#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r8x n ASP 2 N 0.00 0.00 -0.95 -1.34 8.00 -1.26 -4.85 116.55 116.16 1r8x n ASP 2 Ca 0.00 -0.64 0.00 0.00 0.71 0.00 0.00 54.79 54.86 1r8x n ASP 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1r8x n ASP 2 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1r8x n SER 3 N 2.05 0.00 -2.66 -2.24 3.41 -1.26 -5.06 113.62 107.86 1r8x n SER 3 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.58 1r8x n SER 3 Cb 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.02 1r8x n SER 3 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1r8x n VAL 4 N -0.00 0.00 -0.56 -3.33 0.31 -1.26 -5.18 118.33 108.31 1r8x n VAL 4 Ca 0.00 -0.65 -0.19 0.00 -0.01 0.00 0.00 64.34 63.49 1r8x n VAL 4 Cb 0.00 0.89 -0.01 0.00 -0.91 0.00 0.00 33.84 33.81 1r8x n VAL 4 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1r8x n TYR 5 N 0.11 -0.37 -3.78 3.52 9.36 -1.26 -5.03 117.16 119.71 1r8x n TYR 5 Ca -0.14 0.36 -0.13 0.00 3.32 0.00 0.00 57.90 61.31 1r8x n TYR 5 Cb 0.72 -0.78 -0.10 0.00 -0.63 0.00 0.00 39.34 38.55 1r8x n TYR 5 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 1r8x s ARG 6 N -0.41 0.49 0.24 2.98 0.52 -1.26 -5.04 118.95 116.47 1r8x s ARG 6 Ca 0.26 0.03 0.17 0.00 -0.52 0.00 0.00 55.73 55.66 1r8x s ARG 6 Cb -0.35 0.22 0.04 0.00 0.52 0.00 0.00 34.95 35.39 1r8x s ARG 6 CO 0.24 -0.11 1.28 1.79 0.02 0.00 0.00 175.30 178.51 1r8x h THR 7 N 4.29 0.60 -3.35 0.02 1.35 -2.07 -3.45 112.91 110.29 1r8x h THR 7 Ca -0.28 -1.92 -0.06 0.00 -0.55 0.00 0.00 66.41 63.60 1r8x h THR 7 Cb 1.19 2.20 -0.14 0.00 -1.73 0.00 0.00 68.15 69.67 1r8x h THR 7 CO 0.37 0.34 -0.10 0.00 -0.25 0.00 0.00 175.52 175.89 1r8x s ARG 8 N -3.01 1.03 0.59 4.72 1.70 -1.26 -5.16 118.95 117.56 1r8x s ARG 8 Ca 0.02 -0.66 -0.15 0.00 -0.47 0.00 0.00 55.73 54.47 1r8x s ARG 8 Cb 0.08 0.45 -0.04 0.00 -0.57 0.00 0.00 34.95 34.87 1r8x s ARG 8 CO 0.76 -0.39 1.05 -1.12 -1.08 0.00 0.00 175.30 174.52 1r8x s SER 9 N -2.65 5.86 0.05 -2.89 0.01 -1.26 -4.93 113.70 107.90 1r8x s SER 9 Ca 0.01 1.75 -0.30 0.00 1.31 0.00 0.00 55.95 58.73 1r8x s SER 9 Cb 0.02 -2.52 -0.09 0.00 0.21 0.00 0.00 66.02 63.63 1r8x s SER 9 CO -0.10 -1.11 1.82 -0.76 0.41 0.00 0.00 173.24 173.50 1r8x s LEU 10 N -4.56 4.39 0.00 2.44 1.43 -1.26 -2.26 118.68 118.86 1r8x s LEU 10 Ca 0.62 2.59 0.00 0.00 -1.03 0.00 0.00 54.13 56.32 1r8x s LEU 10 Cb -0.15 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.52 1r8x s LEU 10 CO 0.38 -0.99 0.00 0.61 0.23 0.00 0.00 176.35 176.59 1r8x n GLY 11 N 4.28 0.44 4.02 -3.19 0.00 -1.26 -5.09 105.19 104.39 1r8x n GLY 11 Ca 0.18 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 1r8x n GLY 11 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r8x s VAL 12 N -2.00 2.66 -0.00 1.61 -7.23 -0.96 -5.10 120.40 109.38 1r8x s VAL 12 Ca 0.00 -0.98 -0.01 0.00 -1.81 0.00 0.00 61.98 59.18 1r8x s VAL 12 Cb 0.00 -2.68 -0.00 0.00 0.56 0.00 0.00 36.38 34.26 1r8x s VAL 12 CO 0.00 0.00 0.03 0.00 -0.31 0.00 0.00 175.10 174.82 1r8x s ALA 13 N -2.50 -0.05 0.10 1.32 0.00 -1.26 -4.64 121.76 114.73 1r8x s ALA 13 Ca 0.58 -0.13 0.09 0.00 0.00 0.00 0.00 51.96 52.50 1r8x s ALA 13 Cb -0.08 0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.02 1r8x s ALA 13 CO 0.36 -0.08 -0.23 0.00 0.00 0.00 0.00 175.76 175.81 1r8x s ALA 14 N -0.56 2.01 0.14 0.00 0.00 -1.26 -5.09 121.76 116.99 1r8x s ALA 14 Ca -0.06 -1.29 -0.16 0.00 0.00 0.00 0.00 51.96 50.45 1r8x s ALA 14 Cb -0.04 -0.32 -0.00 0.00 0.00 0.00 0.00 23.12 22.76 1r8x s ALA 14 CO -0.00 0.43 1.70 0.93 0.00 0.00 0.00 175.76 178.82 1r8x h GLU 15 N 4.19 0.60 0.00 0.00 5.08 -2.01 -2.97 114.58 119.47 1r8x h GLU 15 Ca -0.47 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 57.79 1r8x h GLU 15 Cb 1.17 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1r8x h GLU 15 CO 0.40 0.55 0.00 0.41 -1.00 0.00 0.00 179.01 179.37 1r8x n GLY 16 N -0.81 -0.70 3.10 -3.84 0.00 -1.26 -4.90 105.19 96.78 1r8x n GLY 16 Ca 0.00 -0.07 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 1r8x n GLY 16 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r8x s LEU 17 N -1.50 1.93 0.52 0.99 1.43 -1.12 -5.11 118.68 115.82 1r8x s LEU 17 Ca 0.17 -0.28 -0.21 0.00 -1.03 0.00 0.00 54.13 52.78 1r8x s LEU 17 Cb 0.08 -0.79 -0.06 0.00 0.03 0.00 0.00 46.19 45.45 1r8x s LEU 17 CO 0.13 0.14 1.19 -2.16 0.23 0.00 0.00 176.35 175.88 1r8x s PRO 18 N -0.08 3.41 0.48 1.29 0.04 -1.26 -4.67 135.00 134.21 1r8x s PRO 18 Ca 0.00 1.80 -0.20 0.00 0.04 0.00 0.00 61.00 62.64 1r8x s PRO 18 Cb -0.08 -2.18 -0.09 0.00 0.04 0.00 0.00 34.50 32.19 1r8x s PRO 18 CO 0.01 -0.85 1.04 -0.51 0.04 0.00 0.00 177.00 176.73 1r8x s ASP 19 N -1.47 6.36 0.00 6.66 1.01 -1.26 -4.89 116.67 123.08 1r8x s ASP 19 Ca 0.70 1.92 0.00 0.00 0.71 0.00 0.00 52.55 55.88 1r8x s ASP 19 Cb -0.29 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.08 1r8x s ASP 19 CO 0.34 -0.77 0.00 0.00 0.21 0.00 0.00 175.17 174.95 1r8x n GLN 20 N -0.94 0.00 -0.69 8.23 1.13 -1.26 -1.25 117.38 122.59 1r8x n GLN 20 Ca 0.09 0.00 0.06 0.00 -1.94 0.00 0.00 57.00 55.21 1r8x n GLN 20 Cb 0.53 0.00 0.16 0.00 0.11 0.00 0.00 30.24 31.03 1r8x n GLN 20 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1r8x n TYR 21 N 0.00 0.00 0.17 1.08 4.02 -1.26 -4.80 117.16 116.37 1r8x n TYR 21 Ca 0.00 -1.19 0.06 0.00 -0.01 0.00 0.00 57.90 56.76 1r8x n TYR 21 Cb 0.00 -0.21 0.12 0.00 -0.02 0.00 0.00 39.34 39.23 1r8x n TYR 21 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1r8x h ALA 22 N 0.83 0.81 -0.01 -0.72 0.00 -1.52 -2.37 119.26 116.28 1r8x h ALA 22 Ca -0.04 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1r8x h ALA 22 Cb 1.18 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1r8x h ALA 22 CO 0.02 0.40 -0.23 -0.25 0.00 0.00 0.00 179.25 179.19 1r8x n ASP 23 N -3.20 1.28 -2.68 0.00 9.92 -1.26 -4.68 116.55 115.93 1r8x n ASP 23 Ca 0.02 -1.10 -0.07 0.00 -0.53 0.00 0.00 54.79 53.11 1r8x n ASP 23 Cb 0.64 0.15 0.06 0.00 -0.64 0.00 0.00 41.12 41.32 1r8x n ASP 23 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1r8x n GLY 24 N 1.32 -2.20 0.09 0.44 0.00 -0.89 -4.89 105.19 99.05 1r8x n GLY 24 Ca 0.13 -1.51 -0.17 0.00 0.00 0.00 0.00 46.02 44.46 1r8x n GLY 24 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1r8x h GLU 25 N 0.00 0.00 -0.86 1.61 4.81 -1.93 -3.11 114.58 115.10 1r8x h GLU 25 Ca -0.10 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.18 1r8x h GLU 25 Cb 0.29 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.62 1r8x h GLU 25 CO 0.07 0.99 0.56 0.00 -0.73 0.00 0.00 179.01 179.89 1r8x h ALA 26 N -0.24 1.52 -0.84 2.92 0.00 -1.94 -2.01 119.26 118.67 1r8x h ALA 26 Ca -0.16 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1r8x h ALA 26 Cb 1.13 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 1r8x h ALA 26 CO -0.10 0.37 0.43 0.00 0.00 0.00 0.00 179.25 179.96 1r8x h ALA 27 N 1.52 1.18 -0.03 0.00 0.00 -1.84 -1.13 119.26 118.95 1r8x h ALA 27 Ca 0.36 -0.14 -0.20 0.00 0.00 0.00 0.00 54.91 54.92 1r8x h ALA 27 Cb 0.13 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1r8x h ALA 27 CO -0.12 0.64 -0.84 0.00 0.00 0.00 0.00 179.25 178.94 1r8x h ARG 28 N 1.19 0.37 -0.38 0.00 3.08 -1.30 -0.44 114.38 116.89 1r8x h ARG 28 Ca 0.29 -0.35 -0.14 0.00 0.07 0.00 0.00 59.98 59.85 1r8x h ARG 28 Cb 0.07 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1r8x h ARG 28 CO -0.04 1.02 -0.31 0.28 -1.07 0.00 0.00 179.97 179.85 1r8x h VAL 29 N 0.23 1.28 0.00 2.04 2.07 -1.33 -3.03 116.25 117.51 1r8x h VAL 29 Ca -0.05 -1.46 -0.08 0.00 0.82 0.00 0.00 66.70 65.92 1r8x h VAL 29 Cb 1.44 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 32.51 1r8x h VAL 29 CO 0.14 0.49 -0.40 -0.25 0.02 0.00 0.00 177.57 177.56 1r8x h TRP 30 N 0.71 0.00 -0.22 1.57 7.01 -1.11 -1.20 115.95 122.71 1r8x h TRP 30 Ca 0.08 0.00 -0.10 0.00 2.11 0.00 0.00 58.89 60.97 1r8x h TRP 30 Cb 0.86 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.91 1r8x h TRP 30 CO 0.05 0.40 -0.31 1.96 -2.79 0.00 0.00 178.44 177.76 1r8x h GLN 31 N 0.00 0.44 -0.79 2.65 4.20 -1.00 -1.54 115.11 119.07 1r8x h GLN 31 Ca -0.00 -0.18 -0.03 0.00 0.06 0.00 0.00 58.65 58.50 1r8x h GLN 31 Cb 0.92 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.65 1r8x h GLN 31 CO 0.05 0.70 0.39 -0.07 -0.67 0.00 0.00 178.83 179.23 1r8x h LEU 32 N 0.38 1.03 -0.37 1.46 3.38 -1.30 -2.69 115.31 117.20 1r8x h LEU 32 Ca 0.05 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 1r8x h LEU 32 Cb 0.73 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1r8x h LEU 32 CO 0.06 0.87 -0.06 0.22 0.09 0.00 0.00 178.44 179.61 1r8x h TYR 33 N 1.11 0.78 0.00 1.13 3.20 -0.37 -2.51 116.97 120.31 1r8x h TYR 33 Ca 0.27 -0.16 0.00 0.00 3.14 0.00 0.00 58.73 61.98 1r8x h TYR 33 Cb 0.11 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.18 1r8x h TYR 33 CO 0.01 0.83 0.00 -0.84 -1.64 0.00 0.00 178.16 176.52 1r8x h ILE 34 N 0.50 0.00 -0.13 1.81 3.07 -1.35 -2.35 117.51 119.07 1r8x h ILE 34 Ca 0.10 -0.73 0.00 0.00 1.55 0.00 0.00 64.86 65.78 1r8x h ILE 34 Cb 0.56 1.71 0.00 0.00 -0.27 0.00 0.00 36.82 38.82 1r8x h ILE 34 CO 0.03 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.74 1r8x n GLY 35 N 0.74 0.21 1.85 0.16 0.00 -1.01 -4.45 105.19 102.69 1r8x n GLY 35 Ca 0.03 -0.42 -0.06 0.00 0.00 0.00 0.00 46.02 45.57 1r8x n GLY 35 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1r8x n ASP 36 N 0.28 4.63 -2.66 1.61 2.03 -0.88 -4.52 116.55 117.04 1r8x n ASP 36 Ca 0.17 -2.31 -0.22 0.00 0.52 0.00 0.00 54.79 52.95 1r8x n ASP 36 Cb 0.33 -1.14 -0.00 0.00 -0.72 0.00 0.00 41.12 39.60 1r8x n ASP 36 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1r8x n THR 37 N 2.14 1.99 -0.11 5.18 -2.24 -1.26 -4.65 114.28 115.33 1r8x n THR 37 Ca 0.22 -4.61 -0.21 0.00 -2.27 0.00 0.00 64.05 57.18 1r8x n THR 37 Cb 0.65 -0.78 -0.09 0.00 -2.10 0.00 0.00 70.33 68.01 1r8x n THR 37 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1r8x n ARG 38 N -0.29 0.55 -2.63 -0.78 1.74 -1.26 -4.56 116.66 109.43 1r8x n ARG 38 Ca 0.30 0.47 -0.42 0.00 -0.77 0.00 0.00 57.85 57.43 1r8x n ARG 38 Cb 0.65 -1.66 -0.03 0.00 -1.02 0.00 0.00 32.46 30.40 1r8x n ARG 38 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1r8x s SER 39 N -6.80 6.21 0.26 0.55 0.01 -1.26 -5.00 113.70 107.68 1r8x s SER 39 Ca -0.29 -0.72 -0.29 0.00 1.31 0.00 0.00 55.95 55.96 1r8x s SER 39 Cb 0.07 -2.52 -0.09 0.00 0.21 0.00 0.00 66.02 63.69 1r8x s SER 39 CO 0.50 -1.70 1.24 -0.60 0.41 0.00 0.00 173.24 173.09 1r8x s ARG 40 N 5.20 4.46 0.35 12.44 3.52 -1.26 -1.81 118.95 141.84 1r8x s ARG 40 Ca 0.33 2.02 -0.27 0.00 -0.13 0.00 0.00 55.73 57.68 1r8x s ARG 40 Cb -0.09 -3.16 -0.09 0.00 -1.56 0.00 0.00 34.95 30.05 1r8x s ARG 40 CO 0.11 -0.08 1.19 0.95 -0.81 0.00 0.00 175.30 176.66 1r8x s THR 41 N -0.68 3.10 0.26 4.11 -4.23 0.96 -4.85 115.64 114.31 1r8x s THR 41 Ca 0.50 1.03 -0.02 0.00 -1.18 0.00 0.00 61.69 62.03 1r8x s THR 41 Cb -0.36 -3.63 0.10 0.00 1.34 0.00 0.00 72.50 69.95 1r8x s THR 41 CO 0.44 0.19 1.74 0.00 -0.54 0.00 0.00 174.62 176.44 1r8x h ALA 42 N 3.19 1.07 -0.74 3.99 0.00 -1.95 -1.50 119.26 123.33 1r8x h ALA 42 Ca -0.48 -0.29 0.07 0.00 0.00 0.00 0.00 54.91 54.21 1r8x h ALA 42 Cb 1.23 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 1r8x h ALA 42 CO 0.65 0.58 0.42 0.93 0.00 0.00 0.00 179.25 181.82 1r8x h GLU 43 N 0.70 0.73 -0.02 0.00 3.07 -1.94 0.34 114.58 117.46 1r8x h GLU 43 Ca 0.13 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 58.91 1r8x h GLU 43 Cb 0.51 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.26 1r8x h GLU 43 CO 0.03 0.48 -0.11 -0.92 -1.40 0.00 0.00 179.01 177.09 1r8x h TYR 44 N 0.75 0.15 -0.26 4.33 5.03 -1.74 -0.94 116.97 124.29 1r8x h TYR 44 Ca 0.33 -0.07 0.06 0.00 2.58 0.00 0.00 58.73 61.64 1r8x h TYR 44 Cb 0.23 -0.02 -0.08 0.00 1.55 0.00 0.00 36.73 38.41 1r8x h TYR 44 CO -0.07 0.77 -0.34 -0.22 -1.32 0.00 0.00 178.16 176.98 1r8x h LYS 45 N -0.51 -0.33 -0.66 1.82 3.64 -1.08 -1.12 116.57 118.33 1r8x h LYS 45 Ca -0.01 0.02 0.14 0.00 -1.27 0.00 0.00 60.65 59.53 1r8x h LYS 45 Cb 0.78 0.07 -0.12 0.00 -0.41 0.00 0.00 32.23 32.55 1r8x h LYS 45 CO 0.02 -0.22 -0.13 0.00 -2.27 0.00 0.00 179.45 176.85 1r8x h ALA 46 N 0.53 0.49 -0.06 5.00 0.00 -0.90 -2.46 119.26 121.87 1r8x h ALA 46 Ca 0.13 0.25 -0.06 0.00 0.00 0.00 0.00 54.91 55.23 1r8x h ALA 46 Cb 0.55 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1r8x h ALA 46 CO -0.44 -0.42 -0.20 2.35 0.00 0.00 0.00 179.25 180.54 1r8x h TRP 47 N 0.02 0.30 0.05 0.00 7.01 0.02 -1.41 115.95 121.94 1r8x h TRP 47 Ca 0.33 -0.13 -0.00 0.00 2.11 0.00 0.00 58.89 61.20 1r8x h TRP 47 Cb 0.51 -0.05 0.00 0.00 -2.10 0.00 0.00 29.16 27.52 1r8x h TRP 47 CO -0.50 0.82 -0.02 1.25 -2.79 0.00 0.00 178.44 177.19 1r8x h LEU 48 N -0.30 -0.06 -1.53 0.65 5.85 -1.35 -0.00 115.31 118.58 1r8x h LEU 48 Ca -0.01 -0.54 0.30 0.00 0.84 0.00 0.00 57.88 58.47 1r8x h LEU 48 Cb 0.83 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.79 1r8x h LEU 48 CO 0.04 0.54 0.72 -0.07 -0.34 0.00 0.00 178.44 179.34 1r8x h LEU 49 N -0.69 0.31 0.00 2.25 3.38 -1.55 0.45 115.31 119.47 1r8x h LEU 49 Ca -0.01 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1r8x h LEU 49 Cb 0.59 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1r8x h LEU 49 CO 0.01 0.04 -0.50 1.23 0.09 0.00 0.00 178.44 179.31 1r8x h GLY 50 N 0.27 0.00 0.46 0.83 0.00 -1.03 -2.86 103.07 100.74 1r8x h GLY 50 Ca 0.60 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.82 1r8x h GLY 50 CO -0.23 0.00 -0.48 -2.00 0.00 0.00 0.00 176.54 173.83 1r8x h LEU 51 N 0.00 0.30 -0.22 3.11 5.85 0.19 -2.82 115.31 121.72 1r8x h LEU 51 Ca 0.00 -0.93 -0.02 0.00 0.84 0.00 0.00 57.88 57.77 1r8x h LEU 51 Cb 0.75 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 1r8x h LEU 51 CO 0.00 1.21 0.06 -0.07 -0.34 0.00 0.00 178.44 179.30 1r8x h LEU 52 N -0.56 0.33 -0.41 2.25 3.38 -1.36 -2.93 115.31 116.02 1r8x h LEU 52 Ca -0.08 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.64 1r8x h LEU 52 Cb 1.34 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 1r8x h LEU 52 CO 0.09 0.46 0.15 0.03 0.09 0.00 0.00 178.44 179.26 1r8x h ARG 53 N 0.18 0.63 -0.93 1.13 3.08 -1.59 -1.45 114.38 115.43 1r8x h ARG 53 Ca 0.07 -0.13 0.25 0.00 0.07 0.00 0.00 59.98 60.24 1r8x h ARG 53 Cb 0.26 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 30.16 1r8x h ARG 53 CO -0.00 0.61 0.64 0.37 -1.07 0.00 0.00 179.97 180.52 1r8x h GLN 54 N 0.52 0.18 -0.56 0.04 4.15 -1.45 -0.31 115.11 117.68 1r8x h GLN 54 Ca 0.14 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.54 1r8x h GLN 54 Cb 0.23 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.88 1r8x h GLN 54 CO -0.01 0.12 0.00 0.72 -1.93 0.00 0.00 178.83 177.73 1r8x n HIS 55 N -4.39 1.38 -3.15 3.99 8.25 -0.93 -4.97 115.22 115.40 1r8x n HIS 55 Ca 0.20 -0.65 -0.23 0.00 -0.26 0.00 0.00 57.72 56.78 1r8x n HIS 55 Cb 0.88 -0.26 0.03 0.00 1.12 0.00 0.00 29.99 31.76 1r8x n HIS 55 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1r8x n GLY 56 N 0.81 -0.52 3.68 -1.41 0.00 -0.13 -4.95 105.19 102.68 1r8x n GLY 56 Ca 0.24 0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.98 1r8x n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r8x n HIS 58 N 4.70 0.00 -3.00 0.00 -0.00 -1.26 -4.64 115.22 111.02 1r8x n HIS 58 Ca 0.01 0.00 -0.43 0.00 0.46 0.00 0.00 57.72 57.76 1r8x n HIS 58 Cb 0.50 0.00 -0.06 0.00 -0.12 0.00 0.00 29.99 30.31 1r8x n HIS 58 CO 0.00 0.00 0.00 0.50 0.46 0.00 0.00 176.34 177.30 1r8x s ARG 59 N -1.78 3.31 0.04 1.57 3.52 -1.26 -2.34 118.95 122.01 1r8x s ARG 59 Ca 0.00 -0.33 0.07 0.00 -0.13 0.00 0.00 55.73 55.34 1r8x s ARG 59 Cb 0.00 -3.99 -0.02 0.00 -1.56 0.00 0.00 34.95 29.37 1r8x s ARG 59 CO 0.00 -1.19 -0.20 0.54 -0.81 0.00 0.00 175.30 173.64 1r8x s VAL 60 N 3.21 1.63 -0.13 7.11 0.11 -0.50 -0.39 120.40 131.44 1r8x s VAL 60 Ca 0.26 -1.18 -0.01 0.00 -2.93 0.00 0.00 61.98 58.12 1r8x s VAL 60 Cb -0.14 -1.42 -0.02 0.00 -1.53 0.00 0.00 36.38 33.28 1r8x s VAL 60 CO 0.19 0.20 -0.10 -0.22 -3.33 0.00 0.00 175.10 171.84 1r8x s LEU 61 N -1.15 2.89 -0.46 2.54 2.96 -0.37 -1.60 118.68 123.49 1r8x s LEU 61 Ca 0.07 -0.25 -0.08 0.00 -0.22 0.00 0.00 54.13 53.64 1r8x s LEU 61 Cb -0.09 -1.66 0.11 0.00 0.50 0.00 0.00 46.19 45.05 1r8x s LEU 61 CO 0.02 0.18 0.32 -0.62 -1.32 0.00 0.00 176.35 174.92 1r8x s ASP 62 N 0.28 5.65 0.28 3.68 -1.08 0.48 -0.97 116.67 124.98 1r8x s ASP 62 Ca -0.08 -1.87 -0.19 0.00 -0.52 0.00 0.00 52.55 49.90 1r8x s ASP 62 Cb -0.15 -1.99 -0.09 0.00 -1.46 0.00 0.00 42.92 39.23 1r8x s ASP 62 CO 0.05 -0.66 0.76 -0.69 0.52 0.00 0.00 175.17 175.15 1r8x s VAL 63 N 1.35 4.57 -0.64 1.11 1.01 -0.77 -1.30 120.40 125.72 1r8x s VAL 63 Ca 0.06 1.22 -0.09 0.00 0.00 0.00 0.00 61.98 63.16 1r8x s VAL 63 Cb -0.25 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.38 1r8x s VAL 63 CO -0.01 0.02 0.65 0.00 0.00 0.00 0.00 175.10 175.77 1r8x n ALA 64 N 0.22 -2.67 -0.02 5.51 0.00 -0.21 -4.54 120.51 118.80 1r8x n ALA 64 Ca 0.01 0.31 0.06 0.00 0.00 0.00 0.00 53.44 53.81 1r8x n ALA 64 Cb 0.52 -2.05 -0.14 0.00 0.00 0.00 0.00 19.45 17.78 1r8x n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r8x n GLY 66 N 1.58 1.43 0.07 0.00 0.00 -1.26 -2.03 105.19 104.97 1r8x n GLY 66 Ca -0.07 -0.63 0.13 0.00 0.00 0.00 0.00 46.02 45.44 1r8x n GLY 66 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1r8x n THR 67 N 0.00 0.47 -0.03 2.61 -2.24 -1.25 -3.56 114.28 110.28 1r8x n THR 67 Ca 0.00 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1r8x n THR 67 Cb 0.00 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 67.57 1r8x n THR 67 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r8x n GLY 68 N 1.11 1.18 0.29 3.38 0.00 -0.86 -1.93 105.19 108.36 1r8x n GLY 68 Ca 0.05 -0.03 -0.15 0.00 0.00 0.00 0.00 46.02 45.90 1r8x n GLY 68 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1r8x h VAL 69 N 0.00 0.41 -0.81 1.61 -1.51 -1.92 0.56 116.25 114.59 1r8x h VAL 69 Ca 0.00 -0.37 0.18 0.00 -1.23 0.00 0.00 66.70 65.28 1r8x h VAL 69 Cb 0.01 0.55 -0.11 0.00 -2.13 0.00 0.00 31.29 29.60 1r8x h VAL 69 CO 0.00 0.05 0.30 0.44 -1.23 0.00 0.00 177.57 177.13 1r8x h ASP 70 N -0.93 0.22 -0.58 4.19 3.32 -1.96 0.11 116.42 120.80 1r8x h ASP 70 Ca -0.07 0.14 -0.05 0.00 0.02 0.00 0.00 57.03 57.07 1r8x h ASP 70 Cb 0.60 0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.26 1r8x h ASP 70 CO 0.11 0.03 0.16 0.28 -1.72 0.00 0.00 179.24 178.10 1r8x h SER 71 N 0.38 0.87 -0.82 6.45 0.02 -1.75 -2.69 113.55 116.02 1r8x h SER 71 Ca 0.47 -0.22 0.12 0.00 -0.84 0.00 0.00 61.79 61.32 1r8x h SER 71 Cb 0.81 -0.23 -0.08 0.00 0.14 0.00 0.00 62.40 63.04 1r8x h SER 71 CO -0.48 0.86 0.44 0.40 -1.14 0.00 0.00 176.83 176.91 1r8x h ILE 72 N 0.83 0.82 0.15 3.27 2.04 0.22 0.26 117.51 125.11 1r8x h ILE 72 Ca 0.19 -0.24 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 1r8x h ILE 72 Cb 0.32 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 1r8x h ILE 72 CO -0.00 0.13 -0.07 -0.03 0.00 0.00 0.00 178.15 178.17 1r8x h MET 73 N 0.69 -0.20 -0.80 2.37 1.85 -1.29 0.45 114.93 118.01 1r8x h MET 73 Ca 0.42 0.01 0.19 0.00 -0.61 