#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 0.67 0.17 -0.18 -1.04 -1.26 -4.61 114.28 108.02 2wcd n THR 9 Ca 0.00 -0.28 0.05 0.00 -2.04 0.00 0.00 64.05 61.78 2wcd n THR 9 Cb 0.00 -0.89 0.14 0.00 -1.82 0.00 0.00 70.33 67.76 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 0.70 0.00 12.58 3.04 -2.06 -3.30 116.25 127.21 2wcd h VAL 10 Ca -0.26 -1.83 0.00 0.00 -1.01 0.00 0.00 66.70 63.60 2wcd h VAL 10 Cb 1.44 2.23 0.00 0.00 -2.01 0.00 0.00 31.29 32.94 2wcd h VAL 10 CO -0.03 0.38 0.24 -0.08 -1.01 0.00 0.00 177.57 177.06 2wcd h GLU 11 N 0.00 0.00 -0.13 4.17 4.81 -2.00 0.17 114.58 121.60 2wcd h GLU 11 Ca -0.00 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 2wcd h GLU 11 Cb 1.19 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.57 2wcd h GLU 11 CO 0.05 0.00 -0.09 0.28 -0.73 0.00 0.00 179.01 178.52 2wcd h VAL 12 N 0.00 1.33 0.08 0.32 2.07 -1.89 -0.93 116.25 117.23 2wcd h VAL 12 Ca 0.00 -1.17 0.01 0.00 0.82 0.00 0.00 66.70 66.36 2wcd h VAL 12 Cb 0.47 1.82 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 2wcd h VAL 12 CO 0.00 0.34 -0.15 0.58 0.02 0.00 0.00 177.57 178.36 2wcd h VAL 13 N -0.07 0.65 -0.02 2.57 2.07 -0.93 0.33 116.25 120.85 2wcd h VAL 13 Ca 0.03 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.57 2wcd h VAL 13 Cb 0.57 0.65 -0.06 0.00 -1.52 0.00 0.00 31.29 30.94 2wcd h VAL 13 CO 0.02 0.00 -0.48 0.50 0.02 0.00 0.00 177.57 177.64 2wcd h LYS 14 N -0.29 -0.59 -0.93 1.57 3.64 -1.51 0.61 116.57 119.07 2wcd h LYS 14 Ca 0.03 0.04 0.13 0.00 -1.27 0.00 0.00 60.65 59.58 2wcd h LYS 14 Cb 0.31 0.13 -0.07 0.00 -0.41 0.00 0.00 32.23 32.19 2wcd h LYS 14 CO -0.09 -0.39 0.59 -0.97 -2.27 0.00 0.00 179.45 176.32 2wcd h ASN 15 N -0.61 0.77 -0.06 4.20 -1.24 -0.99 -1.22 115.58 116.43 2wcd h ASN 15 Ca 0.04 0.04 -0.19 0.00 0.71 0.00 0.00 56.30 56.90 2wcd h ASN 15 Cb 0.69 -0.11 0.00 0.00 0.73 0.00 0.00 38.32 39.63 2wcd h ASN 15 CO -0.35 0.40 -0.64 0.00 -1.29 0.00 0.00 177.43 175.55 2wcd h ALA 16 N 1.57 0.51 -0.43 1.57 0.00 -0.07 -1.05 119.26 121.36 2wcd h ALA 16 Ca 0.46 -0.55 0.06 0.00 0.00 0.00 0.00 54.91 54.88 2wcd h ALA 16 Cb 0.60 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 2wcd h ALA 16 CO -0.22 0.70 0.12 0.97 0.00 0.00 0.00 179.25 180.82 2wcd h ILE 17 N 0.50 0.82 -0.26 0.00 6.09 0.13 0.87 117.51 125.66 2wcd h ILE 17 Ca -0.01 -0.09 -0.12 0.00 -1.37 0.00 0.00 64.86 63.27 2wcd h ILE 17 Cb 1.23 0.52 -0.01 0.00 0.47 0.00 0.00 36.82 39.03 2wcd h ILE 17 CO 0.13 0.05 -0.33 -0.33 -3.07 0.00 0.00 178.15 174.59 2wcd h GLU 18 N 0.27 0.55 -0.29 2.19 5.08 -1.19 -1.55 114.58 119.65 2wcd h GLU 18 Ca 0.21 -0.25 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 2wcd h GLU 18 Cb 0.23 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 2wcd h GLU 18 CO -0.24 0.81 0.11 1.15 -1.00 0.00 0.00 179.01 179.84 2wcd h THR 19 N 0.47 0.93 -0.30 1.13 2.02 -0.51 -2.59 112.91 114.07 2wcd h THR 19 Ca 0.05 -0.08 -0.04 0.00 0.77 0.00 0.00 66.41 67.11 2wcd h THR 19 Cb 0.81 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 2wcd h THR 19 CO 0.07 0.04 0.02 0.00 0.37 0.00 0.00 175.52 176.02 2wcd h ALA 20 N 1.18 1.48 0.22 6.16 0.00 -0.46 -1.68 119.26 126.16 2wcd h ALA 20 Ca 0.13 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2wcd h ALA 20 Cb 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2wcd h ALA 20 CO -0.13 0.37 -0.11 0.22 0.00 0.00 0.00 179.25 179.61 2wcd h ASP 21 N 0.43 -0.25 -0.08 0.00 1.82 -0.91 -2.33 116.42 115.10 2wcd h ASP 21 Ca 0.10 0.01 0.02 0.00 -0.39 0.00 0.00 57.03 56.77 2wcd h ASP 21 Cb 0.26 0.07 -0.00 0.00 0.68 0.00 0.00 39.33 40.33 2wcd h ASP 21 CO 0.00 -0.18 0.44 1.23 -1.61 0.00 0.00 179.24 