#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xxh s ARG 3 N 0.00 4.19 0.24 0.38 0.52 -1.26 -1.98 118.95 121.04 1xxh s ARG 3 Ca 0.00 0.37 -0.22 0.00 -0.52 0.00 0.00 55.73 55.36 1xxh s ARG 3 Cb 0.00 -3.37 0.03 0.00 0.52 0.00 0.00 34.95 32.14 1xxh s ARG 3 CO 0.00 0.34 0.73 -0.48 0.02 0.00 0.00 175.30 175.92 1xxh s LEU 4 N 0.05 -0.30 0.46 2.53 0.05 -0.85 -4.99 118.68 115.63 1xxh s LEU 4 Ca 0.23 -0.48 -0.04 0.00 0.05 0.00 0.00 54.13 53.89 1xxh s LEU 4 Cb -0.15 2.63 -0.03 0.00 -2.05 0.00 0.00 46.19 46.59 1xxh s LEU 4 CO 0.10 -1.23 0.75 -0.31 -0.55 0.00 0.00 176.35 175.11 1xxh s TYR 5 N -3.81 3.53 0.25 3.48 1.51 -1.26 -1.99 117.35 119.06 1xxh s TYR 5 Ca 0.10 0.72 -0.11 0.00 -1.01 0.00 0.00 57.07 56.76 1xxh s TYR 5 Cb -0.05 -2.26 0.35 0.00 -0.11 0.00 0.00 41.96 39.90 1xxh s TYR 5 CO 0.03 -0.24 1.59 -1.35 -1.11 0.00 0.00 175.55 174.47 1xxh h PRO 6 N 0.29 -0.00 -0.72 -1.71 0.11 -1.90 -1.15 132.00 126.92 1xxh h PRO 6 Ca -0.47 0.00 0.16 0.00 0.11 0.00 0.00 66.00 65.80 1xxh h PRO 6 Cb 1.21 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 1xxh h PRO 6 CO 0.61 -0.00 0.49 0.93 -0.21 0.00 0.00 178.00 179.82 1xxh h GLU 7 N -0.00 0.30 0.00 1.05 3.07 -1.96 -0.99 114.58 116.05 1xxh h GLU 7 Ca 0.39 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.24 1xxh h GLU 7 Cb 0.60 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.45 1xxh h GLU 7 CO -0.85 0.20 -0.44 1.04 -1.40 0.00 0.00 179.01 177.55 1xxh n GLN 8 N -4.45 0.27 -0.04 2.33 6.02 -0.45 -4.24 117.38 116.83 1xxh n GLN 8 Ca 0.14 0.12 -0.10 0.00 -0.01 0.00 0.00 57.00 57.15 1xxh n GLN 8 Cb 0.58 -1.71 -0.04 0.00 1.02 0.00 0.00 30.24 30.08 1xxh n GLN 8 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1xxh h LEU 9 N 0.00 -1.13 -1.10 1.08 5.85 -1.00 0.12 115.31 119.13 1xxh h LEU 9 Ca 0.00 0.17 0.15 0.00 0.84 0.00 0.00 57.88 59.04 1xxh h LEU 9 Cb 0.74 0.49 -0.09 0.00 0.37 0.00 0.00 40.66 42.17 1xxh h LEU 9 CO 0.00 -0.37 0.61 0.03 -0.34 0.00 0.00 178.44 178.38 1xxh h ARG 10 N -0.38 0.80 -0.03 1.25 -0.00 -1.74 0.29 114.38 114.58 1xxh h ARG 10 Ca 0.11 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.98 59.54 1xxh h ARG 10 Cb 0.57 -0.18 -0.00 0.00 0.00 0.00 0.00 29.97 30.36 1xxh h ARG 10 CO -0.43 0.53 0.01 0.00 0.00 0.00 0.00 179.97 180.08 1xxh h ALA 11 N 1.59 0.03 -0.48 0.04 0.00 -1.37 -3.08 119.26 115.99 1xxh h ALA 11 Ca 0.51 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 1xxh h ALA 11 Cb 0.72 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1xxh h ALA 11 CO -0.29 -0.35 0.26 0.37 0.00 0.00 0.00 179.25 179.24 1xxh h GLN 12 N -0.17 0.67 -0.83 0.00 -0.00 0.30 -2.79 115.11 112.29 1xxh h GLN 12 Ca 0.01 -0.08 0.20 0.00 -0.00 0.00 0.00 58.65 58.78 1xxh h GLN 12 Cb 0.22 -0.13 -0.13 0.00 0.00 0.00 0.00 27.48 27.45 1xxh h GLN 12 CO -0.00 0.54 0.24 1.25 0.00 0.00 0.00 178.83 180.85 1xxh h LEU 13 N 0.63 0.05 -0.01 -2.39 5.85 -0.45 -2.61 115.31 116.39 1xxh h LEU 13 Ca 0.17 0.17 0.00 0.00 0.84 0.00 0.00 57.88 59.06 1xxh h LEU 13 Cb 0.07 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1xxh h LEU 13 CO -0.03 -0.08 -0.08 0.78 -0.34 0.00 0.00 178.44 178.69 1xxh h ASN 14 N 0.26 -0.26 -0.43 1.25 4.21 -1.41 -1.87 115.58 117.34 1xxh h ASN 14 Ca 0.50 0.03 0.12 0.00 1.21 0.00 0.00 56.30 58.16 1xxh h ASN 14 Cb 0.94 0.10 -0.02 0.00 -1.12 0.00 0.00 38.32 38.22 1xxh h ASN 14 CO -0.58 -0.08 1.04 -0.62 -1.29 0.00 0.00 177.43 175.89 1xxh n GLU 15 N -2.98 0.02 0.00 0.81 1.02 -0.99 -4.73 120.64 113.79 1xxh n GLU 15 Ca -0.01 0.92 0.00 0.00 -0.02 0.00 0.00 57.16 58.05 1xxh n GLU 15 Cb 0.06 -2.41 0.00 0.00 -0.02 0.00 0.00 31.44 29.08 1xxh n GLU 15 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xxh n GLY 16 N -1.54 1.26 3.68 0.62 0.00 -0.70 -5.12 105.19 103.40 1xxh n GLY 16 Ca 0.10 -1.40 -0.35 0.00 0.00 0.00 0.00 46.02 44.37 1xxh n GLY 16 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xxh s LEU 17 N 0.00 3.78 0.17 0.99 2.96 -1.26 -4.39 118.68 120.92 1xxh s LEU 17 Ca 0.00 0.15 0.04 0.00 -0.22 0.00 0.00 54.13 54.10 1xxh s LEU 17 Cb 0.00 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.74 1xxh s LEU 17 CO 0.00 0.28 0.20 -0.13 -1.32 0.00 0.00 176.35 175.39 1xxh s ARG 18 N -0.30 3.12 0.27 1.98 1.81 -1.26 -5.03 118.95 119.54 1xxh s ARG 18 Ca 0.08 -0.78 -0.05 0.00 -1.72 0.00 0.00 55.73 53.26 1xxh s ARG 18 Cb -0.12 -2.77 0.50 0.00 -0.45 0.00 0.00 34.95 32.11 1xxh s ARG 18 CO 0.02 0.49 1.44 0.00 -0.68 0.00 0.00 175.30 176.57 1xxh n ALA 19 N -0.52 0.28 -3.28 2.13 0.00 -1.26 -4.67 120.51 113.19 1xxh n ALA 19 Ca -0.08 1.01 -0.14 0.00 0.00 0.00 0.00 53.44 54.23 1xxh n ALA 19 Cb 0.55 -0.64 -0.08 0.00 0.00 0.00 0.00 19.45 19.28 1xxh n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xxh s ALA 20 N -6.10 -1.01 -0.21 0.00 0.00 -1.26 -2.71 121.76 110.47 1xxh s ALA 20 Ca -0.13 0.53 0.01 0.00 0.00 0.00 0.00 51.96 52.36 1xxh s ALA 20 Cb 0.26 0.09 0.03 0.00 0.00 0.00 0.00 23.12 23.50 1xxh s ALA 20 CO 0.72 -0.31 -0.16 0.71 0.00 0.00 0.00 175.76 176.73 1xxh s TYR 21 N -1.44 2.93 -0.49 0.00 1.51 0.44 -2.43 117.35 117.87 1xxh s TYR 21 Ca -0.12 -1.76 -0.18 0.00 -1.01 0.00 0.00 57.07 54.00 1xxh s TYR 21 Cb -0.04 -1.94 0.06 0.00 -0.11 0.00 0.00 41.96 39.93 1xxh s TYR 21 CO 0.05 -0.81 0.53 -0.51 -1.11 0.00 0.00 175.55 173.70 1xxh s LEU 22 N 1.26 5.20 -0.67 -1.29 1.43 -0.16 -1.25 118.68 123.21 1xxh s LEU 22 Ca 0.01 -1.05 -0.18 0.00 -1.03 0.00 0.00 54.13 51.89 1xxh s LEU 22 Cb -0.15 -2.35 0.13 0.00 0.03 0.00 0.00 46.19 43.86 1xxh s LEU 22 CO -0.10 -0.79 0.75 -0.76 0.23 0.00 0.00 176.35 175.68 1xxh s LEU 23 N 2.24 5.71 -0.13 1.79 1.43 -0.08 -0.91 118.68 128.72 1xxh s LEU 23 Ca 0.11 -1.80 -0.02 0.00 -1.03 0.00 0.00 54.13 51.40 1xxh s LEU 23 Cb -0.21 -2.29 -0.02 0.00 0.03 0.00 0.00 46.19 43.70 1xxh s LEU 23 CO 0.10 -0.98 -0.08 -0.76 0.23 0.00 0.00 176.35 174.87 1xxh s LEU 24 N 2.08 3.04 0.00 1.79 1.43 -1.22 -1.77 118.68 124.03 1xxh s LEU 24 Ca 0.14 -0.18 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 1xxh s LEU 24 Cb -0.20 -1.70 0.00 0.00 0.03 0.00 0.00 46.19 44.32 1xxh s LEU 24 CO 0.01 0.20 0.00 0.61 0.23 0.00 0.00 176.35 177.40 1xxh n GLY 25 N 3.30 -1.85 0.00 -3.19 0.00 0.41 0.23 105.19 104.10 1xxh n GLY 25 Ca -0.18 -1.44 0.03 0.00 0.00 0.00 0.00 46.02 44.44 1xxh n GLY 25 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1xxh n ASN 26 N 3.00 1.14 -4.66 1.61 0.23 -0.70 -2.98 115.26 112.90 1xxh n ASN 26 Ca 0.00 -0.49 -0.42 0.00 -0.53 0.00 0.00 54.58 53.14 1xxh n ASN 26 Cb 0.00 1.09 -0.03 0.00 -2.08 0.00 0.00 39.78 38.76 1xxh n ASN 26 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1xxh s ASP 27 N -1.96 6.68 0.12 0.53 2.15 -1.22 -4.92 116.67 118.05 1xxh s ASP 27 Ca 0.01 2.23 -0.26 0.00 0.43 0.00 0.00 52.55 54.97 1xxh s ASP 27 Cb 0.05 -2.54 -0.05 0.00 -0.30 0.00 0.00 42.92 40.09 1xxh s ASP 27 CO 0.29 -0.91 1.63 -0.65 -0.17 0.00 0.00 175.17 175.36 1xxh h PRO 28 N 9.34 -0.39 -0.22 4.34 0.11 -1.94 -3.04 132.00 140.21 1xxh h PRO 28 Ca -0.39 0.03 -0.20 0.00 0.11 0.00 0.00 66.00 65.54 1xxh h PRO 28 Cb 1.18 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1xxh h PRO 28 CO 0.95 -0.26 -0.66 1.37 -0.21 0.00 0.00 178.00 179.19 1xxh h LEU 29 N -0.40 0.95 -0.36 2.35 -0.00 -1.95 -2.53 115.31 113.37 1xxh h LEU 29 Ca 0.07 -0.57 0.03 0.00 -0.00 0.00 0.00 57.88 57.41 1xxh h LEU 29 Cb 0.49 -0.28 -0.04 0.00 -0.00 0.00 0.00 40.66 40.84 1xxh h LEU 29 CO -0.24 1.37 0.15 -0.07 -0.00 0.00 0.00 178.44 179.65 1xxh h LEU 30 N 0.60 0.20 -0.16 0.17 3.38 -1.96 1.22 115.31 118.77 1xxh h LEU 30 Ca -0.02 0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.03 1xxh h LEU 30 Cb 1.28 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.96 1xxh h LEU 30 CO 0.14 0.15 -0.26 -0.07 0.09 0.00 0.00 178.44 178.50 1xxh h LEU 31 N 0.32 -0.81 0.16 1.67 3.38 -1.56 0.69 115.31 119.17 1xxh h LEU 31 Ca 0.16 0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 1xxh h LEU 31 Cb 0.10 0.36 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1xxh h LEU 31 CO -0.14 -0.30 -0.25 1.56 0.09 0.00 0.00 178.44 179.40 1xxh h GLN 32 N -0.31 -0.42 -0.62 1.13 1.08 -0.80 0.18 115.11 115.35 1xxh h GLN 32 Ca 0.11 0.03 0.08 0.00 -1.45 0.00 0.00 58.65 57.41 1xxh h GLN 32 Cb 0.48 0.09 -0.10 0.00 -0.05 0.00 0.00 27.48 27.90 1xxh h GLN 32 CO -0.34 -0.28 -0.52 0.93 -0.95 0.00 0.00 178.83 177.68 1xxh h GLU 33 N -0.43 -0.23 -0.98 1.46 5.08 0.20 0.18 114.58 119.86 1xxh h GLU 33 Ca -0.02 0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.44 1xxh h GLU 33 Cb 0.40 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.63 1xxh h GLU 33 CO -0.08 -0.15 0.62 0.77 -1.00 0.00 0.00 179.01 179.17 1xxh h SER 34 N -0.24 0.97 0.36 1.42 0.02 0.48 0.90 113.55 117.45 1xxh h SER 34 Ca 0.14 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 1xxh h SER 34 Cb 0.55 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 1xxh h SER 34 CO -0.72 0.59 -0.26 -0.61 -1.14 0.00 0.00 176.83 174.69 1xxh h GLN 35 N 1.08 -0.57 -0.20 3.45 4.15 0.21 -1.56 115.11 121.67 1xxh h GLN 35 Ca 0.44 0.04 0.06 0.00 0.77 0.00 0.00 58.65 59.96 1xxh h GLN 35 Cb 0.27 0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.08 1xxh h GLN 35 CO -0.20 -0.38 0.18 -0.44 -1.93 0.00 0.00 178.83 176.05 1xxh h ASP 36 N -0.59 0.00 -0.05 -0.69 3.32 -0.57 0.17 116.42 118.01 1xxh h ASP 36 Ca -0.05 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.92 1xxh h ASP 36 Cb 0.49 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 1xxh h ASP 36 CO 0.02 0.00 -0.21 0.00 -1.72 0.00 0.00 179.24 177.34 1xxh h ALA 37 N 1.83 1.19 0.24 3.45 0.00 -0.40 -0.13 119.26 125.46 1xxh h ALA 37 Ca 0.09 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1xxh h ALA 37 Cb 0.45 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1xxh h ALA 37 CO -0.00 0.52 -0.12 0.28 0.00 0.00 0.00 179.25 179.93 1xxh h VAL 38 N 0.40 0.00 -0.99 0.00 2.07 0.34 -3.30 116.25 114.76 1xxh h VAL 38 Ca 0.07 -0.29 0.21 0.00 0.82 0.00 0.00 66.70 67.51 1xxh h VAL 38 Cb 0.59 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.24 1xxh h VAL 38 CO 0.04 0.00 0.59 0.03 0.02 0.00 0.00 177.57 178.25 1xxh h ARG 39 N -0.61 0.66 -0.84 1.57 3.08 -1.45 0.19 114.38 116.97 1xxh h ARG 39 Ca -0.03 -0.04 0.24 0.00 0.07 0.00 0.00 59.98 60.22 1xxh h ARG 39 Cb 0.25 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 1xxh h ARG 39 CO 0.06 0.44 0.66 0.37 -1.07 0.00 0.00 179.97 180.42 1xxh h GLN 40 N 0.68 0.00 0.00 0.04 4.15 -1.09 0.32 115.11 119.21 1xxh h GLN 40 Ca 0.60 0.00 0.00 0.00 0.77 0.00 0.00 58.65 60.02 1xxh h GLN 40 Cb 1.02 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.71 1xxh h GLN 40 CO -0.42 0.00 -1.33 0.28 -1.93 0.00 0.00 178.83 175.43 1xxh n VAL 41 N -4.08 0.04 -0.07 2.39 0.31 0.62 -3.87 118.33 113.67 1xxh n VAL 41 Ca 0.17 -0.22 -0.09 0.00 -0.01 0.00 0.00 64.34 64.19 1xxh n VAL 41 Cb 0.96 0.47 -0.06 0.00 -0.91 0.00 0.00 33.84 34.31 1xxh n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xxh h ALA 42 N 2.56 0.05 -0.16 3.52 0.00 0.03 -3.20 119.26 122.06 1xxh h ALA 42 Ca 0.00 -0.49 0.05 0.00 0.00 0.00 0.00 54.91 54.46 1xxh h ALA 42 Cb 0.72 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1xxh h ALA 42 CO 0.00 0.29 0.15 0.00 0.00 0.00 0.00 179.25 179.68 1xxh h ALA 43 N -0.69 1.91 0.00 0.00 0.00 -1.34 1.83 119.26 120.97 1xxh h ALA 43 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1xxh h ALA 43 Cb 0.62 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1xxh h ALA 43 CO -0.04 -0.23 0.00 0.00 0.00 0.00 0.00 179.25 178.97 1xxh n ALA 44 N -2.43 2.28 0.03 0.00 0.00 -1.24 -3.81 120.51 115.34 1xxh n ALA 44 Ca 0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 53.44 53.34 1xxh n ALA 44 Cb 0.27 -1.26 -0.00 0.00 0.00 0.00 0.00 19.45 18.46 1xxh n ALA 44 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1xxh n GLN 45 N -0.87 0.05 0.00 0.00 1.13 0.61 -5.02 117.38 113.29 1xxh n GLN 45 Ca 0.12 0.02 0.00 0.00 -1.94 0.00 0.00 57.00 55.20 1xxh n GLN 45 Cb 0.06 -0.53 0.00 0.00 0.11 0.00 0.00 30.24 29.88 1xxh n GLN 45 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1xxh n GLY 46 N 3.28 0.00 3.35 1.08 0.00 -0.48 -5.08 105.19 107.33 1xxh n GLY 46 Ca -0.01 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.54 1xxh n GLY 46 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xxh s PHE 47 N 0.00 3.73 -0.11 1.61 0.40 -1.04 -4.30 117.98 118.26 1xxh s PHE 47 Ca 0.00 -1.98 -0.05 0.00 -0.60 0.00 0.00 56.93 54.29 1xxh s PHE 47 Cb 0.00 -3.88 -0.04 0.00 0.51 0.00 0.00 43.02 39.60 1xxh s PHE 47 CO 0.00 -1.05 0.10 0.93 0.70 0.00 0.00 175.22 175.90 1xxh h GLU 48 N 7.81 0.00 -6.74 0.44 5.08 -1.89 -3.29 114.58 115.98 1xxh h GLU 48 Ca 0.12 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.96 1xxh h GLU 48 Cb 1.02 0.00 0.07 0.00 0.50 0.00 0.00 28.75 30.35 1xxh h GLU 48 CO 0.82 0.16 0.91 -1.21 -1.00 0.00 0.00 179.01 178.69 1xxh s GLU 49 N -1.73 4.14 -0.04 2.33 2.02 -1.25 -4.97 118.70 119.20 1xxh s GLU 49 Ca -0.05 2.54 0.01 0.00 0.02 0.00 0.00 54.97 57.50 1xxh s GLU 49 Cb -0.00 -3.05 0.02 0.00 0.10 0.00 0.00 34.13 31.19 1xxh s GLU 49 CO 0.13 -0.64 -0.06 -1.01 0.02 0.00 0.00 175.26 173.70 1xxh s HIS 50 N 0.39 0.79 0.18 1.61 3.76 -1.26 -2.03 115.29 118.74 1xxh s HIS 50 Ca 0.66 -0.22 0.08 0.00 -0.15 0.00 0.00 55.06 55.43 1xxh s HIS 50 Cb -0.47 -0.66 -0.04 0.00 1.11 0.00 0.00 32.58 32.51 1xxh s HIS 50 CO 0.42 -0.17 -0.15 -1.01 -0.85 0.00 0.00 174.74 172.98 1xxh s HIS 51 N 0.71 1.69 -0.18 1.40 3.76 0.37 -4.90 115.29 118.15 1xxh s HIS 51 Ca -0.10 -0.55 -0.05 0.00 -0.15 0.00 0.00 55.06 54.22 1xxh s HIS 51 Cb -0.13 -0.81 0.09 0.00 1.11 0.00 0.00 32.58 32.84 1xxh s HIS 51 CO 0.01 0.32 0.31 0.95 -0.85 0.00 0.00 174.74 175.48 1xxh s THR 52 N -2.65 -0.49 -0.14 1.30 -4.23 -1.26 -0.30 115.64 107.88 1xxh s THR 52 Ca 0.19 0.12 0.00 0.00 -1.18 0.00 0.00 61.69 60.82 1xxh s THR 52 Cb -0.02 -0.60 0.02 0.00 1.34 0.00 0.00 72.50 73.23 1xxh s THR 52 CO 0.06 0.00 -0.12 -0.36 -0.54 0.00 0.00 174.62 173.66 1xxh s PHE 53 N 2.47 1.95 0.15 3.99 0.40 -0.26 -4.93 117.98 121.74 1xxh s PHE 53 Ca 0.04 -1.06 -0.30 0.00 -0.60 0.00 0.00 56.93 55.01 1xxh s PHE 53 Cb -0.13 -1.48 -0.07 0.00 0.51 0.00 0.00 43.02 41.85 1xxh s PHE 53 CO -0.11 -0.61 0.99 -1.54 0.70 0.00 0.00 175.22 174.65 1xxh s SER 54 N 1.51 7.46 -0.55 1.36 1.04 -1.26 -1.46 113.70 121.80 1xxh s SER 54 Ca 0.04 1.89 -0.22 0.00 0.48 0.00 0.00 55.95 58.14 1xxh s SER 54 Cb -0.13 -2.60 0.05 0.00 0.10 0.00 0.00 66.02 63.45 1xxh s SER 54 CO -0.09 -0.07 0.84 -0.63 0.98 0.00 0.00 173.24 174.27 1xxh s ILE 55 N -0.23 4.54 -0.02 -1.02 1.01 0.47 -4.84 121.20 121.11 1xxh s ILE 55 Ca 0.47 -0.05 -0.01 0.00 0.00 0.00 0.00 60.65 61.05 1xxh s ILE 55 Cb -0.25 -4.48 0.00 0.00 0.01 0.00 0.00 42.46 37.74 1xxh s ILE 55 CO 0.31 -1.06 0.04 -1.81 0.00 0.00 0.00 174.94 172.43 1xxh s ASP 56 N 2.90 -0.04 0.37 3.58 1.01 -1.26 -2.75 116.67 120.48 1xxh s ASP 56 Ca 0.24 0.09 0.08 0.00 0.71 0.00 0.00 52.55 53.67 1xxh s ASP 56 Cb -0.15 0.09 0.43 0.00 1.01 0.00 0.00 42.92 44.29 1xxh s ASP 56 CO 0.16 -0.02 1.09 1.55 0.21 0.00 0.00 175.17 178.16 1xxh h PRO 57 N 6.10 0.00 -0.67 8.23 0.13 -2.01 -1.04 132.00 142.74 1xxh h PRO 57 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1xxh h PRO 57 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1xxh h PRO 57 CO 0.48 0.00 0.00 -1.71 -0.23 0.00 0.00 178.00 176.54 1xxh n ASN 58 N -2.02 4.08 -4.66 1.44 4.05 -1.26 -4.99 115.26 111.90 1xxh n ASN 58 Ca -0.01 -2.20 -0.29 0.00 0.45 0.00 0.00 54.58 52.53 1xxh n ASN 58 Cb 0.55 -0.51 0.18 0.00 1.23 0.00 0.00 39.78 41.23 1xxh n ASN 58 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 1xxh s THR 59 N -1.45 2.21 -1.10 -0.44 2.01 -0.40 -4.96 115.64 111.52 1xxh s THR 59 Ca 0.47 0.07 -0.06 0.00 0.31 0.00 0.00 61.69 62.48 1xxh s THR 59 Cb 0.27 -2.48 0.30 0.00 0.01 0.00 0.00 72.50 70.60 1xxh s THR 59 CO 0.27 -0.09 1.35 0.47 -0.69 0.00 0.00 174.62 175.93 1xxh n ASP 60 N -4.22 6.08 0.21 3.53 9.92 -1.26 -4.91 116.55 125.90 1xxh n ASP 60 Ca 0.05 -3.27 0.15 0.00 -0.53 0.00 0.00 54.79 51.19 1xxh n ASP 60 Cb 0.56 -1.32 0.73 0.00 -0.64 0.00 0.00 41.12 40.46 1xxh n ASP 60 CO 0.00 0.00 0.00 -0.50 0.13 0.00 0.00 177.20 176.83 1xxh h TRP 61 N 5.90 0.00 -0.30 1.24 4.06 -1.98 -2.61 115.95 122.26 1xxh h TRP 61 Ca 0.19 0.00 -0.15 0.00 2.06 0.00 0.00 58.89 60.99 1xxh h TRP 61 Cb 0.71 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.86 1xxh h TRP 61 CO 0.92 0.00 -0.44 -0.91 -3.56 0.00 0.00 178.44 174.45 1xxh h ASN 62 N 0.00 0.81 0.25 -3.49 2.35 -1.99 -1.08 115.58 112.43 1xxh h ASN 62 Ca 0.00 -0.39 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 1xxh h ASN 62 Cb 0.15 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.26 1xxh h ASN 62 CO 0.00 1.13 -0.44 0.00 -1.65 0.00 0.00 177.43 176.47 1xxh h ALA 63 N 0.90 -1.00 0.00 -0.83 0.00 -1.89 -1.73 119.26 114.70 1xxh h ALA 63 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1xxh h ALA 63 Cb 0.99 0.76 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 1xxh h ALA 63 CO 0.09 -1.08 -0.09 0.82 0.00 0.00 0.00 179.25 179.00 1xxh h ILE 64 N -0.74 0.00 -0.85 0.00 2.04 -1.61 -1.93 117.51 114.42 1xxh h ILE 64 Ca -0.03 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.04 1xxh h ILE 64 Cb 0.69 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.62 1xxh h ILE 64 CO -0.16 0.00 0.01 0.15 0.00 0.00 0.00 178.15 178.15 1xxh h PHE 65 N -0.11 -0.06 0.00 1.37 3.57 -1.20 0.08 116.94 120.59 1xxh h PHE 65 Ca 0.00 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.56 1xxh h PHE 65 Cb 0.12 0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.02 1xxh h PHE 65 CO -0.38 -0.31 0.00 0.66 -2.23 0.00 0.00 178.31 176.05 1xxh h SER 66 N 0.08 0.00 1.47 0.41 4.64 -1.21 -2.99 113.55 115.95 1xxh h SER 66 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 1xxh h SER 66 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1xxh h SER 66 CO -0.77 0.00 0.00 -0.07 -0.87 0.00 0.00 176.83 175.12 1xxh h LEU 67 N 0.00 0.00 0.00 5.97 3.38 -0.15 -3.11 115.31 121.40 1xxh h LEU 67 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xxh h LEU 67 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1xxh h LEU 67 CO 0.00 0.00 -0.58 0.00 0.09 0.00 0.00 178.44 177.95 1xxh h GLN 69 N 0.00 0.00 0.00 0.00 4.20 -1.45 -3.48 115.11 114.37 1xxh h GLN 69 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1xxh h GLN 69 Cb 0.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.03 1xxh h GLN 69 CO 0.00 0.30 0.00 0.00 -0.67 0.00 0.00 178.83 178.46 1xxh n ALA 70 N -2.31 0.00 -2.79 3.87 0.00 -1.21 -5.10 120.51 112.97 1xxh n ALA 70 Ca -0.01 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.28 1xxh n ALA 70 Cb 0.42 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.74 1xxh n ALA 70 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1xxh s SER 72 N -1.00 0.88 0.40 0.00 0.15 -1.26 -5.04 113.70 107.84 1xxh s SER 72 Ca 0.00 -0.35 0.17 0.00 0.70 0.00 0.00 55.95 56.47 1xxh s SER 72 Cb 0.00 -0.03 0.86 0.00 -1.71 0.00 0.00 66.02 65.14 1xxh s SER 72 CO 0.00 -0.06 1.86 -0.07 1.20 0.00 0.00 173.24 176.17 1xxh h LEU 73 N 5.18 0.00 -3.35 3.45 3.38 -2.07 -2.90 115.31 119.00 1xxh h LEU 73 Ca -0.33 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.55 1xxh h LEU 73 Cb 1.19 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.89 1xxh h LEU 73 CO 0.45 0.32 0.02 0.49 0.09 0.00 0.00 178.44 179.81 1xxh n PHE 74 N -3.88 1.17 -0.70 1.13 3.01 -1.26 -4.96 117.46 111.98 1xxh n PHE 74 Ca -0.02 -1.15 -0.03 0.00 1.01 0.00 0.00 57.45 57.27 1xxh n PHE 74 Cb 0.39 -0.42 -0.01 0.00 -0.01 0.00 0.00 39.48 39.44 1xxh n PHE 74 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1xxh n ALA 75 N -0.70 -0.04 -1.75 4.37 0.00 -1.10 -4.88 120.51 116.42 1xxh n ALA 75 Ca 0.28 0.04 -0.38 0.00 0.00 0.00 0.00 53.44 53.38 1xxh n ALA 75 Cb 1.00 -0.85 0.04 0.00 0.00 0.00 0.00 19.45 19.64 1xxh n ALA 75 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1xxh s SER 76 N -1.22 5.24 0.00 0.00 1.04 -1.26 -4.96 113.70 112.54 1xxh s SER 76 Ca 0.00 2.66 0.00 0.00 0.48 0.00 0.00 55.95 59.09 1xxh s SER 76 Cb 0.00 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.49 1xxh s SER 76 CO 0.00 -1.58 0.00 -2.11 0.98 0.00 0.00 173.24 170.53 1xxh n ARG 77 N -1.18 3.01 -3.83 4.02 1.85 -1.26 -4.63 116.66 114.64 1xxh n ARG 77 Ca 0.11 0.00 -0.07 0.00 -1.00 0.00 0.00 57.85 56.89 1xxh n ARG 77 Cb 0.46 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.87 1xxh n ARG 77 CO 0.00 0.00 0.00 1.14 -0.01 0.00 0.00 177.63 178.76 1xxh s GLN 78 N 1.14 1.85 -0.33 2.89 -2.07 -1.26 -3.88 119.66 118.02 1xxh s GLN 78 Ca 0.00 -1.11 -0.01 0.00 -1.82 0.00 0.00 55.36 52.42 1xxh s GLN 78 Cb 0.00 0.57 0.11 0.00 -1.09 0.00 0.00 33.01 32.60 1xxh s GLN 78 CO 0.00 -0.86 0.13 0.99 -1.32 0.00 0.00 175.29 174.24 1xxh s THR 79 N -3.11 0.72 -0.15 3.63 2.01 -0.86 -2.55 115.64 115.33 1xxh s THR 79 Ca 0.14 -1.49 -0.28 0.00 0.31 0.00 0.00 61.69 60.37 1xxh s THR 79 Cb -0.05 -1.54 -0.01 0.00 0.01 0.00 0.00 72.50 70.91 1xxh s THR 79 CO 0.08 -0.75 0.94 -0.22 -0.69 0.00 0.00 174.62 173.98 1xxh s LEU 80 N 1.46 4.20 -0.42 4.42 2.96 -0.54 -0.48 118.68 130.29 1xxh s LEU 80 Ca 0.12 1.38 0.00 0.00 -0.22 0.00 0.00 54.13 55.41 1xxh s LEU 80 Cb -0.19 -3.43 0.11 0.00 0.50 0.00 0.00 46.19 43.19 1xxh s LEU 80 CO -0.21 -0.46 0.18 -0.22 -1.32 0.00 0.00 176.35 174.32 1xxh s LEU 81 N 2.21 4.97 0.01 -0.68 2.96 0.59 -1.50 118.68 127.24 1xxh s LEU 81 Ca 0.44 -2.27 -0.29 0.00 -0.22 0.00 0.00 54.13 51.79 1xxh s LEU 81 Cb -0.17 -1.74 -0.04 0.00 0.50 0.00 0.00 46.19 44.74 1xxh s LEU 81 CO 0.14 -0.43 0.93 -0.76 -1.32 0.00 0.00 176.35 174.91 1xxh s LEU 82 N 0.77 4.39 -0.48 -0.68 1.02 -0.94 -1.10 118.68 121.65 1xxh s LEU 82 Ca 0.11 1.62 -0.14 0.00 0.02 0.00 0.00 54.13 55.73 1xxh s LEU 82 Cb -0.21 -3.50 0.09 0.00 0.02 0.00 0.00 46.19 42.59 1xxh s LEU 82 CO -0.05 -0.19 0.40 -0.76 0.02 0.00 0.00 176.35 175.77 1xxh s LEU 83 N 0.74 5.71 0.66 1.79 1.43 -0.54 -1.40 118.68 127.08 1xxh s LEU 83 Ca 0.49 -1.51 -0.18 0.00 -1.03 0.00 0.00 54.13 51.90 1xxh s LEU 83 Cb -0.21 -2.15 -0.00 0.00 0.03 0.00 0.00 46.19 43.86 1xxh s LEU 83 CO 0.27 -0.69 1.27 -0.22 0.23 0.00 0.00 176.35 177.21 1xxh s LEU 84 N 1.58 3.53 1.26 1.79 2.96 0.89 0.18 118.68 130.88 1xxh s LEU 84 Ca 0.04 2.56 -0.19 0.00 -0.22 0.00 0.00 54.13 56.32 1xxh s LEU 84 Cb -0.26 -4.61 0.28 0.00 0.50 0.00 0.00 46.19 42.10 1xxh s LEU 84 CO 0.05 -2.03 0.66 -2.65 -1.32 0.00 0.00 176.35 171.05 1xxh n PRO 85 N -2.03 -3.38 -0.04 0.98 -0.02 -1.11 -4.70 135.00 124.70 1xxh n PRO 85 Ca 0.15 -0.99 -0.13 0.00 -2.02 0.00 0.00 63.50 60.51 1xxh n PRO 85 Cb 0.49 -1.84 -0.08 0.00 -0.02 0.00 0.00 33.50 32.05 1xxh n PRO 85 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1xxh h GLU 86 N -3.04 0.22 0.00 -0.52 4.81 -1.93 -3.22 114.58 110.89 1xxh h GLU 86 Ca -0.43 -0.12 -0.20 0.00 -0.13 0.00 0.00 59.36 58.47 1xxh h GLU 86 Cb 1.20 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.56 1xxh h GLU 86 CO 0.30 0.67 -0.95 -0.91 -0.73 0.00 0.00 179.01 177.38 1xxh h ASN 87 N -0.22 0.00 -5.00 1.04 2.35 -1.97 -3.45 115.58 108.33 1xxh h ASN 87 