0.00 0.00 59.70 59.71 1r8x h MET 73 Cb 0.49 0.05 -0.12 0.00 0.43 0.00 0.00 31.60 32.45 1r8x h MET 73 CO -0.30 0.03 0.22 -0.07 -0.40 0.00 0.00 176.91 176.38 1r8x h LEU 74 N -0.40 0.04 -0.22 3.39 3.38 -0.95 0.13 115.31 120.68 1r8x h LEU 74 Ca -0.02 0.16 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 1r8x h LEU 74 Cb 0.31 0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1r8x h LEU 74 CO 0.03 -0.06 -0.00 0.58 0.09 0.00 0.00 178.44 179.08 1r8x h VAL 75 N 0.27 1.25 -0.47 1.22 2.07 -0.05 -1.59 116.25 118.96 1r8x h VAL 75 Ca 0.47 -0.88 0.07 0.00 0.82 0.00 0.00 66.70 67.17 1r8x h VAL 75 Cb 0.85 1.40 -0.06 0.00 -1.52 0.00 0.00 31.29 31.96 1r8x h VAL 75 CO -0.55 0.27 0.13 -0.33 0.02 0.00 0.00 177.57 177.11 1r8x h GLU 76 N 0.15 0.28 -0.36 1.57 5.08 0.22 -2.27 114.58 119.25 1r8x h GLU 76 Ca 0.06 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1r8x h GLU 76 Cb 0.40 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1r8x h GLU 76 CO 0.01 0.18 0.00 0.39 -1.00 0.00 0.00 179.01 178.60 1r8x n GLU 77 N -5.05 0.74 -1.04 2.33 -0.58 0.22 -4.81 120.64 112.45 1r8x n GLU 77 Ca 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 1r8x n GLU 77 Cb 0.20 -1.18 0.00 0.00 -0.57 0.00 0.00 31.44 29.89 1r8x n GLU 77 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1r8x n GLY 78 N 0.19 0.44 3.92 0.62 0.00 -0.85 -5.05 105.19 104.46 1r8x n GLY 78 Ca 0.00 -0.99 -0.28 0.00 0.00 0.00 0.00 46.02 44.75 1r8x n GLY 78 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r8x s PHE 79 N -2.00 2.54 -0.43 1.61 0.40 -0.61 -5.04 117.98 114.45 1r8x s PHE 79 Ca 0.00 0.55 0.02 0.00 -0.60 0.00 0.00 56.93 56.90 1r8x s PHE 79 Cb 0.00 -3.59 0.12 0.00 0.51 0.00 0.00 43.02 40.05 1r8x s PHE 79 CO 0.00 -1.94 0.17 0.45 0.70 0.00 0.00 175.22 174.60 1r8x s SER 80 N -4.66 4.77 -0.12 1.36 0.15 -0.99 -4.68 113.70 109.54 1r8x s SER 80 Ca 0.65 -2.44 0.02 0.00 0.70 0.00 0.00 55.95 54.88 1r8x s SER 80 Cb -0.09 -1.69 -0.00 0.00 -1.71 0.00 0.00 66.02 62.53 1r8x s SER 80 CO 0.49 -0.37 -0.20 0.68 1.20 0.00 0.00 173.24 175.04 1r8x s VAL 81 N 0.51 2.35 -0.09 4.45 -7.23 -1.26 -1.41 120.40 117.73 1r8x s VAL 81 Ca 0.13 -0.90 -0.00 0.00 -1.81 0.00 0.00 61.98 59.39 1r8x s VAL 81 Cb -0.22 -1.94 -0.03 0.00 0.56 0.00 0.00 36.38 34.75 1r8x s VAL 81 CO -0.05 0.54 -0.06 -0.32 -0.31 0.00 0.00 175.10 174.91 1r8x s MET 82 N 0.49 2.97 -0.07 4.82 -2.45 -0.63 -2.74 119.30 121.69 1r8x s MET 82 Ca -0.13 -0.54 0.01 0.00 -1.25 0.00 0.00 55.69 53.78 1r8x s MET 82 Cb -0.17 -2.67 0.02 0.00 1.25 0.00 0.00 34.83 33.26 1r8x s MET 82 CO 0.05 0.57 -0.08 -1.12 1.05 0.00 0.00 175.02 175.48 1r8x s SER 83 N -0.54 1.64 0.17 1.11 0.01 0.13 -0.39 113.70 115.84 1r8x s SER 83 Ca 0.08 -0.24 0.08 0.00 1.31 0.00 0.00 55.95 57.18 1r8x s SER 83 Cb -0.12 -0.71 -0.04 0.00 0.21 0.00 0.00 66.02 65.36 1r8x s SER 83 CO 0.02 -0.04 -0.16 0.68 0.41 0.00 0.00 173.24 174.15 1r8x s VAL 84 N 1.04 1.74 0.03 3.43 -7.23 -0.42 -1.52 120.40 117.47 1r8x s VAL 84 Ca -0.08 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 57.81 1r8x s VAL 84 Cb -0.14 -1.88 0.09 0.00 0.56 0.00 0.00 36.38 35.01 1r8x s VAL 84 CO -0.00 -0.42 0.79 -0.62 -0.31 0.00 0.00 175.10 174.53 1r8x s ASP 85 N -2.87 -0.46 0.00 4.85 3.68 -1.14 -1.04 116.67 119.69 1r8x s ASP 85 Ca 0.17 0.11 0.24 0.00 2.13 0.00 0.00 52.55 55.21 1r8x s ASP 85 Cb -0.04 0.46 0.35 0.00 -1.45 0.00 0.00 42.92 42.24 1r8x s ASP 85 CO 0.06 -0.70 1.32 0.00 0.13 0.00 0.00 175.17 175.98 1r8x n ALA 86 N -0.08 3.23 -3.32 3.66 0.00 -1.15 -2.31 120.51 120.55 1r8x n ALA 86 Ca -0.12 -0.55 -0.36 0.00 0.00 0.00 0.00 53.44 52.40 1r8x n ALA 86 Cb 0.62 -0.94 -0.13 0.00 0.00 0.00 0.00 19.45 19.00 1r8x n ALA 86 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1r8x s SER 87 N -2.41 4.86 0.16 0.00 0.15 -1.26 -4.90 113.70 110.30 1r8x s SER 87 Ca 0.23 -0.65 -0.12 0.00 0.70 0.00 0.00 55.95 56.10 1r8x s SER 87 Cb 0.19 -1.82 0.05 0.00 -1.71 0.00 0.00 66.02 62.72 1r8x s SER 87 CO 0.52 -0.14 1.65 0.44 1.20 0.00 0.00 173.24 176.91 1r8x h ASP 88 N 8.17 0.86 -1.00 5.45 3.32 -1.97 -0.86 116.42 130.39 1r8x h ASP 88 Ca -0.34 -0.25 0.23 0.00 0.02 0.00 0.00 57.03 56.69 1r8x h ASP 88 Cb 1.13 -0.23 -0.09 0.00 0.22 0.00 0.00 39.33 40.36 1r8x h ASP 88 CO 0.60 0.89 0.64 0.11 -1.72 0.00 0.00 179.24 179.76 1r8x h LYS 89 N 0.79 0.47 0.11 3.56 1.57 -2.00 0.01 116.57 121.08 1r8x h LYS 89 Ca 0.17 -0.03 -0.36 0.00 -1.87 0.00 0.00 60.65 58.56 1r8x h LYS 89 Cb 0.39 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 1r8x h LYS 89 CO 0.01 0.31 -1.98 -1.33 -0.57 0.00 0.00 179.45 175.89 1r8x n MET 90 N -4.64 0.74 0.27 3.15 2.81 -1.10 -3.95 117.12 114.40 1r8x n MET 90 Ca 0.24 0.26 0.16 0.00 -1.81 0.00 0.00 57.70 56.54 1r8x n MET 90 Cb 0.76 -1.71 0.90 0.00 -0.71 0.00 0.00 33.22 32.46 1r8x n MET 90 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1r8x h LEU 91 N 0.06 0.00 -1.81 4.03 5.85 -0.37 -1.25 115.31 121.82 1r8x h LEU 91 Ca -0.41 0.00 0.24 0.00 0.84 0.00 0.00 57.88 58.55 1r8x h LEU 91 Cb 2.03 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 43.01 1r8x h LEU 91 CO 0.08 0.00 0.63 0.50 -0.34 0.00 0.00 178.44 179.31 1r8x h LYS 92 N 0.00 0.14 0.00 1.25 3.64 -1.15 -0.98 116.57 119.48 1r8x h LYS 92 Ca 0.02 -0.01 -0.27 0.00 -1.27 0.00 0.00 60.65 59.13 1r8x h LYS 92 Cb 0.13 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.87 1r8x h LYS 92 CO -0.00 0.09 -1.70 0.66 -2.27 0.00 0.00 179.45 176.23 1r8x n TYR 93 N -4.36 0.91 -0.01 1.91 4.02 -0.47 -1.54 117.16 117.61 1r8x n TYR 93 Ca 0.19 0.32 -0.12 0.00 -0.01 0.00 0.00 57.90 58.29 1r8x n TYR 93 Cb 0.88 -1.14 -0.07 0.00 -0.02 0.00 0.00 39.34 38.99 1r8x n TYR 93 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1r8x h ALA 94 N 1.10 0.11 -0.53 -0.72 0.00 -0.79 -2.37 119.26 116.06 1r8x h ALA 94 Ca -0.28 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.54 1r8x h ALA 94 Cb 1.93 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.66 1r8x h ALA 94 CO 0.07 -0.29 0.34 -0.07 0.00 0.00 0.00 179.25 179.29 1r8x h LEU 95 N -0.04 0.56 0.33 0.00 -0.00 -1.23 -0.36 115.31 114.56 1r8x h LEU 95 Ca 0.03 -0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.89 1r8x h LEU 95 Cb 0.20 -0.13 -0.00 0.00 -0.00 0.00 0.00 40.66 40.73 1r8x h LEU 95 CO -0.00 0.40 -0.21 0.50 -0.00 0.00 0.00 178.44 179.13 1r8x h LYS 96 N 0.68 -0.49 -0.94 1.13 3.64 -1.29 -1.17 116.57 118.14 1r8x h LYS 96 Ca 0.21 0.03 0.17 0.00 -1.27 0.00 0.00 60.65 59.79 1r8x h LYS 96 Cb -0.03 0.11 -0.08 0.00 -0.41 0.00 0.00 32.23 31.83 1r8x h LYS 96 CO -0.07 -0.32 0.60 1.49 -2.27 0.00 0.00 179.45 178.87 1r8x h GLU 97 N -0.50 0.63 -0.65 1.90 4.57 -1.27 0.11 114.58 119.36 1r8x h GLU 97 Ca -0.04 -0.04 0.03 0.00 -1.18 0.00 0.00 59.36 58.12 1r8x h GLU 97 Cb 0.41 -0.14 -0.04 0.00 -0.16 0.00 0.00 28.75 28.81 1r8x h GLU 97 CO 0.04 0.42 0.41 -0.09 -1.18 0.00 0.00 179.01 178.61 1r8x h ARG 98 N 0.65 0.78 -0.35 1.92 1.12 -0.95 -1.20 114.38 116.36 1r8x h ARG 98 Ca 0.49 -0.05 -0.04 0.00 -1.11 0.00 0.00 59.98 59.28 1r8x h ARG 98 Cb 0.89 -0.18 -0.01 0.00 -0.01 0.00 0.00 29.97 30.66 1r8x h ARG 98 CO -0.25 0.52 0.06 2.35 -3.11 0.00 0.00 179.97 179.53 1r8x h TRP 99 N 0.81 0.61 -0.51 2.20 2.91 0.42 -1.96 115.95 120.43 1r8x h TRP 99 Ca 0.26 -0.09 0.13 0.00 1.13 0.00 0.00 58.89 60.33 1r8x h TRP 99 Cb 0.01 -0.17 -0.02 0.00 -0.51 0.00 0.00 29.16 28.46 1r8x h TRP 99 CO -0.05 0.64 0.36 -0.91 -1.03 0.00 0.00 178.44 177.45 1r8x h ASN 100 N 0.41 0.09 -0.12 2.65 2.35 -0.81 -1.97 115.58 118.18 1r8x h ASN 100 Ca 0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 1r8x h ASN 100 Cb 0.36 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.71 1r8x h ASN 100 CO 0.01 0.05 0.00 0.54 -1.65 0.00 0.00 177.43 176.38 1r8x n ARG 101 N -4.42 2.04 0.31 0.81 1.74 -0.47 -4.78 116.66 111.90 1r8x n ARG 101 Ca 0.09 -2.67 0.19 0.00 -0.77 0.00 0.00 57.85 54.69 1r8x n ARG 101 Cb 0.52 -1.64 0.98 0.00 -1.02 0.00 0.00 32.46 31.30 1r8x n ARG 101 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 1r8x h ARG 102 N 0.81 0.00 -0.30 5.56 0.11 -0.56 -1.78 114.38 118.23 1r8x h ARG 102 Ca 0.00 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 59.93 1r8x h ARG 102 Cb 1.18 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.25 1r8x h ARG 102 CO 0.10 0.00 -0.41 0.87 0.10 0.00 0.00 179.97 180.63 1r8x h LYS 103 N 0.00 0.73 -6.25 0.08 6.56 -1.86 -3.38 116.57 112.44 1r8x h LYS 103 Ca 0.02 -0.38 -0.55 0.00 -1.06 0.00 0.00 60.65 58.67 1r8x h LYS 103 Cb 0.38 0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 32.05 1r8x h LYS 103 CO -0.00 1.00 1.09 -1.21 -2.06 0.00 0.00 179.45 178.27 1r8x s GLU 104 N -4.29 4.12 0.17 3.15 2.02 -0.67 -4.86 118.70 118.34 1r8x s GLU 104 Ca -0.09 2.10 -0.15 0.00 0.02 0.00 0.00 54.97 56.84 1r8x s GLU 104 Cb 0.12 -3.99 0.12 0.00 0.10 0.00 0.00 34.13 30.48 1r8x s GLU 104 CO 0.85 -0.92 1.70 -1.35 0.02 0.00 0.00 175.26 175.57 1r8x h PRO 105 N 9.71 0.12 -0.98 0.39 0.11 -1.88 0.69 132.00 140.17 1r8x h PRO 105 Ca -0.38 -0.01 0.35 0.00 0.11 0.00 0.00 66.00 66.07 1r8x h PRO 105 Cb 1.17 -0.03 -0.18 0.00 0.11 0.00 0.00 31.00 32.08 1r8x h PRO 105 CO 0.96 0.08 0.31 -1.13 -0.21 0.00 0.00 178.00 178.01 1r8x n SER 106 N -5.18 0.15 -0.01 -2.05 3.41 -1.26 -0.64 113.62 108.03 1r8x n SER 106 Ca 0.03 1.64 -0.10 0.00 -0.26 0.00 0.00 58.87 60.18 1r8x n SER 106 Cb 0.21 -0.71 -0.14 0.00 -0.26 0.00 0.00 64.21 63.31 1r8x n SER 106 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 1r8x h PHE 107 N 0.00 0.08 -0.60 7.33 -1.00 -1.33 -3.01 116.94 118.42 1r8x h PHE 107 Ca 0.73 -0.06 0.06 0.00 2.81 0.00 