179.12 2wcd h GLY 22 N -0.29 0.00 0.72 -0.78 0.00 -1.47 -0.75 103.07 100.49 2wcd h GLY 22 Ca -0.03 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.27 2wcd h GLY 22 CO 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 176.54 176.24 2wcd h ALA 23 N 1.20 -1.16 -0.79 3.60 0.00 -0.78 -1.99 119.26 119.34 2wcd h ALA 23 Ca 0.04 -0.21 0.11 0.00 0.00 0.00 0.00 54.91 54.84 2wcd h ALA 23 Cb 0.91 0.37 -0.13 0.00 0.00 0.00 0.00 17.79 18.94 2wcd h ALA 23 CO -0.00 -1.09 -0.45 -0.07 0.00 0.00 0.00 179.25 177.64 2wcd h LEU 24 N -1.04 -1.61 -0.31 0.00 3.38 -0.68 0.14 115.31 115.19 2wcd h LEU 24 Ca -0.10 0.28 0.04 0.00 0.09 0.00 0.00 57.88 58.19 2wcd h LEU 24 Cb 0.74 0.76 -0.06 0.00 0.09 0.00 0.00 40.66 42.18 2wcd h LEU 24 CO 0.16 -0.30 -0.40 0.44 0.09 0.00 0.00 178.44 178.43 2wcd h ASP 25 N -0.11 -1.34 -1.00 -0.43 5.19 -1.40 0.34 116.42 117.66 2wcd h ASP 25 Ca 0.23 0.18 0.14 0.00 -0.62 0.00 0.00 57.03 56.95 2wcd h ASP 25 Cb 0.54 0.55 -0.09 0.00 0.18 0.00 0.00 39.33 40.51 2wcd h ASP 25 CO -0.83 -0.28 0.63 0.25 -3.12 0.00 0.00 179.24 175.89 2wcd h LEU 26 N -0.27 0.89 0.23 1.55 5.85 -0.93 0.14 115.31 122.76 2wcd h LEU 26 Ca 0.05 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.83 2wcd h LEU 26 Cb 0.42 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 2wcd h LEU 26 CO -0.43 0.44 -0.45 0.22 -0.34 0.00 0.00 178.44 177.88 2wcd h TYR 27 N 0.94 -1.27 0.54 1.25 3.20 0.24 -1.09 116.97 120.77 2wcd h TYR 27 Ca 0.51 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.38 2wcd h TYR 27 Cb 0.59 0.52 0.01 0.00 1.54 0.00 0.00 36.73 39.39 2wcd h TYR 27 CO -0.00 -0.53 -0.26 -0.91 -1.64 0.00 0.00 178.16 174.81 2wcd h ASN 28 N -0.73 -0.61 -0.85 -2.11 -0.26 -0.58 0.16 115.58 110.60 2wcd h ASN 28 Ca -0.02 0.01 0.25 0.00 -0.56 0.00 0.00 56.30 55.97 2wcd h ASN 28 Cb 0.68 0.16 -0.16 0.00 -1.06 0.00 0.00 38.32 37.95 2wcd h ASN 28 CO -0.17 -0.42 0.06 1.17 -1.06 0.00 0.00 177.43 177.01 2wcd n LYS 29 N -5.39 -0.07 -0.00 0.81 4.81 0.47 0.80 118.16 119.58 2wcd n LYS 29 Ca -0.12 1.26 -0.17 0.00 -0.87 0.00 0.00 58.31 58.41 2wcd n LYS 29 Cb 0.31 -2.03 -0.13 0.00 0.02 0.00 0.00 35.03 33.20 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 0.35 -0.93 5.64 3.20 -1.00 -2.97 116.97 121.27 2wcd h TYR 30 Ca 0.53 -0.23 0.20 0.00 3.14 0.00 0.00 58.73 62.38 2wcd h TYR 30 Cb 1.14 -0.03 -0.07 0.00 1.54 0.00 0.00 36.73 39.31 2wcd h TYR 30 CO -0.39 1.11 0.60 1.25 -1.64 0.00 0.00 178.16 179.10 2wcd h LEU 31 N -0.51 0.50 -0.02 2.82 5.85 0.31 0.25 115.31 124.51 2wcd h LEU 31 Ca -0.07 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 2wcd h LEU 31 Cb 1.27 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.26 2wcd h LEU 31 CO 0.08 0.20 -0.03 0.44 -0.34 0.00 0.00 178.44 178.79 2wcd h ASP 32 N 0.50 0.06 -0.78 1.25 3.32 0.31 0.28 116.42 121.36 2wcd h ASP 32 Ca 0.49 -0.56 0.22 0.00 0.02 0.00 0.00 57.03 57.20 2wcd h ASP 32 Cb 1.09 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 40.58 2wcd h ASP 32 CO -0.22 0.60 0.55 1.56 -1.72 0.00 0.00 179.24 180.02 2wcd h GLN 33 N -0.48 0.07 0.18 3.56 4.20 -0.92 -2.11 115.11 119.61 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 0.59 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.37 2wcd h GLN 33 CO 0.01 0.05 -1.64 0.28 -0.67 0.00 0.00 178.83 176.85 2wcd h VAL 34 N 0.08 1.06 -3.49 -0.54 2.07 -0.33 -3.36 116.25 111.74 2wcd h VAL 34 Ca 0.38 -2.62 -0.64 0.00 0.82 0.00 0.00 66.70 64.63 2wcd h VAL 34 Cb 1.39 2.82 -0.40 0.00 -1.52 0.00 0.00 31.29 33.57 2wcd h VAL 34 CO -0.03 0.84 -0.70 -0.63 0.02 0.00 0.00 177.57 177.07 2wcd s ILE 35 N -2.59 2.13 -0.72 4.57 1.01 0.95 -4.54 121.20 122.00 2wcd s ILE 35 Ca -0.13 -2.51 -0.05 0.00 0.00 0.00 0.00 60.65 57.96 2wcd s ILE 35 Cb 0.05 -2.54 -0.06 0.00 0.01 0.00 0.00 42.46 39.92 2wcd s ILE 35 CO 0.87 -0.69 2.06 -2.65 0.00 0.00 0.00 174.94 174.53 2wcd n PRO 36 N 3.96 1.81 -0.08 2.79 -0.02 -1.21 -4.54 135.00 137.71 2wcd n PRO 36 Ca 0.04 -1.26 0.01 0.00 -2.02 0.00 0.00 63.50 60.27 2wcd n PRO 36 Cb 0.39 -2.32 0.30 0.00 -0.02 0.00 0.00 33.50 31.85 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 6.10 0.70 0.25 6.00 2.91 -1.94 0.17 115.95 130.13 2wcd h TRP 37 Ca 0.41 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.41 2wcd h TRP 37 Cb 0.25 -0.22 -0.04 0.00 -0.51 0.00 0.00 29.16 28.64 2wcd h TRP 37 CO 1.88 0.53 -0.53 0.37 -1.03 0.00 0.00 178.44 179.66 2wcd h GLN 38 N 0.71 -0.81 -0.84 2.65 5.75 -1.93 0.46 115.11 121.10 2wcd h GLN 38 Ca 0.18 0.06 0.01 0.00 -0.15 0.00 0.00 58.65 58.74 2wcd h GLN 38 Cb 0.10 0.18 -0.04 0.00 1.07 0.00 0.00 27.48 28.79 2wcd h GLN 38 CO -0.02 -0.54 0.55 1.15 -2.65 0.00 0.00 178.83 177.32 2wcd h THR 39 N -0.84 1.20 0.50 2.39 2.02 -1.78 0.65 112.91 117.06 2wcd h THR 39 Ca -0.02 -0.39 -0.02 0.00 0.77 0.00 0.00 66.41 66.74 2wcd h THR 39 Cb 0.80 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 2wcd h THR 39 CO -0.22 0.21 -0.24 0.15 0.37 0.00 0.00 175.52 175.79 2wcd h PHE 40 N 1.13 -0.63 0.11 3.16 3.57 -0.40 -0.03 116.94 123.85 2wcd h PHE 40 Ca 0.31 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.82 2wcd h PHE 40 Cb -0.11 0.21 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 2wcd h PHE 40 CO -0.01 -0.34 -0.31 0.22 -2.23 0.00 0.00 178.31 175.63 2wcd h ASP 41 N -0.80 -0.90 -0.60 0.41 1.82 0.09 -0.89 116.42 115.54 2wcd h ASP 41 Ca -0.07 0.11 0.12 0.00 -0.39 0.00 0.00 57.03 56.80 2wcd h ASP 41 Cb 0.57 0.34 -0.11 0.00 0.68 0.00 0.00 39.33 40.82 2wcd h ASP 41 CO 0.11 -0.40 -0.05 -0.33 -1.61 0.00 0.00 179.24 176.96 2wcd h GLU 42 N -0.53 0.07 -0.66 0.28 5.08 -0.86 0.11 114.58 118.07 2wcd h GLU 42 Ca 0.03 -0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2wcd h GLU 42 Cb 0.56 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.77 2wcd h GLU 42 CO -0.19 0.05 0.44 0.00 -1.00 0.00 0.00 179.01 178.30 2wcd h THR 43 N 0.07 1.16 0.06 1.13 1.03 -0.47 -2.32 112.91 113.56 2wcd h THR 43 Ca 0.31 -0.30 -0.00 0.00 -0.01 0.00 0.00 66.41 66.40 2wcd h THR 43 Cb 0.49 0.21 0.00 0.00 -1.07 0.00 0.00 68.15 67.78 2wcd h THR 43 CO -0.55 0.16 -0.03 0.40 -0.01 0.00 0.00 175.52 175.49 2wcd h ILE 44 N 0.88 1.09 0.22 0.00 1.08 0.39 -3.14 117.51 118.03 2wcd h ILE 44 Ca 0.24 -0.50 -0.00 0.00 -0.39 0.00 0.00 64.86 64.21 2wcd h ILE 44 Cb -0.08 1.43 -0.02 0.00 -3.07 0.00 0.00 36.82 35.07 2wcd h ILE 44 CO -0.06 0.13 -0.35 0.11 -0.69 0.00 0.00 178.15 177.30 2wcd h LYS 45 N -0.30 -0.58 -0.97 2.37 1.57 -0.84 -0.16 116.57 117.67 2wcd h LYS 45 Ca -0.01 0.04 0.23 0.00 -1.87 0.00 0.00 60.65 59.04 2wcd h LYS 45 Cb 0.27 0.13 -0.08 0.00 0.08 0.00 0.00 32.23 32.63 2wcd h LYS 45 CO 0.01 -0.39 0.63 1.49 -0.57 0.00 0.00 179.45 180.63 2wcd h GLU 46 N -0.60 0.39 -0.00 3.15 4.81 -1.53 1.09 114.58 121.89 2wcd h GLU 46 Ca -0.03 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2wcd h GLU 46 Cb 0.55 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.84 2wcd h GLU 46 CO -0.11 0.26 -0.33 1.47 -0.73 0.00 0.00 179.01 179.57 2wcd n LEU 47 N -4.55 0.58 0.01 1.64 -0.00 -1.10 -2.48 117.00 111.11 2wcd n LEU 47 Ca 0.22 -0.01 -0.18 0.00 -0.00 0.00 0.00 56.01 56.03 2wcd n LEU 47 Cb 0.78 -0.23 -0.13 0.00 -0.00 0.00 0.00 43.42 43.83 2wcd n LEU 47 CO 0.29 0.12 0.18 -1.28 -0.00 0.00 0.00 177.39 176.70 2wcd h SER 48 N 0.38 0.37 -0.74 1.45 0.87 0.29 -3.20 113.55 112.97 2wcd h SER 48 Ca 0.00 -0.91 0.17 0.00 -1.23 0.00 0.00 61.79 59.82 2wcd h SER 48 Cb 0.48 -0.12 -0.12 0.00 -0.44 0.00 0.00 62.40 62.21 2wcd h SER 48 CO 0.00 1.25 0.12 -0.09 -0.53 0.00 0.00 176.83 177.58 2wcd h ARG 49 N -0.45 0.20 -0.03 2.24 2.43 -0.35 0.20 114.38 118.62 2wcd h ARG 49 Ca -0.09 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.08 2wcd h ARG 49 Cb 1.40 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 30.86 2wcd h ARG 49 CO 0.11 0.13 -0.44 0.35 -1.51 0.00 0.00 179.97 178.61 2wcd h PHE 50 N 0.21 -1.31 -0.91 2.20 3.57 -1.55 0.29 116.94 119.43 2wcd h PHE 50 Ca 0.42 0.04 0.21 0.00 3.53 0.00 0.00 57.97 62.18 2wcd h PHE 50 Cb 0.74 0.58 -0.07 0.00 2.79 0.00 0.00 35.95 39.99 2wcd h PHE 50 CO -0.31 -0.47 0.61 -0.22 -2.23 0.00 0.00 178.31 175.69 2wcd h LYS 51 N -0.53 0.35 0.00 1.11 3.64 -1.36 -2.84 116.57 116.94 2wcd h LYS 51 Ca 0.01 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2wcd h LYS 51 Cb 0.58 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 2wcd h LYS 51 CO -0.31 0.23 0.00 0.94 -2.27 0.00 0.00 179.45 178.04 2wcd n GLN 52 N -4.49 0.00 -0.34 1.90 -0.06 0.00 -2.47 117.38 111.91 2wcd n GLN 52 Ca 0.20 0.44 0.15 0.00 -2.00 0.00 0.00 57.00 55.78 2wcd n GLN 52 Cb 0.74 -1.14 0.29 0.00 -4.06 0.00 0.00 30.24 26.07 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 0.01 -0.28 3.69 5.08 -0.45 0.21 114.58 122.84 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 29.25 2wcd h GLU 53 CO 0.00 0.01 -0.34 1.88 -1.00 0.00 0.00 179.01 179.55 2wcd h TYR 54 N 0.01 0.89 -0.42 4.33 0.05 -1.65 -2.06 116.97 118.12 2wcd h TYR 54 Ca 0.60 -0.28 0.07 0.00 0.05 0.00 0.00 58.73 59.17 2wcd h TYR 54 Cb 1.24 -0.18 -0.09 0.00 1.01 0.00 0.00 36.73 38.70 2wcd h TYR 54 CO -0.50 1.05 -0.44 1.03 -1.05 0.00 0.00 178.16 178.25 2wcd h SER 55 N 0.47 -1.46 -0.43 3.88 0.87 -0.34 0.28 113.55 116.83 2wcd h SER 55 Ca 0.04 0.22 0.04 0.00 -1.23 0.00 0.00 61.79 60.86 2wcd h SER 55 Cb 0.93 0.64 -0.06 0.00 -0.44 0.00 0.00 62.40 63.46 2wcd h SER 55 CO 0.08 -0.37 -0.35 -0.61 -0.53 0.00 0.00 176.83 175.06 2wcd h GLN 56 N -0.32 -0.11 0.09 2.24 5.75 -0.93 0.16 115.11 121.98 2wcd h GLN 56 Ca 0.14 0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.64 2wcd h GLN 56 Cb 0.58 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.15 2wcd h GLN 56 CO -0.58 -0.07 -0.15 0.00 -2.65 0.00 0.00 178.83 175.37 2wcd h ALA 57 N -0.31 -0.78 -0.78 3.38 0.00 -0.80 -1.98 119.26 117.99 2wcd h ALA 57 Ca 0.07 -0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.11 2wcd h ALA 57 Cb 0.30 0.48 -0.14 0.00 0.00 0.00 0.00 17.79 18.43 2wcd h ALA 57 CO -0.47 -0.80 -0.10 0.00 0.00 0.00 0.00 179.25 177.89 2wcd h ALA 58 N -1.39 0.67 -0.03 0.00 0.00 -0.85 -0.14 119.26 117.52 2wcd h ALA 58 Ca -0.01 0.28 0.01 0.00 0.00 0.00 0.00 54.91 55.19 2wcd h ALA 58 Cb 0.24 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2wcd h ALA 58 CO -0.05 -0.43 -0.19 0.77 0.00 0.00 0.00 179.25 179.36 2wcd h SER 59 N 0.04 -0.58 -0.91 0.00 0.02 -0.37 0.74 113.55 112.50 2wcd h SER 59 Ca 0.40 0.07 0.08 0.00 -0.84 0.00 0.00 61.79 61.50 2wcd h SER 59 Cb 0.68 0.23 -0.06 0.00 0.14 0.00 0.00 62.40 63.38 2wcd h SER 59 CO -0.75 -0.17 0.59 1.62 -1.14 0.00 0.00 176.83 176.98 2wcd h VAL 60 N -0.21 1.03 0.64 2.27 3.04 -0.60 0.11 116.25 122.53 2wcd h VAL 60 Ca 0.01 -0.34 -0.03 0.00 -1.01 0.00 0.00 66.70 65.33 2wcd h VAL 60 Cb 0.24 -0.04 0.01 0.00 -2.01 0.00 0.00 31.29 29.48 2wcd h VAL 60 CO -0.14 0.18 -0.31 0.25 -1.01 0.00 0.00 177.57 176.55 2wcd h LEU 61 N 0.99 -0.73 -1.91 3.16 5.85 -0.69 -0.66 115.31 121.34 2wcd h LEU 61 Ca 0.40 0.00 0.32 0.00 0.84 0.00 0.00 57.88 59.44 2wcd h LEU 61 Cb 0.27 0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 