#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3afe n ASP 8 N 0.00 -0.73 -0.21 2.89 5.68 -1.26 -5.05 116.55 117.87 3afe n ASP 8 Ca 0.00 -2.91 -0.02 0.00 -0.50 0.00 0.00 54.79 51.36 3afe n ASP 8 Cb 0.00 1.62 0.09 0.00 -1.14 0.00 0.00 41.12 41.68 3afe n ASP 8 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3afe h ALA 9 N 1.95 0.81 -0.09 2.12 0.00 -1.98 -2.69 119.26 119.39 3afe h ALA 9 Ca -0.21 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.61 3afe h ALA 9 Cb 1.06 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3afe h ALA 9 CO 0.31 -0.03 -0.44 1.96 0.00 0.00 0.00 179.25 181.05 3afe h GLN 10 N 0.59 0.21 0.00 0.00 7.50 -1.99 -2.38 115.11 119.04 3afe h GLN 10 Ca 0.28 -0.11 -0.17 0.00 0.50 0.00 0.00 58.65 59.15 3afe h GLN 10 Cb 0.20 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.71 3afe h GLN 10 CO -0.19 0.62 -0.83 0.66 -1.50 0.00 0.00 178.83 177.59 3afe h SER 11 N 0.17 0.03 -0.40 1.46 4.64 -1.92 -1.28 113.55 116.25 3afe h SER 11 Ca 0.01 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.27 3afe h SER 11 Cb 0.86 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.92 3afe h SER 11 CO 0.07 0.84 0.11 0.58 -0.87 0.00 0.00 176.83 177.56 3afe h VAL 12 N 0.01 1.22 -0.71 0.95 2.07 -1.32 -0.65 116.25 117.82 3afe h VAL 12 Ca -0.01 -0.75 0.02 0.00 0.82 0.00 0.00 66.70 66.78 3afe h VAL 12 Cb 1.45 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 32.13 3afe h VAL 12 CO 0.11 0.26 0.46 -0.07 0.02 0.00 0.00 177.57 178.35 3afe h LEU 13 N 0.51 0.77 -0.77 2.57 4.07 -1.25 -0.81 115.31 120.40 3afe h LEU 13 Ca 0.13 -0.01 -0.02 0.00 0.08 0.00 0.00 57.88 58.06 3afe h LEU 13 Cb 0.29 -0.18 -0.04 0.00 1.08 0.00 0.00 40.66 41.81 3afe h LEU 13 CO -0.00 0.54 0.41 0.00 -1.08 0.00 0.00 178.44 178.32 3afe h ALA 14 N 1.28 0.99 -0.33 1.53 0.00 -1.02 -1.79 119.26 119.92 3afe h ALA 14 Ca 0.27 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 3afe h ALA 14 Cb -0.04 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 3afe h ALA 14 CO -0.08 0.52 -0.13 0.00 0.00 0.00 0.00 179.25 179.56 3afe h ALA 15 N 1.21 1.16 -0.45 0.00 0.00 -0.72 -2.55 119.26 117.91 3afe h ALA 15 Ca 0.27 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 3afe h ALA 15 Cb 0.05 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3afe h ALA 15 CO -0.04 0.53 -0.06 0.82 0.00 0.00 0.00 179.25 180.50 3afe h ILE 16 N 0.53 1.27 -0.64 0.00 2.04 -0.65 -2.31 117.51 117.75 3afe h ILE 16 Ca 0.09 -1.16 0.13 0.00 1.00 0.00 0.00 64.86 64.92 3afe h ILE 16 Cb 0.53 1.10 -0.10 0.00 -0.74 0.00 0.00 36.82 37.61 3afe h ILE 16 CO 0.03 0.40 0.11 0.44 0.00 0.00 0.00 178.15 179.13 3afe h ASP 17 N 0.68 -0.05 -0.16 1.72 3.32 -1.08 -1.44 116.42 119.41 3afe h ASP 17 Ca 0.12 0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.28 3afe h ASP 17 Cb 0.59 0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 3afe h ASP 17 CO 0.04 -0.03 0.06 0.78 -1.72 0.00 0.00 179.24 178.37 3afe h ASN 18 N 0.23 0.28 1.52 6.45 -0.26 -1.06 -2.54 115.58 120.19 3afe h ASN 18 Ca 0.34 -0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 56.04 3afe h ASN 18 Cb 0.54 -0.07 -0.00 0.00 -1.06 0.00 0.00 38.32 37.72 3afe h ASN 18 CO -0.45 0.28 -0.07 -0.07 -1.06 0.00 0.00 177.43 176.06 3afe h LEU 19 N 0.31 0.00 -0.31 1.61 3.38 -0.73 -3.39 115.31 116.17 3afe h LEU 19 Ca 0.08 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.12 3afe h LEU 19 Cb 0.11 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.78 3afe h LEU 19 CO -0.01 0.07 -0.20 -0.07 0.09 0.00 0.00 178.44 178.32 3afe h LEU 20 N 0.00 -0.67 -1.29 1.67 3.38 -1.10 -1.75 115.31 115.55 3afe h LEU 20 Ca -0.00 0.14 0.11 0.00 0.09 0.00 0.00 57.88 58.22 3afe h LEU 20 Cb 0.85 0.34 -0.06 0.00 0.09 0.00 0.00 40.66 41.88 3afe h LEU 20 CO 0.01 -0.24 0.55 -0.65 0.09 0.00 0.00 178.44 178.20 3afe h PRO 21 N -0.17 0.73 0.10 1.13 0.11 -1.79 0.29 132.00 132.40 3afe h PRO 21 Ca 0.16 -0.04 -0.29 0.00 0.11 0.00 0.00 66.00 65.94 3afe h PRO 21 Cb 0.42 -0.16 0.02 0.00 0.11 0.00 0.00 31.00 31.39 3afe h PRO 21 CO -0.42 0.48 -1.20 1.05 -0.21 0.00 0.00 178.00 177.70 3afe h GLU 22 N 0.75 0.58 -0.58 1.05 4.11 -1.63 -2.60 114.58 116.27 3afe h GLU 22 Ca 0.40 -0.76 -0.07 0.00 0.07 0.00 0.00 59.36 59.00 3afe h GLU 22 Cb 0.53 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 3afe h GLU 22 CO -0.17 1.34 0.09 0.82 0.07 0.00 0.00 179.01 181.15 3afe h ILE 23 N 0.27 1.25 0.01 -1.06 2.04 -0.97 -2.78 117.51 116.26 3afe h ILE 23 Ca -0.17 -0.97 0.03 0.00 1.00 0.00 0.00 64.86 64.75 3afe h ILE 23 Cb 1.87 0.71 -0.04 0.00 -0.74 0.00 0.00 36.82 38.62 3afe h ILE 23 CO 0.23 0.36 -0.20 -0.09 0.00 0.00 0.00 178.15 178.44 3afe h ARG 24 N 0.89 -0.31 0.00 2.37 2.43 -0.93 -2.64 114.38 116.19 3afe h ARG 24 Ca 0.18 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.37 3afe h ARG 24 Cb 0.40 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 3afe h ARG 24 CO 0.01 -0.21 0.00 -0.44 -1.51 0.00 0.00 179.97 177.82 3afe h ASP 25 N -0.32 0.00 0.03 -3.80 3.45 -1.24 -1.62 116.42 112.91 3afe h ASP 25 Ca 0.06 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.52 3afe h ASP 25 Cb 0.40 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.17 3afe h ASP 25 CO -0.18 0.00 -0.18 -1.14 -1.57 0.00 0.00 179.24 176.17 3afe n ARG 26 N -2.59 1.60 -0.29 3.56 0.63 -1.01 -4.49 116.66 114.06 3afe n ARG 26 Ca -0.00 -1.19 0.00 0.00 -0.92 0.00 0.00 57.85 55.74 3afe n ARG 26 Cb 0.17 -1.48 0.13 0.00 0.45 0.00 0.00 32.46 31.74 3afe n ARG 26 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3afe h ALA 27 N 4.22 1.12 0.36 5.13 0.00 -1.10 0.45 119.26 129.44 3afe h ALA 27 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3afe h ALA 27 Cb 0.73 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3afe h ALA 27 CO 0.00 0.22 -0.17 0.37 0.00 0.00 0.00 179.25 179.66 3afe h GLN 28 N 0.90 -0.47 -0.80 0.00 5.75 -1.81 -0.44 115.11 118.24 3afe h GLN 28 Ca 0.36 0.03 0.06 0.00 -0.15 0.00 0.00 58.65 58.95 3afe h GLN 28 Cb 0.18 0.11 -0.06 0.00 1.07 0.00 0.00 27.48 28.78 3afe h GLN 28 CO -0.18 -0.31 0.48 0.00 -2.65 0.00 0.00 178.83 176.18 3afe h ALA 29 N 0.14 1.09 -0.25 3.38 0.00 -1.64 0.70 119.26 122.67 3afe h ALA 29 Ca -0.05 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.90 3afe h ALA 29 Cb 0.38 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 3afe h ALA 29 CO 0.08 0.21 -0.02 1.15 0.00 0.00 0.00 179.25 180.67 3afe h THR 30 N 0.88 0.80 -0.78 0.00 2.02 0.06 0.41 112.91 116.29 3afe h THR 30 Ca 0.35 -0.02 -0.02 0.00 0.77 0.00 0.00 66.41 67.49 3afe h THR 30 Cb 0.18 0.74 -0.04 0.00 -1.74 0.00 0.00 68.15 67.29 3afe h THR 30 CO -0.18 0.01 0.40 -0.08 0.37 0.00 0.00 175.52 176.04 3afe h GLU 31 N 0.05 1.10 -0.30 6.66 4.81 -0.22 -2.73 114.58 123.95 3afe h GLU 31 Ca 0.12 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3afe h GLU 31 Cb 0.17 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 3afe h GLU 31 CO -0.22 0.83 0.19 -0.44 -0.73 0.00 0.00 179.01 178.64 3afe h ASP 32 N 1.10 0.36 -0.00 1.04 3.32 -0.23 -2.96 116.42 119.05 3afe h ASP 32 Ca 0.27 -0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.25 3afe h ASP 32 Cb 0.07 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 3afe h ASP 32 CO -0.04 0.30 -0.06 -0.07 -1.72 0.00 0.00 179.24 177.64 3afe h LEU 33 N 0.39 0.16 1.67 1.55 3.38 -0.67 -3.46 115.31 118.33 3afe h LEU 33 Ca 0.11 -0.02 -0.24 0.00 0.09 0.00 0.00 57.88 57.82 3afe h LEU 33 Cb 0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3afe h LEU 33 CO -0.02 0.25 -0.30 0.54 0.09 0.00 0.00 178.44 179.00 3afe n ARG 34 N -4.36 -0.95 -3.59 1.13 1.74 -1.05 -4.98 116.66 104.60 3afe n ARG 34 Ca -0.01 0.59 -0.05 0.00 -0.77 0.00 0.00 57.85 57.61 3afe n ARG 34 Cb 0.20 -4.75 -0.02 0.00 -1.02 0.00 0.00 32.46 26.87 3afe n ARG 34 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 3afe s ARG 35 N -4.54 0.36 0.30 5.56 1.70 -1.19 -2.76 118.95 118.37 3afe s ARG 35 Ca 0.00 -0.13 -0.30 0.00 -0.47 0.00 0.00 55.73 54.83 3afe s ARG 35 Cb 0.00 0.16 -0.11 0.00 -0.57 0.00 0.00 34.95 34.43 3afe s ARG 35 CO 0.00 -0.16 1.56 -0.51 -1.08 0.00 0.00 175.30 175.12 3afe s LEU 36 N -2.19 4.35 0.26 -1.89 1.02 -1.09 -4.80 118.68 114.33 3afe s LEU 36 Ca 0.09 2.93 -0.30 0.00 0.02 0.00 0.00 54.13 56.86 3afe s LEU 36 Cb -0.01 -3.64 -0.11 0.00 0.02 0.00 0.00 46.19 42.45 3afe s LEU 36 CO -0.05 -0.88 1.56 -2.84 0.02 0.00 0.00 176.35 174.15 3afe s PRO 37 N -0.64 4.17 0.47 1.29 0.02 -1.26 -4.88 135.00 134.17 3afe s PRO 37 Ca 0.62 2.48 0.27 0.00 0.02 0.00 0.00 61.00 64.39 3afe s PRO 37 Cb -0.47 -3.06 1.33 0.00 0.02 0.00 0.00 34.50 32.31 3afe s PRO 37 CO 0.49 -0.58 1.81 -0.44 -0.33 0.00 0.00 177.00 177.94 3afe h ASP 38 N 5.25 0.21 0.10 2.53 3.32 -2.00 -1.43 116.42 124.41 3afe h ASP 38 Ca -0.46 0.04 -0.11 0.00 0.02 0.00 0.00 57.03 56.52 3afe h ASP 38 Cb 1.22 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.76 3afe h ASP 38 CO 0.81 0.04 -0.38 -0.08 -1.72 0.00 0.00 179.24 177.91 3afe h GLU 39 N 0.19 0.37 0.15 3.56 4.81 -1.99 -0.27 114.58 121.39 3afe h GLU 39 Ca 0.55 -0.18 -0.30 0.00 -0.13 0.00 0.00 59.36 59.31 3afe h GLU 39 Cb 1.79 -0.00 0.03 0.00 0.63 0.00 0.00 28.75 31.20 3afe h GLU 39 CO -0.14 0.71 -1.28 1.79 -0.73 0.00 0.00 179.01 179.35 3afe h THR 40 N 0.32 1.33 -0.30 0.32 1.35 -1.65 -2.70 112.91 111.58 3afe h THR 40 Ca 0.03 -2.63 -0.00 0.00 -0.55 0.00 0.00 66.41 63.25 3afe h THR 40 Cb 0.82 2.81 -0.01 0.00 -1.73 0.00 0.00 68.15 70.03 3afe h THR 40 CO 0.07 0.79 0.17 0.58 -0.25 0.00 0.00 175.52 176.88 3afe h VAL 41 N 0.20 1.12 0.21 6.82 2.07 -1.30 0.02 116.25 125.39 3afe h VAL 41 Ca -0.19 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 67.02 3afe h VAL 41 Cb 1.97 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.50 3afe h VAL 41 CO 0.24 0.12 -0.25 0.50 0.02 0.00 0.00 177.57 178.20 3afe h LYS 42 N 0.38 -0.49 -0.56 1.57 3.64 -1.15 -0.20 116.57 119.75 3afe h LYS 42 Ca 0.11 0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.61 3afe h LYS 42 Cb 0.05 0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 31.91 3afe h LYS 42 CO -0.02 -0.32 0.17 0.00 -2.27 0.00 0.00 179.45 177.01 3afe h ALA 43 N 0.19 0.69 -0.04 5.00 0.00 -1.32 0.20 119.26 123.98 3afe h ALA 43 Ca 0.01 0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.04 3afe h ALA 43 Cb 0.49 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 3afe h ALA 43 CO -0.08 -0.24 -0.18 -0.07 0.00 0.00 0.00 179.25 178.67 3afe h LEU 44 N 0.33 -0.54 -1.33 0.00 3.38 -0.60 -1.99 115.31 114.56 3afe h LEU 44 Ca 0.28 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.39 3afe h LEU 44 Cb 0.37 0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.30 3afe h LEU 44 CO -0.32 -0.24 0.49 -0.78 0.09 0.00 0.00 178.44 177.68 3afe h ASP 45 N -0.27 0.72 0.37 -0.43 3.58 0.09 -2.54 116.42 117.95 3afe h ASP 45 Ca 0.07 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.39 3afe h ASP 45 Cb 0.37 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.25 3afe h ASP 45 CO -0.20 0.48 -0.55 0.44 -2.88 0.00 0.00 179.24 176.53 3afe h ASP 46 N 0.83 0.21 0.11 2.28 5.19 0.08 -2.92 116.42 122.19 3afe h ASP 46 Ca 0.32 -0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.61 3afe h ASP 46 Cb 0.20 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.65 3afe h ASP 46 CO -0.10 0.72 -0.10 1.33 -3.12 0.00 0.00 179.24 177.97 3afe n VAL 47 N -3.91 0.00 -0.07 -1.35 0.24 -0.93 -4.93 118.33 107.38 3afe n VAL 47 Ca -0.02 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 3afe n VAL 47 Cb 0.58 0.37 0.00 0.00 -1.47 0.00 0.00 33.84 33.32 3afe n VAL 47 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3afe n GLY 48 N 1.24 0.96 0.13 7.63 0.00 -1.09 -4.58 105.19 109.48 3afe n GLY 48 Ca 0.16 -0.03 -0.07 0.00 0.00 0.00 0.00 46.02 46.08 3afe n GLY 48 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3afe h PHE 49 N 0.00 0.10 0.00 1.61 3.57 -1.69 -1.89 116.94 118.64 3afe h PHE 49 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3afe h PHE 49 Cb 0.00 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 3afe h PHE 49 CO 0.00 0.03 0.00 0.74 -2.23 0.00 0.00 178.31 176.85 3afe h PHE 50 N 0.17 0.00 0.00 0.41 0.04 -1.87 -1.78 116.94 113.91 3afe h PHE 50 Ca 0.13 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.87 3afe h PHE 50 Cb 0.14 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.28 3afe h PHE 50 CO -0.16 0.00 -0.14 1.79 -0.60 0.00 0.00 178.31 179.19 3afe h THR 51 N 0.00 0.33 -0.92 -1.55 1.35 -1.71 -3.38 112.91 107.03 3afe h THR 51 Ca 0.00 -0.97 0.15 0.00 -0.55 0.00 0.00 66.41 65.04 3afe h THR 51 Cb 0.46 1.74 -0.16 0.00 -1.73 0.00 0.00 68.15 68.47 3afe h THR 51 CO 0.00 0.14 -0.35 -0.07 -0.25 0.00 0.00 175.52 174.99 3afe h LEU 52 N 0.00 -1.27 -3.20 3.87 3.38 -1.23 0.45 115.31 117.32 3afe h LEU 52 Ca -0.00 0.29 0.00 0.00 0.09 0.00 0.00 57.88 58.26 3afe h LEU 52 Cb 0.73 0.69 0.00 0.00 0.09 0.00 0.00 40.66 42.17 3afe h LEU 52 CO 0.02 -0.30 0.00 0.18 0.09 0.00 0.00 178.44 178.43 3afe n LEU 53 N -5.50 4.35 -4.77 1.67 4.77 -1.26 -0.80 117.00 115.47 3afe n LEU 53 Ca 0.10 -2.61 -0.38 0.00 -0.03 0.00 0.00 56.01 53.09 3afe n LEU 53 Cb 0.41 -0.53 -0.06 0.00 -2.33 0.00 0.00 43.42 40.92 3afe n LEU 53 CO -0.10 