79 -0.50 -2.79 0.00 0.00 177.10 175.79 1r8y h TRP 117 N 6.43 1.03 0.00 0.43 6.55 -1.94 0.12 115.95 128.57 1r8y h TRP 117 Ca -0.32 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.55 1r8y h TRP 117 Cb 1.19 -0.31 0.00 0.00 -0.86 0.00 0.00 29.16 29.18 1r8y h TRP 117 CO 0.53 0.26 0.00 1.28 -1.05 0.00 0.00 178.44 179.46 1r8y n LEU 118 N -4.71 0.49 -0.31 -4.49 4.77 -1.26 -2.86 117.00 108.63 1r8y n LEU 118 Ca 0.22 0.62 0.05 0.00 -0.03 0.00 0.00 56.01 56.87 1r8y n LEU 118 Cb 0.55 -0.56 0.07 0.00 -2.33 0.00 0.00 43.42 41.14 1r8y n LEU 118 CO 0.23 -0.49 0.40 0.35 -1.33 0.00 0.00 177.39 176.55 1r8y n THR 119 N -2.04 0.88 -0.05 -5.08 -2.24 0.18 -4.89 114.28 101.05 1r8y n THR 119 Ca 0.02 -1.07 0.14 0.00 -2.27 0.00 0.00 64.05 60.88 1r8y n THR 119 Cb 0.21 0.16 0.56 0.00 -2.10 0.00 0.00 70.33 69.16 1r8y n THR 119 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1r8y h LEU 120 N 0.01 0.24 -2.03 3.22 5.85 -0.77 0.12 115.31 121.95 1r8y h LEU 120 Ca -0.00 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 1r8y h LEU 120 Cb 1.22 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.20 1r8y h LEU 120 CO 0.00 0.14 -0.09 -2.24 -0.34 0.00 0.00 178.44 175.91 1r8y h ASP 121 N 0.27 0.00 0.03 1.25 -0.00 -1.85 -2.14 116.42 113.98 1r8y h ASP 121 Ca 0.26 0.00 -0.38 0.00 -0.00 0.00 0.00 57.03 56.91 1r8y h ASP 121 Cb 0.67 0.00 -0.07 0.00 -0.00 0.00 0.00 39.33 39.93 1r8y h ASP 121 CO -0.06 0.09 -2.39 0.29 -0.00 0.00 0.00 179.24 177.18 1r8y n LYS 122 N -3.64 0.67 0.08 4.15 4.01 -0.12 -4.57 118.16 118.74 1r8y n LYS 122 Ca -0.02 0.12 -0.04 0.00 -0.51 0.00 0.00 58.31 57.86 1r8y n LYS 122 Cb 0.21 -1.54 0.16 0.00 -0.51 0.00 0.00 35.03 33.34 1r8y n LYS 122 CO 0.00 0.00 0.00 -0.44 -1.11 0.00 0.00 177.40 175.85 1r8y h ASP 123 N 0.01 0.29 -3.68 4.39 3.32 -1.03 -3.43 116.42 116.29 1r8y h ASP 123 Ca -0.55 -0.15 -0.68 0.00 0.02 0.00 0.00 57.03 55.68 1r8y h ASP 123 Cb 2.02 -0.08 -0.29 0.00 0.22 0.00 0.00 39.33 41.19 1r8y h ASP 123 CO -0.03 0.76 -0.83 -0.69 -1.72 0.00 0.00 179.24 176.72 1r8y s VAL 124 N -3.93 2.49 -1.26 -1.35 1.01 -0.82 -4.91 120.40 111.63 1r8y s VAL 124 Ca -0.04 -0.89 -0.14 0.00 0.00 0.00 0.00 61.98 60.90 1r8y s VAL 124 Cb 0.12 -1.97 0.13 0.00 0.00 0.00 0.00 36.38 34.67 1r8y s VAL 124 CO 0.79 0.56 1.64 0.18 0.00 0.00 0.00 175.10 178.27 1r8y n LEU 125 N 3.13 5.46 -0.34 3.92 7.99 -1.26 -4.75 117.00 131.16 1r8y n LEU 125 Ca -0.18 -4.32 0.23 0.00 -0.01 0.00 0.00 56.01 51.73 1r8y n LEU 125 Cb 0.52 -1.64 0.48 0.00 -0.11 0.00 0.00 43.42 42.68 1r8y n LEU 125 CO 0.27 0.69 1.20 -1.28 -1.51 0.00 0.00 177.39 176.76 1r8y h SER 126 N 6.97 0.50 0.00 -1.43 0.87 -1.91 -3.48 113.55 115.07 1r8y h SER 126 Ca 0.38 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 61.05 1r8y h SER 126 Cb 0.82 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.81 1r8y h SER 126 CO 1.40 0.06 0.00 0.61 -0.53 0.00 0.00 176.83 178.37 1r8y n GLY 127 N -1.42 2.48 0.06 5.77 0.00 -1.26 -1.76 105.19 109.06 1r8y n GLY 127 Ca 0.27 -0.34 0.07 0.00 0.00 0.00 0.00 46.02 46.02 1r8y n GLY 127 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1r8y n ASP 128 N 4.98 0.24 0.00 1.61 9.92 -1.26 -5.00 116.55 127.04 1r8y n ASP 128 Ca 0.00 0.58 0.00 0.00 -0.53 0.00 0.00 54.79 54.84 1r8y n ASP 128 Cb 0.00 -0.63 0.00 0.00 -0.64 0.00 0.00 41.12 39.85 1r8y n ASP 128 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1r8y n GLY 129 N -0.67 2.48 3.84 0.44 0.00 -0.72 -4.35 105.19 106.20 1r8y n GLY 129 Ca 0.01 -2.04 -0.28 0.00 0.00 0.00 0.00 46.02 43.71 1r8y n GLY 129 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r8y s PHE 130 N -2.44 3.29 0.22 1.61 0.40 0.30 -4.54 117.98 116.82 1r8y s PHE 130 Ca 0.00 0.08 -0.04 0.00 -0.60 0.00 0.00 56.93 56.37 1r8y s PHE 130 Cb 0.00 -1.62 0.22 0.00 0.51 0.00 0.00 43.02 42.13 1r8y s PHE 130 CO 0.00 0.53 1.68 -0.44 0.70 0.00 0.00 175.22 177.69 1r8y h ASP 131 N 2.74 0.83 -3.90 1.36 3.32 -1.19 -1.43 116.42 118.15 1r8y h ASP 131 Ca -0.47 -0.25 -0.16 0.00 0.02 0.00 0.00 57.03 56.17 1r8y h ASP 131 Cb 1.18 -0.22 -0.25 0.00 0.22 0.00 0.00 39.33 40.26 1r8y h ASP 131 CO 0.67 0.95 -0.40 0.00 -1.72 0.00 0.00 179.24 178.74 1r8y s ALA 132 N -4.82 -0.65 -0.05 3.45 0.00 -1.04 -1.56 121.76 117.08 1r8y s ALA 132 Ca -0.10 0.72 0.06 0.00 0.00 0.00 0.00 51.96 52.64 1r8y s ALA 132 Cb 0.14 -0.41 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 1r8y s ALA 132 CO 0.83 -0.13 -0.22 0.08 0.00 0.00 0.00 175.76 176.31 1r8y s VAL 133 N 0.05 1.83 -0.01 0.00 1.01 0.42 -1.71 120.40 122.00 1r8y s VAL 133 Ca -0.01 -0.95 0.05 0.00 0.00 0.00 0.00 61.98 61.07 1r8y s VAL 133 Cb -0.02 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.79 1r8y s VAL 133 CO 0.01 0.52 -0.18 0.27 0.00 0.00 0.00 175.10 175.72 1r8y s ILE 134 N -0.18 1.38 -0.38 2.22 -4.36 0.29 -0.40 121.20 119.78 1r8y s ILE 134 Ca -0.01 -0.76 0.02 0.00 -0.26 0.00 0.00 60.65 59.64 1r8y s ILE 134 Cb -0.12 -1.15 0.16 0.00 1.25 0.00 0.00 42.46 42.59 1r8y s ILE 134 CO 0.02 0.38 0.32 0.00 0.24 0.00 0.00 174.94 175.91 1r8y s LEU 136 N 0.87 2.44 -0.84 0.00 1.43 -1.26 -2.42 118.68 118.90 1r8y s LEU 136 Ca 0.23 -1.46 -0.01 0.00 -1.03 0.00 0.00 54.13 51.85 1r8y s LEU 136 Cb -0.12 -0.94 0.00 0.00 0.03 0.00 0.00 46.19 45.16 1r8y s LEU 136 CO -0.06 -1.07 0.17 0.61 0.23 0.00 0.00 176.35 176.23 1r8y n GLY 137 N -1.61 0.01 2.46 -3.19 0.00 -1.26 -3.78 105.19 97.83 1r8y n GLY 137 Ca -0.10 -0.38 -0.20 0.00 0.00 0.00 0.00 46.02 45.34 1r8y n GLY 137 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1r8y n ASN 138 N -0.23 -5.59 0.22 1.61 5.15 -1.26 -4.90 115.26 110.26 1r8y n ASN 138 Ca -0.09 0.20 0.10 0.00 -0.60 0.00 0.00 54.58 54.19 1r8y n ASN 138 Cb 0.58 -4.77 0.43 0.00 -0.53 0.00 0.00 39.78 35.48 1r8y n ASN 138 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1r8y h SER 139 N 0.00 0.00 1.08 1.20 0.02 -1.83 -2.91 113.55 111.11 1r8y h SER 139 Ca -0.45 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.44 1r8y h SER 139 Cb 1.34 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.87 1r8y h SER 139 CO 0.58 0.23 -0.24 0.15 -1.14 0.00 0.00 176.83 176.41 1r8y h PHE 140 N 0.00 0.00 0.00 3.45 3.57 -1.88 -2.42 116.94 119.66 1r8y h PHE 140 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1r8y h PHE 140 Cb 0.79 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.53 1r8y h PHE 140 CO 0.00 0.24 0.00 0.00 -2.23 0.00 0.00 178.31 176.32 1r8y n ALA 141 N -2.21 1.82 0.13 2.41 0.00 -1.10 -2.08 120.51 119.47 1r8y n ALA 141 Ca 0.01 -0.07 -0.02 0.00 0.00 0.00 0.00 53.44 53.36 1r8y n ALA 141 Cb 0.48 -1.24 0.19 0.00 0.00 0.00 0.00 19.45 18.88 1r8y n ALA 141 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1r8y h HIS 142 N 0.00 0.11 -3.40 0.00 3.86 -1.61 0.47 115.15 114.58 1r8y h HIS 142 Ca 0.00 -0.04 -0.57 0.00 -1.16 0.00 0.00 60.37 58.60 1r8y h HIS 142 Cb 0.15 -0.02 -0.06 0.00 1.06 0.00 0.00 27.41 28.54 1r8y h HIS 142 CO 0.00 0.62 0.91 -1.17 0.86 0.00 0.00 177.93 179.15 1r8y s LEU 143 N -7.86 3.81 0.81 2.43 2.96 -0.88 -4.79 118.68 115.17 1r8y s LEU 143 Ca -0.03 0.89 -0.12 0.00 -0.22 0.00 0.00 54.13 54.66 1r8y s LEU 143 Cb 0.13 -3.54 0.08 0.00 0.50 0.00 0.00 46.19 43.36 1r8y s LEU 143 CO 0.77 -1.06 1.16 -2.16 -1.32 0.00 0.00 176.35 173.73 1r8y s PRO 144 N 4.07 1.93 -1.08 0.98 0.04 -1.26 -4.68 135.00 135.00 1r8y s PRO 144 Ca 0.49 0.21 -0.03 0.00 0.04 0.00 0.00 61.00 61.71 1r8y s PRO 144 Cb -0.12 -1.94 0.30 0.00 0.04 0.00 0.00 34.50 32.79 1r8y s PRO 144 CO 0.23 -1.64 1.65 -3.47 0.04 0.00 0.00 177.00 173.81 1r8y n ASP 145 N -3.36 6.73 0.14 6.66 2.03 -1.26 -4.83 116.55 122.66 1r8y n ASP 145 Ca 0.08 -3.48 0.05 0.00 0.52 0.00 0.00 54.79 51.95 1r8y n ASP 145 Cb 0.60 -1.25 0.50 0.00 -0.72 0.00 0.00 41.12 40.25 1r8y n ASP 145 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1r8y n LYS 147 N -4.44 0.62 0.00 0.00 2.85 -1.26 -5.01 118.16 110.92 1r8y n LYS 147 Ca -0.01 0.19 0.00 0.00 -1.05 0.00 0.00 58.31 57.44 1r8y n LYS 147 Cb 0.14 -1.80 0.00 0.00 -0.65 0.00 0.00 35.03 32.72 1r8y n LYS 147 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1r8y n GLY 148 N 1.37 3.15 3.76 2.58 0.00 -1.04 -5.05 105.19 109.95 1r8y n GLY 148 Ca -0.09 -0.89 -0.32 0.00 0.00 0.00 0.00 46.02 44.73 1r8y n GLY 148 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1r8y s ASP 149 N 0.00 4.44 -0.16 1.61 1.47 -1.26 -4.88 116.67 117.89 1r8y s ASP 149 Ca 0.00 1.92 0.00 0.00 1.18 0.00 0.00 52.55 55.65 1r8y s ASP 149 Cb 0.00 -2.53 0.16 0.00 -0.34 0.00 0.00 42.92 40.21 1r8y s ASP 149 CO 0.00 -2.08 1.63 0.00 0.68 0.00 0.00 175.17 175.40 1r8y n GLN 150 N -3.34 1.42 -0.32 2.11 6.02 -1.26 -4.48 117.38 117.53 1r8y n GLN 150 Ca 0.10 -0.90 0.10 0.00 -0.01 0.00 0.00 57.00 56.28 1r8y n GLN 150 Cb 0.53 -1.35 0.27 0.00 1.02 0.00 0.00 30.24 30.70 1r8y n GLN 150 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1r8y h SER 151 N 0.77 0.59 0.73 1.08 4.64 -1.97 -0.84 113.55 118.55 1r8y h SER 151 Ca 0.18 0.10 -0.09 0.00 -0.47 0.00 0.00 61.79 61.51 1r8y h SER 151 Cb 1.25 0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 1r8y h SER 151 CO 0.39 0.21 -0.45 -0.33 -0.87 0.00 0.00 176.83 175.78 1r8y h GLU 152 N 0.64 0.00 -0.10 4.77 5.08 -1.92 -1.82 114.58 121.23 1r8y h GLU 152 Ca 0.51 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.86 1r8y h GLU 152 Cb 0.79 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.04 1r8y h GLU 152 CO -0.39 0.45 -0.02 0.45 -1.00 0.00 0.00 179.01 178.50 1r8y h HIS 153 N 0.00 0.20 -0.13 4.33 3.86 -1.52 -0.61 115.15 121.29 1r8y h HIS 153 Ca -0.00 -0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.16 1r8y h HIS 153 Cb 0.93 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 29.35 1r8y h HIS 153 CO 0.00 0.48 0.07 -0.09 0.86 0.00 0.00 177.93 179.24 1r8y h ARG 154 N -0.13 0.17 0.12 2.45 2.43 -0.90 0.14 114.38 118.66 1r8y h ARG 154 Ca 0.03 -0.01 -0.16 0.00 -0.81 0.00 0.00 59.98 59.02 1r8y h ARG 154 Cb 0.41 -0.04 0.02 0.00 -0.42 0.00 0.00 29.97 29.94 1r8y h ARG 154 CO 0.01 0.13 -0.71 1.25 -1.51 0.00 0.00 179.97 179.13 1r8y h LEU 155 N 0.17 0.42 -0.56 3.80 5.85 -1.21 -2.60 115.31 121.18 1r8y h LEU 155 Ca 0.05 -0.95 0.06 0.00 0.84 0.00 0.00 57.88 57.88 1r8y h LEU 155 Cb 0.01 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 1r8y h LEU 155 CO -0.01 1.34 0.27 0.00 -0.34 0.00 0.00 178.44 179.70 1r8y h ALA 156 N 0.09 0.73 -0.20 1.25 0.00 -0.66 -1.32 119.26 119.14 1r8y h ALA 156 Ca -0.12 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1r8y h ALA 156 Cb 1.55 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 1r8y h ALA 156 CO 0.13 -0.09 -0.10 -0.07 0.00 0.00 0.00 179.25 179.12 1r8y h LEU 157 N 0.51 0.44 -1.74 0.00 3.38 -1.10 -1.73 115.31 115.08 1r8y h LEU 157 Ca 0.26 -0.42 0.09 0.00 0.09 0.00 0.00 57.88 57.91 1r8y h LEU 157 Cb 0.21 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 1r8y h LEU 157 CO -0.20 0.76 0.35 0.50 0.09 0.00 0.00 178.44 179.94 1r8y h LYS 158 N 0.12 0.29 0.02 1.13 3.64 -1.31 -0.29 116.57 120.18 1r8y h LYS 158 Ca 0.04 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1r8y h LYS 158 Cb 0.60 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1r8y h LYS 158 CO 0.03 0.19 -0.01 -0.91 -2.27 0.00 0.00 179.45 176.49 1r8y h ASN 159 N 0.30 -0.02 -0.48 4.20 4.21 -1.05 -1.38 115.58 121.36 1r8y h ASN 159 Ca 0.24 -0.73 0.10 0.00 1.21 0.00 0.00 56.30 57.12 1r8y h ASN 159 Cb 0.54 0.01 -0.10 0.00 -1.12 0.00 0.00 38.32 