#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r7h s VAL 19 N 0.00 5.13 -0.09 0.00 1.01 -1.26 -4.56 120.40 120.63 2r7h s VAL 19 Ca 0.00 0.95 0.00 0.00 0.00 0.00 0.00 61.98 62.94 2r7h s VAL 19 Cb 0.00 -3.81 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 2r7h s VAL 19 CO 0.00 0.38 -0.08 0.00 0.00 0.00 0.00 175.10 175.40 2r7h s ALA 20 N 0.23 2.89 -0.21 5.51 0.00 0.29 -4.92 121.76 125.54 2r7h s ALA 20 Ca 0.26 -0.89 -0.10 0.00 0.00 0.00 0.00 51.96 51.23 2r7h s ALA 20 Cb -0.16 -1.24 -0.05 0.00 0.00 0.00 0.00 23.12 21.67 2r7h s ALA 20 CO 0.11 0.47 0.14 -0.06 0.00 0.00 0.00 175.76 176.42 2r7h s PHE 21 N -0.44 3.37 -0.03 0.00 0.08 -1.26 -0.32 117.98 119.38 2r7h s PHE 21 Ca 0.06 0.29 0.04 0.00 0.12 0.00 0.00 56.93 57.44 2r7h s PHE 21 Cb -0.12 -2.20 -0.00 0.00 -0.57 0.00 0.00 43.02 40.13 2r7h s PHE 21 CO 0.02 0.21 -0.14 0.50 -0.10 0.00 0.00 175.22 175.71 2r7h s ARG 22 N 0.61 1.42 -0.07 0.44 3.52 -0.18 -4.95 118.95 119.74 2r7h s ARG 22 Ca 0.08 -0.50 0.19 0.00 -0.13 0.00 0.00 55.73 55.36 2r7h s ARG 22 Cb -0.12 -1.28 -0.28 0.00 -1.56 0.00 0.00 34.95 31.71 2r7h s ARG 22 CO 0.00 0.22 0.33 0.54 -0.81 0.00 0.00 175.30 175.59 2r7h n ARG 23 N 3.10 0.71 -2.34 5.12 3.00 -1.26 -0.57 116.66 124.42 2r7h n ARG 23 Ca -0.17 -0.13 -0.42 0.00 -0.01 0.00 0.00 57.85 57.11 2r7h n ARG 23 Cb 0.54 -1.46 -0.03 0.00 0.00 0.00 0.00 32.46 31.50 2r7h n ARG 23 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 2r7h s GLN 24 N -3.12 4.42 -0.17 5.56 0.74 -1.26 -4.66 119.66 121.18 2r7h s GLN 24 Ca -0.08 1.88 -0.19 0.00 0.05 0.00 0.00 55.36 57.03 2r7h s GLN 24 Cb 0.11 -3.29 -0.03 0.00 1.10 0.00 0.00 33.01 30.89 2r7h s GLN 24 CO 0.79 -0.25 0.52 0.08 -0.55 0.00 0.00 175.29 175.89 2r7h s VAL 25 N 0.70 5.12 0.30 1.34 1.01 -1.26 -5.02 120.40 122.59 2r7h s VAL 25 Ca 0.58 0.99 0.08 0.00 0.00 0.00 0.00 61.98 63.64 2r7h s VAL 25 Cb -0.32 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 2r7h s VAL 25 CO 0.32 0.22 0.13 -0.76 0.00 0.00 0.00 175.10 175.01 2r7h s LEU 26 N 1.29 3.39 0.48 3.92 1.43 -1.26 -4.98 118.68 122.95 2r7h s LEU 26 Ca 0.26 -0.60 0.15 0.00 -1.03 0.00 0.00 54.13 52.91 2r7h s LEU 26 Cb -0.15 -1.91 1.15 0.00 0.03 0.00 0.00 46.19 45.30 2r7h s LEU 26 CO 0.10 -0.17 2.07 -0.65 0.23 0.00 0.00 176.35 177.93 2r7h h PRO 27 N 1.59 0.21 0.00 1.29 0.11 -1.99 -2.47 132.00 130.75 2r7h h PRO 27 Ca -0.45 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 2r7h h PRO 27 Cb 1.25 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 2r7h h PRO 27 CO 0.61 0.14 -0.11 1.96 -0.21 0.00 0.00 178.00 180.39 2r7h h GLN 28 N 0.22 0.00 -0.82 1.05 7.50 -2.03 -3.34 115.11 117.69 2r7h h GLN 28 Ca 0.14 0.00 -0.04 0.00 0.50 0.00 0.00 58.65 59.25 2r7h h GLN 28 Cb 0.28 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 27.77 2r7h h GLN 28 CO -0.02 0.11 0.34 -0.44 -1.50 0.00 0.00 178.83 177.32 2r7h h ASP 29 N 0.00 1.11 -0.50 1.46 3.32 -1.85 -2.88 116.42 117.08 2r7h h ASP 29 Ca -0.00 -0.16 0.09 0.00 0.02 0.00 0.00 57.03 56.97 2r7h h ASP 29 Cb 0.37 -0.29 -0.07 0.00 0.22 0.00 0.00 39.33 39.56 2r7h h ASP 29 CO 0.01 0.97 0.06 0.00 -1.72 0.00 0.00 179.24 178.57 2r7h h ALA 30 N 1.19 0.53 0.04 3.45 0.00 -1.77 0.37 119.26 123.07 2r7h h ALA 30 Ca 0.27 0.12 -0.24 0.00 0.00 0.00 0.00 54.91 55.06 2r7h h ALA 30 Cb 0.19 0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.17 2r7h h ALA 30 CO -0.03 -0.34 -1.04 1.25 0.00 0.00 0.00 179.25 179.10 2r7h h LEU 31 N 0.19 0.53 -0.70 0.00 5.85 -1.82 -2.42 115.31 116.94 2r7h h LEU 31 Ca 0.25 -0.46 -0.04 0.00 0.84 0.00 0.00 57.88 58.47 2r7h h LEU 31 Cb 0.36 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 2r7h h LEU 31 CO -0.36 1.28 0.28 -0.07 -0.34 0.00 0.00 178.44 179.23 2r7h h LEU 32 N 0.19 0.96 -0.35 2.25 3.38 -1.23 -0.91 115.31 119.61 2r7h h LEU 32 Ca -0.10 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 2r7h h LEU 32 Cb 1.70 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 42.18 2r7h h LEU 32 CO 0.18 0.87 0.14 0.58 0.09 0.00 0.00 178.44 180.30 2r7h h VAL 33 N 1.00 1.19 -0.22 1.22 2.07 -0.31 -1.33 116.25 119.86 2r7h h VAL 33 Ca 0.23 -0.58 0.03 0.00 0.82 0.00 0.00 66.70 67.21 2r7h h VAL 33 Cb 0.21 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 2r7h h VAL 33 CO -0.02 0.20 0.02 -0.09 0.02 0.00 0.00 177.57 177.70 2r7h h ARG 34 N 0.41 0.09 -0.49 1.57 2.43 -1.05 0.13 114.38 117.47 2r7h h ARG 34 Ca 0.12 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 2r7h h ARG 34 Cb 0.19 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.69 2r7h h ARG 34 CO -0.01 0.06 0.24 0.00 -1.51 0.00 0.00 179.97 178.75 2r7h h ARG 35 N 0.09 0.69 0.18 0.20 3.08 -1.04 0.10 114.38 117.68 2r7h h ARG 35 Ca 0.10 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 2r7h h ARG 35 Cb 0.12 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.04 2r7h h ARG 35 CO -0.16 0.54 -0.09 0.28 -1.07 0.00 0.00 179.97 179.47 2r7h h VAL 36 N 0.69 0.91 -0.77 2.04 2.07 -0.41 -1.49 116.25 119.29 2r7h h VAL 36 Ca 0.17 -0.41 0.06 0.00 0.82 0.00 0.00 66.70 67.35 2r7h h VAL 36 Cb 0.08 1.15 -0.06 0.00 -1.52 0.00 0.00 31.29 30.94 2r7h h VAL 36 CO -0.02 0.09 0.46 0.58 0.02 0.00 0.00 177.57 178.70 2r7h h VAL 37 N -0.44 1.01 0.00 2.57 2.07 -0.30 -2.32 116.25 118.84 2r7h h VAL 37 Ca -0.02 -0.29 -0.08 0.00 0.82 0.00 0.00 66.70 67.12 2r7h h VAL 37 Cb 0.34 