0.00 57.97 61.51 1r8x h PHE 107 Cb 1.78 -0.00 -0.05 0.00 3.61 0.00 0.00 35.95 41.28 1r8x h PHE 107 CO -0.22 1.12 0.30 0.22 -1.61 0.00 0.00 178.31 178.12 1r8x h ASP 108 N 0.01 0.43 0.45 2.17 3.58 0.48 -2.24 116.42 121.29 1r8x h ASP 108 Ca -0.28 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.21 1r8x h ASP 108 Cb 2.00 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 43.01 1r8x h ASP 108 CO 0.09 0.28 0.00 0.59 -2.88 0.00 0.00 179.24 177.32 1r8x n ASN 109 N -4.86 0.00 -4.68 2.28 5.03 0.19 -4.79 115.26 108.43 1r8x n ASN 109 Ca 0.07 0.10 -0.42 0.00 0.87 0.00 0.00 54.58 55.19 1r8x n ASN 109 Cb 0.18 -0.33 -0.03 0.00 -1.02 0.00 0.00 39.78 38.58 1r8x n ASN 109 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 1r8x s TRP 110 N -2.66 1.93 -0.23 3.10 -0.00 -0.85 -4.80 118.94 115.44 1r8x s TRP 110 Ca 0.17 -0.07 -0.08 0.00 -0.00 0.00 0.00 56.10 56.13 1r8x s TRP 110 Cb 0.14 -4.14 -0.03 0.00 -0.00 0.00 0.00 33.47 29.43 1r8x s TRP 110 CO 0.32 -4.81 0.08 0.08 -0.00 0.00 0.00 176.95 172.62 1r8x s VAL 111 N 3.33 4.55 -0.15 5.86 1.01 -1.11 -5.04 120.40 128.85 1r8x s VAL 111 Ca 0.81 -0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.70 1r8x s VAL 111 Cb -0.43 -3.11 0.02 0.00 0.00 0.00 0.00 36.38 32.87 1r8x s VAL 111 CO 0.37 0.37 -0.16 -0.63 0.00 0.00 0.00 175.10 175.04 1r8x s ILE 112 N 1.25 1.73 0.06 2.22 1.01 -1.26 0.22 121.20 126.44 1r8x s ILE 112 Ca 0.05 -0.74 -0.03 0.00 0.00 0.00 0.00 60.65 59.92 1r8x s ILE 112 Cb -0.14 -1.59 -0.03 0.00 0.01 0.00 0.00 42.46 40.70 1r8x s ILE 112 CO 0.04 0.49 0.04 -1.61 0.00 0.00 0.00 174.94 173.89 1r8x s GLU 113 N 1.32 0.68 0.08 2.79 0.41 -0.57 -5.00 118.70 118.40 1r8x s GLU 113 Ca 0.03 -1.12 -0.23 0.00 -0.41 0.00 0.00 54.97 53.24 1r8x s GLU 113 Cb -0.13 0.25 -0.07 0.00 -1.78 0.00 0.00 34.13 32.40 1r8x s GLU 113 CO -0.10 -0.16 0.68 -1.21 -0.49 0.00 0.00 175.26 173.99 1r8x s GLU 114 N -3.83 4.40 0.06 1.61 2.02 -1.26 -2.90 118.70 118.80 1r8x s GLU 114 Ca 0.06 0.94 -0.27 0.00 0.02 0.00 0.00 54.97 55.72 1r8x s GLU 114 Cb 0.07 -3.29 0.09 0.00 0.10 0.00 0.00 34.13 31.09 1r8x s GLU 114 CO -0.10 0.50 0.81 0.00 0.02 0.00 0.00 175.26 176.49 1r8x s ALA 115 N -0.75 -1.73 -0.06 5.21 0.00 -0.98 -4.84 121.76 118.62 1r8x s ALA 115 Ca 0.33 0.75 0.02 0.00 0.00 0.00 0.00 51.96 53.06 1r8x s ALA 115 Cb -0.21 0.58 0.01 0.00 0.00 0.00 0.00 23.12 23.51 1r8x s ALA 115 CO 0.22 -0.75 -0.11 1.21 0.00 0.00 0.00 175.76 176.33 1r8x s ASN 116 N -2.61 1.67 0.45 0.00 3.84 -1.26 -2.92 114.94 114.11 1r8x s ASN 116 Ca 0.05 -0.27 0.22 0.00 0.21 0.00 0.00 52.86 53.06 1r8x s ASN 116 Cb -0.01 -0.77 1.21 0.00 -0.55 0.00 0.00 41.25 41.13 1r8x s ASN 116 CO -0.09 0.02 1.86 -0.50 -2.79 0.00 0.00 177.10 175.60 1r8x h TRP 117 N 7.04 0.38 0.00 0.43 6.55 -1.98 0.32 115.95 128.69 1r8x h TRP 117 Ca -0.32 0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.53 1r8x h TRP 117 Cb 1.18 -0.11 0.00 0.00 -0.86 0.00 0.00 29.16 29.37 1r8x h TRP 117 CO 0.49 0.09 0.00 1.28 -1.05 0.00 0.00 178.44 179.25 1r8x n LEU 118 N -4.45 0.00 -0.16 -4.49 4.77 -1.26 -3.15 117.00 108.26 1r8x n LEU 118 Ca 0.19 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 1r8x n LEU 118 Cb 0.79 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.63 1r8x n LEU 118 CO 0.33 -0.04 0.26 0.35 -1.33 0.00 0.00 177.39 176.95 1r8x n THR 119 N -1.25 0.04 -0.31 -5.08 -2.24 0.85 -4.91 114.28 101.37 1r8x n THR 119 Ca 0.13 -0.05 0.16 0.00 -2.27 0.00 0.00 64.05 62.02 1r8x n THR 119 Cb 0.19 0.82 0.33 0.00 -2.10 0.00 0.00 70.33 69.56 1r8x n THR 119 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1r8x h LEU 120 N 0.00 -0.04 -0.35 3.22 5.85 -0.72 0.11 115.31 123.39 1r8x h LEU 120 Ca 0.00 0.22 0.08 0.00 0.84 0.00 0.00 57.88 59.01 1r8x h LEU 120 Cb 1.12 0.30 -0.09 0.00 0.37 0.00 0.00 40.66 42.36 1r8x h LEU 120 CO 0.00 -0.22 -0.29 -2.24 -0.34 0.00 0.00 178.44 175.34 1r8x h ASP 121 N 0.15 -0.97 0.89 1.25 2.03 -1.86 -1.31 116.42 116.60 1r8x h ASP 121 Ca 0.60 0.17 0.00 0.00 -0.73 0.00 0.00 57.03 57.07 1r8x h ASP 121 Cb 1.28 0.46 0.00 0.00 -0.83 0.00 0.00 39.33 40.23 1r8x h ASP 121 CO -0.72 -0.31 0.00 2.29 -1.03 0.00 0.00 179.24 179.48 1r8x n LYS 122 N -5.41 0.09 -0.04 4.15 0.00 -0.03 -3.82 118.16 113.11 1r8x n LYS 122 Ca 0.01 0.01 0.11 0.00 -0.00 0.00 0.00 58.31 58.43 1r8x n LYS 122 Cb 0.32 -1.50 0.12 0.00 -0.00 0.00 0.00 35.03 33.97 1r8x n LYS 122 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1r8x n ASP 123 N -1.45 2.92 -3.28 -5.58 10.43 -0.52 -4.79 116.55 114.28 1r8x n ASP 123 Ca 0.08 -1.91 -0.05 0.00 2.57 0.00 0.00 54.79 55.48 1r8x n ASP 123 Cb 0.31 -0.06 -0.05 0.00 1.84 0.00 0.00 41.12 43.16 1r8x n ASP 123 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1r8x s VAL 124 N -1.70 -0.74 -0.81 2.53 1.01 -1.05 -4.80 120.40 114.85 1r8x s VAL 124 Ca 0.28 -0.08 -0.25 0.00 0.00 0.00 0.00 61.98 61.92 1r8x s VAL 124 Cb 0.19 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.63 1r8x s VAL 124 CO 0.27 -0.11 1.92 -1.48 0.00 0.00 0.00 175.10 175.71 1r8x s LEU 125 N 2.65 3.20 0.56 3.92 -0.00 -1.26 -4.77 118.68 122.98 1r8x s LEU 125 Ca 0.14 -0.36 0.26 0.00 -0.00 0.00 0.00 54.13 54.17 1r8x s LEU 125 Cb -0.15 -2.55 1.40 0.00 -0.00 0.00 0.00 46.19 44.90 1r8x s LEU 125 CO -0.20 -2.63 1.76 -1.28 -0.00 0.00 0.00 176.35 174.00 1r8x h SER 126 N 12.44 0.00 0.00 1.48 0.87 -1.93 -3.49 113.55 122.92 1r8x h SER 126 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1r8x h SER 126 Cb 1.05 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.01 1r8x h SER 126 CO 1.21 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 178.12 1r8x n GLY 127 N -1.23 0.93 0.72 5.77 0.00 -1.26 -1.12 105.19 109.00 1r8x n GLY 127 Ca -0.02 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1r8x n GLY 127 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1r8x n ASP 128 N -3.28 1.49 0.00 1.61 -0.08 -1.26 -4.93 116.55 110.09 1r8x n ASP 128 Ca 0.00 -1.58 0.00 0.00 -1.51 0.00 0.00 54.79 51.70 1r8x n ASP 128 Cb 0.00 -0.39 0.00 0.00 2.34 0.00 0.00 41.12 43.07 1r8x n ASP 128 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1r8x n GLY 129 N 0.33 1.57 3.76 0.27 0.00 -0.27 -4.65 105.19 106.20 1r8x n GLY 129 Ca 0.00 -2.08 -0.26 0.00 0.00 0.00 0.00 46.02 43.67 1r8x n GLY 129 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r8x s PHE 130 N -1.81 3.06 -0.01 1.61 0.40 0.27 -4.55 117.98 116.95 1r8x s PHE 130 Ca 0.00 -0.05 -0.22 0.00 -0.60 0.00 0.00 56.93 56.06 1r8x s PHE 130 Cb 0.00 -1.47 -0.20 0.00 0.51 0.00 0.00 43.02 41.86 1r8x s PHE 130 CO 0.00 0.52 1.18 -0.44 0.70 0.00 0.00 175.22 177.18 1r8x h ASP 131 N 2.50 0.31 -4.29 1.36 3.32 -1.04 0.83 116.42 119.41 1r8x h ASP 131 Ca -0.47 -0.64 -0.51 0.00 0.02 0.00 0.00 57.03 55.42 1r8x h ASP 131 Cb 1.20 -0.09 -0.27 0.00 0.22 0.00 0.00 39.33 40.39 1r8x h ASP 131 CO 0.62 0.90 -0.82 0.00 -1.72 0.00 0.00 179.24 178.22 1r8x s ALA 132 N -3.67 1.39 -0.15 3.45 0.00 -1.10 -0.88 121.76 120.81 1r8x s ALA 132 Ca -0.15 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 50.99 1r8x s ALA 132 Cb 0.03 -0.29 0.02 0.00 0.00 0.00 0.00 23.12 22.88 1r8x s ALA 132 CO 0.75 0.31 -0.16 0.08 0.00 0.00 0.00 175.76 176.75 1r8x s VAL 133 N -0.63 1.66 -0.08 0.00 1.01 -0.19 -1.23 120.40 120.93 1r8x s VAL 133 Ca 0.05 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.35 1r8x s VAL 133 Cb -0.07 -1.53 -0.02 0.00 0.00 0.00 0.00 36.38 34.75 1r8x s VAL 133 CO 0.01 0.47 -0.11 0.27 0.00 0.00 0.00 175.10 175.74 1r8x s ILE 134 N 1.34 3.32 -0.39 2.22 -4.36 -0.15 -0.08 121.20 123.10 1r8x s ILE 134 Ca 0.02 -0.61 0.03 0.00 -0.26 0.00 0.00 60.65 59.83 1r8x s ILE 134 Cb -0.13 -2.35 0.16 0.00 1.25 0.00 0.00 42.46 41.39 1r8x s ILE 134 CO -0.09 0.57 0.32 0.00 0.24 0.00 0.00 174.94 175.99 1r8x s LEU 136 N 0.64 2.96 -0.50 0.00 1.43 -1.26 -3.08 118.68 118.86 1r8x s LEU 136 Ca 0.26 -1.09 0.00 0.00 -1.03 0.00 0.00 54.13 52.27 1r8x s LEU 136 Cb -0.08 -1.46 0.00 0.00 0.03 0.00 0.00 46.19 44.68 1r8x s LEU 136 CO -0.10 -0.86 0.00 0.61 0.23 0.00 0.00 176.35 176.23 1r8x n GLY 137 N -1.59 0.71 1.64 -3.19 0.00 -1.26 -3.98 105.19 97.53 1r8x n GLY 137 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1r8x n GLY 137 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1r8x n ASN 138 N 0.23 -1.01 -0.01 1.61 5.15 -1.26 -4.95 115.26 115.01 1r8x n ASN 138 Ca -0.05 0.00 -0.08 0.00 -0.60 0.00 0.00 54.58 53.85 1r8x n ASN 138 Cb 0.24 -0.43 -0.14 0.00 -0.53 0.00 0.00 39.78 38.92 1r8x n ASN 138 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1r8x h SER 139 N 0.00 0.00 -1.69 1.20 0.02 -1.82 -3.18 113.55 108.08 1r8x h SER 139 Ca 0.00 -0.00 0.49 0.00 -0.84 0.00 0.00 61.79 61.44 1r8x h SER 139 Cb 0.86 -0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.33 1r8x h SER 139 CO 0.00 1.00 1.25 0.15 -1.14 0.00 0.00 176.83 178.09 1r8x h PHE 140 N 0.00 0.00 0.00 3.45 3.57 -1.86 0.22 116.94 122.32 1r8x h PHE 140 Ca -0.26 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.24 1r8x h PHE 140 Cb 1.99 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.73 1r8x h PHE 140 CO 0.00 0.00 0.00 0.00 -2.23 0.00 0.00 178.31 176.08 1r8x n ALA 141 N -2.84 2.06 0.45 2.41 0.00 -1.20 -1.14 120.51 120.25 1r8x n ALA 141 Ca 0.38 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.88 1r8x n ALA 141 Cb 1.76 -1.40 0.47 0.00 0.00 0.00 0.00 19.45 20.29 1r8x n ALA 141 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1r8x n HIS 142 N -1.72 0.77 -2.82 0.00 8.25 0.77 -0.41 115.22 120.05 1r8x n HIS 142 Ca 0.05 0.29 -0.43 0.00 -0.26 0.00 0.00 57.72 57.37 1r8x n HIS 142 Cb 0.30 -0.97 -0.04 0.00 1.12 0.00 0.00 29.99 30.40 1r8x n HIS 142 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1r8x s LEU 143 N -4.38 4.01 0.61 2.41 2.96 -0.29 -4.87 118.68 119.12 1r8x s LEU 143 Ca 0.06 0.39 -0.10 0.00 -0.22 0.00 0.00 54.13 54.26 1r8x s LEU 143 Cb 0.10 -3.22 -0.02 0.00 0.50 0.00 0.00 46.19 43.55 1r8x s LEU 143 CO 0.42 -0.92 0.99 -2.16 -1.32 0.00 0.00 176.35 173.36 1r8x s PRO 144 N 3.55 3.38 -1.19 0.98 0.04 -1.26 -4.63 135.00 135.86 1r8x s PRO 144 Ca 0.37 0.52 -0.09 0.00 0.04 0.00 0.00 61.00 61.84 1r8x s PRO 144 Cb -0.11 -2.14 0.22 0.00 0.04 0.00 0.00 34.50 32.51 1r8x s PRO 144 CO 0.21 -0.61 1.55 -3.47 0.04 0.00 0.00 177.00 174.72 1r8x n ASP 145 N -2.70 5.49 -0.19 6.66 2.03 -1.26 -4.78 116.55 121.79 1r8x n ASP 145 Ca 0.05 -3.13 -0.10 0.00 0.52 0.00 0.00 54.79 52.14 1r8x n ASP 145 Cb 0.55 -1.44 0.01 0.00 -0.72 0.00 0.00 41.12 39.52 1r8x n ASP 145 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1r8x h LYS 147 N 0.84 0.00 0.00 0.00 2.10 -2.02 -3.48 116.57 114.02 1r8x h LYS 147 Ca 0.15 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.80 1r8x h LYS 147 Cb 0.54 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.87 1r8x h LYS 147 CO 0.03 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 177.89 1r8x n GLY 148 N 1.13 3.22 0.49 0.07 0.00 -1.17 -4.90 105.19 104.04 1r8x n GLY 148 Ca 0.04 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.11 1r8x n GLY 148 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1r8x n ASP 149 N 0.00 2.32 -0.51 1.61 5.68 -1.26 -4.97 116.55 119.42 1r8x n ASP 149 Ca 0.00 -1.69 -0.07 0.00 -0.50 0.00 0.00 54.79 52.53 1r8x n ASP 149 Cb 0.00 -0.10 -0.03 0.00 -1.14 0.00 0.00 41.12 39.85 1r8x n ASP 149 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1r8x n GLN 150 N 0.51 -1.01 -0.11 0.11 6.02 -1.26 -4.90 117.38 116.74 1r8x n GLN 150 Ca 0.08 0.64 0.01 0.00 -0.01 0.00 0.00 57.00 57.72 1r8x n GLN 150 Cb 0.33 -4.60 0.29 0.00 1.02 0.00 0.00 30.24 27.28 1r8x n GLN 150 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1r8x h SER 151 N 0.00 0.68 -0.37 1.08 4.64 -1.96 -1.94 113.55 115.68 1r8x h SER 151 Ca -0.14 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.12 1r8x h SER 151 Cb 0.71 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 1r8x h SER 151 CO 0.20 0.57 0.19 -0.33 -0.87 0.00 0.00 176.83 176.59 1r8x h GLU 152 N 0.77 0.52 -0.69 4.77 5.08 -1.92 -1.75 114.58 121.37 1r8x h GLU 152 Ca 0.20 -0.07 0.10 0.00 -1.00 0.00 0.00 59.36 58.59 1r8x h GLU 152 Cb 0.05 -0.10 -0.08 0.00 0.50 0.00 0.00 28.75 29.13 1r8x h GLU 152 CO -0.03 0.44 0.30 0.45 -1.00 0.00 0.00 179.01 179.18 1r8x h HIS 153 N 0.46 0.53 -0.51 4.33 3.86 -1.80 0.16 115.15 122.18 1r8x h HIS 153 Ca 0.13 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.30 1r8x h HIS 153 Cb 0.09 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.40 1r8x h HIS 153 CO -0.02 0.15 0.02 0.00 0.86 0.00 0.00 177.93 178.94 1r8x h ARG 154 N 0.50 0.85 0.11 2.45 3.08 -1.09 -1.28 114.38 118.99 1r8x h ARG 154 Ca 0.35 -0.22 -0.27 0.00 0.07 0.00 0.00 59.98 59.91 1r8x h ARG 154 Cb 0.43 -0.10 0.01 0.00 0.08 0.00 0.00 29.97 30.39 1r8x h ARG 154 CO -0.31 0.83 -1.19 1.25 -1.07 0.00 0.00 179.97 179.49 1r8x h LEU 155 N 0.79 0.49 -0.52 3.04 5.85 -0.58 -1.33 115.31 123.06 1r8x h LEU 155 Ca 0.16 -0.48 -0.04 0.00 0.84 0.00 0.00 57.88 58.35 1r8x h LEU 155 Cb 0.44 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1r8x h LEU 155 CO 0.02 1.35 0.16 0.00 -0.34 0.00 0.00 178.44 179.63 1r8x h ALA 156 N 0.59 0.68 -0.08 1.25 0.00 -0.39 -1.31 119.26 120.00 1r8x h ALA 156 Ca -0.13 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 1r8x h ALA 156 Cb 1.89 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 19.48 1r8x h ALA 156 CO 0.20 0.34 -0.06 -0.07 0.00 0.00 0.00 179.25 179.66 1r8x h LEU 157 N 0.71 0.19 -1.09 0.00 3.38 -1.21 -1.74 115.31 115.56 1r8x h LEU 157 Ca 0.17 -0.46 0.28 0.00 0.09 0.00 0.00 57.88 57.96 1r8x h LEU 157 Cb 0.27 -0.05 -0.13 0.00 0.09 0.00 0.00 40.66 40.84 1r8x h LEU 157 CO -0.01 0.61 0.61 0.11 0.09 0.00 0.00 178.44 179.86 1r8x h LYS 158 N -0.22 0.43 0.20 1.13 1.57 -1.06 0.55 116.57 119.17 1r8x h LYS 158 Ca 0.01 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1r8x h LYS 158 Cb 0.55 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1r8x h LYS 158 CO 0.02 0.29 -0.10 -0.91 -0.57 0.00 0.00 179.45 178.18 1r8x h ASN 159 N 0.45 -0.23 -0.46 0.86 2.35 -1.03 -2.16 115.58 115.36 1r8x h ASN 159 Ca 0.67 -0.21 0.08 0.00 -0.55 0.00 0.00 56.30 56.29 1r8x h ASN 159 Cb 1.48 0.06 -0.10 0.00 0.05 0.00 0.00 38.32 39.82 1r8x h ASN 159 CO -0.48 0.31 -0.42 0.40 -1.65 0.00 0.00 177.43 175.58 1r8x h ILE 160 N -0.99 0.12 -0.28 2.81 2.04 -0.40 -2.46 117.51 118.36 1r8x h ILE 160 Ca -0.03 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.90 1r8x h ILE 160 Cb 0.43 0.12 -0.08 0.00 -0.74 0.00 0.00 36.82 36.54 1r8x h ILE 160 CO 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 178.15 177.88 1r8x h ALA 161 N 0.52 -0.25 0.00 1.87 0.00 0.03 0.44 119.26 121.88 1r8x h ALA 161 Ca 0.15 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1r8x h ALA 161 Cb 0.57 0.64 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1r8x h ALA 161 CO -0.61 -0.74 0.53 0.66 0.00 0.00 0.00 179.25 179.09 1r8x h SER 162 N -0.31 0.00 1.29 0.00 4.64 -0.90 0.88 113.55 119.16 1r8x h SER 162 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1r8x h SER 162 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1r8x h SER 162 CO -0.45 0.00 0.00 0.24 -0.87 0.00 0.00 176.83 175.75 1r8x h MET 163 N 0.00 0.00 -5.83 4.77 2.86 0.04 -3.45 114.93 113.32 1r8x h MET 163 Ca 0.00 0.00 -0.60 0.00 -2.06 0.00 0.00 59.70 57.04 1r8x h MET 163 Cb 1.06 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.62 1r8x h MET 163 CO 0.00 0.00 0.44 0.08 1.06 0.00 0.00 176.91 178.49 1r8x s VAL 164 N -3.39 4.75 0.37 -2.22 1.01 0.30 0.93 120.40 122.15 1r8x s VAL 164 Ca 0.05 1.19 -0.25 0.00 0.00 0.00 0.00 61.98 62.96 1r8x s VAL 164 Cb 0.08 -4.18 -0.12 0.00 0.00 0.00 0.00 36.38 32.16 1r8x s VAL 164 CO 0.55 -0.30 0.90 -1.14 0.00 0.00 0.00 175.10 175.11 1r8x n ARG 165 N 6.31 1.15 -1.55 2.72 0.63 0.28 -4.69 116.66 121.50 1r8x n ARG 165 Ca 0.04 0.41 -0.53 0.00 -0.92 0.00 0.00 57.85 56.85 1r8x n ARG 165 Cb 0.48 -1.83 -0.06 0.00 0.45 0.00 0.00 32.46 31.50 1r8x n ARG 165 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1r8x n PRO 166 N 0.47 0.76 -1.24 -0.14 -0.02 -1.26 -0.44 135.00 133.13 1r8x n PRO 166 Ca 0.10 0.27 -0.08 0.00 -2.02 0.00 0.00 63.50 61.77 1r8x n PRO 166 Cb 0.36 -1.82 -0.03 0.00 -0.02 0.00 0.00 33.50 31.99 1r8x n PRO 166 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r8x n GLY 167 N 2.10 0.94 3.24 -1.23 0.00 -1.26 -4.99 105.19 103.99 1r8x n GLY 167 Ca 0.18 -0.25 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 1r8x n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r8x n GLY 168 N -1.03 1.57 3.32 -0.02 0.00 0.41 -4.63 105.19 104.82 1r8x n GLY 168 Ca -0.08 -2.15 -0.28 0.00 0.00 0.00 0.00 46.02 43.51 1r8x n GLY 168 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r8x s LEU 169 N 0.00 2.24 -0.15 0.99 1.43 -0.06 -3.19 118.68 119.94 1r8x s LEU 169 Ca 0.52 -0.64 -0.00 0.00 -1.03 0.00 0.00 54.13 52.98 1r8x s LEU 169 Cb -0.04 -1.12 -0.01 0.00 0.03 0.00 0.00 46.19 45.06 1r8x s LEU 169 CO 0.33 0.18 -0.13 -0.22 0.23 0.00 0.00 176.35 176.74 1r8x s LEU 170 N -1.59 2.63 -0.32 1.79 2.96 0.70 -1.03 118.68 123.82 1r8x s LEU 170 Ca 0.10 -0.39 0.03 0.00 -0.22 0.00 0.00 54.13 53.65 1r8x s LEU 170 Cb -0.10 -1.60 0.09 0.00 0.50 0.00 0.00 46.19 45.08 1r8x s LEU 170 CO 0.04 0.11 0.04 -0.69 -1.32 0.00 0.00 176.35 174.52 1r8x s VAL 171 N 0.67 2.08 0.05 1.68 1.01 0.88 -0.11 120.40 126.67 1r8x s VAL 171 Ca -0.07 -2.13 0.05 0.00 0.00 0.00 0.00 61.98 59.83 1r8x s VAL 171 Cb -0.15 -2.50 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 1r8x s VAL 171 CO 0.02 -0.54 -0.14 -0.51 0.00 0.00 0.00 175.10 173.94 1r8x s ILE 172 N 1.02 1.07 0.08 2.22 2.07 -0.75 -1.11 121.20 125.79 1r8x s ILE 172 Ca 0.08 -1.14 0.01 0.00 -1.41 0.00 0.00 60.65 58.19 1r8x s ILE 172 Cb -0.19 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.36 1r8x s ILE 172 CO -0.10 -0.13 -0.06 1.51 -1.91 0.00 0.00 174.94 174.26 1r8x s ASP 173 N -1.44 0.93 0.03 4.50 3.84 -1.18 0.11 116.67 123.47 1r8x s ASP 173 Ca -0.01 -0.99 -0.11 0.00 -0.00 0.00 0.00 52.55 51.44 1r8x s ASP 173 Cb -0.09 0.12 0.01 0.00 -1.38 0.00 0.00 42.92 41.59 1r8x s ASP 173 CO 0.02 -0.50 0.24 -1.38 -0.00 0.00 0.00 175.17 173.55 1r8x s HIS 174 N -3.63 -0.03 0.56 2.11 -3.43 -0.07 -4.34 115.29 106.45 1r8x s HIS 174 Ca 0.10 -0.10 -0.21 0.00 -0.80 0.00 0.00 55.06 54.05 1r8x s HIS 174 Cb 0.06 0.03 -0.04 0.00 -1.43 0.00 0.00 32.58 31.19 1r8x s HIS 174 CO -0.06 -0.43 1.36 1.03 -2.00 0.00 0.00 174.74 174.63 1r8x s ARG 175 N -2.26 3.05 -0.70 -0.38 1.81 -1.26 0.11 118.95 119.32 1r8x s ARG 175 Ca -0.07 2.23 -0.26 0.00 -1.72 0.00 0.00 55.73 55.91 1r8x s ARG 175 Cb -0.02 -2.20 -0.07 0.00 -0.45 0.00 0.00 34.95 32.21 1r8x s ARG 175 CO -0.02 -1.26 2.17 1.21 -0.68 0.00 0.00 175.30 176.72 1r8x s ASN 176 N -1.00 4.65 0.29 0.23 3.84 0.73 -4.66 114.94 119.02 1r8x s ASN 176 Ca 0.73 0.22 0.19 0.00 0.21 0.00 0.00 52.86 54.21 1r8x s ASN 176 Cb -0.40 -2.53 0.12 0.00 -0.55 0.00 0.00 41.25 37.88 1r8x s ASN 176 CO 0.47 -3.00 1.34 1.88 -2.79 0.00 0.00 177.10 175.00 1r8x h TYR 177 N 14.73 0.00 -0.10 0.43 -1.99 -1.89 -2.87 116.97 125.28 1r8x h TYR 177 Ca -0.10 0.00 0.04 0.00 2.00 0.00 0.00 58.73 60.67 1r8x h TYR 177 Cb 1.11 