#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wcd n THR 9 N 0.00 0.66 0.19 -0.18 -1.04 -1.26 -4.61 114.28 108.04 2wcd n THR 9 Ca 0.00 -0.27 0.08 0.00 -2.04 0.00 0.00 64.05 61.81 2wcd n THR 9 Cb 0.00 -0.89 0.19 0.00 -1.82 0.00 0.00 70.33 67.81 2wcd n THR 9 CO 0.00 0.00 0.00 1.62 -0.64 0.00 0.00 175.07 176.05 2wcd h VAL 10 N 0.00 0.46 0.00 12.58 3.04 -2.06 -3.29 116.25 126.97 2wcd h VAL 10 Ca -0.26 -1.51 0.00 0.00 -1.01 0.00 0.00 66.70 63.92 2wcd h VAL 10 Cb 1.43 2.11 0.00 0.00 -2.01 0.00 0.00 31.29 32.82 2wcd h VAL 10 CO -0.03 0.25 0.19 -0.08 -1.01 0.00 0.00 177.57 176.89 2wcd h GLU 11 N 0.00 0.00 -0.15 4.17 4.81 -2.00 0.16 114.58 121.56 2wcd h GLU 11 Ca -0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 2wcd h GLU 11 Cb 1.09 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.47 2wcd h GLU 11 CO 0.03 0.00 -0.02 0.28 -0.73 0.00 0.00 179.01 178.58 2wcd h VAL 12 N 0.00 1.27 0.02 0.32 2.07 -1.89 -0.30 116.25 117.75 2wcd h VAL 12 Ca 0.00 -0.91 0.02 0.00 0.82 0.00 0.00 66.70 66.63 2wcd h VAL 12 Cb 0.38 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 2wcd h VAL 12 CO 0.00 0.27 -0.12 0.58 0.02 0.00 0.00 177.57 178.32 2wcd h VAL 13 N 0.00 0.70 0.04 2.57 2.07 -0.95 0.83 116.25 121.52 2wcd h VAL 13 Ca 0.04 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.59 2wcd h VAL 13 Cb 0.42 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 30.84 2wcd h VAL 13 CO 0.01 0.00 -0.43 0.50 0.02 0.00 0.00 177.57 177.67 2wcd h LYS 14 N -0.21 -0.59 -0.92 1.57 3.64 -1.47 0.58 116.57 119.17 2wcd h LYS 14 Ca 0.04 0.04 0.11 0.00 -1.27 0.00 0.00 60.65 59.57 2wcd h LYS 14 Cb 0.26 0.13 -0.07 0.00 -0.41 0.00 0.00 32.23 32.14 2wcd h LYS 14 CO -0.11 -0.40 0.59 -0.97 -2.27 0.00 0.00 179.45 176.30 2wcd h ASN 15 N -0.62 0.80 -0.21 4.20 -1.24 -0.83 -1.31 115.58 116.37 2wcd h ASN 15 Ca 0.03 0.03 -0.17 0.00 0.71 0.00 0.00 56.30 56.90 2wcd h ASN 15 Cb 0.67 -0.13 -0.00 0.00 0.73 0.00 0.00 38.32 39.59 2wcd h ASN 15 CO -0.30 0.45 -0.51 0.00 -1.29 0.00 0.00 177.43 175.78 2wcd h ALA 16 N 1.56 0.57 -0.37 1.57 0.00 0.03 -1.18 119.26 121.44 2wcd h ALA 16 Ca 0.44 -0.50 0.06 0.00 0.00 0.00 0.00 54.91 54.91 2wcd h ALA 16 Cb 0.49 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 2wcd h ALA 16 CO -0.20 0.68 0.04 0.97 0.00 0.00 0.00 179.25 180.74 2wcd h ILE 17 N 0.62 0.77 -0.26 0.00 6.09 0.12 0.15 117.51 125.01 2wcd h ILE 17 Ca 0.02 -0.05 -0.11 0.00 -1.37 0.00 0.00 64.86 63.35 2wcd h ILE 17 Cb 1.09 0.61 -0.01 0.00 0.47 0.00 0.00 36.82 38.97 2wcd h ILE 17 CO 0.11 0.03 -0.30 -0.33 -3.07 0.00 0.00 178.15 174.59 2wcd h GLU 18 N 0.15 0.52 -0.28 2.19 5.08 -1.19 -1.46 114.58 119.59 2wcd h GLU 18 Ca 0.18 -0.22 0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2wcd h GLU 18 Cb 0.23 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 2wcd h GLU 18 CO -0.27 0.76 0.13 1.15 -1.00 0.00 0.00 179.01 179.79 2wcd h THR 19 N 0.45 0.97 -0.27 1.13 2.02 -0.40 -2.49 112.91 114.33 2wcd h THR 19 Ca 0.06 -0.09 -0.04 0.00 0.77 0.00 0.00 66.41 67.11 2wcd h THR 19 Cb 0.74 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.81 2wcd h THR 19 CO 0.06 0.05 0.01 0.00 0.37 0.00 0.00 175.52 176.01 2wcd h ALA 20 N 1.15 1.52 0.36 6.16 0.00 -0.17 -1.52 119.26 126.76 2wcd h ALA 20 Ca 0.12 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2wcd h ALA 20 Cb 0.05 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2wcd h ALA 20 CO -0.09 0.35 -0.17 0.22 0.00 0.00 0.00 179.25 179.56 2wcd h ASP 21 N 0.39 -0.41 -0.03 0.00 1.82 -0.85 -2.24 116.42 115.10 2wcd h ASP 21 Ca 0.09 0.01 0.01 0.00 -0.39 0.00 0.00 57.03 56.75 2wcd h ASP 21 Cb 0.25 0.11 -0.00 0.00 0.68 0.00 0.00 39.33 40.36 2wcd h ASP 21 CO 0.01 -0.29 0.37 1.23 -1.61 0.00 0.00 179.24 178.95 2wcd h GLY 22 N -0.49 0.00 0.59 -0.78 0.00 -1.39 -0.91 103.07 100.08 2wcd h GLY 22 Ca -0.05 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 2wcd h GLY 22 CO 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 176.54 176.34 2wcd h ALA 23 N 1.28 -1.05 -0.86 3.60 0.00 -0.71 -2.12 119.26 119.39 2wcd h ALA 23 Ca 0.01 -0.17 0.11 0.00 0.00 0.00 0.00 54.91 54.86 2wcd h ALA 23 Cb 0.76 0.31 -0.13 0.00 0.00 0.00 0.00 17.79 18.73 2wcd h ALA 23 CO -0.00 -1.00 -0.47 -0.07 0.00 0.00 0.00 179.25 177.72 2wcd h LEU 24 N -0.90 -1.69 -0.35 0.00 3.38 -0.69 0.13 115.31 115.20 2wcd h LEU 24 Ca -0.08 0.30 0.04 0.00 0.09 0.00 0.00 57.88 58.22 2wcd h LEU 24 Cb 0.61 0.80 -0.06 0.00 0.09 0.00 0.00 40.66 42.09 2wcd h LEU 24 CO 0.13 -0.29 -0.37 0.44 0.09 0.00 0.00 178.44 178.45 2wcd h ASP 25 N -0.08 -1.26 -0.96 -0.43 5.19 -1.44 0.41 116.42 117.85 2wcd h ASP 25 Ca 0.23 0.17 0.13 0.00 -0.62 0.00 0.00 57.03 56.95 2wcd h ASP 25 Cb 0.53 0.52 -0.08 0.00 0.18 0.00 0.00 39.33 40.48 2wcd h ASP 25 CO -0.88 -0.24 0.61 0.25 -3.12 0.00 0.00 179.24 175.86 2wcd h LEU 26 N -0.21 0.83 0.28 1.55 5.85 -0.91 0.17 115.31 122.86 2wcd h LEU 26 Ca 0.06 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 2wcd h LEU 26 Cb 0.36 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 2wcd h LEU 26 CO -0.43 0.42 -0.42 0.22 -0.34 0.00 0.00 178.44 177.89 2wcd h TYR 27 N 0.88 -1.18 0.74 1.25 3.20 0.25 -0.64 116.97 121.47 2wcd h TYR 27 Ca 0.48 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.34 2wcd h TYR 27 Cb 0.59 0.48 0.01 0.00 1.54 0.00 0.00 36.73 39.34 2wcd h TYR 27 CO -0.00 -0.52 -0.35 -0.91 -1.64 0.00 0.00 178.16 174.74 2wcd h ASN 28 N -0.73 -0.84 -0.75 -2.11 -0.26 -0.53 0.43 115.58 110.80 2wcd h ASN 28 Ca -0.03 0.03 0.22 0.00 -0.56 0.00 0.00 56.30 55.95 2wcd h ASN 28 Cb 0.67 0.22 -0.14 0.00 -1.06 0.00 0.00 38.32 38.00 2wcd h ASN 28 CO -0.13 -0.60 0.05 1.17 -1.06 0.00 0.00 177.43 176.87 2wcd n LYS 29 N -5.52 -0.06 -0.01 0.81 4.81 0.57 0.10 118.16 118.87 2wcd n LYS 29 Ca -0.14 1.11 -0.17 0.00 -0.87 0.00 0.00 58.31 58.25 2wcd n LYS 29 Cb 0.40 -1.79 -0.13 0.00 0.02 0.00 0.00 35.03 33.53 2wcd n LYS 29 CO 0.00 0.00 0.00 -0.92 1.17 0.00 0.00 177.40 177.65 2wcd h TYR 30 N 0.00 0.30 -0.97 5.64 3.20 -0.84 -2.98 116.97 121.33 2wcd h TYR 30 Ca 0.47 -0.20 0.22 0.00 3.14 0.00 0.00 58.73 62.36 2wcd h TYR 30 Cb 1.00 -0.02 -0.08 0.00 1.54 0.00 0.00 36.73 39.17 2wcd h TYR 30 CO -0.35 1.10 0.62 1.25 -1.64 0.00 0.00 178.16 179.15 2wcd h LEU 31 N -0.58 0.50 -0.01 2.82 5.85 0.53 0.24 115.31 124.66 2wcd h LEU 31 Ca -0.06 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 2wcd h LEU 31 Cb 1.25 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.26 2wcd h LEU 31 CO 0.08 0.17 -0.01 0.44 -0.34 0.00 0.00 178.44 178.77 2wcd h ASP 32 N 0.48 0.02 -0.75 1.25 3.32 0.59 0.28 116.42 121.61 2wcd h ASP 32 Ca 0.53 -0.55 0.22 0.00 0.02 0.00 0.00 57.03 57.24 2wcd h ASP 32 Cb 1.21 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.73 2wcd h ASP 32 CO -0.25 0.57 0.54 1.56 -1.72 0.00 0.00 179.24 179.94 2wcd h GLN 33 N -0.53 0.00 0.16 3.56 4.20 -0.87 -2.02 115.11 119.62 2wcd h GLN 33 Ca 0.00 -0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.37 2wcd h GLN 33 Cb 0.57 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.35 2wcd h GLN 33 CO 0.00 0.00 -1.70 0.28 -0.67 0.00 0.00 178.83 176.75 2wcd h VAL 34 N 0.00 0.99 -3.52 -0.54 2.07 -0.37 -3.35 116.25 111.53 2wcd h VAL 34 Ca 0.36 -2.59 -0.64 0.00 0.82 0.00 0.00 66.70 64.64 2wcd h VAL 34 Cb 1.44 2.75 -0.40 0.00 -1.52 0.00 0.00 31.29 33.56 2wcd h VAL 34 CO -0.00 0.84 -0.70 -0.63 0.02 0.00 0.00 177.57 177.09 2wcd s ILE 35 N -2.59 2.17 -0.77 4.57 1.01 0.96 -4.54 121.20 122.02 2wcd s ILE 35 Ca -0.14 -2.52 -0.05 0.00 0.00 0.00 0.00 60.65 57.94 2wcd s ILE 35 Cb 0.06 -2.58 -0.06 0.00 0.01 0.00 0.00 42.46 39.89 2wcd s ILE 35 CO 0.85 -0.68 2.11 -2.65 0.00 0.00 0.00 174.94 174.58 2wcd n PRO 36 N 3.97 1.91 -0.10 2.79 -0.02 -1.22 -4.54 135.00 137.80 2wcd n PRO 36 Ca 0.04 -1.31 0.00 0.00 -2.02 0.00 0.00 63.50 60.21 2wcd n PRO 36 Cb 0.39 -2.34 0.28 0.00 -0.02 0.00 0.00 33.50 31.81 2wcd n PRO 36 CO 0.00 0.00 0.00 2.35 1.98 0.00 0.00 175.50 179.83 2wcd h TRP 37 N 6.05 0.74 0.21 6.00 2.91 -1.94 0.19 115.95 130.11 2wcd h TRP 37 Ca 0.43 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.43 2wcd h TRP 37 Cb 0.25 -0.23 -0.04 0.00 -0.51 0.00 0.00 29.16 28.63 2wcd h TRP 37 CO 1.88 0.55 -0.49 0.37 -1.03 0.00 0.00 178.44 179.72 2wcd h GLN 38 N 0.75 -0.75 -0.92 2.65 5.75 -1.93 0.43 115.11 121.10 2wcd h GLN 38 Ca 0.19 0.05 0.01 0.00 -0.15 0.00 0.00 58.65 58.75 2wcd h GLN 38 Cb 0.09 0.17 -0.05 0.00 1.07 0.00 0.00 27.48 28.76 2wcd h GLN 38 CO -0.02 -0.50 0.61 1.15 -2.65 0.00 0.00 178.83 177.41 2wcd h THR 39 N -0.77 1.22 0.49 2.39 2.02 -1.79 0.27 112.91 116.74 2wcd h THR 39 Ca -0.02 -0.42 -0.02 0.00 0.77 0.00 0.00 66.41 66.71 2wcd h THR 39 Cb 0.74 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.04 2wcd h THR 39 CO -0.21 0.22 -0.23 0.15 0.37 0.00 0.00 175.52 175.82 2wcd h PHE 40 N 1.23 -0.61 -0.06 3.16 3.57 -0.34 0.02 116.94 123.91 2wcd h PHE 40 Ca 0.34 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.86 2wcd h PHE 40 Cb -0.12 0.20 -0.05 0.00 2.79 0.00 0.00 35.95 38.78 2wcd h PHE 40 CO -0.01 -0.33 -0.23 0.22 -2.23 0.00 0.00 178.31 175.74 2wcd h ASP 41 N -0.77 -0.69 -0.47 0.41 1.82 0.04 -0.75 116.42 116.01 2wcd h ASP 41 Ca -0.07 0.10 0.09 0.00 -0.39 0.00 0.00 57.03 56.77 2wcd h ASP 41 Cb 0.56 0.30 -0.09 0.00 0.68 0.00 0.00 39.33 40.78 2wcd h ASP 41 CO 0.11 -0.29 -0.12 -0.33 -1.61 0.00 0.00 179.24 177.00 2wcd h GLU 42 N -0.33 -0.00 -0.61 0.28 5.08 -0.91 -0.49 114.58 117.60 2wcd h GLU 42 Ca 0.08 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.46 2wcd h GLU 42 Cb 0.44 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 2wcd h GLU 42 CO -0.25 -0.00 0.41 0.00 -1.00 0.00 0.00 179.01 178.17 2wcd h THR 43 N -0.00 1.12 0.00 1.13 1.03 -0.39 -2.15 112.91 113.64 2wcd h THR 43 Ca 0.22 -0.27 -0.00 0.00 -0.01 0.00 0.00 66.41 66.36 2wcd h THR 43 Cb 0.34 0.27 0.00 0.00 -1.07 0.00 0.00 68.15 67.69 2wcd h THR 43 CO -0.48 0.14 -0.00 0.40 -0.01 0.00 0.00 175.52 175.57 2wcd h ILE 44 N 0.78 1.21 0.32 0.00 1.08 0.35 -3.17 117.51 118.07 2wcd h ILE 44 