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 2r7h h VAL 37 CO 0.04 0.15 -0.39 -0.33 0.02 0.00 0.00 177.57 177.06 2r7h h GLU 38 N 0.84 0.00 0.00 1.57 5.08 -0.69 -2.99 114.58 118.39 2r7h h GLU 38 Ca 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 2r7h h GLU 38 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2r7h h GLU 38 CO -0.18 0.39 0.00 0.66 -1.00 0.00 0.00 179.01 178.89 2r7h h SER 39 N 0.00 0.00 1.04 1.42 4.64 -0.69 -3.31 113.55 116.65 2r7h h SER 39 Ca -0.00 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.15 2r7h h SER 39 Cb 0.70 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.76 2r7h h SER 39 CO 0.05 0.00 -1.02 0.71 -0.87 0.00 0.00 176.83 175.70 2r7h h THR 40 N 0.00 0.90 0.00 2.95 1.35 -1.48 -3.41 112.91 113.22 2r7h h THR 40 Ca 0.00 -2.42 0.00 0.00 -0.55 0.00 0.00 66.41 63.44 2r7h h THR 40 Cb 0.52 2.38 0.00 0.00 -1.73 0.00 0.00 68.15 69.32 2r7h h THR 40 CO 0.00 0.52 0.00 0.61 -0.25 0.00 0.00 175.52 176.40 2r7h n GLY 41 N 1.34 0.72 0.97 5.82 0.00 -1.25 -4.89 105.19 107.90 2r7h n GLY 41 Ca -0.04 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.08 2r7h n GLY 41 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2r7h n PHE 42 N -2.55 0.36 -3.98 1.61 3.01 -1.26 -4.89 117.46 109.76 2r7h n PHE 42 Ca 0.00 -0.21 -0.29 0.00 1.01 0.00 0.00 57.45 57.96 2r7h n PHE 42 Cb 0.00 -0.00 -0.16 0.00 -0.01 0.00 0.00 39.48 39.30 2r7h n PHE 42 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 2r7h s PHE 43 N -1.41 2.04 0.84 1.38 0.40 -1.26 -5.03 117.98 114.94 2r7h s PHE 43 Ca 0.32 -1.20 -0.11 0.00 -0.60 0.00 0.00 56.93 55.33 2r7h s PHE 43 Cb 0.19 -1.50 0.10 0.00 0.51 0.00 0.00 43.02 42.31 2r7h s PHE 43 CO 0.27 -0.65 1.09 0.95 0.70 0.00 0.00 175.22 177.58 2r7h s THR 44 N 1.53 2.94 0.37 0.64 -4.23 -1.26 -4.63 115.64 111.00 2r7h s THR 44 Ca 0.03 0.31 0.13 0.00 -1.18 0.00 0.00 61.69 60.98 2r7h s THR 44 Cb -0.14 -2.87 0.35 0.00 1.34 0.00 0.00 72.50 71.18 2r7h s THR 44 CO -0.09 -0.40 1.82 -0.65 -0.54 0.00 0.00 174.62 174.76 2r7h h PRO 45 N -1.32 0.53 -0.77 3.99 0.11 -1.99 0.13 132.00 132.68 2r7h h PRO 45 Ca -0.48 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 2r7h h PRO 45 Cb 1.27 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 2r7h h PRO 45 CO 0.55 0.35 0.29 1.49 -0.21 0.00 0.00 178.00 180.47 2r7h h GLU 46 N 0.55 1.17 -0.23 1.05 4.81 -1.99 0.27 114.58 120.20 2r7h h GLU 46 Ca 0.52 -0.22 -0.19 0.00 -0.13 0.00 0.00 59.36 59.33 2r7h h GLU 46 Cb 1.09 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.29 2r7h h GLU 46 CO -0.26 0.96 -0.61 0.93 -0.73 0.00 0.00 179.01 179.30 2r7h h GLU 47 N 1.13 0.79 -0.19 1.92 5.08 -1.46 -2.36 114.58 119.48 2r7h h GLU 47 Ca 0.25 -0.54 -0.06 0.00 -1.00 0.00 0.00 59.36 58.02 2r7h h GLU 47 Cb 0.25 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2r7h h GLU 47 CO -0.02 1.16 -0.13 0.00 -1.00 0.00 0.00 179.01 179.03 2r7h h ALA 48 N 0.71 1.43 -0.56 3.43 0.00 -0.46 -1.24 119.26 122.58 2r7h h ALA 48 Ca -0.00 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 2r7h h ALA 48 Cb 1.22 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 2r7h h ALA 48 CO 0.13 0.40 0.17 -0.44 0.00 0.00 0.00 179.25 179.51 2r7h h ASP 49 N 0.30 0.81 0.22 0.00 3.32 -0.74 -1.49 116.42 118.84 2r7h h ASP 49 Ca 0.06 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 2r7h h ASP 49 Cb 0.41 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2r7h h ASP 49 CO 0.02 0.81 -0.10 0.58 -1.72 0.00 0.00 179.24 178.83 2r7h h VAL 50 N 0.78 0.81 -0.75 -1.35 2.07 -1.03 0.05 116.25 116.84 2r7h h VAL 50 Ca 0.18 -0.15 0.17 0.00 0.82 0.00 0.00 66.70 67.72 2r7h h VAL 50 Cb 0.29 0.90 -0.12 0.00 -1.52 0.00 0.00 31.29 30.84 2r7h h VAL 50 CO -0.00 0.03 0.13 0.00 0.02 0.00 0.00 177.57 177.75 2r7h h ALA 51 N 0.41 0.93 -0.15 1.67 0.00 -1.02 -0.51 119.26 120.58 2r7h h ALA 51 Ca -0.03 0.19 -0.20 0.00 0.00 0.00 0.00 54.91 54.87 2r7h h ALA 51 Cb 0.28 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2r7h h ALA 51 CO 0.05 -0.38 -0.72 0.37 0.00 0.00 0.00 179.25 178.57 2r7h h GLN 52 N 0.21 0.67 -0.94 0.00 4.15 -1.15 -3.27 115.11 114.77 2r7h h GLN 52 Ca 0.43 -0.52 0.00 0.00 0.77 0.00 0.00 58.65 59.33 2r7h h GLN 52 Cb 0.75 0.10 -0.05 0.00 0.21 0.00 0.00 27.48 28.50 2r7h h GLN 52 CO -0.57 1.14 0.60 0.93 -1.93 0.00 0.00 178.83 179.01 2r7h h GLU 53 N 0.47 1.26 -0.73 1.69 5.08 0.61 -2.03 114.58 120.92 2r7h h GLU 53 Ca -0.03 -0.09 0.03 0.00 -1.00 0.00 0.00 59.36 58.26 2r7h h GLU 53 Cb 1.32 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 30.26 2r7h h GLU 53 CO 0.14 0.85 0.48 -0.07 -1.00 0.00 0.00 179.01 179.41 2r7h h LEU 54 N 1.29 0.78 -0.29 1.33 3.38 -1.40 0.13 115.31 120.52 2r7h h LEU 54 Ca 0.34 -0.01 -0.19 0.00 0.09 0.00 0.00 57.88 58.11 2r7h h LEU 54 Cb -0.11 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.46 2r7h h LEU 54 CO -0.07 0.54 -0.61 0.58 0.09 0.00 0.00 178.44 178.97 2r7h h VAL 55 N 0.90 1.28 -0.41 1.22 2.07 -1.50 -2.78 116.25 117.03 2r7h h VAL 55 Ca 0.29 -1.81 -0.07 0.00 0.82 0.00 0.00 66.70 65.93 2r7h h VAL 55 Cb 0.02 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 2r7h h VAL 55 CO -0.08 0.58 -0.02 0.44 0.02 0.00 0.00 177.57 178.51 2r7h h ASP 56 N 0.60 0.74 -0.31 0.57 3.32 -0.73 -2.01 116.42 118.60 2r7h h ASP 56 Ca -0.00 -0.32 -0.02 0.00 0.02 0.00 0.00 57.03 56.70 2r7h