0.73 0.22 -1.58 -1.33 0.00 0.00 177.39 175.33 3afe s GLN 54 N -2.12 4.24 0.63 3.23 0.74 0.15 -3.68 119.66 122.85 3afe s GLN 54 Ca 0.44 0.59 -0.18 0.00 0.05 0.00 0.00 55.36 56.27 3afe s GLN 54 Cb 0.31 -3.34 -0.03 0.00 1.10 0.00 0.00 33.01 31.05 3afe s GLN 54 CO 0.17 0.39 0.96 -2.30 -0.55 0.00 0.00 175.29 173.97 3afe n PRO 55 N 2.75 0.80 0.13 1.67 -0.02 -1.26 0.11 135.00 139.17 3afe n PRO 55 Ca -0.09 0.32 0.13 0.00 -2.02 0.00 0.00 63.50 61.84 3afe n PRO 55 Cb 0.51 -2.18 0.44 0.00 -0.02 0.00 0.00 33.50 32.25 3afe n PRO 55 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 3afe h GLN 56 N 0.29 0.00 0.00 -0.52 3.07 -1.91 -1.25 115.11 114.79 3afe h GLN 56 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.26 3afe h GLN 56 Cb 1.36 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.92 3afe h GLN 56 CO 0.50 0.00 0.00 -0.56 0.09 0.00 0.00 178.83 178.86 3afe h GLN 57 N 0.00 0.00 -0.29 0.06 3.07 -1.90 -2.43 115.11 113.62 3afe h GLN 57 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3afe h GLN 57 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.17 3afe h GLN 57 CO 0.00 0.00 0.00 0.91 0.09 0.00 0.00 178.83 179.83 3afe n TRP 58 N -2.93 0.63 -0.37 0.06 7.02 -0.92 -4.94 117.44 115.99 3afe n TRP 58 Ca -0.01 -0.66 0.00 0.00 -1.02 0.00 0.00 57.50 55.81 3afe n TRP 58 Cb 0.15 -0.15 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 3afe n TRP 58 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3afe n GLY 59 N 0.03 0.76 3.05 6.99 0.00 -0.91 -4.84 105.19 110.26 3afe n GLY 59 Ca 0.15 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.98 3afe n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3afe n GLY 60 N -2.21 0.43 0.20 -0.02 0.00 -0.52 -4.93 105.19 98.14 3afe n GLY 60 Ca 0.00 -1.98 0.05 0.00 0.00 0.00 0.00 46.02 44.10 3afe n GLY 60 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3afe n LEU 61 N 0.00 1.13 -3.78 0.99 4.77 -0.11 -3.58 117.00 116.41 3afe n LEU 61 Ca 0.13 -0.71 -0.17 0.00 -0.03 0.00 0.00 56.01 55.23 3afe n LEU 61 Cb 0.46 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 3afe n LEU 61 CO 0.32 0.23 -0.08 0.00 -1.33 0.00 0.00 177.39 176.53 3afe n GLN 62 N -0.45 -0.77 -1.61 3.23 10.64 0.12 -4.79 117.38 123.75 3afe n GLN 62 Ca 0.04 -0.28 -0.28 0.00 -1.83 0.00 0.00 57.00 54.66 3afe n GLN 62 Cb 0.22 -0.40 0.20 0.00 -0.86 0.00 0.00 30.24 29.40 3afe n GLN 62 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3afe s ASP 64 N -5.28 6.71 0.53 0.00 -1.08 -1.26 -4.73 116.67 111.56 3afe s ASP 64 Ca 0.70 2.34 0.21 0.00 -0.52 0.00 0.00 52.55 55.28 3afe s ASP 64 Cb -0.03 -2.57 1.41 0.00 -1.46 0.00 0.00 42.92 40.27 3afe s ASP 64 CO 0.50 -0.80 2.15 -0.65 0.52 0.00 0.00 175.17 176.88 3afe h PRO 65 N 7.92 0.00 -0.21 4.34 0.11 -1.94 -1.92 132.00 140.31 3afe h PRO 65 Ca -0.41 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.65 3afe h PRO 65 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3afe h PRO 65 CO 0.91 0.05 -0.10 0.00 -0.21 0.00 0.00 178.00 178.65 3afe h ALA 66 N 1.95 1.44 0.00 -0.75 0.00 -1.90 -2.16 119.26 117.84 3afe h ALA 66 Ca -0.00 -0.21 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 3afe h ALA 66 Cb 0.09 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3afe h ALA 66 CO 0.01 0.39 -0.79 -0.07 0.00 0.00 0.00 179.25 178.79 3afe h LEU 67 N 0.32 0.00 -0.20 0.00 3.38 -1.75 -1.73 115.31 115.33 3afe h LEU 67 Ca 0.07 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 3afe h LEU 67 Cb 0.38 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 3afe h LEU 67 CO 0.02 0.79 -0.29 0.15 0.09 0.00 0.00 178.44 179.20 3afe h PHE 68 N 0.00 0.69 -0.27 1.13 3.57 -1.39 -1.78 116.94 118.89 3afe h PHE 68 Ca -0.01 -0.23 -0.13 0.00 3.53 0.00 0.00 57.97 61.13 3afe h PHE 68 Cb 1.46 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 40.05 3afe h PHE 68 CO 0.00 0.95 -0.37 0.74 -2.23 0.00 0.00 178.31 177.40 3afe h PHE 69 N 0.23 0.71 -0.75 0.41 0.04 -1.41 -2.16 116.94 114.00 3afe h PHE 69 Ca 0.02 -0.20 0.09 0.00 2.80 0.00 0.00 57.97 60.68 3afe h PHE 69 Cb 0.87 -0.16 -0.05 0.00 2.20 0.00 0.00 35.95 38.82 3afe h PHE 69 CO 0.09 0.88 0.49 1.49 -0.60 0.00 0.00 178.31 180.66 3afe h GLU 70 N 0.50 0.69 0.75 1.51 4.57 -1.23 0.12 114.58 121.49 3afe h GLU 70 Ca 0.05 -0.04 -0.04 0.00 -1.18 0.00 0.00 59.36 58.15 3afe h GLU 70 Cb 0.87 -0.16 0.01 0.00 -0.16 0.00 0.00 28.75 29.31 3afe h GLU 70 CO 0.07 0.45 -0.36 0.00 -1.18 0.00 0.00 179.01 178.00 3afe h ALA 71 N 1.61 -1.00 -0.64 2.92 0.00 -0.72 -2.73 119.26 118.70 3afe h ALA 71 Ca 0.34 -0.22 0.11 0.00 0.00 0.00 0.00 54.91 55.13 3afe h ALA 71 Cb 0.39 0.39 -0.04 0.00 0.00 0.00 0.00 17.79 18.53 3afe h ALA 71 CO -0.12 -1.05 0.43 1.79 0.00 0.00 0.00 179.25 180.30 3afe h THR 72 N -1.04 0.88 -0.46 0.00 1.35 -0.75 0.35 112.91 113.25 3afe h THR 72 Ca -0.10 -0.15 -0.06 0.00 -0.55 0.00 0.00 66.41 65.55 3afe h THR 72 Cb 0.78 0.41 -0.02 0.00 -1.73 0.00 0.00 68.15 67.59 3afe h THR 72 CO 0.17 0.08 0.05 -0.09 -0.25 0.00 0.00 175.52 175.48 3afe h ARG 73 N 0.43 0.72 -0.17 4.72 2.43 -0.74 -0.45 114.38 121.32 3afe h ARG 73 Ca 0.30 -0.16 -0.09 0.00 -0.81 0.00 0.00 59.98 59.22 3afe h ARG 73 Cb 0.59 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.03 3afe h ARG 73 CO -0.09 0.70 -0.25 0.00 -1.51 0.00 0.00 179.97 178.82 3afe h ARG 74 N 0.69 0.47 -0.11 0.20 3.08 -0.02 -2.21 114.38 116.48 3afe h ARG 74 Ca 0.15 -0.28 0.04 0.00 0.07 0.00 0.00 59.98 59.96 3afe h ARG 74 Cb 0.35 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.38 3afe h ARG 74 CO 0.01 0.87 -0.16 -0.07 -1.07 0.00 0.00 179.97 179.55 3afe h LEU 75 N 0.10 -0.48 -2.01 3.04 3.38 -1.18 -2.05 115.31 116.12 3afe h LEU 75 Ca 0.02 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3afe h LEU 75 Cb 0.82 0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.79 3afe h LEU 75 CO 0.06 -0.21 -0.03 0.00 0.09 0.00 0.00 178.44 178.35 3afe h ALA 76 N 0.82 1.05 0.00 1.53 0.00 -1.08 0.48 119.26 122.07 3afe h ALA 76 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3afe h ALA 76 Cb 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3afe h ALA 76 CO -0.23 0.04 0.00 -1.13 0.00 0.00 0.00 179.25 177.93 3afe n SER 77 N -3.21 0.00 0.00 0.00 3.41 -0.78 -3.63 113.62 109.41 3afe n SER 77 Ca -0.01 0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.90 3afe n SER 77 Cb 0.23 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 3afe n SER 77 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3afe n VAL 78 N -1.42 0.00 -3.49 -3.33 0.24 -0.83 -3.99 118.33 105.50 3afe n VAL 78 Ca 0.08 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 62.17 3afe n VAL 78 Cb 0.24 -0.88 -0.13 0.00 -1.47 0.00 0.00 33.84 31.60 3afe n VAL 78 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3afe h GLY 80 N 8.33 -1.23 1.27 0.00 0.00 -1.79 0.30 103.07 109.96 3afe h GLY 80 Ca -0.16 0.83 0.01 0.00 0.00 0.00 0.00 47.33 48.00 3afe h GLY 80 CO 0.33 -0.21 0.49 1.76 0.00 0.00 0.00 176.54 178.91 3afe h SER 81 N -0.13 0.85 -0.08 0.19 0.02 -1.91 0.40 113.55 112.88 3afe h SER 81 Ca 0.10 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 3afe h SER 81 Cb 0.38 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.71 3afe h SER 81 CO -0.64 0.62 0.02 0.74 -1.14 0.00 0.00 176.83 176.44 3afe h THR 82 N 1.00 1.18 -0.79 -2.27 2.02 -1.64 -1.54 112.91 110.87 3afe h THR 82 Ca 0.27 -0.55 0.00 0.00 0.77 0.00 0.00 66.41 66.90 3afe h THR 82 Cb -0.11 1.39 -0.04 0.00 -1.74 0.00 0.00 68.15 67.65 3afe h THR 82 CO -0.06 0.16 0.49 1.23 0.37 0.00 0.00 175.52 177.71 3afe h GLY 83 N -0.06 1.12 0.76 2.16 0.00 -0.39 -1.72 103.07 104.94 3afe h GLY 83 Ca 0.03 -0.45 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 3afe h GLY 83 CO -0.00 0.44 -0.03 -0.25 0.00 0.00 0.00 176.54 176.69 3afe h TRP 84 N 1.07 -0.09 -0.40 5.60 2.91 -0.86 -1.48 115.95 122.70 3afe h TRP 84 Ca 0.28 -0.00 -0.04 0.00 1.13 0.00 0.00 58.89 60.26 3afe h TRP 84 Cb -0.08 0.03 -0.02 0.00 -0.51 0.00 0.00 29.16 28.59 3afe h TRP 84 CO -0.01 0.16 0.09 0.28 -1.03 0.00 0.00 178.44 177.93 3afe h VAL 85 N -0.33 1.23 -0.18 2.65 2.07 -1.27 -2.58 116.25 117.85 3afe h VAL 85 Ca -0.01 -0.81 0.03 0.00 0.82 0.00 0.00 66.70 66.72 3afe h VAL 85 Cb 0.29 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 3afe h VAL 85 CO 0.02 0.28 0.00 0.28 0.02 0.00 0.00 177.57 178.17 3afe h SER 86 N 0.51 -0.06 -0.53 0.57 0.02 -1.30 0.29 113.55 113.04 3afe h SER 86 Ca 0.12 0.04 0.06 0.00 -0.84 0.00 0.00 61.79 61.17 3afe h SER 86 Cb 0.33 0.06 -0.05 0.00 0.14 0.00 0.00 62.40 62.88 3afe h SER 86 CO 0.00 -0.00 0.25 -1.28 -1.14 0.00 0.00 176.83 174.66 3afe h SER 87 N 0.06 0.33 -0.04 3.07 0.87 -1.20 0.14 113.55 116.78 3afe h SER 87 Ca 0.08 0.04 -0.21 0.00 -1.23 0.00 0.00 61.79 60.47 3afe h SER 87 Cb 0.10 -0.02 0.02 0.00 -0.44 0.00 0.00 62.40 62.06 3afe h SER 87 CO -0.14 0.23 -0.80 0.40 -0.53 0.00 0.00 176.83 175.98 3afe h ILE 88 N 0.48 1.33 -0.41 2.23 2.04 -0.99 -2.20 117.51 119.98 3afe h ILE 88 Ca 0.24 -2.10 -0.11 0.00 1.00 0.00 0.00 64.86 63.90 3afe h ILE 88 Cb 0.19 2.35 -0.01 0.00 -0.74 0.00 0.00 36.82 38.62 3afe h ILE 88 CO -0.19 0.64 -0.18 0.58 0.00 0.00 0.00 178.15 178.99 3afe h VAL 89 N 0.24 1.28 -0.69 1.67 2.07 -0.36 -3.13 116.25 117.32 3afe h VAL 89 Ca -0.09 -1.32 0.03 0.00 0.82 0.00 0.00 66.70 66.14 3afe h VAL 89 Cb 1.47 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 32.45 3afe h VAL 89 CO 0.16 0.44 0.43 1.23 0.02 0.00 0.00 177.57 179.85 3afe h GLY 90 N 0.67 0.99 2.00 2.17 0.00 -0.70 -2.07 103.07 106.14 3afe h GLY 90 Ca 0.09 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.10 3afe h GLY 90 CO 0.06 0.27 0.00 1.55 0.00 0.00 0.00 176.54 178.42 3afe n VAL 91 N -4.67 0.94 0.09 4.60 3.14 -0.83 -1.75 118.33 119.84 3afe n VAL 91 Ca 0.07 0.24 -0.08 0.00 -2.96 0.00 0.00 64.34 61.61 3afe n VAL 91 Cb 0.09 -1.00 -0.01 0.00 -1.06 0.00 0.00 33.84 31.86 3afe n VAL 91 CO 0.00 0.00 0.00 0.45 -6.46 0.00 0.00 176.83 170.82 3afe h HIS 92 N 0.00 0.27 0.00 1.45 3.86 -1.32 -0.95 115.15 118.45 3afe h HIS 92 Ca 0.00 -0.15 -0.01 0.00 -1.16 0.00 0.00 60.37 59.05 3afe h HIS 92 Cb 0.28 -0.03 -0.00 0.00 1.06 0.00 0.00 27.41 28.71 3afe h HIS 92 CO 0.00 0.96 -0.05 -0.91 0.86 0.00 0.00 177.93 178.79 3afe h ASN 93 N 0.10 0.00 0.19 2.45 2.35 -1.40 0.23 115.58 119.50 3afe h ASN 93 Ca -0.04 0.00 -0.28 0.00 -0.55 0.00 0.00 56.30 55.43 3afe h ASN 93 Cb 1.50 0.00 0.03 0.00 0.05 0.00 0.00 38.32 39.90 3afe h ASN 93 CO 0.13 0.05 -1.23 -0.25 -1.65 0.00 0.00 177.43 174.49 3afe h TRP 94 N 0.00 0.87 -0.64 1.19 7.01 -1.52 -3.28 115.95 119.58 3afe h TRP 94 Ca -0.00 -0.61 -0.08 0.00 2.11 0.00 0.00 58.89 60.31 3afe h TRP 94 Cb 0.48 -0.05 -0.02 0.00 -2.10 0.00 0.00 29.16 27.47 3afe h TRP 94 CO 0.00 1.47 0.07 1.25 -2.79 0.00 0.00 178.44 178.44 3afe h HIS 95 N 0.03 1.15 0.00 2.65 2.76 -0.42 -2.91 115.15 118.42 3afe h HIS 95 Ca -0.21 -0.17 -0.03 0.00 -2.20 0.00 0.00 60.37 57.76 3afe h HIS 95 Cb 1.95 -0.31 -0.00 0.00 1.55 0.00 0.00 27.41 30.59 3afe h HIS 95 CO 0.15 0.98 -0.16 1.25 -1.30 0.00 0.00 177.93 178.84 3afe h LEU 96 N 1.00 0.00 -1.62 0.26 5.85 -0.71 -1.78 115.31 118.32 3afe h LEU 96 Ca 0.19 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 3afe h LEU 96 Cb 0.47 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.50 3afe h LEU 96 CO 0.02 0.16 -0.06 0.00 -0.34 0.00 0.00 178.44 178.22 3afe h ALA 97 N 1.84 1.04 0.00 1.25 0.00 -1.57 -1.99 119.26 119.82 3afe h ALA 97 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3afe h ALA 97 Cb 0.45 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3afe h ALA 97 CO 0.02 0.08 -0.37 1.28 0.00 0.00 0.00 179.25 180.26 3afe n LEU 98 N -3.22 0.39 -4.81 0.00 4.32 -0.67 -4.23 117.00 108.78 3afe n LEU 98 Ca -0.00 0.17 -0.32 0.00 -0.02 0.00 0.00 56.01 55.83 3afe n LEU 98 Cb 0.30 -0.31 0.01 0.00 -1.62 0.00 0.00 43.42 41.80 3afe n LEU 98 CO 0.28 0.07 0.71 -0.36 -1.22 0.00 0.00 177.39 176.87 3afe s PHE 99 N -3.02 3.08 0.65 -1.77 0.08 -0.75 -2.80 117.98 113.46 3afe s PHE 99 Ca 0.11 1.48 -0.11 0.00 0.12 0.00 0.00 56.93 58.54 3afe s PHE 99 Cb 0.17 -2.95 -0.02 0.00 -0.57 0.00 0.00 43.02 39.65 3afe s PHE 99 CO 0.65 -1.04 1.04 0.16 -0.10 0.00 0.00 175.22 175.94 3afe s ASP 100 N -3.04 5.85 0.30 1.36 1.47 -1.26 -2.71 116.67 118.64 3afe s ASP 100 Ca 0.62 1.52 0.04 0.00 1.18 0.00 0.00 52.55 55.90 3afe s ASP 100 Cb -0.15 -2.48 0.78 0.00 -0.34 0.00 0.00 42.92 40.73 3afe s ASP 100 CO 0.40 -1.12 1.63 -0.61 0.68 0.00 0.00 175.17 176.14 3afe h GLN 101 N -0.46 0.15 -0.43 2.11 5.75 -1.92 -0.17 115.11 120.14 3afe h GLN 101 Ca -0.44 -0.01 0.07 0.00 -0.15 0.00 0.00 58.65 58.12 3afe h GLN 101 Cb 1.20 -0.03 -0.09 0.00 1.07 0.00 0.00 27.48 29.63 3afe h GLN 101 CO 0.60 0.10 -0.44 0.00 -2.65 0.00 0.00 178.83 176.43 3afe h ARG 102 N 0.15 -0.31 0.24 1.69 2.47 -1.91 0.22 114.38 116.93 3afe h ARG 102 Ca 0.59 0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 59.32 3afe h ARG 102 Cb 1.25 0.07 -0.00 0.00 -1.65 0.00 0.00 29.97 29.63 3afe h ARG 102 CO -0.72 -0.21 -0.14 0.00 0.56 0.00 0.00 179.97 179.46 3afe h ALA 103 N 0.40 -0.35 -0.70 0.04 0.00 -1.19 -2.42 119.26 115.04 3afe h ALA 103 Ca 0.14 -0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.12 