Ca 0.24 -0.61 -0.01 0.00 -0.39 0.00 0.00 64.86 64.09 2wcd h ILE 44 Cb -0.01 1.62 -0.02 0.00 -3.07 0.00 0.00 36.82 35.35 2wcd h ILE 44 CO -0.06 0.16 -0.39 0.11 -0.69 0.00 0.00 178.15 177.28 2wcd h LYS 45 N -0.26 -0.70 -0.97 2.37 1.57 -0.62 -0.50 116.57 117.46 2wcd h LYS 45 Ca -0.00 0.05 0.22 0.00 -1.87 0.00 0.00 60.65 59.05 2wcd h LYS 45 Cb 0.26 0.16 -0.08 0.00 0.08 0.00 0.00 32.23 32.65 2wcd h LYS 45 CO 0.00 -0.47 0.62 1.49 -0.57 0.00 0.00 179.45 180.53 2wcd h GLU 46 N -0.73 0.47 -0.00 3.15 4.81 -1.53 1.00 114.58 121.75 2wcd h GLU 46 Ca -0.04 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 2wcd h GLU 46 Cb 0.65 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.92 2wcd h GLU 46 CO -0.09 0.31 -0.26 1.47 -0.73 0.00 0.00 179.01 179.72 2wcd n LEU 47 N -4.59 0.72 0.05 1.64 -0.00 -1.13 -2.40 117.00 111.30 2wcd n LEU 47 Ca 0.22 -0.10 -0.20 0.00 -0.00 0.00 0.00 56.01 55.93 2wcd n LEU 47 Cb 0.72 -0.18 -0.15 0.00 -0.00 0.00 0.00 43.42 43.81 2wcd n LEU 47 CO 0.27 0.14 0.02 -1.28 -0.00 0.00 0.00 177.39 176.54 2wcd h SER 48 N 0.73 0.48 -0.72 1.45 0.87 0.25 -3.22 113.55 113.39 2wcd h SER 48 Ca 0.00 -0.95 0.15 0.00 -1.23 0.00 0.00 61.79 59.76 2wcd h SER 48 Cb 0.47 -0.16 -0.10 0.00 -0.44 0.00 0.00 62.40 62.17 2wcd h SER 48 CO 0.00 1.42 0.21 -0.09 -0.53 0.00 0.00 176.83 177.84 2wcd h ARG 49 N -0.35 0.31 -0.01 2.24 2.43 -0.29 0.13 114.38 118.85 2wcd h ARG 49 Ca -0.15 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.01 2wcd h ARG 49 Cb 1.67 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 31.11 2wcd h ARG 49 CO 0.15 0.21 -0.43 0.35 -1.51 0.00 0.00 179.97 178.74 2wcd h PHE 50 N 0.32 -1.27 -1.01 2.20 3.57 -1.55 0.23 116.94 119.44 2wcd h PHE 50 Ca 0.40 0.04 0.25 0.00 3.53 0.00 0.00 57.97 62.18 2wcd h PHE 50 Cb 0.64 0.55 -0.09 0.00 2.79 0.00 0.00 35.95 39.84 2wcd h PHE 50 CO -0.23 -0.46 0.65 -0.22 -2.23 0.00 0.00 178.31 175.82 2wcd h LYS 51 N -0.54 0.42 0.00 1.11 3.64 -1.41 -2.84 116.57 116.96 2wcd h LYS 51 Ca 0.01 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2wcd h LYS 51 Cb 0.58 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 2wcd h LYS 51 CO -0.29 0.28 0.00 0.94 -2.27 0.00 0.00 179.45 178.11 2wcd n GLN 52 N -4.61 0.00 -0.34 1.90 -0.06 -0.03 -2.32 117.38 111.93 2wcd n GLN 52 Ca 0.24 0.40 0.15 0.00 -2.00 0.00 0.00 57.00 55.79 2wcd n GLN 52 Cb 0.81 -1.16 0.30 0.00 -4.06 0.00 0.00 30.24 26.13 2wcd n GLN 52 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 2wcd h GLU 53 N 0.00 0.02 -0.26 3.69 5.08 -0.58 0.26 114.58 122.79 2wcd h GLU 53 Ca 0.00 -0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.23 2wcd h GLU 53 Cb 0.00 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 2wcd h GLU 53 CO 0.00 0.01 -0.33 1.88 -1.00 0.00 0.00 179.01 179.57 2wcd h TYR 54 N 0.02 0.83 -0.45 4.33 0.05 -1.64 -1.95 116.97 118.16 2wcd h TYR 54 Ca 0.60 -0.27 0.07 0.00 0.05 0.00 0.00 58.73 59.18 2wcd h TYR 54 Cb 1.26 -0.17 -0.09 0.00 1.01 0.00 0.00 36.73 38.74 2wcd h TYR 54 CO -0.47 1.02 -0.48 1.03 -1.05 0.00 0.00 178.16 178.20 2wcd h SER 55 N 0.40 -1.62 -0.51 3.88 0.87 -0.16 0.62 113.55 117.04 2wcd h SER 55 Ca 0.03 0.23 0.05 0.00 -1.23 0.00 0.00 61.79 60.87 2wcd h SER 55 Cb 0.91 0.69 -0.07 0.00 -0.44 0.00 0.00 62.40 63.49 2wcd h SER 55 CO 0.08 -0.38 -0.37 -0.61 -0.53 0.00 0.00 176.83 175.03 2wcd h GLN 56 N -0.33 -0.08 0.07 2.24 5.75 -0.92 0.17 115.11 122.00 2wcd h GLN 56 Ca 0.12 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.63 2wcd h GLN 56 Cb 0.59 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.14 2wcd h GLN 56 CO -0.61 -0.05 -0.14 0.00 -2.65 0.00 0.00 178.83 175.38 2wcd h ALA 57 N -0.20 -0.74 -0.72 3.38 0.00 -0.68 -2.00 119.26 118.30 2wcd h ALA 57 Ca 0.08 -0.04 0.16 0.00 0.00 0.00 0.00 54.91 55.11 2wcd h ALA 57 Cb 0.30 0.50 -0.13 0.00 0.00 0.00 0.00 17.79 18.46 2wcd h ALA 57 CO -0.52 -0.76 -0.05 0.00 0.00 0.00 0.00 179.25 177.91 2wcd h ALA 58 N -1.38 0.66 -0.05 0.00 0.00 -0.76 -0.64 119.26 117.09 2wcd h ALA 58 Ca -0.01 0.24 0.01 0.00 0.00 0.00 0.00 54.91 55.16 2wcd h ALA 58 Cb 0.21 0.44 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 2wcd h ALA 58 CO -0.05 -0.42 -0.21 0.77 0.00 0.00 0.00 179.25 179.33 2wcd h SER 59 N 0.07 -0.68 -0.95 0.00 0.02 -0.38 0.35 113.55 111.99 2wcd h SER 59 Ca 0.38 0.08 0.10 0.00 -0.84 0.00 0.00 61.79 61.50 2wcd h SER 59 Cb 0.64 0.27 -0.07 0.00 0.14 0.00 0.00 62.40 63.37 2wcd h SER 59 CO -0.66 -0.19 0.61 1.62 -1.14 0.00 0.00 176.83 177.06 2wcd h VAL 60 N -0.23 0.98 0.57 2.27 3.04 -0.61 -0.27 116.25 121.99 2wcd h VAL 60 Ca 0.01 -0.34 -0.03 0.00 -1.01 0.00 0.00 66.70 65.34 2wcd h VAL 60 Cb 0.27 -0.08 0.01 0.00 -2.01 0.00 0.00 31.29 29.47 2wcd h VAL 60 CO -0.17 0.18 -0.27 0.25 -1.01 0.00 0.00 177.57 176.55 2wcd h LEU 61 N 0.98 -0.64 -1.99 3.16 5.85 -0.76 -1.33 115.31 120.57 2wcd h LEU 61 Ca 0.44 -0.03 0.30 0.00 0.84 0.00 0.00 57.88 59.43 2wcd h LEU 61 Cb 0.38 0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 2wcd h LEU 61 CO -0.20 -0.26 0.75 0.58 -0.34 0.00 0.00 178.44 178.97 2wcd h VAL 62 N -1.11 0.47 -0.02 1.05 2.07 -0.08 0.17 116.25 118.79 2wcd h VAL 62 Ca -0.08 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 2wcd h VAL 62 Cb 0.63 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 2wcd h VAL 62 CO 0.13 0.00 -0.08 1.23 0.02 0.00 0.00 177.57 178.87 2wcd h GLY 63 N 0.00 0.11 0.57 2.17 0.00 -0.85 -2.76 103.07 102.30 2wcd h GLY 63 Ca 0.49 -0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.73 2wcd h GLY 63 CO -0.01 0.12 0.07 -0.55 0.00 0.00 0.00 176.54 176.18 2wcd h ASP 64 N -0.50 0.01 -0.88 0.19 3.32 0.24 -1.06 116.42 117.75 2wcd h ASP 64 Ca -0.00 0.06 0.20 0.00 0.02 0.00 0.00 57.03 57.30 2wcd h ASP 64 Cb 0.72 0.08 -0.11 0.00 0.22 0.00 0.00 39.33 40.23 2wcd h ASP 64 CO 0.02 0.04 0.40 0.40 -1.72 0.00 0.00 179.24 178.38 2wcd h ILE 65 N 0.20 0.55 0.47 0.35 1.08 -0.82 0.20 117.51 119.55 2wcd h ILE 65 Ca 0.17 -0.16 -0.02 0.00 -0.39 0.00 0.00 64.86 64.46 2wcd h ILE 65 Cb 0.20 0.05 0.00 0.00 -3.07 0.00 0.00 36.82 34.00 2wcd h ILE 65 CO -0.23 0.08 -0.23 0.50 -0.69 0.00 0.00 178.15 177.59 2wcd h LYS 66 N 0.46 -0.61 -0.89 2.37 3.64 -0.92 0.23 116.57 120.84 2wcd h LYS 66 Ca 0.53 0.04 0.12 0.00 -1.27 0.00 0.00 60.65 60.07 2wcd h LYS 66 Cb 0.93 0.14 -0.14 0.00 -0.41 0.00 0.00 32.23 32.75 2wcd h LYS 66 CO -0.48 -0.33 -0.45 1.15 -2.27 0.00 0.00 179.45 177.06 2wcd h THR 67 N -0.81 0.02 -0.47 1.00 2.02 -0.44 0.38 112.91 114.62 2wcd h THR 67 Ca -0.07 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.19 2wcd h THR 67 Cb 0.56 0.02 -0.07 0.00 -1.74 0.00 0.00 68.15 66.93 2wcd h THR 67 CO 0.11 0.00 0.09 -0.07 0.37 0.00 0.00 175.52 176.01 2wcd h LEU 68 N -0.06 -0.01 0.13 2.58 4.07 -0.23 0.42 115.31 122.21 2wcd h LEU 68 Ca 0.26 0.09 0.01 0.00 0.08 0.00 0.00 57.88 58.31 2wcd h LEU 68 Cb 0.54 0.12 -0.02 0.00 1.08 0.00 0.00 40.66 42.38 2wcd h LEU 68 CO -0.90 0.02 -0.16 -0.07 -1.08 0.00 0.00 178.44 176.25 2wcd h LEU 69 N 0.22 -0.43 -0.89 1.67 3.38 0.13 -1.24 115.31 118.15 2wcd h LEU 69 Ca 0.23 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.30 2wcd h LEU 69 Cb 0.31 0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.16 2wcd h LEU 69 CO -0.31 -0.24 0.56 0.24 0.09 0.00 0.00 178.44 178.78 2wcd h MET 70 N -0.33 1.03 -0.13 1.13 2.86 0.40 -1.72 114.93 118.17 2wcd h MET 70 Ca 0.01 -0.06 0.04 0.00 -2.06 0.00 0.00 59.70 57.64 2wcd h MET 70 Cb 0.33 -0.23 -0.05 0.00 0.06 0.00 0.00 31.60 31.71 2wcd h MET 70 CO -0.06 0.68 -0.19 -0.44 1.06 0.00 0.00 176.91 177.96 2wcd h ASP 71 N 1.07 -0.59 0.18 1.22 3.32 0.18 -2.65 116.42 119.14 2wcd h ASP 71 Ca 0.37 0.10 0.01 0.00 0.02 0.00 0.00 57.03 57.53 2wcd h ASP 71 Cb 0.08 0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.86 2wcd h ASP 71 CO -0.14 -0.24 -0.47 -1.28 -1.72 0.00 0.00 179.24 175.39 2wcd h SER 72 N -0.24 -1.38 -0.98 6.45 0.87 -0.65 -2.00 113.55 115.61 2wcd h SER 72 Ca 0.10 0.14 0.13 0.00 -1.23 0.00 0.00 61.79 60.93 2wcd h SER 72 Cb 0.39 0.51 -0.15 0.00 -0.44 0.00 0.00 62.40 62.71 2wcd h SER 72 CO -0.27 -0.54 -0.46 -0.61 -0.53 0.00 0.00 176.83 174.42 2wcd h GLN 73 N -0.75 -0.01 -0.53 2.24 5.75 -1.08 0.85 115.11 121.58 2wcd h GLN 73 Ca -0.00 0.00 0.06 0.00 -0.15 0.00 0.00 58.65 58.55 2wcd h GLN 73 Cb 0.74 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.24 2wcd h GLN 73 CO -0.23 -0.01 0.25 -0.44 -2.65 0.00 0.00 178.83 175.75 2wcd h ASP 74 N -0.01 0.33 0.11 -0.69 3.45 -1.31 0.53 116.42 118.84 2wcd h ASP 74 Ca 0.28 0.04 -0.04 0.00 0.43 0.00 0.00 57.03 57.73 2wcd h ASP 74 Cb 0.53 -0.02 -0.01 0.00 -0.56 0.00 0.00 39.33 39.28 2wcd h ASP 74 CO -0.96 0.23 -0.16 0.11 -1.57 0.00 0.00 179.24 176.88 2wcd h LYS 75 N 0.48 0.11 0.32 3.56 1.57 0.12 -0.85 116.57 121.88 2wcd h LYS 75 Ca 0.24 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.98 2wcd h LYS 75 Cb 0.19 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.48 2wcd h LYS 75 CO -0.19 0.28 -0.15 -0.92 -0.57 0.00 0.00 179.45 177.90 2wcd h TYR 76 N 0.11 -0.40 -0.41 -1.35 3.20 0.98 -1.91 116.97 117.18 2wcd h TYR 76 Ca 0.02 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.93 2wcd h TYR 76 Cb 0.36 0.13 -0.08 0.00 1.54 0.00 0.00 36.73 38.68 2wcd h TYR 76 CO 0.00 -0.09 -0.53 0.35 -1.64 0.00 0.00 178.16 176.25 2wcd h PHE 77 N -0.73 -1.64 -0.30 -3.82 3.57 -0.43 0.13 116.94 113.73 2wcd h PHE 77 Ca -0.04 0.08 0.03 0.00 3.53 0.00 0.00 57.97 61.57 2wcd h PHE 77 Cb 0.49 0.77 -0.04 0.00 2.79 0.00 0.00 35.95 39.96 2wcd h PHE 77 CO 0.01 -0.46 -0.24 1.49 -2.23 0.00 0.00 178.31 176.88 2wcd h GLU 78 N -0.36 -0.08 -0.41 1.11 4.81 -1.24 0.41 114.58 118.82 2wcd h GLU 78 Ca 0.07 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.36 2wcd h GLU 78 Cb 0.56 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.88 2wcd h GLU 78 CO -0.58 -0.05 -0.54 0.00 -0.73 0.00 0.00 179.01 177.11 2wcd h ALA 79 N -0.57 -0.76 -0.23 2.92 0.00 -0.48 0.39 119.26 120.53 2wcd h ALA 79 Ca 0.05 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.99 2wcd h ALA 79 Cb 0.21 1.12 