h ASP 56 Cb 1.22 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.55 2r7h h ASP 56 CO 0.13 0.88 0.14 -0.33 -1.72 0.00 0.00 179.24 178.34 2r7h h GLU 57 N 0.57 0.51 -0.25 3.56 3.07 -0.78 -1.23 114.58 120.03 2r7h h GLU 57 Ca 0.11 -0.06 -0.12 0.00 -0.50 0.00 0.00 59.36 58.79 2r7h h GLU 57 Cb 0.52 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.32 2r7h h GLU 57 CO 0.03 0.43 -0.34 1.25 -1.40 0.00 0.00 179.01 178.98 2r7h h HIS 58 N 0.51 0.63 0.00 4.33 -0.00 -1.32 -1.42 115.15 117.89 2r7h h HIS 58 Ca 0.13 -0.16 0.00 0.00 -0.00 0.00 0.00 60.37 60.33 2r7h h HIS 58 Cb 0.12 -0.14 0.00 0.00 -0.00 0.00 0.00 27.41 27.38 2r7h h HIS 58 CO 0.00 0.82 0.00 1.28 -0.00 0.00 0.00 177.93 180.03 2r7h n LEU 59 N -4.06 1.89 0.00 0.26 4.77 -0.47 -1.07 117.00 118.31 2r7h n LEU 59 Ca -0.01 -0.94 0.00 0.00 -0.03 0.00 0.00 56.01 55.03 2r7h n LEU 59 Cb 0.47 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2r7h n LEU 59 CO 0.44 0.32 0.00 1.41 -1.33 0.00 0.00 177.39 178.23 2r7h n HIS 61 N 0.65 0.00 0.00 -1.77 8.25 -0.53 -5.09 115.22 116.72 2r7h n HIS 61 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2r7h n HIS 61 Cb 0.32 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.30 2r7h n HIS 61 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2r7h n GLY 62 N -0.29 0.32 0.37 -1.41 0.00 -0.23 -4.68 105.19 99.27 2r7h n GLY 62 Ca 0.00 -2.00 0.19 0.00 0.00 0.00 0.00 46.02 44.21 2r7h n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r7h h ALA 63 N 0.00 2.43 -1.35 4.61 0.00 -1.90 -2.92 119.26 120.13 2r7h h ALA 63 Ca 0.00 -0.02 0.40 0.00 0.00 0.00 0.00 54.91 55.29 2r7h h ALA 63 Cb 0.00 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 17.74 2r7h h ALA 63 CO 0.00 -0.57 0.93 0.00 0.00 0.00 0.00 179.25 179.61 2r7h h ALA 64 N 1.75 3.00 0.00 0.00 0.00 -1.95 0.30 119.26 122.36 2r7h h ALA 64 Ca 0.23 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2r7h h ALA 64 Cb 0.91 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2r7h h ALA 64 CO -0.01 -1.47 0.00 0.00 0.00 0.00 0.00 179.25 177.77 2r7h n GLY 66 N -0.09 0.47 3.16 0.00 0.00 0.09 -5.03 105.19 103.80 2r7h n GLY 66 Ca 0.01 -0.84 -0.33 0.00 0.00 0.00 0.00 46.02 44.86 2r7h n GLY 66 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2r7h s TYR 67 N -2.02 2.78 0.20 1.61 2.02 -1.26 -4.00 117.35 116.67 2r7h s TYR 67 Ca 0.00 -1.46 0.09 0.00 -0.37 0.00 0.00 57.07 55.32 2r7h s TYR 67 Cb 0.00 -1.92 -0.04 0.00 -0.40 0.00 0.00 41.96 39.60 2r7h s TYR 67 CO 0.00 -0.72 -0.07 -1.01 -1.57 0.00 0.00 175.55 172.18 2r7h s HIS 68 N 1.18 2.66 0.02 2.71 3.76 0.10 -4.90 115.29 120.83 2r7h s HIS 68 Ca 0.02 -0.22 0.00 0.00 -0.15 0.00 0.00 55.06 54.72 2r7h s HIS 68 Cb -0.14 -1.27 -0.02 0.00 1.11 0.00 0.00 32.58 32.27 2r7h s HIS 68 CO -0.09 0.54 -0.03 -0.06 -0.85 0.00 0.00 174.74 174.25 2r7h s PHE 69 N -1.87 0.30 -0.19 1.40 0.40 -1.26 -0.87 117.98 115.89 2r7h s PHE 69 Ca 0.27 -0.41 -0.01 0.00 -0.60 0.00 0.00 56.93 56.18 2r7h s PHE 69 Cb -0.08 -0.20 0.05 0.00 0.51 0.00 0.00 43.02 43.30 2r7h s PHE 69 CO 0.16 -0.13 -0.02 0.08 0.70 0.00 0.00 175.22 176.01 2r7h s VAL 70 N -1.12 1.02 -0.22 -0.44 1.01 -0.77 -4.43 120.40 115.45 2r7h s VAL 70 Ca -0.11 -0.76 -0.10 0.00 0.00 0.00 0.00 61.98 61.01 2r7h s VAL 70 Cb -0.08 -1.33 -0.05 0.00 0.00 0.00 0.00 36.38 34.92 2r7h s VAL 70 CO -0.01 -0.04 0.13 -0.36 0.00 0.00 0.00 175.10 174.82 2r7h s PHE 71 N 1.65 3.30 -0.32 5.22 0.08 0.27 -1.03 117.98 127.15 2r7h s PHE 71 Ca -0.02 0.17 -0.17 0.00 0.12 0.00 0.00 56.93 57.04 2r7h s PHE 71 Cb -0.17 -2.21 -0.02 0.00 -0.57 0.00 0.00 43.02 40.06 2r7h s PHE 71 CO -0.07 0.10 0.46 0.00 -0.10 0.00 0.00 175.22 175.61 2r7h s ALA 72 N 0.83 3.52 0.14 5.36 0.00 0.02 -1.02 121.76 130.61 2r7h s ALA 72 Ca 0.07 -0.94 0.11 0.00 0.00 0.00 0.00 51.96 51.20 2r7h s ALA 72 Cb -0.13 -2.91 -0.04 0.00 0.00 0.00 0.00 23.12 20.04 2r7h s ALA 72 CO 0.02 -1.01 -0.24 0.95 0.00 0.00 0.00 175.76 175.48 2r7h s THR 73 N 2.26 2.42 -0.14 0.00 -4.23 0.56 -0.71 115.64 115.80 2r7h s THR 73 Ca 0.17 -1.74 -0.02 0.00 -1.18 0.00 0.00 61.69 58.92 2r7h s THR 73 Cb -0.16 -2.09 0.05 0.00 1.34 0.00 0.00 72.50 71.64 2r7h s THR 73 CO 0.12 0.06 0.02 -1.61 -0.54 0.00 0.00 174.62 172.67 2r7h s GLU 74 N -2.17 0.63 5.96 3.99 2.02 -0.01 -0.55 118.70 128.57 2r7h s GLU 74 Ca 0.16 -0.20 0.00 0.00 0.02 0.00 0.00 54.97 54.95 2r7h s GLU 74 Cb -0.10 -1.65 0.00 0.00 0.10 0.00 0.00 34.13 32.48 2r7h s GLU 74 CO 0.08 -0.51 0.00 -0.40 0.02 0.00 0.00 175.26 174.45 2r7h n ASP 75 N 5.10 0.00 -1.01 -0.19 3.85 -1.26 -1.17 116.55 121.86 2r7h n ASP 75 Ca -0.08 0.00 0.06 0.00 -0.71 0.00 0.00 54.79 54.06 2r7h n ASP 75 Cb 0.48 0.00 0.21 0.00 -1.35 0.00 0.00 41.12 40.47 2r7h n ASP 75 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 2r7h n ASP 76 N 2.52 2.92 0.00 -1.12 3.85 -1.26 -5.07 116.55 118.39 2r7h n ASP 76 Ca 0.00 -2.20 0.00 0.00 -0.71 0.00 0.00 54.79 51.88 2r7h n ASP 76 Cb 0.00 -0.41 0.00 0.00 -1.35 0.00 0.00 41.12 39.36 2r7h n ASP 76 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 2r7h n ASP 77 N 0.66 0.00 0.00 -1.12 3.85 -0.32 -5.15 116.55 114.47 2r7h n ASP 77 Ca 0.16 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.24 2r7h n ASP 77 Cb 0.54 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.31 2r7h n ASP 77 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2r7h