3afe h ALA 103 Cb 0.58 0.17 -0.10 0.00 0.00 0.00 0.00 17.79 18.44 3afe h ALA 103 CO -0.59 -0.70 0.19 1.96 0.00 0.00 0.00 179.25 180.10 3afe h GLN 104 N -0.36 0.29 -0.63 0.00 4.20 -1.19 -2.15 115.11 115.27 3afe h GLN 104 Ca -0.02 -0.02 0.06 0.00 0.06 0.00 0.00 58.65 58.72 3afe h GLN 104 Cb 0.30 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 27.96 3afe h GLN 104 CO 0.03 0.19 0.34 1.49 -0.67 0.00 0.00 178.83 180.22 3afe h GLU 105 N 0.30 0.62 -0.44 1.46 4.57 -0.11 -0.47 114.58 120.52 3afe h GLU 105 Ca 0.38 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.49 3afe h GLU 105 Cb 0.62 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.05 3afe h GLU 105 CO -0.46 0.41 0.14 0.93 -1.18 0.00 0.00 179.01 178.85 3afe h GLU 106 N 0.64 0.64 0.00 1.92 5.08 -1.01 0.62 114.58 122.48 3afe h GLU 106 Ca 0.28 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3afe h GLU 106 Cb 0.17 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3afe h GLU 106 CO -0.18 0.56 -0.00 0.28 -1.00 0.00 0.00 179.01 178.67 3afe h VAL 107 N 0.63 1.73 -0.08 3.13 2.07 -1.09 -3.40 116.25 119.25 3afe h VAL 107 Ca 0.15 -2.24 0.00 0.00 0.82 0.00 0.00 66.70 65.43 3afe h VAL 107 Cb 0.19 3.24 0.00 0.00 -1.52 0.00 0.00 31.29 33.20 3afe h VAL 107 CO -0.01 0.58 0.00 0.79 0.02 0.00 0.00 177.57 178.95 3afe n TRP 108 N -4.63 0.09 0.04 1.57 8.01 -0.28 -4.48 117.44 117.77 3afe n TRP 108 Ca -0.10 -0.08 -0.14 0.00 -1.31 0.00 0.00 57.50 55.88 3afe n TRP 108 Cb 0.45 -0.00 -0.09 0.00 -2.01 0.00 0.00 31.31 29.67 3afe n TRP 108 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.69 177.46 3afe h GLY 109 N 2.60 -1.17 1.40 6.99 0.00 0.12 -3.03 103.07 109.97 3afe h GLY 109 Ca 0.00 0.66 -0.26 0.00 0.00 0.00 0.00 47.33 47.73 3afe h GLY 109 CO 0.00 -0.28 -1.42 0.83 0.00 0.00 0.00 176.54 175.67 3afe h GLU 110 N -0.57 0.03 -2.77 4.80 4.39 -1.84 -3.45 114.58 115.16 3afe h GLU 110 Ca 0.01 -0.04 -0.45 0.00 0.34 0.00 0.00 59.36 59.22 3afe h GLU 110 Cb 0.62 0.02 -0.39 0.00 -0.10 0.00 0.00 28.75 28.89 3afe h GLU 110 CO -0.31 0.76 -0.73 0.34 -1.16 0.00 0.00 179.01 177.91 3afe s ASP 111 N -6.42 2.53 0.31 1.42 -1.08 -1.16 -5.02 116.67 107.26 3afe s ASP 111 Ca -0.03 -0.80 0.26 0.00 -0.52 0.00 0.00 52.55 51.46 3afe s ASP 111 Cb 0.09 -0.09 0.97 0.00 -1.46 0.00 0.00 42.92 42.43 3afe s ASP 111 CO 0.82 -0.38 1.77 1.55 0.52 0.00 0.00 175.17 179.45 3afe h PRO 112 N 8.38 0.00 -0.89 4.34 0.13 -1.82 -2.88 132.00 139.26 3afe h PRO 112 Ca -0.17 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.82 3afe h PRO 112 Cb 1.09 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.14 3afe h PRO 112 CO 0.35 0.00 0.18 -1.13 -0.23 0.00 0.00 178.00 177.17 3afe n SER 113 N -2.46 3.50 -4.74 1.44 3.41 -1.26 -4.91 113.62 108.61 3afe n SER 113 Ca 0.03 -2.70 -0.40 0.00 -0.26 0.00 0.00 58.87 55.54 3afe n SER 113 Cb 0.31 -0.65 -0.05 0.00 -0.26 0.00 0.00 64.21 63.56 3afe n SER 113 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3afe s THR 114 N -1.88 4.25 0.07 6.66 2.01 -1.09 -5.05 115.64 120.61 3afe s THR 114 Ca 0.30 2.08 0.02 0.00 0.31 0.00 0.00 61.69 64.41 3afe s THR 114 Cb 0.25 -4.32 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 3afe s THR 114 CO 0.07 0.42 0.08 -0.13 -0.69 0.00 0.00 174.62 174.37 3afe s ARG 115 N -0.67 2.92 -0.03 4.92 0.52 -1.26 -4.97 118.95 120.38 3afe s ARG 115 Ca 0.44 -0.65 0.07 0.00 -0.52 0.00 0.00 55.73 55.07 3afe s ARG 115 Cb -0.25 -2.75 -0.02 0.00 0.52 0.00 0.00 34.95 32.45 3afe s ARG 115 CO 0.31 0.58 -0.25 0.42 0.02 0.00 0.00 175.30 176.38 3afe s ILE 116 N -1.36 1.97 0.01 1.52 1.01 -1.26 -1.01 121.20 122.07 3afe s ILE 116 Ca 0.28 -1.06 0.00 0.00 0.00 0.00 0.00 60.65 59.88 3afe s ILE 116 Cb -0.12 -1.64 0.00 0.00 0.01 0.00 0.00 42.46 40.71 3afe s ILE 116 CO 0.21 0.56 0.00 -1.54 0.00 0.00 0.00 174.94 174.17 3afe n SER 117 N 2.59 0.87 -3.62 3.58 3.41 -0.58 -4.69 113.62 115.17 3afe n SER 117 Ca -0.16 -1.02 -0.02 0.00 -0.26 0.00 0.00 58.87 57.41 3afe n SER 117 Cb 0.52 -0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.45 3afe n SER 117 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3afe s SER 118 N -1.04 -0.14 -0.27 4.04 1.04 -1.26 -1.33 113.70 114.75 3afe s SER 118 Ca 0.00 -0.13 -0.00 0.00 0.48 0.00 0.00 55.95 56.30 3afe s SER 118 Cb -0.00 0.24 0.15 0.00 0.10 0.00 0.00 66.02 66.51 3afe s SER 118 CO 0.00 -0.43 0.39 -0.55 0.98 0.00 0.00 173.24 173.63 3afe s SER 119 N -2.68 0.41 0.02 7.02 0.15 -0.87 -3.98 113.70 113.77 3afe s SER 119 Ca 0.11 -0.12 0.27 0.00 0.70 0.00 0.00 55.95 56.91 3afe s SER 119 Cb 0.01 1.07 0.80 0.00 -1.71 0.00 0.00 66.02 66.20 3afe s SER 119 CO -0.04 -0.33 1.63 -1.22 1.20 0.00 0.00 173.24 174.49 3afe n TYR 120 N 5.36 0.10 -2.13 3.44 4.01 -1.26 -0.81 117.16 125.86 3afe n TYR 120 Ca -0.02 0.03 -0.41 0.00 -0.16 0.00 0.00 57.90 57.34 3afe n TYR 120 Cb 0.49 -0.43 -0.03 0.00 -0.31 0.00 0.00 39.34 39.07 3afe n TYR 120 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3afe s ALA 121 N -3.02 3.56 -0.84 -0.72 0.00 -1.26 -4.18 121.76 115.29 3afe s ALA 121 Ca 0.12 1.21 -0.24 0.00 0.00 0.00 0.00 51.96 53.05 3afe s ALA 121 Cb 0.17 -3.50 -0.16 0.00 0.00 0.00 0.00 23.12 19.63 3afe s ALA 121 CO 0.63 -0.62 1.90 -0.35 0.00 0.00 0.00 175.76 177.32 3afe n PRO 122 N 2.21 1.29 -0.86 0.00 -0.04 -1.26 -4.26 135.00 132.08 3afe n PRO 122 Ca 0.05 -1.96 -0.03 0.00 -0.04 0.00 0.00 63.50 61.52 3afe n PRO 122 Cb 0.42 -3.21 0.27 0.00 -0.04 0.00 0.00 33.50 30.94 3afe n PRO 122 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3afe n MET 123 N 7.62 3.17 -0.66 0.54 2.81 -1.25 -4.90 117.12 124.45 3afe n MET 123 Ca 0.47 -3.05 0.00 0.00 -1.81 0.00 0.00 57.70 53.31 3afe n MET 123 Cb 0.43 -2.06 0.00 0.00 -0.71 0.00 0.00 33.22 30.88 3afe n MET 123 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3afe n GLY 124 N -0.44 1.21 3.49 3.03 0.00 -1.26 -2.90 105.19 108.32 3afe n GLY 124 Ca 0.36 -0.73 -0.10 0.00 0.00 0.00 0.00 46.02 45.55 3afe n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3afe s ALA 125 N -1.00 -1.72 -0.18 4.61 0.00 -0.60 -4.23 121.76 118.65 3afe s ALA 125 Ca 0.00 0.75 -0.01 0.00 0.00 0.00 0.00 51.96 52.70 3afe s ALA 125 Cb 0.00 0.61 -0.00 0.00 0.00 0.00 0.00 23.12 23.73 3afe s ALA 125 CO 0.00 -0.74 -0.12 0.20 0.00 0.00 0.00 175.76 175.10 3afe s GLY 126 N -2.61 1.51 -0.05 0.00 0.00 -1.05 -1.18 107.32 103.94 3afe s GLY 126 Ca 0.04 -1.11 -0.16 0.00 0.00 0.00 0.00 44.72 43.49 3afe s GLY 126 CO -0.10 0.19 0.43 0.14 0.00 0.00 0.00 173.10 173.77 3afe s VAL 127 N 1.09 5.08 0.12 1.40 1.01 0.27 -1.83 120.40 127.55 3afe s VAL 127 Ca 0.00 0.88 -0.31 0.00 0.00 0.00 0.00 61.98 62.55 3afe s VAL 127 Cb -0.14 -3.75 -0.10 0.00 0.00 0.00 0.00 36.38 32.38 3afe s VAL 127 CO -0.03 0.48 1.78 -0.69 0.00 0.00 0.00 175.10 176.63 3afe s VAL 128 N -0.39 2.59 0.01 2.92 1.01 -0.86 0.10 120.40 125.80 3afe s VAL 128 Ca 0.24 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.37 3afe s VAL 128 Cb -0.16 -3.09 -0.00 0.00 0.00 0.00 0.00 36.38 33.13 3afe s VAL 128 CO 0.12 0.00 0.01 1.33 0.00 0.00 0.00 175.10 176.56 3afe n VAL 129 N 4.65 0.00 -2.19 2.92 0.24 -1.10 -4.86 118.33 118.00 3afe n VAL 129 Ca 0.17 -0.09 -0.43 0.00 -2.04 0.00 0.00 64.34 61.96 3afe n VAL 129 Cb 0.38 0.03 -0.02 0.00 -1.47 0.00 0.00 33.84 32.76 3afe n VAL 129 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3afe s ASP 130 N -1.09 6.52 0.00 -1.34 2.15 -1.26 -3.06 116.67 118.59 3afe s ASP 130 Ca 0.01 1.62 0.00 0.00 0.43 0.00 0.00 52.55 54.61 3afe s ASP 130 Cb 0.00 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.09 3afe s ASP 130 CO 0.01 -1.14 0.00 0.61 -0.17 0.00 0.00 175.17 174.47 3afe n GLY 131 N 4.44 0.83 0.00 2.66 0.00 -1.26 -4.85 105.19 107.02 3afe n GLY 131 Ca 0.17 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3afe n GLY 131 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3afe n GLY 132 N -2.31 0.54 3.19 -0.02 0.00 -1.17 -0.81 105.19 104.62 3afe n GLY 132 Ca 0.00 -0.30 -0.13 0.00 0.00 0.00 0.00 46.02 45.59 3afe n GLY 132 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3afe s TYR 133 N 0.00 -0.11 -0.27 1.61 2.02 0.87 -2.72 117.35 118.75 3afe s TYR 133 Ca 0.00 0.13 0.03 0.00 -0.37 0.00 0.00 57.07 56.86 3afe s TYR 133 Cb 0.00 0.05 0.06 0.00 -0.40 0.00 0.00 41.96 41.67 3afe s TYR 133 CO 0.00 -0.35 -0.09 -1.17 -1.57 0.00 0.00 175.55 172.37 3afe s LEU 134 N -1.34 3.61 -0.06 -1.29 2.96 0.29 0.44 118.68 123.28 3afe s LEU 134 Ca -0.14 -1.46 0.00 0.00 -0.22 0.00 0.00 54.13 52.32 3afe s LEU 134 Cb -0.06 -1.57 -0.03 0.00 0.50 0.00 0.00 46.19 45.03 3afe s LEU 134 CO 0.03 -0.21 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.12 3afe s VAL 135 N 1.10 3.91 -0.03 1.68 1.01 -0.15 0.95 120.40 128.86 3afe s VAL 135 Ca -0.07 -0.43 -0.03 0.00 0.00 0.00 0.00 61.98 61.45 3afe s VAL 135 Cb -0.20 -2.63 0.01 0.00 0.00 0.00 0.00 36.38 33.56 3afe s VAL 135 CO -0.05 0.58 0.09 0.20 0.00 0.00 0.00 175.10 175.92 3afe s ASN 136 N -0.91 -0.09 0.00 3.32 0.01 -0.33 -2.54 114.94 114.40 3afe s ASN 136 Ca 0.13 0.18 0.00 0.00 -0.71 0.00 0.00 52.86 52.46 3afe s ASN 136 Cb -0.11 0.17 0.00 0.00 0.41 0.00 0.00 41.25 41.72 3afe s ASN 136 CO 0.03 -0.04 0.00 0.61 -1.51 0.00 0.00 177.10 176.19 3afe n GLY 137 N 3.14 1.52 3.02 0.66 0.00 -0.39 -1.55 105.19 111.59 3afe n GLY 137 Ca -0.14 -0.99 -0.31 0.00 0.00 0.00 0.00 46.02 44.59 3afe n GLY 137 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3afe s SER 138 N 0.00 3.68 -0.09 1.61 0.01 -1.14 -0.76 113.70 117.01 3afe s SER 138 Ca 0.00 -1.02 -0.03 0.00 1.31 0.00 0.00 55.95 56.21 3afe s SER 138 Cb 0.00 -1.34 -0.03 0.00 0.21 0.00 0.00 66.02 64.86 3afe s SER 138 CO 0.00 -0.15 0.03 0.26 0.41 0.00 0.00 173.24 173.79 3afe s TRP 139 N 1.31 3.25 0.45 2.43 0.51 -0.10 -4.74 118.94 122.06 3afe s TRP 139 Ca -0.03 0.26 0.07 0.00 -2.12 0.00 0.00 56.10 54.28 3afe s TRP 139 Cb -0.17 -1.82 -0.01 0.00 -0.81 0.00 0.00 33.47 30.66 3afe s TRP 139 CO -0.08 0.53 0.36 0.54 -0.51 0.00 0.00 176.95 177.79 3afe s ASN 140 N -0.94 4.83 -0.93 2.95 2.20 -1.26 0.12 114.94 121.92 3afe s ASN 140 Ca 0.14 -0.94 0.00 0.00 -0.94 0.00 0.00 52.86 51.12 3afe s ASN 140 Cb -0.11 -0.27 0.00 0.00 -2.00 0.00 0.00 41.25 38.86 3afe s ASN 140 CO 0.03 -0.77 0.00 0.79 -2.94 0.00 0.00 177.10 174.21 3afe n TRP 141 N -1.57 -0.14 -2.50 1.54 7.02 -0.89 -4.77 117.44 116.13 3afe n TRP 141 Ca 0.02 0.00 -0.40 0.00 -1.02 0.00 0.00 57.50 56.10 3afe n TRP 141 Cb 0.63 -1.99 -0.03 0.00 -2.42 0.00 0.00 31.31 27.50 3afe n TRP 141 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 3afe s SER 142 N -2.80 6.38 0.04 -0.99 0.15 -0.68 -4.84 113.70 110.95 3afe s SER 142 Ca 0.00 -1.50 -0.33 0.00 0.70 0.00 0.00 55.95 54.81 3afe s SER 142 Cb 0.00 -2.57 -0.12 0.00 -1.71 0.00 0.00 66.02 61.62 3afe s SER 142 CO 0.00 -1.62 1.77 -1.20 1.20 0.00 0.00 173.24 173.38 3afe n SER 143 N 9.45 3.43 0.00 5.45 7.64 -1.26 -1.67 113.62 136.65 3afe n SER 143 Ca 0.36 1.01 0.00 0.00 1.01 0.00 0.00 58.87 61.25 3afe n SER 143 Cb 0.50 -1.42 0.00 0.00 -1.01 0.00 0.00 64.21 62.28 3afe n SER 143 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3afe n GLY 144 N 4.02 0.39 0.44 0.23 0.00 -0.02 -4.69 105.19 105.56 3afe n GLY 144 Ca 0.20 0.00 0.26 0.00 0.00 0.00 0.00 46.02 46.48 3afe n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3afe h ASP 146 N 0.23 0.00 0.00 0.00 3.45 -1.83 -2.30 116.42 115.97 3afe h ASP 146 Ca 0.52 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.98 3afe h ASP 146 Cb 1.63 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 40.40 3afe h ASP 146 CO -0.14 0.00 -0.02 1.41 -1.57 0.00 0.00 179.24 178.92 3afe n HIS 147 N -2.28 0.00 -4.32 4.55 8.25 0.12 -5.04 115.22 116.49 3afe n HIS 147 Ca -0.01 -1.01 -0.23 0.00 -0.26 0.00 0.00 57.72 56.20 3afe n HIS 147 Cb 0.34 -0.15 -0.12 0.00 1.12 0.00 0.00 29.99 31.18 3afe n HIS 147 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3afe s ALA 148 N -2.88 1.99 -0.31 -1.41 0.00 -0.87 -4.67 121.76 113.61 3afe s ALA 148 Ca 0.32 -1.40 0.22 0.00 0.00 0.00 0.00 51.96 51.10 3afe s ALA 148 Cb 0.28 -0.23 -0.21 0.00 0.00 0.00 0.00 23.12 22.96 3afe s ALA 148 CO 0.03 0.32 0.71 0.43 0.00 0.00 0.00 175.76 177.24 3afe n SER 149 N 0.64 0.37 -4.10 0.00 7.64 -0.18 -4.85 113.62 113.14 3afe n SER 149 Ca -0.16 -0.16 -0.20 0.00 1.01 0.00 0.00 58.87 59.36 3afe n SER 149 Cb 0.55 1.44 -0.09 0.00 -1.01 0.00 0.00 64.21 65.10 3afe n SER 149 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 3afe s TRP 150 N -3.36 1.66 -0.05 1.43 0.52 -1.15 0.12 118.94 118.11 3afe s TRP 150 Ca -0.02 -1.28 -0.23 0.00 0.02 0.00 0.00 56.10 54.58 3afe s TRP 150 Cb 0.14 -0.96 0.05 0.00 -1.15 0.00 0.00 33.47 31.55 3afe s TRP 150 CO 0.87 -0.40 0.52 -0.08 0.02 0.00 0.00 176.95 177.88 3afe s THR 151 N -3.53 0.02 0.26 2.01 -1.32 -0.30 -1.53 115.64 111.26 3afe s THR 151 Ca 0.34 -0.19 -0.07 0.00 -1.21 0.00 0.00 61.69 60.56 3afe s THR 151 Cb 0.05 -0.82 -0.06 0.00 -1.51 0.00 0.00 72.50 70.16 3afe s THR 151 CO 0.16 -0.11 0.55 -0.36 -2.21 0.00 0.00 174.62 172.66 3afe s PHE 152 N -1.11 3.46 -0.04 9.09 0.08 -0.44 -1.83 117.98 127.18 3afe s PHE 152 Ca -0.11 0.75 -0.02 0.00 0.12 0.00 0.00 56.93 57.67 3afe s PHE 152 Cb -0.02 -2.18 0.02 0.00 -0.57 0.00 0.00 43.02 40.27 3afe s PHE 152 CO 0.07 0.21 0.09 0.14 -0.10 0.00 0.00 175.22 175.63 3afe s VAL 153 N -1.97 -0.03 0.53 -0.44 -7.23 -0.81 -2.05 120.40 108.40 3afe s VAL 153 Ca 0.46 0.11 -0.06 0.00 -1.81 0.00 0.00 61.98 60.67 3afe s VAL 153 Cb -0.11 -0.15 -0.02 0.00 0.56 0.00 0.00 36.38 36.66 3afe s VAL 153 CO 0.26 0.04 0.86 -0.83 -0.31 0.00 0.00 175.10 175.12 3afe s GLY 154 N 0.63 1.55 0.00 2.32 0.00 0.01 -1.66 107.32 110.16 3afe s GLY 154 Ca -0.05 -0.49 0.00 0.00 0.00 0.00 0.00 44.72 44.18 3afe s GLY 154 CO -0.03 -0.28 0.00 0.61 0.00 0.00 0.00 173.10 173.40 3afe n GLY 155 N -2.43 4.19 3.80 0.20 0.00 -1.16 -3.95 105.19 105.84 3afe n GLY 155 Ca 0.02 -1.23 -0.31 0.00 0.00 0.00 0.00 46.02 44.51 3afe n GLY 155 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3afe s PRO 156 N -2.98 2.65 -0.26 1.61 0.02 -1.26 -3.14 135.00 131.65 3afe s PRO 156 Ca 0.00 1.06 -0.15 0.00 0.02 0.00 0.00 61.00 61.94 3afe s PRO 156 Cb 0.00 -1.95 -0.04 0.00 0.02 0.00 0.00 34.50 32.53 3afe s PRO 156 CO 0.00 -1.33 0.35 0.08 -0.33 0.00 0.00 177.00 175.77 3afe s VAL 157 N -2.96 5.20 -0.28 3.83 1.01 0.19 -2.54 120.40 124.86 3afe s VAL 157 Ca 0.60 0.55 -0.07 0.00 0.00 0.00 0.00 61.98 63.06 3afe s VAL 157 Cb -0.16 -3.68 -0.00 0.00 0.00 0.00 0.00 36.38 32.54 3afe s VAL 157 CO 0.55 0.19 0.07 -0.63 0.00 0.00 0.00 175.10 175.28 3afe s ILE 158 N 1.84 4.01 -0.20 2.22 1.09 -0.76 -1.34 121.20 128.06 3afe s ILE 158 Ca 0.15 -0.53 0.00 0.00 -1.10 0.00 0.00 60.65 59.17 3afe s ILE 158 Cb -0.15 -2.99 0.02 0.00 -1.06 0.00 0.00 42.46 38.27 3afe s ILE 158 CO 0.09 0.18 -0.15 -0.75 -0.10 0.00 0.00 174.94 174.21 3afe s LYS 159 N 1.53 2.98 -1.29 2.79 2.36 -1.18 -2.02 119.74 124.91 3afe s LYS 159 Ca 0.04 -0.85 -0.05 0.00 -2.55 0.00 0.00 55.97 52.56 3afe s LYS 159 Cb -0.16 -2.71 -0.01 0.00 -1.05 0.00 0.00 37.83 33.90 3afe s LYS 159 CO 0.02 -0.26 0.64 -3.47 1.55 0.00 0.00 175.35 173.84 3afe n ASP 160 N 4.64 -2.04 -1.16 1.43 4.64 -1.26 -4.43 116.55 118.37 3afe n ASP 160 Ca -0.20 -0.92 0.14 0.00 -1.38 0.00 0.00 54.79 52.44 3afe n ASP 160 Cb 0.49 -3.63 -0.08 0.00 -1.04 0.00 0.00 41.12 36.86 3afe n ASP 160 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3afe n GLY 161 N -1.71 -3.24 0.00 0.27 0.00 -1.26 -5.07 105.19 94.18 3afe n GLY 161 Ca -0.25 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.65 3afe n GLY 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3afe n ARG 162 N -3.88 0.00 -3.28 1.61 5.12 -1.26 -4.95 116.66 110.02 3afe n ARG 162 Ca -0.08 0.00 -0.39 0.00 -1.93 0.00 0.00 57.85 55.45 3afe n ARG 162 Cb 0.55 0.00 -0.08 0.00 -1.16 0.00 0.00 32.46 31.78 3afe n ARG 162 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3afe s PRO 163 N -4.53 4.10 -0.20 5.56 0.05 -1.26 -3.11 135.00 135.61 3afe s PRO 163 Ca 0.00 0.29 -0.11 0.00 0.05 0.00 0.00 61.00 61.22 3afe s PRO 163 Cb 0.00 -3.62 -0.08 0.00 0.05 0.00 0.00 34.50 30.85 3afe s PRO 163 CO 0.00 -0.26 -0.27 1.33 0.05 0.00 0.00 177.00 177.85 3afe n VAL 164 N 4.93 1.21 -4.45 -0.36 0.24 -0.45 -5.02 118.33 114.43 3afe n VAL 164 Ca -0.05 -0.21 -0.22 0.00 -2.04 0.00 0.00 64.34 61.82 3afe n VAL 164 Cb 0.50 -1.85 -0.10 0.00 -1.47 0.00 0.00 33.84 30.91 3afe n VAL 164 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3afe s ASP 165 N -6.75 2.71 -0.02 -1.34 2.15 -1.24 -4.97 116.67 107.21 3afe s ASP 165 Ca -0.28 -1.26 0.00 0.00 0.43 0.00 0.00 52.55 51.44 3afe s ASP 165 Cb 0.10 -0.16 0.02 0.00 -0.30 0.00 0.00 42.92 42.59 3afe s ASP 165 CO 0.37 -0.44 -0.00 0.12 -0.17 0.00 0.00 175.17 175.05 3afe s PHE 166 N -3.08 0.28 0.00 -5.34 5.36 -1.26 0.57 117.98 114.50 3afe s PHE 166 Ca 0.32 0.00 0.00 0.00 -0.96 0.00 0.00 56.93 56.29 3afe s PHE 166 Cb 0.06 -0.35 0.00 0.00 -0.34 0.00 0.00 43.02 42.38 3afe s PHE 166 CO 0.13 -0.11 0.00 0.41 -1.46 0.00 0.00 175.22 174.20 3afe n GLY 167 N 3.96 2.57 3.21 13.12 0.00 -1.19 -2.49 105.19 124.38 3afe n GLY 167 Ca -0.25 -0.39 -0.26 0.00 0.00 0.00 0.00 46.02 45.12 3afe n GLY 167 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3afe s SER 168 N 2.00 2.29 -0.12 1.61 0.01 -0.65 -2.96 113.70 115.89 3afe s SER 168 Ca 0.00 -0.38 -0.03 0.00 1.31 0.00 0.00 55.95 56.84 3afe s SER 168 Cb 0.00 -0.24 -0.03 0.00 0.21 0.00 0.00 66.02 65.95 3afe s SER 168 CO 0.00 0.22 0.01 -0.36 0.41 0.00 0.00 173.24 173.52 3afe s PHE 169 N -0.52 3.18 -0.29 2.43 0.08 -0.67 -1.82 117.98 120.37 3afe s PHE 169 Ca 0.07 0.11 -0.10 0.00 0.12 0.00 0.00 56.93 57.13 3afe s PHE 169 Cb -0.08 -1.88 -0.03 0.00 -0.57 0.00 0.00 43.02 40.46 3afe s PHE 169 CO -0.00 0.34 0.16 -1.17 -0.10 0.00 0.00 175.22 174.45 3afe s LEU 170 N -0.46 3.99 0.02 -0.37 2.96 0.32 -1.93 118.68 123.20 3afe s LEU 170 Ca 0.08 -0.21 0.04 0.00 -0.22 0.00 0.00 54.13 53.82 3afe s LEU 170 Cb -0.12 -2.06 -0.02 0.00 0.50 0.00 0.00 46.19 44.50 3afe s LEU 170 CO 0.02 -0.10 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.21 3afe s ILE 171 N 1.69 0.88 0.40 6.68 1.01 -0.76 -4.91 121.20 126.19 3afe s ILE 171 Ca 0.06 -0.75 -0.19 0.00 0.00 0.00 0.00 60.65 59.78 3afe s ILE 171 Cb -0.16 -0.79 -0.10 0.00 0.01 0.00 0.00 42.46 41.42 3afe s ILE 171 CO 0.08 0.05 0.88 -2.84 0.00 0.00 0.00 174.94 173.11 3afe s PRO 172 N -0.79 4.14 0.33 2.79 0.02 -1.26 -1.15 135.00 139.08 3afe s PRO 172 Ca 0.01 0.96 0.11 0.00 0.02 0.00 0.00 61.00 62.10 3afe s PRO 172 Cb -0.06 -2.26 1.00 0.00 0.02 0.00 0.00 34.50 33.20 3afe s PRO 172 CO 0.00 0.02 1.63 -0.09 -0.33 0.00 0.00 177.00 178.23 3afe h ARG 173 N 1.98 0.17 0.00 5.54 9.65 0.53 0.33 114.38 132.58 3afe h ARG 173 Ca -0.49 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.38 3afe h ARG 173 Cb 1.18 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.72 3afe h ARG 173 CO 0.62 0.11 0.00 -1.13 2.80 0.00 0.00 179.97 182.37 3afe n SER 174 N -5.21 0.56 -0.75 -3.80 3.41 -1.26 -2.70 113.62 103.87 3afe n SER 174 Ca 0.29 0.71 0.07 0.00 -0.26 0.00 0.00 58.87 59.68 3afe n SER 174 Cb 0.94 -0.80 0.20 0.00 -0.26 0.00 0.00 64.21 64.29 3afe n SER 174 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3afe n GLU 175 N -2.20 2.90 -3.83 4.33 1.02 0.12 -4.95 120.64 118.03 3afe n GLU 175 Ca -0.00 -2.41 -0.12 0.00 -0.02 0.00 0.00 57.16 54.61 3afe n GLU 175 Cb 0.10 -1.53 -0.11 0.00 -0.02 0.00 0.00 31.44 29.88 3afe n GLU 175 CO 0.00 0.00 0.00 1.52 1.18 0.00 0.00 177.13 179.83 3afe s TYR 176 N -1.83 -0.11 0.23 -0.32 -0.85 -1.10 -4.59 117.35 108.78 3afe s TYR 176 Ca 0.31 0.25 -0.14 0.00 -0.52 0.00 0.00 57.07 56.97 3afe s TYR 176 Cb 0.22 0.03 -0.08 0.00 0.38 0.00 0.00 41.96 42.51 3afe s TYR 176 CO 0.12 -0.20 0.64 -2.00 -1.52 0.00 0.00 175.55 172.59 3afe s GLU 177 N -0.60 3.99 -0.33 -3.49 2.12 -0.75 -4.90 118.70 114.75 3afe s GLU 177 Ca -0.07 0.56 -0.05 0.00 0.36 0.00 0.00 54.97 55.77 3afe s GLU 177 Cb -0.04 -2.70 0.04 0.00 0.26 0.00 0.00 34.13 31.69 3afe s GLU 177 CO 0.01 0.33 0.07 0.42 -0.54 0.00 0.00 175.26 175.55 3afe s ILE 178 N -1.72 3.53 -0.31 -3.70 1.01 -1.26 -1.28 121.20 117.47 3afe s ILE 178 Ca 0.46 -1.22 -0.21 0.00 0.00 0.00 0.00 60.65 59.69 3afe s ILE 178 Cb -0.13 -3.01 -0.01 0.00 0.01 0.00 0.00 42.46 39.32 3afe s ILE 178 CO 0.19 -0.16 0.66 -0.75 0.00 0.00 0.00 174.94 174.89 3afe s LYS 179 N 1.35 3.89 -0.69 2.79 2.47 0.84 -4.93 119.74 125.47 3afe s LYS 179 Ca -0.03 0.34 -0.27 0.00 -1.56 0.00 0.00 55.97 54.45 3afe s LYS 179 Cb -0.20 -3.74 0.01 0.00 -1.46 0.00 0.00 37.83 32.45 3afe s LYS 179 CO 0.02 -0.61 1.49 0.34 0.16 0.00 0.00 175.35 176.74 3afe s ASP 180 N 1.65 5.85 -0.13 1.43 -1.08 -1.26 -1.96 116.67 121.17 3afe s ASP 180 Ca 0.27 -0.15 0.19 0.00 -0.52 0.00 0.00 52.55 52.33 3afe s ASP 180 Cb -0.15 -2.55 0.44 0.00 -1.46 0.00 0.00 42.92 39.20 3afe s ASP 180 CO 0.12 -2.02 1.18 1.33 0.52 0.00 0.00 175.17 176.31 3afe n VAL 181 N 6.69 1.15 -3.27 1.11 0.24 -1.26 -5.00 118.33 118.00 3afe n VAL 181 Ca 0.09 -2.29 -0.45 0.00 -2.04 0.00 0.00 64.34 59.66 3afe n VAL 181 Cb 0.50 0.39 -0.01 0.00 -1.47 0.00 0.00 33.84 33.26 3afe n VAL 181 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 3afe s TRP 182 N -1.87 4.01 -0.52 6.34 -0.11 -1.26 -4.88 118.94 120.64 3afe s TRP 182 Ca 0.36 -2.41 0.04 0.00 1.22 0.00 0.00 56.10 55.31 3afe s TRP 182 Cb 0.38 -3.92 0.16 0.00 -1.50 0.00 0.00 33.47 28.59 3afe s TRP 182 CO -0.10 -1.04 0.38 0.71 -4.62 0.00 0.00 176.95 172.28 3afe s TYR 183 N -0.39 2.12 0.35 5.86 2.02 -1.26 -5.01 117.35 121.03 3afe s TYR 183 Ca 0.30 -2.70 0.03 0.00 -0.37 0.00 0.00 57.07 54.33 3afe s TYR 183 Cb -0.09 -1.70 -0.04 0.00 -0.40 0.00 0.00 41.96 39.73 3afe s TYR 183 CO -0.07 -0.72 0.10 0.14 -1.57 0.00 0.00 175.55 173.43 3afe s VAL 184 N -0.45 0.80 -0.48 0.71 -7.23 -1.26 -5.07 120.40 107.42 3afe s VAL 184 Ca 0.28 -2.00 0.24 0.00 -1.81 0.00 0.00 61.98 58.68 3afe s VAL 184 Cb -0.03 -2.58 0.15 0.00 0.56 0.00 0.00 36.38 34.48 3afe s VAL 184 CO -0.16 0.00 1.39 1.62 -0.31 0.00 0.00 175.10 177.64 3afe h VAL 185 N 2.03 0.00 -3.95 1.32 3.04 -1.99 -3.44 116.25 113.27 3afe h VAL 185 Ca -0.38 -0.78 -0.11 0.00 -1.01 0.00 0.00 66.70 64.42 3afe h VAL 185 Cb 1.26 1.51 -0.13 0.00 -2.01 0.00 0.00 31.29 31.92 3afe h VAL 185 CO 0.62 0.00 -0.38 -0.83 -1.01 0.00 0.00 177.57 175.97 3afe s GLY 186 N -4.01 0.48 -1.05 3.17 0.00 -1.26 -4.77 107.32 99.89 3afe s GLY 186 Ca 0.05 -0.92 -0.04 0.00 0.00 0.00 0.00 44.72 43.81 3afe s GLY 186 CO 0.71 -0.91 0.22 1.04 0.00 0.00 0.00 173.10 174.15 3afe n LEU 187 N -0.16 -1.21 -0.20 0.66 4.77 -1.26 -4.85 117.00 114.75 3afe n LEU 187 Ca -0.09 -0.03 -0.04 0.00 -0.03 0.00 0.00 56.01 55.82 3afe n LEU 187 Cb 0.63 -2.02 0.02 0.00 -2.33 0.00 0.00 43.42 39.73 3afe n LEU 187 CO 0.25 0.01 0.66 0.03 -1.33 0.00 0.00 177.39 177.01 3afe h ARG 188 N -0.43 -0.12 -0.10 3.23 3.08 -1.88 -0.56 114.38 117.61 3afe h ARG 188 Ca -0.32 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.74 3afe h ARG 188 Cb 1.23 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.30 3afe h ARG 188 CO 0.39 -0.08 0.00 0.41 -1.07 0.00 0.00 179.97 179.62 3afe n GLY 189 N -1.44 -0.34 0.20 0.04 0.00 -1.26 -3.11 105.19 99.28 3afe n GLY 189 Ca 0.05 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.17 3afe n GLY 189 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3afe h THR 190 N 0.00 0.18 -5.87 2.61 1.35 -1.32 -2.88 112.91 106.98 3afe h THR 190 Ca 0.00 -1.26 -0.39 0.00 -0.55 0.00 0.00 66.41 64.21 3afe h THR 190 Cb 0.05 2.09 0.12 0.00 -1.73 0.00 0.00 68.15 68.68 3afe h THR 190 CO 0.00 0.10 -0.73 0.61 -0.25 0.00 0.00 175.52 175.26 3afe n GLY 191 N 1.13 -0.47 2.32 5.82 0.00 -1.11 -0.84 105.19 112.04 3afe n GLY 191 Ca 0.04 0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.87 3afe n GLY 191 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3afe n SER 192 N -3.03 8.54 -2.84 1.61 7.64 -1.26 -3.73 113.62 120.55 3afe n SER 192 Ca -0.09 -2.65 -0.08 0.00 1.01 0.00 0.00 58.87 57.05 3afe n SER 192 Cb 0.60 -1.52 0.07 0.00 -1.01 0.00 0.00 64.21 62.34 3afe n SER 192 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3afe n ASN 193 N 3.26 -1.51 -4.49 6.43 5.03 -1.24 -2.44 115.26 120.30 3afe n ASN 193 Ca 0.75 -0.61 -0.33 0.00 0.87 0.00 0.00 54.58 55.26 3afe n ASN 193 Cb 0.26 -0.28 -0.13 0.00 -1.02 0.00 0.00 39.78 38.62 3afe n ASN 193 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 3afe s THR 194 N -1.51 3.27 -0.27 3.41 2.01 -0.83 -1.69 115.64 120.03 3afe s THR 194 Ca 0.19 -0.63 -0.07 0.00 0.31 0.00 0.00 61.69 61.49 3afe s THR 194 Cb -0.02 -2.31 -0.01 0.00 0.01 0.00 0.00 72.50 70.17 3afe s THR 194 CO 0.15 0.58 0.07 -0.76 -0.69 0.00 0.00 174.62 173.97 3afe s LEU 195 N -0.59 3.63 -0.36 4.42 1.43 0.33 -0.11 118.68 127.43 3afe s LEU 195 Ca 0.09 -0.50 -0.11 0.00 -1.03 0.00 0.00 54.13 52.58 3afe s LEU 195 Cb -0.11 -1.89 0.02 0.00 0.03 0.00 0.00 46.19 44.24 3afe s LEU 195 CO 0.01 -0.12 0.20 -0.69 0.23 0.00 0.00 176.35 175.98 3afe s VAL 196 N 1.54 4.64 -0.32 -1.59 1.01 -0.41 -0.92 120.40 124.36 3afe s VAL 196 Ca 0.04 -0.73 -0.07 0.00 0.00 0.00 0.00 61.98 61.23 3afe s VAL 196 Cb -0.16 -3.53 0.02 0.00 0.00 0.00 0.00 36.38 32.71 3afe s VAL 196 CO 0.02 -0.16 0.09 -0.69 0.00 0.00 0.00 175.10 174.37 3afe s VAL 197 N 1.58 3.89 -0.24 2.92 1.01 0.06 -1.81 120.40 127.80 3afe s VAL 197 Ca 0.03 -0.90 -0.01 0.00 0.00 0.00 0.00 61.98 61.10 3afe s VAL 197 Cb -0.19 -3.10 0.03 0.00 0.00 0.00 0.00 36.38 33.12 3afe s VAL 197 CO 0.07 -0.05 -0.08 -0.75 0.00 0.00 0.00 175.10 174.29 3afe s LYS 198 N 1.46 2.78 -1.42 2.72 2.20 -1.26 -1.26 119.74 124.96 3afe s LYS 198 Ca 0.01 -1.00 -0.02 0.00 -0.36 0.00 0.00 55.97 54.59 3afe s LYS 198 Cb -0.18 -2.93 0.02 0.00 -1.51 0.00 0.00 37.83 33.23 3afe s LYS 198 CO 0.03 -0.40 0.54 -0.25 -0.36 0.00 0.00 175.35 174.91 3afe n ASP 199 N 4.64 -0.99 -4.66 1.43 8.00 -1.05 -4.95 116.55 118.96 3afe n ASP 199 Ca -0.17 -0.95 -0.37 0.00 0.71 0.00 0.00 54.79 54.02 3afe n ASP 199 Cb 0.47 -3.30 -0.09 0.00 -0.02 0.00 0.00 41.12 38.17 3afe n ASP 199 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3afe s VAL 200 N -3.81 5.34 0.04 2.53 1.01 -1.08 -4.88 120.40 119.56 3afe s VAL 200 Ca 0.10 0.24 -0.30 0.00 0.00 0.00 0.00 61.98 62.02 3afe s VAL 200 Cb -0.05 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 3afe s VAL 200 CO 0.87 0.34 0.99 0.12 0.00 