2wcd h LEU 61 CO -0.16 -0.34 0.79 0.58 -0.34 0.00 0.00 178.44 178.96 2wcd h VAL 62 N -1.19 0.45 -0.02 1.05 2.07 0.78 0.14 116.25 119.54 2wcd h VAL 62 Ca -0.09 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 2wcd h VAL 62 Cb 0.68 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2wcd h VAL 62 CO 0.14 0.01 -0.04 1.23 0.02 0.00 0.00 177.57 178.93 2wcd h GLY 63 N 0.06 0.06 0.48 2.17 0.00 -0.59 -2.76 103.07 102.48 2wcd h GLY 63 Ca 0.54 -0.08 0.06 0.00 0.00 0.00 0.00 47.33 47.86 2wcd h GLY 63 CO -0.05 0.07 0.05 -0.55 0.00 0.00 0.00 176.54 176.06 2wcd h ASP 64 N -0.52 -0.05 -0.88 0.19 3.32 0.65 -0.68 116.42 118.45 2wcd h ASP 64 Ca -0.00 0.07 0.20 0.00 0.02 0.00 0.00 57.03 57.32 2wcd h ASP 64 Cb 0.65 0.11 -0.12 0.00 0.22 0.00 0.00 39.33 40.19 2wcd h ASP 64 CO 0.01 0.01 0.40 0.40 -1.72 0.00 0.00 179.24 178.34 2wcd h ILE 65 N 0.17 0.54 0.41 0.35 1.08 -0.86 0.20 117.51 119.39 2wcd h ILE 65 Ca 0.19 -0.16 -0.02 0.00 -0.39 0.00 0.00 64.86 64.48 2wcd h ILE 65 Cb 0.24 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.03 2wcd h ILE 65 CO -0.27 0.08 -0.19 0.50 -0.69 0.00 0.00 178.15 177.58 2wcd h LYS 66 N 0.45 -0.52 -0.91 2.37 3.64 -0.86 0.26 116.57 121.00 2wcd h LYS 66 Ca 0.53 0.04 0.13 0.00 -1.27 0.00 0.00 60.65 60.08 2wcd h LYS 66 Cb 0.96 0.12 -0.14 0.00 -0.41 0.00 0.00 32.23 32.76 2wcd h LYS 66 CO -0.49 -0.25 -0.44 1.15 -2.27 0.00 0.00 179.45 177.16 2wcd h THR 67 N -0.75 0.02 -0.47 1.00 2.02 -0.36 0.42 112.91 114.79 2wcd h THR 67 Ca -0.06 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.19 2wcd h THR 67 Cb 0.52 0.02 -0.05 0.00 -1.74 0.00 0.00 68.15 66.90 2wcd h THR 67 CO 0.09 0.00 0.16 -0.07 0.37 0.00 0.00 175.52 176.07 2wcd h LEU 68 N -0.05 0.16 0.19 2.58 4.07 -0.22 0.49 115.31 122.53 2wcd h LEU 68 Ca 0.27 0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.29 2wcd h LEU 68 Cb 0.55 0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.32 2wcd h LEU 68 CO -0.91 0.12 -0.17 -0.07 -1.08 0.00 0.00 178.44 176.32 2wcd h LEU 69 N 0.33 -0.45 -0.82 1.67 3.38 0.13 -1.31 115.31 118.24 2wcd h LEU 69 Ca 0.22 0.04 0.07 0.00 0.09 0.00 0.00 57.88 58.30 2wcd h LEU 69 Cb 0.23 0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 2wcd h LEU 69 CO -0.23 -0.26 0.49 0.24 0.09 0.00 0.00 178.44 178.77 2wcd h MET 70 N -0.38 0.86 -0.14 1.13 2.86 0.46 -1.63 114.93 118.09 2wcd h MET 70 Ca -0.00 -0.05 0.05 0.00 -2.06 0.00 0.00 59.70 57.63 2wcd h MET 70 Cb 0.36 -0.19 -0.06 0.00 0.06 0.00 0.00 31.60 31.76 2wcd h MET 70 CO -0.03 0.57 -0.27 -0.44 1.06 0.00 0.00 176.91 177.80 2wcd h ASP 71 N 0.89 -0.82 0.11 1.22 3.32 0.31 -2.57 116.42 118.87 2wcd h ASP 71 Ca 0.37 0.13 0.02 0.00 0.02 0.00 0.00 57.03 57.56 2wcd h ASP 71 Cb 0.21 0.36 -0.05 0.00 0.22 0.00 0.00 39.33 40.08 2wcd h ASP 71 CO -0.19 -0.31 -0.49 -1.28 -1.72 0.00 0.00 179.24 175.25 2wcd h SER 72 N -0.33 -1.46 -0.95 6.45 0.87 -0.60 -2.06 113.55 115.48 2wcd h SER 72 Ca 0.10 0.16 0.13 0.00 -1.23 0.00 0.00 61.79 60.96 2wcd h SER 72 Cb 0.49 0.54 -0.15 0.00 -0.44 0.00 0.00 62.40 62.84 2wcd h SER 72 CO -0.33 -0.53 -0.43 -0.61 -0.53 0.00 0.00 176.83 174.40 2wcd h GLN 73 N -0.71 -0.03 -0.47 2.24 5.75 -1.05 0.67 115.11 121.51 2wcd h GLN 73 Ca 0.01 0.00 0.06 0.00 -0.15 0.00 0.00 58.65 58.57 2wcd h GLN 73 Cb 0.73 0.01 -0.05 0.00 1.07 0.00 0.00 27.48 29.24 2wcd h GLN 73 CO -0.28 -0.02 0.19 -0.44 -2.65 0.00 0.00 178.83 175.63 2wcd h ASP 74 N -0.03 0.22 -0.35 -0.69 3.45 -1.25 -0.64 116.42 117.14 2wcd h ASP 74 Ca 0.29 0.05 -0.04 0.00 0.43 0.00 0.00 57.03 57.76 2wcd h ASP 74 Cb 0.56 0.02 -0.02 0.00 -0.56 0.00 0.00 39.33 39.32 2wcd h ASP 74 CO -0.94 0.16 0.11 0.11 -1.57 0.00 0.00 179.24 177.11 