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1xxh h ASN 87 Cb 0.63 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1xxh h ASN 87 CO 0.02 0.95 0.00 0.61 -1.65 0.00 0.00 177.43 177.37 1xxh n GLY 88 N 1.33 2.20 3.49 2.83 0.00 -1.22 -4.95 105.19 108.87 1xxh n GLY 88 Ca 0.00 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 1xxh n GLY 88 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1xxh n PRO 89 N 0.98 0.62 0.00 1.61 -0.02 -1.26 -4.77 135.00 132.16 1xxh n PRO 89 Ca 0.00 0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 1xxh n PRO 89 Cb 0.00 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.07 1xxh n PRO 89 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1xxh n ASN 90 N 12.11 -0.05 -0.02 2.55 0.23 -1.26 -4.78 115.26 124.04 1xxh n ASN 90 Ca 0.50 -0.02 -0.17 0.00 -0.53 0.00 0.00 54.58 54.35 1xxh n ASN 90 Cb 0.25 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 37.88 1xxh n ASN 90 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1xxh h ALA 91 N -2.00 0.27 0.00 -2.53 0.00 -2.01 -3.15 119.26 109.84 1xxh h ALA 91 Ca 0.00 -0.59 -0.03 0.00 0.00 0.00 0.00 54.91 54.29 1xxh h ALA 91 Cb 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1xxh h ALA 91 CO 0.00 0.62 -0.15 0.00 0.00 0.00 0.00 179.25 179.72 1xxh h ALA 92 N 0.52 1.05 -0.29 0.00 0.00 -2.01 -2.63 119.26 115.91 1xxh h ALA 92 Ca -0.06 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1xxh h ALA 92 Cb 1.38 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1xxh h ALA 92 CO 0.15 0.19 0.00 -0.89 0.00 0.00 0.00 179.25 178.70 1xxh n ILE 93 N -3.35 0.37 0.34 0.00 5.41 -1.22 -3.18 119.36 117.74 1xxh n ILE 93 Ca -0.00 -0.53 0.12 0.00 1.00 0.00 0.00 62.75 63.34 1xxh n ILE 93 Cb 0.36 0.61 0.24 0.00 -0.71 0.00 0.00 39.64 40.13 1xxh n ILE 93 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 1xxh h ASN 94 N 3.16 0.00 0.00 4.38 2.35 -1.42 -3.18 115.58 120.87 1xxh h ASN 94 Ca 0.00 -0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.51 1xxh h ASN 94 Cb 0.70 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.03 1xxh h ASN 94 CO 0.00 0.00 -1.74 -0.62 -1.65 0.00 0.00 177.43 173.42 1xxh n GLU 95 N -2.83 0.56 -0.40 0.81 1.02 -1.24 -3.47 120.64 115.09 1xxh n GLU 95 Ca 0.04 0.27 0.39 0.00 -0.02 0.00 0.00 57.16 57.84 1xxh n GLU 95 Cb 0.50 -1.49 0.66 0.00 -0.02 0.00 0.00 31.44 31.09 1xxh n GLU 95 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1xxh h GLN 96 N -1.00 0.00 0.03 3.49 4.20 -1.66 1.76 115.11 121.93 1xxh h GLN 96 Ca -0.36 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.00 1xxh h GLN 96 Cb 1.29 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 29.02 1xxh h GLN 96 CO -0.22 0.00 -2.14 1.28 -0.67 0.00 0.00 178.83 177.08 1xxh n LEU 97 N -3.67 1.52 0.20 1.46 4.32 -1.20 -4.00 117.00 115.63 1xxh n LEU 97 Ca 0.31 0.13 0.13 0.00 -0.02 0.00 0.00 56.01 56.56 1xxh n LEU 97 Cb 1.62 -0.28 0.72 0.00 -1.62 0.00 0.00 43.42 43.86 1xxh n LEU 97 CO 0.34 0.65 1.11 0.25 -1.22 0.00 0.00 177.39 178.53 1xxh h LEU 98 N 0.02 0.00 0.42 2.23 7.12 0.25 -1.87 115.31 123.47 1xxh h LEU 98 Ca -0.46 0.00 -0.02 0.00 0.13 0.00 0.00 57.88 57.53 1xxh h LEU 98 Cb 2.06 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 42.19 1xxh h LEU 98 CO 0.03 0.00 -0.20 0.74 -0.13 0.00 0.00 178.44 178.88 1xxh h THR 99 N 0.00 0.45 0.00 1.05 2.02 -0.74 -2.55 112.91 113.14 1xxh h THR 99 Ca 0.07 -0.54 0.00 0.00 0.77 0.00 0.00 66.41 66.70 1xxh h THR 99 Cb 0.29 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.36 1xxh h THR 99 CO -0.00 0.08 0.00 0.18 0.37 0.00 0.00 175.52 176.15 1xxh n LEU 100 N -5.20 0.31 0.04 2.58 4.77 -0.77 -2.65 117.00 116.09 1xxh n LEU 100 Ca -0.10 -0.16 0.11 0.00 -0.03 0.00 0.00 56.01 55.84 1xxh n LEU 100 Cb 0.29 -0.16 -0.08 0.00 -2.33 0.00 0.00 43.42 41.14 1xxh n LEU 100 CO 0.29 0.08 -0.36 1.07 -1.33 0.00 0.00 177.39 177.14 1xxh n THR 101 N -0.09 0.27 -0.76 -5.08 5.66 -0.81 -4.25 114.28 109.22 1xxh n THR 101 Ca 0.00 -0.49 0.07 0.00 -3.05 0.00 0.00 64.05 60.59 1xxh n THR 101 Cb 0.08 -0.10 0.13 0.00 -1.55 0.00 0.00 70.33 68.88 1xxh n THR 101 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1xxh n GLY 102 N 1.24 4.20 0.13 1.09 0.00 -1.08 -4.67 105.19 106.10 1xxh n GLY 102 Ca -0.02 -0.82 -0.18 0.00 0.00 0.00 0.00 46.02 45.00 1xxh n GLY 102 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1xxh n LEU 103 N -0.96 2.94 -2.09 0.99 7.94 -1.26 -5.03 117.00 119.53 1xxh n LEU 103 Ca 0.13 -0.10 -0.20 0.00 -1.11 0.00 0.00 56.01 54.73 1xxh n LEU 103 Cb 0.58 -0.94 0.00 0.00 0.53 0.00 0.00 43.42 43.59 1xxh n LEU 103 CO 0.03 0.93 -0.26 0.18 -1.11 0.00 0.00 177.39 177.17 1xxh n LEU 104 N -3.29 -1.58 -3.75 -1.96 4.77 -1.26 -5.02 117.00 104.91 1xxh n LEU 104 Ca -0.44 0.36 -0.12 0.00 -0.03 0.00 0.00 56.01 55.78 1xxh n LEU 104 Cb 1.00 -0.42 -0.08 0.00 -2.33 0.00 0.00 43.42 41.59 1xxh n LEU 104 CO 0.28 -2.18 0.03 -1.38 -1.33 0.00 0.00 177.39 172.81 1xxh s HIS 105 N -0.89 -0.13 -1.35 -1.77 -3.43 -1.26 -5.03 115.29 101.43 1xxh s HIS 105 Ca 0.29 0.07 0.00 0.00 -0.80 0.00 0.00 55.06 54.61 1xxh s HIS 105 Cb -0.28 0.10 0.00 0.00 -1.43 0.00 0.00 32.58 30.97 1xxh s HIS 105 CO 0.31 -0.47 0.33 -0.25 -2.00 0.00 0.00 174.74 172.67 1xxh n ASP 106 N 0.78 0.00 -2.47 7.38 8.00 -1.26 -1.91 116.55 127.07 1xxh n ASP 106 Ca -0.19 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.10 1xxh n ASP 106 Cb 0.58 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.70 1xxh n ASP 106 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1xxh n ASP 107 N -0.83 3.77 -2.75 -2.24 9.92 -1.26 -4.83 116.55 118.33 1xxh n ASP 107 Ca 0.00 -3.38 -0.02 0.00 -0.53 0.00 0.00 54.79 50.86 1xxh n ASP 107 Cb 0.00 -0.46 0.02 0.00 -0.64 0.00 0.00 41.12 40.04 1xxh n ASP 107 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1xxh s LEU 108 N -3.47 -0.73 -0.12 0.64 0.20 -0.80 -3.98 118.68 110.42 1xxh s LEU 108 Ca 0.42 -0.76 -0.30 0.00 0.69 0.00 0.00 54.13 54.19 1xxh s LEU 108 Cb 0.41 0.95 -0.02 0.00 -0.43 0.00 0.00 46.19 47.10 1xxh s LEU 108 CO -0.09 -0.04 1.20 -0.22 -0.29 0.00 0.00 176.35 176.91 1xxh s LEU 109 N 1.16 4.22 -0.16 -0.68 0.20 -1.06 -4.51 118.68 117.86 1xxh s LEU 109 Ca 0.24 1.71 -0.13 0.00 0.69 0.00 0.00 54.13 56.64 1xxh s LEU 109 Cb 0.06 -3.55 -0.05 0.00 -0.43 0.00 0.00 46.19 42.23 1xxh s LEU 109 CO -0.09 -0.65 0.28 -0.22 -0.29 0.00 0.00 176.35 175.37 1xxh s LEU 110 N 2.79 4.25 -0.28 -0.68 2.96 -1.10 -1.47 118.68 125.15 1xxh s LEU 110 Ca 0.54 0.49 -0.02 0.00 -0.22 0.00 0.00 54.13 54.93 1xxh s LEU 110 Cb -0.22 -2.35 0.09 0.00 0.50 0.00 0.00 46.19 44.21 1xxh s LEU 110 CO 0.18 0.12 0.09 -0.63 -1.32 0.00 0.00 176.35 174.78 1xxh s ILE 111 N 0.40 0.64 0.23 6.68 1.01 -0.56 0.17 121.20 129.76 1xxh s ILE 111 Ca 0.16 -1.11 -0.07 0.00 0.00 0.00 0.00 60.65 59.63 1xxh s ILE 111 Cb -0.13 -1.42 -0.06 0.00 0.01 0.00 0.00 42.46 40.87 1xxh s ILE 111 CO 0.04 -0.59 0.51 -0.69 0.00 0.00 0.00 174.94 174.20 1xxh s VAL 112 N 1.75 5.02 -0.11 2.92 1.01 -0.38 -2.22 120.40 128.39 1xxh s VAL 112 Ca 0.07 0.22 -0.06 0.00 0.00 0.00 0.00 61.98 62.21 1xxh s VAL 112 Cb -0.17 -3.66 0.05 0.00 0.00 0.00 0.00 36.38 32.60 1xxh s VAL 112 CO -0.24 -0.13 0.27 -0.60 0.00 0.00 0.00 175.10 174.40 1xxh s ARG 113 N -3.04 0.23 0.03 2.72 3.52 -0.49 -0.91 118.95 121.01 1xxh s ARG 113 Ca 0.45 0.57 -0.17 0.00 -0.13 0.00 0.00 55.73 56.45 1xxh s ARG 113 Cb -0.11 -0.11 0.06 0.00 -1.56 0.00 0.00 34.95 33.23 1xxh s ARG 113 CO 0.25 -0.17 0.77 0.41 -0.81 0.00 0.00 175.30 175.76 1xxh n GLY 114 N 4.27 0.52 3.82 8.12 0.00 -0.73 -0.08 105.19 121.12 1xxh n GLY 114 Ca -0.25 -1.00 -0.33 0.00 0.00 0.00 0.00 46.02 44.44 1xxh n GLY 114 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1xxh s ASN 115 N -2.75 6.76 0.72 1.61 -0.87 -1.16 -0.45 114.94 118.80 1xxh s ASN 115 Ca 0.18 1.69 -0.18 0.00 -1.57 0.00 0.00 52.86 52.98 1xxh s ASN 115 Cb -0.01 -2.53 -0.13 0.00 -0.02 0.00 0.00 41.25 38.55 1xxh s ASN 115 CO 0.01 -0.49 -0.98 2.29 -2.57 0.00 0.00 177.10 175.36 1xxh n LYS 116 N -0.96 0.00 -4.50 -0.60 2.85 -1.26 -4.39 118.16 109.31 1xxh n LYS 116 Ca 0.07 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 57.02 1xxh n LYS 116 Cb 0.54 -0.72 -0.11 0.00 -0.65 0.00 0.00 35.03 34.09 1xxh n LYS 116 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1xxh s LEU 117 N 5.72 3.03 0.36 -5.58 1.43 -1.26 -4.87 118.68 117.50 1xxh s LEU 117 Ca 0.27 -0.22 -0.25 0.00 -1.03 0.00 0.00 54.13 52.89 1xxh s LEU 117 Cb 0.02 -1.75 -0.09 0.00 0.03 0.00 0.00 46.19 44.40 1xxh s LEU 117 CO 0.50 0.27 1.02 -0.94 0.23 0.00 0.00 176.35 177.44 1xxh s SER 118 N -1.46 7.03 0.51 2.29 1.04 -1.26 -4.83 113.70 117.02 1xxh s SER 118 Ca 0.17 2.00 0.42 0.00 0.48 0.00 0.00 55.95 59.02 1xxh s SER 118 Cb -0.11 -2.59 1.61 0.00 0.10 0.00 0.00 66.02 65.03 1xxh s SER 118 CO 0.07 -0.30 1.61 0.07 0.98 0.00 0.00 173.24 175.67 1xxh h LYS 119 N 2.92 0.02 0.16 4.02 -0.00 -1.99 0.19 116.57 121.88 1xxh h LYS 119 Ca -0.48 -0.00 -0.01 0.00 -0.00 0.00 0.00 60.65 60.17 1xxh h LYS 119 Cb 1.21 -0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.43 1xxh h LYS 119 CO 0.64 0.01 -0.08 0.00 -0.00 0.00 0.00 179.45 180.03 1xxh h ALA 120 N 1.28 -0.21 0.00 0.07 0.00 -2.01 -3.25 119.26 115.13 1xxh h ALA 120 Ca 0.87 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.66 1xxh h ALA 120 Cb 3.21 0.08 0.00 0.00 0.00 0.00 0.00 17.79 21.08 1xxh h ALA 120 CO -0.18 -0.21 0.31 1.96 0.00 0.00 0.00 179.25 181.13 1xxh h GLN 121 N -1.02 0.00 -1.16 0.00 4.20 -1.11 -1.34 115.11 114.69 1xxh h GLN 121 Ca -0.02 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.32 1xxh h GLN 121 Cb 0.30 0.00 -0.19 0.00 0.30 0.00 0.00 27.48 27.89 1xxh h GLN 121 CO 0.04 0.00 0.47 0.39 -0.67 0.00 0.00 178.83 179.06 1xxh n GLU 122 N -2.81 1.90 0.00 1.46 1.02 0.10 -3.17 120.64 119.14 1xxh n GLU 122 Ca -0.02 -1.96 0.00 0.00 -0.02 0.00 0.00 57.16 55.16 1xxh n GLU 122 Cb 0.35 -1.77 0.00 0.00 -0.02 0.00 0.00 31.44 30.00 1xxh n GLU 122 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1xxh n ASN 123 N -0.32 0.00 -4.59 1.62 3.02 -0.51 -4.79 115.26 109.70 1xxh n ASN 123 Ca 0.38 -0.23 -0.42 0.00 -0.03 0.00 0.00 54.58 54.28 1xxh n ASN 123 Cb 0.97 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 40.11 1xxh n ASN 123 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xxh s ALA 124 N 0.00 2.56 0.00 5.41 0.00 -1.19 -4.70 121.76 123.84 1xxh s ALA 124 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.63 1xxh s ALA 124 Cb 0.00 -4.12 0.00 0.00 0.00 0.00 0.00 23.12 19.00 1xxh s ALA 124 CO 0.00 -3.05 0.00 0.00 0.00 0.00 0.00 175.76 172.71 1xxh n ALA 125 N 12.36 0.00 0.28 0.00 0.00 -1.26 -1.10 120.51 130.79 1xxh n ALA 125 Ca 0.31 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.59 1xxh n ALA 125 Cb 0.46 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.83 1xxh n ALA 125 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 1xxh h TRP 126 N 0.00 -0.81 -0.15 0.00 5.08 -1.86 -3.00 115.95 115.20 1xxh h TRP 126 Ca 0.00 -0.01 0.04 0.00 1.08 0.00 0.00 58.89 60.01 1xxh h TRP 126 Cb 0.00 0.29 -0.05 0.00 -3.00 0.00 0.00 29.16 26.40 1xxh h TRP 126 CO 0.00 -0.47 -0.14 0.35 -1.28 0.00 0.00 178.44 176.90 1xxh h PHE 127 N -0.75 -0.36 -0.11 0.12 3.04 -1.43 0.01 116.94 117.45 1xxh h PHE 127 Ca -0.05 0.02 0.03 0.00 3.98 0.00 0.00 57.97 61.95 1xxh h PHE 127 Cb 0.62 0.19 -0.00 0.00 2.56 0.00 0.00 35.95 39.31 1xxh h PHE 127 CO -0.11 -0.21 0.52 0.00 -2.02 0.00 0.00 178.31 176.49 1xxh h THR 128 N -0.17 0.06 0.04 4.41 1.03 -1.68 -1.91 112.91 114.69 1xxh h THR 128 Ca 0.10 0.00 -0.00 0.00 -0.01 0.00 