37.65 1r8y h ASN 159 CO -0.05 0.75 -0.16 0.40 -1.29 0.00 0.00 177.43 177.08 1r8y h ILE 160 N -0.84 0.45 -0.97 2.81 2.04 -1.23 -1.79 117.51 117.98 1r8y h ILE 160 Ca -0.00 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.91 1r8y h ILE 160 Cb 0.75 0.45 -0.06 0.00 -0.74 0.00 0.00 36.82 37.22 1r8y h ILE 160 CO 0.00 0.00 0.63 0.00 0.00 0.00 0.00 178.15 178.79 1r8y h ALA 161 N 1.38 1.42 0.00 1.87 0.00 -1.05 -1.08 119.26 121.80 1r8y h ALA 161 Ca 0.23 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1r8y h ALA 161 Cb 0.40 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1r8y h ALA 161 CO -0.52 0.45 0.06 0.66 0.00 0.00 0.00 179.25 179.90 1r8y h SER 162 N 1.16 0.00 1.56 0.00 4.64 -0.35 -1.57 113.55 118.98 1r8y h SER 162 Ca 0.41 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1r8y h SER 162 Cb 0.13 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1r8y h SER 162 CO -0.15 0.00 -0.01 0.24 -0.87 0.00 0.00 176.83 176.04 1r8y h MET 163 N 0.00 0.00 -6.16 4.77 2.86 -0.98 -3.45 114.93 111.96 1r8y h MET 163 Ca 0.00 0.00 -0.56 0.00 -2.06 0.00 0.00 59.70 57.08 1r8y h MET 163 Cb 0.12 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.73 1r8y h MET 163 CO 0.00 0.01 0.24 0.08 1.06 0.00 0.00 176.91 178.30 1r8y s VAL 164 N -3.41 4.96 0.69 -2.22 1.01 -0.59 -0.54 120.40 120.29 1r8y s VAL 164 Ca 0.04 1.70 -0.16 0.00 0.00 0.00 0.00 61.98 63.57 1r8y s VAL 164 Cb 0.07 -4.16 0.02 0.00 0.00 0.00 0.00 36.38 32.30 1r8y s VAL 164 CO 0.62 0.18 1.21 0.00 0.00 0.00 0.00 175.10 177.11 1r8y s ARG 165 N 1.07 2.41 0.30 2.72 3.03 -0.54 -4.69 118.95 123.25 1r8y s ARG 165 Ca 0.43 1.78 -0.29 0.00 2.03 0.00 0.00 55.73 59.67 1r8y s ARG 165 Cb -0.19 -1.86 -0.13 0.00 -1.03 0.00 0.00 34.95 31.74 1r8y s ARG 165 CO 0.21 -1.63 1.30 -2.30 -1.13 0.00 0.00 175.30 171.75 1r8y n PRO 166 N -2.38 2.01 -1.24 3.89 -0.02 -1.26 -1.14 135.00 134.87 1r8y n PRO 166 Ca 0.13 0.71 -0.08 0.00 -2.02 0.00 0.00 63.50 62.24 1r8y n PRO 166 Cb 0.50 -2.30 -0.03 0.00 -0.02 0.00 0.00 33.50 31.65 1r8y n PRO 166 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r8y n GLY 167 N 1.33 1.00 3.73 -1.23 0.00 -1.24 -4.89 105.19 103.88 1r8y n GLY 167 Ca 0.08 -0.53 -0.23 0.00 0.00 0.00 0.00 46.02 45.34 1r8y n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r8y n GLY 168 N -1.75 2.51 3.43 -0.02 0.00 -0.29 -4.76 105.19 104.31 1r8y n GLY 168 Ca -0.08 -2.27 -0.33 0.00 0.00 0.00 0.00 46.02 43.34 1r8y n GLY 168 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r8y s LEU 169 N 0.00 2.71 -0.21 0.99 1.02 -0.60 -2.44 118.68 120.16 1r8y s LEU 169 Ca 0.39 -0.25 -0.02 0.00 0.02 0.00 0.00 54.13 54.27 1r8y s LEU 169 Cb -0.03 -1.57 0.00 0.00 0.02 0.00 0.00 46.19 44.61 1r8y s LEU 169 CO 0.25 0.28 -0.10 -0.22 0.02 0.00 0.00 176.35 176.58 1r8y s LEU 170 N -0.33 2.63 -0.35 1.79 2.96 0.11 -0.44 118.68 125.05 1r8y s LEU 170 Ca 0.03 -0.49 -0.08 0.00 -0.22 0.00 0.00 54.13 53.37 1r8y s LEU 170 Cb -0.13 -1.65 0.04 0.00 0.50 0.00 0.00 46.19 44.96 1r8y s LEU 170 CO 0.02 -0.02 0.14 -0.69 -1.32 0.00 0.00 176.35 174.49 1r8y s VAL 171 N 1.41 3.98 -0.03 1.68 1.01 0.47 -0.23 120.40 128.69 1r8y s VAL 171 Ca 0.05 -1.09 0.02 0.00 0.00 0.00 0.00 61.98 60.96 1r8y s VAL 171 Cb -0.14 -3.26 0.01 0.00 0.00 0.00 0.00 36.38 32.99 1r8y s VAL 171 CO -0.07 -0.21 -0.08 -0.51 0.00 0.00 0.00 175.10 174.23 1r8y s ILE 172 N 1.44 0.74 0.40 2.22 2.07 -0.27 0.07 121.20 127.87 1r8y s ILE 172 Ca -0.01 -0.31 0.07 0.00 -1.41 0.00 0.00 60.65 59.00 1r8y s ILE 172 Cb -0.20 -0.68 -0.07 0.00 0.13 0.00 0.00 42.46 41.65 1r8y s ILE 172 CO 0.04 0.24 0.07 1.51 -1.91 0.00 0.00 174.94 174.89 1r8y s ASP 173 N 0.37 4.09 -0.04 4.50 -4.77 -1.02 -0.24 116.67 119.57 1r8y s ASP 173 Ca -0.06 -1.22 -0.27 0.00 -3.30 0.00 0.00 52.55 47.70 1r8y s ASP 173 Cb -0.10 -0.44 0.06 0.00 -1.09 0.00 0.00 42.92 41.35 1r8y s ASP 173 CO 0.01 -0.45 0.58 -1.38 0.70 0.00 0.00 175.17 174.63 1r8y s HIS 174 N -2.65 -0.54 0.82 2.11 -3.43 -0.67 -4.48 115.29 106.45 1r8y s HIS 174 Ca 0.37 0.91 -0.13 0.00 -0.80 0.00 0.00 55.06 55.41 1r8y s HIS 174 Cb 0.07 0.33 0.09 0.00 -1.43 0.00 0.00 32.58 31.63 1r8y s HIS 174 CO 0.20 -0.55 1.20 0.50 -2.00 0.00 0.00 174.74 174.09 1r8y s ARG 175 N -1.22 1.58 -1.09 -0.38 3.52 -1.26 -1.01 118.95 119.09 1r8y s ARG 175 Ca -0.12 1.74 -0.23 0.00 -0.13 0.00 0.00 55.73 56.99 1r8y s ARG 175 Cb -0.01 -1.77 -0.07 0.00 -1.56 0.00 0.00 34.95 31.53 1r8y s ARG 175 CO 0.08 -2.25 1.94 1.21 -0.81 0.00 0.00 175.30 175.47 1r8y s ASN 176 N -2.20 5.06 0.25 -2.12 3.84 0.13 -4.71 114.94 115.17 1r8y s ASN 176 Ca 0.73 -1.32 0.26 0.00 0.21 0.00 0.00 52.86 52.73 1r8y s ASN 176 Cb -0.28 -2.58 0.84 0.00 -0.55 0.00 0.00 41.25 38.68 1r8y s ASN 176 CO 0.51 -2.97 1.76 1.88 -2.79 0.00 0.00 177.10 175.48 1r8y h TYR 177 N 10.27 0.00 -0.43 0.43 0.05 -1.89 -2.34 116.97 123.07 1r8y h TYR 177 Ca 0.17 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.88 1r8y h TYR 177 Cb 0.96 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.69 1r8y h TYR 177 CO 1.21 0.00 -0.01 -0.44 -1.05 0.00 0.00 178.16 177.87 1r8y h ASP 178 N 0.00 0.75 0.25 3.88 3.32 -1.84 -1.19 116.42 121.58 1r8y h ASP 178 Ca 0.00 -0.31 -0.01 0.00 0.02 0.00 0.00 57.03 56.73 1r8y h ASP 178 Cb 0.65 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1r8y h ASP 178 CO 0.00 0.88 -0.12 0.22 -1.72 0.00 0.00 179.24 178.50 1r8y h TYR 179 N 0.60 -0.31 -0.40 4.55 3.20 -1.90 -2.83 116.97 119.88 1r8y h TYR 179 Ca 0.12 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.07 1r8y h TYR 179 Cb 0.50 0.10 -0.08 0.00 1.54 0.00 0.00 36.73 38.79 1r8y h TYR 179 CO 0.04 0.00 -0.18 0.82 -1.64 0.00 0.00 178.16 177.20 1r8y h ILE 180 N -0.63 0.44 -0.42 1.81 2.04 -1.35 0.14 117.51 