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 2wcd h ALA 79 CO -0.32 -1.02 0.07 1.79 0.00 0.00 0.00 179.25 179.77 2wcd h THR 80 N -0.37 0.93 0.13 0.00 1.35 -0.55 -1.82 112.91 112.59 2wcd h THR 80 Ca 0.07 -0.06 0.01 0.00 -0.55 0.00 0.00 66.41 65.88 2wcd h THR 80 Cb 0.56 0.74 -0.02 0.00 -1.73 0.00 0.00 68.15 67.71 2wcd h THR 80 CO -0.58 0.03 -0.16 -0.61 -0.25 0.00 0.00 175.52 173.95 2wcd h GLN 81 N 0.17 -0.31 -0.79 4.72 -0.00 0.80 0.21 115.11 119.92 2wcd h GLN 81 Ca 0.10 0.02 0.15 0.00 -0.00 0.00 0.00 58.65 58.92 2wcd h GLN 81 Cb 0.08 0.07 -0.14 0.00 0.00 0.00 0.00 27.48 27.48 2wcd h GLN 81 CO -0.11 -0.21 -0.27 1.15 0.00 0.00 0.00 178.83 179.38 2wcd h THR 82 N -0.33 0.15 0.82 2.39 2.02 -0.05 -0.12 112.91 117.79 2wcd h THR 82 Ca 0.01 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.15 2wcd h THR 82 Cb 0.33 0.15 0.01 0.00 -1.74 0.00 0.00 68.15 66.89 2wcd h THR 82 CO -0.06 0.00 -0.39 0.58 0.37 0.00 0.00 175.52 176.01 2wcd h VAL 83 N -0.05 0.18 -1.40 3.16 2.07 -0.41 -2.61 116.25 117.19 2wcd h VAL 83 Ca 0.34 -0.03 0.41 0.00 0.82 0.00 0.00 66.70 68.24 2wcd h VAL 83 Cb 0.58 0.19 -0.07 0.00 -1.52 0.00 0.00 31.29 30.47 2wcd h VAL 83 CO -0.82 0.00 0.99 0.22 0.02 0.00 0.00 177.57 177.98 2wcd h TYR 84 N -1.12 0.15 0.22 1.57 3.20 0.20 0.53 116.97 121.71 2wcd h TYR 84 Ca -0.11 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.75 2wcd h TYR 84 Cb 0.85 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.08 2wcd h TYR 84 CO -0.01 -0.02 -0.11 0.93 -1.64 0.00 0.00 178.16 177.31 2wcd h GLU 85 N 0.06 -0.29 -0.02 1.82 5.08 -0.75 -3.09 114.58 117.38 2wcd h GLU 85 Ca 0.70 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 59.08 2wcd h GLU 85 Cb 2.63 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 31.95 2wcd h GLU 85 CO -0.10 0.09 0.00 2.35 -1.00 0.00 0.00 179.01 180.36 2wcd h TRP 86 N -0.86 0.04 0.00 4.33 7.01 -0.73 -2.07 115.95 123.67 2wcd h TRP 86 Ca -0.03 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.96 2wcd h TRP 86 Cb 0.51 -0.01 0.00 0.00 -2.10 0.00 0.00 29.16 27.56 2wcd h TRP 86 CO 0.06 0.32 0.30 0.00 -2.79 0.00 0.00 178.44 176.33 2wcd n GLY 88 N -1.28 -0.43 0.24 0.00 0.00 -0.83 -3.39 105.19 99.50 2wcd n GLY 88 Ca -0.01 -0.15 -0.06 0.00 0.00 0.00 0.00 46.02 45.80 2wcd n GLY 88 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2wcd h VAL 89 N -0.72 1.15 -0.32 1.61 3.04 -0.81 -3.17 116.25 117.04 2wcd h VAL 89 Ca -0.67 -0.30 0.07 0.00 -1.01 0.00 0.00 66.70 64.79 2wcd h VAL 89 Cb 1.70 0.32 -0.08 0.00 -2.01 0.00 0.00 31.29 31.21 2wcd h VAL 89 CO -0.33 0.15 -0.30 0.00 -1.01 0.00 0.00 177.57 176.08 2wcd h ALA 90 N 1.20 -0.18 -0.57 3.17 0.00 -1.01 -2.30 119.26 119.57 2wcd h ALA 90 Ca 0.21 0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.29 2wcd h ALA 90 Cb -0.07 0.63 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 2wcd h ALA 90 CO -0.04 -0.72 0.23 1.15 0.00 0.00 0.00 179.25 179.87 2wcd h THR 91 N -0.27 0.82 -0.70 0.00 2.02 -1.56 0.16 112.91 113.38 2wcd h THR 91 Ca 0.15 -0.15 0.12 0.00 0.77 0.00 0.00 66.41 67.31 2wcd h THR 91 Cb 0.52 0.36 -0.08 0.00 -1.74 0.00 0.00 68.15 67.21 2wcd h THR 91 CO -0.47 0.08 0.28 1.56 0.37 0.00 0.00 175.52 177.34 2wcd h GLN 92 N 0.42 0.44 -0.06 6.66 4.20 -1.46 -0.14 115.11 125.17 2wcd h GLN 92 Ca 0.28 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.92 2wcd h GLN 92 Cb 0.30 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.98 2wcd h GLN 92 CO -0.26 0.29 -0.13 -0.07 -0.67 0.00 0.00 178.83 177.99 2wcd h LEU 93 N 0.45 0.22 -1.10 1.46 3.38 -0.36 -0.22 115.31 119.14 2wcd h LEU 93 Ca 0.37 -0.57 0.08 0.00 0.09 0.00 0.00 57.88 57.85 2wcd h LEU 93 Cb 0.50 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.12 2wcd h LEU 93 CO -0.35 0.74 0.61 -0.07 0.09 0.00 0.00 178.44 179.46 2wcd h LEU 94 N -0.30 0.93 -0.45 1.67 -0.00 -0.78 0.18 115.31 116.56 2wcd h LEU 94 Ca 0.00 0.02 -0.04 0.00 -0.00 0.00 0.00 57.88 57.86 2wcd h LEU 94 Cb 0.71 -0.18 -0.02 0.00 -0.00 0.00 0.00 40.66 41.17 2wcd h LEU 94 CO 0.03 0.58 0.14 0.00 -0.00 0.00 0.00 178.44 179.18 2wcd h ALA 95 N 1.50 0.58 -0.15 1.53 0.00 -0.82 0.06 119.26 121.97 2wcd h ALA 95 Ca 0.42 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 2wcd h ALA 95 Cb 0.26 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2wcd h ALA 95 CO -0.17 0.24 0.08 0.00 0.00 0.00 0.00 179.25 179.39 2wcd h ALA 96 N 0.99 0.19 -0.53 0.00 0.00 -0.37 -1.65 119.26 117.89 2wcd h ALA 96 Ca 0.14 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.05 2wcd h ALA 96 Cb 0.27 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 2wcd h ALA 96 CO -0.00 -0.25 0.21 -0.92 0.00 0.00 0.00 179.25 178.28 2wcd h TYR 97 N 0.13 0.36 -0.38 0.00 3.20 -0.32 0.39 116.97 120.35 2wcd h TYR 97 Ca 0.05 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2wcd h TYR 97 Cb 0.10 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 2wcd h TYR 97 CO -0.03 0.13 0.24 0.82 -1.64 0.00 0.00 178.16 177.67 2wcd h ILE 98 N 0.40 1.10 0.00 1.81 1.08 -0.79 -2.69 117.51 118.42 2wcd h ILE 98 Ca 0.25 -0.21 -0.00 0.00 -0.39 0.00 0.00 64.86 64.51 2wcd h ILE 98 Cb 0.26 0.56 0.00 0.00 -3.07 0.00 0.00 36.82 34.57 2wcd h ILE 98 CO -0.24 0.10 -0.00 0.25 -0.69 0.00 0.00 178.15 177.57 2wcd h LEU 99 N 0.52 -0.00 -2.17 1.44 5.85 -0.06 -3.30 115.31 117.58 2wcd h LEU 99 Ca 0.14 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.49 2wcd h LEU 99 Cb -0.04 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.99 2wcd h LEU 99 CO -0.03 0.68 0.00 -0.07 -0.34 0.00 0.00 178.44 178.68 2wcd h LEU 100 N -1.00 0.00 -3.75 2.25 3.38 -0.33 -2.42 115.31 113.43 2wcd h LEU 100 Ca -0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 2wcd h LEU 100 Cb 0.37 0.00 -0.38 0.00 0.09 0.00 0.00 40.66 40.74 2wcd h LEU 100 CO 0.00 0.00 -0.51 0.49 0.09 0.00 0.00 178.44 178.51 2wcd n PHE 101 N -2.83 2.69 0.51 1.13 3.72 -1.02 -4.31 117.46 117.35 2wcd n PHE 101 Ca -0.02 -2.31 -0.21 0.00 -0.05 0.00 0.00 57.45 54.87 2wcd n PHE 101 Cb 0.12 -0.52 -0.10 0.00 -0.94 0.00 0.00 39.48 38.04 2wcd n PHE 101 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 2wcd h ASP 102 N 2.08 -1.14 -3.28 4.37 3.58 -1.51 -3.40 116.42 117.12 2wcd h ASP 102 Ca 0.39 0.04 -0.65 0.00 0.42 0.00 0.00 57.03 57.24 2wcd h ASP 102 Cb 1.41 0.30 -0.17 0.00 1.72 0.00 0.00 39.33 42.59 2wcd h ASP 102 CO 0.86 -0.79 -0.61 -1.61 -2.88 0.00 0.00 179.24 174.20 2wcd s GLU 103 N -5.99 3.49 -0.10 0.28 2.02 -1.26 -5.05 118.70 112.09 2wcd s GLU 103 Ca -0.20 -0.41 -0.39 0.00 0.02 0.00 0.00 54.97 53.99 2wcd s GLU 103 Cb 0.02 -2.96 -0.17 0.00 0.10 0.00 0.00 34.13 31.13 2wcd s GLU 103 CO 0.60 0.45 1.51 0.98 0.02 0.00 0.00 175.26 178.83 2wcd n TYR 104 N 2.93 1.72 -3.36 1.61 9.36 -1.26 -4.92 117.16 123.24 2wcd n TYR 104 Ca -0.18 0.63 -0.45 0.00 3.32 0.00 0.00 57.90 61.23 2wcd n TYR 104 Cb 0.53 -2.37 -0.06 0.00 -0.63 0.00 0.00 39.34 36.80 2wcd n TYR 104 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 2wcd s ASN 105 N 1.90 6.12 0.46 2.98 3.84 -1.26 -4.95 114.94 124.02 2wcd s ASN 105 Ca 0.92 -1.66 0.13 0.00 0.21 0.00 0.00 52.86 52.46 2wcd s ASN 105 Cb -1.04 -2.18 1.04 0.00 -0.55 0.00 0.00 41.25 38.52 2wcd s ASN 105 CO 0.57 -0.77 2.04 -0.08 -2.79 0.00 0.00 177.10 176.07 2wcd h GLU 106 N 8.80 0.12 0.00 0.43 4.81 -1.96 -1.59 114.58 125.18 2wcd h GLU 106 Ca -0.29 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 58.88 2wcd h GLU 106 Cb 1.10 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 2wcd h GLU 106 CO 0.97 0.18 -0.28 0.87 -0.73 0.00 0.00 179.01 180.02 2wcd h LYS 107 N 0.12 0.00 0.00 1.92 1.79 -2.02 -3.25 116.57 115.12 2wcd h LYS 107 Ca 0.03 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2wcd h LYS 107 Cb 0.17 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 2wcd h LYS 107 CO 0.01 1.00 0.00 1.63 -1.08 0.00 0.00 179.45 181.01 2wcd n LYS 108 N -4.57 0.29 -0.15 3.15 5.02 -1.19 -3.95 118.16 116.76 2wcd n LYS 108 Ca -0.15 0.09 -0.03 0.00 -2.02 0.00 0.00 58.31 56.20 2wcd n LYS 108 Cb 0.53 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 34.10 2wcd n LYS 108 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wcd h ALA 109 N 3.00 0.52 -0.51 7.82 0.00 -1.32 0.49 119.26 129.26 2wcd h ALA 109 Ca 0.00 0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2wcd h ALA 109 Cb 0.21 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2wcd h ALA 109 CO 0.00 -0.33 0.04 0.66 0.00 0.00 0.00 179.25 179.62 2wcd h SER 110 N 0.21 0.86 0.57 0.00 4.64 -1.80 -2.60 113.55 115.42 2wcd h SER 110 Ca 0.24 -0.29 -0.03 0.00 -0.47 0.00 0.00 61.79 61.25 2wcd h SER 110 Cb 0.33 -0.23 0.01 0.00 -0.31 0.00 0.00 62.40 62.19 2wcd h SER 110 CO -0.33 0.93 -0.27 0.00 -0.87 0.00 0.00 176.83 176.29 2wcd h ALA 111 N 0.96 -0.77 -0.96 5.18 0.00 -1.66 -2.24 119.26 119.77 2wcd h ALA 111 Ca 0.15 -0.20 0.30 0.00 0.00 0.00 0.00 54.91 55.17 2wcd h ALA 111 Cb 0.47 0.30 -0.16 0.00 0.00 0.00 0.00 17.79 18.40 2wcd h ALA 111 CO 0.02 -0.85 0.31 0.37 0.00 0.00 0.00 179.25 179.11 2wcd h GLN 112 N -0.93 0.13 0.43 0.00 5.75 -0.90 0.82 115.11 120.41 2wcd h GLN 112 Ca -0.08 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.39 2wcd h GLN 112 Cb 0.64 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.17 2wcd h GLN 112 CO 0.13 0.09 -0.21 -0.22 -2.65 0.00 0.00 178.83 175.97 2wcd h LYS 113 N 0.13 -0.56 -0.49 1.69 3.11 -1.32 0.20 116.57 119.34 2wcd h LYS 113 Ca 0.66 0.04 0.08 0.00 -2.81 0.00 0.00 60.65 58.62 2wcd h LYS 113 Cb 1.50 0.13 -0.07 0.00 -1.00 0.00 0.00 32.23 32.79 2wcd h LYS 113 CO -0.74 -0.29 0.10 -0.44 -2.81 0.00 0.00 179.45 175.27 2wcd h ASP 114 N -0.73 0.01 0.61 4.20 5.19 0.24 -0.96 116.42 124.98 2wcd h ASP 114 Ca -0.06 0.08 -0.02 0.00 -0.62 0.00 0.00 57.03 56.41 2wcd h ASP 114 Cb 0.52 0.11 -0.01 0.00 0.18 0.00 0.00 39.33 40.13 2wcd h ASP 114 CO 0.10 0.04 -0.44 0.40 -3.12 0.00 0.00 179.24 176.21 2wcd h ILE 115 N 0.24 0.11 -0.99 0.35 2.04 0.57 -0.74 117.51 119.09 2wcd h ILE 115 Ca 0.24 0.00 0.31 0.00 1.00 0.00 0.00 64.86 66.41 2wcd h ILE 115 Cb 0.32 0.11 -0.15 0.00 -0.74 0.00 0.00 36.82 36.37 2wcd h ILE 115 CO -0.31 0.00 0.55 -0.07 0.00 0.00 0.00 178.15 178.32 2wcd h LEU 116 N -1.01 0.51 0.75 1.44 3.38 -0.16 -1.22 115.31 118.99 2wcd h LEU 116 Ca -0.07 0.18 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 2wcd h LEU 116 Cb 0.84 0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.73 2wcd h LEU 116 CO 0.03 -0.10 -0.36 0.40 0.09 0.00 0.00 178.44 178.50 2wcd h ILE 117 N 0.35 0.00 -0.03 1.22 2.04 -0.60 -1.99 117.51 118.50 2wcd h ILE 117 Ca 0.71 -0.25 0.01 0.00 1.00 0.00 0.00 64.86 66.33 2wcd h ILE 117 Cb 1.57 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 37.62 2wcd h ILE 117 CO -0.59 0.00 -0.33 0.50 0.00 0.00 0.00 178.15 177.73 2wcd h LYS 118 N -1.26 -0.37 -0.80 2.37 3.64 -0.03 0.77 116.57 120.88 2wcd h LYS 118 Ca -0.10 0.03 0.16 0.00 -1.27 0.00 0.00 60.65 59.46 2wcd h LYS 118 Cb 0.77 0.08 -0.10 0.00 -0.41 0.00 0.00 32.23 32.58 2wcd h LYS 118 CO 0.17 -0.25 0.34 -0.24 -2.27 0.00 0.00 179.45 177.20 2wcd h VAL 119 N -0.39 0.62 0.57 2.00 3.04 -1.43 0.66 116.25 121.32 2wcd h VAL 119 Ca 0.01 -0.16 -0.03 0.00 -1.01 0.00 0.00 66.70 65.52 2wcd h VAL 119 Cb 0.43 0.12 0.01 0.00 -2.01 0.00 0.00 31.29 29.83 2wcd h VAL 119 CO -0.23 0.08 -0.27 -0.07 -1.01 0.00 0.00 177.57 176.07 2wcd h LEU 120 N 0.46 -0.64 -0.84 3.16 3.38 -0.87 -2.13 115.31 117.83 2wcd h LEU 120 Ca 0.46 -0.01 0.20 0.00 0.09 0.00 0.00 57.88 58.61 2wcd h LEU 120 Cb 0.73 0.17 -0.15 0.00 0.09 0.00 0.00 40.66 41.50 2wcd h LEU 120 CO -0.43 -0.25 -0.00 0.44 0.09 0.00 0.00 178.44 178.29 2wcd h ASP 121 N -1.15 -0.42 0.68 -0.43 3.32 0.92 0.49 116.42 119.84 2wcd h ASP 121 Ca -0.08 0.22 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 2wcd h ASP 121 Cb 0.62 0.40 0.00 0.00 0.22 0.00 0.00 39.33 40.57 2wcd h ASP 121 CO 0.13 -0.23 -0.36 -0.78 -1.72 0.00 0.00 179.24 176.27 2wcd h ASP 122 N 0.08 -0.88 -0.99 6.45 3.58 0.32 -2.19 116.42 122.78 2wcd h ASP 122 Ca 0.47 0.04 0.16 0.00 0.42 0.00 0.00 57.03 58.11 2wcd h ASP 122 Cb 0.86 0.24 -0.09 0.00 1.72 0.00 0.00 39.33 42.06 2wcd h ASP 122 CO -0.76 -0.59 0.62 1.23 -2.88 0.00 0.00 179.24 176.86 2wcd h GLY 123 N -0.96 1.64 0.29 -0.78 0.00 -0.99 0.86 103.07 103.14 2wcd h GLY 123 Ca -0.09 -0.38 0.10 0.00 0.00 0.00 0.00 47.33 46.96 2wcd h GLY 123 CO 0.13 0.05 0.17 -2.22 0.00 0.00 0.00 176.54 174.67 2wcd h ILE 124 N 0.84 0.71 0.41 2.60 2.04 -0.70 1.12 117.51 124.52 2wcd h ILE 124 Ca 0.53 -0.11 -0.02 0.00 1.00 0.00 0.00 64.86 66.26 2wcd h ILE 124 Cb 0.73 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 2wcd h ILE 124 CO -0.31 0.06 -0.19 0.74 0.00 0.00 0.00 178.15 178.44 2wcd h THR 125 N 0.32 0.49 -0.68 -0.27 2.02 -0.40 -2.16 112.91 112.23 2wcd h THR 125 Ca 0.31 -0.55 0.13 0.00 0.77 0.00 0.00 66.41 67.07 2wcd h THR 125 Cb 0.42 0.70 -0.09 0.00 -1.74 0.00 0.00 68.15 67.44 2wcd h THR 125 CO -0.35 0.08 0.21 0.11 0.37 0.00 0.00 175.52 175.94 2wcd h LYS 126 N -0.91 0.33 -0.38 6.66 1.57 -0.46 -0.57 116.57 122.82 2wcd h LYS 126 Ca -0.06 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2wcd h LYS 126 Cb 0.55 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 2wcd h LYS 126 CO 0.09 0.22 0.24 -0.07 -0.57 0.00 0.00 179.45 179.37 2wcd h LEU 127 N 0.34 0.44 0.30 2.94 3.38 0.13 -1.86 115.31 120.98 2wcd h LEU 127 Ca 0.37 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.32 2wcd h LEU 127 Cb 0.55 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 2wcd h LEU 127 CO -0.41 0.33 -0.35 -1.13 0.09 0.00 0.00 178.44 176.97 2wcd h ASN 128 N 0.51 -0.95 -0.75 -0.43 -0.73 -0.46 -2.45 115.58 110.31 2wcd h ASN 128 Ca 0.14 0.09 0.12 0.00 1.87 0.00 0.00 56.30 58.52 2wcd h ASN 128 Cb -0.04 0.33 -0.05 0.00 0.27 0.00 0.00 38.32 38.83 2wcd h ASN 128 CO -0.03 -0.48 0.49 -0.33 -0.37 0.00 0.00 177.43 176.72 2wcd h GLU 129 N -0.69 0.52 -0.16 6.67 5.08 -1.08 -0.33 114.58 124.59 2wcd h GLU 129 Ca -0.01 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 2wcd h GLU 129 Cb 0.64 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.75 2wcd h GLU 129 CO -0.09 0.35 -0.03 0.00 -1.00 0.00 0.00 179.01 178.24 2wcd h ALA 130 N 1.64 0.11 -0.01 3.43 0.00 -0.88 0.16 119.26 123.70 2wcd h ALA 130 Ca 0.36 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.35 2wcd h ALA 130 Cb 0.65 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 2wcd h ALA 130 CO -0.13 -0.47 -0.12 1.96 0.00 0.00 0.00 179.25 180.49 2wcd h GLN 131 N 0.01 -0.19 -0.50 0.00 4.20 -0.73 -0.78 115.11 117.12 2wcd h GLN 131 Ca 0.07 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.82 2wcd h GLN 131 Cb 0.11 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.90 2wcd h GLN 131 CO -0.15 -0.13 0.29 0.87 -0.67 0.00 0.00 178.83 179.04 2wcd h LYS 132 N -0.20 0.55 -0.53 1.46 1.57 -1.15 0.27 116.57 118.54 2wcd h LYS 132 Ca 0.05 -0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.88 2wcd h LYS 132 Cb 0.26 -0.12 -0.07 0.00 0.08 0.00 0.00 32.23 32.38 2wcd h LYS 132 CO -0.13 0.37 0.15 1.03 -0.57 0.00 0.00 179.45 180.30 2wcd h SER 133 N 0.57 0.11 -0.20 0.86 0.87 -0.62 -0.04 113.55 115.09 2wcd h SER 133 Ca 0.20 0.08 -0.02 0.00 -1.23 0.00 0.00 61.79 60.82 2wcd h SER 133 Cb 0.04 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 2wcd h SER 133 CO -0.10 0.08 0.04 -0.07 -0.53 0.00 0.00 176.83 176.25 2wcd h LEU 134 N 0.31 0.32 -0.45 2.23 3.38 -0.16 -2.07 115.31 118.87 2wcd h LEU 134 Ca 0.26 -0.25 0.06 0.00 0.09 0.00 0.00 57.88 58.05 2wcd h LEU 134 Cb 0.33 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.94 2wcd h LEU 134 CO -0.30 0.48 0.13 0.25 0.09 0.00 0.00 178.44 179.09 2wcd h LEU 135 N 0.14 0.11 -0.96 1.67 5.85 -0.05 -0.84 115.31 121.23 2wcd h LEU 135 Ca 0.06 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 2wcd h LEU 135 Cb 0.29 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 2wcd h LEU 135 CO 0.00 0.09 0.42 1.62 -0.34 0.00 0.00 178.44 180.23 2wcd h VAL 136 N 0.29 1.25 -0.69 1.05 3.04 -0.94 -0.99 116.25 119.27 2wcd h VAL 136 Ca 0.22 -0.66 0.02 0.00 -1.01 0.00 0.00 66.70 65.27 2wcd h VAL 136 Cb 0.24 0.17 -0.04 0.00 -2.01 0.00 0.00 31.29 29.65 2wcd h VAL 136 CO -0.24 0.29 0.44 -1.28 -1.01 0.00 0.00 177.57 175.77 2wcd h SER 137 N 1.16 0.74 -0.38 3.17 0.87 -0.58 -2.04 113.55 116.48 2wcd h SER 137 Ca 0.28 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.84 2wcd h SER 137 Cb 0.08 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 2wcd h SER 137 CO -0.04 0.52 0.23 -1.28 -0.53 0.00 0.00 176.83 175.73 2wcd h SER 138 N 0.88 0.45 -0.12 6.23 0.87 -0.30 -1.90 113.55 119.66 2wcd h SER 138 Ca 0.27 -0.05 0.03 0.00 -1.23 0.00 0.00 61.79 60.81 2wcd h SER 138 Cb -0.03 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 61.81 2wcd h SER 138 CO -0.09 0.37 0.11 1.56 -0.53 0.00 0.00 176.83 178.25 2wcd h GLN 139 N 0.50 0.00 -0.29 2.24 4.20 -0.75 -3.07 115.11 117.93 2wcd h GLN 139 Ca 0.14 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.89 2wcd h GLN 139 Cb -0.01 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.74 2wcd h GLN 139 CO -0.03 0.00 0.06 0.66 -0.67 0.00 0.00 178.83 178.85 2wcd h SER 140 N 0.00 0.01 0.32 1.46 4.64 -0.64 -2.38 113.55 116.96 2wcd h SER 140 Ca 0.06 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2wcd h SER 140 Cb 0.28 0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2wcd h SER 140 CO -0.00 0.04 0.00 -0.26 -0.87 0.00 0.00 176.83 175.74 2wcd h PHE 141 N 0.16 0.00 -0.29 4.77 0.04 -1.65 -3.31 116.94 116.67 2wcd h PHE 141 Ca 0.14 0.00 0.05 0.00 2.80 0.00 0.00 57.97 60.96 2wcd h PHE 141 Cb 0.14 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.25 2wcd h PHE 141 CO -0.17 0.00 -0.02 -0.91 -0.60 0.00 0.00 178.31 176.61 2wcd h ASN 142 N 0.00 -0.16 0.66 2.17 4.21 -1.58 0.17 115.58 121.05 2wcd h ASN 142 Ca 0.00 0.07 -0.03 0.00 1.21 0.00 0.00 56.30 57.55 2wcd h ASN 142 Cb 0.16 0.13 0.00 0.00 -1.12 0.00 0.00 38.32 37.49 2wcd h ASN 142 CO 0.00 -0.05 -0.35 -1.13 -1.29 0.00 0.00 177.43 174.61 2wcd h ASN 143 N 0.06 -0.85 -0.69 5.81 -1.24 -1.77 -2.44 115.58 114.45 2wcd h ASN 143 Ca 0.14 0.04 0.15 0.00 0.71 0.00 0.00 56.30 57.33 2wcd h ASN 143 Cb 0.19 0.23 -0.12 0.00 0.73 0.00 0.00 38.32 39.35 2wcd h ASN 143 CO -0.25 -0.57 -0.02 0.00 -1.29 0.00 0.00 177.43 175.30 2wcd h ALA 144 N -0.62 0.67 -0.85 1.57 0.00 -1.72 -0.01 119.26 118.30 2wcd h ALA 144 Ca -0.09 0.22 0.16 0.00 0.00 0.00 0.00 54.91 55.21 2wcd h ALA 144 Cb 0.73 0.40 -0.06 0.00 0.00 0.00 0.00 17.79 18.86 2wcd h ALA 144 CO 0.13 -0.41 0.56 1.03 0.00 0.00 0.00 179.25 180.55 2wcd h SER 145 N 0.09 0.50 0.27 0.00 0.87 -0.27 0.49 113.55 115.51 2wcd h SER 145 Ca 0.37 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.95 2wcd h SER 145 Cb 0.62 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 2wcd h SER 145 CO -0.62 0.24 -0.13 1.23 -0.53 0.00 0.00 176.83 177.03 2wcd h GLY 146 N 0.53 -0.37 -0.34 5.77 0.00 -0.57 -3.01 103.07 105.08 2wcd h GLY 146 Ca 0.43 0.14 0.27 0.00 0.00 0.00 0.00 47.33 48.17 2wcd h GLY 146 CO -0.17 -0.14 0.50 0.50 0.00 0.00 0.00 176.54 177.23 2wcd h LYS 147 N -0.88 0.39 -0.01 4.80 1.57 -0.54 0.17 116.57 122.07 2wcd h LYS 147 Ca -0.04 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2wcd h LYS 147 Cb 0.51 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.68 2wcd h LYS 147 CO 0.06 0.26 -0.32 -0.07 -0.57 0.00 0.00 179.45 178.81 2wcd h LEU 148 N 0.40 -0.97 -0.53 2.94 3.38 -0.95 -1.61 115.31 117.97 2wcd h LEU 148 Ca 0.65 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.74 2wcd h LEU 148 Cb 1.35 0.39 -0.02 0.00 0.09 0.00 0.00 40.66 42.46 2wcd h LEU 148 CO -0.56 -0.38 0.29 0.25 0.09 0.00 0.00 178.44 178.12 2wcd h LEU 149 N -0.47 0.66 -0.22 1.67 6.46 -0.61 -1.78 115.31 121.03 2wcd h LEU 149 Ca 0.06 -0.10 0.04 0.00 -0.12 0.00 0.00 57.88 57.77 2wcd h LEU 149 Cb 0.56 -0.17 -0.07 0.00 -0.73 0.00 0.00 40.66 40.25 2wcd h LEU 149 CO -0.27 0.57 -0.52 0.00 -0.62 0.00 0.00 178.44 177.60 2wcd h ALA 150 N 1.12 -0.77 -0.40 1.25 0.00 -0.86 0.72 119.26 120.32 2wcd h ALA 150 Ca 0.19 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.11 