0.00 66.41 66.50 1xxh h THR 128 Cb 0.31 0.50 0.00 0.00 -1.07 0.00 0.00 68.15 67.89 1xxh h THR 128 CO -0.25 0.00 -0.02 0.00 -0.01 0.00 0.00 175.52 175.24 1xxh h ALA 129 N 1.06 -0.24 -0.48 0.00 0.00 -0.85 -3.22 119.26 115.53 1xxh h ALA 129 Ca 0.05 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.09 1xxh h ALA 129 Cb 1.10 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1xxh h ALA 129 CO -0.00 -0.24 0.84 -0.07 0.00 0.00 0.00 179.25 179.78 1xxh h LEU 130 N -0.20 0.00 0.00 0.00 3.38 -1.40 -2.85 115.31 114.24 1xxh h LEU 130 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1xxh h LEU 130 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1xxh h LEU 130 CO 0.01 0.00 0.45 0.00 0.09 0.00 0.00 178.44 178.99 1xxh n ALA 131 N -2.04 0.00 0.00 1.53 0.00 -0.76 -0.92 120.51 118.32 1xxh n ALA 131 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1xxh n ALA 131 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.45 1xxh n ALA 131 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1xxh n ASN 132 N -0.95 1.11 0.13 0.00 5.15 -1.08 -4.88 115.26 114.74 1xxh n ASN 132 Ca 0.00 0.00 -0.11 0.00 -0.60 0.00 0.00 54.58 53.87 1xxh n ASN 132 Cb 0.45 0.00 -0.07 0.00 -0.53 0.00 0.00 39.78 39.63 1xxh n ASN 132 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 1xxh h ARG 133 N 0.00 -0.38 0.00 1.20 3.08 -1.25 -3.47 114.38 113.56 1xxh h ARG 133 Ca 0.00 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1xxh h ARG 133 Cb 0.91 0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.05 1xxh h ARG 133 CO 0.00 -0.05 0.00 -1.13 -1.07 0.00 0.00 179.97 177.72 1xxh n SER 134 N -5.05 -0.78 -3.64 7.04 3.41 -0.45 -4.20 113.62 109.95 1xxh n SER 134 Ca -0.08 -0.01 -0.10 0.00 -0.26 0.00 0.00 58.87 58.42 1xxh n SER 134 Cb 0.26 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.14 1xxh n SER 134 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1xxh s VAL 135 N -0.40 0.00 -0.09 -3.33 1.01 -1.02 -3.70 120.40 112.88 1xxh s VAL 135 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 61.98 61.99 1xxh s VAL 135 Cb 0.00 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 1xxh s VAL 135 CO 0.00 0.00 -0.11 -1.58 0.00 0.00 0.00 175.10 173.41 1xxh s GLN 136 N 0.70 2.91 -0.35 2.72 0.74 -0.84 -0.98 119.66 124.57 1xxh s GLN 136 Ca -0.02 -0.63 0.01 0.00 0.05 0.00 0.00 55.36 54.77 1xxh s GLN 136 Cb -0.05 -2.56 0.09 0.00 1.10 0.00 0.00 33.01 31.59 1xxh s GLN 136 CO -0.07 0.50 0.07 0.08 -0.55 0.00 0.00 175.29 175.32 1xxh s VAL 137 N -0.38 2.66 -0.28 1.34 1.01 -0.09 -2.01 120.40 122.65 1xxh s VAL 137 Ca 0.05 -2.06 -0.29 0.00 0.00 0.00 0.00 61.98 59.68 1xxh s VAL 137 Cb -0.12 -2.82 -0.07 0.00 0.00 0.00 0.00 36.38 33.37 1xxh s VAL 137 CO 0.02 -0.50 2.25 0.41 0.00 0.00 0.00 175.10 177.28 1xxh n THR 138 N 4.42 0.27 -3.77 3.92 -1.04 -0.84 -3.39 114.28 113.85 1xxh n THR 138 Ca -0.02 -0.46 -0.33 0.00 -2.04 0.00 0.00 64.05 61.20 1xxh n THR 138 Cb 0.42 -2.41 -0.10 0.00 -1.82 0.00 0.00 70.33 66.43 1xxh n THR 138 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xxh s GLN 140 N -1.13 2.13 -0.08 0.00 -1.52 -1.26 -1.72 119.66 116.08 1xxh s GLN 140 Ca 0.24 -0.85 -0.33 0.00 -1.95 0.00 0.00 55.36 52.47 1xxh s GLN 140 Cb -0.10 -1.95 -0.11 0.00 -0.22 0.00 0.00 33.01 30.64 1xxh s GLN 140 CO -0.12 0.45 1.93 2.41 -0.25 0.00 0.00 175.29 179.72 1xxh n THR 141 N 2.69 0.61 -1.62 -0.19 -1.04 -1.26 -4.91 114.28 108.56 1xxh n THR 141 Ca -0.16 -0.13 -0.39 0.00 -2.04 0.00 0.00 64.05 61.33 1xxh n THR 141 Cb 0.52 -2.00 0.04 0.00 -1.82 0.00 0.00 70.33 67.07 1xxh n THR 141 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1xxh n PRO 142 N 7.01 1.07 -0.84 -2.82 -0.04 -1.26 -4.98 135.00 133.14 1xxh n PRO 142 Ca 0.23 0.40 -0.29 0.00 -0.04 0.00 0.00 63.50 63.80 1xxh n PRO 142 Cb 0.32 -2.15 0.25 0.00 -0.04 0.00 0.00 33.50 31.89 1xxh n PRO 142 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1xxh n GLU 143 N -0.65 -3.41 0.07 0.54 -0.00 -1.26 -4.30 120.64 111.63 1xxh n GLU 143 Ca 0.12 -1.62 0.17 0.00 -0.00 0.00 0.00 57.16 55.83 1xxh n GLU 143 Cb 0.45 -1.62 0.68 0.00 -0.00 0.00 0.00 31.44 30.95 1xxh n GLU 143 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.13 179.09 1xxh h GLN 144 N 0.00 0.00 0.08 3.44 7.50 -1.98 1.40 115.11 125.55 1xxh h GLN 144 Ca -0.39 0.00 -0.26 0.00 0.50 0.00 0.00 58.65 58.50 1xxh h GLN 144 Cb 1.22 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.73 1xxh h GLN 144 CO 0.25 0.00 -1.28 0.00 -1.50 0.00 0.00 178.83 176.30 1xxh h ALA 145 N 1.80 0.27 0.00 3.87 0.00 -2.03 -3.34 119.26 119.83 1xxh h ALA 145 Ca 0.18 -1.00 0.00 0.00 0.00 0.00 0.00 54.91 54.10 1xxh h ALA 145 Cb 0.74 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1xxh h ALA 145 CO -0.00 1.15 -1.59 0.94 0.00 0.00 0.00 179.25 179.75 1xxh n GLN 146 N -3.42 0.40 -0.23 0.00 -0.06 -0.92 -4.44 117.38 108.71 1xxh n GLN 146 Ca -0.09 -0.12 -0.05 0.00 -2.00 0.00 0.00 57.00 54.75 1xxh n GLN 146 Cb 1.01 -1.52 0.01 0.00 -4.06 0.00 0.00 30.24 25.68 1xxh n GLN 146 CO 0.00 0.00 0.00 1.25 -0.20 0.00 0.00 177.06 178.11 1xxh h LEU 147 N 0.00 -1.23 -0.73 1.69 5.85 0.18 0.19 115.31 121.26 1xxh h LEU 147 Ca 0.00 0.24 -0.12 0.00 0.84 0.00 0.00 57.88 58.84 1xxh h LEU 147 Cb 0.80 0.61 -0.01 0.00 0.37 0.00 0.00 40.66 42.43 1xxh h LEU 147 CO 0.00 -0.30 -0.28 -0.65 -0.34 0.00 0.00 178.44 176.87 1xxh h PRO 148 N -0.14 0.67 -0.91 5.25 0.11 -1.78 -2.99 132.00 132.21 1xxh h PRO 148 Ca 0.24 -0.29 0.06 0.00 0.11 0.00 0.00 66.00 66.13 1xxh h PRO 148 Cb 0.56 -0.02 -0.06 0.00 0.11 0.00 0.00 31.00 31.58 1xxh h PRO 148 CO -0.72 0.87 0.57 -0.09 -0.21 0.00 0.00 178.00 178.42 1xxh h ARG 149 N 0.58 1.01 0.45 1.05 9.65 -1.08 -0.10 114.38 125.94 1xxh h ARG 149 Ca 0.07 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 58.88 1xxh h ARG 149 Cb 0.77 -0.23 -0.01 0.00 -1.39 0.00 0.00 29.97 29.11 1xxh h ARG 149 CO 0.06 0.67 -0.33 2.35 2.80 0.00 0.00 179.97 185.53 1xxh h TRP 150 N 1.04 -0.87 -0.66 2.20 7.01 -0.62 0.46 115.95 124.52 1xxh h TRP 150 Ca 0.39 -0.00 0.17 0.00 2.11 0.00 0.00 58.89 61.56 1xxh h TRP 150 Cb 0.16 0.32 -0.03 0.00 -2.10 0.00 0.00 29.16 27.51 1xxh h TRP 150 CO -0.02 -0.49 0.46 0.28 -2.79 0.00 0.00 178.44 175.88 1xxh h VAL 151 N -0.76 0.73 0.02 2.65 2.07 -1.27 0.17 116.25 119.85 1xxh h VAL 151 Ca -0.05 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 1xxh h VAL 151 Cb 0.65 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1xxh h VAL 151 CO 0.02 0.02 -0.01 0.00 0.02 0.00 0.00 177.57 177.62 1xxh h ALA 152 N 1.68 -0.02 -0.09 1.67 0.00 0.21 -2.30 119.26 120.41 1xxh h ALA 152 Ca 0.32 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1xxh h ALA 152 Cb 1.06 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1xxh h ALA 152 CO -0.04 -0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.06 1xxh n ALA 153 N -2.49 -0.43 -0.39 0.00 0.00 0.15 -1.41 120.51 115.94 1xxh n ALA 153 Ca -0.09 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.28 1xxh n ALA 153 Cb 0.35 0.06 -0.05 0.00 0.00 0.00 0.00 19.45 19.81 1xxh n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xxh h ARG 154 N 0.00 -0.02 -0.80 0.00 2.47 -0.88 0.53 114.38 115.69 1xxh h ARG 154 Ca 0.00 0.00 0.17 0.00 -1.26 0.00 0.00 59.98 58.89 1xxh h ARG 154 Cb 0.00 0.00 -0.15 0.00 -1.65 0.00 0.00 29.97 28.17 1xxh h ARG 154 CO 0.00 -0.01 -0.17 0.00 0.56 0.00 0.00 179.97 180.35 1xxh h ALA 155 N 0.82 0.58 -0.16 0.04 0.00 -1.39 1.25 119.26 120.39 1xxh h ALA 155 Ca 0.23 0.31 0.03 0.00 0.00 0.00 0.00 54.91 55.47 1xxh h ALA 155 Cb 0.49 0.59 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1xxh h ALA 155 CO -0.94 -0.41 0.11 -0.22 0.00 0.00 0.00 179.25 177.79 1xxh h LYS 156 N 0.01 0.09 0.00 0.00 3.64 0.13 0.24 116.57 120.67 1xxh h LYS 156 Ca 0.39 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 1xxh h LYS 156 Cb 0.62 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1xxh h LYS 156 CO -0.81 0.06 -0.02 -0.56 -2.27 0.00 0.00 179.45 175.85 1xxh h GLN 157 N 0.09 0.00 -0.43 1.90 3.07 0.22 -2.49 115.11 117.46 1xxh h GLN 157 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.81 1xxh h GLN 157 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.73 1xxh h GLN 157 CO -0.01 0.00 0.00 1.28 0.09 0.00 0.00 178.83 180.19 1xxh n LEU 158 N -2.38 2.06 -3.36 0.06 4.77 0.78 -4.89 117.00 114.03 1xxh n LEU 158 Ca 0.05 -1.03 -0.16 0.00 -0.03 0.00 0.00 56.01 54.84 1xxh n LEU 158 Cb 0.45 -0.30 0.09 0.00 -2.33 0.00 0.00 43.42 41.33 1xxh n LEU 158 CO 0.31 0.44 0.09 -3.20 -1.33 0.00 0.00 177.39 173.71 1xxh n ASN 159 N 0.44 -2.87 -4.21 -1.43 5.15 -0.94 -5.02 115.26 106.38 1xxh n ASN 159 Ca 0.11 -0.63 -0.29 0.00 -0.60 0.00 0.00 54.58 53.18 1xxh n ASN 159 Cb 0.36 -5.08 -0.16 0.00 -0.53 0.00 0.00 39.78 34.37 1xxh n ASN 159 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1xxh s LEU 160 N -6.12 2.01 -1.13 1.20 1.02 -0.83 -4.92 118.68 109.90 1xxh s LEU 160 Ca 0.08 -0.44 -0.05 0.00 0.02 0.00 0.00 54.13 53.74 1xxh s LEU 160 Cb -0.01 -1.19 0.27 0.00 0.02 0.00 0.00 46.19 45.28 1xxh s LEU 160 CO 0.72 0.21 1.65 -0.62 0.02 0.00 0.00 176.35 178.34 1xxh n GLU 161 N 2.99 4.41 -2.50 1.70 1.02 -1.26 -4.11 120.64 122.89 1xxh n GLU 161 Ca -0.17 -4.29 -0.42 0.00 -0.02 0.00 0.00 57.16 52.25 1xxh n GLU 161 Cb 0.52 -2.60 -0.02 0.00 -0.02 0.00 0.00 31.44 29.32 1xxh n GLU 161 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1xxh s LEU 162 N -2.36 3.44 0.73 -4.62 0.20 -1.26 -3.12 118.68 111.69 1xxh s LEU 162 Ca 0.35 0.22 -0.16 0.00 0.69 0.00 0.00 54.13 55.23 1xxh s LEU 162 Cb 0.08 -3.16 0.03 0.00 -0.43 0.00 0.00 46.19 42.71 1xxh s LEU 162 CO 0.05 -1.55 1.18 0.47 -0.29 0.00 0.00 176.35 176.20 1xxh n ASP 163 N 8.84 1.27 0.03 3.68 9.92 -1.17 -4.66 116.55 134.46 1xxh n ASP 163 Ca 0.10 0.69 -0.13 0.00 -0.53 0.00 0.00 54.79 54.93 1xxh n ASP 163 Cb 0.49 -1.50 -0.06 0.00 -0.64 0.00 0.00 41.12 39.41 1xxh n ASP 163 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 1xxh h ASP 164 N -0.23 -1.26 -0.42 -2.24 3.32 -1.95 1.19 116.42 114.83 1xxh h ASP 164 Ca -0.48 0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.73 1xxh h ASP 164 Cb 1.32 0.51 -0.02 0.00 0.22 0.00 0.00 39.33 41.36 1xxh h ASP 164 CO 0.49 -0.44 0.27 0.00 -1.72 0.00 0.00 179.24 177.84 1xxh h ALA 165 N 0.07 1.69 0.00 3.45 0.00 -1.96 0.26 119.26 122.77 1xxh h ALA 165 Ca 0.06 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1xxh h ALA 165 Cb 0.63 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1xxh h ALA 165 CO -0.35 0.28 -0.23 0.00 0.00 0.00 0.00 179.25 178.95 1xxh h ALA 166 N 1.73 0.90 -0.03 0.00 0.00 -1.44 -2.89 119.26 117.53 1xxh h ALA 166 Ca 0.15 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1xxh h ALA 166 Cb -0.06 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.70 1xxh h ALA 166 CO -0.03 0.29 -0.30 -0.97 0.00 0.00 0.00 179.25 178.24 1xxh h ASN 167 N 0.00 0.31 0.44 0.00 -0.73 0.42 -3.26 115.58 112.77 1xxh h ASN 167 Ca -0.00 -0.71 -0.01 0.00 1.87 0.00 0.00 56.30 57.45 1xxh h ASN 167 Cb 0.99 -0.09 -0.02 0.00 0.27 0.00 0.00 38.32 39.47 1xxh h ASN 167 CO 0.03 0.97 -0.46 1.56 -0.37 0.00 0.00 177.43 179.16 1xxh h GLN 168 N -0.32 -0.87 -0.67 6.67 4.20 -0.52 -1.49 115.11 122.11 1xxh h GLN 168 Ca -0.03 0.06 0.12 0.00 0.06 0.00 0.00 58.65 58.86 1xxh h GLN 168 Cb 0.99 0.20 -0.12 0.00 0.30 0.00 0.00 27.48 28.85 1xxh h GLN 168 CO 0.06 -0.58 -0.31 0.28 -0.67 0.00 0.00 178.83 177.61 1xxh h VAL 169 N -0.91 0.17 -0.87 -0.54 2.07 -1.66 0.56 116.25 115.07 1xxh h VAL 169 Ca -0.05 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.57 1xxh h VAL 169 Cb 