119.54 1r8y h ILE 180 Ca -0.03 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.73 1r8y h ILE 180 Cb 0.45 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 1r8y h ILE 180 CO 0.06 0.00 -0.12 -0.07 0.00 0.00 0.00 178.15 178.02 1r8y h LEU 181 N -0.11 0.74 -0.48 1.44 3.38 -1.31 2.46 115.31 121.42 1r8y h LEU 181 Ca 0.19 -0.22 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 1r8y h LEU 181 Cb 0.41 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1r8y h LEU 181 CO -0.47 0.88 -0.53 0.77 0.09 0.00 0.00 178.44 179.18 1r8y h SER 182 N 0.68 0.00 0.14 -0.43 4.64 -1.02 -3.19 113.55 114.36 1r8y h SER 182 Ca 0.12 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.14 1r8y h SER 182 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1r8y h SER 182 CO 0.04 0.53 -1.50 0.74 -0.87 0.00 0.00 176.83 175.77 1r8y h THR 183 N 0.00 1.01 0.00 2.95 2.02 -0.49 -3.48 112.91 114.92 1r8y h THR 183 Ca -0.01 -2.43 0.00 0.00 0.77 0.00 0.00 66.41 64.74 1r8y h THR 183 Cb 1.20 2.74 0.00 0.00 -1.74 0.00 0.00 68.15 70.35 1r8y h THR 183 CO 0.07 0.75 0.00 0.61 0.37 0.00 0.00 175.52 177.32 1r8y n GLY 184 N 1.78 0.92 3.30 2.16 0.00 0.83 -5.04 105.19 109.13 1r8y n GLY 184 Ca -0.25 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 1r8y n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r8y s ALA 186 N -0.56 3.10 0.46 0.00 0.00 -1.26 -4.46 121.76 119.03 1r8y s ALA 186 Ca 0.09 -2.45 -0.25 0.00 0.00 0.00 0.00 51.96 49.35 1r8y s ALA 186 Cb -0.10 -2.33 -0.08 0.00 0.00 0.00 0.00 23.12 20.61 1r8y s ALA 186 CO -0.01 -1.73 1.37 -2.14 0.00 0.00 0.00 175.76 173.25 1r8y s PRO 187 N 1.14 3.66 0.43 0.00 0.02 -1.26 -4.89 135.00 134.09 1r8y s PRO 187 Ca 0.07 2.29 -0.17 0.00 0.02 0.00 0.00 61.00 63.21 1r8y s PRO 187 Cb -0.22 -2.60 -0.09 0.00 0.02 0.00 0.00 34.50 31.61 1r8y s PRO 187 CO -0.04 -0.79 0.89 -1.25 -0.33 0.00 0.00 177.00 175.48 1r8y s PRO 188 N -2.49 4.04 -1.16 5.54 0.04 -1.26 -4.44 135.00 135.27 1r8y s PRO 188 Ca 0.62 0.89 -0.03 0.00 0.04 0.00 0.00 61.00 62.52 1r8y s PRO 188 Cb -0.41 -2.25 0.00 0.00 0.04 0.00 0.00 34.50 31.88 1r8y s PRO 188 CO 0.52 -0.06 0.99 0.41 0.04 0.00 0.00 177.00 178.90 1r8y n GLY 189 N -0.93 -0.35 0.13 0.56 0.00 -1.26 -4.92 105.19 98.43 1r8y n GLY 189 Ca 0.06 0.10 0.02 0.00 0.00 0.00 0.00 46.02 46.20 1r8y n GLY 189 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1r8y n LYS 190 N -4.17 -0.04 -1.69 1.61 4.81 -1.26 -4.94 118.16 112.48 1r8y n LYS 190 Ca -0.17 -0.66 -0.58 0.00 -0.87 0.00 0.00 58.31 56.03 1r8y n LYS 190 Cb 0.62 -1.04 -0.07 0.00 0.02 0.00 0.00 35.03 34.56 1r8y n LYS 190 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1r8y n ASN 191 N 0.11 2.03 0.01 3.14 2.85 -1.26 -4.82 115.26 117.32 1r8y n ASN 191 Ca 0.02 1.10 0.11 0.00 -0.11 0.00 0.00 54.58 55.70 1r8y n ASN 191 Cb 0.09 -1.11 0.02 0.00 1.24 0.00 0.00 39.78 40.01 1r8y n ASN 191 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1r8y n ILE 192 N 4.03 0.06 -0.13 -1.44 0.13 -1.26 -4.08 119.36 116.66 1r8y n ILE 192 Ca 0.25 -0.11 -0.26 0.00 -1.10 0.00 0.00 62.75 61.54 1r8y n ILE 192 Cb 0.12 0.49 -0.10 0.00 -0.84 0.00 0.00 39.64 39.31 1r8y n ILE 192 CO 0.00 0.00 0.00 -1.22 2.80 0.00 0.00 176.55 178.13 1r8y n TYR 193 N -1.70 0.00 -3.79 9.51 4.01 -1.26 -4.46 117.16 119.48 1r8y n TYR 193 Ca 0.03 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.49 1r8y n TYR 193 Cb 0.38 -0.94 -0.16 0.00 -0.31 0.00 0.00 39.34 38.30 1r8y n TYR 193 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1r8y s TYR 194 N -2.48 1.34 0.01 -0.72 2.02 -1.26 -0.01 117.35 116.25 1r8y s TYR 194 Ca -0.36 -1.05 -0.30 0.00 -0.37 0.00 0.00 57.07 54.99 1r8y s TYR 194 Cb 0.13 -1.15 -0.07 0.00 -0.40 0.00 0.00 41.96 40.47 1r8y s TYR 194 CO 0.48 -0.64 1.67 -1.59 -1.57 0.00 0.00 175.55 173.91 1r8y s LYS 195 N 1.75 4.19 0.41 -0.62 -2.85 -1.15 -4.68 119.74 116.80 1r8y s LYS 195 Ca -0.02 2.28 -0.15 0.00 -1.00 0.00 0.00 55.97 57.09 1r8y s LYS 195 Cb -0.17 -3.83 -0.08 0.00 -2.06 0.00 0.00 37.83 31.69 1r8y s LYS 195 CO -0.07 -0.80 0.83 -1.54 0.10 0.00 0.00 175.35 173.87 1r8y s SER 196 N 3.01 6.67 -0.14 0.03 1.04 -1.26 -4.56 113.70 118.50 1r8y s SER 196 Ca 0.75 1.34 0.19 0.00 0.48 0.00 0.00 55.95 58.71 1r8y s SER 196 Cb -0.37 -2.41 0.31 0.00 0.10 0.00 0.00 66.02 63.66 1r8y s SER 196 CO 0.32 -0.38 1.17 0.47 0.98 0.00 0.00 173.24 175.81 1r8y n ASP 197 N -0.99 2.45 -4.60 7.02 8.00 -1.26 -4.97 116.55 122.19 1r8y n ASP 197 Ca 0.04 -3.11 -0.33 0.00 0.71 0.00 0.00 54.79 52.10 1r8y n ASP 197 Cb 0.54 -0.44 -0.11 0.00 -0.02 0.00 0.00 41.12 41.09 1r8y n ASP 197 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1r8y s LEU 198 N -2.89 3.21 -1.43 0.64 1.43 -1.26 -5.02 118.68 113.36 1r8y s LEU 198 Ca 0.33 -0.06 -0.08 0.00 -1.03 0.00 0.00 54.13 53.30 1r8y s LEU 198 Cb 0.29 -1.76 0.05 0.00 0.03 0.00 0.00 46.19 44.79 1r8y s LEU 198 CO 0.03 0.33 2.54 0.41 0.23 0.00 0.00 176.35 179.89 1r8y n THR 199 N 1.93 4.75 -1.32 5.49 -1.04 -1.26 -4.98 114.28 117.85 1r8y n THR 199 Ca -0.17 -3.65 -0.44 0.00 -2.04 0.00 0.00 64.05 57.76 1r8y n THR 199 Cb 0.53 -2.32 -0.02 0.00 -1.82 0.00 0.00 70.33 66.70 1r8y n THR 199 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 1r8y n LYS 200 N 2.80 0.00 -4.69 -2.82 2.85 -1.26 -4.45 118.16 110.59 1r8y n LYS 200 Ca 0.66 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 57.68 1r8y n LYS 200 Cb 0.26 -0.98 -0.16 0.00 -0.65 0.00 0.00 35.03 33.50 1r8y n LYS 200 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 1r8y s ASP 201 N -0.98 1.85 -0.06 -5.58 -1.08 0.35 -4.92 116.67 106.25 1r8y s ASP 201 Ca 0.60 -0.30 0.03 0.00 -0.52 0.00 0.00 52.55 52.37 1r8y s ASP 201 Cb -0.77 -0.53 0.00 0.00 -1.46 0.00 0.00 42.92 40.17 