0.00 -0.06 0.00 2.00 0.00 0.00 36.73 39.79 1r8x h TYR 177 CO 1.09 0.25 -0.26 -0.44 -0.00 0.00 0.00 178.16 178.80 1r8x h ASP 178 N 0.00 -0.79 -0.09 3.88 3.32 -1.84 0.54 116.42 121.45 1r8x h ASP 178 Ca -0.02 0.12 0.02 0.00 0.02 0.00 0.00 57.03 57.17 1r8x h ASP 178 Cb 1.21 0.34 -0.02 0.00 0.22 0.00 0.00 39.33 41.08 1r8x h ASP 178 CO 0.03 -0.31 -0.05 0.22 -1.72 0.00 0.00 179.24 177.40 1r8x h TYR 179 N -0.34 -0.13 -0.73 4.55 3.20 -1.96 -3.01 116.97 118.55 1r8x h TYR 179 Ca 0.09 0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.06 1r8x h TYR 179 Cb 0.48 0.07 -0.07 0.00 1.54 0.00 0.00 36.73 38.75 1r8x h TYR 179 CO -0.34 -0.09 0.39 0.82 -1.64 0.00 0.00 178.16 177.30 1r8x h ILE 180 N -0.06 0.90 0.00 1.81 2.04 -1.14 0.20 117.51 121.26 1r8x h ILE 180 Ca 0.06 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.68 1r8x h ILE 180 Cb 0.14 0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.38 1r8x h ILE 180 CO -0.13 0.12 0.00 0.18 0.00 0.00 0.00 178.15 178.33 1r8x n LEU 181 N -4.81 0.17 -0.10 1.44 4.77 0.18 0.63 117.00 119.28 1r8x n LEU 181 Ca 0.11 0.55 -0.16 0.00 -0.03 0.00 0.00 56.01 56.48 1r8x n LEU 181 Cb 0.24 -0.54 -0.06 0.00 -2.33 0.00 0.00 43.42 40.73 1r8x n LEU 181 CO 0.27 -0.41 -0.82 -0.24 -1.33 0.00 0.00 177.39 174.86 1r8x n SER 182 N -1.70 1.91 0.23 -1.43 2.88 0.41 -3.99 113.62 111.93 1r8x n SER 182 Ca 0.02 0.41 0.12 0.00 -1.33 0.00 0.00 58.87 58.09 1r8x n SER 182 Cb 0.14 -0.82 0.43 0.00 -0.75 0.00 0.00 64.21 63.21 1r8x n SER 182 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1r8x h THR 183 N -1.00 0.29 0.00 2.46 1.35 -0.76 -3.47 112.91 111.78 1r8x h THR 183 Ca -0.26 -1.00 0.00 0.00 -0.55 0.00 0.00 66.41 64.60 1r8x h THR 183 Cb 1.13 1.79 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 1r8x h THR 183 CO -0.16 0.13 0.00 0.61 -0.25 0.00 0.00 175.52 175.85 1r8x n GLY 184 N 0.41 0.48 3.26 5.82 0.00 0.20 -4.99 105.19 110.37 1r8x n GLY 184 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 1r8x n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r8x s ALA 186 N 0.30 3.44 0.43 0.00 0.00 -1.26 -4.50 121.76 120.17 1r8x s ALA 186 Ca -0.16 -2.61 -0.26 0.00 0.00 0.00 0.00 51.96 48.93 1r8x s ALA 186 Cb -0.17 -3.85 -0.09 0.00 0.00 0.00 0.00 23.12 19.01 1r8x s ALA 186 CO 0.08 -2.73 1.42 -2.30 0.00 0.00 0.00 175.76 172.23 1r8x n PRO 187 N 6.31 2.29 -3.18 0.00 -0.02 -1.26 -4.98 135.00 134.16 1r8x n PRO 187 Ca 0.12 0.81 -0.26 0.00 -2.02 0.00 0.00 63.50 62.15 1r8x n PRO 187 Cb 0.47 -2.61 -0.01 0.00 -0.02 0.00 0.00 33.50 31.33 1r8x n PRO 187 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1r8x s PRO 188 N -2.36 3.54 -0.93 0.52 0.04 -1.26 -4.41 135.00 130.15 1r8x s PRO 188 Ca 0.60 -0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.54 1r8x s PRO 188 Cb -0.46 -2.58 0.00 0.00 0.04 0.00 0.00 34.50 31.50 1r8x s PRO 188 CO 0.59 0.07 0.00 0.41 0.04 0.00 0.00 177.00 178.11 1r8x n GLY 189 N -1.68 0.67 0.58 0.56 0.00 -1.26 -4.91 105.19 99.16 1r8x n GLY 189 Ca -0.03 -0.56 0.06 0.00 0.00 0.00 0.00 46.02 45.50 1r8x n GLY 189 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1r8x n LYS 190 N -2.41 1.47 -1.63 1.61 4.76 -1.26 -4.81 118.16 115.89 1r8x n LYS 190 Ca -0.10 -1.55 -0.43 0.00 -2.87 0.00 0.00 58.31 53.36 1r8x n LYS 190 Cb 0.42 -1.26 -0.03 0.00 -1.84 0.00 0.00 35.03 32.31 1r8x n LYS 190 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1r8x n ASN 191 N 0.69 3.69 -0.07 4.39 2.85 -1.26 -4.84 115.26 120.71 1r8x n ASN 191 Ca 0.09 0.55 0.16 0.00 -0.11 0.00 0.00 54.58 55.27 1r8x n ASN 191 Cb 0.36 -1.54 0.86 0.00 1.24 0.00 0.00 39.78 40.71 1r8x n ASN 191 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 1r8x n ILE 192 N 6.66 0.00 -0.11 -1.44 -5.35 -1.26 -3.97 119.36 113.89 1r8x n ILE 192 Ca 0.25 -0.03 -0.22 0.00 -0.27 0.00 0.00 62.75 62.48 1r8x n ILE 192 Cb 0.42 -0.35 -0.08 0.00 -1.74 0.00 0.00 39.64 37.89 1r8x n ILE 192 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1r8x n TYR 193 N -0.87 0.00 -3.87 4.28 4.02 -1.26 -4.69 117.16 114.77 1r8x n TYR 193 Ca 0.22 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.83 1r8x n TYR 193 Cb 0.16 -0.80 -0.16 0.00 -0.02 0.00 0.00 39.34 38.52 1r8x n TYR 193 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1r8x s TYR 194 N -2.41 1.74 0.25 -0.72 1.51 -1.25 -0.03 117.35 116.44 1r8x s TYR 194 Ca -0.31 -1.21 -0.30 0.00 -1.01 0.00 0.00 57.07 54.25 1r8x s TYR 194 Cb 0.11 -1.32 -0.10 0.00 -0.11 0.00 0.00 41.96 40.54 1r8x s TYR 194 CO 0.41 -0.65 1.36 -1.59 -1.11 0.00 0.00 175.55 173.96 1r8x s LYS 195 N 1.62 4.34 0.31 -0.62 0.00 -0.75 -4.73 119.74 119.90 1r8x s LYS 195 Ca -0.01 2.19 -0.09 0.00 0.00 0.00 0.00 55.97 58.06 1r8x s LYS 195 Cb -0.17 -3.13 -0.07 0.00 0.00 0.00 0.00 37.83 34.47 1r8x s LYS 195 CO -0.07 -0.30 0.64 0.45 0.00 0.00 0.00 175.35 176.07 1r8x s SER 196 N 0.13 6.56 -0.03 0.03 0.15 -1.26 -4.56 113.70 114.71 1r8x s SER 196 Ca 0.56 0.96 0.06 0.00 0.70 0.00 0.00 55.95 58.22 1r8x s SER 196 Cb -0.39 -2.25 -0.08 0.00 -1.71 0.00 0.00 66.02 61.59 1r8x s SER 196 CO 0.44 -0.22 0.09 -0.67 1.20 0.00 0.00 173.24 174.07 1r8x n ASP 197 N -0.75 3.65 -4.72 5.45 -0.08 -1.26 -4.98 116.55 113.86 1r8x n ASP 197 Ca 0.01 0.00 -0.42 0.00 -1.51 0.00 0.00 54.79 52.87 1r8x n ASP 197 Cb 0.53 1.02 -0.03 0.00 2.34 0.00 0.00 41.12 44.98 1r8x n ASP 197 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 1r8x s LEU 198 N -3.81 4.39 -0.26 -2.67 2.96 -1.26 -4.99 118.68 113.03 1r8x s LEU 198 Ca -0.02 2.00 -0.27 0.00 -0.22 0.00 0.00 54.13 55.62 1r8x s LEU 198 Cb 0.03 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.14 1r8x s LEU 198 CO 0.24 -0.42 0.94 -0.89 -1.32 0.00 0.00 176.35 174.90 1r8x s THR 199 N 0.86 4.72 -0.04 3.68 2.01 -1.26 -5.01 115.64 120.60 1r8x s THR 199 Ca 0.57 1.69 -0.07 0.00 0.31 0.00 0.00 61.69 64.20 1r8x s THR 199 Cb -0.29 -4.24 0.01 0.00 0.01 0.00 0.00 72.50 67.99 1r8x s THR 199 CO 0.30 -0.21 0.16 -1.59 -0.69 0.00 0.00 174.62 172.59 1r8x s LYS 200 N 3.12 0.31 0.10 4.92 -2.85 -1.26 -3.67 119.74 120.42 1r8x s LYS 200 Ca 0.39 -0.02 0.07 0.00 -1.00 0.00 0.00 55.97 55.41 1r8x s LYS 200 Cb -0.14 0.14 -0.04 0.00 -2.06 0.00 0.00 37.83 35.73 1r8x s LYS 200 CO 0.09 -0.06 -0.09 0.34 0.10 0.00 0.00 175.35 175.73 1r8x s ASP 201 N -0.50 4.45 -0.11 0.03 -1.08 -0.11 -4.87 116.67 114.47 1r8x s ASP 201 Ca -0.06 -0.37 -0.05 0.00 -0.52 0.00 0.00 52.55 51.55 1r8x s ASP 201 Cb -0.04 -0.87 0.05 0.00 -1.46 0.00 0.00 42.92 40.61 1r8x s ASP 201 CO 0.01 0.18 0.24 -0.63 0.52 0.00 0.00 175.17 175.48 1r8x s ILE 202 N -1.23 -0.18 -0.14 4.11 1.01 -1.26 0.56 121.20 124.07 1r8x s ILE 202 Ca 0.22 0.21 -0.03 0.00 0.00 0.00 0.00 60.65 61.05 1r8x s ILE 202 Cb -0.11 -0.38 -0.03 0.00 0.01 0.00 0.00 42.46 41.95 1r8x s ILE 202 CO 0.14 0.09 -0.05 -0.89 0.00 0.00 0.00 174.94 174.23 1r8x s THR 203 N 1.71 3.82 -0.18 2.92 2.01 -0.70 -4.95 115.64 120.27 1r8x s THR 203 Ca -0.05 -0.39 -0.04 0.00 0.31 0.00 0.00 61.69 61.51 1r8x s THR 203 Cb -0.11 -2.65 -0.02 0.00 0.01 0.00 0.00 72.50 69.73 1r8x s THR 203 CO -0.08 0.52 -0.02 -0.89 -0.69 0.00 0.00 174.62 173.45 1r8x s THR 204 N 0.13 3.86 -0.11 -0.82 2.01 -1.26 -0.96 115.64 118.49 1r8x s THR 204 Ca -0.02 -0.35 0.01 0.00 0.31 0.00 0.00 61.69 61.64 1r8x s THR 204 Cb -0.14 -2.72 0.02 0.00 0.01 0.00 0.00 72.50 69.67 1r8x s THR 204 CO 0.03 0.46 -0.13 -0.44 -0.69 0.00 0.00 174.62 173.85 1r8x s SER 205 N 0.74 2.31 -0.18 3.53 0.01 -0.63 -4.94 113.70 114.54 1r8x s SER 205 Ca -0.01 -0.39 -0.00 0.00 1.31 0.00 0.00 55.95 56.86 1r8x s SER 205 Cb -0.14 -1.01 0.01 0.00 0.21 0.00 0.00 66.02 65.09 1r8x s SER 205 CO 0.02 -0.02 -0.15 -0.69 0.41 0.00 0.00 173.24 172.81 1r8x s VAL 206 N 1.16 2.54 -0.21 3.43 1.01 -1.26 -0.13 120.40 126.93 1r8x s VAL 206 Ca -0.04 -0.79 -0.10 0.00 0.00 0.00 0.00 61.98 61.06 1r8x s VAL 206 Cb -0.14 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.10 1r8x s VAL 206 CO -0.03 0.50 0.13 -0.22 0.00 0.00 0.00 175.10 175.48 1r8x s LEU 207 N 1.23 4.11 -0.20 3.92 2.96 0.17 -4.93 118.68 125.92 1r8x s LEU 207 Ca 0.03 0.17 -0.00 0.00 -0.22 0.00 0.00 54.13 54.10 1r8x s LEU 207 Cb -0.14 -2.07 0.02 0.00 0.50 0.00 0.00 46.19 44.50 1r8x s LEU 207 CO -0.07 0.14 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.07 1r8x s THR 208 N 0.57 2.48 -0.15 3.68 2.01 -1.26 0.23 115.64 123.20 1r8x s THR 208 Ca 0.07 -0.90 -0.04 0.00 0.31 0.00 0.00 61.69 61.13 1r8x s THR 208 Cb -0.12 -2.13 -0.03 0.00 0.01 0.00 0.00 72.50 70.23 1r8x s THR 208 CO 0.00 0.42 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.64 1r8x s VAL 209 N 1.32 4.03 -1.14 3.82 1.01 0.17 -4.44 120.40 125.17 1r8x s VAL 209 Ca 0.03 -0.31 -0.09 0.00 0.00 0.00 0.00 61.98 61.61 1r8x s VAL 209 Cb -0.14 -2.76 0.09 0.00 0.00 0.00 0.00 36.38 33.57 1r8x s VAL 209 CO -0.09 0.50 0.23 0.59 0.00 0.00 0.00 175.10 176.34 1r8x n ASN 210 N 3.38 -0.46 -0.09 3.32 3.02 -1.26 0.75 115.26 123.91 1r8x n ASN 210 Ca -0.17 -0.82 -0.01 0.00 -0.03 0.00 0.00 54.58 53.54 1r8x n ASN 210 Cb 0.53 -1.04 -0.01 0.00 -0.61 0.00 0.00 39.78 38.65 1r8x n ASN 210 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1r8x n ASN 211 N -1.51 -3.76 -4.47 6.41 5.15 -1.26 -5.01 115.26 110.82 1r8x n ASN 211 Ca -0.04 0.03 -0.33 0.00 -0.60 0.00 0.00 54.58 53.64 1r8x n ASN 211 Cb 0.36 -1.36 -0.13 0.00 -0.53 0.00 0.00 39.78 38.12 1r8x n ASN 211 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1r8x s LYS 212 N -0.94 3.01 0.13 1.20 2.47 0.23 -5.10 119.74 120.74 1r8x s LYS 212 Ca 0.00 -0.64 -0.31 0.00 -1.56 0.00 0.00 55.97 53.47 1r8x s LYS 212 Cb 0.00 -2.58 -0.08 0.00 -1.46 