0.00 0.00 175.10 177.42 3afe s PHE 201 N 1.06 3.69 -0.16 5.22 5.36 -1.26 -0.98 117.98 130.90 3afe s PHE 201 Ca 0.09 1.70 0.00 0.00 -0.96 0.00 0.00 56.93 57.76 3afe s PHE 201 Cb -0.14 -3.13 0.03 0.00 -0.34 0.00 0.00 43.02 39.45 3afe s PHE 201 CO 0.05 -0.05 -0.12 0.08 -1.46 0.00 0.00 175.22 173.71 3afe s VAL 202 N 0.68 1.55 0.68 3.12 1.01 0.17 -4.98 120.40 122.62 3afe s VAL 202 Ca 0.51 -0.72 -0.17 0.00 0.00 0.00 0.00 61.98 61.60 3afe s VAL 202 Cb -0.22 -1.51 0.01 0.00 0.00 0.00 0.00 36.38 34.65 3afe s VAL 202 CO 0.29 0.36 1.26 -2.16 0.00 0.00 0.00 175.10 174.86 3afe s PRO 203 N 1.48 2.39 0.60 2.72 0.04 -1.26 -0.09 135.00 140.88 3afe s PRO 203 Ca 0.03 1.96 0.30 0.00 0.04 0.00 0.00 61.00 63.34 3afe s PRO 203 Cb -0.14 -1.84 1.71 0.00 0.04 0.00 0.00 34.50 34.28 3afe s PRO 203 CO -0.10 -1.70 2.09 -0.09 0.04 0.00 0.00 177.00 177.25 3afe h ARG 204 N 0.24 0.00 -0.01 4.56 2.43 -1.30 -0.04 114.38 120.27 3afe h ARG 204 Ca -0.50 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 3afe h ARG 204 Cb 1.32 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.87 3afe h ARG 204 CO 0.52 0.00 -0.01 -2.39 -1.51 0.00 0.00 179.97 176.58 3afe n HIS 205 N -3.64 0.00 -1.40 2.20 1.44 -1.26 -3.22 115.22 109.34 3afe n HIS 205 Ca 0.01 0.00 -0.00 0.00 -2.01 0.00 0.00 57.72 55.72 3afe n HIS 205 Cb 0.33 -0.01 0.20 0.00 0.12 0.00 0.00 29.99 30.63 3afe n HIS 205 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 3afe n ARG 206 N -0.42 1.89 -4.59 -1.40 1.74 -0.03 -4.16 116.66 109.70 3afe n ARG 206 Ca 0.21 -3.13 -0.26 0.00 -0.77 0.00 0.00 57.85 53.89 3afe n ARG 206 Cb 0.24 -1.77 -0.17 0.00 -1.02 0.00 0.00 32.46 29.74 3afe n ARG 206 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 3afe s PHE 207 N -3.18 1.70 -0.12 -1.55 5.36 -1.20 -0.53 117.98 118.48 3afe s PHE 207 Ca 0.43 -0.69 0.03 0.00 -0.96 0.00 0.00 56.93 55.73 3afe s PHE 207 Cb 0.39 -1.23 -0.00 0.00 -0.34 0.00 0.00 43.02 41.83 3afe s PHE 207 CO -0.00 -0.35 -0.21 -1.17 -1.46 0.00 0.00 175.22 172.03 3afe s LEU 208 N 0.76 2.23 0.33 6.12 2.96 -0.76 -4.99 118.68 125.34 3afe s LEU 208 Ca -0.12 -0.52 -0.19 0.00 -0.22 0.00 0.00 54.13 53.07 3afe s LEU 208 Cb -0.16 -1.46 -0.10 0.00 0.50 0.00 0.00 46.19 44.98 3afe s LEU 208 CO 0.03 0.14 0.83 -0.55 -1.32 0.00 0.00 176.35 175.47 3afe s SER 209 N 0.45 6.96 0.07 3.68 0.15 -1.26 -1.63 113.70 122.12 3afe s SER 209 Ca -0.15 1.51 -0.16 0.00 0.70 0.00 0.00 55.95 57.85 3afe s SER 209 Cb -0.17 -2.46 -0.13 0.00 -1.71 0.00 0.00 66.02 61.54 3afe s SER 209 CO 0.06 -0.18 1.33 1.88 1.20 0.00 0.00 173.24 177.53 3afe h TYR 210 N 2.53 0.77 -0.60 3.44 0.05 -1.85 -2.24 116.97 119.07 3afe h TYR 210 Ca -0.48 -0.28 0.12 0.00 0.05 0.00 0.00 58.73 58.14 3afe h TYR 210 Cb 1.18 -0.14 -0.11 0.00 1.01 0.00 0.00 36.73 38.67 3afe h TYR 210 CO 0.62 1.04 -0.13 -0.22 -1.05 0.00 0.00 178.16 178.42 3afe h LYS 211 N 0.28 0.01 0.17 4.88 1.63 -1.94 0.20 116.57 121.81 3afe h LYS 211 Ca 0.00 -0.00 0.01 0.00 -0.85 0.00 0.00 60.65 59.82 3afe h LYS 211 Cb 1.00 -0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.60 3afe h LYS 211 CO 0.09 0.01 -0.27 0.00 -3.45 0.00 0.00 179.45 175.82 3afe h ALA 212 N 1.60 -0.50 -0.66 5.00 0.00 -1.92 -1.17 119.26 121.62 3afe h ALA 212 Ca 0.29 -0.06 0.14 0.00 0.00 0.00 0.00 54.91 55.29 3afe h ALA 212 Cb 0.45 0.43 -0.11 0.00 0.00 0.00 0.00 17.79 18.56 3afe h ALA 212 CO -0.61 -0.82 0.01 0.52 0.00 0.00 0.00 179.25 178.35 3afe h MET 213 N -0.51 0.12 -0.83 0.00 2.86 -0.62 -0.58 114.93 115.37 3afe h MET 213 Ca 0.02 -0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.69 3afe h MET 213 Cb 0.52 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.10 3afe h MET 213 CO -0.13 0.08 0.54 -0.91 1.06 0.00 0.00 176.91 177.55 3afe h ASN 214 N 0.12 0.86 1.62 1.22 -0.26 -0.14 -2.73 115.58 116.28 3afe h ASN 214 Ca 0.35 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 56.08 3afe h ASN 214 Cb 0.58 -0.19 0.00 0.00 -1.06 0.00 0.00 38.32 37.64 3afe h ASN 214 CO -0.56 0.58 0.00 0.44 -1.06 0.00 0.00 177.43 176.83 3afe h ASP 215 N 0.99 0.00 -3.98 5.81 3.32 0.10 -3.47 116.42 119.19 3afe h ASP 215 Ca 0.34 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 57.14 3afe h ASP 215 Cb 0.09 0.00 0.09 0.00 0.22 0.00 0.00 39.33 39.72 3afe h ASP 215 CO -0.11 0.00 -0.42 1.41 -1.72 0.00 0.00 179.24 178.41 3afe n HIS 216 N -2.58 -1.77 -0.53 4.55 8.25 -0.73 -4.93 115.22 117.47 3afe n HIS 216 Ca 0.05 0.63 0.03 0.00 -0.26 0.00 0.00 57.72 58.17 3afe n HIS 216 Cb 0.45 -3.49 0.05 0.00 1.12 0.00 0.00 29.99 28.12 3afe n HIS 216 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3afe n THR 217 N -4.03 1.16 -1.75 1.59 -2.24 -0.94 -5.04 114.28 103.03 3afe n THR 217 Ca 0.00 -1.28 -0.42 0.00 -2.27 0.00 0.00 64.05 60.08 3afe n THR 217 Cb 0.54 0.30 -0.03 0.00 -2.10 0.00 0.00 70.33 69.04 3afe n THR 217 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3afe s ALA 218 N -1.48 3.82 0.29 6.98 0.00 -1.24 -4.88 121.76 125.25 3afe s ALA 218 Ca 0.10 1.47 0.03 0.00 0.00 0.00 0.00 51.96 53.57 3afe s ALA 218 Cb 0.09 -3.72 0.70 0.00 0.00 0.00 0.00 23.12 20.19 3afe s ALA 218 CO 0.01 -1.07 1.72 0.78 0.00 0.00 0.00 175.76 177.20 3afe h GLY 219 N 7.82 1.56 2.00 0.00 0.00 -1.87 -1.34 103.07 111.24 3afe h GLY 219 Ca -0.44 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 46.67 3afe h GLY 219 CO 0.95 -0.19 0.00 -1.33 0.00 0.00 0.00 176.54 175.96 3afe h GLY 220 N 0.50 0.00 2.00 4.60 0.00 -1.34 -2.81 103.07 106.02 3afe h GLY 220 Ca 0.55 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.85 3afe h GLY 220 CO -0.47 0.00 -0.12 1.41 0.00 0.00 0.00 176.54 177.36 3afe h LEU 221 N 0.00 0.00 0.20 3.11 3.38 -1.41 -0.56 115.31 120.04 3afe h LEU 221 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3afe h LEU 221 Cb 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3afe h LEU 221 CO 0.00 0.12 -0.14 0.00 0.09 0.00 0.00 178.44 178.51 3afe h ALA 222 N 1.88 -0.32 0.22 1.53 0.00 -1.70 -3.24 119.26 117.63 3afe h ALA 222 Ca -0.00 -0.06 -0.29 0.00 0.00 0.00 0.00 54.91 54.56 3afe h ALA 222 Cb 0.65 0.18 0.03 0.00 0.00 0.00 0.00 17.79 18.65 3afe h ALA 222 CO 0.02 -0.69 -1.29 1.79 0.00 0.00 0.00 179.25 179.07 3afe h THR 223 N -0.34 1.35 -3.49 0.00 1.35 -1.77 -3.41 112.91 106.61 3afe h THR 223 Ca -0.02 -2.65 -0.77 0.00 -0.55 0.00 0.00 66.41 62.42 3afe h THR 223 Cb 0.29 3.10 -0.24 0.00 -1.73 0.00 0.00 68.15 69.56 3afe h THR 223 CO 0.01 0.78 0.11 0.20 -0.25 0.00 0.00 175.52 176.38 3afe s ASN 224 N -7.41 6.61 0.00 5.36 0.01 -0.23 -4.85 114.94 114.43 3afe s ASN 224 Ca -0.10 -2.38 0.12 0.00 -0.71 0.00 0.00 52.86 49.79 3afe s ASN 224 Cb 0.03 -2.23 0.23 0.00 0.41 0.00 0.00 41.25 39.68 3afe s ASN 224 CO 0.91 -0.71 1.10 -1.54 -1.51 0.00 0.00 177.10 175.35 3afe n SER 225 N 4.61 2.56 -4.62 -1.22 3.41 -1.24 -4.38 113.62 112.74 3afe n SER 225 Ca 0.08 -1.77 -0.38 0.00 -0.26 0.00 0.00 58.87 56.54 3afe n SER 225 Cb 0.46 -0.14 0.04 0.00 -0.26 0.00 0.00 64.21 64.31 3afe n SER 225 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3afe n ALA 226 N 0.67 0.28 -0.28 7.33 0.00 -1.26 -4.87 120.51 122.38 3afe n ALA 226 Ca 0.10 0.06 0.05 0.00 0.00 0.00 0.00 53.44 53.65 3afe n ALA 226 Cb 0.38 -2.12 0.20 0.00 0.00 0.00 0.00 19.45 17.91 3afe n ALA 226 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3afe h PRO 227 N 0.78 0.61 -0.36 0.00 0.11 -1.92 -2.69 132.00 128.54 3afe h PRO 227 Ca -0.48 -0.04 0.10 0.00 0.11 0.00 0.00 66.00 65.70 3afe h PRO 227 Cb 1.35 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3afe h PRO 227 CO 0.52 0.41 0.34 -0.24 -0.21 0.00 0.00 178.00 178.82 3afe h VAL 228 N 0.63 0.51 0.00 3.15 3.04 -1.86 -0.36 116.25 121.37 3afe h VAL 228 Ca 0.43 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.12 3afe h VAL 228 Cb 0.55 0.74 0.00 0.00 -2.01 0.00 0.00 31.29 30.57 3afe h VAL 228 CO -0.33 0.00 0.00 -1.22 -1.01 0.00 0.00 177.57 175.01 3afe n TYR 229 N -3.93 0.00 0.09 3.17 4.01 -1.01 -3.12 117.16 116.37 3afe n TYR 229 Ca 0.06 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.82 3afe n TYR 229 Cb 0.51 -0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.56 3afe n TYR 229 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 3afe n LYS 230 N -0.50 0.60 -1.94 -0.72 5.02 -0.14 -4.98 118.16 115.49 3afe n LYS 230 Ca 0.00 -1.02 -0.39 0.00 -2.02 0.00 0.00 58.31 54.88 3afe n LYS 230 Cb 0.00 -1.08 0.02 0.00 -0.02 0.00 0.00 35.03 33.95 3afe n LYS 230 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3afe s MET 231 N -0.53 3.57 0.27 1.97 -1.94 -1.18 -4.96 119.30 116.50 3afe s MET 231 Ca 0.05 2.16 -0.29 0.00 -1.71 0.00 0.00 55.69 55.90 3afe s MET 231 Cb 0.03 -2.49 -0.10 0.00 2.01 0.00 0.00 34.83 34.29 3afe s MET 231 CO 0.05 -0.82 1.33 -2.14 -0.01 0.00 0.00 175.02 173.43 3afe s PRO 232 N -2.61 4.36 0.27 2.03 0.02 -1.26 -4.89 135.00 132.92 3afe s PRO 232 Ca 0.64 2.17 0.00 0.00 0.02 0.00 0.00 61.00 63.84 3afe s PRO 232 Cb -0.38 -3.12 0.59 0.00 0.02 0.00 0.00 34.50 31.61 3afe s PRO 232 CO 0.47 -0.25 1.73 2.35 -0.33 0.00 0.00 177.00 180.98 3afe h TRP 233 N 4.38 0.69 0.00 6.54 -0.00 -1.93 0.40 115.95 126.03 3afe h TRP 233 Ca -0.47 0.04 -0.00 0.00 -0.00 0.00 0.00 58.89 58.46 3afe h TRP 233 Cb 1.22 -0.18 -0.00 0.00 -0.00 0.00 0.00 29.16 30.20 3afe h TRP 233 CO 0.59 0.08 -0.00 0.78 -0.00 0.00 0.00 178.44 179.89 3afe h GLY 234 N 0.52 0.00 0.02 2.65 0.00 -1.88 0.29 103.07 104.67 3afe h GLY 234 Ca 0.49 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 47.44 3afe h GLY 234 CO -0.43 0.00 -2.44 2.41 0.00 0.00 0.00 176.54 176.08 3afe n THR 235 N -3.10 1.48 -0.05 4.70 -1.04 -0.56 -4.37 114.28 111.34 3afe n THR 235 Ca -0.03 -0.63 -0.15 0.00 -2.04 0.00 0.00 64.05 61.20 3afe n THR 235 Cb 0.09 -1.24 -0.07 0.00 -1.82 0.00 0.00 70.33 67.30 3afe n THR 235 CO 0.00 0.00 0.00 -0.03 -0.64 0.00 0.00 175.07 174.40 3afe h MET 236 N 0.00 0.58 0.14 -2.82 -1.53 -0.21 -2.81 114.93 108.28 3afe h MET 236 Ca -0.57 -0.40 -0.01 0.00 -3.44 0.00 0.00 59.70 55.29 3afe h MET 236 Cb 1.97 0.06 0.00 0.00 -0.55 0.00 0.00 31.60 33.08 3afe h MET 236 CO -0.06 1.01 -0.07 1.25 0.14 0.00 0.00 176.91 179.19 3afe h HIS 237 N 0.24 -0.17 -0.26 1.39 6.17 -0.69 -2.60 115.15 119.24 3afe h HIS 237 Ca -0.00 -0.00 -0.00 0.00 0.71 0.00 0.00 60.37 61.07 3afe h HIS 237 Cb 1.02 0.06 -0.01 0.00 2.52 0.00 0.00 27.41 30.99 3afe h HIS 237 CO 0.10 0.28 0.14 -1.35 0.71 0.00 0.00 177.93 177.80 3afe h PRO 238 N -0.90 0.35 -0.06 5.26 0.11 -1.74 -1.21 132.00 133.81 3afe h PRO 238 Ca -0.02 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 3afe h PRO 238 Cb 0.52 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.55 3afe h PRO 238 CO 0.03 0.26 -0.22 1.15 -0.21 0.00 0.00 178.00 179.01 3afe h THR 239 N 0.35 1.19 0.00 -1.15 2.02 -1.53 0.32 112.91 114.12 3afe h THR 239 Ca 0.09 -0.88 -0.03 0.00 0.77 0.00 0.00 66.41 66.37 3afe h THR 239 Cb 0.01 1.38 -0.00 0.00 -1.74 0.00 0.00 68.15 67.80 3afe h THR 239 CO -0.02 0.26 -0.15 0.00 0.37 0.00 0.00 175.52 175.98 3afe h THR 240 N 0.10 0.70 0.15 3.16 1.03 -0.80 -1.05 112.91 116.20 3afe h THR 240 Ca 0.02 -0.62 -0.28 0.00 -0.01 0.00 0.00 66.41 65.51 3afe h THR 240 Cb 0.44 1.38 0.01 0.00 -1.07 0.00 0.00 68.15 68.92 3afe h THR 240 CO 0.03 0.15 -1.38 0.40 -0.01 0.00 0.00 175.52 174.71 3afe h ILE 241 N 0.00 1.14 -0.02 0.00 1.08 -0.89 -3.39 117.51 115.43 3afe h ILE 241 Ca -0.00 -2.49 -0.25 0.00 -0.39 0.00 0.00 64.86 61.73 3afe h ILE 241 Cb 0.37 2.86 0.02 0.00 -3.07 0.00 0.00 36.82 37.00 3afe h ILE 241 CO 0.02 0.75 -1.00 0.28 -0.69 0.00 0.00 178.15 177.52 3afe h SER 242 N -0.17 0.84 -0.11 1.72 0.02 -0.94 -3.27 113.55 111.64 3afe h SER 242 Ca -0.28 -0.66 0.05 0.00 -0.84 0.00 0.00 61.79 60.06 3afe h SER 242 Cb 1.86 -0.26 -0.06 0.00 0.14 0.00 0.00 62.40 64.09 3afe h SER 242 CO 0.13 1.46 -0.29 0.00 -1.14 0.00 0.00 176.83 176.99 3afe h ALA 243 N 0.49 -0.33 -0.37 3.77 0.00 -1.39 0.89 119.26 122.32 3afe h ALA 243 Ca -0.11 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 3afe h ALA 243 Cb 1.64 0.55 -0.02 0.00 0.00 0.00 0.00 17.79 19.97 3afe h ALA 243 CO 0.19 -0.77 0.12 -1.35 0.00 0.00 0.00 179.25 177.44 3afe h PRO 244 N -0.38 0.53 -0.55 0.00 0.11 -1.75 -0.15 132.00 129.81 3afe h PRO 244 Ca 0.09 -0.08 -0.02 0.00 0.11 0.00 0.00 66.00 66.11 3afe h PRO 244 Cb 0.52 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 31.51 3afe h PRO 244 CO -0.32 0.47 0.28 0.82 -0.21 0.00 0.00 178.00 179.03 3afe h ILE 245 N 0.53 1.19 -0.30 4.15 2.04 -1.31 0.07 117.51 123.88 3afe h ILE 245 Ca 0.13 -0.53 0.04 0.00 1.00 0.00 0.00 64.86 65.50 3afe h ILE 245 Cb 0.16 0.54 -0.04 0.00 -0.74 0.00 0.00 36.82 36.74 3afe h ILE 245 CO -0.01 0.22 0.04 0.58 0.00 0.00 0.00 178.15 178.98 3afe h VAL 246 N 0.73 0.83 -1.00 1.67 2.07 0.10 -1.28 116.25 119.38 3afe h VAL 246 Ca 0.19 -0.05 0.19 0.00 0.82 0.00 0.00 66.70 67.86 3afe h VAL 246 Cb 0.09 0.68 -0.11 0.00 -1.52 0.00 0.00 31.29 30.43 3afe h VAL 246 CO -0.03 0.03 0.61 1.23 0.02 0.00 0.00 177.57 179.43 3afe h GLY 247 N 0.14 1.78 1.30 2.17 0.00 -0.50 -0.90 103.07 107.06 3afe h GLY 247 Ca 0.14 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 3afe h GLY 247 CO -0.20 -0.07 0.30 -0.33 0.00 0.00 0.00 176.54 176.23 3afe h MET 248 N 