0.79 0.17 -0.08 0.00 -1.52 0.00 0.00 31.29 30.65 1xxh h VAL 169 CO -0.07 0.00 0.51 -0.07 0.02 0.00 0.00 177.57 177.96 1xxh h LEU 170 N -0.11 0.72 -1.56 2.57 3.38 -1.57 0.55 115.31 119.28 1xxh h LEU 170 Ca 0.27 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.26 1xxh h LEU 170 Cb 0.55 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 1xxh h LEU 170 CO -0.73 0.40 -0.14 0.00 0.09 0.00 0.00 178.44 178.06 1xxh h TYR 172 N 0.00 0.00 -2.28 0.00 0.05 0.14 -3.33 116.97 111.56 1xxh h TYR 172 Ca -0.00 0.00 -0.50 0.00 0.05 0.00 0.00 58.73 58.28 1xxh h TYR 172 Cb 0.52 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.22 1xxh h TYR 172 CO 0.00 0.74 -0.50 0.00 -1.05 0.00 0.00 178.16 177.35 1xxh n TYR 174 N -1.11 -1.72 -1.86 0.00 4.02 -1.26 -4.70 117.16 110.53 1xxh n TYR 174 Ca -0.08 0.37 -0.22 0.00 -0.01 0.00 0.00 57.90 57.96 1xxh n TYR 174 Cb 0.57 -2.68 -0.08 0.00 -0.02 0.00 0.00 39.34 37.13 1xxh n TYR 174 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 1xxh s GLU 175 N -5.84 1.91 0.00 -0.72 2.12 -1.25 -3.39 118.70 111.53 1xxh s GLU 175 Ca 0.33 -0.79 0.00 0.00 0.36 0.00 0.00 54.97 54.87 1xxh s GLU 175 Cb -0.18 -5.12 0.00 0.00 0.26 0.00 0.00 34.13 29.10 1xxh s GLU 175 CO 0.40 -4.63 0.00 0.41 -0.54 0.00 0.00 175.26 170.91 1xxh n GLY 176 N 6.01 4.08 3.03 -1.50 0.00 -1.26 -5.01 105.19 110.53 1xxh n GLY 176 Ca 0.43 -0.90 -0.36 0.00 0.00 0.00 0.00 46.02 45.20 1xxh n GLY 176 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1xxh n ASN 177 N 0.00 2.67 -0.40 1.61 2.85 -1.22 -4.68 115.26 116.09 1xxh n ASN 177 Ca 0.00 -2.52 0.32 0.00 -0.11 0.00 0.00 54.58 52.27 1xxh n ASN 177 Cb 0.00 -0.98 0.51 0.00 1.24 0.00 0.00 39.78 40.55 1xxh n ASN 177 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 1xxh n LEU 178 N 6.75 0.07 0.01 1.20 -0.00 -1.26 -0.37 117.00 123.40 1xxh n LEU 178 Ca 0.44 0.81 -0.08 0.00 -0.00 0.00 0.00 56.01 57.18 1xxh n LEU 178 Cb 0.31 -0.40 -0.05 0.00 -0.00 0.00 0.00 43.42 43.28 1xxh n LEU 178 CO 0.95 -0.85 0.50 0.25 -0.00 0.00 0.00 177.39 178.24 1xxh h LEU 179 N 0.00 -0.94 -0.43 -1.96 5.85 -1.97 -0.74 115.31 115.12 1xxh h LEU 179 Ca 0.62 0.11 0.05 0.00 0.84 0.00 0.00 57.88 59.49 1xxh h LEU 179 Cb 2.25 0.36 -0.04 0.00 0.37 0.00 0.00 40.66 43.60 1xxh h LEU 179 CO -0.16 -0.27 0.18 0.00 -0.34 0.00 0.00 178.44 177.85 1xxh h ALA 180 N -0.84 0.52 -0.99 1.25 0.00 -1.10 -1.72 119.26 116.39 1xxh h ALA 180 Ca 0.01 0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.07 1xxh h ALA 180 Cb 0.38 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.08 1xxh h ALA 180 CO -0.23 -0.20 0.62 -0.07 0.00 0.00 0.00 179.25 179.38 1xxh h LEU 181 N 0.37 0.93 -0.95 0.00 3.38 -1.52 0.70 115.31 118.21 1xxh h LEU 181 Ca 0.19 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.14 1xxh h LEU 181 Cb 0.15 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1xxh h LEU 181 CO -0.17 0.52 0.03 0.00 0.09 0.00 0.00 178.44 178.91 1xxh h ALA 182 N 1.51 1.13 0.01 1.53 0.00 -0.54 -3.05 119.26 119.86 1xxh h ALA 182 Ca 0.48 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1xxh h ALA 182 Cb 0.41 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1xxh h ALA 182 CO -0.25 0.56 -0.00 0.37 0.00 0.00 0.00 179.25 179.93 1xxh h GLN 183 N 0.75 -0.01 -0.01 0.00 5.75 0.66 -3.15 115.11 119.10 1xxh h GLN 183 Ca 0.15 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.65 1xxh h GLN 183 Cb 0.41 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.97 1xxh h GLN 183 CO 0.01 -0.01 0.84 0.00 -2.65 0.00 0.00 178.83 177.03 1xxh h ALA 184 N -1.99 1.85 0.03 3.38 0.00 0.07 0.56 119.26 123.15 1xxh h ALA 184 Ca -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1xxh h ALA 184 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1xxh h ALA 184 CO 0.00 -0.85 -0.01 -0.07 0.00 0.00 0.00 179.25 178.32 1xxh h LEU 185 N 0.00 -0.03 -1.63 0.00 3.38 -1.49 -1.08 115.31 114.46 1xxh h LEU 185 Ca 0.00 -0.69 -0.03 0.00 0.09 0.00 0.00 57.88 57.25 1xxh h LEU 185 Cb 1.69 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 42.44 1xxh h LEU 185 CO -0.00 0.75 -0.14 -0.33 0.09 0.00 0.00 178.44 178.81 1xxh h GLU 186 N -0.90 0.00 -0.01 1.13 5.08 -0.90 0.53 114.58 119.51 1xxh h GLU 186 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1xxh h GLU 186 Cb 0.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1xxh h GLU 186 CO 0.01 0.14 -0.07 -0.09 -1.00 0.00 0.00 179.01 178.00 1xxh h ARG 187 N 0.00 0.07 -0.17 2.33 2.43 -1.40 -2.58 114.38 115.06 1xxh h ARG 187 Ca -0.00 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.03 1xxh h ARG 187 Cb 0.49 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 1xxh h ARG 187 CO 0.02 0.73 -0.26 1.25 -1.51 0.00 0.00 179.97 180.20 1xxh h LEU 188 N -0.57 0.32 -0.41 3.80 7.12 -0.78 0.95 115.31 125.74 1xxh h LEU 188 Ca -0.00 -0.10 0.08 0.00 0.13 0.00 0.00 57.88 57.99 1xxh h LEU 188 Cb 0.74 -0.09 -0.08 0.00 -0.53 0.00 0.00 40.66 40.70 1xxh h LEU 188 CO 0.01 0.58 -0.12 -1.28 -0.13 0.00 0.00 178.44 177.50 1xxh h SER 189 N 0.29 -0.43 -0.80 1.25 0.87 0.10 -2.04 113.55 112.80 1xxh h SER 189 Ca 0.04 0.13 -0.00 0.00 -1.23 0.00 0.00 61.79 60.73 1xxh h SER 189 Cb 0.61 0.27 -0.04 0.00 -0.44 0.00 0.00 62.40 62.80 1xxh h SER 189 CO 0.04 -0.15 0.50 -0.07 -0.53 0.00 0.00 176.83 176.62 1xxh h LEU 190 N -0.02 0.94 -0.49 2.23 -0.00 -0.45 -2.88 115.31 114.65 1xxh h LEU 190 Ca 0.20 -0.04 -0.03 0.00 -0.00 0.00 0.00 57.88 58.00 1xxh h LEU 190 Cb 0.32 -0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 40.73 1xxh h LEU 190 CO -0.44 0.71 0.17 -0.07 -0.00 0.00 0.00 178.44 178.81 1xxh h LEU 191 N 1.10 0.70 -5.97 1.67 3.38 -0.50 -3.37 115.31 112.32 1xxh h LEU 191 Ca 0.29 -0.19 -0.58 0.00 0.09 0.00 0.00 57.88 57.49 1xxh h LEU 191 Cb -0.07 -0.18 -0.41 0.00 0.09 0.00 0.00 40.66 40.08 1xxh h LEU 191 CO -0.06 0.70 -0.79 0.79 0.09 0.00 0.00 178.44 179.17 1xxh n TRP 192 N -4.53 2.34 -1.67 1.13 8.01 -1.03 -5.07 117.44 116.62 1xxh n TRP 192 Ca 0.01 -3.94 -0.42 0.00 -1.31 0.00 0.00 57.50 51.84 1xxh n TRP 192 Cb 0.18 -0.48 -0.03 0.00 -2.01 0.00 0.00 31.31 28.97 1xxh n TRP 192 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.69 174.54 1xxh s PRO 193 N -2.30 4.02 -0.40 -0.99 0.02 -1.10 0.58 135.00 134.84 1xxh s PRO 193 Ca 0.40 2.53 0.00 0.00 0.02 0.00 0.00 61.00 63.96 1xxh s PRO 193 Cb 0.20 -4.18 0.00 0.00 0.02 0.00 0.00 34.50 30.53 1xxh s PRO 193 CO -0.07 -1.09 0.00 -0.25 -0.33 0.00 0.00 177.00 175.26 1xxh n ASP 194 N 8.03 -2.25 -4.90 2.53 8.00 -1.26 -5.05 116.55 121.64 1xxh n ASP 194 Ca 0.21 0.01 -0.23 0.00 0.71 0.00 0.00 54.79 55.49 1xxh n ASP 194 Cb 0.42 -1.45 -0.01 0.00 -0.02 0.00 0.00 41.12 40.05 1xxh n ASP 194 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1xxh s GLY 195 N -2.82 2.20 0.00 0.44 0.00 0.20 -5.15 107.32 102.19 1xxh s GLY 195 Ca 0.00 -1.67 0.07 0.00 0.00 0.00 0.00 44.72 43.12 1xxh s GLY 195 CO 0.00 -1.81 -0.22 0.54 0.00 0.00 0.00 173.10 171.61 1xxh s LYS 196 N -4.24 1.66 -1.12 2.90 1.02 -1.26 -4.61 119.74 114.09 1xxh s LYS 196 Ca 0.43 -0.83 -0.05 0.00 0.02 0.00 0.00 55.97 55.55 1xxh s LYS 196 Cb -0.03 -1.66 0.28 0.00 -0.52 0.00 0.00 37.83 35.90 1xxh s LYS 196 CO 0.26 0.45 1.64 1.28 -0.92 0.00 0.00 175.35 178.06 1xxh n LEU 197 N 2.34 6.68 -4.34 3.17 4.77 -1.18 -4.94 117.00 123.49 1xxh n LEU 197 Ca -0.16 -5.13 -0.29 0.00 -0.03 0.00 0.00 56.01 50.41 1xxh n LEU 197 Cb 0.53 -1.30 0.24 0.00 -2.33 0.00 0.00 43.42 40.56 1xxh n LEU 197 CO 0.23 1.71 0.15 0.41 -1.33 0.00 0.00 177.39 178.55 1xxh n THR 198 N 1.50 0.00 -0.03 -5.08 -1.04 -1.26 -3.07 114.28 105.30 1xxh n THR 198 Ca 0.33 -0.34 -0.08 0.00 -2.04 0.00 0.00 64.05 61.92 1xxh n THR 198 Cb 0.32 -0.86 0.09 0.00 -1.82 0.00 0.00 70.33 68.07 1xxh n THR 198 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1xxh h LEU 199 N -2.72 0.67 -0.60 -4.42 5.85 -1.93 -2.83 115.31 109.33 1xxh h LEU 199 Ca -0.55 -0.29 -0.06 0.00 0.84 0.00 0.00 57.88 57.82 1xxh h LEU 199 Cb 1.31 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 1xxh h LEU 199 CO 0.41 0.97 0.14 -0.65 -0.34 0.00 0.00 178.44 178.97 1xxh h PRO 200 N 0.53 0.96 0.06 5.25 0.11 -1.99 -2.15 132.00 134.77 1xxh h PRO 200 Ca 0.05 -0.23 -0.00 0.00 0.11 0.00 0.00 66.00 65.93 1xxh h PRO 200 Cb 0.88 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1xxh h PRO 200 CO 0.08 0.88 -0.03 0.00 -0.21 0.00 0.00 178.00 178.72 1xxh h ARG 201 N 0.87 -0.08 0.11 1.05 3.08 -1.89 -3.07 114.38 114.45 1xxh h ARG 201 Ca 0.19 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.24 1xxh h ARG 201 Cb 0.36 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1xxh h ARG 201 CO 0.00 0.08 -0.05 0.28 -1.07 0.00 0.00 179.97 179.21 1xxh h VAL 202 N -0.24 1.09 -1.08 2.04 2.07 -1.57 -3.05 116.25 115.51 1xxh h VAL 202 Ca -0.01 -1.03 0.29 0.00 0.82 0.00 0.00 66.70 66.77 1xxh h VAL 202 Cb 0.21 1.72 -0.08 0.00 -1.52 0.00 0.00 31.29 31.62 1xxh h VAL 202 CO 0.01 0.24 0.73 -0.08 0.02 0.00 0.00 177.57 178.49 1xxh h GLU 203 N -0.65 0.23 0.00 1.57 4.81 -1.49 0.13 114.58 119.19 1xxh h GLU 203 Ca -0.02 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1xxh h GLU 203 Cb 0.51 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1xxh h GLU 203 CO 0.03 0.15 -0.00 0.37 -0.73 0.00 0.00 179.01 178.83 1xxh h GLN 204 N 0.24 -0.00 -1.02 1.92 -0.00 -1.62 -0.32 115.11 114.31 1xxh h GLN 204 Ca 0.58 0.00 0.29 0.00 -0.00 0.00 0.00 58.65 59.52 1xxh h GLN 204 Cb 1.78 0.00 -0.13 0.00 0.00 0.00 0.00 27.48 29.13 1xxh h GLN 204 CO -0.19 0.58 0.60 0.00 0.00 0.00 0.00 178.83 179.82 1xxh h ALA 205 N -0.42 1.92 0.05 3.38 0.00 -1.22 0.88 119.26 123.85 1xxh h ALA 205 Ca -0.00 0.15 -0.25 0.00 0.00 0.00 0.00 54.91 54.81 1xxh h ALA 205 Cb 0.58 0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.48 1xxh h ALA 205 CO 0.00 -0.46 -1.01 0.28 0.00 0.00 0.00 179.25 178.06 1xxh h VAL 206 N 0.44 1.32 0.72 0.00 2.07 -0.84 -1.07 116.25 118.89 1xxh h VAL 206 Ca 0.69 -2.30 -0.04 0.00 0.82 0.00 0.00 66.70 65.88 1xxh h VAL 206 Cb 1.48 2.57 0.01 0.00 -1.52 0.00 0.00 31.29 33.83 1xxh h VAL 206 CO -0.52 0.70 -0.34 -1.13 0.02 0.00 0.00 177.57 176.29 1xxh h ASN 207 N 0.21 -0.82 -0.84 0.57 -1.24 0.15 -2.96 115.58 110.66 1xxh h ASN 207 Ca -0.14 0.01 -0.00 0.00 0.71 0.00 0.00 56.30 56.88 1xxh h ASN 207 Cb 1.69 0.21 -0.04 0.00 0.73 0.00 0.00 38.32 40.91 1xxh h ASN 207 CO 0.20 -0.53 0.52 -0.78 -1.29 0.00 0.00 177.43 175.55 1xxh h ASP 208 N -1.06 0.99 -0.91 1.15 1.82 0.44 -1.06 116.42 117.80 1xxh h ASP 208 Ca -0.10 -0.05 0.26 0.00 -0.39 0.00 0.00 57.03 56.75 1xxh h ASP 208 Cb 0.76 -0.25 -0.04 0.00 0.68 0.00 0.00 39.33 40.48 1xxh h ASP 208 CO 0.16 0.75 0.92 0.00 -1.61 0.00 0.00 179.24 179.46 1xxh h ALA 209 N 1.28 2.76 -5.97 -0.78 0.00 -1.03 -3.45 119.26 112.07 1xxh h ALA 209 Ca 0.30 -0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.98 1xxh h ALA 209 Cb -0.07 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1xxh h ALA 209 CO -0.06 -1.38 -0.41 0.00 0.00 0.00 0.00 179.25 177.39 1xxh n ALA 210 N -2.39 -1.67 -2.83 0.00 0.00 -0.40 -4.97 120.51 108.24 1xxh n ALA 210 Ca 0.20 -0.13 -0.34 0.00 0.00 0.00 0.00 53.44 53.17 1xxh n ALA 210 Cb 1.21 -0.39 -0.12 0.00 0.00 0.00 0.00 19.45 20.16 1xxh n ALA 210 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1xxh s HIS 211 N -2.76 3.00 -0.08 0.00 -3.43 -1.26 -5.11 115.29 105.66 1xxh s HIS 211 Ca 0.03 -0.18 0.04 0.00 -0.80 0.00 0.00 55.06 54.16 1xxh s HIS 211 Cb -0.02 -1.87 -0.00 0.00 -1.43 0.00 0.00 32.58 29.26 1xxh s HIS 211 CO 0.34 0.11 -0.22 -0.06 -2.00 0.00 0.00 174.74 172.91 1xxh s PHE 212 N -0.09 2.27 0.20 0.38 0.40 -1.26 -5.09 117.98 114.79 1xxh s PHE 212 Ca 0.02 -0.84 -0.13 0.00 -0.60 0.00 0.00 56.93 55.38 1xxh s PHE 212 Cb -0.13 -1.53 -0.07 0.00 0.51 0.00 0.00 43.02 41.80 1xxh s PHE 212 CO 0.03 -0.32 0.58 0.99 0.70 0.00 0.00 175.22 177.20 1xxh s THR 213 N 0.24 4.84 -0.33 0.64 2.01 -1.26 -4.88 115.64 116.90 1xxh s THR 213 Ca -0.13 0.75 0.18 0.00 0.31 0.00 0.00 61.69 62.80 1xxh s THR 213 Cb -0.16 -3.69 0.18 0.00 0.01 0.00 0.00 72.50 68.84 1xxh s THR 213 CO 0.06 0.08 1.56 -0.81 -0.69 0.00 0.00 174.62 174.82 1xxh n PRO 214 N 0.34 0.12 0.16 4.92 -0.04 -1.26 0.24 135.00 139.48 1xxh n PRO 214 Ca -0.02 0.61 0.01 0.00 -0.04 0.00 0.00 63.50 64.06 1xxh n PRO 214 Cb 0.52 -1.89 0.25 0.00 -0.04 0.00 0.00 33.50 32.35 1xxh n PRO 214 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 1xxh h PHE 215 N 0.00 0.00 -0.36 0.54 -0.00 -1.98 -1.85 116.94 113.29 1xxh h PHE 215 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.97 57.83 1xxh h PHE 215 Cb 0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 35.95 1xxh h PHE 215 CO 0.00 0.51 -0.33 0.45 -0.00 0.00 0.00 178.31 178.94 1xxh h HIS 216 N 0.00 1.03 0.87 0.41 3.86 0.28 -1.79 115.15 119.82 1xxh h HIS 216 Ca -0.01 -0.30 -0.04 0.00 -1.16 0.00 0.00 60.37 58.86 1xxh h HIS 216 Cb 0.95 -0.22 0.01 0.00 1.06 0.00 0.00 27.41 29.21 1xxh h HIS 216 CO 0.00 1.11 -0.43 2.35 0.86 0.00 0.00 177.93 181.82 1xxh h TRP 217 N 0.67 -1.12 -0.51 2.45 7.01 -1.06 -2.38 115.95 121.02 1xxh h TRP 217 Ca 0.06 -0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.11 1xxh h TRP 217 Cb 0.92 0.37 -0.09 0.00 -2.10 0.00 0.00 29.16 28.26 1xxh h TRP 217 CO 0.07 -0.69 -0.50 0.28 -2.79 0.00 0.00 178.44 174.81 1xxh h VAL 218 N -1.19 0.05 -1.01 2.65 2.07 -1.35 0.22 116.25 117.69 1xxh h VAL 218 Ca -0.12 0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.65 1xxh h VAL 218 Cb 0.91 0.05 -0.12 0.00 -1.52 0.00 0.00 31.29 30.61 1xxh h VAL 218 CO 0.19 0.00 0.61 0.44 0.02 0.00 0.00 177.57 178.83 1xxh h ASP 219 N -0.30 0.63 0.81 0.57 5.19 -1.31 0.96 116.42 122.98 1xxh h ASP 219 Ca 0.13 0.13 -0.04 0.00 -0.62 0.00 0.00 57.03 56.63 1xxh h ASP 219 Cb 0.57 0.03 0.01 0.00 0.18 0.00 0.00 39.33 40.12 1xxh h ASP 219 CO -0.65 0.10 -0.39 0.00 -3.12 0.00 0.00 179.24 175.18 1xxh h ALA 220 N 1.71 -1.09 -1.43 3.45 0.00 -0.06 -1.49 119.26 120.35 1xxh h ALA 220 Ca 0.64 -0.25 0.42 0.00 0.00 0.00 0.00 54.91 55.72 1xxh h ALA 220 Cb 1.29 0.42 -0.06 0.00 0.00 0.00 0.00 17.79 19.45 1xxh h ALA 220 CO -0.45 -1.06 1.22 -0.07 0.00 0.00 0.00 179.25 178.89 1xxh h LEU 221 N -1.19 0.00 -1.00 0.00 3.38 0.20 1.39 115.31 118.09 1xxh h LEU 221 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1xxh h LEU 221 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1xxh h LEU 221 CO 0.18 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.64 1xxh h LEU 222 N 0.00 0.00 0.00 1.67 3.38 0.19 -3.44 115.31 117.11 1xxh h LEU 222 Ca 0.68 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.65 1xxh h LEU 222 Cb 3.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 43.86 1xxh h LEU 222 CO -0.01 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.13 1xxh n GLY 224 N -0.41 4.25 3.60 0.83 0.00 0.48 -4.89 105.19 109.06 1xxh n GLY 224 Ca 0.01 -1.33 -0.41 0.00 0.00 0.00 0.00 46.02 44.29 1xxh n GLY 224 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1xxh n LYS 225 N -1.39 1.26 -0.03 1.61 3.00 -1.26 -4.86 118.16 116.48 1xxh n LYS 225 Ca 0.00 0.45 0.09 0.00 -0.00 0.00 0.00 58.31 58.85 1xxh n LYS 225 Cb 0.00 -2.04 0.49 0.00 0.00 0.00 0.00 35.03 33.48 1xxh n LYS 225 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1xxh h SER 226 N 1.35 0.37 -0.17 3.14 4.64 -1.92 -3.27 113.55 117.69 1xxh h SER 226 Ca -0.45 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 60.89 1xxh h SER 226 Cb 1.34 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 63.33 1xxh h SER 226 CO 0.56 0.25 -0.10 1.17 -0.87 0.00 0.00 176.83 177.83 1xxh n LYS 227 N -4.47 -0.07 -0.12 4.77 4.81 -1.26 0.19 118.16 122.00 1xxh n LYS 227 Ca 0.07 1.00 -0.05 0.00 -0.87 0.00 0.00 58.31 58.45 1xxh n LYS 227 Cb 0.25 -1.49 0.03 0.00 0.02 0.00 0.00 35.03 33.84 1xxh n LYS 227 CO 0.00 0.00 0.00 0.07 1.17 0.00 0.00 177.40 178.64 1xxh h ARG 228 N 0.00 0.29 -0.38 1.64 -0.00 -1.95 -2.15 114.38 111.83 1xxh h ARG 228 Ca 0.03 -0.02 0.04 0.00 -0.00 0.00 0.00 59.98 60.03 1xxh h ARG 228 Cb 0.07 -0.07 -0.06 0.00 -0.00 0.00 0.00 29.97 29.91 1xxh h ARG 228 CO -0.16 0.19 -0.39 0.00 -0.00 0.00 0.00 179.97 179.61 1xxh h ALA 229 N 1.26 -0.57 -0.59 0.08 0.00 -0.65 0.32 119.26 119.10 1xxh h ALA 229 Ca 0.19 0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.17 1xxh h ALA 229 Cb 0.17 1.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.97 1xxh h ALA 229 CO -0.19 -0.79 0.30 -0.07 0.00 0.00 0.00 179.25 178.50 1xxh h LEU 230 N -0.21 0.42 0.39 0.00 4.07 -0.06 -2.19 115.31 117.73 1xxh h LEU 230 Ca 0.06 0.04 -0.00 0.00 0.08 0.00 0.00 57.88 58.06 1xxh h LEU 230 Cb 0.38 -0.04 -0.02 0.00 1.08 0.00 0.00 40.66 42.06 1xxh h LEU 230 CO -0.47 0.28 -0.42 -0.74 -1.08 0.00 0.00 178.44 176.01 1xxh h HIS 231 N 0.56 -1.14 0.00 1.13 2.76 -0.62 0.36 115.15 118.20 1xxh h HIS 231 Ca 0.27 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.45 1xxh h HIS 231 Cb 0.20 0.45 0.00 0.00 1.55 0.00 0.00 27.41 29.61 1xxh h HIS 231 CO -0.10 -0.57 0.33 0.82 -1.30 0.00 0.00 177.93 177.11 1xxh h ILE 232 N -0.83 0.00 0.00 6.26 2.04 -0.01 0.40 117.51 125.37 1xxh h ILE 232 Ca -0.03 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 1xxh h ILE 232 Cb 0.75 0.39 -0.00 0.00 -0.74 0.00 0.00 36.82 37.22 1xxh h ILE 232 CO -0.08 0.00 -0.13 0.25 0.00 0.00 0.00 178.15 178.18 1xxh h LEU 233 N 0.00 0.00 -1.79 1.44 5.85 -0.32 0.12 115.31 120.61 1xxh h LEU 233 Ca 0.00 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.46 1xxh h LEU 233 Cb 0.66 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.69 1xxh h LEU 233 CO 0.00 0.69 -0.10 0.06 -0.34 0.00 0.00 178.44 178.75 1xxh h GLN 234 N -1.00 0.00 -0.03 1.25 3.07 -0.90 -0.08 115.11 117.42 1xxh h GLN 234 Ca -0.02 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.70 1xxh h GLN 234 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.91 1xxh h GLN 234 CO -0.01 0.10 -0.08 1.96 0.09 0.00 0.00 178.83 180.89 1xxh h GLN 235 N 0.00 0.11 0.00 0.06 1.08 -1.04 -2.84 115.11 112.47 1xxh h GLN 235 Ca -0.00 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.12 1xxh h GLN 235 Cb 0.42 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.86 1xxh h GLN 235 CO 0.01 0.70 0.00 1.28 -0.95 0.00 0.00 178.83 179.87 1xxh n LEU 236 N -4.69 0.00 -0.06 1.46 4.77 0.03 -0.43 117.00 118.09 1xxh n LEU 236 Ca -0.08 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.82 1xxh n LEU 236 Cb 0.36 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.39 1xxh n LEU 236 CO 0.36 0.00 -0.89 0.54 -1.33 0.00 0.00 177.39 176.07 1xxh n ARG 237 N -0.42 0.78 -0.35 3.23 1.74 -1.07 -3.56 116.66 117.01 1xxh n ARG 237 Ca 0.00 0.05 -0.06 0.00 -0.77 0.00 0.00 57.85 57.07 1xxh n ARG 237 Cb 0.00 -1.25 0.04 0.00 -1.02 0.00 0.00 32.46 30.23 1xxh n ARG 237 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1xxh n LEU 238 N -2.75 4.15 -0.43 0.55 4.77 0.43 -0.20 117.00 123.52 1xxh n LEU 238 Ca -0.21 -2.12 0.00 0.00 -0.03 0.00 0.00 56.01 53.66 1xxh n LEU 238 Cb 0.75 -0.64 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1xxh n LEU 238 CO 0.14 0.69 0.26 1.21 -1.33 0.00 0.00 177.39 178.36 1xxh n GLU 239 N 0.16 0.06 -3.50 3.23 2.13 -1.17 -4.99 120.64 116.55 1xxh n GLU 239 Ca 0.15 -1.00 -0.22 0.00 0.66 0.00 0.00 57.16 56.75 1xxh n GLU 239 Cb 0.77 -0.54 -0.03 0.00 0.27 0.00 0.00 31.44 31.92 1xxh n GLU 239 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1xxh n GLY 240 N -0.05 -0.46 3.76 8.31 0.00 0.72 -4.88 105.19 112.59 1xxh n GLY 240 Ca 0.01 0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 1xxh n GLY 240 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xxh s SER 241 N -2.65 5.51 0.26 1.61 0.01 -1.23 -4.99 113.70 112.22 1xxh s SER 241 Ca 0.42 2.41 -0.19 0.00 1.31 0.00 0.00 55.95 59.90 1xxh s SER 241 Cb -0.24 -2.60 -0.09 0.00 0.21 0.00 0.00 66.02 63.30 1xxh s SER 241 CO 0.52 -1.37 0.74 -1.61 0.41 0.00 0.00 173.24 171.92 1xxh s GLU 242 N -3.09 4.20 0.32 12.44 2.02 -1.26 -4.88 118.70 128.44 1xxh s GLU 242 Ca 0.72 0.84 0.16 0.00 0.02 0.00 0.00 54.97 56.72 1xxh s GLU 242 Cb -0.31 -2.73 0.36 0.00 0.10 0.00 0.00 34.13 31.55 1xxh s GLU 242 CO 0.35 0.31 1.58 -1.00 0.02 0.00 0.00 175.26 176.52 1xxh h PRO 243 N 3.04 0.00 -0.37 0.39 0.13 -1.96 -3.23 132.00 130.01 1xxh h PRO 243 Ca -0.48 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.67 1xxh h PRO 243 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 1xxh h PRO 243 CO 0.65 0.48 0.25 0.28 -0.23 0.00 0.00 178.00 179.42 1xxh h VAL 244 N 0.00 1.05 0.00 1.56 2.07 -2.00 -0.54 116.25 118.38 1xxh h VAL 244 Ca -0.00 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 1xxh h VAL 244 Cb 1.17 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1xxh h VAL 244 CO 0.06 0.08 -0.27 -0.29 0.02 0.00 0.00 177.57 177.17 1xxh h ILE 245 N 0.43 0.05 0.02 4.57 2.10 -1.97 -3.20 117.51 119.51 1xxh h ILE 245 Ca 0.15 -1.08 -0.17 0.00 1.08 0.00 0.00 64.86 64.84 1xxh h ILE 245 Cb 0.05 1.91 0.01 0.00 -1.09 0.00 0.00 36.82 37.71 1xxh h ILE 245 CO -0.03 0.03 -0.67 -0.07 -1.08 0.00 0.00 178.15 176.33 1xxh h LEU 246 N 0.00 0.56 0.04 2.19 3.38 -1.19 -3.07 115.31 117.22 1xxh h LEU 246 Ca -0.00 -0.78 0.00 0.00 0.09 0.00 0.00 57.88 57.19 1xxh h LEU 246 Cb 1.03 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 1xxh h LEU 246 CO 0.00 1.27 -0.18 -0.07 0.09 0.00 0.00 178.44 179.56 1xxh h LEU 247 N -0.08 -0.54 -2.80 1.67 3.38 -1.36 -2.30 115.31 113.28 1xxh h LEU 247 Ca -0.09 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1xxh h LEU 247 Cb 1.39 0.20 -0.00 0.00 0.09 0.00 0.00 40.66 42.33 1xxh h LEU 247 CO 0.13 -0.19 -0.00 0.03 0.09 0.00 0.00 178.44 178.50 1xxh h ARG 248 N -0.25 0.00 -0.01 1.13 3.08 -1.70 -1.35 114.38 115.27 1xxh h ARG 248 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1xxh h ARG 248 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1xxh h ARG 248 CO -0.10 0.00 -0.06 1.15 -1.07 0.00 0.00 179.97 179.89 1xxh h THR 249 N 0.00 1.51 -0.62 2.04 2.02 -1.37 -2.74 112.91 113.74 1xxh h THR 249 Ca -0.00 -1.59 -0.02 0.00 0.77 0.00 0.00 66.41 65.58 1xxh h THR 249 Cb 0.05 2.53 -0.03 0.00 -1.74 0.00 0.00 68.15 68.97 1xxh h THR 249 CO 0.00 0.42 0.32 0.25 0.37 0.00 0.00 175.52 176.88 1xxh h LEU 250 N -0.56 0.78 0.10 2.58 5.85 -0.87 -3.01 115.31 120.18 1xxh h LEU 250 Ca -0.00 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.66 1xxh h LEU 250 Cb 0.72 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 1xxh h LEU 250 CO 0.01 0.65 -0.45 -0.61 -0.34 0.00 0.00 178.44 177.70 1xxh h GLN 251 N 0.87 -0.62 -0.94 1.25 4.15 -1.19 0.66 115.11 119.30 1xxh h GLN 251 Ca 0.22 0.04 0.28 0.00 0.77 0.00 0.00 58.65 59.96 1xxh h GLN 251 Cb 0.06 0.14 -0.15 0.00 0.21 0.00 0.00 27.48 27.74 1xxh h GLN 251 CO -0.03 -0.41 0.36 0.00 -1.93 0.00 0.00 178.83 176.81 1xxh h ARG 252 N -0.64 0.21 0.00 1.69 3.08 -1.35 0.78 114.38 118.15 1xxh h ARG 252 Ca -0.00 -0.01 -0.13 0.00 0.07 0.00 0.00 59.98 59.90 1xxh h ARG 252 Cb 0.65 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.63 1xxh h ARG 252 CO -0.25 0.14 -0.67 0.93 -1.07 0.00 0.00 179.97 179.05 1xxh h GLU 253 N 0.22 0.00 0.12 0.04 4.39 -1.25 -2.31 114.58 115.79 1xxh h GLU 253 Ca 0.64 0.00 -0.29 0.00 0.34 0.00 0.00 59.36 60.05 1xxh h