0.00 0.00 37.83 33.71 1r8x s LYS 212 CO 0.00 0.44 1.38 0.00 0.16 0.00 0.00 175.35 177.33 1r8x s ALA 213 N -0.24 3.58 0.00 3.13 0.00 -1.26 0.45 121.76 127.42 1r8x s ALA 213 Ca 0.02 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.09 1r8x s ALA 213 Cb -0.13 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.46 1r8x s ALA 213 CO 0.03 -0.60 0.00 1.58 0.00 0.00 0.00 175.76 176.77 1r8x n HIS 214 N 3.75 0.00 -3.77 0.00 -0.00 0.14 -4.82 115.22 110.51 1r8x n HIS 214 Ca 0.11 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 58.16 1r8x n HIS 214 Cb 0.42 0.00 -0.11 0.00 -0.12 0.00 0.00 29.99 30.19 1r8x n HIS 214 CO 0.00 0.00 0.00 1.41 0.46 0.00 0.00 176.34 178.21 1r8x s MET 215 N -1.81 0.42 -0.17 1.57 1.75 -0.74 -4.51 119.30 115.81 1r8x s MET 215 Ca 0.00 0.25 -0.05 0.00 -1.25 0.00 0.00 55.69 54.64 1r8x s MET 215 Cb 0.00 0.20 -0.03 0.00 2.84 0.00 0.00 34.83 37.84 1r8x s MET 215 CO 0.00 -0.07 0.01 0.08 -0.65 0.00 0.00 175.02 174.38 1r8x s VAL 216 N -0.22 4.21 -0.12 10.11 1.01 -0.22 0.44 120.40 135.61 1r8x s VAL 216 Ca -0.04 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.72 1r8x s VAL 216 Cb -0.03 -2.88 0.02 0.00 0.00 0.00 0.00 36.38 33.49 1r8x s VAL 216 CO 0.01 0.47 -0.15 -0.89 0.00 0.00 0.00 175.10 174.54 1r8x s THR 217 N 0.51 1.52 -0.22 3.92 2.01 0.82 0.10 115.64 124.30 1r8x s THR 217 Ca -0.01 -0.63 -0.06 0.00 0.31 0.00 0.00 61.69 61.30 1r8x s THR 217 Cb -0.14 -1.40 -0.02 0.00 0.01 0.00 0.00 72.50 70.95 1r8x s THR 217 CO 0.02 0.45 0.02 -0.76 -0.69 0.00 0.00 174.62 173.66 1r8x s LEU 218 N 1.17 3.26 -0.32 4.42 1.43 0.15 -1.60 118.68 127.20 1r8x s LEU 218 Ca -0.02 -0.24 -0.12 0.00 -1.03 0.00 0.00 54.13 52.72 1r8x s LEU 218 Cb -0.14 -1.85 -0.03 0.00 0.03 0.00 0.00 46.19 44.21 1r8x s LEU 218 CO -0.05 0.01 0.21 -1.81 0.23 0.00 0.00 176.35 174.95 1r8x s ASP 219 N 1.31 5.96 0.09 2.29 1.01 -0.14 -1.99 116.67 125.20 1r8x s ASP 219 Ca 0.04 -0.32 -0.23 0.00 0.71 0.00 0.00 52.55 52.75 1r8x s ASP 219 Cb -0.15 -2.11 -0.07 0.00 1.01 0.00 0.00 42.92 41.61 1r8x s ASP 219 CO 0.01 -0.17 0.69 -0.31 0.21 0.00 0.00 175.17 175.60 1r8x s TYR 220 N 1.72 3.81 -0.28 4.23 1.51 0.96 -1.72 117.35 127.58 1r8x s TYR 220 Ca 0.06 1.44 0.03 0.00 -1.01 0.00 0.00 57.07 57.59 1r8x s TYR 220 Cb -0.17 -2.68 0.07 0.00 -0.11 0.00 0.00 41.96 39.07 1r8x s TYR 220 CO 0.10 0.46 -0.06 0.99 -1.11 0.00 0.00 175.55 175.93 1r8x s THR 221 N -0.76 2.26 0.16 -0.71 2.01 0.19 -2.21 115.64 116.58 1r8x s THR 221 Ca 0.34 -1.81 0.06 0.00 0.31 0.00 0.00 61.69 60.59 1r8x s THR 221 Cb -0.21 -2.42 -0.04 0.00 0.01 0.00 0.00 72.50 69.84 1r8x s THR 221 CO 0.22 -0.19 0.06 -0.69 -0.69 0.00 0.00 174.62 173.33 1r8x s VAL 222 N 1.06 4.08 -0.15 3.82 1.01 -0.22 -0.94 120.40 129.06 1r8x s VAL 222 Ca -0.03 -1.23 -0.05 0.00 0.00 0.00 0.00 61.98 60.67 1r8x s VAL 222 Cb -0.20 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 1r8x s VAL 222 CO -0.06 -0.08 0.03 0.00 0.00 0.00 0.00 175.10 174.99 1r8x s GLN 223 N -2.93 3.61 0.00 2.72 0.00 -1.24 -1.61 119.66 120.21 1r8x s GLN 223 Ca 0.29 -0.38 0.00 0.00 -0.00 0.00 0.00 55.36 55.26 1r8x s GLN 223 Cb -0.10 -3.03 0.00 0.00 0.00 0.00 0.00 33.01 29.88 1r8x s GLN 223 CO 0.21 0.42 0.00 1.33 0.00 0.00 0.00 175.29 177.24 1r8x n VAL 224 N 3.05 0.00 -0.45 3.63 0.24 -1.26 -4.87 118.33 118.67 1r8x n VAL 224 Ca -0.18 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 61.99 1r8x n VAL 224 Cb 0.53 -0.19 -0.01 0.00 -1.47 0.00 0.00 33.84 32.69 1r8x n VAL 224 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 1r8x n PRO 225 N -0.06 1.22 0.00 7.34 -0.02 -1.26 -4.92 135.00 137.30 1r8x n PRO 225 Ca 0.00 -1.08 0.00 0.00 -2.02 0.00 0.00 63.50 60.40 1r8x n PRO 225 Cb 0.00 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.20 1r8x n PRO 225 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r8x n GLY 234 N 3.89 4.18 2.92 -1.23 0.00 -1.26 -5.22 105.19 108.46 1r8x n GLY 234 Ca 0.27 -1.11 -0.29 0.00 0.00 0.00 0.00 46.02 44.89 1r8x n GLY 234 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r8x s PHE 235 N -0.44 3.29 0.00 1.61 2.99 -1.26 -3.81 117.98 120.37 1r8x s PHE 235 Ca 0.00 -3.22 -0.01 0.00 0.00 0.00 0.00 56.93 53.70 1r8x s PHE 235 Cb 0.00 -2.74 -0.04 0.00 0.00 0.00 0.00 43.02 40.24 1r8x s PHE 235 CO 0.00 -0.67 0.15 -1.12 -0.00 0.00 0.00 175.22 173.59 1r8x s SER 236 N -0.73 6.13 0.26 1.36 0.01 -0.63 -4.93 113.70 115.16 1r8x s SER 236 Ca 0.20 0.26 0.09 0.00 1.31 0.00 0.00 55.95 57.82 1r8x s SER 236 Cb -0.17 -1.87 -0.04 0.00 0.21 0.00 0.00 66.02 64.15 1r8x s SER 236 CO -0.07 0.25 -0.01 -0.54 0.41 0.00 0.00 173.24 173.29 1r8x s LYS 237 N -1.97 2.29 0.19 12.44 -0.14 -1.26 -1.06 119.74 130.23 1r8x s LYS 237 Ca 0.27 -1.40 -0.22 0.00 -1.36 0.00 0.00 55.97 53.25 1r8x s LYS 237 Cb -0.12 -2.17 0.06 0.00 -1.68 0.00 0.00 37.83 33.91 1r8x s LYS 237 CO 0.19 0.37 0.62 -0.59 -0.76 0.00 0.00 175.35 175.17 1r8x s PHE 238 N -2.29 -0.44 -0.02 3.18 -0.12 -0.94 -4.20 117.98 113.15 1r8x s PHE 238 Ca 0.31 0.16 0.02 0.00 -0.05 0.00 0.00 56.93 57.38 1r8x s PHE 238 Cb -0.07 0.58 0.00 0.00 -0.63 0.00 0.00 43.02 42.90 1r8x s PHE 238 CO 0.20 -0.93 -0.08 0.50 -0.05 0.00 0.00 175.22 174.85 1r8x s ARG 239 N -3.79 0.84 0.08 1.99 3.52 -1.26 -0.02 118.95 120.30 1r8x s ARG 239 Ca 0.04 -0.28 0.06 0.00 -0.13 0.00 0.00 55.73 55.41 1r8x s ARG 239 Cb -0.02 -0.80 -0.03 0.00 -1.56 0.00 0.00 34.95 32.54 1r8x s ARG 239 CO -0.08 0.12 -0.15 -0.51 -0.81 0.00 0.00 175.30 173.87 1r8x s LEU 240 N 0.11 2.30 0.24 -0.88 1.43 -0.84 -4.98 118.68 116.06 1r8x s LEU 240 Ca -0.02 -0.66 0.11 0.00 -1.03 0.00 0.00 54.13 52.54 1r8x s LEU 240 Cb -0.07 -0.55 -0.05 0.00 0.03 0.00 0.00 46.19 45.55 1r8x s LEU 240 CO 0.00 -0.08 -0.21 -0.44 0.23 0.00 0.00 176.35 175.85 1r8x s SER 241 N -1.89 3.40 0.03 2.29 0.01 -1.26 0.30 113.70 116.57 1r8x s SER 241 Ca 0.01 -0.96 -0.01 0.00 1.31 0.00 0.00 55.95 56.30 1r8x s SER 241 Cb -0.09 -0.26 -0.03 0.00 0.21 0.00 0.00 66.02 65.85 1r8x s SER 241 CO 0.03 0.05 -0.02 -0.31 0.41 0.00 0.00 173.24 173.39 1r8x s TYR 242 N -2.22 0.36 -0.20 2.43 1.51 0.28 -4.71 117.35 114.80 1r8x s TYR 242 Ca 0.25 -0.74 -0.17 0.00 -1.01 0.00 0.00 57.07 55.40 1r8x s TYR 242 Cb -0.06 -0.27 -0.04 0.00 -0.11 0.00 0.00 41.96 41.49 1r8x s TYR 242 CO 0.12 -0.28 0.45 -0.47 -1.11 0.00 0.00 175.55 174.26 1r8x s TYR 243 N -2.54 3.37 -0.74 2.71 5.04 0.45 -1.06 117.35 124.58 1r8x s TYR 243 Ca -0.06 0.68 -0.27 0.00 -2.44 0.00 0.00 57.07 54.99 1r8x s TYR 243 Cb -0.02 -2.59 0.02 0.00 0.35 0.00 0.00 41.96 39.72 1r8x s TYR 243 CO -0.05 -0.06 1.38 -1.25 -1.34 0.00 0.00 175.55 174.23 1r8x s PRO 244 N 1.47 3.12 -0.62 4.97 0.04 -1.26 -4.82 135.00 137.91 1r8x s PRO 244 Ca 0.21 -0.17 -0.23 0.00 0.04 0.00 0.00 61.00 60.86 1r8x s PRO 244 Cb -0.15 -4.28 0.06 0.00 0.04 0.00 0.00 34.50 30.17 1r8x s PRO 244 CO 0.09 -2.25 0.93 -1.01 0.04 0.00 0.00 177.00 174.80 1r8x s HIS 245 N 6.22 2.73 0.59 0.56 3.76 -1.26 -4.98 115.29 122.91 1r8x s HIS 245 Ca 0.41 -0.43 -0.19 0.00 -0.15 0.00 0.00 55.06 54.69 1r8x s HIS 245 Cb -0.08 -4.19 -0.04 0.00 1.11 0.00 0.00 32.58 29.37 1r8x s HIS 245 CO 0.14 -1.54 1.10 0.00 -0.85 0.00 0.00 174.74 173.60 1r8x h LEU 247 N 0.74 0.88 0.40 0.00 5.85 -1.95 -2.09 115.31 119.14 1r8x h LEU 247 Ca -0.49 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.02 1r8x h LEU 247 Cb 1.35 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 42.12 1r8x h LEU 247 CO 0.53 0.85 -0.50 0.00 -0.34 0.00 0.00 178.44 178.98 1r8x h ALA 248 N 1.07 -1.07 -0.45 1.25 0.00 -1.99 -1.60 119.26 116.47 1r8x h ALA 248 Ca 0.20 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.03 1r8x h ALA 248 Cb 0.28 0.75 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 1r8x h ALA 248 CO -0.01 -1.15 -0.01 1.03 0.00 0.00 0.00 179.25 179.12 1r8x h SER 249 N -0.92 -0.21 -0.69 0.00 0.87 -1.86 -1.02 113.55 109.72 1r8x h SER 249 Ca -0.04 0.11 -0.04 0.00 -1.23 0.00 0.00 61.79 60.58 1r8x h SER 249 Cb 0.83 0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.96 1r8x h SER 249 CO -0.12 -0.07 0.26 0.15 -0.53 0.00 0.00 176.83 176.52 1r8x h PHE 250 N 0.10 1.06 -0.03 2.24 3.04 -1.41 -0.80 116.94 121.14 1r8x h PHE 250 Ca 0.22 -0.09 0.03 0.00 3.98 0.00 0.00 57.97 62.12 1r8x h PHE 250 Cb 0.33 -0.32 -0.06 0.00 2.56 0.00 0.00 35.95 38.47 1r8x h PHE 250 CO -0.30 0.83 -0.40 1.15 -2.02 0.00 0.00 178.31 177.58 1r8x h THR 251 N 0.99 0.18 0.05 4.41 2.02 -0.18 -0.39 112.91 119.99 1r8x h THR 251 Ca 0.23 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.42 1r8x h THR 251 Cb 0.24 0.18 -0.04 0.00 -1.74 0.00 0.00 68.15 66.80 1r8x h THR 251 CO -0.02 0.00 -0.37 -0.08 0.37 0.00 0.00 175.52 175.42 1r8x h GLU 252 N -0.53 -0.49 -0.72 6.66 4.22 -1.13 -2.18 114.58 120.40 1r8x h GLU 252 Ca 0.06 0.03 0.08 0.00 0.08 0.00 0.00 59.36 59.61 1r8x h GLU 252 Cb 0.63 0.11 -0.11 0.00 0.50 0.00 0.00 28.75 29.88 1r8x h GLU 252 CO -0.32 -0.32 -0.54 -0.07 -2.18 0.00 0.00 179.01 175.58 1r8x h LEU 253 N -0.51 -1.89 -1.99 1.64 3.38 -0.98 -1.56 115.31 113.40 1r8x h LEU 253 Ca 0.00 0.28 -0.02 0.00 0.09 0.00 0.00 57.88 58.23 1r8x h LEU 253 Cb 0.52 0.83 -0.00 0.00 0.09 0.00 0.00 40.66 42.10 1r8x h LEU 253 CO -0.22 -0.31 -0.09 1.62 0.09 0.00 0.00 178.44 179.52 1r8x h VAL 254 N -0.18 0.48 0.11 1.22 3.04 -0.97 -2.50 116.25 117.46 1r8x h VAL 254 Ca 0.15 -0.46 -0.01 0.00 -1.01 0.00 0.00 66.70 65.37 1r8x h VAL 254 Cb 0.52 1.31 0.00 0.00 -2.01 0.00 0.00 31.29 31.11 1r8x h VAL 254 CO -0.78 0.09 -0.05 0.03 -1.01 0.00 0.00 177.57 175.85 1r8x h ARG 255 N 0.00 -0.15 -1.49 4.17 3.08 -0.64 -3.15 114.38 116.20 1r8x h ARG 255 Ca -0.00 