2wcd h LYS 75 N 0.37 0.62 0.27 3.56 1.57 0.80 -1.12 116.57 122.65 2wcd h LYS 75 Ca 0.22 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 2wcd h LYS 75 Cb 0.19 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.40 2wcd h LYS 75 CO -0.20 0.56 -0.13 -0.92 -0.57 0.00 0.00 179.45 178.19 2wcd h TYR 76 N 0.61 -0.34 -0.31 -1.35 3.20 0.55 -1.94 116.97 117.39 2wcd h TYR 76 Ca 0.14 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.05 2wcd h TYR 76 Cb 0.22 0.11 -0.08 0.00 1.54 0.00 0.00 36.73 38.52 2wcd h TYR 76 CO 0.01 -0.10 -0.52 0.35 -1.64 0.00 0.00 178.16 176.26 2wcd h PHE 77 N -0.53 -1.55 -0.25 -3.82 3.57 -0.78 0.15 116.94 113.72 2wcd h PHE 77 Ca -0.04 0.07 0.02 0.00 3.53 0.00 0.00 57.97 61.56 2wcd h PHE 77 Cb 0.39 0.72 -0.04 0.00 2.79 0.00 0.00 35.95 39.82 2wcd h PHE 77 CO -0.01 -0.50 -0.20 1.49 -2.23 0.00 0.00 178.31 176.85 2wcd h GLU 78 N -0.45 -0.07 -0.53 1.11 4.81 -1.24 0.43 114.58 118.65 2wcd h GLU 78 Ca 0.08 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.37 2wcd h GLU 78 Cb 0.62 0.02 -0.09 0.00 0.63 0.00 0.00 28.75 29.93 2wcd h GLU 78 CO -0.53 -0.04 -0.55 0.00 -0.73 0.00 0.00 179.01 177.15 2wcd h ALA 79 N -0.65 -0.72 -0.36 2.92 0.00 -0.60 0.39 119.26 120.23 2wcd h ALA 79 Ca 0.04 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.00 2wcd h ALA 79 Cb 0.18 1.18 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 2wcd h ALA 79 CO -0.27 -1.02 0.19 1.79 0.00 0.00 0.00 179.25 179.94 2wcd h THR 80 N -0.30 1.01 0.18 0.00 1.35 -0.47 -1.90 112.91 112.78 2wcd h THR 80 Ca 0.09 -0.14 -0.00 0.00 -0.55 0.00 0.00 66.41 65.81 2wcd h THR 80 Cb 0.54 0.58 -0.00 0.00 -1.73 0.00 0.00 68.15 67.54 2wcd h THR 80 CO -0.66 0.07 -0.11 -0.61 -0.25 0.00 0.00 175.52 173.96 2wcd h GLN 81 N 0.40 -0.28 -0.71 4.72 -0.00 0.10 0.21 115.11 119.55 2wcd h GLN 81 Ca 0.15 0.02 0.14 0.00 -0.00 0.00 0.00 58.65 58.95 2wcd h GLN 81 Cb 0.03 0.06 -0.13 0.00 0.00 0.00 0.00 27.48 27.44 2wcd h GLN 81 CO -0.08 -0.19 -0.25 1.15 0.00 0.00 0.00 178.83 179.46 2wcd h THR 82 N -0.29 0.21 0.83 2.39 2.02 -0.10 -0.27 112.91 117.70 2wcd h THR 82 Ca -0.02 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.13 2wcd h THR 82 Cb 0.24 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 66.86 2wcd h THR 82 CO 0.01 0.00 -0.47 0.58 0.37 0.00 0.00 175.52 176.01 2wcd h VAL 83 N -0.05 0.05 -1.40 3.16 2.07 -0.52 -2.59 116.25 116.97 2wcd h VAL 83 Ca 0.32 0.00 0.41 0.00 0.82 0.00 0.00 66.70 68.24 2wcd h VAL 83 Cb 0.55 0.05 -0.06 0.00 -1.52 0.00 0.00 31.29 30.32 2wcd h VAL 83 CO -0.76 0.00 1.00 0.22 0.02 0.00 0.00 177.57 178.05 2wcd h TYR 84 N -1.20 0.03 0.16 1.57 3.20 0.27 0.51 116.97 121.51 2wcd h TYR 84 Ca -0.11 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.75 2wcd h TYR 84 Cb 0.95 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.22 2wcd h TYR 84 CO -0.07 -0.00 -0.08 0.93 -1.64 0.00 0.00 178.16 177.29 2wcd h GLU 85 N 0.01 -0.21 -0.01 1.82 5.08 -0.75 -3.09 114.58 117.43 2wcd h GLU 85 Ca 0.67 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 59.04 2wcd h GLU 85 Cb 2.66 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 31.96 2wcd h GLU 85 CO -0.02 0.22 -0.00 2.35 -1.00 0.00 0.00 179.01 180.55 2wcd h TRP 86 N -0.82 0.01 0.00 4.33 7.01 -0.61 -2.23 115.95 123.64 2wcd h TRP 86 Ca -0.02 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.98 2wcd h TRP 86 Cb 0.53 -0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.58 2wcd h TRP 86 CO 0.08 0.35 0.28 0.00 -2.79 0.00 0.00 178.44 176.36 2wcd n GLY 88 N -1.28 -0.46 0.24 0.00 0.00 -0.88 -3.32 105.19 99.49 2wcd n GLY 88 Ca -0.01 -0.13 -0.04 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.79 