GLU 253 Cb 1.40 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 30.05 1xxh h GLU 253 CO -0.67 0.56 -1.42 1.25 -1.16 0.00 0.00 179.01 177.57 1xxh h LEU 254 N 0.00 0.39 0.20 1.33 5.85 0.44 -2.61 115.31 120.91 1xxh h LEU 254 Ca -0.02 -0.50 -0.01 0.00 0.84 0.00 0.00 57.88 58.19 1xxh h LEU 254 Cb 1.47 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.37 1xxh h LEU 254 CO 0.07 1.40 -0.10 -0.07 -0.34 0.00 0.00 178.44 179.41 1xxh h LEU 255 N 0.07 -0.23 -0.94 2.25 3.38 0.25 -2.48 115.31 117.62 1xxh h LEU 255 Ca -0.20 -0.30 0.27 0.00 0.09 0.00 0.00 57.88 57.74 1xxh h LEU 255 Cb 2.00 0.06 -0.16 0.00 0.09 0.00 0.00 40.66 42.64 1xxh h LEU 255 CO 0.18 0.27 0.19 0.25 0.09 0.00 0.00 178.44 179.42 1xxh h LEU 256 N -0.82 -0.15 -1.76 1.67 6.46 -1.53 2.10 115.31 121.28 1xxh h LEU 256 Ca -0.03 0.24 0.01 0.00 -0.12 0.00 0.00 57.88 57.98 1xxh h LEU 256 Cb 0.52 0.36 -0.01 0.00 -0.73 0.00 0.00 40.66 40.79 1xxh h LEU 256 CO 0.04 -0.28 0.18 -0.07 -0.62 0.00 0.00 178.44 177.70 1xxh h LEU 257 N 0.10 0.28 0.37 2.25 3.38 -1.30 -2.51 115.31 117.88 1xxh h LEU 257 Ca 0.61 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.56 1xxh h LEU 257 Cb 1.32 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1xxh h LEU 257 CO -0.78 0.20 -0.18 0.58 0.09 0.00 0.00 178.44 178.35 1xxh h VAL 258 N 0.33 0.55 -0.08 1.22 2.07 0.39 -2.68 116.25 118.04 1xxh h VAL 258 Ca 0.11 -0.58 0.02 0.00 0.82 0.00 0.00 66.70 67.06 1xxh h VAL 258 Cb 0.03 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 1xxh h VAL 258 CO -0.02 0.10 -0.26 0.78 0.02 0.00 0.00 177.57 178.19 1xxh h ASN 259 N -0.86 -0.82 -0.96 0.57 2.35 -1.24 0.00 115.58 114.62 1xxh h ASN 259 Ca -0.05 0.10 0.12 0.00 -0.55 0.00 0.00 56.30 55.92 1xxh h ASN 259 Cb 0.54 0.32 -0.14 0.00 0.05 0.00 0.00 38.32 39.09 1xxh h ASN 259 CO 0.08 -0.22 -0.46 0.18 -1.65 0.00 0.00 177.43 175.37 1xxh n LEU 260 N -3.92 -0.79 0.03 1.61 4.77 -0.96 0.23 117.00 117.97 1xxh n LEU 260 Ca -0.03 1.70 0.07 0.00 -0.03 0.00 0.00 56.01 57.73 1xxh n LEU 260 Cb 0.17 -0.32 0.50 0.00 -2.33 0.00 0.00 43.42 41.44 1xxh n LEU 260 CO 0.03 -1.47 1.15 0.50 -1.33 0.00 0.00 177.39 176.28 1xxh h LYS 261 N 0.00 0.38 0.00 3.23 1.63 -1.10 -0.40 116.57 120.30 1xxh h LYS 261 Ca 0.26 -0.02 -0.04 0.00 -0.85 0.00 0.00 60.65 60.00 1xxh h LYS 261 Cb 0.50 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 32.04 1xxh h LYS 261 CO -0.94 0.25 -0.20 0.00 -3.45 0.00 0.00 179.45 175.11 1xxh h ARG 262 N 0.39 0.00 -2.47 1.90 3.08 0.49 -3.26 114.38 114.50 1xxh h ARG 262 Ca 0.16 0.00 -0.72 0.00 0.07 0.00 0.00 59.98 59.49 1xxh h ARG 262 Cb 0.15 0.00 -0.34 0.00 0.08 0.00 0.00 29.97 29.86 1xxh h ARG 262 CO -0.04 0.20 0.26 1.04 -1.07 0.00 0.00 179.97 180.36 1xxh n GLN 263 N -3.59 4.01 -4.05 0.04 6.02 0.60 -4.87 117.38 115.54 1xxh n GLN 263 Ca -0.01 -4.67 -0.35 0.00 -0.01 0.00 0.00 57.00 51.97 1xxh n GLN 263 Cb 0.34 -2.39 -0.14 0.00 1.02 0.00 0.00 30.24 29.07 1xxh n GLN 263 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1xxh s SER 264 N -2.16 4.19 0.00 1.08 1.04 -1.23 -4.19 113.70 112.44 1xxh s SER 264 Ca 0.38 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.42 1xxh s SER 264 Cb 0.15 -1.70 0.00 0.00 0.10 0.00 0.00 66.02 64.56 1xxh s SER 264 CO -0.02 0.01 0.00 0.00 0.98 0.00 0.00 173.24 174.22 1xxh n ALA 265 N 4.57 0.00 -0.01 5.32 0.00 -1.26 -4.83 120.51 124.30 1xxh n ALA 265 Ca -0.18 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.08 1xxh n ALA 265 Cb 0.51 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.82 1xxh n ALA 265 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1xxh n HIS 266 N -2.00 1.13 -3.65 0.00 -0.00 -1.26 -4.97 115.22 104.47 1xxh n HIS 266 Ca 0.00 0.28 -0.02 0.00 -0.00 0.00 0.00 57.72 57.98 1xxh n HIS 266 Cb 0.00 -1.16 -0.07 0.00 -0.00 0.00 0.00 29.99 28.76 1xxh n HIS 266 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 1xxh s THR 267 N -2.57 0.00 0.14 3.57 2.01 -1.26 -5.12 115.64 112.41 1xxh s THR 267 Ca -0.17 0.00 -0.34 0.00 0.31 0.00 0.00 61.69 61.49 1xxh s THR 267 Cb 0.07 -1.00 -0.14 0.00 0.01 0.00 0.00 72.50 71.44 1xxh s THR 267 CO 0.78 0.00 1.59 -2.65 -0.69 0.00 0.00 174.62 173.65 1xxh n PRO 268 N 2.21 2.11 -0.19 4.92 -0.02 -1.26 -4.69 135.00 138.07 1xxh n PRO 268 Ca -0.13 0.76 0.15 0.00 -2.02 0.00 0.00 63.50 62.26 1xxh n PRO 268 Cb 0.57 -2.53 0.25 0.00 -0.02 0.00 0.00 33.50 31.76 1xxh n PRO 268 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1xxh n LEU 269 N 3.61 0.04 0.00 2.45 7.94 -1.26 -0.99 117.00 128.79 1xxh n LEU 269 Ca 0.17 0.41 0.00 0.00 -1.11 0.00 0.00 56.01 55.48 1xxh n LEU 269 Cb 0.28 -0.20 0.00 0.00 0.53 0.00 0.00 43.42 44.03 1xxh n LEU 269 CO 0.64 -0.43 0.00 0.54 -1.11 0.00 0.00 177.39 177.03 1xxh n ARG 270 N -3.03 0.00 -0.22 1.96 1.74 -1.26 -2.48 116.66 113.36 1xxh n ARG 270 Ca 0.14 0.00 0.22 0.00 -0.77 0.00 0.00 57.85 57.44 1xxh n ARG 270 Cb 0.59 -0.46 0.39 0.00 -1.02 0.00 0.00 32.46 31.96 1xxh n ARG 270 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1xxh n ALA 271 N -3.00 0.70 0.37 7.54 0.00 -0.16 -0.43 120.51 125.52 1xxh n ALA 271 Ca 0.00 0.65 -0.19 0.00 0.00 0.00 0.00 53.44 53.90 1xxh n ALA 271 Cb 0.00 -0.66 -0.10 0.00 0.00 0.00 0.00 19.45 18.69 1xxh n ALA 271 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1xxh h LEU 272 N 0.00 -1.26 -0.99 0.00 5.85 -1.54 -2.79 115.31 114.59 1xxh h LEU 272 Ca 0.55 0.08 0.15 0.00 0.84 0.00 0.00 57.88 59.51 1xxh h LEU 272 Cb 1.51 0.39 -0.16 0.00 0.37 0.00 0.00 40.66 42.77 1xxh h LEU 272 CO -0.47 -0.70 -0.39 0.49 -0.34 0.00 0.00 178.44 177.03 1xxh n PHE 273 N -5.59 0.03 0.15 1.25 0.99 0.42 0.03 117.46 114.75 1xxh n PHE 273 Ca -0.13 1.22 -0.17 0.00 -0.00 0.00 0.00 57.45 58.37 1xxh n PHE 273 Cb 0.48 -0.87 -0.10 0.00 -1.00 0.00 0.00 39.48 37.99 1xxh n PHE 273 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 1xxh h ASP 274 N 0.00 -1.51 -0.62 4.37 5.19 -1.64 0.11 116.42 122.33 1xxh h ASP 274 Ca 0.34 0.15 0.07 0.00 -0.62 0.00 0.00 57.03 56.97 1xxh h ASP 274 Cb 0.59 0.54 -0.08 0.00 0.18 0.00 0.00 39.33 40.56 1xxh h ASP 274 CO -0.98 -0.58 -0.33 0.29 -3.12 0.00 0.00 179.24 174.52 1xxh n LYS 275 N -5.50 -0.24 0.14 3.56 4.76 0.10 0.21 118.16 121.19 1xxh n LYS 275 Ca -0.09 0.93 0.00 0.00 -2.87 0.00 0.00 58.31 56.28 1xxh n LYS 275 Cb 0.42 -1.38 0.17 0.00 -1.84 0.00 0.00 35.03 32.41 1xxh n LYS 275 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1xxh h HIS 276 N 0.00 0.00 -0.09 2.13 3.86 -1.05 -3.48 115.15 116.53 1xxh h HIS 276 Ca 0.13 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.30 1xxh h HIS 276 Cb 0.28 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.74 1xxh h HIS 276 CO -0.61 0.59 -0.03 0.54 0.86 0.00 0.00 177.93 179.28 1xxh n ARG 277 N -3.64 -0.37 0.00 2.45 1.74 0.55 -4.89 116.66 112.51 1xxh n ARG 277 Ca -0.01 0.33 0.07 0.00 -0.77 0.00 0.00 57.85 57.48 1xxh n ARG 277 Cb 0.63 -3.80 -0.13 0.00 -1.02 0.00 0.00 32.46 28.14 1xxh n ARG 277 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1xxh n VAL 278 N -2.82 0.42 -1.22 1.55 0.31 -1.26 -4.83 118.33 110.49 1xxh n VAL 278 Ca -0.02 -0.58 -0.08 0.00 -0.01 0.00 0.00 64.34 63.66 1xxh n VAL 278 Cb 0.12 -0.20 -0.05 0.00 -0.91 0.00 0.00 33.84 32.80 1xxh n VAL 278 CO 0.00 0.00 0.00 1.87 -1.32 0.00 0.00 176.83 177.38 1xxh n TRP 279 N -2.47 0.37 -0.07 3.52 -0.00 -1.26 -4.65 117.44 112.88 1xxh n TRP 279 Ca -0.08 -0.09 -0.03 0.00 -0.00 0.00 0.00 57.50 57.30 1xxh n TRP 279 Cb 0.67 -1.37 -0.16 0.00 -0.00 0.00 0.00 31.31 30.45 1xxh n TRP 279 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1xxh n GLN 280 N 6.08 0.68 0.00 5.87 0.00 -1.26 -4.80 117.38 123.95 1xxh n GLN 280 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 57.00 57.13 1xxh n GLN 280 Cb 0.47 -1.54 0.00 0.00 0.00 0.00 0.00 30.24 29.18 1xxh n GLN 280 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1xxh n ASN 281 N -2.61 0.00 0.07 2.61 2.85 -1.26 -4.91 115.26 112.00 1xxh n ASN 281 Ca -0.23 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.24 1xxh n ASN 281 Cb 0.97 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.99 1xxh n ASN 281 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1xxh n ARG 282 N -0.67 0.01 -3.14 1.20 1.74 -1.26 -3.48 116.66 111.05 1xxh n ARG 282 Ca 0.00 0.19 -0.45 0.00 -0.77 0.00 0.00 57.85 56.82 1xxh n ARG 282 Cb 0.00 -1.65 -0.05 0.00 -1.02 0.00 0.00 32.46 29.74 1xxh n ARG 282 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1xxh s ARG 283 N -1.99 3.06 0.00 5.56 3.52 -1.26 -4.31 118.95 123.52 1xxh s ARG 283 Ca 0.00 -1.24 0.00 0.00 -0.13 0.00 0.00 55.73 54.36 1xxh s ARG 283 Cb 0.00 -4.22 0.00 0.00 -1.56 0.00 0.00 34.95 29.17 1xxh s ARG 283 CO 0.00 -1.44 0.00 0.41 -0.81 0.00 0.00 175.30 173.46 1xxh n GLY 284 N 5.25 -0.54 4.89 8.12 0.00 -1.23 -5.05 105.19 116.65 1xxh n GLY 284 Ca -0.09 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1xxh n GLY 284 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xxh n GLY 287 N 0.00 1.54 0.33 -0.02 0.00 -1.26 -4.63 105.19 101.15 1xxh n GLY 287 Ca 0.00 -0.02 0.18 0.00 0.00 0.00 0.00 46.02 46.18 1xxh n GLY 287 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1xxh h GLU 288 N 0.00 0.44 0.74 1.61 4.81 -1.99 0.13 114.58 120.32 1xxh h GLU 288 Ca 0.00 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1xxh h GLU 288 Cb 0.00 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 29.29 1xxh h GLU 288 CO 0.00 0.29 -0.36 0.00 -0.73 0.00 0.00 179.01 178.21 1xxh h ALA 289 N 1.76 -1.00 0.00 2.92 0.00 -1.90 -2.76 119.26 118.29 1xxh h ALA 289 Ca 0.65 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1xxh h ALA 289 Cb 1.32 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1xxh h ALA 289 CO -0.53 -0.95 0.00 1.28 0.00 0.00 0.00 179.25 179.05 1xxh n LEU 290 N -5.45 0.00 -0.01 0.00 4.77 0.42 0.46 117.00 117.19 1xxh n LEU 290 Ca -0.13 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 55.87 1xxh n LEU 290 Cb 0.40 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.44 1xxh n LEU 290 CO 0.32 0.00 -0.60 0.59 -1.33 0.00 0.00 177.39 176.37 1xxh n ASN 291 N -0.46 3.52 -0.01 -1.43 3.02 -0.95 -4.74 115.26 114.22 1xxh n ASN 291 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1xxh n ASN 291 Cb 0.00 1.17 -0.00 0.00 -0.61 0.00 0.00 39.78 40.34 1xxh n ASN 291 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1xxh n ARG 292 N -1.82 4.48 -3.16 3.52 3.00 0.17 -4.95 116.66 117.91 1xxh n ARG 292 Ca -0.03 -0.16 -0.41 0.00 -0.01 0.00 0.00 57.85 57.24 1xxh n ARG 292 Cb 0.27 -0.67 -0.07 0.00 0.00 0.00 0.00 32.46 31.99 1xxh n ARG 292 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1xxh s LEU 293 N -1.42 4.12 0.52 0.55 1.43 -0.69 -4.98 118.68 118.20 1xxh s LEU 293 Ca 0.00 0.47 -0.18 0.00 -1.03 0.00 0.00 54.13 53.39 1xxh s LEU 293 Cb 0.00 -2.76 -0.07 0.00 0.03 0.00 0.00 46.19 43.40 1xxh s LEU 293 CO 0.02 -0.40 1.04 -0.94 0.23 0.00 0.00 176.35 176.29 1xxh s SER 294 N 1.59 6.18 0.32 2.29 1.04 -1.26 -4.86 113.70 119.00 1xxh s SER 294 Ca 0.24 1.86 0.10 0.00 0.48 0.00 0.00 55.95 58.63 1xxh s SER 294 Cb -0.15 -2.55 0.96 0.00 0.10 0.00 0.00 66.02 64.38 1xxh s SER 294 CO 0.10 -0.89 1.65 1.56 0.98 0.00 0.00 173.24 176.64 1xxh h GLN 295 N 1.13 0.24 -0.31 4.02 7.50 -1.97 0.20 115.11 125.92 1xxh h GLN 295 Ca -0.48 -0.01 -0.18 0.00 0.50 0.00 0.00 58.65 58.47 1xxh h GLN 295 Cb 1.22 -0.05 -0.00 0.00 0.05 0.00 0.00 27.48 28.69 1xxh h GLN 295 CO 0.59 0.16 -0.51 1.79 -1.50 0.00 0.00 178.83 179.36 1xxh h THR 296 N 0.25 1.27 -0.61 -0.54 1.35 -2.01 -3.08 112.91 109.55 1xxh h THR 296 Ca 0.68 -1.69 0.09 0.00 -0.55 