n ALA 79 N -3.00 0.40 0.00 2.12 0.00 0.11 -0.83 120.51 119.31 2r7h n ALA 79 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2r7h n ALA 79 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2r7h n ALA 79 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r7h n GLY 80 N -0.06 -1.71 3.67 0.00 0.00 -1.14 -0.80 105.19 105.16 2r7h n GLY 80 Ca 0.00 -1.10 -0.06 0.00 0.00 0.00 0.00 46.02 44.86 2r7h n GLY 80 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2r7h s TYR 81 N -2.21 -0.22 0.03 1.61 1.13 0.50 -0.80 117.35 117.39 2r7h s TYR 81 Ca 0.00 -0.05 0.06 0.00 -1.41 0.00 0.00 57.07 55.67 2r7h s TYR 81 Cb 0.00 0.61 -0.02 0.00 -1.10 0.00 0.00 41.96 41.45 2r7h s TYR 81 CO 0.00 -0.78 -0.18 0.00 -2.51 0.00 0.00 175.55 172.08 2r7h s ALA 82 N -3.32 1.48 -0.08 9.51 0.00 -0.19 -0.63 121.76 128.53 2r7h s ALA 82 Ca 0.09 -0.91 0.03 0.00 0.00 0.00 0.00 51.96 51.17 2r7h s ALA 82 Cb -0.02 -0.29 0.01 0.00 0.00 0.00 0.00 23.12 22.82 2r7h s ALA 82 CO -0.01 0.32 -0.17 0.00 0.00 0.00 0.00 175.76 175.89 2r7h s TYR 84 N 0.50 0.14 -0.17 0.00 1.13 -0.05 -0.65 117.35 118.24 2r7h s TYR 84 Ca -0.16 -0.64 -0.35 0.00 -1.41 0.00 0.00 57.07 54.51 2r7h s TYR 84 Cb -0.17 0.59 0.14 0.00 -1.10 0.00 0.00 41.96 41.43 2r7h s TYR 84 CO 0.06 -1.31 1.33 0.20 -2.51 0.00 0.00 175.55 173.32 2r7h s GLY 85 N -3.02 -0.33 0.37 5.49 0.00 -0.50 0.02 107.32 109.35 2r7h s GLY 85 Ca 0.16 1.40 -0.27 0.00 0.00 0.00 0.00 44.72 46.02 2r7h s GLY 85 CO 0.10 0.41 1.22 2.56 0.00 0.00 0.00 173.10 177.40 2r7h s PRO 86 N -2.21 4.17 -0.01 2.90 0.04 -1.26 -0.92 135.00 137.72 2r7h s PRO 86 Ca 0.12 2.00 -0.30 0.00 0.04 0.00 0.00 61.00 62.86 2r7h s PRO 86 Cb 0.02 -2.85 -0.04 0.00 0.04 0.00 0.00 34.50 31.67 2r7h s PRO 86 CO -0.04 -0.27 1.20 0.99 0.04 0.00 0.00 177.00 178.92 2r7h s THR 87 N -1.28 4.19 0.48 1.26 2.01 -0.15 -4.78 115.64 117.37 2r7h s THR 87 Ca 0.54 1.55 -0.23 0.00 0.31 0.00 0.00 61.69 63.85 2r7h s THR 87 Cb -0.35 -3.99 -0.08 0.00 0.01 0.00 0.00 72.50 68.09 2r7h s THR 87 CO 0.45 0.04 1.13 -2.65 -0.69 0.00 0.00 174.62 172.90 2r7h n PRO 88 N 4.72 1.48 -2.54 4.92 -0.02 -1.26 -3.07 135.00 139.23 2r7h n PRO 88 Ca 0.10 0.54 -0.18 0.00 -2.02 0.00 0.00 63.50 61.94 2r7h n PRO 88 Cb 0.46 -2.25 0.01 0.00 -0.02 0.00 0.00 33.50 31.70 2r7h n PRO 88 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2r7h n ALA 89 N -0.75 -0.62 -2.15 3.55 0.00 -1.26 -5.00 120.51 114.28 2r7h n ALA 89 Ca 0.10 0.18 -0.10 0.00 0.00 0.00 0.00 53.44 53.62 2r7h n ALA 89 Cb 0.42 -2.44 -0.10 0.00 0.00 0.00 0.00 19.45 17.33 2r7h n ALA 89 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2r7h s THR 90 N -2.94 0.11 -0.21 0.00 -4.23 -1.18 -5.14 115.64 102.06 2r7h s THR 90 Ca 0.09 -1.91 0.01 0.00 -1.18 0.00 0.00 61.69 58.71 2r7h s THR 90 Cb -0.04 -2.02 0.04 0.00 1.34 0.00 0.00 72.50 71.82 2r7h s THR 90 CO 0.12 -0.50 -0.12 -1.61 -0.54 0.00 0.00 174.62 171.97 2r7h s GLU 91 N -4.04 2.28 -0.10 3.99 2.02 -1.26 -4.73 118.70 116.86 2r7h s GLU 91 Ca 0.23 -0.94 0.00 0.00 0.02 0.00 0.00 54.97 54.28 2r7h s GLU 91 Cb 0.07 -2.54 0.00 0.00 0.10 0.00 0.00 34.13 31.77 2r7h s GLU 91 CO 0.01 -0.41 0.00 0.41 0.02 0.00 0.00 175.26 175.29 2r7h n GLY 92 N 4.62 0.49 3.55 -1.39 0.00 -1.26 -4.89 105.19 106.31 2r7h n GLY 92 Ca -0.16 -0.39 -0.34 0.00 0.00 0.00 0.00 46.02 45.14 2r7h n GLY 92 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r7h s THR 93 N -1.97 3.66 0.08 2.61 2.01 -1.26 -0.20 115.64 120.56 2r7h s THR 93 Ca 0.00 -0.49 0.04 0.00 0.31 0.00 0.00 61.69 61.56 2r7h s THR 93 Cb 0.00 -2.51 -0.03 0.00 0.01 0.00 0.00 72.50 69.97 2r7h s THR 93 CO 0.00 0.58 -0.12 -0.31 -0.69 0.00 0.00 174.62 174.08 2r7h s TYR 94 N -0.55 1.14 -0.13 4.92 1.51 -0.62 -0.97 117.35 122.64 2r7h s TYR 94 Ca 0.08 -0.54 -0.00 0.00 -1.01 0.00 0.00 57.07 55.60 2r7h s TYR 94 Cb -0.12 -0.63 -0.02 0.00 -0.11 0.00 0.00 41.96 41.09 2r7h s TYR 94 CO 0.02 0.04 -0.12 -0.51 -1.11 0.00 0.00 175.55 173.87 2r7h s ASP 95 N -2.04 4.10 -0.39 2.29 1.01 -0.09 -0.44 116.67 121.11 2r7h s ASP 95 Ca 0.01 -0.30 -0.22 0.00 0.71 0.00 0.00 52.55 52.75 2r7h s ASP 95 Cb -0.07 -1.61 0.01 0.00 1.01 0.00 0.00 42.92 42.26 2r7h s ASP 95 CO 0.02 0.17 0.71 -0.22 0.21 0.00 0.00 175.17 176.05 2r7h s LEU 96 N 0.32 4.26 -0.06 1.23 2.96 0.92 -1.41 118.68 126.89 2r7h s LEU 96 Ca -0.10 0.08 -0.23 0.00 -0.22 0.00 0.00 54.13 53.66 2r7h s LEU 96 Cb -0.16 -2.88 -0.18 0.00 0.50 0.00 0.00 46.19 43.47 2r7h s LEU 96 CO 0.05 -0.72 0.95 1.88 -1.32 0.00 0.00 176.35 177.19 2r7h h TYR 97 N 8.63 -0.11 -1.81 5.38 0.05 -1.19 -3.41 116.97 124.51 2r7h h TYR 97 Ca -0.25 -0.00 0.20 0.00 0.05 0.00 0.00 58.73 58.72 2r7h h TYR 97 Cb 1.10 0.04 -0.17 0.00 1.01 0.00 0.00 36.73 38.71 2r7h h TYR 97 CO 0.77 0.42 0.68 1.67 -1.05 0.00 0.00 178.16 180.64 2r7h s TRP 98 N -3.43 -0.21 -0.18 4.88 -2.14 -1.14 -4.90 118.94 111.81 2r7h s TRP 98 Ca -0.14 0.12 0.00 0.00 2.66 0.00 0.00 56.10 58.74 2r7h s TRP 98 Cb 0.00 0.53 0.01 0.00 -3.10 0.00 0.00 33.47 30.91 2r7h s TRP 98 CO 0.56 -0.35 -0.18 0.42 -2.66 0.00 0.00 176.95 174.73 2r7h s ILE 99 N -2.72 2.28 -0.12 0.66 1.01 -1.26 -1.45 121.20 119.59 2r7h s ILE 99 Ca 0.08 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 59.89 2r7h s ILE 99 Cb -0.01 -1.97 0.01 0.00 0.01 0.00 0.00 42.46 40.50 2r7h s ILE 99 CO -0.06 0.52 -0.23 0.00 0.00 0.00 0.00 174.94 175.17 