2wcd h ALA 150 Cb 0.06 0.99 -0.07 0.00 0.00 0.00 0.00 17.79 18.77 2wcd h ALA 150 CO -0.03 -1.03 -0.44 1.25 0.00 0.00 0.00 179.25 178.99 2wcd h LEU 151 N -0.50 -1.51 0.05 0.00 5.85 -1.05 -0.36 115.31 117.78 2wcd h LEU 151 Ca 0.06 0.20 0.03 0.00 0.84 0.00 0.00 57.88 59.01 2wcd h LEU 151 Cb 0.65 0.63 -0.05 0.00 0.37 0.00 0.00 40.66 42.26 2wcd h LEU 151 CO -0.48 -0.29 -0.39 -0.78 -0.34 0.00 0.00 178.44 176.16 2wcd h ASP 152 N -0.26 -1.16 -0.99 1.25 1.82 -0.86 0.26 116.42 116.48 2wcd h ASP 152 Ca 0.07 0.14 0.19 0.00 -0.39 0.00 0.00 57.03 57.03 2wcd h ASP 152 Cb 0.44 0.45 -0.18 0.00 0.68 0.00 0.00 39.33 40.72 2wcd h ASP 152 CO -0.52 -0.45 -0.29 -1.28 -1.61 0.00 0.00 179.24 175.10 2wcd h SER 153 N -0.58 -1.07 0.09 2.28 0.87 0.10 -0.40 113.55 114.84 2wcd h SER 153 Ca 0.04 0.30 -0.00 0.00 -1.23 0.00 0.00 61.79 60.90 2wcd h SER 153 Cb 0.64 0.66 0.00 0.00 -0.44 0.00 0.00 62.40 63.25 2wcd h SER 153 CO -0.27 -0.32 -0.04 -0.61 -0.53 0.00 0.00 176.83 175.06 2wcd h GLN 154 N -0.00 -0.11 -1.52 2.24 4.15 -0.46 -2.65 115.11 116.77 2wcd h GLN 154 Ca 0.44 0.01 0.44 0.00 0.77 0.00 0.00 58.65 60.31 2wcd h GLN 154 Cb 0.69 0.03 -0.06 0.00 0.21 0.00 0.00 27.48 28.34 2wcd h GLN 154 CO -1.01 0.27 1.09 1.25 -1.93 0.00 0.00 178.83 178.49 2wcd h LEU 155 N -0.98 0.01 0.14 -2.39 6.46 -0.27 1.35 115.31 119.63 2wcd h LEU 155 Ca -0.01 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.74 2wcd h LEU 155 Cb 0.43 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.36 2wcd h LEU 155 CO 0.02 -0.00 -0.07 0.74 -0.62 0.00 0.00 178.44 178.51 2wcd h THR 156 N 0.00 0.85 -0.84 1.05 2.02 -1.07 -2.62 112.91 112.30 2wcd h THR 156 Ca 0.72 -1.23 0.01 0.00 0.77 0.00 0.00 66.41 66.69 2wcd h THR 156 Cb 2.89 1.46 -0.04 0.00 -1.74 0.00 0.00 68.15 70.72 2wcd h THR 156 CO -0.02 0.23 0.56 -1.13 0.37 0.00 0.00 175.52 175.53 2wcd h ASN 157 N -0.89 0.95 0.51 4.18 -0.73 -0.30 -2.87 115.58 116.44 2wcd h ASN 157 Ca -0.02 -0.02 -0.08 0.00 1.87 0.00 0.00 56.30 58.05 2wcd h ASN 157 Cb 0.52 -0.23 -0.01 0.00 0.27 0.00 0.00 38.32 38.87 2wcd h ASN 157 CO 0.03 0.69 -0.39 -0.78 -0.37 0.00 0.00 177.43 176.61 2wcd h ASP 158 N 1.13 0.00 -0.23 1.15 1.82 0.15 -2.91 116.42 117.53 2wcd h ASP 158 Ca 0.31 0.00 -0.13 0.00 -0.39 0.00 0.00 57.03 56.82 2wcd h ASP 158 Cb -0.11 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 39.90 2wcd h ASP 158 CO -0.08 0.39 -0.36 0.15 -1.61 0.00 0.00 179.24 177.73 2wcd h PHE 159 N 0.00 0.81 0.00 0.28 3.57 -1.23 -2.19 116.94 118.17 2wcd h PHE 159 Ca -0.00 -0.27 -0.03 0.00 3.53 0.00 0.00 57.97 61.19 2wcd h PHE 159 Cb 0.75 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 39.33 2wcd h PHE 159 CO 0.00 1.03 -0.13 0.66 -2.23 0.00 0.00 178.31 177.64 2wcd h SER 160 N 0.36 0.00 0.69 0.41 4.64 -1.47 -1.66 113.55 116.52 2wcd h SER 160 Ca 0.02 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.18 2wcd h SER 160 Cb 0.95 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.02 2wcd h SER 160 CO 0.08 0.13 -0.77 -0.08 -0.87 0.00 0.00 176.83 175.33 2wcd h GLU 161 N 0.00 0.06 0.10 4.77 4.57 -1.22 -2.11 114.58 120.75 2wcd h GLU 161 Ca -0.00 -0.06 -0.29 0.00 -1.18 0.00 0.00 59.36 57.84 2wcd h GLU 161 Cb 0.38 0.01 0.02 0.00 -0.16 0.00 0.00 28.75 29.01 2wcd h GLU 161 CO 0.02 0.79 -1.20 0.87 -1.18 0.00 0.00 179.01 178.31 2wcd h LYS 162 N 0.03 0.57 0.00 1.92 6.56 -0.95 -2.18 116.57 122.53 2wcd h LYS 162 Ca -0.01 -0.75 -0.01 0.00 -1.06 0.00 0.00 60.65 58.82 2wcd h LYS 162 Cb 1.35 0.24 -0.00 0.00 -0.57 0.00 0.00 32.23 33.25 2wcd h LYS 162 CO 0.10 1.33 -0.03 0.77 -2.06 0.00 0.00 179.45 179.56 2wcd h SER 163 N 0.26 0.00 -0.07 0.86 0.02 -1.28 0.63 113.55 113.97 2wcd h SER 163 Ca -0.17 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.61 2wcd h SER 163 Cb 1.87 0.00 0.01 0.00 0.14 0.00 0.00 62.40 64.42 2wcd h SER 163 CO 0.22 0.03 -0.62 -1.28 -1.14 0.00 0.00 176.83 174.04 2wcd h SER 164 N 0.00 0.67 0.20 3.07 0.87 -1.38 -3.26 113.55 113.71 2wcd h SER 164 Ca -0.00 -0.68 -0.05 0.00 -1.23 0.00 0.00 61.79 59.82 2wcd h SER 164 Cb 0.06 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.81 2wcd h SER 164 CO 0.00 1.25 -0.23 0.22 -0.53 0.00 0.00 176.83 177.55 2wcd h TYR 165 N 0.14 0.06 0.13 2.24 3.20 -0.35 -2.07 116.97 120.31 2wcd h TYR 165 Ca -0.06 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.80 2wcd h TYR 165 Cb 1.28 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.54 2wcd h TYR 165 CO 0.12 0.29 -0.07 0.35 -1.64 0.00 0.00 178.16 177.21 2wcd h PHE 166 N 0.06 -0.17 -0.99 -3.82 3.57 0.12 -0.80 116.94 114.91 2wcd h PHE 166 Ca 0.01 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.58 2wcd h PHE 166 Cb 0.43 0.06 -0.07 0.00 2.79 0.00 0.00 35.95 39.17 2wcd h PHE 166 CO 0.00 -0.10 0.64 0.37 -2.23 0.00 0.00 178.31 176.99 2wcd h GLN 167 N -0.18 1.11 0.00 1.11 4.15 -1.60 0.49 115.11 120.19 2wcd h GLN 167 Ca -0.02 -0.07 -0.00 0.00 0.77 0.00 0.00 58.65 59.33 2wcd h GLN 167 Cb 0.14 -0.25 -0.00 0.00 0.21 0.00 0.00 27.48 27.58 2wcd h GLN 167 CO 0.02 0.73 -0.02 0.77 -1.93 0.00 0.00 178.83 178.41 2wcd h SER 168 N 1.14 0.00 0.02 -0.69 0.02 -1.38 -1.78 113.55 110.87 2wcd h SER 168 Ca 0.43 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 61.03 2wcd h SER 168 Cb 0.21 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.70 2wcd h SER 168 CO -0.18 0.02 -1.99 1.67 -1.14 0.00 0.00 176.83 175.21 2wcd n GLN 169 N -3.29 0.62 -0.07 3.45 -0.06 0.14 -3.36 117.38 114.81 2wcd n GLN 169 Ca -0.02 0.36 0.13 0.00 -2.00 0.00 0.00 57.00 55.46 2wcd n GLN 169 Cb 0.13 -1.62 0.52 0.00 -4.06 0.00 0.00 30.24 25.21 2wcd n GLN 169 CO 0.00 0.00 0.00 -0.39 -0.20 0.00 0.00 177.06 176.47 2wcd h VAL 170 N -0.68 0.88 0.22 1.69 -1.51 -0.55 0.12 116.25 116.42 2wcd h VAL 170 Ca -0.52 -0.12 0.01 0.00 -1.23 0.00 0.00 66.70 64.84 2wcd h VAL 170 Cb 1.62 0.49 -0.03 0.00 -2.13 0.00 0.00 31.29 31.24 2wcd h VAL 170 CO -0.22 0.07 -0.30 0.44 -1.23 0.00 0.00 177.57 176.33 2wcd h ASP 171 N 0.36 -0.83 -1.17 4.19 3.32 -1.47 -0.95 116.42 119.87 2wcd h ASP 171 Ca 0.27 0.08 0.33 0.00 0.02 0.00 0.00 57.03 57.73 2wcd h ASP 171 Cb 0.58 0.30 -0.07 0.00 0.22 0.00 0.00 39.33 40.35 2wcd h ASP 171 CO -0.07 -0.41 0.80 0.50 -1.72 0.00 0.00 179.24 178.35 2wcd h LYS 172 N -0.58 0.15 -0.18 3.56 3.64 -0.79 -0.00 116.57 122.38 2wcd h LYS 172 Ca 0.01 -0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 2wcd h LYS 172 Cb 0.56 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2wcd h LYS 172 CO -0.11 0.10 -0.35 0.82 -2.27 0.00 0.00 179.45 177.64 2wcd h ILE 173 N 0.16 1.34 0.60 2.00 2.04 -0.47 -1.28 117.51 121.90 2wcd h ILE 173 Ca 0.62 -1.58 -0.03 0.00 1.00 0.00 0.00 64.86 64.86 2wcd h ILE 173 Cb 2.06 1.91 0.01 0.00 -0.74 0.00 0.00 36.82 40.06 2wcd h ILE 173 CO -0.16 0.48 -0.29 0.03 0.00 0.00 0.00 178.15 178.21 2wcd h ARG 174 N 0.21 -0.78 -0.93 2.37 3.08 -0.35 -1.81 114.38 116.17 2wcd h ARG 174 Ca 0.01 0.05 0.23 0.00 0.07 0.00 0.00 59.98 60.34 2wcd h ARG 174 Cb 0.94 0.18 -0.06 0.00 0.08 0.00 0.00 29.97 31.10 2wcd h ARG 174 CO 0.08 -0.49 0.62 -0.22 -1.07 0.00 0.00 179.97 178.89 2wcd h LYS 175 N -0.90 0.32 0.08 0.04 3.11 -1.16 0.21 116.57 118.26 2wcd h LYS 175 Ca -0.08 -0.02 -0.27 0.00 -2.81 0.00 0.00 60.65 57.47 2wcd h LYS 175 Cb 0.65 -0.07 0.02 0.00 -1.00 0.00 0.00 32.23 31.83 2wcd h LYS 175 CO 0.14 0.21 -1.14 0.93 -2.81 0.00 0.00 179.45 176.77 2wcd h GLU 176 N 0.33 0.50 0.25 1.90 5.08 -1.13 -3.01 114.58 118.50 2wcd h GLU 176 Ca 0.48 -0.65 -0.34 0.00 -1.00 0.00 0.00 59.36 57.86 2wcd h GLU 176 Cb 1.33 0.21 0.04 0.00 0.50 0.00 0.00 28.75 30.83 2wcd h GLU 176 CO -0.16 1.27 -1.50 0.00 -1.00 0.00 0.00 179.01 177.61 2wcd h ALA 177 N 0.49 -0.13 0.06 3.43 0.00 -0.08 -3.08 119.26 119.95 2wcd h ALA 177 Ca -0.14 -0.88 -0.24 0.00 0.00 0.00 0.00 54.91 53.65 2wcd h ALA 177 Cb 1.81 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.78 2wcd h ALA 177 CO 0.21 0.73 -1.09 1.88 0.00 0.00 0.00 179.25 180.98 2wcd h TYR 178 N 0.14 0.28 -0.00 0.00 0.05 -0.86 -0.32 116.97 116.26 2wcd h TYR 178 Ca -0.26 -0.19 0.00 0.00 0.05 0.00 0.00 58.73 58.33 2wcd h TYR 178 Cb 2.17 -0.01 -0.00 0.00 1.01 0.00 0.00 36.73 39.89 2wcd h TYR 178 CO 0.13 1.12 0.01 0.00 -1.05 0.00 0.00 178.16 178.37 2wcd h ALA 179 N 0.80 1.18 0.00 3.88 0.00 -1.64 0.12 119.26 123.60 2wcd h ALA 179 Ca -0.07 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 2wcd h ALA 179 Cb 1.82 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.60 2wcd h ALA 179 CO 0.16 -0.01 -0.40 0.78 0.00 0.00 0.00 179.25 179.78 2wcd h GLY 180 N 0.00 0.00 0.86 0.00 0.00 -1.29 -3.20 103.07 99.44 2wcd h GLY 180 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2wcd h GLY 180 CO -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 176.54 176.17 2wcd h ALA 181 N -0.33 -0.95 -1.68 3.60 0.00 -0.96 -1.46 119.26 117.49 2wcd h ALA 181 Ca -0.10 -0.19 0.51 0.00 0.00 0.00 0.00 54.91 55.13 2wcd h ALA 181 Cb 0.94 0.45 -0.09 0.00 0.00 0.00 0.00 17.79 19.09 2wcd h ALA 181 CO -0.06 -1.05 1.18 0.00 0.00 0.00 0.00 179.25 179.32 2wcd n ALA 182 N -2.59 1.63 0.69 0.00 0.00 0.41 0.77 120.51 121.41 2wcd n ALA 182 Ca -0.13 0.67 0.06 0.00 0.00 0.00 0.00 53.44 54.04 2wcd n ALA 182 Cb 0.40 -1.04 0.34 0.00 0.00 0.00 0.00 19.45 19.15 2wcd n ALA 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wcd n ALA 183 N -2.76 1.85 1.07 0.00 0.00 -0.55 -2.49 120.51 117.63 2wcd n ALA 183 Ca 0.40 -0.07 0.13 0.00 0.00 0.00 0.00 53.44 53.91 2wcd n ALA 183 Cb 1.76 -1.20 0.62 0.00 0.00 0.00 0.00 19.45 20.63 2wcd n ALA 183 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wcd n GLY 184 N -0.22 -1.32 0.49 0.00 0.00 0.23 -3.69 105.19 100.68 2wcd n GLY 184 Ca 0.08 -0.11 0.31 0.00 0.00 0.00 0.00 46.02 46.30 2wcd n GLY 184 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wcd h VAL 185 N 0.00 0.41 0.81 1.61 2.07 -1.71 -2.38 116.25 117.06 2wcd h VAL 185 Ca 0.00 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 2wcd h VAL 185 Cb 0.38 0.46 0.01 0.00 -1.52 0.00 0.00 31.29 30.61 2wcd h VAL 185 CO 0.00 0.00 -0.39 0.58 