0.01 0.43 0.00 0.07 0.00 0.00 59.98 60.49 1r8x h ARG 255 Cb 0.30 0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.32 1r8x h ARG 255 CO 0.01 0.04 1.07 0.00 -1.07 0.00 0.00 179.97 180.02 1r8x h ALA 256 N -0.85 3.38 -0.85 0.04 0.00 -1.40 -0.92 119.26 118.65 1r8x h ALA 256 Ca -0.02 -0.04 0.12 0.00 0.00 0.00 0.00 54.91 54.97 1r8x h ALA 256 Cb 0.26 0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.08 1r8x h ALA 256 CO 0.03 -1.81 0.47 0.00 0.00 0.00 0.00 179.25 177.93 1r8x h ALA 257 N 1.27 1.25 -0.36 0.00 0.00 -1.40 -0.14 119.26 119.89 1r8x h ALA 257 Ca 0.72 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.57 1r8x h ALA 257 Cb 2.84 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 20.48 1r8x h ALA 257 CO -0.03 0.01 0.14 1.19 0.00 0.00 0.00 179.25 180.56 1r8x n PHE 258 N -4.80 1.18 0.00 0.00 3.01 -0.35 -4.66 117.46 111.84 1r8x n PHE 258 Ca 0.16 -0.70 0.00 0.00 1.01 0.00 0.00 57.45 57.91 1r8x n PHE 258 Cb 0.36 -0.42 0.00 0.00 -0.01 0.00 0.00 39.48 39.41 1r8x n PHE 258 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1r8x n GLY 259 N 0.03 1.89 0.00 1.37 0.00 -0.06 -2.49 105.19 105.93 1r8x n GLY 259 Ca 0.20 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1r8x n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r8x n GLY 260 N 0.00 1.00 3.57 -0.02 0.00 -1.26 -3.75 105.19 104.73 1r8x n GLY 260 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1r8x n GLY 260 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1r8x s ARG 261 N 0.00 3.77 -0.08 1.61 3.03 -1.04 -4.91 118.95 121.33 1r8x s ARG 261 Ca 0.00 -1.53 -0.18 0.00 2.03 0.00 0.00 55.73 56.05 1r8x s ARG 261 Cb 0.00 -5.43 0.04 0.00 -1.03 0.00 0.00 34.95 28.53 1r8x s ARG 261 CO 0.00 -2.22 0.43 0.00 -1.13 0.00 0.00 175.30 172.38 1r8x s GLN 263 N -0.75 4.14 -0.20 0.00 -1.52 -0.54 -4.96 119.66 115.82 1r8x s GLN 263 Ca -0.08 0.53 -0.04 0.00 -1.95 0.00 0.00 55.36 53.82 1r8x s GLN 263 Cb -0.04 -3.29 0.07 0.00 -0.22 0.00 0.00 33.01 29.53 1r8x s GLN 263 CO 0.04 0.51 0.08 -1.58 -0.25 0.00 0.00 175.29 174.08 1r8x s HIS 264 N -0.55 0.56 0.34 0.91 2.46 -1.26 -0.63 115.29 117.12 1r8x s HIS 264 Ca 0.26 -0.64 0.09 0.00 0.47 0.00 0.00 55.06 55.25 1r8x s HIS 264 Cb -0.17 -0.88 -0.06 0.00 -0.13 0.00 0.00 32.58 31.33 1r8x s HIS 264 CO 0.14 -0.60 -0.09 -1.54 -2.47 0.00 0.00 174.74 170.18 1r8x s SER 265 N 2.01 3.66 -0.05 9.88 1.04 -0.82 -5.03 113.70 124.40 1r8x s SER 265 Ca 0.02 -1.20 -0.01 0.00 0.48 0.00 0.00 55.95 55.24 1r8x s SER 265 Cb -0.16 -0.34 0.03 0.00 0.10 0.00 0.00 66.02 65.65 1r8x s SER 265 CO -0.13 -0.22 0.02 0.54 0.98 0.00 0.00 173.24 174.43 1r8x s VAL 266 N -2.64 0.18 0.13 5.02 0.11 -1.26 -1.54 120.40 120.40 1r8x s VAL 266 Ca 0.32 0.19 -0.08 0.00 -2.93 0.00 0.00 61.98 59.47 1r8x s VAL 266 Cb 0.03 -0.34 -0.06 0.00 -1.53 0.00 0.00 36.38 34.48 1r8x s VAL 266 CO 0.16 0.20 0.43 -0.76 -3.33 0.00 0.00 175.10 171.79 1r8x s LEU 267 N 1.66 4.29 0.00 2.54 1.43 0.15 -2.90 118.68 125.85 1r8x s LEU 267 Ca -0.01 0.77 0.00 0.00 -1.03 0.00 0.00 54.13 53.86 1r8x s LEU 267 Cb -0.13 -3.21 0.00 0.00 0.03 0.00 0.00 46.19 42.88 1r8x s LEU 267 CO -0.03 0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.25 1r8x n GLY 268 N 0.48 -3.10 3.22 -3.19 0.00 0.63 -2.05 105.19 101.17 1r8x n GLY 268 Ca -0.05 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 1r8x n GLY 268 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1r8x s ASP 269 N -2.05 6.14 0.00 1.61 -0.00 -1.26 -4.26 116.67 116.85 1r8x s ASP 269 Ca 0.00 -2.92 0.00 0.00 -0.00 0.00 0.00 52.55 49.63 1r8x s ASP 269 Cb 0.00 -2.05 0.00 0.00 -0.00 0.00 0.00 42.92 40.87 1r8x s ASP 269 CO 0.00 -0.44 0.00 0.49 -0.00 0.00 0.00 175.17 175.22 1r8x n PHE 270 N 3.53 0.00 -2.89 4.23 0.99 -1.26 -4.96 117.46 117.10 1r8x n PHE 270 Ca 0.13 0.00 -0.25 0.00 -0.00 0.00 0.00 57.45 57.33 1r8x n PHE 270 Cb 0.42 -0.01 0.00 0.00 -1.00 0.00 0.00 39.48 38.89 1r8x n PHE 270 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 1r8x s LYS 271 N 0.00 3.35 1.14 -1.08 1.02 -1.26 -5.02 119.74 117.89 1r8x s LYS 271 Ca 0.00 -0.11 -0.13 0.00 0.02 0.00 0.00 55.97 55.74 1r8x s LYS 271 Cb 0.00 -2.48 0.27 0.00 -0.52 0.00 0.00 37.83 35.10 1r8x s LYS 271 CO 0.00 -0.18 1.04 -2.14 -0.92 0.00 0.00 175.35 173.15 1r8x s PRO 272 N -4.62 -0.74 -0.22 -1.68 0.02 -1.26 0.23 135.00 126.73 1r8x s PRO 272 Ca 0.46 0.63 -0.00 0.00 0.02 0.00 0.00 61.00 62.11 1r8x s PRO 272 Cb -0.10 -1.59 0.06 0.00 0.02 0.00 0.00 34.50 32.89 1r8x s PRO 272 CO 0.41 -3.55 -0.03 -0.47 -0.33 0.00 0.00 177.00 173.03 1r8x s TYR 273 N -2.62 2.00 -0.35 6.54 5.04 -1.14 -3.49 117.35 123.32 1r8x s TYR 273 Ca 0.68 -1.49 -0.12 0.00 -2.44 0.00 0.00 57.07 53.69 1r8x s TYR 273 Cb -0.22 -1.42 0.00 0.00 0.35 0.00 0.00 41.96 40.67 1r8x s TYR 273 CO 0.62 -0.73 0.22 -1.59 -1.34 0.00 0.00 175.55 172.73 1r8x s LYS 274 N 1.53 3.21 0.09 4.97 -2.85 -1.26 -4.94 119.74 120.49 1r8x s LYS 274 Ca -0.04 -0.83 -0.31 0.00 -1.00 0.00 0.00 55.97 53.79 1r8x s LYS 274 Cb -0.18 -3.74 -0.10 0.00 -2.06 0.00 0.00 37.83 31.74 1r8x s LYS 274 CO -0.07 -0.54 1.89 -0.35 0.10 0.00 0.00 175.35 176.38 1r8x n PRO 275 N 5.05 2.83 -0.12 1.78 -0.04 -1.26 -1.37 135.00 141.87 1r8x n PRO 275 Ca -0.13 1.03 0.00 0.00 -0.04 0.00 0.00 63.50 64.37 1r8x n PRO 275 Cb 0.48 -2.95 0.00 0.00 -0.04 0.00 0.00 33.50 30.99 1r8x n PRO 275 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1r8x n GLY 276 N 4.35 0.91 3.78 0.55 0.00 -1.26 -5.10 105.19 108.43 1r8x n GLY 276 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 1r8x n GLY 276 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1r8x s GLN 277 N -0.88 3.23 0.16 1.61 -2.07 -0.47 -4.98 119.66 116.26 1r8x s GLN 277 Ca 0.00 1.45 -0.15 0.00 -1.82 0.00 0.00 55.36 54.83 1r8x s GLN 277 Cb 0.00 -2.00 0.07 0.00 -1.09 0.00 0.00 33.01 29.98 1r8x s GLN 277 CO 0.00 -0.92 1.79 0.00 -1.32 0.00 0.00 175.29 174.84 1r8x h ALA 278 N 0.76 0.53 -2.50 2.60 0.00 -1.99 -3.43 119.26 115.24 1r8x h ALA 278 Ca -0.48 0.01 -0.53 0.00 0.00 0.00 0.00 54.91 53.90 1r8x h ALA 278 Cb 1.25 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.97 1r8x h ALA 278 CO 0.56 -0.12 0.78 -0.47 0.00 0.00 0.00 179.25 180.00 1r8x s TYR 279 N -6.15 3.07 -0.40 0.00 5.04 -1.26 -5.01 117.35 112.65 1r8x s TYR 279 Ca -0.13 0.86 -0.15 0.00 -2.44 0.00 0.00 57.07 55.20 1r8x s TYR 279 Cb 0.12 -3.71 0.01 0.00 0.35 0.00 0.00 41.96 38.73 1r8x s TYR 279 CO 0.72 -2.56 0.32 0.08 -1.34 0.00 0.00 175.55 172.78 1r8x s VAL 280 N 1.55 5.22 0.45 3.14 1.01 -1.26 -5.04 120.40 125.48 1r8x s VAL 280 Ca 0.65 -0.47 -0.23 0.00 0.00 0.00 0.00 61.98 61.93 1r8x s VAL 280 Cb -0.36 -3.91 -0.08 0.00 0.00 0.00 0.00 36.38 32.03 1r8x s VAL 280 CO 0.30 -0.27 1.14 -2.16 0.00 0.00 0.00 175.10 174.11 1r8x s PRO 281 N 1.81 3.82 0.04 2.72 0.04 -1.26 -4.97 135.00 137.20 1r8x s PRO 281 Ca 0.07 1.72 -0.08 0.00 0.04 0.00 0.00 61.00 62.75 1r8x s PRO 281 Cb -0.18 -2.42 -0.30 0.00 0.04 0.00 0.00 34.50 31.64 1r8x s PRO 281 CO 0.11 -0.48 1.01 0.00 0.04 0.00 0.00 177.00 177.68 1r8x s TYR 283 N -2.63 1.88 -0.18 0.00 1.51 -1.26 -0.19 117.35 116.48 1r8x s TYR 283 Ca -0.07 -0.44 -0.02 0.00 -1.01 0.00 0.00 57.07 55.52 1r8x s TYR 283 Cb 0.06 -0.95 -0.01 0.00 -0.11 0.00 0.00 41.96 40.94 1r8x s TYR 283 CO 0.89 0.33 -0.08 -0.06 -1.11 0.00 0.00 175.55 175.52 1r8x s PHE 284 N -1.83 2.91 -0.16 2.71 0.08 0.12 -4.27 117.98 117.53 1r8x s PHE 284 Ca 0.15 -0.78 -0.06 0.00 0.12 0.00 0.00 56.93 56.36 1r8x s PHE 284 Cb -0.07 -1.98 -0.04 0.00 -0.57 0.00 0.00 43.02 40.36 1r8x s PHE 284 CO 0.07 -0.37 0.06 0.42 -0.10 0.00 0.00 175.22 175.29 1r8x s ILE 285 N 0.91 4.75 -0.31 0.64 1.01 -0.87 -0.89 121.20 126.43 1r8x s ILE 285 Ca -0.02 -0.06 -0.07 0.00 0.00 0.00 0.00 60.65 60.51 1r8x s ILE 285 Cb -0.15 -3.11 0.02 0.00 0.01 0.00 0.00 42.46 39.23 1r8x s ILE 285 CO 0.00 0.50 0.09 -1.00 0.00 0.00 0.00 174.94 174.53 1r8x s HIS 286 N 0.07 3.19 -0.32 3.97 3.76 0.30 0.31 115.29 126.57 1r8x s HIS 286 Ca 0.05 -1.16 -0.12 0.00 -0.15 0.00 0.00 55.06 53.68 1r8x s HIS 286 Cb -0.12 -2.26 -0.03 0.00 1.11 0.00 0.00 32.58 31.28 1r8x s HIS 286 CO 0.01 -0.64 0.22 0.08 -0.85 0.00 0.00 174.74 173.55 1r8x s VAL 287 N 1.46 5.25 -0.07 -0.90 1.01 -0.59 -1.81 120.40 124.74 1r8x s VAL 287 Ca 0.01 -0.09 0.04 0.00 0.00 0.00 0.00 61.98 61.94 1r8x s VAL 287 Cb -0.18 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.56 1r8x s VAL 287 CO 0.02 0.09 -0.20 -0.76 0.00 0.00 0.00 175.10 174.25 1r8x s LEU 288 N 1.73 2.37 0.40 3.92 1.02 0.84 -1.95 118.68 127.01 1r8x s LEU 288 Ca 0.06 -0.40 0.07 0.00 0.02 0.00 0.00 54.13 53.89 1r8x s LEU 288 Cb -0.17 -1.47 -0.06 0.00 0.02 0.00 0.00 46.19 44.51 1r8x s LEU 288 CO 0.10 0.25 0.09 -0.75 0.02 0.00 0.00 176.35 176.06 1r8x s LYS 289 N -0.15 2.09 0.00 1.70 2.20 0.19 -0.22 119.74 125.55 1r8x s LYS 289 Ca -0.03 -1.95 0.00 0.00 -0.36 0.00 0.00 55.97 53.64 1r8x s LYS 289 Cb -0.14 -1.83 0.00 0.00 -1.51 0.00 0.00 37.83 34.35 1r8x s LYS 289 CO 0.04 -0.06 0.00 1.63 -0.36 0.00 0.00 175.35 176.60 1r8x n LYS 290 N -1.09 3.32 0.00 4.03 5.02 -1.19 -1.47 118.16 126.77 1r8x n LYS 290 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 1r8x n LYS 290 Cb 0.65 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.66 1r8x n LYS 290 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1r8x n THR 291 N 0.00 0.00 -0.43 -0.18 5.66 -1.21 -4.21 114.28 113.92 1r8x n THR 291 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1r8x n THR 291 Cb 0.00 -0.65 0.00 0.00 -1.55 0.00 0.00 70.33 68.13 1r8x n THR 291 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49