2r7h s ALA 100 N 1.28 2.20 -0.05 9.38 0.00 0.20 -4.99 121.76 129.79 2r7h s ALA 100 Ca 0.04 -1.03 0.06 0.00 0.00 0.00 0.00 51.96 51.03 2r7h s ALA 100 Cb -0.13 -0.91 -0.01 0.00 0.00 0.00 0.00 23.12 22.07 2r7h s ALA 100 CO -0.11 0.11 -0.22 0.08 0.00 0.00 0.00 175.76 175.63 2r7h s VAL 101 N 0.60 1.80 0.55 0.00 1.01 -1.26 -0.37 120.40 122.73 2r7h s VAL 101 Ca -0.12 -0.93 -0.22 0.00 0.00 0.00 0.00 61.98 60.71 2r7h s VAL 101 Cb -0.17 -1.53 -0.05 0.00 0.00 0.00 0.00 36.38 34.64 2r7h s VAL 101 CO 0.03 0.51 1.36 0.00 0.00 0.00 0.00 175.10 176.99 2r7h s ALA 102 N -0.15 2.80 0.33 5.51 0.00 0.02 -4.77 121.76 125.50 2r7h s ALA 102 Ca -0.02 1.33 0.08 0.00 0.00 0.00 0.00 51.96 53.35 2r7h s ALA 102 Cb -0.12 -3.57 0.80 0.00 0.00 0.00 0.00 23.12 20.23 2r7h s ALA 102 CO 0.02 -1.38 1.81 -1.00 0.00 0.00 0.00 175.76 175.22 2r7h h PRO 103 N 1.43 0.69 0.00 0.00 0.13 -1.91 -1.29 132.00 131.05 2r7h h PRO 103 Ca -0.51 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 64.58 2r7h h PRO 103 Cb 1.30 -0.16 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 2r7h h PRO 103 CO 0.57 0.46 -0.01 1.12 -0.23 0.00 0.00 178.00 179.91 2r7h h HIS 104 N 0.71 0.00 -0.31 1.56 2.07 -1.96 -2.81 115.15 114.41 2r7h h HIS 104 Ca 0.53 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 58.00 2r7h h HIS 104 Cb 0.88 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.83 2r7h h HIS 104 CO -0.00 0.01 0.01 0.54 -3.07 0.00 0.00 177.93 175.41 2r7h n ARG 105 N -3.10 2.85 0.14 5.12 5.12 -0.51 -4.77 116.66 121.51 2r7h n ARG 105 Ca 0.00 -2.92 0.12 0.00 -1.93 0.00 0.00 57.85 53.12 2r7h n ARG 105 Cb 0.29 -1.88 0.15 0.00 -1.16 0.00 0.00 32.46 29.86 2r7h n ARG 105 CO 0.00 0.00 0.00 0.37 -1.93 0.00 0.00 177.63 176.07 2r7h h GLN 106 N 1.78 0.00 -1.11 5.56 4.15 -1.27 -3.27 115.11 120.95 2r7h h GLN 106 Ca 0.05 0.00 -0.60 0.00 0.77 0.00 0.00 58.65 58.88 2r7h h GLN 106 Cb 1.56 0.00 -0.39 0.00 0.21 0.00 0.00 27.48 28.85 2r7h h GLN 106 CO 0.29 0.00 -0.40 0.72 -1.93 0.00 0.00 178.83 177.51 2r7h n HIS 107 N -2.66 3.03 0.44 3.99 8.25 -1.26 -4.65 115.22 122.37 2r7h n HIS 107 Ca 0.03 -2.60 0.04 0.00 -0.26 0.00 0.00 57.72 54.93 2r7h n HIS 107 Cb 0.50 -0.49 -0.05 0.00 1.12 0.00 0.00 29.99 31.07 2r7h n HIS 107 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2r7h n SER 108 N -0.66 0.48 0.00 0.41 2.88 -1.23 -5.00 113.62 110.50 2r7h n SER 108 Ca 0.46 -0.74 0.00 0.00 -1.33 0.00 0.00 58.87 57.26 2r7h n SER 108 Cb 0.78 0.97 0.00 0.00 -0.75 0.00 0.00 64.21 65.21 2r7h n SER 108 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2r7h n GLY 109 N 1.21 0.69 0.23 0.46 0.00 -1.26 -4.94 105.19 101.57 2r7h n GLY 109 Ca 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.00 2r7h n GLY 109 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2r7h h LEU 110 N 0.00 0.46 -0.11 0.99 5.85 -1.91 -2.20 115.31 118.40 2r7h h LEU 110 Ca 0.00 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.56 2r7h h LEU 110 Cb 0.00 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 2r7h h LEU 110 CO 0.00 0.75 0.04 1.23 -0.34 0.00 0.00 178.44 180.12 2r7h h GLY 111 N 1.06 0.13 1.08 3.75 0.00 -1.92 0.12 103.07 107.30 2r7h h GLY 111 Ca 0.05 -0.03 -0.03 0.00 0.00 0.00 0.00 47.33 47.32 2r7h h GLY 111 CO 0.06 0.02 0.38 3.21 0.00 0.00 0.00 176.54 180.21 2r7h h ARG 112 N 0.10 1.18 -0.48 4.80 3.08 -1.95 -1.55 114.38 119.56 2r7h h ARG 112 Ca 0.05 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 2r7h h ARG 112 Cb 0.02 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 2r7h h ARG 112 CO -0.05 0.92 0.20 0.00 -1.07 0.00 0.00 179.97 179.97 2r7h h ALA 113 N 1.25 0.62 -0.45 0.04 0.00 -1.00 -0.25 119.26 119.47 2r7h h ALA 113 Ca 0.28 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2r7h h ALA 113 Cb 0.13 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2r7h h ALA 113 CO -0.03 0.22 0.17 -0.07 0.00 0.00 0.00 179.25 179.54 2r7h h LEU 114 N 0.63 0.63 -0.65 0.00 3.38 -0.49 -2.24 115.31 116.57 2r7h h LEU 114 Ca 0.16 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2r7h h LEU 114 Cb 0.17 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2r7h h LEU 114 CO -0.02 0.63 0.36 0.25 0.09 0.00 0.00 178.44 179.76 2r7h h LEU 115 N 0.58 0.80 -1.16 1.67 5.85 -1.08 -1.97 115.31 120.01 2r7h h LEU 115 Ca 0.15 -0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.86 2r7h h LEU 115 Cb 0.20 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 40.97 2r7h h LEU 115 CO -0.01 0.65 0.58 0.00 -0.34 0.00 0.00 178.44 179.33 2r7h h ALA 116 N 1.18 1.55 -0.40 1.25 0.00 -0.85 -0.83 119.26 121.15 2r7h h ALA 116 Ca 0.23 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.99 2r7h h ALA 116 Cb 0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2r7h h ALA 116 CO -0.04 0.30 -0.27 0.93 0.00 0.00 0.00 179.25 180.18 2r7h h GLU 117 N 0.98 0.89 -0.46 0.00 4.39 -0.92 -1.43 114.58 118.03 2r7h h GLU 117 Ca 0.39 -0.42 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2r7h h GLU 117 Cb 0.26 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.88 2r7h h GLU 117 CO -0.15 1.07 0.29 0.28 -1.16 0.00 0.00 179.01 179.34 2r7h h VAL 118 N 0.71 1.13 -0.87 3.13 2.07 -0.92 -1.31 116.25 120.19 2r7h h VAL 118 Ca 0.08 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 2r7h h VAL 118 Cb 0.84 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 