0.02 0.00 0.00 177.57 177.78 2wcd h VAL 186 N 0.00 0.00 -4.38 2.57 2.07 -1.87 -3.44 116.25 111.20 2wcd h VAL 186 Ca 0.46 -0.19 -0.47 0.00 0.82 0.00 0.00 66.70 67.32 2wcd h VAL 186 Cb 1.98 0.00 0.09 0.00 -1.52 0.00 0.00 31.29 31.83 2wcd h VAL 186 CO -0.00 0.00 0.37 0.00 0.02 0.00 0.00 177.57 177.95 2wcd s ALA 187 N -5.30 2.83 0.87 1.67 0.00 -0.90 -5.01 121.76 115.92 2wcd s ALA 187 Ca -0.16 -0.64 -0.14 0.00 0.00 0.00 0.00 51.96 51.02 2wcd s ALA 187 Cb 0.02 -2.89 0.01 0.00 0.00 0.00 0.00 23.12 20.26 2wcd s ALA 187 CO 0.48 -1.45 0.48 0.41 0.00 0.00 0.00 175.76 175.67 2wcd n GLY 188 N -3.15 -1.77 0.30 0.00 0.00 -1.26 -4.71 105.19 94.60 2wcd n GLY 188 Ca 0.08 -0.62 0.09 0.00 0.00 0.00 0.00 46.02 45.57 2wcd n GLY 188 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2wcd h PRO 189 N -1.13 0.24 0.00 1.61 0.11 -1.90 0.78 132.00 131.71 2wcd h PRO 189 Ca -0.44 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 2wcd h PRO 189 Cb 1.30 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 2wcd h PRO 189 CO 0.37 0.16 -0.01 0.74 -0.21 0.00 0.00 178.00 179.05 2wcd h PHE 190 N 0.25 0.00 -0.30 0.65 -1.00 -1.96 0.23 116.94 114.80 2wcd h PHE 190 Ca 0.12 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.81 2wcd h PHE 190 Cb 0.17 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.72 2wcd h PHE 190 CO -0.00 0.01 -0.18 0.78 -1.61 0.00 0.00 178.31 177.31 2wcd h GLY 191 N 0.10 0.59 0.91 -1.45 0.00 0.30 -2.87 103.07 100.65 2wcd h GLY 191 Ca -0.00 -0.45 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 2wcd h GLY 191 CO 0.00 0.41 0.01 1.41 0.00 0.00 0.00 176.54 178.37 2wcd h LEU 192 N 0.50 0.02 -0.58 3.11 4.07 -0.40 0.26 115.31 122.29 2wcd h LEU 192 Ca 0.08 -0.09 0.11 0.00 0.08 0.00 0.00 57.88 58.06 2wcd h LEU 192 Cb 0.59 -0.01 -0.11 0.00 1.08 0.00 0.00 40.66 42.21 2wcd h LEU 192 CO 0.04 0.11 -0.30 0.40 -1.08 0.00 0.00 178.44 177.61 2wcd h ILE 193 N -0.06 0.21 0.17 1.22 2.04 -1.39 1.06 117.51 120.75 2wcd h ILE 193 Ca 0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 2wcd h ILE 193 Cb 0.09 0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 36.38 2wcd h ILE 193 CO -0.00 0.00 -0.10 0.40 0.00 0.00 0.00 178.15 178.45 2wcd h ILE 194 N -0.14 0.80 0.64 -0.67 2.04 -1.28 -0.61 117.51 118.29 2wcd h ILE 194 Ca 0.24 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.07 2wcd h ILE 194 Cb 0.54 0.80 0.01 0.00 -0.74 0.00 0.00 36.82 37.42 2wcd h ILE 194 CO -0.67 0.00 -0.31 -1.28 0.00 0.00 0.00 178.15 175.90 2wcd h SER 195 N -0.25 -0.73 -0.44 1.72 0.87 0.72 -0.81 113.55 114.62 2wcd h SER 195 Ca -0.02 0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.50 2wcd h SER 195 Cb 0.21 0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.33 2wcd h SER 195 CO 0.03 -0.50 0.10 0.22 -0.53 0.00 0.00 176.83 176.14 2wcd h TYR 196 N -0.89 0.80 -0.27 2.24 3.20 0.11 0.13 116.97 122.28 2wcd h TYR 196 Ca -0.09 -0.08 -0.01 0.00 3.14 0.00 0.00 58.73 61.69 2wcd h TYR 196 Cb 0.67 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 2wcd h TYR 196 CO -0.02 0.69 0.12 0.77 -1.64 0.00 0.00 178.16 178.08 2wcd h SER 197 N 0.75 0.36 -0.98 -2.11 0.02 -1.05 -0.59 113.55 109.95 2wcd h SER 197 Ca 0.16 -0.14 0.13 0.00 -0.84 0.00 0.00 61.79 61.10 2wcd h SER 197 Cb 0.31 -0.09 -0.08 0.00 0.14 0.00 0.00 62.40 62.67 2wcd h SER 197 CO 0.00 0.40 0.62 0.40 -1.14 0.00 0.00 176.83 177.11 2wcd h ILE 198 N 0.29 0.88 0.00 3.27 1.08 -0.48 -2.58 117.51 119.98 2wcd h ILE 198 Ca 0.09 -0.31 0.00 0.00 -0.39 0.00 0.00 64.86 64.25 2wcd h ILE 198 Cb 0.15 -0.10 0.00 0.00 -3.07 0.00 0.00 36.82 33.80 2wcd h ILE 198 CO -0.01 0.17 0.00 0.00 -0.69 0.00 0.00 178.15 177.62 2wcd n ALA 199 N -2.37 0.00 -0.46 1.87 0.00 -0.03 -3.31 120.51 116.22 2wcd n ALA 199 Ca 0.19 0.00 0.38 0.00 0.00 0.00 0.00 53.44 54.01 2wcd n ALA 199 Cb 0.40 0.00 0.66 0.00 0.00 0.00 0.00 19.45 20.51 2wcd n ALA 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wcd h ALA 200 N -2.00 2.77 0.79 0.00 0.00 -1.31 0.26 119.26 119.77 2wcd h ALA 200 Ca 0.00 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 2wcd h ALA 200 Cb 0.00 0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.03 2wcd h ALA 200 CO 0.00 -1.44 -0.38 0.78 0.00 0.00 0.00 179.25 178.21 2wcd h GLY 201 N 0.04 -1.11 1.05 0.00 0.00 -1.48 0.13 103.07 101.70 2wcd h GLY 201 Ca 0.85 0.41 -0.05 0.00 0.00 0.00 0.00 47.33 48.55 2wcd h GLY 201 CO -0.46 -0.40 0.29 -2.08 0.00 0.00 0.00 176.54 173.89 2wcd h VAL 202 N -1.11 1.26 0.57 4.60 2.07 -0.92 0.37 116.25 123.10 2wcd h VAL 202 Ca -0.11 -0.84 -0.03 0.00 0.82 0.00 0.00 66.70 66.54 2wcd h VAL 202 Cb 0.81 0.36 0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2wcd h VAL 202 CO 0.18 0.34 -0.27 0.58 0.02 0.00 0.00 177.57 178.42 2wcd h VAL 203 N 1.13 0.00 0.00 2.57 2.07 -0.63 -1.80 116.25 119.59 2wcd h VAL 203 Ca 0.26 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.66 2wcd h VAL 203 Cb 0.24 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.01 2wcd h VAL 203 CO -0.02 0.00 0.00 -0.62 0.02 0.00 0.00 177.57 176.95 2wcd n GLU 204 N -4.36 0.07 -0.04 1.57 -0.58 0.45 -1.30 120.64 116.44 2wcd n GLU 204 Ca -0.09 0.28 -0.01 0.00 -0.42 0.00 0.00 57.16 56.92 2wcd n GLU 204 Cb 0.30 -1.62 -0.00 0.00 -0.57 0.00 0.00 31.44 29.55 2wcd n GLU 204 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 2wcd h GLY 205 N 2.66 0.00 0.00 0.62 0.00 -0.16 -3.43 103.07 102.76 2wcd h GLY 205 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.12 2wcd h GLY 205 CO 0.00 0.00 -1.79 0.28 0.00 0.00 0.00 176.54 175.03 2wcd n LYS 206 N -3.99 0.34 0.00 4.80 5.02 -0.69 -4.78 118.16 118.86 2wcd n LYS 206 Ca -0.01 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 2wcd n LYS 206 Cb 0.04 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 2wcd n LYS 206 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2wcd n LEU 207 N -2.98 0.00 -0.23 -0.35 4.77 -0.74 -1.04 117.00 116.44 2wcd n LEU 207 Ca -0.25 0.83 0.03 0.00 -0.03 0.00 0.00 56.01 56.60 2wcd n LEU 207 Cb 0.76 -0.33 0.14 0.00 -2.33 0.00 0.00 43.42 41.65 2wcd n LEU 207 CO 0.13 -0.33 0.87 0.40 -1.33 0.00 0.00 177.39 177.12 2wcd h ILE 208 N 0.00 0.48 -0.80 -0.08 1.08 -1.50 0.14 117.51 116.83 2wcd h ILE 208 Ca 0.00 -0.06 0.02 0.00 -0.39 0.00 0.00 64.86 64.43 2wcd h ILE 208 Cb 0.00 0.29 -0.04 0.00 -3.07 0.00 0.00 36.82 34.00 2wcd h ILE 208 CO 0.00 0.03 0.53 -0.65 -0.69 0.00 0.00 178.15 177.37 2wcd h PRO 209 N 0.17 1.03 -0.35 2.37 0.11 -1.80 0.08 132.00 133.61 2wcd h PRO 209 Ca 0.37 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 66.46 2wcd h PRO 209 Cb 0.62 -0.23 -0.04 0.00 0.11 0.00 0.00 31.00 31.46 2wcd h PRO 209 CO -0.54 0.68 0.10 0.93 -0.21 0.00 0.00 178.00 178.96 2wcd h GLU 210 N 1.06 0.22 -0.01 1.05 4.39 0.70 0.79 114.58 122.78 2wcd h GLU 210 Ca 0.30 -0.01 0.01 0.00 0.34 0.00 0.00 59.36 60.00 2wcd h GLU 210 Cb -0.08 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.50 2wcd h GLU 210 CO -0.08 0.15 -0.06 -0.07 -1.16 0.00 0.00 179.01 177.79 2wcd h LEU 211 N 0.23 -0.16 -2.21 1.33 3.38 -0.71 0.25 115.31 117.42 2wcd h LEU 211 Ca 0.16 0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.21 2wcd h LEU 211 Cb 0.16 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2wcd h LEU 211 CO -0.19 -0.08 0.25 0.11 0.09 0.00 0.00 178.44 178.62 2wcd h LYS 212 N -0.09 0.00 -0.02 1.13 1.57 -0.58 -0.68 116.57 117.89 2wcd h LYS 212 Ca 0.03 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.74 2wcd h LYS 212 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.44 2wcd h LYS 212 CO -0.07 0.00 -0.26 -0.97 -0.57 0.00 0.00 179.45 177.58 2wcd h ASN 213 N 0.00 0.27 -0.42 0.86 -0.00 0.12 -3.07 115.58 113.33 2wcd h ASN 213 Ca 0.09 -0.71 -0.08 0.00 -0.00 0.00 0.00 56.30 55.59 2wcd h ASN 213 Cb 0.59 -0.08 -0.01 0.00 -0.00 0.00 0.00 38.32 38.81 2wcd h ASN 213 CO -0.00 0.94 -0.06 0.11 -0.00 0.00 0.00 177.43 178.42 2wcd h LYS 214 N -0.39 0.79 -1.05 6.67 6.56 -0.52 -0.71 116.57 127.92 2wcd h LYS 214 Ca -0.03 -0.28 0.30 0.00 -1.06 0.00 0.00 60.65 59.58 2wcd h LYS 214 Cb 0.96 -0.06 -0.05 0.00 -0.57 0.00 0.00 32.23 32.52 2wcd h LYS 214 CO 0.05 0.89 0.75 1.25 -2.06 0.00 0.00 179.45 180.34 2wcd h LEU 215 N 0.62 0.03 0.15 2.94 7.12 -1.25 0.46 115.31 125.37 2wcd h LEU 215 Ca 0.11 0.01 -0.25 0.00 0.13 0.00 0.00 57.88 57.87 2wcd h LEU 215 Cb 0.58 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 40.72 2wcd h LEU 215 CO 0.03 0.01 -1.21 0.50 -0.13 0.00 0.00 178.44 177.64 2wcd h LYS 216 N 0.03 0.32 -0.11 1.25 3.64 -1.26 -2.10 116.57 118.34 2wcd h LYS 216 Ca 0.51 -0.55 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 2wcd h LYS 216 Cb 1.98 0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 33.99 2wcd h LYS 216 CO -0.02 1.26 -0.03 0.66 -2.27 0.00 0.00 179.45 179.04 2wcd h SER 217 N -0.24 0.14 0.31 4.20 4.64 0.66 0.77 113.55 124.03 2wcd h SER 217 Ca -0.24 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.05 2wcd h SER 217 Cb 1.80 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.85 2wcd h SER 217 CO 0.13 0.20 -0.15 0.58 -0.87 0.00 0.00 176.83 176.72 2wcd h VAL 218 N 0.15 0.00 -0.86 0.95 2.07 -0.33 -1.28 116.25 116.96 2wcd h VAL 218 Ca 0.04 -0.32 0.25 0.00 0.82 0.00 0.00 66.70 67.48 2wcd h VAL 218 Cb 0.16 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.90 2wcd h VAL 218 CO 0.01 0.00 0.69 -0.61 0.02 0.00 0.00 177.57 177.68 2wcd h GLN 219 N -0.75 0.00 -0.02 1.57 4.15 -1.11 0.73 115.11 119.68 2wcd h GLN 219 Ca -0.04 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.36 2wcd h GLN 219 Cb 0.32 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.01 2wcd h GLN 219 CO 0.07 0.00 -0.04 -0.97 -1.93 0.00 0.00 178.83 175.96 2wcd h ASN 220 N 0.00 0.07 -0.34 -0.69 -0.73 0.56 -2.91 115.58 111.55 2wcd h ASN 220 Ca 0.41 -0.55 -0.11 0.00 1.87 0.00 0.00 56.30 57.92 2wcd h ASN 220 Cb 1.79 -0.02 -0.01 0.00 0.27 0.00 0.00 38.32 40.35 2wcd h ASN 220 CO -0.00 0.61 -0.20 0.15 -0.37 0.00 0.00 177.43 177.61 2wcd h PHE 221 N -0.46 0.85 -0.90 0.67 3.57 0.68 -2.26 116.94 119.09 2wcd