1r8y s ASP 201 CO 0.58 0.12 -0.16 -0.63 0.52 0.00 0.00 175.17 175.60 1r8y s ILE 202 N 0.12 1.38 -0.17 4.11 1.01 -1.26 0.12 121.20 126.51 1r8y s ILE 202 Ca -0.04 -0.66 -0.03 0.00 0.00 0.00 0.00 60.65 59.92 1r8y s ILE 202 Cb -0.11 -1.22 -0.02 0.00 0.01 0.00 0.00 42.46 41.13 1r8y s ILE 202 CO 0.02 0.41 -0.06 -0.89 0.00 0.00 0.00 174.94 174.41 1r8y s THR 203 N 0.32 3.49 -0.27 2.92 2.01 -0.90 -4.98 115.64 118.23 1r8y s THR 203 Ca -0.10 -0.48 -0.11 0.00 0.31 0.00 0.00 61.69 61.30 1r8y s THR 203 Cb -0.14 -2.53 -0.05 0.00 0.01 0.00 0.00 72.50 69.79 1r8y s THR 203 CO 0.04 0.48 0.21 -0.89 -0.69 0.00 0.00 174.62 173.76 1r8y s THR 204 N 0.72 5.30 -0.14 -0.82 2.01 -1.26 -2.09 115.64 119.36 1r8y s THR 204 Ca -0.03 0.23 -0.00 0.00 0.31 0.00 0.00 61.69 62.20 1r8y s THR 204 Cb -0.15 -3.55 -0.01 0.00 0.01 0.00 0.00 72.50 68.80 1r8y s THR 204 CO 0.02 0.25 -0.14 -0.44 -0.69 0.00 0.00 174.62 173.63 1r8y s SER 205 N 1.63 3.89 -0.16 3.53 0.01 0.46 -4.89 113.70 118.17 1r8y s SER 205 Ca 0.08 -0.38 -0.06 0.00 1.31 0.00 0.00 55.95 56.91 1r8y s SER 205 Cb -0.16 -1.59 -0.04 0.00 0.21 0.00 0.00 66.02 64.44 1r8y s SER 205 CO 0.10 0.14 0.04 -0.69 0.41 0.00 0.00 173.24 173.23 1r8y s VAL 206 N 0.52 4.58 -0.23 3.43 1.01 -1.26 -0.07 120.40 128.38 1r8y s VAL 206 Ca -0.09 -0.12 -0.08 0.00 0.00 0.00 0.00 61.98 61.69 1r8y s VAL 206 Cb -0.16 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 1r8y s VAL 206 CO 0.04 0.50 0.09 -0.22 0.00 0.00 0.00 175.10 175.50 1r8y s LEU 207 N 0.11 3.67 -0.31 3.92 2.96 0.06 -4.99 118.68 124.10 1r8y s LEU 207 Ca 0.04 -0.07 -0.02 0.00 -0.22 0.00 0.00 54.13 53.86 1r8y s LEU 207 Cb -0.13 -1.97 0.06 0.00 0.50 0.00 0.00 46.19 44.65 1r8y s LEU 207 CO 0.01 0.04 0.02 -0.89 -1.32 0.00 0.00 176.35 174.21 1r8y s THR 208 N 1.16 2.97 -0.19 3.68 2.01 -1.26 -0.54 115.64 123.46 1r8y s THR 208 Ca 0.05 -1.48 -0.10 0.00 0.31 0.00 0.00 61.69 60.47 1r8y s THR 208 Cb -0.14 -2.75 -0.05 0.00 0.01 0.00 0.00 72.50 69.56 1r8y s THR 208 CO 0.04 -0.17 0.13 -0.69 -0.69 0.00 0.00 174.62 173.23 1r8y s VAL 209 N 1.23 5.38 -1.49 3.82 1.01 -0.81 -4.34 120.40 125.19 1r8y s VAL 209 Ca -0.04 0.18 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 1r8y s VAL 209 Cb -0.20 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.74 1r8y s VAL 209 CO -0.02 0.45 0.05 0.59 0.00 0.00 0.00 175.10 176.17 1r8y n ASN 210 N 3.41 0.59 0.00 3.32 3.02 -1.26 0.21 115.26 124.55 1r8y n ASN 210 Ca -0.16 -1.25 0.00 0.00 -0.03 0.00 0.00 54.58 53.13 1r8y n ASN 210 Cb 0.52 -1.55 0.00 0.00 -0.61 0.00 0.00 39.78 38.14 1r8y n ASN 210 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1r8y n ASN 211 N -2.77 0.00 -4.61 6.41 4.05 -1.26 -4.99 115.26 112.09 1r8y n ASN 211 Ca -0.31 0.00 -0.38 0.00 0.45 0.00 0.00 54.58 54.34 1r8y n ASN 211 Cb 0.68 -0.90 -0.10 0.00 1.23 0.00 0.00 39.78 40.69 1r8y n ASN 211 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 177.26 173.46 1r8y s LYS 212 N -0.23 4.01 0.16 1.20 2.20 0.13 -5.05 119.74 122.17 1r8y s LYS 212 Ca 0.00 -0.14 -0.33 0.00 -0.36 0.00 0.00 55.97 55.14 1r8y s LYS 212 Cb 0.00 -3.63 -0.16 0.00 -1.51 0.00 0.00 37.83 32.53 1r8y s LYS 212 CO 0.00 -0.16 1.14 0.00 -0.36 0.00 0.00 175.35 175.96 1r8y n ALA 213 N 4.98 -1.00 0.00 3.13 0.00 -1.26 -1.93 120.51 124.44 1r8y n ALA 213 Ca -0.12 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1r8y n ALA 213 Cb 0.51 -2.00 0.00 0.00 0.00 0.00 0.00 19.45 17.97 1r8y n ALA 213 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1r8y n HIS 214 N 1.45 0.00 -3.65 0.00 -0.00 0.30 -4.85 115.22 108.47 1r8y n HIS 214 Ca 0.15 0.00 -0.15 0.00 0.46 0.00 0.00 57.72 58.19 1r8y n HIS 214 Cb 0.24 0.00 -0.08 0.00 -0.12 0.00 0.00 29.99 30.03 1r8y n HIS 214 CO 0.00 0.00 0.00 1.41 0.46 0.00 0.00 176.34 178.21 1r8y s MET 215 N -1.22 0.77 -0.18 1.57 1.75 -1.14 -4.69 119.30 116.16 1r8y s MET 215 Ca 0.00 0.49 0.01 0.00 -1.25 0.00 0.00 55.69 54.94 1r8y s MET 215 Cb 0.00 0.36 0.02 0.00 2.84 0.00 0.00 34.83 38.06 1r8y s MET 215 CO 0.00 -0.16 -0.18 0.08 -0.65 0.00 0.00 175.02 174.11 1r8y s VAL 216 N -0.35 1.97 -0.15 10.11 1.01 -0.06 -0.76 120.40 132.16 1r8y s VAL 216 Ca -0.05 -0.92 -0.00 0.00 0.00 0.00 0.00 61.98 61.01 1r8y s VAL 216 Cb -0.03 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.53 1r8y s VAL 216 CO 0.04 0.49 -0.13 -0.89 0.00 0.00 0.00 175.10 174.61 1r8y s THR 217 N 1.32 2.94 -0.20 3.92 2.01 0.90 -0.44 115.64 126.08 1r8y s THR 217 Ca 0.04 -0.68 -0.04 0.00 0.31 0.00 0.00 61.69 61.32 1r8y s THR 217 Cb -0.13 -2.25 -0.02 0.00 0.01 0.00 0.00 72.50 70.11 1r8y s THR 217 CO -0.12 0.51 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.52 1r8y s LEU 218 N 0.67 3.03 -0.48 4.42 1.43 -0.11 -0.40 118.68 127.24 1r8y s LEU 218 Ca -0.07 -0.30 -0.16 0.00 -1.03 0.00 0.00 54.13 52.57 1r8y s LEU 218 Cb -0.15 -1.76 0.07 0.00 0.03 0.00 0.00 46.19 44.37 1r8y s LEU 218 CO 0.02 0.04 0.45 -1.81 0.23 0.00 0.00 176.35 175.28 1r8y s ASP 219 N 1.12 6.17 0.04 2.29 1.01 -0.89 -1.61 116.67 124.79 1r8y s ASP 219 Ca 0.02 -1.22 -0.27 0.00 0.71 0.00 0.00 52.55 51.79 1r8y s ASP 219 Cb -0.15 -2.21 -0.05 0.00 1.01 0.00 0.00 42.92 41.53 1r8y s ASP 219 CO 0.00 -0.70 0.84 -0.31 0.21 0.00 0.00 175.17 175.21 1r8y s TYR 220 N 1.88 3.72 -0.46 4.23 1.51 -0.06 -2.11 117.35 126.06 1r8y s TYR 220 Ca 0.07 1.56 0.00 0.00 -1.01 0.00 0.00 57.07 57.69 1r8y s TYR 220 Cb -0.23 -2.93 0.12 0.00 -0.11 0.00 0.00 41.96 38.82 1r8y s TYR 220 CO 0.08 0.18 0.23 0.99 -1.11 0.00 0.00 175.55 175.92 1r8y s THR 221 N 0.26 2.99 0.38 -0.71 2.01 0.33 -1.28 115.64 119.61 1r8y s THR 221 Ca 0.43 -2.59 0.03 0.00 0.31 0.00 0.00 61.69 59.87 1r8y s THR 221 Cb -0.21 -3.06 -0.01 0.00 0.01 0.00 0.00 72.50 69.23 1r8y s