0.75 0.91 -0.40 4.80 2.07 0.17 0.08 114.93 123.31 3afe h MET 248 Ca 0.58 -0.12 -0.05 0.00 -2.07 0.00 0.00 59.70 58.04 3afe h MET 248 Cb 0.93 -0.17 -0.02 0.00 -1.87 0.00 0.00 31.60 30.48 3afe h MET 248 CO -0.38 0.71 0.04 0.00 1.07 0.00 0.00 176.91 178.35 3afe h ALA 249 N 1.42 0.53 -0.67 6.32 0.00 -0.67 -0.04 119.26 126.15 3afe h ALA 249 Ca 0.22 -0.23 0.08 0.00 0.00 0.00 0.00 54.91 54.98 3afe h ALA 249 Cb 0.11 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.69 3afe h ALA 249 CO -0.03 0.26 0.34 1.88 0.00 0.00 0.00 179.25 181.71 3afe h TYR 250 N 0.51 0.62 0.10 0.00 -1.99 -0.73 0.81 116.97 116.29 3afe h TYR 250 Ca 0.12 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.87 3afe h TYR 250 Cb 0.41 -0.18 0.00 0.00 2.00 0.00 0.00 36.73 38.96 3afe h TYR 250 CO 0.03 0.25 -0.05 0.78 -0.00 0.00 0.00 178.16 179.18 3afe h GLY 251 N 0.61 -0.14 0.70 3.88 0.00 -0.74 -1.59 103.07 105.80 3afe h GLY 251 Ca 0.32 0.05 0.11 0.00 0.00 0.00 0.00 47.33 47.81 3afe h GLY 251 CO -0.23 -0.05 0.55 0.00 0.00 0.00 0.00 176.54 176.81 3afe h ALA 252 N 0.61 1.77 -0.07 3.60 0.00 -0.80 -1.85 119.26 122.52 3afe h ALA 252 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3afe h ALA 252 Cb 0.23 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3afe h ALA 252 CO 0.02 0.04 -0.00 -0.92 0.00 0.00 0.00 179.25 178.39 3afe h TYR 253 N 0.74 0.14 -0.66 0.00 3.20 -0.51 -2.30 116.97 117.57 3afe h TYR 253 Ca 0.40 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.24 3afe h TYR 253 Cb 0.54 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.74 3afe h TYR 253 CO -0.00 0.40 0.38 0.00 -1.64 0.00 0.00 178.16 177.29 3afe h ALA 254 N 0.72 0.85 0.41 1.82 0.00 -0.92 -0.88 119.26 121.25 3afe h ALA 254 Ca 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3afe h ALA 254 Cb 0.35 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3afe h ALA 254 CO 0.00 0.35 -0.48 0.00 0.00 0.00 0.00 179.25 179.12 3afe h ALA 255 N 1.19 -1.11 -0.89 0.00 0.00 -1.35 -1.39 119.26 115.72 3afe h ALA 255 Ca 0.23 -0.17 0.10 0.00 0.00 0.00 0.00 54.91 55.07 3afe h ALA 255 Cb 0.02 0.74 -0.07 0.00 0.00 0.00 0.00 17.79 18.48 3afe h ALA 255 CO -0.04 -1.15 0.53 1.25 0.00 0.00 0.00 179.25 179.84 3afe h HIS 256 N -0.91 0.96 -0.00 0.00 6.17 -1.22 -1.96 115.15 118.19 3afe h HIS 256 Ca -0.05 0.03 -0.00 0.00 0.71 0.00 0.00 60.37 61.06 3afe h HIS 256 Cb 0.81 -0.30 -0.00 0.00 2.52 0.00 0.00 27.41 30.44 3afe h HIS 256 CO -0.28 0.41 0.00 0.28 0.71 0.00 0.00 177.93 179.05 3afe h VAL 257 N 0.89 1.09 -0.26 5.26 2.07 -0.91 0.31 116.25 124.69 3afe h VAL 257 Ca 0.42 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 67.71 3afe h VAL 257 Cb 0.36 1.26 -0.06 0.00 -1.52 0.00 0.00 31.29 31.33 3afe h VAL 257 CO -0.24 0.07 -0.44 -0.08 0.02 0.00 0.00 177.57 176.90 3afe h GLU 258 N -0.10 -0.34 -0.49 1.57 4.81 -0.79 0.33 114.58 119.58 3afe h GLU 258 Ca 0.00 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3afe h GLU 258 Cb 0.11 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 3afe h GLU 258 CO -0.00 -0.23 0.31 1.25 -0.73 0.00 0.00 179.01 179.61 3afe h HIS 259 N -0.35 0.62 0.00 0.92 2.76 -1.22 -2.01 115.15 115.86 3afe h HIS 259 Ca 0.05 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.16 3afe h HIS 259 Cb 0.49 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.23 3afe h HIS 259 CO -0.66 0.40 -0.47 0.37 -1.30 0.00 0.00 177.93 176.27 3afe h GLN 260 N 0.66 0.00 0.71 5.26 5.75 0.06 -3.16 115.11 124.40 3afe h GLN 260 Ca 0.18 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.64 3afe h GLN 260 Cb -0.06 0.00 0.01 0.00 1.07 0.00 0.00 27.48 28.50 3afe h GLN 260 CO -0.04 0.29 -0.34 0.78 -2.65 0.00 0.00 178.83 176.87 3afe h GLY 261 N 3.71 -1.00 0.11 2.39 0.00 0.42 -0.95 103.07 107.75 3afe h GLY 261 Ca -0.02 0.37 0.06 0.00 0.00 0.00 0.00 47.33 47.74 3afe h GLY 261 CO 0.04 -0.36 -0.29 0.07 0.00 0.00 0.00 176.54 175.99 3afe h LYS 262 N -1.18 -0.32 -0.76 4.80 2.10 -1.68 -2.86 116.57 116.67 3afe h LYS 262 Ca -0.10 0.02 0.16 0.00 -2.00 0.00 0.00 60.65 58.74 3afe h LYS 262 Cb 0.76 0.07 -0.11 0.00 -0.90 0.00 0.00 32.23 32.05 3afe h LYS 262 CO 0.16 -0.21 0.22 -0.09 -2.00 0.00 0.00 179.45 177.53 3afe h ARG 263 N -0.33 0.31 -2.25 0.07 2.43 -1.50 -0.99 114.38 112.11 3afe h ARG 263 Ca 0.12 -0.02 -0.81 0.00 -0.81 0.00 0.00 59.98 58.46 3afe h ARG 263 Cb 0.52 -0.07 -0.27 0.00 -0.42 0.00 0.00 29.97 29.73 3afe h ARG 263 CO -0.39 0.20 1.06 1.33 -1.51 0.00 0.00 179.97 180.66 3afe n VAL 264 N -5.12 6.09 -3.15 0.20 0.24 -0.37 -4.47 118.33 111.75 3afe n VAL 264 Ca 0.15 -5.95 -0.23 0.00 -2.04 0.00 0.00 64.34 56.28 3afe n VAL 264 Cb 0.47 -1.55 -0.05 0.00 -1.47 0.00 0.00 33.84 31.25 3afe n VAL 264 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3afe n ARG 265 N -0.04 1.70 -3.80 7.34 1.74 -0.38 -4.93 116.66 118.29 3afe n ARG 265 Ca 0.47 -3.89 -0.34 0.00 -0.77 0.00 0.00 57.85 53.33 3afe n ARG 265 Cb 0.26 -1.82 -0.11 0.00 -1.02 0.00 0.00 32.46 29.77 3afe n ARG 265 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3afe s ALA 266 N -2.47 3.53 -0.58 7.54 0.00 -1.26 -5.07 121.76 123.44 3afe s ALA 266 Ca 0.41 -3.33 -0.12 0.00 0.00 0.00 0.00 51.96 48.92 3afe s ALA 266 Cb 0.27 -2.48 0.15 0.00 0.00 0.00 0.00 23.12 21.06 3afe s ALA 266 CO -0.09 -2.08 0.50 0.00 0.00 0.00 0.00 175.76 174.08 3afe s ALA 267 N -0.27 3.65 0.21 0.00 0.00 -1.26 -5.22 121.76 118.87 3afe s ALA 267 Ca 0.18 -2.75 0.10 0.00 0.00 0.00 0.00 51.96 49.49 3afe s ALA 267 Cb -0.21 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 19.73 3afe s ALA 267 CO -0.03 -2.04 -0.13 -0.51 0.00 0.00 0.00 175.76 173.04 3afe s ASP 275 N 2.81 3.99 -0.45 0.00 -0.00 -1.26 -5.30 116.67 116.46 3afe s ASP 275 Ca 0.08 -0.72 0.07 0.00 -0.00 0.00 0.00 52.55 51.97 3afe s ASP 275 Cb -0.24 -0.56 0.24 0.00 -0.00 0.00 0.00 42.92 42.36 3afe s ASP 275 CO -0.01 0.08 0.71 -0.67 -0.00 0.00 0.00 175.17 175.29 3afe n ASP 276 N -0.12 -1.52 -0.29 0.27 4.64 -1.26 -4.99 116.55 113.28 3afe n ASP 276 Ca -0.10 -3.01 0.03 0.00 -1.38 0.00 0.00 54.79 50.33 3afe n ASP 276 Cb 0.57 0.70 0.16 0.00 -1.04 0.00 0.00 41.12 41.51 3afe n ASP 276 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 3afe h PRO 277 N 4.06 0.75 -0.88 -0.67 0.13 -2.06 -2.98 132.00 130.36 3afe h PRO 277 Ca -0.04 -0.05 0.13 0.00 -0.87 0.00 0.00 66.00 65.17 3afe h PRO 277 Cb 0.96 -0.17 -0.09 0.00 0.13 0.00 0.00 31.00 31.84 3afe h PRO 277 CO 0.38 0.50 0.49 0.35 -0.23 0.00 0.00 178.00 179.49 3afe h PHE 278 N 0.78 0.88 -0.01 1.56 -0.00 -2.00 0.30 116.94 118.44 3afe h PHE 278 Ca 0.39 0.03 -0.11 0.00 -0.00 0.00 0.00 57.97 58.28 3afe h PHE 278 Cb 0.35 -0.26 -0.01 0.00 -0.00 0.00 0.00 35.95 36.03 3afe h PHE 278 CO -0.06 0.29 -0.50 0.00 -0.00 0.00 0.00 178.31 178.03 3afe h ALA 279 N 1.53 1.15 -0.03 2.41 0.00 -1.96 -2.98 119.26 119.38 3afe h ALA 279 Ca 0.46 -0.46 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3afe h ALA 279 Cb 0.55 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3afe h ALA 279 CO -0.31 0.63 -0.21 0.87 0.00 0.00 0.00 179.25 180.23 3afe h LYS 280 N 0.02 0.19 -0.10 0.00 1.57 -1.00 -3.14 116.57 114.11 3afe h LYS 280 Ca -0.00 -0.17 0.04 0.00 -1.87 0.00 0.00 60.65 58.65 3afe h LYS 280 Cb 0.89 0.04 -0.06 0.00 0.08 0.00 0.00 32.23 33.18 3afe h LYS 280 CO 0.07 0.85 -0.35 0.28 -0.57 0.00 0.00 179.45 179.72 3afe h VAL 281 N -0.41 0.24 0.00 0.50 2.07 -1.10 -0.35 116.25 117.20 3afe h VAL 281 Ca -0.02 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 3afe h VAL 281 Cb 0.90 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 3afe h VAL 281 CO 0.04 0.00 -0.12 0.08 0.02 0.00 0.00 177.57 177.59 3afe h ARG 282 N -0.45 0.00 0.03 1.57 0.11 -1.61 0.39 114.38 114.42 3afe h ARG 282 Ca 0.08 0.00 -0.27 0.00 0.10 0.00 0.00 59.98 59.90 3afe h ARG 282 Cb 0.58 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.68 3afe h ARG 282 CO -0.35 0.12 -1.07 0.82 0.10 0.00 0.00 179.97 179.59 3afe h ILE 283 N 0.00 1.30 -0.69 0.08 2.04 -1.31 -1.95 117.51 116.98 3afe h ILE 283 Ca -0.00 -2.34 -0.06 0.00 1.00 0.00 0.00 64.86 63.46 3afe h ILE 283 Cb 0.32 2.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.83 3afe h ILE 283 CO 0.02 0.72 0.21 0.00 0.00 0.00 0.00 178.15 179.09 3afe h ALA 284 N 0.44 1.07 -0.16 1.87 0.00 0.20 -0.58 119.26 122.10 3afe h ALA 284 Ca -0.13 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.48 3afe h ALA 284 Cb 1.73 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 19.25 3afe h ALA 284 CO 0.21 0.63 -0.22 0.93 0.00 0.00 0.00 179.25 180.80 3afe h GLU 285 N 1.03 0.43 -0.31 0.00 5.08 -0.97 -1.73 114.58 118.10 3afe h GLU 285 Ca 0.22 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 3afe h GLU 285 Cb 0.30 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3afe h GLU 285 CO -0.01 0.83 0.16 0.00 -1.00 0.00 0.00 179.01 179.00 3afe h ALA 286 N 0.59 0.40 -0.71 3.43 0.00 -1.32 0.30 119.26 121.96 3afe h ALA 286 Ca 0.02 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 54.93 3afe h ALA 286 Cb 0.78 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.38 3afe h ALA 286 CO 0.05 -0.06 0.38 0.00 0.00 0.00 0.00 179.25 179.62 3afe h ALA 287 N 1.03 0.97 -0.07 0.00 0.00 -1.06 -0.07 119.26 120.05 3afe h ALA 287 Ca 0.11 0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.89 3afe h ALA 287 Cb 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3afe h ALA 287 CO -0.02 0.02 -0.66 1.03 0.00 0.00 0.00 179.25 179.63 3afe h SER 288 N 0.67 0.36 0.16 0.00 0.87 -0.91 -1.77 113.55 112.93 3afe h SER 288 Ca 0.33 -0.22 -0.20 0.00 -1.23 0.00 0.00 61.79 60.47 3afe h SER 288 Cb 0.28 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.13 3afe h SER 288 CO -0.22 0.92 -0.77 0.44 -0.53 0.00 0.00 176.83 176.67 3afe h ASP 289 N 0.22 0.61 -0.41 6.23 3.32 -0.44 -1.81 116.42 124.14 3afe h ASP 289 Ca -0.02 -0.41 -0.08 0.00 0.02 0.00 0.00 57.03 56.55 3afe h ASP 289 Cb 1.20 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.56 3afe h ASP 289 CO 0.11 1.17 -0.06 0.40 -1.72 0.00 0.00 179.24 179.13 3afe h ILE 290 N 0.34 1.27 -0.37 0.35 2.04 -0.98 -0.54 117.51 119.62 3afe h ILE 290 Ca -0.04 -1.14 -0.02 0.00 1.00 0.00 0.00 64.86 64.67 3afe h ILE 290 Cb 1.36 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 38.60 3afe h ILE 290 CO 0.14 0.38 0.17 -0.78 0.00 0.00 0.00 178.15 178.06 3afe h ASP 291 N 0.59 0.46 -0.10 1.72 3.58 -1.26 -1.42 116.42 119.98 3afe h ASP 291 Ca 0.11 -0.04 -0.23 0.00 0.42 0.00 0.00 57.03 57.29 3afe h ASP 291 Cb 0.58 -0.12 0.01 0.00 1.72 0.00 0.00 39.33 41.52 3afe h ASP 291 CO 0.03 0.41 -0.81 0.00 -2.88 0.00 0.00 179.24 175.99 3afe h ALA 292 N 1.67 0.31 0.32 -0.78 0.00 -0.91 -1.54 119.26 118.32 3afe h ALA 292 Ca 0.13 -0.61 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 3afe h ALA 292 Cb 0.08 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3afe h ALA 292 CO -0.02 0.69 -0.45 0.00 0.00 0.00 0.00 179.25 179.47 3afe h ALA 293 N 0.56 -1.05 0.04 0.00 0.00 -0.59 -2.37 119.26 115.85 3afe h ALA 293 Ca -0.06 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.73 3afe h ALA 293 Cb 1.44 0.74 -0.04 0.00 0.00 0.00 0.00 17.79 19.93 3afe h ALA 293 CO 0.16 -1.11 -0.26 2.35 0.00 0.00 0.00 179.25 180.40 3afe h TRP 294 N -0.81 -0.69 -0.51 0.00 2.91 -1.27 -1.04 115.95 114.55 3afe h TRP 294 Ca -0.04 0.02 0.10 0.00 1.13 0.00 0.00 58.89 60.10 3afe h TRP 294 Cb 0.73 0.30 -0.10 0.00 -0.51 0.00 0.00 29.16 29.58 3afe h TRP 294 CO -0.31 -0.35 -0.25 0.00 -1.03 0.00 0.00 178.44 176.50 3afe h ARG 295 N -0.42 -0.13 0.25 2.65 3.08 -1.27 0.93 114.38 119.48 3afe h ARG 295 Ca 0.05 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 3afe h ARG 295 Cb 0.48 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.56 3afe h ARG 295 CO -0.20 -0.08 -0.12 1.96 -1.07 0.00 0.00 179.97 180.46 3afe h GLN 296 N -0.13 -0.33 0.27 0.04 4.20 -1.11 0.65 115.11 118.70 3afe h GLN 296 Ca 0.23 0.02 0.01 0.00 0.06 0.00 0.00 58.65 58.97 3afe h GLN 296 Cb 0.50 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.32 3afe h GLN 296 CO -0.59 -0.16 -0.40 1.25 -0.67 0.00 0.00 178.83 178.26 3afe h LEU 297 N -0.42 -1.14 -0.84 1.46 5.85 -0.72 0.24 115.31 119.74 3afe h LEU 297 Ca -0.03 0.11 -0.12 0.00 0.84 0.00 0.00 57.88 58.67 3afe h LEU 297 Cb 0.32 0.40 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 3afe h LEU 297 CO 0.06 -0.52 -0.58 -0.29 -0.34 0.00 0.00 178.44 176.78 3afe h ILE 298 N -0.73 1.41 -0.26 4.05 6.09 -0.85 -2.88 117.51 124.33 3afe h ILE 298 Ca -0.01 -1.97 -0.02 0.00 -1.37 0.00 0.00 64.86 61.49 3afe h ILE 298 Cb 0.70 2.06 -0.01 0.00 0.47 0.00 0.00 36.82 40.04 3afe h ILE 298 CO -0.14 0.56 0.07 1.23 -3.07 0.00 0.00 178.15 176.80 3afe h GLY 299 N 1.72 0.45 1.34 8.18 0.00 0.80 -0.20 103.07 115.35 3afe h GLY 299 Ca -0.01 -0.28 -0.10 0.00 0.00 0.00 0.00 47.33 46.94 3afe h GLY 299 CO 0.08 0.26 -0.16 3.43 0.00 0.00 0.00 176.54 180.14 3afe h ASN 300 N 0.25 0.77 -0.67 0.19 -0.26 -0.96 -0.44 115.58 114.47 3afe h ASN 300 Ca 0.08 -0.25 0.03 0.00 -0.56 0.00 0.00 56.30 55.60 3afe h ASN 300 Cb 0.28 -0.21 -0.04 0.00 -1.06 0.00 0.00 38.32 37.28 3afe h ASN 300 CO 0.00 0.94 0.42 0.58 -1.06 0.00 0.00 177.43 178.31 3afe h VAL 301 N 0.69 1.08 -0.10 2.81 2.07 -1.28 -2.52 116.25 119.00 3afe h VAL 301 Ca 0.11 -0.28 -0.19 0.00 0.82 0.00 0.00 66.70 67.16 3afe h VAL 301 Cb 0.66 0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 30.62 3afe h VAL 301 CO 0.05 0.15 -0.74 0.28 0.02 0.00 0.00 177.57 177.33 3afe h SER 302 N 0.81 0.60 -0.55 0.57 0.02 -0.71 -2.41 113.55 111.89 3afe h SER 302 Ca 0.27 -0.39 -0.01 0.00 -0.84 0.00 0.00 61.79 60.83 3afe h SER 302 Cb 0.03 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 3afe h SER 302 CO -0.11 1.14 0.32 0.44 -1.14 0.00 0.00 176.83 177.49 3afe h ASP 303 N 0.35 0.68 0.16 3.07 3.32 -0.97 -1.15 116.42 121.88 3afe h ASP 303 Ca -0.03 -0.04 -0.29 0.00 0.02 0.00 0.00 57.03 56.69 3afe h ASP 303 Cb 1.32 -0.17 0.02 0.00 0.22 0.00 0.00 39.33 40.73 3afe h ASP 303 CO 0.13 0.54 -1.19 -0.33 -1.72 0.00 0.00 179.24 176.67 3afe h GLU 304 N 0.78 0.59 -0.05 3.56 5.08 -1.31 -2.97 114.58 120.27 3afe h GLU 304 Ca 0.20 -0.76 -0.15 0.00 -1.00 0.00 0.00 59.36 57.65 3afe h GLU 304 Cb -0.01 0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 3afe h GLU 304 CO -0.04 1.33 -0.63 -0.92 -1.00 0.00 0.00 179.01 177.76 3afe h TYR 305 N 0.28 0.25 -0.51 4.33 3.20 -1.31 -2.37 116.97 120.84 3afe h TYR 305 Ca -0.17 -0.10 -0.09 0.00 3.14 0.00 0.00 58.73 61.51 3afe h TYR 305 Cb 1.85 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 40.06 3afe h TYR 305 CO 0.10 0.77 -0.05 0.00 -1.64 0.00 0.00 178.16 177.35 3afe h ALA 306 N 1.21 0.96 -0.06 1.82 0.00 -1.26 -0.23 119.26 121.70 3afe h ALA 306 Ca -0.01 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 3afe h ALA 306 Cb 1.14 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 3afe h ALA 306 CO 0.09 0.62 0.02 -0.07 0.00 0.00 0.00 179.25 179.92 3afe h LEU 307 N 0.81 0.08 -1.12 0.00 3.38 -1.37 -2.34 115.31 114.75 3afe h LEU 307 Ca 0.14 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 3afe h LEU 307 Cb 0.55 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 3afe h LEU 307 CO 0.03 0.22 0.10 -0.07 0.09 0.00 0.00 178.44 178.81 3afe h LEU 308 N -0.06 0.67 -1.17 1.67 3.38 -1.30 -0.72 115.31 117.78 3afe h LEU 308 Ca 0.02 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 3afe h LEU 308 Cb 0.16 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 3afe h LEU 308 CO -0.00 0.68 -0.13 0.00 0.09 0.00 0.00 178.44 179.07 3afe h ALA 309 N 1.41 1.31 -0.13 1.53 0.00 -0.86 -1.14 119.26 121.39 3afe h ALA 309 Ca 0.16 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3afe h ALA 309 Cb 0.28 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3afe h ALA 309 CO -0.00 0.46 0.00 0.00 0.00 0.00 0.00 179.25 179.71 3afe n ALA 310 N -2.48 2.53 0.00 0.00 0.00 -0.90 -4.89 120.51 114.78 3afe n ALA 310 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.07 3afe n ALA 310 Cb 0.31 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.63 3afe n ALA 310 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3afe n GLY 311 N 0.96 3.00 3.48 0.00 0.00 -0.43 -5.01 105.19 107.19 3afe n GLY 311 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 3afe n GLY 311 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3afe s LYS 312 N -0.00 -1.65 0.16 1.61 1.02 -0.31 -4.92 119.74 115.65 3afe s LYS 312 Ca 0.00 0.20 0.08 0.00 0.02 0.00 0.00 55.97 56.27 3afe s LYS 312 Cb 0.00 -1.52 -0.04 0.00 -0.52 0.00 0.00 37.83 35.75 3afe s LYS 312 CO 0.00 -4.05 -0.05 -2.00 -0.92 0.00 0.00 175.35 168.33 3afe s GLU 313 N -5.09 2.25 -0.48 1.68 2.12 -1.26 -4.08 118.70 113.85 3afe s GLU 313 Ca 0.69 -1.12 -0.22 0.00 0.36 0.00 0.00 54.97 54.67 3afe s GLU 313 Cb -0.14 -2.30 0.03 0.00 0.26 0.00 0.00 34.13 31.98 3afe s GLU 313 CO 0.58 0.46 0.77 0.42 -0.54 0.00 0.00 175.26 176.95 3afe s ILE 314 N -1.59 4.66 0.47 -3.70 1.01 -1.26 -4.95 121.20 115.84 3afe s ILE 314 Ca 0.25 0.20 -0.23 0.00 0.00 0.00 0.00 60.65 60.87 3afe s ILE 314 Cb -0.10 -4.34 -0.07 0.00 0.01 0.00 0.00 42.46 37.96 3afe s ILE 314 CO 0.17 -0.79 1.23 -2.84 0.00 0.00 0.00 174.94 172.70 3afe s PRO 315 N 3.24 3.66 0.26 2.79 0.02 -1.26 -4.92 135.00 138.79 3afe s PRO 315 Ca 0.26 1.94 -0.02 0.00 0.02 0.00 0.00 61.00 63.20 3afe s PRO 315 Cb -0.14 -2.43 0.49 0.00 0.02 0.00 0.00 34.50 32.44 3afe s PRO 315 CO 0.20 -0.68 1.78 0.35 -0.33 0.00 0.00 177.00 178.32 3afe h PHE 316 N 2.03 0.81 -1.01 6.54 3.57 -2.00 -1.24 116.94 125.64 3afe h PHE 316 Ca -0.50 0.03 0.28 0.00 3.53 0.00 0.00 57.97 61.32 3afe h PHE 316 Cb 1.26 -0.24 -0.13 0.00 2.79 0.00 0.00 35.95 39.63 3afe h PHE 316 CO 0.52 0.25 0.60 1.49 -2.23 0.00 0.00 178.31 178.93 3afe h GLU 317 N 0.70 0.44 -0.05 1.11 4.57 -1.99 0.59 114.58 119.94 3afe h GLU 317 Ca 0.44 -0.03 -0.22 0.00 -1.18 0.00 0.00 59.36 58.37 3afe h GLU 317 Cb 0.55 -0.10 0.01 0.00 -0.16 0.00 0.00 28.75 29.05 3afe h GLU 317 CO -0.32 0.29 -0.88 1.25 -1.18 0.00 0.00 179.01 178.17 3afe h LEU 318 N 0.45 0.68 -0.83 1.64 5.85 -1.59 -1.58 115.31 119.93 3afe h LEU 318 Ca 0.68 -0.50 -0.10 0.00 0.84 0.00 0.00 57.88 58.81 3afe h LEU 318 Cb 1.46 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 42.27 3afe h LEU 318 CO -0.51 1.29 -0.16 0.03 -0.34 0.00 0.00 178.44 178.74 3afe h ARG 319 N 0.34 0.69 -0.42 1.25 3.08 -0.89 -0.71 114.38 117.71 3afe h ARG 319 Ca -0.07 -0.24 -0.15 0.00 0.07 0.00 0.00 59.98 59.58 3afe h ARG 319 Cb 1.50 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.50 3afe h ARG 319 CO 0.16 0.82 -0.32 0.00 -1.07 0.00 0.00 179.97 179.56 3afe h ALA 320 N 1.20 0.62 -0.46 0.04 0.00 -1.09 -2.31 119.26 117.26 3afe h ALA 320 Ca 0.10 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.52 3afe h ALA 320 Cb 0.63 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 3afe h ALA 320 CO 0.04 0.68 0.06 0.00 0.00 0.00 0.00 179.25 180.03 3afe h ARG 321 N 0.80 0.72 -0.46 0.00 3.08 -0.98 -2.58 114.38 114.98 3afe h ARG 321 Ca 0.08 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 3afe h ARG 321 Cb 0.91 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 3afe h ARG 321 CO 0.08 0.70 0.16 0.00 -1.07 0.00 0.00 179.97 179.84 3afe h ALA 322 N 1.37 0.59 -0.71 0.04 0.00 -0.93 -1.66 119.26 117.96 3afe h ALA 322 Ca 0.15 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3afe h ALA 322 Cb 0.35 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3afe h ALA 322 CO 0.01 0.23 0.25 0.00 0.00 0.00 0.00 179.25 179.74 3afe h ARG 323 N 0.60 1.08 0.01 0.00 2.47 -1.06 0.13 114.38 117.59 3afe h ARG 323 Ca 0.15 -0.20 -0.26 0.00 -1.26 0.00 0.00 59.98 58.41 3afe h ARG 323 Cb 0.24 -0.17 0.02 0.00 -1.65 0.00 0.00 29.97 28.41 3afe h ARG 323 CO -0.01 0.90 -1.03 0.07 0.56 0.00 0.00 179.97 180.45 3afe h ARG 324 N 1.04 0.61 -0.60 0.04 -0.00 -1.36 -2.59 114.38 111.53 3afe h ARG 324 Ca 0.24 -0.67 -0.07 0.00 -0.00 0.00 0.00 59.98 59.47 3afe h ARG 324 Cb 0.24 0.19 -0.03 0.00 -0.00 0.00 0.00 29.97 30.38 3afe h ARG 324 CO -0.01 1.27 0.10 -0.44 -0.00 0.00 0.00 179.97 180.89 3afe h ASP 325 N 0.34 0.92 -0.34 0.08 3.32 -1.14 -2.29 116.42 117.31 3afe h ASP 325 Ca -0.12 -0.20 -0.04 0.00 0.02 0.00 0.00 57.03 56.68 3afe h ASP 325 Cb 1.69 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.98 3afe h ASP 325 CO 0.20 0.92 0.05 -0.61 -1.72 0.00 0.00 179.24 178.07 3afe h GLN 326 N 0.92 0.58 0.00 3.56 -0.00 -0.63 0.38 115.11 119.91 3afe h GLN 326 Ca 0.19 -0.16 -0.10 0.00 -0.00 0.00 0.00 58.65 58.57 3afe h GLN 326 Cb 0.39 -0.06 -0.01 0.00 0.00 0.00 0.00 27.48 27.79 3afe h GLN 326 CO 0.01 0.66 -0.49 -0.39 0.00 0.00 0.00 178.83 178.62 3afe h VAL 327 N 0.41 1.29 -0.36 2.39 -1.51 -1.50 -2.72 116.25 114.25 3afe h VAL 327 Ca 0.10 -1.73 -0.14 0.00 -1.23 0.00 0.00 66.70 63.71 3afe h VAL 327 Cb 0.37 1.95 -0.01 0.00 -2.13 0.00 0.00 31.29 31.47 3afe h VAL 327 CO 0.01 0.48 -0.33 -0.09 -1.23 0.00 0.00 177.57 176.42 3afe h ARG 328 N 0.00 0.81 -0.44 5.19 1.12 -0.81 -2.42 114.38 117.83 3afe h ARG 328 Ca -0.00 -0.39 0.00 0.00 -1.11 0.00 0.00 59.98 58.48 3afe h ARG 328 Cb 0.91 -0.01 -0.02 0.00 -0.01 0.00 0.00 29.97 30.84 3afe h ARG 328 CO 0.06 1.02 0.28 0.00 -3.11 0.00 0.00 179.97 178.22 3afe h ALA 329 N 0.95 0.56 -0.17 2.80 0.00 0.05 -1.13 119.26 122.31 3afe h ALA 329 Ca 0.07 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.96 3afe h ALA 329 Cb 0.87 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 3afe h ALA 329 CO 0.08 0.02 0.02 1.15 0.00 0.00 0.00 179.25 180.52 3afe h THR 330 N 0.59 0.91 -0.20 0.00 2.02 -1.48 -0.52 112.91 114.23 3afe h THR 330 Ca 0.16 -0.03 0.06 0.00 0.77 0.00 0.00 66.41 67.37 3afe h THR 330 Cb -0.05 0.82 -0.07 0.00 -1.74 0.00 0.00 68.15 67.11 3afe h THR 330 CO -0.03 0.02 -0.31 1.23 0.37 0.00 0.00 175.52 176.79 3afe h GLY 331 N 0.08 -0.38 2.00 2.16 0.00 -0.87 -0.91 103.07 105.16 3afe h GLY 331 Ca 0.08 0.39 -0.00 0.00 0.00 0.00 0.00 47.33 47.79 3afe h GLY 331 CO -0.11 -0.21 -0.01 0.07 0.00 0.00 0.00 176.54 176.27 3afe h ARG 332 N -0.35 0.00 -0.07 4.80 0.11 -1.06 -0.91 114.38 116.90 3afe h ARG 332 Ca 0.12 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.17 3afe h ARG 332 Cb 0.54 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.61 3afe h ARG 332 CO -0.40 0.01 -0.06 0.77 0.10 0.00 0.00 179.97 180.40 3afe h SER 333 N 0.00 0.17 -0.20 0.08 0.02 -0.58 -2.46 113.55 110.59 3afe h SER 333 Ca -0.00 -0.46 -0.01 0.00 -0.84 0.00 0.00 61.79 60.48 3afe h SER 333 Cb 0.76 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.24 3afe h SER 333 CO 0.00 0.60 0.07 0.40 -1.14 0.00 0.00 176.83 176.76 3afe h ILE 334 N -0.25 1.17 -0.95 3.27 2.04 -0.92 -0.28 117.51 121.60 3afe h ILE 334 Ca 0.01 -0.54 0.07 0.00 1.00 0.00 0.00 64.86 65.41 3afe h ILE 334 Cb 0.54 1.15 -0.07 0.00 -0.74 0.00 0.00 36.82 37.71 3afe h ILE 334 CO 0.01 0.17 0.60 0.00 0.00 0.00 0.00 178.15 178.94 3afe h ALA 335 N 0.91 1.33 -0.18 1.87 0.00 -1.26 0.33 119.26 122.25 3afe h ALA 335 Ca 0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3afe h ALA 335 Cb 0.20 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3afe h ALA 335 CO -0.00 0.35 0.05 0.77 0.00 0.00 0.00 179.25 180.42 3afe h SER 336 N 1.07 0.27 -1.00 0.00 0.02 -1.00 -2.44 113.55 110.46 3afe h SER 336 Ca 0.42 -0.21 0.04 0.00 -0.84 0.00 0.00 61.79 61.19 3afe h SER 336 Cb 0.22 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 62.63 3afe h SER 336 CO -0.19 0.41 0.66 0.40 -1.14 0.00 0.00 176.83 176.97 3afe h ILE 337 N 0.11 1.17 -0.85 3.27 2.04 -0.53 0.06 117.51 122.78 3afe h ILE 337 Ca 0.06 -0.43 0.02 0.00 1.00 0.00 0.00 64.86 65.50 3afe h ILE 337 Cb 0.24 -0.21 -0.04 0.00 -0.74 0.00 0.00 36.82 36.07 3afe h ILE 337 CO -0.00 0.23 0.56 0.44 0.00 0.00 0.00 178.15 179.38 3afe h ASP 338 N 1.27 0.95 0.33 1.72 5.19 -0.76 0.21 116.42 125.33 3afe h ASP 338 Ca 0.40 -0.02 -0.21 0.00 -0.62 0.00 0.00 57.03 56.58 3afe h ASP 338 Cb 0.01 -0.23 -0.00 0.00 0.18 0.00 0.00 39.33 39.28 3afe h ASP 338 CO -0.13 0.68 -0.88 0.03 -3.12 0.00 0.00 179.24 175.82 3afe h ARG 339 N 1.12 0.40 0.00 3.56 3.08 -0.75 -1.54 114.38 120.24 3afe h ARG 339 Ca 0.32 -0.40 -0.11 0.00 0.07 0.00 0.00 59.98 59.86 3afe h ARG 339 Cb -0.07 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 3afe h ARG 339 CO -0.08 1.06 -0.54 -0.07 -1.07 0.00 0.00 179.97 179.28 3afe h LEU 340 N 0.24 0.00 0.04 3.04 3.38 -0.70 -2.40 115.31 118.91 3afe h LEU 340 Ca -0.06 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 3afe h LEU 340 Cb 1.