h PHE 221 Ca 0.00 -0.22 0.22 0.00 3.53 0.00 0.00 57.97 61.50 2wcd h PHE 221 Cb 0.59 -0.19 -0.13 0.00 2.79 0.00 0.00 35.95 39.02 2wcd h PHE 221 CO 0.11 0.95 0.39 0.35 -2.23 0.00 0.00 178.31 177.88 2wcd h PHE 222 N 0.50 0.64 0.46 0.41 3.57 0.19 0.17 116.94 122.88 2wcd h PHE 222 Ca 0.07 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.59 2wcd h PHE 222 Cb 0.75 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.35 2wcd h PHE 222 CO 0.06 -0.06 -0.22 1.15 -2.23 0.00 0.00 178.31 177.01 2wcd h THR 223 N 0.38 0.34 -0.98 4.41 2.02 -1.27 -0.55 112.91 117.27 2wcd h THR 223 Ca 0.56 -0.52 0.17 0.00 0.77 0.00 0.00 66.41 67.39 2wcd h THR 223 Cb 1.08 0.50 -0.10 0.00 -1.74 0.00 0.00 68.15 67.89 2wcd h THR 223 CO -0.54 0.06 0.58 0.71 0.37 0.00 0.00 175.52 176.70 2wcd h THR 224 N -1.01 0.76 -0.08 3.16 1.35 -1.03 -0.73 112.91 115.32 2wcd h THR 224 Ca -0.06 -0.27 -0.01 0.00 -0.55 0.00 0.00 66.41 65.51 2wcd h THR 224 Cb 0.58 -0.10 -0.00 0.00 -1.73 0.00 0.00 68.15 66.89 2wcd h THR 224 CO 0.10 0.14 0.01 0.25 -0.25 0.00 0.00 175.52 175.78 2wcd h LEU 225 N 0.79 0.14 -1.11 3.87 6.46 -0.97 0.07 115.31 124.56 2wcd h LEU 225 Ca 0.54 -0.28 0.14 0.00 -0.12 0.00 0.00 57.88 58.16 2wcd h LEU 225 Cb 0.76 -0.04 -0.08 0.00 -0.73 0.00 0.00 40.66 40.57 2wcd h LEU 225 CO -0.35 0.38 0.61 -1.28 -0.62 0.00 0.00 178.44 177.18 2wcd h SER 226 N -0.12 0.80 0.17 1.25 0.87 0.27 0.93 113.55 117.72 2wcd h SER 226 Ca 0.02 0.06 -0.15 0.00 -1.23 0.00 0.00 61.79 60.49 2wcd h SER 226 Cb 0.31 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 2wcd h SER 226 CO 0.00 0.39 -0.57 0.78 -0.53 0.00 0.00 176.83 176.90 2wcd h ASN 227 N 0.84 0.47 0.20 6.23 -0.26 -1.02 -1.59 115.58 120.45 2wcd h ASN 227 Ca 0.50 -0.26 -0.02 0.00 -0.56 0.00 0.00 56.30 55.96 2wcd h ASN 227 Cb 0.67 -0.13 -0.00 0.00 -1.06 0.00 0.00 38.32 37.79 2wcd h ASN 227 CO -0.27 0.94 -0.11 0.00 -1.06 0.00 0.00 177.43 176.93 2wcd h THR 228 N 0.32 0.78 0.05 2.81 1.03 0.12 -1.40 112.91 116.61 2wcd h THR 228 Ca 0.00 -0.41 -0.00 0.00 -0.01 0.00 0.00 66.41 65.99 2wcd h THR 228 Cb 1.09 1.24 0.00 0.00 -1.07 0.00 0.00 68.15 69.41 2wcd h THR 228 CO 0.10 0.10 -0.03 0.58 -0.01 0.00 0.00 175.52 176.27 2wcd h VAL 229 N 0.00 1.03 -1.09 0.00 2.07 -0.77 -2.97 116.25 114.52 2wcd h VAL 229 Ca -0.00 -1.58 0.30 0.00 0.82 0.00 0.00 66.70 66.24 2wcd h VAL 229 Cb 0.23 1.88 -0.10 0.00 -1.52 0.00 0.00 31.29 31.77 2wcd h VAL 229 CO 0.01 0.32 0.70 0.11 0.02 0.00 0.00 177.57 178.73 2wcd h LYS 230 N -0.94 0.33 0.74 1.57 1.57 -1.04 -0.38 116.57 118.43 2wcd h LYS 230 Ca -0.01 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 2wcd h LYS 230 Cb 0.58 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.83 2wcd h LYS 230 CO 0.01 0.22 -0.36 0.37 -0.57 0.00 0.00 179.45 179.12 2wcd h GLN 231 N 0.34 -0.96 -0.70 3.15 5.75 -1.30 -1.63 115.11 119.75 2wcd h GLN 231 Ca 0.64 0.07 0.15 0.00 -0.15 0.00 0.00 58.65 59.36 2wcd h GLN 231 Cb 1.70 0.22 -0.13 0.00 1.07 0.00 0.00 27.48 30.34 2wcd h GLN 231 CO -0.34 -0.64 -0.08 0.00 -2.65 0.00 0.00 178.83 175.12 2wcd h ALA 232 N -1.38 0.61 -0.90 3.38 0.00 -1.09 0.40 119.26 120.28 2wcd h ALA 232 Ca -0.10 0.25 0.08 0.00 0.00 0.00 0.00 54.91 55.14 2wcd h ALA 232 Cb 0.76 0.46 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 2wcd h ALA 232 CO 0.17 -0.42 0.58 -0.91 0.00 0.00 0.00 179.25 178.67 2wcd h ASN 233 N 0.05 0.84 -0.31 0.00 2.35 -1.07 0.25 115.58 117.69 2wcd h ASN 233 Ca 0.36 0.02 -0.17 0.00 -0.55 0.00 0.00 56.30 55.96 2wcd h ASN 233 Cb 0.60 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.80 2wcd h ASN 233 CO -0.67 0.51 -0.47 0.50 -1.65 0.00 0.00 177.43 175.66 2wcd h LYS 234 N 0.94 0.86 -0.19 0.81 3.64 0.59 -2.46 116.57 120.77 2wcd h LYS 234 Ca 0.41 -0.52 -0.02 0.00 -1.27 0.00 0.00 60.65 59.25 2wcd h LYS 234 Cb 0.33 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 2wcd h LYS 234 CO -0.17 1.15 0.03 -0.44 -2.27 0.00 0.00 179.45 177.75 2wcd h ASP 235 N 0.65 0.30 -0.26 4.20 3.32 0.43 -1.61 116.42 123.45 2wcd h ASP 235 Ca 0.03 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 56.82 2wcd h ASP 235 Cb 1.07 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.53 2wcd h ASP 235 CO 0.11 0.49 0.16 0.40 -1.72 0.00 0.00 179.24 178.68 2wcd h ILE 236 N 0.10 1.09 -0.80 0.35 2.04 -0.60 -1.97 117.51 117.72 2wcd h ILE 236 Ca 0.06 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 2wcd h ILE 236 Cb 0.32 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 2wcd h ILE 236 CO 0.00 0.08 0.45 0.44 0.00 0.00 0.00 178.15 179.13 2wcd h ASP 237 N 0.33 0.97 -0.67 1.72 5.19 -1.35 -1.49 116.42 121.13 2wcd h ASP 237 Ca 0.09 -0.07 -0.07 0.00 -0.62 0.00 0.00 57.03 56.37 2wcd h ASP 237 Cb -0.00 -0.25 -0.03 0.00 0.18 0.00 0.00 39.33 39.23 2wcd h ASP 237 CO -0.02 0.77 0.17 0.00 -3.12 0.00 0.00 179.24 177.04 2wcd h ALA 238 N 1.39 1.01 -0.13 3.45 0.00 -0.96 -1.55 119.26 122.47 2wcd h ALA 238 Ca 0.28 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2wcd h ALA 238 Cb -0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2wcd h ALA 238 CO -0.05 0.65 0.04 0.00 0.00 0.00 0.00 179.25 179.89 2wcd h ALA 239 N 1.15 0.17 -0.63 0.00 0.00 -0.75 -1.96 119.26 117.24 2wcd h ALA 239 Ca 0.22 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.08 2wcd h ALA 239 Cb 0.35 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 2wcd h ALA 239 CO 0.00 -0.21 0.42 0.87 0.00 0.00 0.00 179.25 180.32 2wcd h LYS 240 N 0.03 0.54 0.30 0.00 1.57 -1.04 -0.24 116.57 117.73 2wcd h LYS 240 Ca 0.04 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2wcd h LYS 240 Cb 0.22 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.41 2wcd h LYS 240 CO -0.00 0.36 -0.14 1.25 -0.57 0.00 0.00 179.45 180.34 2wcd h LEU 241 N 0.56 -0.34 -0.91 2.94 7.12 -1.01 -2.43 115.31 121.24 2wcd h LEU 241 Ca 0.28 0.01 0.21 0.00 0.13 0.00 0.00 57.88 58.52 2wcd h LEU 241 Cb 0.38 0.09 -0.17 0.00 -0.53 0.00 0.00 40.66 40.42 2wcd h LEU 241 CO -0.09 -0.21 -0.11 1.17 -0.13 0.00 0.00 178.44 179.08 2wcd n LYS 242 N -3.25 -0.08 0.38 1.25 4.81 -0.76 -1.02 118.16 119.49 2wcd n LYS 242 Ca -0.05 1.39 -0.18 0.00 -0.87 0.00 0.00 58.31 58.60 2wcd n LYS 242 Cb 0.16 -2.14 -0.09 0.00 0.02 0.00 0.00 35.03 32.98 2wcd n LYS 242 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 2wcd h LEU 243 N 0.00 -0.95 -0.51 3.14 3.38 -0.99 -1.18 115.31 118.22 2wcd h LEU 243 Ca 0.49 0.05 -0.05 0.00 0.09 0.00 0.00 57.88 58.45 2wcd h LEU 243 Cb 0.89 0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 2wcd h LEU 243 CO -0.90 -0.62 0.10 0.71 0.09 0.00 0.00 178.44 177.83 2wcd h THR 244 N -1.00 1.25 0.00 0.22 1.35 -0.77 0.54 112.91 114.50 2wcd h THR 244 Ca -0.09 -0.89 -0.02 0.00 -0.55 0.00 0.00 66.41 64.86 2wcd h THR 244 Cb 0.79 0.85 -0.00 0.00 -1.73 0.00 0.00 68.15 68.06 2wcd h THR 244 CO 0.11 0.32 -0.08 0.71 -0.25 0.00 0.00 175.52 176.34 2wcd h THR 245 N 0.71 0.62 0.06 6.82 1.35 -1.06 0.71 112.91 122.12 2wcd h THR 245 Ca 0.16 -0.34 -0.00 0.00 -0.55 0.00 0.00 66.41 65.68 2wcd h THR 245 Cb 0.37 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 2wcd h THR 245 CO 0.01 0.08 -0.03 -0.08 -0.25 0.00 0.00 175.52 175.25 2wcd h GLU 246 N 0.00 -0.07 -0.98 4.72 4.57 -0.60 -2.76 114.58 119.45 2wcd h GLU 246 Ca -0.00 0.01 0.22 0.00 -1.18 0.00 0.00 59.36 58.40 2wcd h GLU 246 Cb 0.20 0.02 -0.19 0.00 -0.16 0.00 0.00 28.75 28.63 2wcd h GLU 246 CO 0.01 0.53 -0.16 0.82 -1.18 0.00 0.00 179.01 179.03 2wcd h ILE 247 N -0.87 0.02 -0.02 2.32 2.04 0.17 0.42 117.51 121.59 2wcd h ILE 247 Ca -0.01 -0.00 -0.19 0.00 1.00 0.00 0.00 64.86 65.66 2wcd h ILE 247 Cb 0.64 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 2wcd h ILE 247 CO 0.01 0.00 -0.81 0.00 0.00 0.00 0.00 178.15 177.36 2wcd h ALA 248 N 1.98 0.58 -0.51 1.87 0.00 -1.00 -0.29 119.26 121.89 2wcd h ALA 248 Ca 0.51 -0.67 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2wcd h ALA 248 Cb 0.88 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2wcd h ALA 248 CO -0.98 0.84 0.08 0.00 0.00 0.00 0.00 179.25 179.19 2wcd h ALA 249 N 0.99 0.68 -0.60 0.00 0.00 -0.51 -0.44 119.26 119.38 2wcd h ALA 249 Ca -0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 2wcd h ALA 249 Cb 1.40 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 2wcd h ALA 249 CO 0.13 0.43 0.30 0.82 0.00 0.00 0.00 179.25 180.93 2wcd h ILE 250 N 0.73 1.19 -0.65 0.00 2.04 -0.18 -2.63 117.51 118.02 2wcd h ILE 250 Ca 0.16 -0.52 0.12 0.00 1.00 0.00 0.00 64.86 65.62 2wcd h ILE 250 Cb 0.41 0.41 -0.09 0.00 -0.74 0.00 0.00 36.82 36.81 2wcd h ILE 250 CO 0.01 0.22 0.18 1.23 0.00 0.00 0.00 178.15 179.79 2wcd h GLY 251 N 0.92 0.88 0.11 5.37 0.00 0.53 -1.02 103.07 109.86 2wcd h GLY 251 Ca 0.21 -0.06 0.09 0.00 0.00 0.00 0.00 47.33 47.57 2wcd h GLY 251 CO -0.03 -0.11 -0.10 0.83 0.00 0.00 0.00 176.54 177.13 2wcd h GLU 252 N 0.31 0.02 0.48 4.80 4.39 -0.86 -1.45 114.58 122.27 2wcd h GLU 252 Ca 0.35 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 60.02 2wcd h GLU 252 Cb 0.52 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 2wcd h GLU 252 CO -0.41 0.01 -0.23 0.82 -1.16 0.00 0.00 179.01 178.04 2wcd h ILE 253 N 0.02 0.51 -0.86 3.13 2.04 -1.37 -2.86 117.51 118.11 2wcd h ILE 253 Ca 0.22 -0.19 0.08 0.00 1.00 0.00 0.00 64.86 65.97 2wcd h ILE 253 Cb 0.34 0.60 -0.10 0.00 -0.74 0.00 0.00 36.82 36.91 2wcd h ILE 253 CO -0.46 0.03 -0.51 1.17 0.00 0.00 0.00 178.15 178.39 2wcd n LYS 254 N -5.32 -0.38 -0.07 2.37 4.81 -0.48 -0.36 118.16 118.72 2wcd n LYS 254 Ca -0.11 1.35 -0.07 0.00 -0.87 0.00 0.00 58.31 58.61 2wcd n LYS 254 Cb 0.29 -1.99 -0.01 0.00 0.02 0.00 0.00 35.03 33.34 2wcd n LYS 254 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 2wcd h THR 255 N 0.00 0.76 -0.12 3.15 1.35 -1.26 0.51 112.91 117.31 2wcd h THR 255 Ca 0.14 -0.02 0.04 0.00 -0.55 0.00 0.00 66.41 66.02 2wcd h THR 255 Cb 0.35 0.71 -0.04 0.00 -1.73 0.00 0.00 68.15 67.44 2wcd h THR 255 CO -0.81 0.01 -0.14 -0.33 -0.25 0.00 0.00 175.52 173.99 2wcd h GLU 256 N 0.05 -0.17 0.11 4.72 4.39 -0.73 0.17 114.58 123.11 2wcd h GLU 