THR 221 CO 0.25 -0.73 0.55 0.68 -0.69 0.00 0.00 174.62 174.68 1r8y s VAL 222 N 0.52 4.25 0.20 3.82 -7.23 0.17 -0.49 120.40 121.63 1r8y s VAL 222 Ca 0.13 -0.73 0.07 0.00 -1.81 0.00 0.00 61.98 59.64 1r8y s VAL 222 Cb -0.22 -3.52 -0.04 0.00 0.56 0.00 0.00 36.38 33.16 1r8y s VAL 222 CO -0.04 -0.29 0.04 0.00 -0.31 0.00 0.00 175.10 174.51 1r8y s GLN 223 N -4.33 2.52 -0.72 4.82 0.00 -1.26 -1.50 119.66 119.20 1r8y s GLN 223 Ca 0.45 -1.13 0.03 0.00 -0.00 0.00 0.00 55.36 54.70 1r8y s GLN 223 Cb -0.10 -2.38 0.17 0.00 0.00 0.00 0.00 33.01 30.71 1r8y s GLN 223 CO 0.34 0.43 0.52 0.08 0.00 0.00 0.00 175.29 176.67 1r8y s VAL 224 N -1.91 3.26 -0.81 3.63 1.01 -0.08 -4.88 120.40 120.62 1r8y s VAL 224 Ca 0.29 -3.95 -0.23 0.00 0.00 0.00 0.00 61.98 58.10 1r8y s VAL 224 Cb -0.09 -3.12 -0.19 0.00 0.00 0.00 0.00 36.38 32.99 1r8y s VAL 224 CO 0.20 -0.98 2.40 -2.65 0.00 0.00 0.00 175.10 174.07 1r8y n PRO 225 N 2.33 0.43 -0.16 2.72 -0.02 -1.26 -3.31 135.00 135.73 1r8y n PRO 225 Ca 0.17 -0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 1r8y n PRO 225 Cb 0.35 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.27 1r8y n PRO 225 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1r8y n SER 232 N 13.28 0.00 -3.29 2.55 2.88 -1.26 -5.11 113.62 122.67 1r8y n SER 232 Ca 0.53 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.81 1r8y n SER 232 Cb 0.31 0.00 0.26 0.00 -0.75 0.00 0.00 64.21 64.03 1r8y n SER 232 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1r8y n PRO 233 N 0.00 -4.03 -3.49 -1.46 -0.02 -1.26 -4.98 135.00 119.76 1r8y n PRO 233 Ca 0.00 -1.28 -0.38 0.00 -2.02 0.00 0.00 63.50 59.83 1r8y n PRO 233 Cb 0.00 -1.80 -0.06 0.00 -0.02 0.00 0.00 33.50 31.62 1r8y n PRO 233 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1r8y s GLY 234 N -2.82 2.49 -0.37 -1.23 0.00 -1.21 -4.80 107.32 99.38 1r8y s GLY 234 Ca 0.59 -0.20 -0.11 0.00 0.00 0.00 0.00 44.72 45.00 1r8y s GLY 234 CO 0.49 0.16 0.20 -1.36 0.00 0.00 0.00 173.10 172.59 1r8y s PHE 235 N -1.09 3.24 0.13 1.90 2.99 -1.26 -0.90 117.98 122.99 1r8y s PHE 235 Ca 0.24 -0.96 0.09 0.00 0.00 0.00 0.00 56.93 56.30 1r8y s PHE 235 Cb -0.17 -2.43 -0.04 0.00 0.00 0.00 0.00 43.02 40.39 1r8y s PHE 235 CO 0.14 -0.64 -0.21 -1.12 -0.00 0.00 0.00 175.22 173.39 1r8y s SER 236 N 1.55 2.68 0.11 1.36 0.01 -0.56 -5.01 113.70 113.84 1r8y s SER 236 Ca 0.02 -0.75 0.09 0.00 1.31 0.00 0.00 55.95 56.63 1r8y s SER 236 Cb -0.19 -0.16 -0.04 0.00 0.21 0.00 0.00 66.02 65.85 1r8y s SER 236 CO 0.06 0.05 -0.24 -0.54 0.41 0.00 0.00 173.24 172.98 1r8y s LYS 237 N -2.19 1.30 0.11 12.44 1.02 -1.26 -0.66 119.74 130.50 1r8y s LYS 237 Ca 0.10 -1.23 -0.12 0.00 0.02 0.00 0.00 55.97 54.75 1r8y s LYS 237 Cb -0.09 -1.66 0.01 0.00 -0.52 0.00 0.00 37.83 35.58 1r8y s LYS 237 CO 0.05 0.39 0.28 -0.59 -0.92 0.00 0.00 175.35 174.57 1r8y s PHE 238 N -1.07 0.05 0.02 3.18 -0.71 -0.41 -4.33 117.98 114.71 1r8y s PHE 238 Ca 0.10 -0.43 0.05 0.00 -1.04 0.00 0.00 56.93 55.61 1r8y s PHE 238 Cb -0.10 0.07 -0.02 0.00 -1.21 0.00 0.00 43.02 41.76 1r8y s PHE 238 CO 0.05 -0.63 -0.15 0.50 -1.34 0.00 0.00 175.22 173.64 1r8y s ARG 239 N -3.85 1.10 -0.03 1.99 3.52 -1.26 -0.88 118.95 119.54 1r8y s ARG 239 Ca 0.06 -0.70 -0.05 0.00 -0.13 0.00 0.00 55.73 54.91 1r8y s ARG 239 Cb 0.03 -1.11 0.01 0.00 -1.56 0.00 0.00 34.95 32.32 1r8y s ARG 239 CO -0.10 0.29 0.13 -0.51 -0.81 0.00 0.00 175.30 174.30 1r8y s LEU 240 N -0.84 1.55 0.24 -0.88 1.43 -0.63 -5.01 118.68 114.53 1r8y s LEU 240 Ca 0.04 0.05 0.06 0.00 -1.03 0.00 0.00 54.13 53.25 1r8y s LEU 240 Cb -0.07 0.53 -0.05 0.00 0.03 0.00 0.00 46.19 46.63 1r8y s LEU 240 CO 0.01 -0.19 -0.08 -0.44 0.23 0.00 0.00 176.35 175.88 1r8y s SER 241 N -0.57 2.47 -0.06 2.29 0.01 -1.26 -0.94 113.70 115.64 1r8y s SER 241 Ca -0.07 -1.13 -0.08 0.00 1.31 0.00 0.00 55.95 55.99 1r8y s SER 241 Cb -0.04 -0.11 0.02 0.00 0.21 0.00 0.00 66.02 66.09 1r8y s SER 241 CO 0.01 -0.32 0.21 -0.31 0.41 0.00 0.00 173.24 173.24 1r8y s TYR 242 N -3.09 -0.17 -0.19 2.43 1.51 0.41 -4.67 117.35 113.58 1r8y s TYR 242 Ca 0.26 0.40 -0.25 0.00 -1.01 0.00 0.00 57.07 56.47 1r8y s TYR 242 Cb 0.03 0.05 -0.01 0.00 -0.11 0.00 0.00 41.96 41.92 1r8y s TYR 242 CO 0.09 -0.17 0.82 -0.47 -1.11 0.00 0.00 175.55 174.70 1r8y s TYR 243 N -0.32 3.39 -1.26 2.71 5.04 0.16 -0.89 117.35 126.18 1r8y s TYR 243 Ca -0.04 1.21 -0.18 0.00 -2.44 0.00 0.00 57.07 55.61 1r8y s TYR 243 Cb -0.03 -3.01 0.01 0.00 0.35 0.00 0.00 41.96 39.28 1r8y s TYR 243 CO 0.01 -0.27 1.91 -0.35 -1.34 0.00 0.00 175.55 175.51 1r8y n PRO 244 N 5.41 2.64 -1.94 4.97 -0.04 -1.26 -4.73 135.00 140.04 1r8y n PRO 244 Ca 0.04 -2.81 -0.43 0.00 -0.04 0.00 0.00 63.50 60.26 1r8y n PRO 244 Cb 0.48 -3.43 -0.03 0.00 -0.04 0.00 0.00 33.50 30.49 1r8y n PRO 244 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1r8y s HIS 245 N 5.35 1.76 0.49 0.54 3.76 -1.26 -4.94 115.29 120.99 1r8y s HIS 245 Ca 0.55 0.48 -0.20 0.00 -0.15 0.00 0.00 55.06 55.74 1r8y s HIS 245 Cb 0.07 -4.05 -0.08 0.00 1.11 0.00 0.00 32.58 29.63 1r8y s HIS 245 CO 0.05 -3.38 1.07 0.00 -0.85 0.00 0.00 174.74 171.63 1r8y h LEU 247 N 1.56 0.82 0.65 0.00 5.85 -1.94 -1.22 115.31 121.03 1r8y h LEU 247 Ca -0.50 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.18 1r8y h LEU 247 Cb 1.23 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 42.05 1r8y h LEU 247 CO 0.59 0.59 -0.41 0.00 -0.34 0.00 0.00 178.44 178.87 1r8y h ALA 248 N 1.27 -1.21 -0.75 1.25 0.00 -2.00 -1.96 119.26 115.87 1r8y h ALA 248 Ca 0.27 -0.21 0.17 0.00 0.00 0.00 0.00 54.91 55.14 1r8y h ALA 248 Cb -0.10 0.54 -0.12 0.00 0.00 0.00 0.00 17.79 18.11 1r8y h ALA 248 CO -0.06 -1.17 0.11 1.03 0.00 0.00 0.00 179.25 179.16 1r8y h SER 249 N -1.00 -0.13 0.04 0.00 0.87 -1.94 -1.60 113.55 109.79 1r8y h SER 249 Ca -0.09 0.17 -0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1r8y h SER 249 Cb 0.81 0.26 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 1r8y h SER 249 CO 0.08 -0.11 -0.02 0.15 -0.53 0.00 0.00 176.83 176.40 1r8y h PHE 250 N 0.19 -0.05 -0.59 2.24 3.57 -1.23 0.24 116.94 121.30 1r8y h PHE 250 Ca 0.43 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 62.00 1r8y h PHE 250 Cb 0.76 0.02 -0.10 0.00 2.79 0.00 0.00 35.95 39.42 1r8y h PHE 250 CO -0.32 0.24 -0.53 1.15 -2.23 0.00 0.00 178.31 176.62 1r8y h THR 251 N -0.35 0.02 -0.63 4.41 2.02 -1.11 0.25 112.91 117.52 1r8y h THR 251 Ca -0.01 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.26 1r8y h THR 251 Cb 0.32 0.02 -0.11 0.00 -1.74 0.00 0.00 68.15 66.65 1r8y h THR 251 CO 0.01 0.00 -0.45 -0.33 0.37 0.00 0.00 175.52 175.12 1r8y h GLU 252 N -0.26 -0.20 0.08 6.66 4.39 -1.16 -1.60 114.58 122.49 1r8y h GLU 252 Ca 0.13 0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.85 1r8y h GLU 252 Cb 0.55 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.23 1r8y h GLU 252 CO -0.70 -0.13 -0.12 -0.07 -1.16 0.00 0.00 179.01 176.83 1r8y h LEU 253 N -0.20 -0.32 -0.55 1.33 3.38 0.17 -1.54 115.31 117.57 1r8y h LEU 253 Ca 0.18 0.04 -0.12 0.00 0.09 0.00 0.00 57.88 58.07 1r8y h LEU 253 Cb 0.56 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1r8y h LEU 253 CO -0.72 -0.18 -0.11 1.62 0.09 0.00 0.00 178.44 179.14 1r8y h VAL 254 N -0.24 1.27 -0.10 1.22 3.04 -0.52 -2.31 116.25 118.60 1r8y h VAL 254 Ca 0.02 -1.28 0.00 0.00 -1.01 0.00 0.00 66.70 64.43 1r8y h VAL 254 Cb 0.25 0.96 -0.01 0.00 -2.01 0.00 0.00 31.29 30.49 1r8y h VAL 254 CO -0.06 0.45 0.06 0.03 -1.01 0.00 0.00 177.57 177.04 1r8y h ARG 255 N 0.92 0.12 -0.12 4.17 3.08 -1.16 -1.92 114.38 119.47 1r8y h ARG 255 Ca 0.14 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.22 1r8y h ARG 255 Cb 0.69 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.71 1r8y h ARG 255 CO 0.05 0.08 0.09 0.00 -1.07 0.00 0.00 179.97 179.12 1r8y h ALA 256 N 1.05 2.04 0.00 0.04 0.00 -1.10 -2.00 119.26 119.29 1r8y h ALA 256 Ca 0.04 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1r8y h ALA 256 Cb -0.00 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1r8y h ALA 256 CO -0.02 -0.15 -0.06 0.00 0.00 0.00 0.00 179.25 179.01 1r8y h ALA 257 N 1.93 1.22 -0.02 0.00 0.00 -0.77 0.02 119.26 121.64 1r8y h ALA 257 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1r8y h ALA 257 Cb 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1r8y h ALA 257 CO -0.00 0.08 -0.31 1.19 0.00 0.00 0.00 179.25 180.20 1r8y n PHE 258 N -3.47 0.00 -2.56 0.00 3.72 -0.77 -4.59 117.46 109.79 1r8y n PHE 258 Ca -0.02 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.24 1r8y n PHE 258 Cb 0.19 -0.03 0.01 0.00 -0.94 0.00 0.00 39.48 38.71 1r8y n PHE 258 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1r8y n GLY 259 N 1.37 -0.12 3.29 1.37 0.00 -0.01 -2.94 105.19 108.16 1r8y n GLY 259 Ca 0.11 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1r8y n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r8y n GLY 260 N -1.16 2.68 2.32 -0.02 0.00 -1.11 -4.91 105.19 102.98 1r8y n GLY 260 Ca -0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 1r8y n GLY 260 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1r8y n ARG 261 N -1.99 3.37 -4.22 1.61 1.85 -1.15 -4.88 116.66 111.25 1r8y n ARG 261 Ca 0.00 -2.30 -0.14 0.00 -1.00 0.00 0.00 57.85 54.41 1r8y n ARG 261 Cb 0.00 -2.47 -0.10 0.00 -1.05 0.00 0.00 32.46 28.84 1r8y n ARG 261 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1r8y s GLN 263 N -3.99 2.72 -0.05 0.00 -0.21 0.80 -4.86 119.66 114.07 1r8y s GLN 263 Ca 0.39 -0.89 -0.01 0.00 0.02 0.00 0.00 55.36 54.87 1r8y s GLN 263 Cb 0.06 -2.22 0.03 0.00 1.00 0.00 0.00 33.01 31.88 1r8y s GLN 263 CO 0.16 0.32 0.02 -1.58 -2.12 0.00 0.00 175.29 172.09 1r8y s HIS 264 N -0.02 0.31 0.02 0.91 5.65 -1.26 -1.66 115.29 119.25 1r8y s HIS 264 Ca -0.08 0.05 0.05 0.00 0.25 0.00 0.00 55.06 55.34 1r8y s HIS 264 Cb -0.15 -0.55 -0.02 0.00 -1.18 0.00 0.00 32.58 30.68 1r8y s HIS 264 CO 0.05 -0.21 -0.16 -1.12 -0.65 0.00 0.00 174.74 172.65 1r8y s SER 265 N 1.76 1.91 -0.18 9.88 0.01 -0.93 -5.03 113.70 121.12 1r8y s SER 265 Ca 0.01 -0.42 -0.02 0.00 1.31 0.00 0.00 55.95 56.82 1r8y s SER 265 Cb -0.13 -0.16 -0.01 0.00 0.21 0.00 0.00 66.02 65.93 1r8y s SER 265 CO -0.03 0.11 -0.08 0.54 0.41 0.00 0.00 173.24 174.19 1r8y s VAL 266 N -0.68 3.27 0.36 3.43 0.11 -1.26 -1.50 120.40 124.13 1r8y s VAL 266 Ca 0.04 -0.55 -0.07 0.00 -2.93 0.00 0.00 61.98 58.47 1r8y s VAL 266 Cb -0.07 -2.44 -0.06 0.00 -1.53 0.00 0.00 36.38 32.28 1r8y s VAL 266 CO 0.01 0.47 0.68 -0.76 -3.33 0.00 0.00 175.10 172.17 1r8y s LEU 267 N 0.94 3.91 0.00 2.54 1.43 0.53 -2.89 118.68 125.13 1r8y s LEU 267 Ca -0.01 0.92 0.00 0.00 -1.03 0.00 0.00 54.13 54.01 1r8y s LEU 267 Cb -0.15 -3.78 0.00 0.00 0.03 0.00 0.00 46.19 42.29 1r8y s LEU 267 CO 0.00 -0.33 0.00 0.61 0.23 0.00 0.00 176.35 176.86 1r8y n GLY 268 N -1.27 1.83 0.06 -3.19 0.00 0.81 -2.97 105.19 100.46 1r8y n GLY 268 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1r8y n GLY 268 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1r8y n ASP 269 N 0.00 0.39 0.00 1.61 8.00 -1.26 -4.30 116.55 120.99 1r8y n ASP 269 Ca 0.00 0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.66 1r8y n ASP 269 Cb 0.00 1.19 0.00 0.00 -0.02 0.00 0.00 41.12 42.29 1r8y n ASP 269 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1r8y n PHE 270 N -2.51 0.00 -3.31 1.24 0.99 -1.26 -4.89 117.46 107.72 1r8y n PHE 270 Ca -0.05 0.00 -0.38 0.00 -0.00 0.00 0.00 57.45 57.02 1r8y