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.25 3afe h LEU 340 CO 0.15 0.54 -0.02 0.15 0.09 0.00 0.00 178.44 179.35 3afe h PHE 341 N 0.00 -0.06 -0.96 1.13 3.57 -0.45 -2.55 116.94 117.61 3afe h PHE 341 Ca -0.01 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.57 3afe h PHE 341 Cb 0.99 0.02 -0.07 0.00 2.79 0.00 0.00 35.95 39.68 3afe h PHE 341 CO 0.00 0.50 0.61 1.49 -2.23 0.00 0.00 178.31 178.68 3afe h GLU 342 N -0.66 1.06 0.00 1.11 4.81 -1.32 -2.11 114.58 117.47 3afe h GLU 342 Ca -0.01 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.08 3afe h GLU 342 Cb 0.58 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 3afe h GLU 342 CO 0.01 0.70 -0.40 0.00 -0.73 0.00 0.00 179.01 178.59 3afe h ALA 343 N 1.45 1.12 0.00 2.92 0.00 -1.45 -2.87 119.26 120.44 3afe h ALA 343 Ca 0.43 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3afe h ALA 343 Cb 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3afe h ALA 343 CO -0.19 0.50 0.00 0.43 0.00 0.00 0.00 179.25 179.99 3afe n SER 344 N -3.74 0.53 0.00 0.00 7.64 -0.79 -4.94 113.62 112.32 3afe n SER 344 Ca -0.01 0.63 0.00 0.00 1.01 0.00 0.00 58.87 60.50 3afe n SER 344 Cb 0.48 -0.74 0.00 0.00 -1.01 0.00 0.00 64.21 62.94 3afe n SER 344 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3afe n GLY 345 N 0.09 1.42 0.34 0.23 0.00 -1.08 -3.88 105.19 102.31 3afe n GLY 345 Ca 0.03 -0.62 0.01 0.00 0.00 0.00 0.00 46.02 45.43 3afe n GLY 345 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3afe h ALA 346 N -0.78 1.47 0.00 4.61 0.00 -1.92 -2.44 119.26 120.20 3afe h ALA 346 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3afe h ALA 346 Cb 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.50 3afe h ALA 346 CO 0.00 0.48 0.00 0.25 0.00 0.00 0.00 179.25 179.98 3afe n THR 347 N -4.42 0.14 1.16 0.00 -2.24 -1.25 -2.16 114.28 105.51 3afe n THR 347 Ca 0.07 0.03 0.13 0.00 -2.27 0.00 0.00 64.05 62.01 3afe n THR 347 Cb 0.05 -0.62 0.31 0.00 -2.10 0.00 0.00 70.33 67.96 3afe n THR 347 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3afe n ALA 348 N -1.20 3.28 0.32 6.98 0.00 -0.92 -4.12 120.51 124.86 3afe n ALA 348 Ca 0.14 -0.41 0.12 0.00 0.00 0.00 0.00 53.44 53.29 3afe n ALA 348 Cb 0.17 -1.10 0.17 0.00 0.00 0.00 0.00 19.45 18.69 3afe n ALA 348 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3afe h LEU 349 N 0.94 0.00 -9.92 0.00 3.38 -1.59 -3.39 115.31 104.72 3afe h LEU 349 Ca 0.00 -0.04 -0.49 0.00 0.09 0.00 0.00 57.88 57.44 3afe h LEU 349 Cb 0.52 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.29 3afe h LEU 349 CO 0.00 0.02 0.44 -0.94 0.09 0.00 0.00 178.44 178.05 3afe s SER 350 N -5.35 6.85 0.49 -0.43 1.04 -1.26 -4.90 113.70 110.14 3afe s SER 350 Ca 0.06 2.14 0.27 0.00 0.48 0.00 0.00 55.95 58.89 3afe s SER 350 Cb 0.09 -2.60 1.45 0.00 0.10 0.00 0.00 66.02 65.06 3afe s SER 350 CO 0.70 -0.43 1.79 0.78 0.98 0.00 0.00 173.24 177.06 3afe h ASN 351 N 2.86 0.00 0.20 7.02 2.35 -1.96 -1.12 115.58 124.93 3afe h ASN 351 Ca -0.48 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 54.93 3afe h ASN 351 Cb 1.22 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.53 3afe h ASN 351 CO 0.63 0.00 -2.10 -1.84 -1.65 0.00 0.00 177.43 172.48 3afe n GLU 352 N -2.56 0.67 -1.69 0.81 0.28 -1.26 -4.98 120.64 111.92 3afe n GLU 352 Ca -0.02 0.15 -0.66 0.00 -0.16 0.00 0.00 57.16 56.47 3afe n GLU 352 Cb 0.21 -1.64 -0.10 0.00 1.43 0.00 0.00 31.44 31.34 3afe n GLU 352 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3afe n ALA 353 N -2.74 -1.04 -0.14 -1.84 0.00 -0.43 -4.87 120.51 109.45 3afe n ALA 353 Ca -0.28 0.45 -0.10 0.00 0.00 0.00 0.00 53.44 53.52 3afe n ALA 353 Cb 1.09 -1.97 -0.01 0.00 0.00 0.00 0.00 19.45 18.56 3afe n ALA 353 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3afe h PRO 354 N 5.73 0.64 -0.99 0.00 0.11 -1.93 -2.86 132.00 132.71 3afe h PRO 354 Ca -0.40 -0.15 0.17 0.00 0.11 0.00 0.00 66.00 65.72 3afe h PRO 354 Cb 1.37 -0.08 -0.10 0.00 0.11 0.00 0.00 31.00 32.30 3afe h PRO 354 CO 0.99 0.66 0.60 0.97 -0.21 0.00 0.00 178.00 181.01 3afe h ILE 355 N 0.50 0.77 0.00 4.15 2.10 -1.92 0.25 117.51 123.36 3afe h ILE 355 Ca 0.12 -0.28 -0.05 0.00 1.08 0.00 0.00 64.86 65.73 3afe h ILE 355 Cb 0.31 -0.12 -0.01 0.00 -1.09 0.00 0.00 36.82 35.91 3afe h ILE 355 CO 0.00 0.15 -0.25 0.06 -1.08 0.00 0.00 178.15 177.03 3afe h GLN 356 N 0.82 0.00 -0.02 2.19 -0.00 -1.71 -2.02 115.11 114.38 3afe h GLN 356 Ca 0.55 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 59.19 3afe h GLN 356 Cb 0.75 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.23 3afe h GLN 356 CO -0.35 0.25 -0.01 -0.09 -0.00 0.00 0.00 178.83 178.64 3afe h ARG 357 N 0.00 0.03 -0.85 0.06 2.43 -0.90 -0.88 114.38 114.28 3afe h ARG 357 Ca -0.00 -0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.28 3afe h ARG 357 Cb 0.65 -0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 30.12 3afe h ARG 357 CO 0.03 0.46 0.46 0.74 -1.51 0.00 0.00 179.97 180.15 3afe h PHE 358 N -0.39 0.83 -0.31 2.20 0.04 -1.17 0.66 116.94 118.80 3afe h PHE 358 Ca 0.00 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.77 3afe h PHE 358 Cb 0.45 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 38.35 3afe h PHE 358 CO 0.08 0.27 0.07 2.35 -0.60 0.00 0.00 178.31 180.47 3afe h TRP 359 N 0.71 0.53 -0.57 -0.55 7.01 -1.28 -0.68 115.95 121.12 3afe h TRP 359 Ca 0.44 -0.06 -0.05 0.00 2.11 0.00 0.00 58.89 61.32 3afe h TRP 359 Cb 0.53 -0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 27.42 3afe h TRP 359 CO -0.07 0.56 0.15 0.00 -2.79 0.00 0.00 178.44 176.28 3afe h ARG 360 N 0.34 0.91 -0.15 2.65 3.08 -0.60 -2.84 114.38 117.77 3afe h ARG 360 Ca 0.10 -0.22 -0.02 0.00 0.07 0.00 0.00 59.98 59.92 3afe h ARG 360 Cb 0.30 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 3afe h ARG 360 CO 0.00 0.84 0.03 -0.44 -1.07 0.00 0.00 179.97 179.34 3afe h ASP 361 N 0.82 0.23 -0.71 7.04 3.32 -0.69 -1.54 116.42 124.88 3afe h ASP 361 Ca 0.18 -0.24 0.06 0.00 0.02 0.00 0.00 57.03 57.06 3afe h ASP 361 Cb 0.34 -0.06 -0.06 0.00 0.22 0.00 0.00 39.33 39.77 3afe h ASP 361 CO 0.00 0.40 0.41 0.00 -1.72 0.00 0.00 179.24 178.33 3afe h ALA 362 N 0.83 0.97 -0.16 3.45 0.00 -1.15 0.39 119.26 123.59 3afe h ALA 362 Ca 0.05 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 3afe h ALA 362 Cb 0.27 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3afe h ALA 362 CO 0.00 0.08 -0.25 0.45 0.00 0.00 0.00 179.25 179.53 3afe h HIS 363 N 0.74 0.31 -0.01 0.00 3.86 -1.25 -0.41 115.15 118.40 3afe h HIS 363 Ca 0.32 -0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 59.47 3afe h HIS 363 Cb 0.21 -0.08 -0.00 0.00 1.06 0.00 0.00 27.41 28.60 3afe h HIS 363 CO -0.07 0.52 -0.00 0.00 0.86 0.00 0.00 177.93 179.24 3afe h ALA 364 N 1.49 0.01 -0.64 2.45 0.00 -0.47 -3.09 119.26 119.01 3afe h ALA 364 Ca 0.04 -0.19 0.13 0.00 0.00 0.00 0.00 54.91 54.89 3afe h ALA 364 Cb 0.59 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 3afe h ALA 364 CO 0.04 -0.30 0.43 0.78 0.00 0.00 0.00 179.25 180.20 3afe h GLY 365 N -0.35 0.50 1.11 0.00 0.00 -0.64 -2.52 103.07 101.18 3afe h GLY 365 Ca 0.00 -0.14 0.12 0.00 0.00 0.00 0.00 47.33 47.31 3afe h GLY 365 CO 0.00 0.06 0.33 -0.09 0.00 0.00 0.00 176.54 176.85 3afe h ARG 366 N 0.32 0.11 0.00 4.80 9.65 -0.98 -2.02 114.38 126.26 3afe h ARG 366 Ca 0.30 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.18 3afe h ARG 366 Cb 0.75 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.30 3afe h ARG 366 CO -0.08 0.07 0.00 -0.39 2.80 0.00 0.00 179.97 182.38 3afe h VAL 367 N 0.11 0.00 -2.95 0.20 -1.51 -1.56 -3.44 116.25 107.10 3afe h VAL 367 Ca 0.22 -0.62 -0.59 0.00 -1.23 0.00 0.00 66.70 64.48 3afe h VAL 367 Cb 0.74 1.59 0.13 0.00 -2.13 0.00 0.00 31.29 31.62 3afe h VAL 367 CO -0.02 0.00 0.12 1.57 -1.23 0.00 0.00 177.57 178.01 3afe n HIS 368 N -2.88 1.08 0.17 5.19 -0.00 -0.76 -4.86 115.22 113.17 3afe n HIS 368 Ca 0.02 0.58 0.02 0.00 -0.00 0.00 0.00 57.72 58.34 3afe n HIS 368 Cb 0.38 -2.22 0.31 0.00 -0.00 0.00 0.00 29.99 28.46 3afe n HIS 368 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3afe h ALA 369 N 1.54 1.21 0.00 1.57 0.00 -1.90 -1.81 119.26 119.87 3afe h ALA 369 Ca -0.44 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.07 3afe h ALA 369 Cb 1.34 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3afe h ALA 369 CO 0.57 0.56 0.00 0.00 0.00 0.00 0.00 179.25 180.38 3afe h ALA 370 N 1.55 1.00 -0.00 0.00 0.00 -1.94 -2.19 119.26 117.68 3afe h ALA 370 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3afe h ALA 370 Cb 0.81 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.60 3afe h ALA 370 CO 0.06 0.00 -0.54 0.09 0.00 0.00 0.00 179.25 178.86 3afe n ASN 371 N -2.49 0.70 -4.61 0.00 5.03 -0.68 -4.78 115.26 108.43 3afe n ASN 371 Ca -0.01 -0.49 -0.45 0.00 0.87 0.00 0.00 54.58 54.50 3afe n ASN 371 Cb 0.11 0.35 -0.04 0.00 -1.02 0.00 0.00 39.78 39.18 3afe n ASN 371 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 3afe n ASP 372 N -1.33 3.34 -0.03 6.41 2.03 -0.83 -4.85 116.55 121.29 3afe n ASP 372 Ca 0.06 0.58 -0.11 0.00 0.52 0.00 0.00 54.79 55.84 3afe n ASP 372 Cb 0.34 -1.46 -0.06 0.00 -0.72 0.00 0.00 41.12 39.22 3afe n ASP 372 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3afe h PRO 373 N 12.26 0.21 -0.49 -0.67 0.11 -1.91 -3.25 132.00 138.27 3afe h PRO 373 Ca -0.43 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 65.70 3afe h PRO 373 Cb 1.26 -0.03 -0.06 0.00 0.11 0.00 0.00 31.00 32.28 3afe h PRO 373 CO 0.96 0.33 0.18 1.49 -0.21 0.00 0.00 178.00 180.75 3afe h GLU 374 N 0.05 0.34 -0.28 1.05 4.81 -1.99 -0.41 114.58 118.15 3afe h GLU 374 Ca 0.04 -0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 3afe h GLU 374 Cb 0.20 -0.08 -0.07 0.00 0.63 0.00 0.00 28.75 29.44 3afe h GLU 374 CO -0.00 0.23 -0.16 -0.09 -0.73 0.00 0.00 179.01 178.26 3afe h ARG 375 N 0.35 -0.12 -0.53 1.92 2.43 -1.97 -0.49 114.38 115.98 3afe h ARG 375 Ca 0.23 0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.29 3afe h ARG 375 Cb 0.24 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 3afe h ARG 375 CO -0.24 -0.08 -0.13 0.00 -1.51 0.00 0.00 179.97 178.02 3afe h ALA 376 N 1.08 0.76 -0.30 2.80 0.00 -1.38 -2.92 119.26 119.30 3afe h ALA 376 Ca 0.15 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 3afe h ALA 376 Cb 0.35 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3afe h ALA 376 CO -0.36 0.67 -0.20 1.88 0.00 0.00 0.00 179.25 181.24 3afe h TYR 377 N 0.90 0.61 -0.57 0.00 0.05 -0.58 -2.53 116.97 114.85 3afe h TYR 377 Ca 0.14 -0.12 -0.05 0.00 0.05 0.00 0.00 58.73 58.75 3afe h TYR 377 Cb 0.70 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 38.26 3afe h TYR 377 CO 0.05 0.72 0.16 0.28 -1.05 0.00 0.00 178.16 178.31 3afe h VAL 378 N 0.49 1.24 -0.29 -2.88 2.07 -1.02 0.53 116.25 116.40 3afe h VAL 378 Ca 0.08 -0.85 0.03 0.00 0.82 0.00 0.00 66.70 66.78 3afe h VAL 378 Cb 0.62 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 3afe h VAL 378 CO 0.04 0.32 0.11 0.40 0.02 0.00 0.00 177.57 178.46 3afe h ILE 379 N 0.81 0.94 -0.39 4.57 2.04 -1.32 0.39 117.51 124.55 3afe h ILE 379 Ca 0.18 -0.08 -0.13 0.00 1.00 0.00 0.00 64.86 65.82 3afe h ILE 379 Cb 0.31 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 3afe h ILE 379 CO -0.00 0.05 -0.29 0.15 0.00 0.00 0.00 178.15 178.06 3afe h PHE 380 N 0.25 0.98 -0.39 1.37 3.04 -1.24 -2.30 116.94 118.63 3afe h PHE 380 Ca 0.12 -0.25 -0.01 0.00 3.98 0.00 0.00 57.97 61.82 3afe h PHE 380 Cb 0.08 -0.22 -0.02 0.00 2.56 0.00 0.00 35.95 38.35 3afe h PHE 380 CO -0.12 1.02 0.22 0.78 -2.02 0.00 0.00 178.31 178.19 3afe h GLY 381 N 0.91 0.59 0.54 2.40 0.00 0.39 -1.85 103.07 106.05 3afe h GLY 381 Ca 0.08 -0.27 0.04 0.00 0.00 0.00 0.00 47.33 47.19 3afe h GLY 381 CO 0.07 0.25 -0.08 3.43 0.00 0.00 0.00 176.54 180.21 3afe h ASN 382 N 0.51 -0.28 -0.96 0.19 2.35 -0.11 -1.89 115.58 115.39 3afe h ASN 382 Ca 0.14 0.07 0.03 0.00 -0.55 0.00 0.00 56.30 55.99 3afe h ASN 382 Cb 0.05 0.16 -0.05 0.00 0.05 0.00 0.00 38.32 38.53 3afe h ASN 382 CO -0.02 -0.11 0.63 -0.74 -1.65 0.00 0.00 177.43 175.53 3afe h HIS 383 N -0.06 1.18 -0.06 1.19 2.76 -1.12 -1.37 115.15 117.66 3afe h HIS 383 Ca 0.10 0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.22 3afe h HIS 383 Cb 0.21 -0.39 -0.01 0.00 1.55 0.00 0.00 27.41 28.76 3afe h HIS 383 CO -0.24 0.70 -0.35 0.93 -1.30 0.00 0.00 177.93 177.67 3afe h GLU 384 N 1.23 0.12 -0.12 5.26 4.39 -1.10 -3.11 114.58 121.25 3afe h GLU 384 Ca 0.37 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 60.03 3afe h GLU 384 Cb -0.04 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.60 3afe h GLU 384 CO -0.11 0.46 0.00 1.19 -1.16 0.00 0.00 179.01 179.39 3afe n PHE 385 N -4.10 0.15 -2.03 4.33 0.99 -0.61 -4.91 117.46 111.28 3afe n PHE 385 Ca -0.02 -0.08 -0.02 0.00 -0.00 0.00 0.00 57.45 57.34 3afe n PHE 385 Cb 0.41 0.00 -0.00 0.00 -1.00 0.00 0.00 39.48 38.89 3afe n PHE 385 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3afe n GLY 386 N 1.08 0.28 3.85 1.37 0.00 -0.99 -5.05 105.19 105.73 3afe n GLY 386 Ca 0.16 -0.80 -0.29 0.00 0.00 0.00 0.00 46.02 45.10 3afe n GLY 386 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3afe s LEU 387 N -0.62 4.06 0.42 0.99 1.02 -0.65 -5.05 118.68 118.86 3afe s LEU 387 Ca 0.00 0.07 -0.26 0.00 0.02 0.00 0.00 54.13 53.96 3afe s LEU 387 Cb 0.00 -2.68 -0.09 0.00 0.02 0.00 0.00 46.19 43.44 3afe s LEU 387 CO 0.00 0.12 1.35 -2.16 0.02 0.00 0.00 176.35 175.68 3afe s PRO 388 N -2.77 3.87 0.63 1.29 0.04 -1.26 -4.39 135.00 132.40 3afe s PRO 388 Ca 0.32 2.26 -0.18 0.00 0.04 0.00 0.00 61.00 63.45 3afe s PRO 388 Cb -0.12 -2.73 -0.02 0.00 0.04 0.00 0.00 34.50 31.68 3afe s PRO 388 CO 0.25 -0.61 1.20 -2.14 0.04 0.00 0.00 177.00 175.74 3afe s PRO 389 N -2.31 2.80 0.00 0.56 0.02 -1.26 -4.93 135.00 129.87 3afe s PRO 389 Ca 0.58 1.77 0.00 0.00 0.02 0.00 0.00 61.00 63.37 3afe s PRO 389 Cb -0.40 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.20 3afe s PRO 389 CO 0.52 -1.33 0.00 0.41 -0.33 0.00 0.00 177.00 176.27 3afe n GLY 390 N 0.39 1.43 0.00 0.52 0.00 -1.26 -5.08 105.19 101.18 3afe n GLY 390 Ca 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3afe n GLY 390 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3afe n ASP 391 N 0.00 0.00 -0.10 1.61 -0.08 -1.26 -4.82 116.55 111.90 3afe n ASP 391 Ca 0.00 0.00 0.14 0.00 -1.51 0.00 0.00 54.79 53.42 3afe n ASP 391 Cb 0.00 0.00 0.67 0.00 2.34 0.00 0.00 41.12 44.13 3afe n ASP 391 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 3afe n THR 392 N 0.00 0.00 -1.04 5.18 -2.24 -1.26 -4.35 114.28 110.57 3afe n THR 392 Ca 0.00 -0.05 -0.25 0.00 -2.27 0.00 0.00 64.05 61.48 3afe n THR 392 Cb 0.00 -0.18 -0.07 0.00 -2.10 0.00 0.00 70.33 67.98 3afe n THR 392 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 3afe n MET 393 N -0.95 2.66 0.00 -0.78 0.00 -1.26 -4.83 117.12 111.96 3afe n MET 393 Ca 0.16 -1.55 0.00 0.00 0.00 0.00 0.00 57.70 56.31 3afe n MET 393 Cb 0.26 -2.40 0.00 0.00 0.00 0.00 0.00 33.22 31.08 3afe n MET 393 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 175.97 177.52