0.00 0.00 66.41 64.93 1xxh h THR 296 Cb 1.50 1.59 -0.07 0.00 -1.73 0.00 0.00 68.15 69.44 1xxh h THR 296 CO -0.65 0.55 0.26 1.56 -0.25 0.00 0.00 175.52 176.99 1xxh h GLN 297 N 0.67 0.45 0.00 4.72 4.20 -0.99 -1.97 115.11 122.20 1xxh h GLN 297 Ca 0.02 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1xxh h GLN 297 Cb 1.11 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.79 1xxh h GLN 297 CO 0.12 0.30 0.00 1.28 -0.67 0.00 0.00 178.83 179.85 1xxh n LEU 298 N -4.95 0.00 -0.36 1.46 4.32 -0.70 -1.78 117.00 114.98 1xxh n LEU 298 Ca 0.08 0.97 -0.02 0.00 -0.02 0.00 0.00 56.01 57.03 1xxh n LEU 298 Cb 0.25 -0.47 0.03 0.00 -1.62 0.00 0.00 43.42 41.61 1xxh n LEU 298 CO 0.24 -0.47 0.54 -1.14 -1.22 0.00 0.00 177.39 175.34 1xxh n ARG 299 N -2.43 -0.24 -0.25 3.23 0.63 -0.99 0.12 116.66 116.74 1xxh n ARG 299 Ca 0.00 1.45 0.05 0.00 -0.92 0.00 0.00 57.85 58.42 1xxh n ARG 299 Cb 0.00 -2.14 0.15 0.00 0.45 0.00 0.00 32.46 30.92 1xxh n ARG 299 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 1xxh h GLN 300 N 0.00 0.12 0.00 -0.14 4.20 -1.14 2.41 115.11 120.56 1xxh h GLN 300 Ca 0.31 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 59.00 1xxh h GLN 300 Cb 0.55 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.30 1xxh h GLN 300 CO -0.93 0.08 -0.06 0.00 -0.67 0.00 0.00 178.83 177.24 1xxh h ALA 301 N 1.67 1.16 0.08 3.87 0.00 0.18 -1.20 119.26 125.01 1xxh h ALA 301 Ca 0.40 -0.06 -0.32 0.00 0.00 0.00 0.00 54.91 54.93 1xxh h ALA 301 Cb 0.69 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1xxh h ALA 301 CO -0.62 0.08 -1.74 0.28 0.00 0.00 0.00 179.25 177.24 1xxh h VAL 302 N 0.00 0.88 -0.13 0.00 2.07 0.50 -2.87 116.25 116.69 1xxh h VAL 302 Ca -0.00 -2.62 -0.01 0.00 0.82 0.00 0.00 66.70 64.89 1xxh h VAL 302 Cb 0.29 2.56 -0.01 0.00 -1.52 0.00 0.00 31.29 32.61 1xxh h VAL 302 CO 0.01 0.73 0.04 -0.61 0.02 0.00 0.00 177.57 177.76 1xxh h GLN 303 N 0.04 0.21 0.24 1.57 4.15 0.15 -2.05 115.11 119.43 1xxh h GLN 303 Ca -0.31 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.06 1xxh h GLN 303 Cb 2.02 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 29.66 1xxh h GLN 303 CO 0.11 0.35 -0.24 -0.07 -1.93 0.00 0.00 178.83 177.05 1xxh h LEU 304 N 0.03 -0.63 -0.55 -2.39 3.38 -1.37 -0.74 115.31 113.03 1xxh h LEU 304 Ca 0.04 0.06 0.10 0.00 0.09 0.00 0.00 57.88 58.17 1xxh h LEU 304 Cb 0.23 0.22 -0.11 0.00 0.09 0.00 0.00 40.66 41.09 1xxh h LEU 304 CO -0.00 -0.35 -0.29 0.25 0.09 0.00 0.00 178.44 178.14 1xxh h LEU 305 N -0.51 -0.99 0.12 1.67 6.46 -1.46 0.18 115.31 120.78 1xxh h LEU 305 Ca -0.01 0.21 0.01 0.00 -0.12 0.00 0.00 57.88 57.97 1xxh h LEU 305 Cb 0.47 0.51 -0.03 0.00 -0.73 0.00 0.00 40.66 40.88 1xxh h LEU 305 CO -0.05 -0.29 -0.39 0.74 -0.62 0.00 0.00 178.44 177.83 1xxh h THR 306 N -0.15 0.00 -0.98 1.05 2.02 -0.89 0.28 112.91 114.25 1xxh h THR 306 Ca 0.24 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.57 1xxh h THR 306 Cb 0.53 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.78 1xxh h THR 306 CO -0.64 0.00 -0.39 0.03 0.37 0.00 0.00 175.52 174.90 1xxh h ARG 307 N -0.59 -0.01 0.01 6.66 3.08 0.27 0.51 114.38 124.30 1xxh h ARG 307 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1xxh h ARG 307 Cb 0.58 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.62 1xxh h ARG 307 CO -0.20 -0.01 -0.14 1.15 -1.07 0.00 0.00 179.97 179.71 1xxh h THR 308 N -0.01 0.00 -0.86 2.04 2.02 0.27 1.88 112.91 118.25 1xxh h THR 308 Ca 0.34 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.73 1xxh h THR 308 Cb 0.60 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.85 1xxh h THR 308 CO -0.98 0.00 -0.04 -0.08 0.37 0.00 0.00 175.52 174.80 1xxh h GLU 309 N -0.18 0.05 0.32 6.66 4.57 0.15 1.55 114.58 127.71 1xxh h GLU 309 Ca 0.00 -0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 1xxh h GLU 309 Cb 0.19 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 1xxh h GLU 309 CO -0.09 0.03 -0.16 1.25 -1.18 0.00 0.00 179.01 178.87 1xxh h LEU 310 N 0.05 -0.37 -1.57 1.64 6.46 0.37 -2.49 115.31 119.41 1xxh h LEU 310 Ca 0.48 0.01 0.18 0.00 -0.12 0.00 0.00 57.88 58.43 1xxh h LEU 310 Cb 0.87 0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.87 1xxh h LEU 310 CO -0.80 -0.13 0.75 0.74 -0.62 0.00 0.00 178.44 178.38 1xxh h THR 311 N -0.70 0.19 -0.19 1.05 2.02 0.36 0.80 112.91 116.44 1xxh h THR 311 Ca -0.04 0.00 -0.19 0.00 0.77 0.00 0.00 66.41 66.95 1xxh h THR 311 Cb 0.33 0.38 0.01 0.00 -1.74 0.00 0.00 68.15 67.13 1xxh h THR 311 CO 0.07 0.00 -0.62 0.25 0.37 0.00 0.00 175.52 175.59 1xxh h LEU 312 N 0.00 0.88 -3.04 2.58 5.85 0.23 -3.25 115.31 118.56 1xxh h LEU 312 Ca 0.29 -0.59 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1xxh h LEU 312 Cb 1.79 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.57 1xxh h LEU 312 CO -0.00 1.32 0.00 1.17 -0.34 0.00 0.00 178.44 180.59 1xxh n LYS 313 N -4.04 3.51 0.00 1.25 4.81 0.27 -3.38 118.16 120.57 1xxh n LYS 313 Ca -0.07 -2.86 0.00 0.00 -0.87 0.00 0.00 58.31 54.51 1xxh n LYS 313 Cb 0.67 -1.83 0.00 0.00 0.02 0.00 0.00 35.03 33.89 1xxh n LYS 313 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1xxh n GLN 314 N 1.31 2.30 -2.83 1.64 7.27 -0.42 -4.64 117.38 122.02 1xxh n GLN 314 Ca 0.26 0.00 -0.00 0.00 0.07 0.00 0.00 57.00 57.33 1xxh n GLN 314 Cb 0.83 -0.81 0.05 0.00 2.41 0.00 0.00 30.24 32.72 1xxh n GLN 314 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1xxh n ASP 315 N -1.25 1.53 0.00 1.69 8.00 -1.23 -5.07 116.55 120.22 1xxh n ASP 315 Ca 0.00 -2.05 0.00 0.00 0.71 0.00 0.00 54.79 53.45 1xxh n ASP 315 Cb 0.00 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 40.63 1xxh n ASP 315 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1xxh n TYR 316 N -0.58 0.00 0.00 1.24 4.02 -1.22 -3.09 117.16 117.53 1xxh n TYR 316 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.96 1xxh n TYR 316 Cb 0.80 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.12 1xxh n TYR 316 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1xxh n GLY 317 N 0.00 0.68 1.78 2.72 0.00 -1.25 -5.03 105.19 104.09 1xxh n GLY 317 Ca 0.00 -0.42 -0.16 0.00 0.00 0.00 0.00 46.02 45.44 1xxh n GLY 317 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xxh n GLN 318 N 0.00 2.07 -3.22 1.61 -0.00 -1.18 -4.95 117.38 111.70 1xxh n GLN 318 Ca 0.00 -3.10 -0.21 0.00 -0.00 0.00 0.00 57.00 53.69 1xxh n GLN 318 Cb 0.00 -2.02 0.02 0.00 -0.00 0.00 0.00 30.24 28.23 1xxh n GLN 318 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 1xxh n SER 319 N -1.14 -6.68 -0.11 2.61 3.41 -1.26 -4.89 113.62 105.56 1xxh n SER 319 Ca 0.49 0.05 -0.05 0.00 -0.26 0.00 0.00 58.87 59.10 1xxh n SER 319 Cb 1.40 -3.57 0.15 0.00 -0.26 0.00 0.00 64.21 61.92 1xxh n SER 319 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1xxh h VAL 320 N 1.63 1.25 -0.80 -3.33 3.04 -1.96 -3.19 116.25 112.88 1xxh h VAL 320 Ca -0.28 -1.03 0.26 0.00 -1.01 0.00 0.00 66.70 64.64 1xxh h VAL 320 Cb 1.20 0.90 -0.15 0.00 -2.01 0.00 0.00 31.29 31.23 1xxh h VAL 320 CO 0.24 0.36 0.17 0.79 -1.01 0.00 0.00 177.57 178.12 1xxh n TRP 321 N -4.21 0.67 0.00 3.17 7.02 -1.26 -0.33 117.44 122.50 1xxh n TRP 321 Ca 0.02 0.95 0.00 0.00 -1.02 0.00 0.00 57.50 57.46 1xxh n TRP 321 Cb 0.31 -1.20 0.00 0.00 -2.42 0.00 0.00 31.31 28.00 1xxh n TRP 321 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1xxh n ALA 322 N -2.94 -0.02 -0.15 6.99 0.00 -1.21 -1.20 120.51 121.97 1xxh n ALA 322 Ca 0.23 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.64 1xxh n ALA 322 Cb 0.77 0.42 0.03 0.00 0.00 0.00 0.00 19.45 20.67 1xxh n ALA 322 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1xxh h GLU 323 N 0.00 -0.04 -0.82 0.00 5.08 -0.93 -1.12 114.58 116.75 1xxh h GLU 323 Ca 0.00 0.00 0.19 0.00 -1.00 0.00 0.00 59.36 58.56 1xxh h GLU 323 Cb 0.00 0.01 -0.14 0.00 0.50 0.00 0.00 28.75 29.12 1xxh h GLU 323 CO 0.00 -0.03 0.01 -0.07 -1.00 0.00 0.00 179.01 177.92 1xxh h LEU 324 N -0.05 -0.39 -0.02 1.33 3.38 -0.83 0.41 115.31 119.15 1xxh h LEU 324 Ca 0.23 0.22 0.03 0.00 0.09 0.00 0.00 57.88 58.46 1xxh h LEU 324 Cb 0.41 0.38 -0.05 0.00 0.09 0.00 0.00 40.66 41.49 1xxh h LEU 324 CO -0.53 -0.22 -0.29 -0.08 0.09 0.00 0.00 178.44 177.41 1xxh h GLU 325 N 0.09 -0.41 0.48 1.13 4.81 0.17 0.16 114.58 121.00 1xxh h GLU 325 Ca 0.46 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.70 1xxh h GLU 325 Cb 0.84 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.29 1xxh h GLU 325 CO -0.73 -0.28 -0.51 0.78 -0.73 0.00 0.00 179.01 177.54 1xxh h GLY 326 N -0.43 -1.27 -0.36 1.92 0.00 -0.83 -2.57 103.07 99.53 1xxh h GLY 326 Ca 0.07 0.60 0.03 0.00 0.00 0.00 0.00 47.33 48.03 1xxh h GLY 326 CO -0.26 -0.37 -0.21 -0.10 0.00 0.00 0.00 176.54 175.60 1xxh n LEU 327 N -5.54 -0.38 -0.11 3.11 0.00 0.12 -0.18 117.00 114.02 1xxh n LEU 327 Ca -0.12 0.91 -0.07 0.00 0.00 0.00 0.00 56.01 56.73 1xxh n LEU 327 Cb 0.46 -0.22 -0.01 0.00 0.00 0.00 0.00 43.42 43.66 1xxh n LEU 327 CO 0.26 -0.66 0.67 0.77 0.00 0.00 0.00 177.39 178.43 1xxh h SER 328 N 0.00 -0.92 -0.79 1.96 4.64 -0.72 0.51 113.55 118.22 1xxh h SER 328 Ca 0.06 0.17 0.23 0.00 -0.47 0.00 0.00 61.79 61.78 1xxh h SER 328 Cb 0.15 0.45 -0.03 0.00 -0.31 0.00 0.00 62.40 62.66 1xxh h SER 328 CO -0.34 -0.29 0.71 -0.07 -0.87 0.00 0.00 176.83 175.97 1xxh h LEU 329 N -0.22 0.00 -0.15 5.97 3.38 -0.17 0.22 115.31 124.34 1xxh h LEU 329 Ca 0.18 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.11 1xxh h LEU 329 Cb 0.50 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 1xxh h LEU 329 CO -0.50 0.00 -0.05 0.25 0.09 0.00 0.00 178.44 178.22 1xxh h LEU 330 N 0.00 0.30 -0.05 1.67 7.12 0.66 -2.79 115.31 122.22 1xxh h LEU 330 Ca 0.38 -0.39 0.00 0.00 0.13 0.00 0.00 57.88 57.99 1xxh h LEU 330 Cb 1.80 -0.08 0.00 0.00 -0.53 0.00 0.00 40.66 41.84 1xxh h LEU 330 CO -0.00 0.63 0.00 0.18 -0.13 0.00 0.00 178.44 179.11 1xxh n LEU 331 N -4.67 0.02 0.00 2.25 4.77 0.76 -2.88 117.00 117.26 1xxh n LEU 331 Ca -0.06 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1xxh n LEU 331 Cb 0.28 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1xxh n LEU 331 CO 0.37 0.01 0.10 0.00 -1.33 0.00 0.00 177.39 176.54 1xxh s HIS 333 N -0.34 0.11 0.64 0.00 3.76 -1.14 -4.95 115.29 113.38 1xxh s HIS 333 Ca 0.00 -0.47 -0.18 0.00 -0.15 0.00 0.00 55.06 54.26 1xxh s HIS 333 Cb 0.00 0.22 -0.01 0.00 1.11 0.00 0.00 32.58 33.90 1xxh s HIS 333 CO 0.00 -0.86 1.25 0.15 -0.85 0.00 0.00 174.74 174.43 1xxh s LYS 334 N -3.92 2.62 0.56 1.40 1.02 -1.26 -4.87 119.74 115.28 1xxh s LYS 334 Ca 0.13 1.93 0.07 0.00 0.02 0.00 0.00 55.97 58.12 1xxh s LYS 334 Cb 0.01 -1.87 0.07 0.00 -0.52 0.00 0.00 37.83 35.52 1xxh s LYS 334 CO -0.00 -1.51 0.61 -0.35 -0.92 0.00 0.00 175.35 173.18 1xxh n PRO 335 N -1.95 0.64 0.00 -1.68 -0.04 -1.26 -5.06 135.00 125.65 1xxh n PRO 335 Ca 0.15 -3.24 0.00 0.00 -0.04 0.00 0.00 63.50 60.36 1xxh n PRO 335 Cb 0.49 0.05 0.00 0.00 -0.04 0.00 0.00 33.50 34.00 1xxh n PRO 335 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1xxh n LEU 336 N 0.00 0.00 -0.41 1.53 -0.00 -1.26 -5.13 117.00 111.73 1xxh n LEU 336 Ca 0.08 0.00 0.07 0.00 -0.00 0.00 0.00 56.01 56.16 1xxh n LEU 336 Cb 0.61 0.00 0.17 0.00 -0.00 0.00 0.00 43.42 44.19 1xxh n LEU 336 CO 0.38 0.00 0.43 0.00 -0.00 0.00 0.00 177.39 178.20 1xxh n ALA 337 N -3.00 2.97 -1.49 1.47 0.00 -1.26 -5.15 120.51 114.06 1xxh n ALA 337 Ca 0.00 -2.91 0.00 0.00 0.00 0.00 0.00 53.44 50.53 1xxh n ALA 337 Cb 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 19.45 19.07 1xxh n ALA 337 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25