n PHE 270 Cb 0.63 0.00 -0.06 0.00 -1.00 0.00 0.00 39.48 39.05 1r8y n PHE 270 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 1r8y s LYS 271 N 0.00 4.14 0.97 -1.08 1.02 -1.26 -5.00 119.74 118.53 1r8y s LYS 271 Ca 0.00 0.67 -0.14 0.00 0.02 0.00 0.00 55.97 56.52 1r8y s LYS 271 Cb 0.00 -3.18 0.01 0.00 -0.52 0.00 0.00 37.83 34.14 1r8y s LYS 271 CO 0.00 0.62 0.15 -2.30 -0.92 0.00 0.00 175.35 172.90 1r8y n PRO 272 N 1.57 -0.34 -3.98 -1.68 -0.02 -1.26 0.28 135.00 129.57 1r8y n PRO 272 Ca -0.10 -0.07 -0.31 0.00 -2.02 0.00 0.00 63.50 61.01 1r8y n PRO 272 Cb 0.51 -1.69 -0.16 0.00 -0.02 0.00 0.00 33.50 32.14 1r8y n PRO 272 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1r8y s TYR 273 N -2.32 2.49 -0.42 6.00 5.04 -1.14 -3.95 117.35 123.05 1r8y s TYR 273 Ca 0.54 -1.72 -0.18 0.00 -2.44 0.00 0.00 57.07 53.27 1r8y s TYR 273 Cb -0.19 -1.64 0.02 0.00 0.35 0.00 0.00 41.96 40.49 1r8y s TYR 273 CO 0.70 -0.77 0.49 0.15 -1.34 0.00 0.00 175.55 174.78 1r8y s LYS 274 N 1.37 3.17 0.12 4.97 1.02 -1.26 -4.89 119.74 124.24 1r8y s LYS 274 Ca -0.04 -0.63 -0.35 0.00 0.02 0.00 0.00 55.97 54.97 1r8y s LYS 274 Cb -0.18 -3.95 -0.16 0.00 -0.52 0.00 0.00 37.83 33.02 1r8y s LYS 274 CO -0.07 -0.87 1.35 -2.30 -0.92 0.00 0.00 175.35 172.54 1r8y n PRO 275 N 5.76 1.36 -1.23 -1.68 -0.02 -1.26 0.35 135.00 138.28 1r8y n PRO 275 Ca -0.06 0.49 -0.08 0.00 -2.02 0.00 0.00 63.50 61.83 1r8y n PRO 275 Cb 0.48 -2.13 -0.03 0.00 -0.02 0.00 0.00 33.50 31.79 1r8y n PRO 275 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r8y n GLY 276 N 2.57 0.96 3.52 -1.23 0.00 -1.26 -5.04 105.19 104.71 1r8y n GLY 276 Ca 0.17 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 1r8y n GLY 276 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r8y n GLN 277 N -2.33 0.11 0.25 1.61 10.64 0.15 -4.99 117.38 122.83 1r8y n GLN 277 Ca -0.08 0.09 -0.16 0.00 -1.83 0.00 0.00 57.00 55.03 1r8y n GLN 277 Cb 0.31 -2.03 -0.08 0.00 -0.86 0.00 0.00 30.24 27.59 1r8y n GLN 277 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1r8y h ALA 278 N -0.85 -0.70 -2.65 2.61 0.00 -1.96 -3.42 119.26 112.28 1r8y h ALA 278 Ca -0.45 -0.13 -0.52 0.00 0.00 0.00 0.00 54.91 53.81 1r8y h ALA 278 Cb 1.31 0.39 0.03 0.00 0.00 0.00 0.00 17.79 19.52 1r8y h ALA 278 CO 0.41 -0.92 0.63 -0.47 0.00 0.00 0.00 179.25 178.90 1r8y s TYR 279 N -6.05 3.31 -0.24 0.00 5.04 -1.26 -5.04 117.35 113.11 1r8y s TYR 279 Ca -0.17 1.26 -0.07 0.00 -2.44 0.00 0.00 57.07 55.65 1r8y s TYR 279 Cb 0.05 -3.55 -0.02 0.00 0.35 0.00 0.00 41.96 38.79 1r8y s TYR 279 CO 0.63 -1.71 0.04 0.14 -1.34 0.00 0.00 175.55 173.32 1r8y s VAL 280 N 0.22 4.10 0.60 3.14 -7.23 -1.26 -5.04 120.40 114.92 1r8y s VAL 280 Ca 0.56 -0.25 -0.14 0.00 -1.81 0.00 0.00 61.98 60.35 1r8y s VAL 280 Cb -0.35 -2.91 -0.04 0.00 0.56 0.00 0.00 36.38 33.65 1r8y s VAL 280 CO 0.37 0.36 1.03 -2.84 -0.31 0.00 0.00 175.10 173.71 1r8y s PRO 281 N 1.58 3.44 -0.08 4.82 0.02 -1.26 -5.01 135.00 138.52 1r8y s PRO 281 Ca 0.06 1.01 -0.10 0.00 0.02 0.00 0.00 61.00 61.99 1r8y s PRO 281 Cb -0.15 -2.06 -0.29 0.00 0.02 0.00 0.00 34.50 32.03 1r8y s PRO 281 CO 0.02 -0.69 0.54 0.00 -0.33 0.00 0.00 177.00 176.54 1r8y s TYR 283 N -2.56 2.66 -0.21 0.00 1.51 -1.26 -0.70 117.35 116.79 1r8y s TYR 283 Ca -0.19 -0.29 -0.00 0.00 -1.01 0.00 0.00 57.07 55.58 1r8y s TYR 283 Cb 0.06 -1.32 0.05 0.00 -0.11 0.00 0.00 41.96 40.65 1r8y s TYR 283 CO 0.82 0.55 -0.05 -0.06 -1.11 0.00 0.00 175.55 175.70 1r8y s PHE 284 N -2.38 2.02 -0.23 2.71 0.08 -0.18 -4.42 117.98 115.58 1r8y s PHE 284 Ca 0.33 -1.44 -0.11 0.00 0.12 0.00 0.00 56.93 55.84 1r8y s PHE 284 Cb -0.05 -1.44 -0.05 0.00 -0.57 0.00 0.00 43.02 40.92 1r8y s PHE 284 CO 0.20 -0.71 0.16 0.42 -0.10 0.00 0.00 175.22 175.19 1r8y s ILE 285 N 1.52 5.37 -0.21 0.64 1.01 -1.16 -1.67 121.20 126.69 1r8y s ILE 285 Ca -0.03 0.21 -0.07 0.00 0.00 0.00 0.00 60.65 60.76 1r8y s ILE 285 Cb -0.17 -3.50 -0.03 0.00 0.01 0.00 0.00 42.46 38.76 1r8y s ILE 285 CO -0.07 0.37 0.05 -1.00 0.00 0.00 0.00 174.94 174.29 1r8y s HIS 286 N 0.87 3.12 -0.07 3.97 3.76 0.67 0.20 115.29 127.80 1r8y s HIS 286 Ca 0.08 -0.26 0.04 0.00 -0.15 0.00 0.00 55.06 54.77 1r8y s HIS 286 Cb -0.13 -2.15 -0.01 0.00 1.11 0.00 0.00 32.58 31.40 1r8y s HIS 286 CO 0.03 -0.16 -0.20 0.54 -0.85 0.00 0.00 174.74 174.10 1r8y s VAL 287 N 1.06 2.51 -0.03 -0.90 0.11 -0.56 -1.11 120.40 121.49 1r8y s VAL 287 Ca 0.04 -0.90 0.02 0.00 -2.93 0.00 0.00 61.98 58.21 1r8y s VAL 287 Cb -0.14 -1.97 0.01 0.00 -1.53 0.00 0.00 36.38 32.75 1r8y s VAL 287 CO 0.03 0.56 -0.07 -0.76 -3.33 0.00 0.00 175.10 171.53 1r8y s LEU 288 N -0.17 1.65 -0.04 2.54 1.43 0.68 -2.18 118.68 122.60 1r8y s LEU 288 Ca -0.02 -0.16 -0.06 0.00 -1.03 0.00 0.00 54.13 52.85 1r8y s LEU 288 Cb -0.14 -0.50 -0.04 0.00 0.03 0.00 0.00 46.19 45.54 1r8y s LEU 288 CO 0.04 0.02 0.22 -0.54 0.23 0.00 0.00 176.35 176.32 1r8y s LYS 289 N 0.42 3.53 0.76 1.70 -0.14 -0.66 0.03 119.74 125.39 1r8y s LYS 289 Ca -0.06 -0.11 -0.11 0.00 -1.36 0.00 0.00 55.97 54.33 1r8y s LYS 289 Cb -0.10 -3.13 0.05 0.00 -1.68 0.00 0.00 37.83 32.97 1r8y s LYS 289 CO 0.01 0.70 1.08 0.21 -0.76 0.00 0.00 175.35 176.58 1r8y s LYS 290 N -1.53 2.36 -0.48 1.68 2.47 -1.02 -0.14 119.74 123.07 1r8y s LYS 290 Ca 0.23 0.87 0.03 0.00 -1.56 0.00 0.00 55.97 55.55 1r8y s LYS 290 Cb -0.13 -1.93 0.44 0.00 -1.46 0.00 0.00 37.83 34.75 1r8y s LYS 290 CO 0.13 -1.49 1.50 0.25 0.16 0.00 0.00 175.35 175.90 1r8y n THR 291 N -3.38 2.92 -0.42 3.43 -2.24 -0.68 -3.72 114.28 110.19 1r8y n THR 291 Ca 0.08 -4.01 0.00 0.00 -2.27 0.00 0.00 64.05 57.84 1r8y n THR 291 Cb 0.55 -1.18 0.00 0.00 -2.10 0.00 0.00 70.33 67.59 1r8y n THR 291 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97