1.06 -0.10 1.61 3.04 -0.93 -3.19 116.25 116.96 2wcd h VAL 89 Ca -0.66 -0.25 0.04 0.00 -1.01 0.00 0.00 66.70 64.83 2wcd h VAL 89 Cb 1.66 0.28 -0.06 0.00 -2.01 0.00 0.00 31.29 31.16 2wcd h VAL 89 CO -0.34 0.13 -0.39 0.00 -1.01 0.00 0.00 177.57 175.96 2wcd h ALA 90 N 1.27 -0.55 -0.71 3.17 0.00 -1.10 -2.48 119.26 118.86 2wcd h ALA 90 Ca 0.25 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.28 2wcd h ALA 90 Cb 0.04 0.73 -0.09 0.00 0.00 0.00 0.00 17.79 18.46 2wcd h ALA 90 CO -0.11 -0.90 0.25 1.15 0.00 0.00 0.00 179.25 179.64 2wcd h THR 91 N -0.49 0.65 -0.76 0.00 2.02 -1.54 0.27 112.91 113.06 2wcd h THR 91 Ca 0.07 -0.13 0.11 0.00 0.77 0.00 0.00 66.41 67.23 2wcd h THR 91 Cb 0.61 0.23 -0.08 0.00 -1.74 0.00 0.00 68.15 67.17 2wcd h THR 91 CO -0.37 0.07 0.37 1.56 0.37 0.00 0.00 175.52 177.53 2wcd h GLN 92 N 0.39 0.58 -0.03 6.66 4.20 -1.47 -0.00 115.11 125.44 2wcd h GLN 92 Ca 0.39 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 59.03 2wcd h GLN 92 Cb 0.58 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.23 2wcd h GLN 92 CO -0.40 0.38 -0.09 -0.07 -0.67 0.00 0.00 178.83 177.98 2wcd h LEU 93 N 0.60 0.13 -1.00 1.46 3.38 -0.19 -0.11 115.31 119.57 2wcd h LEU 93 Ca 0.39 -0.64 0.09 0.00 0.09 0.00 0.00 57.88 57.82 2wcd h LEU 93 Cb 0.47 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 41.10 2wcd h LEU 93 CO -0.31 0.74 0.64 -0.07 0.09 0.00 0.00 178.44 179.53 2wcd h LEU 94 N -0.48 0.98 -0.54 1.67 -0.00 -0.90 0.23 115.31 116.27 2wcd h LEU 94 Ca -0.00 0.03 -0.04 0.00 -0.00 0.00 0.00 57.88 57.87 2wcd h LEU 94 Cb 0.73 -0.17 -0.02 0.00 -0.00 0.00 0.00 40.66 41.20 2wcd h LEU 94 CO 0.02 0.57 0.20 0.00 -0.00 0.00 0.00 178.44 179.22 2wcd h ALA 95 N 1.50 0.70 -0.19 1.53 0.00 -0.84 -0.33 119.26 121.64 2wcd h ALA 95 Ca 0.47 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2wcd h ALA 95 Cb 0.34 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2wcd h ALA 95 CO -0.22 0.34 0.07 0.00 0.00 0.00 0.00 179.25 179.44 2wcd h ALA 96 N 1.05 0.24 -0.62 0.00 0.00 -0.21 -1.83 119.26 117.89 2wcd h ALA 96 Ca 0.18 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.04 2wcd h ALA 96 Cb 0.23 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 2wcd h ALA 96 CO -0.01 -0.17 0.31 -0.92 0.00 0.00 0.00 179.25 178.47 2wcd h TYR 97 N 0.15 0.57 -0.44 0.00 3.20 -0.24 0.31 116.97 120.53 2wcd h TYR 97 Ca 0.06 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 2wcd h TYR 97 Cb 0.18 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 2wcd h TYR 97 CO -0.01 0.25 0.24 0.82 -1.64 0.00 0.00 178.16 177.82 2wcd h ILE 98 N 0.58 1.14 0.04 1.81 1.08 -0.92 -2.53 117.51 118.71 2wcd h ILE 98 Ca 0.28 -0.35 -0.00 0.00 -0.39 0.00 0.00 64.86 64.40 2wcd h ILE 98 Cb 0.22 0.55 0.00 0.00 -3.07 0.00 0.00 36.82 34.52 2wcd h ILE 98 CO -0.20 0.15 -0.02 0.25 -0.69 0.00 0.00 178.15 177.64 2wcd h LEU 99 N 0.61 -0.04 -1.91 1.44 5.85 -0.31 -3.30 115.31 117.64 2wcd h LEU 99 Ca 0.16 -0.31 0.00 0.00 0.84 0.00 0.00 57.88 58.57 2wcd h LEU 99 Cb 0.02 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.06 2wcd h LEU 99 CO -0.03 0.60 0.00 -0.07 -0.34 0.00 0.00 178.44 178.60 2wcd h LEU 100 N -1.00 0.00 -3.75 2.25 3.38 -0.46 -2.32 115.31 113.41 2wcd h LEU 100 Ca -0.01 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.43 2wcd h LEU 100 Cb 0.35 0.00 -0.37 0.00 0.09 0.00 0.00 40.66 40.73 2wcd h LEU 100 CO 0.01 0.00 -0.42 0.49 0.09 0.00 0.00 178.44 178.60 2wcd n PHE 101 N -2.75 2.65 0.49 1.13 3.72 -0.95 -4.32 117.46 117.42 2wcd n PHE 101 Ca -0.01 -2.32 -0.20 0.00 -0.05 0.00 0.00 57.45 54.87 2wcd n PHE 101 Cb 0.14 -0.57 -0.10 0.00 -0.94 0.00 0.00 39.48 38.01 