256 Ca 0.14 0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.87 2wcd h GLU 256 Cb 0.19 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.84 2wcd h GLU 256 CO -0.26 -0.12 -0.31 1.15 -1.16 0.00 0.00 179.01 178.31 2wcd h THR 257 N -0.18 0.33 -0.99 1.13 2.02 0.20 -0.43 112.91 114.98 2wcd h THR 257 Ca 0.09 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.42 2wcd h THR 257 Cb 0.31 0.33 -0.10 0.00 -1.74 0.00 0.00 68.15 66.95 2wcd h THR 257 CO -0.23 0.00 0.61 -0.08 0.37 0.00 0.00 175.52 176.19 2wcd h GLU 258 N -0.53 0.84 0.37 6.66 4.81 0.43 -0.07 114.58 127.08 2wcd h GLU 258 Ca 0.03 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 2wcd h GLU 258 Cb 0.57 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.76 2wcd h GLU 258 CO -0.19 0.55 -0.18 1.15 -0.73 0.00 0.00 179.01 179.62 2wcd h THR 259 N 0.86 0.00 -0.77 0.32 2.02 0.09 -2.78 112.91 112.65 2wcd h THR 259 Ca 0.53 -0.03 0.18 0.00 0.77 0.00 0.00 66.41 67.86 2wcd h THR 259 Cb 0.68 0.00 -0.15 0.00 -1.74 0.00 0.00 68.15 66.94 2wcd h THR 259 CO -0.32 0.00 -0.08 0.41 0.37 0.00 0.00 175.52 175.89 2wcd n THR 260 N -3.43 -0.32 0.03 3.16 -1.04 -0.24 0.17 114.28 112.60 2wcd n THR 260 Ca -0.06 1.73 -0.13 0.00 -2.04 0.00 0.00 64.05 63.55 2wcd n THR 260 Cb 0.20 -2.46 -0.07 0.00 -1.82 0.00 0.00 70.33 66.18 2wcd n THR 260 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 2wcd h ARG 261 N 0.00 -0.52 -0.98 -2.82 9.65 -0.93 -1.32 114.38 117.46 2wcd h ARG 261 Ca 0.42 0.04 0.16 0.00 -1.10 0.00 0.00 59.98 59.49 2wcd h ARG 261 Cb 0.77 0.12 -0.10 0.00 -1.39 0.00 0.00 29.97 29.38 2wcd h ARG 261 CO -0.76 -0.35 0.60 0.74 2.80 0.00 0.00 179.97 183.00 2wcd h PHE 262 N -0.54 1.06 -0.88 2.20 0.04 0.01 -0.69 116.94 118.14 2wcd h PHE 262 Ca 0.06 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.87 2wcd h PHE 262 Cb 0.65 -0.32 -0.04 0.00 2.20 0.00 0.00 35.95 38.43 2wcd h PHE 262 CO -0.47 0.31 0.57 1.88 -0.60 0.00 0.00 178.31 180.01 2wcd h TYR 263 N 0.84 1.13 -0.79 -0.55 0.05 -0.46 0.14 116.97 117.32 2wcd h TYR 263 Ca 0.53 0.02 0.22 0.00 0.05 0.00 0.00 58.73 59.55 2wcd h TYR 263 Cb 0.70 -0.38 -0.04 0.00 1.01 0.00 0.00 36.73 38.03 2wcd h TYR 263 CO -0.02 0.72 0.56 0.28 -1.05 0.00 0.00 178.16 178.66 2wcd h VAL 264 N 1.20 0.62 0.00 -2.88 2.07 -0.05 -1.33 116.25 115.89 2wcd h VAL 264 Ca 0.32 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.82 2wcd h VAL 264 Cb -0.11 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 2wcd h VAL 264 CO -0.07 0.01 0.00 0.47 0.02 0.00 0.00 177.57 178.00 2wcd n ASP 265 N -4.33 0.16 0.18 0.57 9.92 0.47 -2.15 116.55 121.37 2wcd n ASP 265 Ca 0.16 0.55 0.05 0.00 -0.53 0.00 0.00 54.79 55.02 2wcd n ASP 265 Cb 0.83 -0.58 0.26 0.00 -0.64 0.00 0.00 41.12 40.99 2wcd n ASP 265 CO 0.00 0.00 0.00 1.88 0.13 0.00 0.00 177.20 179.21 2wcd h TYR 266 N 0.00 0.00 0.00 1.24 0.05 -1.31 -3.47 116.97 113.48 2wcd h TYR 266 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2wcd h TYR 266 Cb 0.18 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.92 2wcd h TYR 266 CO 0.00 0.41 0.00 -0.25 -1.05 0.00 0.00 178.16 177.27 2wcd n ASP 267 N -3.46 0.00 -4.56 3.88 9.92 -0.91 -4.96 116.55 116.45 2wcd n ASP 267 Ca 0.00 0.00 -0.24 0.00 -0.53 0.00 0.00 54.79 54.02 2wcd n ASP 267 Cb 0.56 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.99 2wcd n ASP 267 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2wcd s ASP 268 N 0.38 4.83 0.00 -2.24 -1.08 -1.26 -4.72 116.67 112.58 2wcd s ASP 268 Ca 0.00 -0.66 0.00 0.00 -0.52 0.00 0.00 52.55 51.37 2wcd s ASP 268 Cb 0.00 -2.56 0.00 0.00 -1.46 0.00 0.00 42.92 38.90 2wcd s ASP 268 CO 0.00 -3.07 0.71 0.18 0.52 0.00 0.00 175.17 173.51 2wcd n LEU 269 N 15.11 0.00 -0.27 -1.34 4.77 -1.26 -0.82 117.00 133.19 2wcd n LEU 269 Ca 0.42 0.24 0.04 0.00 -0.03 0.00 0.00 56.01 56.68 2wcd n LEU 269 Cb 0.46 -0.24 0.02 0.00 -2.33 0.00 0.00 43.42 41.33 2wcd n LEU 269 CO 0.60 -0.24 0.31 0.23 -1.33 0.00 0.00 177.39 176.96 2wcd n MET 270 N -1.21 0.92 -1.76 3.23 2.81 -1.26 -4.85 117.12 115.00 2wcd n MET 270 Ca 0.00 -0.82 -0.42 0.00 -1.81 0.00 0.00 57.70 54.65 2wcd n MET 270 Cb 0.03 -1.10 -0.03 0.00 -0.71 0.00 0.00 33.22 31.41 2wcd n MET 270 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 2wcd s LEU 271 N -0.98 4.37 0.22 4.03 0.20 0.00 -4.87 118.68 121.65 2wcd s LEU 271 Ca 0.08 2.84 -0.09 0.00 0.69 0.00 0.00 54.13 57.66 2wcd s LEU 271 Cb 0.07 -3.60 0.34 0.00 -0.43 0.00 0.00 46.19 42.57 2wcd s LEU 271 CO 0.14 -0.95 1.70 0.77 -0.29 0.00 0.00 176.35 177.72 2wcd h SER 272 N 6.69 -0.00 -0.01 3.68 4.64 -1.95 -1.04 113.55 125.55 2wcd h SER 272 Ca -0.43 0.12 0.01 0.00 -0.47 0.00 0.00 61.79 61.02 2wcd h SER 272 Cb 1.20 0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 63.43 2wcd h SER 272 CO 0.94 -0.01 -0.29 -0.07 -0.87 0.00 0.00 176.83 176.53 2wcd h LEU 273 N 0.26 -0.91 -1.60 5.97 3.38 -1.97 0.92 115.31 121.36 2wcd h LEU 273 Ca 0.34 0.10 0.16 0.00 0.09 0.00 0.00 57.88 58.58 2wcd h LEU 273 Cb 0.53 0.35 -0.05 0.00 0.09 0.00 0.00 40.66 41.58 2wcd h LEU 273 CO -0.44 -0.28 0.52 0.25 0.09 0.00 0.00 178.44 178.58 2wcd h LEU 274 N -0.36 0.36 0.02 1.67 5.85 -1.76 0.82 115.31 121.91 2wcd h LEU 274 Ca 0.01 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2wcd h LEU 274 Cb 0.39 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.37 2wcd h LEU 274 CO -0.20 0.18 -0.01 0.50 -0.34 0.00 0.00 178.44 178.56 2wcd h LYS 275 N 0.38 -0.02 0.28 1.25 1.63 0.13 -2.01 116.57 118.20 2wcd h LYS 275 Ca 0.39 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 60.17 2wcd h LYS 275 Cb 0.96 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.59 2wcd h LYS 275 CO -0.12 0.49 -0.13 0.93 -3.45 0.00 0.00 179.45 177.16 2wcd h GLU 276 N -0.54 -0.36 -0.91 1.90 4.39 0.24 -1.54 114.58 117.77 2wcd h GLU 276 Ca -0.00 0.02 0.25 0.00 0.34 0.00 0.00 59.36 59.98 2wcd h GLU 276 Cb 0.52 0.08 -0.15 0.00 -0.10 0.00 0.00 28.75 29.10 2wcd h GLU 276 CO 0.00 -0.23 0.25 0.00 -1.16 0.00 0.00 179.01 177.87 2wcd h ALA 277 N 0.34 1.36 -0.24 3.43 0.00 0.54 0.45 119.26 125.14 2wcd h ALA 277 Ca -0.04 0.24 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 2wcd h ALA 277 Cb 0.29 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2wcd h ALA 277 CO 0.06 -0.51 -0.29 0.00 0.00 0.00 0.00 179.25 178.51 2wcd h ALA 278 N 1.82 1.05 -0.21 0.00 0.00 -0.73 -0.50 119.26 120.69 2wcd h ALA 278 Ca 0.59 -0.37 -0.17 0.00 0.00 0.00 0.00 54.91 54.96 2wcd h ALA 278 Cb 1.23 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2wcd h ALA 278 CO -0.69 0.58 -0.51 0.87 0.00 0.00 0.00 179.25 179.50 2wcd h LYS 279 N 0.42 0.73 -0.10 0.00 1.57 0.66 -3.10 116.57 116.74 2wcd h LYS 279 Ca 0.06 -0.49 0.01 0.00 -1.87 0.00 0.00 60.65 58.35 2wcd h LYS 279 Cb 0.72 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.10 2wcd h LYS 279 CO 0.06 1.12 0.05 -0.22 -0.57 0.00 0.00 179.45 179.88 2wcd h LYS 280 N 0.44 0.10 -0.97 3.15 3.64 -0.11 -2.03 116.57 120.80 2wcd h LYS 280 Ca -0.00 -0.01 0.29 0.00 -1.27 0.00 0.00 60.65 59.66 2wcd h LYS 280 Cb 1.13 -0.02 -0.15 0.00 -0.41 0.00 0.00 32.23 32.78 2wcd h LYS 280 CO 0.11 0.07 0.47 0.52 -2.27 0.00 0.00 179.45 178.35 2wcd h MET 281 N 0.11 0.30 -0.15 1.90 2.86 -1.11 0.57 114.93 119.41 2wcd h MET 281 Ca 0.04 -0.02 -0.15 0.00 -2.06 0.00 0.00 59.70 57.52 2wcd h MET 281 Cb 0.01 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 2wcd h MET 281 CO -0.03 0.20 -0.53 0.82 1.06 0.00 0.00 176.91 178.42 2wcd h ILE 282 N 0.30 1.34 0.29 -1.22 2.04 -1.31 -0.97 117.51 117.98 2wcd h ILE 282 Ca 0.67 -1.79 -0.01 0.00 1.00 0.00 0.00 64.86 64.73 2wcd h ILE 282 Cb 1.47 1.81 0.00 0.00 -0.74 0.00 0.00 36.82 39.36 2wcd h ILE 282 CO -0.62 0.55 -0.14 0.78 0.00 0.00 0.00 178.15 178.72 2wcd h ASN 283 N 0.32 -0.33 -0.90 1.72 2.35 -0.20 -1.69 115.58 116.86 2wcd h ASN 283 Ca 0.01 0.01 0.29 0.00 -0.55 0.00 0.00 56.30 56.06 2wcd h ASN 283 Cb 1.04 0.08 -0.17 0.00 0.05 0.00 0.00 38.32 39.33 2wcd h ASN 283 CO 0.09 -0.09 0.17 0.41 -1.65 0.00 0.00 177.43 176.36 2wcd n THR 284 N -3.82 -0.38 0.19 2.81 -1.04 0.17 0.78 114.28 112.98 2wcd n THR 284 Ca -0.05 1.94 -0.15 0.00 -2.04 0.00 0.00 64.05 63.75 2wcd n THR 284 Cb 0.15 -2.93 -0.08 0.00 -1.82 0.00 0.00 70.33 65.65 2wcd n THR 284 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wcd h ASN 286 N -0.56 0.44 -0.12 0.00 -1.24 0.14 -0.28 115.58 113.94 2wcd h ASN 286 Ca -0.05 0.09 -0.09 0.00 0.71 0.00 0.00 56.30 56.97 2wcd h ASN 286 Cb 0.42 0.03 -0.02 0.00 0.73 0.00 0.00 38.32 39.48 2wcd h ASN 286 CO 0.07 0.19 -0.19 -0.33 -1.29 0.00 0.00 177.43 175.88 2wcd h GLU 287 N 0.56 0.53 -0.17 6.67 5.08 -1.11 -2.01 114.58 124.13 2wcd h GLU 287 Ca 0.43 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2wcd h GLU 287 Cb 0.61 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 2wcd h GLU 287 CO -0.37 0.69 0.09 -0.92 -1.00 0.00 0.00 179.01 177.50 2wcd h TYR 288 N 0.48 0.22 0.06 4.33 3.20 -0.63 -2.59 116.97 122.04 2wcd h TYR 288 Ca 0.08 0.00 -0.25 0.00 3.14 0.00 0.00 58.73 61.70 2wcd h TYR 288 Cb 0.59 -0.07 0.01 0.00 1.54 0.00 0.00 36.73 38.80 2wcd h TYR 288 CO 0.02 0.16 -1.07 1.96 -1.64 0.00 0.00 178.16 177.59 2wcd h GLN 289 N 0.24 0.39 0.15 1.82 1.08 -0.75 -1.34 115.11 116.70 2wcd h GLN 289 Ca 0.06 -0.49 -0.01 0.00 -1.45 0.00 0.00 58.65 56.76 2wcd h GLN 289 Cb 0.02 0.16 0.00 0.00 -0.05 0.00 0.00 27.48 27.61 2wcd h GLN 289 CO -0.01 1.17 -0.07 0.87 -0.95 0.00 0.00 178.83 179.84 2wcd h LYS 290 N 0.18 -0.20 -0.18 1.46 1.57 -1.32 -3.32 116.57 114.77 2wcd h LYS 290 Ca -0.11 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 2wcd h LYS 290 Cb 1.74 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 34.09 2wcd h LYS 290 CO 0.18 0.13 0.02 0.00 -0.57 0.00 0.00 179.45 179.22 2wcd h ARG 291 N -0.98 0.30 -0.01 3.15 3.08 -1.65 -3.52 114.38 114.75 2wcd h ARG 291 Ca -0.02 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.95 2wcd h ARG 291 Cb 0.42 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.44 2wcd h ARG 291 CO 0.03 0.47 0.00 1.58 -1.07 0.00 0.00 179.97 180.99