2r7h h VAL 118 CO 0.07 0.13 0.49 0.58 0.02 0.00 0.00 177.57 178.87 2r7h h VAL 119 N 0.62 1.25 -0.13 2.57 2.07 -1.06 -0.68 116.25 120.89 2r7h h VAL 119 Ca 0.17 -0.60 0.01 0.00 0.82 0.00 0.00 66.70 67.10 2r7h h VAL 119 Cb -0.04 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 29.78 2r7h h VAL 119 CO -0.03 0.27 0.07 -0.74 0.02 0.00 0.00 177.57 177.16 2r7h h HIS 120 N 1.21 0.13 -0.70 1.57 6.17 -0.97 -0.19 115.15 122.37 2r7h h HIS 120 Ca 0.31 0.01 -0.06 0.00 0.71 0.00 0.00 60.37 61.33 2r7h h HIS 120 Cb 0.00 -0.04 -0.03 0.00 2.52 0.00 0.00 27.41 29.87 2r7h h HIS 120 CO 0.01 0.08 0.21 -0.44 0.71 0.00 0.00 177.93 178.49 2r7h h ASP 121 N 0.15 1.04 -0.29 3.26 3.32 -0.83 -1.66 116.42 121.40 2r7h h ASP 121 Ca 0.05 -0.21 -0.07 0.00 0.02 0.00 0.00 57.03 56.82 2r7h h ASP 121 Cb 0.00 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 2r7h h ASP 121 CO -0.03 0.98 -0.07 0.58 -1.72 0.00 0.00 179.24 178.97 2r7h h VAL 122 N 1.04 1.28 -0.56 -1.35 2.07 -1.03 -3.00 116.25 114.71 2r7h h VAL 122 Ca 0.23 -1.11 0.06 0.00 0.82 0.00 0.00 66.70 66.70 2r7h h VAL 122 Cb 0.32 1.40 -0.06 0.00 -1.52 0.00 0.00 31.29 31.43 2r7h h VAL 122 CO -0.00 0.35 0.26 0.03 0.02 0.00 0.00 177.57 178.22 2r7h h ARG 123 N 0.33 0.47 -0.12 1.57 3.08 -0.85 -0.10 114.38 118.77 2r7h h ARG 123 Ca 0.07 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.12 2r7h h ARG 123 Cb 0.56 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2r7h h ARG 123 CO 0.03 0.31 0.08 -0.07 -1.07 0.00 0.00 179.97 179.25 2r7h h LEU 124 N 0.48 0.04 -1.51 3.04 4.07 -1.17 -1.69 115.31 118.56 2r7h h LEU 124 Ca 0.26 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.22 2r7h h LEU 124 Cb 0.23 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 41.96 2r7h h LEU 124 CO -0.22 0.03 0.00 0.35 -1.08 0.00 0.00 178.44 177.52 2r7h n THR 125 N -4.51 0.53 -0.60 0.22 -2.24 -1.13 -4.90 114.28 101.65 2r7h n THR 125 Ca -0.00 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 2r7h n THR 125 Cb 0.17 0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 2r7h n THR 125 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2r7h n GLY 126 N 1.16 0.66 3.77 3.38 0.00 -0.64 -5.00 105.19 108.53 2r7h n GLY 126 Ca 0.14 -0.41 -0.38 0.00 0.00 0.00 0.00 46.02 45.37 2r7h n GLY 126 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2r7h s GLY 127 N -2.37 2.83 -0.20 -0.02 0.00 -0.06 -4.72 107.32 102.77 2r7h s GLY 127 Ca 0.00 0.98 0.04 0.00 0.00 0.00 0.00 44.72 45.74 2r7h s GLY 127 CO 0.00 1.47 -0.14 0.54 0.00 0.00 0.00 173.10 174.97 2r7h n ARG 128 N -0.21 0.66 -4.24 2.90 1.74 0.71 -4.23 116.66 113.99 2r7h n ARG 128 Ca 0.06 0.10 -0.18 0.00 -0.77 0.00 0.00 57.85 57.06 2r7h n ARG 128 Cb 0.47 -1.42 -0.13 0.00 -1.02 0.00 0.00 32.46 30.37 2r7h n ARG 128 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2r7h s LEU 129 N -6.04 2.19 -0.11 0.55 1.43 -0.87 -0.30 118.68 115.53 2r7h s LEU 129 Ca -0.25 -0.46 0.00 0.00 -1.03 0.00 0.00 54.13 52.39 2r7h s LEU 129 Cb 0.07 -0.46 0.02 0.00 0.03 0.00 0.00 46.19 45.85 2r7h s LEU 129 CO 0.51 -0.03 -0.09 -0.22 0.23 0.00 0.00 176.35 176.75 2r7h s LEU 130 N -1.22 1.32 -0.02 1.79 2.96 -0.14 -1.59 118.68 121.78 2r7h s LEU 130 Ca -0.01 -0.32 0.01 0.00 -0.22 0.00 0.00 54.13 53.59 2r7h s LEU 130 Cb -0.08 -0.87 -0.03 0.00 0.50 0.00 0.00 46.19 45.71 2r7h s LEU 130 CO 0.01 -0.08 -0.02 -0.36 -1.32 0.00 0.00 176.35 174.58 2r7h s PHE 131 N 1.48 3.04 -0.02 5.38 0.08 0.42 -0.50 117.98 127.86 2r7h s PHE 131 Ca 0.01 0.07 0.03 0.00 0.12 0.00 0.00 56.93 57.16 2r7h s PHE 131 Cb -0.13 -1.68 -0.00 0.00 -0.57 0.00 0.00 43.02 40.64 2r7h s PHE 131 CO -0.06 0.44 -0.11 0.00 -0.10 0.00 0.00 175.22 175.39 2r7h s ALA 132 N -1.02 0.93 -0.04 5.36 0.00 -0.60 -0.06 121.76 126.33 2r7h s ALA 132 Ca 0.18 -0.43 0.06 0.00 0.00 0.00 0.00 51.96 51.77 2r7h s ALA 132 Cb -0.11 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.70 2r7h s ALA 132 CO 0.08 0.19 -0.22 -1.21 0.00 0.00 0.00 175.76 174.60 2r7h s GLU 133 N -0.06 2.35 0.33 0.00 2.02 -1.26 -0.48 118.70 121.59 2r7h s GLU 133 Ca 0.01 -0.86 -0.01 0.00 0.02 0.00 0.00 54.97 54.14 2r7h s GLU 133 Cb -0.06 -2.17 -0.01 0.00 0.10 0.00 0.00 34.13 31.99 2r7h s GLU 133 CO 0.00 0.53 0.42 -0.08 0.02 0.00 0.00 175.26 176.15 2r7h s THR 134 N -0.51 0.00 0.32 3.63 -1.32 -0.41 -4.98 115.64 112.37 2r7h s THR 134 Ca 0.07 -1.69 -0.07 0.00 -1.21 0.00 0.00 61.69 58.78 2r7h s THR 134 Cb -0.11 -2.59 -0.06 0.00 -1.51 0.00 0.00 72.50 68.23 2r7h s THR 134 CO 0.01 0.00 0.62 -0.55 -2.21 0.00 0.00 174.62 172.49 2r7h s SER 135 N -3.25 6.50 0.00 8.08 0.15 -1.26 -0.23 113.70 123.68 2r7h s SER 135 Ca 0.33 0.88 0.25 0.00 0.70 0.00 0.00 55.95 58.10 2r7h s SER 135 Cb 0.01 -2.21 0.81 0.00 -1.71 0.00 0.00 66.02 62.91 2r7h s SER 135 CO 0.21 -0.24 1.60 0.61 1.20 0.00 0.00 173.24 176.62 2r7h n GLY 136 N -0.92 0.33 3.82 9.45 0.00 0.27 -4.75 105.19 113.38 2r7h n GLY 136 Ca -0.00 -0.48 -0.32 0.00 0.00 0.00 0.00 46.02 45.22 2r7h n GLY 136 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2r7h s ILE 137 N -1.89 3.99 0.25 -0.61 -4.36 -1.26 -4.89 121.20 112.43 2r7h s ILE 137 Ca 0.35 0.78 -0.07 0.00 -0.26 0.00 0.00 60.65 61.45 2r7h s ILE 137 Cb 0.20 -3.42 0.29 0.00 1.25 0.00 0.00 42.46 40.77 2r7h s ILE 137 CO 0.30 -0.71 1.63 0.08 0.24 0.00 0.00 174.94 176.48 2r7h h ARG 138 N -0.15 0.10 -0.95 0.37 0.11 -1.97 -1.18 114.38 110.71 2r7h h ARG 138 Ca -0.45 -0.01 0.26 0.00 0.10 0.00 0.00 59.98 59.88 2r7h h ARG 138 Cb 1.21 -0.02 -0.05 0.00 1.11 0.00 0.00 29.97 32.22 2r7h h ARG 138 CO 0.57 0.06 0.67 -0.22 0.10 0.00 0.00 179.97 181.15 2r7h h LYS 139 N 0.10 0.11 -0.24 0.08 3.64 -1.97 0.06 116.57 118.35 2r7h h LYS 139 Ca 0.42 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.79 2r7h h LYS 139 Cb 0.75 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 2r7h h LYS 139 CO -0.68 0.07 0.00 0.66 -2.27 0.00 0.00 179.45 177.24 2r7h n TYR 140 N -4.34 0.30 -0.21 1.91 4.02 -0.45 -4.43 117.16 113.97 2r7h n TYR 140 Ca 0.20 -0.15 0.01 0.00 -0.01 0.00 0.00 57.90 57.95 2r7h n TYR 140 Cb 0.94 0.00 0.12 0.00 -0.02 0.00 0.00 39.34 40.38 2r7h n TYR 140 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2r7h h ALA 141 N 4.19 0.82 -0.30 -0.72 0.00 -0.99 -1.49 119.26 120.77 2r7h h ALA 141 Ca 0.00 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.03 2r7h h ALA 141 Cb 0.65 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 2r7h h ALA 141 CO 0.00 -0.20 0.14 -1.35 0.00 0.00 0.00 179.25 177.83 2r7h h PRO 142 N 0.40 0.28 -0.42 0.00 0.11 -1.80 -1.82 132.00 128.76 2r7h h PRO 142 Ca 0.32 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 66.47 2r7h h PRO 142 Cb 0.42 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 31.42 2r7h h PRO 142 CO -0.33 0.19 0.13 1.15 -0.21 0.00 0.00 178.00 178.92 2r7h h THR 143 N 0.29 0.84 -0.95 -1.15 2.02 -1.77 0.36 112.91 112.55 2r7h h THR 143 Ca 0.13 -0.10 0.02 0.00 0.77 0.00 0.00 66.41 67.23 2r7h h THR 143 Cb 0.06 0.54 -0.05 0.00 -1.74 0.00 0.00 68.15 66.95 2r7h h THR 143 CO -0.10 0.05 0.62 0.03 0.37 0.00 0.00 175.52 176.50 2r7h h ARG 144 N 0.28 1.21 -0.19 6.66 3.08 -1.05 -1.70 114.38 122.67 2r7h h ARG 144 Ca 0.20 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 2r7h h ARG 144 Cb 0.20 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 2r7h h ARG 144 CO -0.22 0.80 0.11 0.00 -1.07 0.00 0.00 179.97 179.59 2r7h h ARG 145 N 1.24 0.26 -0.26 0.04 2.47 -0.68 -0.12 114.38 117.33 2r7h h ARG 145 Ca 0.36 -0.03 0.06 0.00 -1.26 0.00 0.00 59.98 59.12 2r7h h ARG 145 Cb -0.07 -0.05 -0.07 0.00 -1.65 0.00 0.00 29.97 28.13 2r7h h ARG 145 CO -0.10 0.25 -0.20 0.35 0.56 0.00 0.00 179.97 180.83 2r7h h PHE 146 N 0.21 -0.51 -0.36 3.04 3.57 -0.56 0.42 116.94 122.75 2r7h h PHE 146 Ca 0.07 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.59 2r7h h PHE 146 Cb 0.06 0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 2r7h h PHE 146 CO -0.04 -0.27 0.16 1.88 -2.23 0.00 0.00 178.31 177.81 2r7h h TYR 147 N -0.19 0.53 -0.80 0.41 0.05 -1.16 -1.33 116.97 114.49 2r7h h TYR 147 Ca 0.14 -0.03 -0.04 0.00 0.05 0.00 0.00 58.73 58.86 2r7h h TYR 147 Cb 0.41 -0.16 -0.04 0.00 1.01 0.00 0.00 36.73 37.95 2r7h h TYR 147 CO -0.37 0.46 0.35 0.93 -1.05 0.00 0.00 178.16 178.48 2r7h h GLU 148 N 0.44 1.17 0.00 4.88 5.08 -0.58 -1.18 114.58 124.39 2r7h h GLU 148 Ca 0.12 -0.19 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 2r7h h GLU 148 Cb 0.14 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2r7h h GLU 148 CO -0.01 0.93 -0.37 0.00 -1.00 0.00 0.00 179.01 178.55 2r7h h ARG 149 N 1.14 0.00 -0.01 2.33 3.08 0.01 -2.72 114.38 118.21 2r7h h ARG 149 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.32 2r7h h ARG 149 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.22 2r7h h ARG 149 CO -0.03 0.37 0.00 0.00 -1.07 0.00 0.00 179.97 179.25 2r7h n ALA 150 N -2.44 2.63 -0.25 0.04 0.00 -0.52 -4.89 120.51 115.09 2r7h n ALA 150 Ca -0.02 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2r7h n ALA 150 Cb 0.42 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.50 2r7h n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r7h n GLY 151 N 0.94 0.87 3.82 0.00 0.00 -1.03 -5.07 105.19 104.72 2r7h n GLY 151 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 2r7h n GLY 151 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2r7h s PHE 152 N -2.02 3.43 -0.02 1.61 0.40 -0.49 -4.80 117.98 116.08 2r7h s PHE 152 Ca 0.00 1.57 0.07 0.00 -0.60 0.00 0.00 56.93 57.97 2r7h s PHE 152 Cb 0.00 -2.80 -0.02 0.00 0.51 0.00 0.00 43.02 40.70 2r7h s PHE 152 CO 0.00 0.02 -0.23 -1.54 0.70 0.00 0.00 175.22 174.17 2r7h s SER 153 N -2.03 3.32 -0.37 1.36 1.04 -0.41 -4.28 113.70 112.33 2r7h s SER 153 Ca 0.57 -0.40 -0.28 0.00 0.48 0.00 0.00 55.95 56.31 2r7h s SER 153 Cb -0.12 -0.47 -0.01 0.00 0.10 0.00 0.00 66.02 65.52 2r7h s SER 153 CO 0.17 0.32 1.66 0.00 0.98 0.00 0.00 173.24 176.37 2r7h s ALA 154 N -0.66 2.91 -0.09 5.32 0.00 -1.26 0.09 121.76 128.07 2r7h s ALA 154 Ca 0.11 0.07 0.20 0.00 0.00 0.00 0.00 51.96 52.33 2r7h s ALA 154 Cb -0.10 -4.00 -0.30 0.00 0.00 0.00 0.00 23.12 18.72 2r7h s ALA 154 CO -0.00 -2.60 0.32 -1.91 0.00 0.00 0.00 175.76 171.58 2r7h n GLU 155 N 8.34 0.69 -3.75 0.00 2.13 0.10 -4.95 120.64 123.21 2r7h n GLU 155 Ca 0.20 -0.13 -0.13 0.00 0.66 0.00 0.00 57.16 57.76 2r7h n GLU 155 Cb 0.47 -1.51 -0.08 0.00 0.27 0.00 0.00 31.44 30.59 2r7h n GLU 155 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2r7h s ALA 156 N -3.12 -0.81 -0.08 4.31 0.00 -1.09 -5.00 121.76 115.97 2r7h s ALA 156 Ca -0.09 0.31 -0.01 0.00 0.00 0.00 0.00 51.96 52.18 2r7h s ALA 156 Cb 0.11 0.12 0.03 0.00 0.00 0.00 0.00 23.12 23.37 2r7h s ALA 156 CO 0.86 -0.29 -0.03 0.08 0.00 0.00 0.00 175.76 176.38 2r7h s VAL 157 N -1.55 0.62 -0.38 0.00 1.01 -1.26 -0.42 120.40 118.42 2r7h s VAL 157 Ca -0.12 -0.05 -0.07 0.00 0.00 0.00 0.00 61.98 61.74 2r7h s VAL 157 Cb -0.04 -0.72 0.06 0.00 0.00 0.00 0.00 36.38 35.68 2r7h s VAL 157 CO 0.03 0.30 0.19 -0.76 0.00 0.00 0.00 175.10 174.85 2r7h s LEU 158 N 1.78 4.79 0.21 3.92 1.43 -0.29 -4.98 118.68 125.53 2r7h s LEU 158 Ca 0.03 -1.38 -0.31 0.00 -1.03 0.00 0.00 54.13 51.45 2r7h s LEU 158 Cb -0.13 -1.92 -0.11 0.00 0.03 0.00 0.00 46.19 44.07 2r7h s LEU 158 CO -0.06 -0.44 1.57 -0.54 0.23 0.00 0.00 176.35 177.11 2r7h s LYS 159 N 1.39 4.20 -1.34 1.70 -0.14 -1.26 -1.70 119.74 122.59 2r7h s LYS 159 Ca 0.01 2.42 -0.08 0.00 -1.36 0.00 0.00 55.97 56.97 2r7h s LYS 159 Cb -0.21 -3.11 0.05 0.00 -1.68 0.00 0.00 37.83 32.88 2r7h s LYS 159 CO 0.02 -0.59 0.50 0.00 -0.76 0.00 0.00 175.35 174.52 2r7h n ALA 160 N 3.30 -1.03 -0.04 5.17 0.00 -1.25 -4.88 120.51 121.78 2r7h n ALA 160 Ca 0.12 0.14 -0.11 0.00 0.00 0.00 0.00 53.44 53.59 2r7h n ALA 160 Cb 0.38 -3.00 -0.04 0.00 0.00 0.00 0.00 19.45 16.79 2r7h n ALA 160 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2r7h h PHE 161 N -1.03 0.24 0.17 0.00 3.57 -1.32 -3.24 116.94 115.32 2r7h h PHE 161 Ca -0.45 -0.01 -0.30 0.00 3.53 0.00 0.00 57.97 60.74 2r7h h PHE 161 Cb 1.30 -0.08 0.02 0.00 2.79 0.00 0.00 35.95 39.98 2r7h h PHE 161 CO 0.64 0.23 -1.38 1.88 -2.23 0.00 0.00 178.31 177.45 2r7h h TYR 162 N 0.17 0.67 -1.75 0.41 0.05 -1.61 -3.49 116.97 111.42 2r7h h TYR 162 Ca 0.06 -0.49 0.31 0.00 0.05 0.00 0.00 58.73 58.66 2r7h h TYR 162 Cb 0.07 -0.03 -0.10 0.00 1.01 0.00 0.00 36.73 37.69 2r7h h TYR 162 CO -0.04 1.40 0.81 -0.98 -1.05 0.00 0.00 178.16 178.30 2r7h s ARG 163 N -2.63 0.51 0.16 4.88 1.70 -1.22 -5.02 118.95 117.33 2r7h s ARG 163 Ca -0.07 -0.30 -0.34 0.00 -0.47 0.00 0.00 55.73 54.55 2r7h s ARG 163 Cb 0.06 0.16 -0.14 0.00 -0.57 0.00 0.00 34.95 34.46 2r7h s ARG 163 CO 0.90 -0.24 1.49 0.00 -1.08 0.00 0.00 175.30 176.37 2r7h n ALA 164 N -0.61 0.79 -0.87 7.88 0.00 -1.26 -0.82 120.51 125.61 2r7h n ALA 164 Ca -0.05 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.84 2r7h n ALA 164 Cb 0.61 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.79 2r7h n ALA 164 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r7h n GLY 165 N 2.98 0.56 2.97 0.00 0.00 -1.26 -4.97 105.19 105.47 2r7h n GLY 165 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2r7h n GLY 165 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2r7h s ASP 166 N -2.47 4.46 0.40 1.61 -1.08 -0.00 -4.75 116.67 114.84 2r7h s ASP 166 Ca 0.00 -2.65 -0.16 0.00 -0.52 0.00 0.00 52.55 49.23 2r7h s ASP 166 Cb 0.00 -1.60 -0.09 0.00 -1.46 0.00 0.00 42.92 39.77 2r7h s ASP 166 CO 0.00 -0.29 0.84 -1.81 0.52 0.00 0.00 175.17 174.43 2r7h s ASP 167 N 0.22 6.72 -0.20 -0.34 1.01 -1.26 -1.57 116.67 121.25 2r7h s ASP 167 Ca 0.15 1.39 -0.09 0.00 0.71 0.00 0.00 52.55 54.70 2r7h s ASP 167 Cb -0.23 -2.42 -0.05 0.00 1.01 0.00 0.00 42.92 41.23 2r7h s ASP 167 CO -0.04 -0.36 0.12 -0.75 0.21 0.00 0.00 175.17 174.35 2r7h s LYS 168 N -3.44 4.13 -0.14 8.23 2.20 -0.69 -0.57 119.74 129.46 2r7h s LYS 168 Ca 0.56 -0.25 -0.02 0.00 -0.36 0.00 0.00 55.97 55.90 2r7h s LYS 168 Cb -0.10 -3.39 -0.02 0.00 -1.51 0.00 0.00 37.83 32.81 2r7h s LYS 168 CO 0.22 0.27 -0.08 0.42 -0.36 0.00 0.00 175.35 175.82 2r7h s ILE 169 N 0.44 3.52 -0.24 5.43 1.09 0.67 -1.13 121.20 130.97 2r7h s ILE 169 Ca 0.07 -0.50 -0.06 0.00 -1.10 0.00 0.00 60.65 59.06 2r7h s ILE 169 Cb -0.12 -2.51 -0.02 0.00 -1.06 0.00 0.00 42.46 38.76 2r7h s ILE 169 CO -0.01 0.51 0.03 -0.63 -0.10 0.00 0.00 174.94 174.74 2r7h s ILE 170 N 0.30 3.92 -0.13 2.92 1.01 0.44 -1.28 121.20 128.38 2r7h s ILE 170 Ca -0.06 -0.33 -0.07 0.00 0.00 0.00 0.00 60.65 60.19 2r7h s ILE 170 Cb -0.15 -2.83 -0.04 0.00 0.01 0.00 0.00 42.46 39.45 2r7h s ILE 170 CO 0.04 0.35 0.10 -0.31 0.00 0.00 0.00 174.94 175.13 2r7h s TYR 171 N 1.55 3.45 -0.09 3.97 2.02 0.36 0.02 117.35 128.64 2r7h s TYR 171 Ca 0.06 0.38 0.02 0.00 -0.37 0.00 0.00 57.07 57.16 2r7h s TYR 171 Cb -0.15 -1.96 -0.02 0.00 -0.40 0.00 0.00 41.96 39.43 2r7h s TYR 171 CO 0.01 0.55 -0.16 0.50 -1.57 0.00 0.00 175.55 174.87 2r7h s ARG 172 N -0.62 2.94 -0.14 -0.62 3.52 0.11 -1.56 118.95 122.59 2r7h s ARG 172 Ca 0.12 -0.74 0.00 0.00 -0.13 0.00 0.00 55.73 54.98 2r7h s ARG 172 Cb -0.12 -2.45 0.02 0.00 -1.56 0.00 0.00 34.95 30.85 2r7h s ARG 172 CO 0.02 0.37 -0.12 -1.17 -0.81 0.00 0.00 175.30 173.59 2r7h s LEU 173 N -0.09 1.56 -0.17 -0.88 2.96 0.34 -1.28 118.68 121.12 2r7h s LEU 173 Ca -0.03 -0.45 -0.26 0.00 -0.22 0.00 0.00 54.13 53.17 2r7h s LEU 173 Cb -0.14 -1.09 -0.01 0.00 0.50 0.00 0.00 46.19 45.45 2r7h s LEU 173 CO 0.04 -0.08 0.89 -1.61 -1.32 0.00 0.00 176.35 174.27 2r7h s GLU 174 N 1.55 4.31 -0.02 1.98 2.02 -1.26 -0.97 118.70 126.30 2r7h s GLU 174 Ca 0.05 1.12 0.22 0.00 0.02 0.00 0.00 54.97 56.38 2r7h s GLU 174 Cb -0.13 -3.58 -0.30 0.00 0.10 0.00 0.00 34.13 30.22 2r7h s GLU 174 CO -0.10 -0.38 0.58 0.28 0.02 0.00 0.00 175.26 175.66 2r7h n VAL 175 N 4.81 0.02 -1.55 2.63 0.31 0.59 -4.98 118.33 120.16 2r7h n VAL 175 Ca 0.06 -0.42 0.00 0.00 -0.01 0.00 0.00 64.34 63.97 2r7h n VAL 175 Cb 0.48 0.15 0.00 0.00 -0.91 0.00 0.00 33.84 33.56 2r7h n VAL 175 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51