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 2.03 -1.20 -3.25 4.37 3.58 -1.49 -3.40 116.42 117.07 2wcd h ASP 102 Ca 0.40 0.05 -0.66 0.00 0.42 0.00 0.00 57.03 57.25 2wcd h ASP 102 Cb 1.38 0.33 -0.16 0.00 1.72 0.00 0.00 39.33 42.61 2wcd h ASP 102 CO 0.88 -0.79 -0.60 -1.61 -2.88 0.00 0.00 179.24 174.23 2wcd s GLU 103 N -5.94 3.40 -0.06 0.28 2.02 -1.26 -5.05 118.70 112.09 2wcd s GLU 103 Ca -0.19 -0.38 -0.38 0.00 0.02 0.00 0.00 54.97 54.03 2wcd s GLU 103 Cb 0.02 -2.96 -0.16 0.00 0.10 0.00 0.00 34.13 31.14 2wcd s GLU 103 CO 0.60 0.52 1.52 0.98 0.02 0.00 0.00 175.26 178.90 2wcd n TYR 104 N 2.71 1.77 -3.37 1.61 9.36 -1.26 -4.92 117.16 123.06 2wcd n TYR 104 Ca -0.18 0.56 -0.45 0.00 3.32 0.00 0.00 57.90 61.16 2wcd n TYR 104 Cb 0.53 -2.40 -0.06 0.00 -0.63 0.00 0.00 39.34 36.78 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 1.79 6.08 0.46 2.98 3.84 -1.26 -4.95 114.94 123.88 2wcd s ASN 105 Ca 0.90 -1.77 0.14 0.00 0.21 0.00 0.00 52.86 52.34 2wcd s ASN 105 Cb -0.98 -2.16 1.06 0.00 -0.55 0.00 0.00 41.25 38.61 2wcd s ASN 105 CO 0.54 -0.80 2.04 -0.08 -2.79 0.00 0.00 177.10 176.01 2wcd h GLU 106 N 8.78 0.07 0.01 0.43 4.81 -1.96 -1.33 114.58 125.39 2wcd h GLU 106 Ca -0.28 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 58.86 2wcd h GLU 106 Cb 1.09 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 2wcd h GLU 106 CO 0.98 0.16 -0.41 0.87 -0.73 0.00 0.00 179.01 179.88 2wcd h LYS 107 N 0.07 0.02 0.00 1.92 1.79 -2.02 -3.25 116.57 115.09 2wcd h LYS 107 Ca 0.01 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 2wcd h LYS 107 Cb 0.19 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 2wcd h LYS 107 CO 0.01 1.02 0.00 1.63 -1.08 0.00 0.00 179.45 181.03 2wcd n LYS 108 N -4.51 0.19 -0.16 3.15 5.02 -1.18 -4.00 118.16 116.68 2wcd n LYS 108 Ca -0.16 0.11 -0.02 0.00 -2.02 0.00 0.00 58.31 56.21 2wcd n LYS 108 Cb 0.56 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 34.13 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 2.90 0.48 -0.51 7.82 0.00 -1.27 0.10 119.26 128.78 2wcd h ALA 109 Ca 0.00 0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 2wcd h ALA 109 Cb 0.26 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2wcd h ALA 109 CO 0.00 -0.38 0.07 0.66 0.00 0.00 0.00 179.25 179.60 2wcd h SER 110 N 0.13 0.83 0.58 0.00 4.64 -1.80 -2.55 113.55 115.37 2wcd h SER 110 Ca 0.25 -0.27 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 2wcd h SER 110 Cb 0.38 -0.22 0.01 0.00 -0.31 0.00 0.00 62.40 62.25 2wcd h SER 110 CO -0.41 0.89 -0.28 0.00 -0.87 0.00 0.00 176.83 176.16 2wcd h ALA 111 N 0.97 -0.77 -0.99 5.18 0.00 -1.65 -2.29 119.26 119.71 2wcd h ALA 111 Ca 0.15 -0.19 0.30 0.00 0.00 0.00 0.00 54.91 55.17 2wcd h ALA 111 Cb 0.42 0.30 -0.14 0.00 0.00 0.00 0.00 17.79 18.36 2wcd h ALA 111 CO 0.01 -0.88 0.54 0.37 0.00 0.00 0.00 179.25 179.29 2wcd h GLN 112 N -0.89 0.35 0.28 0.00 5.75 -0.76 0.83 115.11 120.67 2wcd h GLN 112 Ca -0.08 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.39 2wcd h GLN 112 Cb 0.63 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.11 2wcd h GLN 112 CO 0.13 0.23 -0.14 -0.22 -2.65 0.00 0.00 178.83 176.18 2wcd h LYS 113 N 0.36 -0.37 -0.57 1.69 3.11 -1.32 0.18 116.57 119.65 2wcd h LYS 113 Ca 0.70 0.03 0.06 0.00 -2.81 0.00 0.00 60.65 58.63 2wcd h LYS 113 Cb 1.53 0.08 -0.06 0.00 -1.00 0.00 0.00 32.23 32.79 2wcd h LYS 113 CO -0.59 -0.11 0.27 -0.44 -2.81 0.00 0.00 179.45 175.77 2wcd h ASP 114 N -0.59 0.35 0.84 4.20 5.19 0.41 -1.08 116.42 125.73 2wcd h ASP 114 Ca -0.04 0.05 -0.04 0.00 -0.62 0.00 0.00 57.03 56.38 2wcd h ASP 114 Cb 0.43 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.93 2wcd h ASP 114 CO 0.06 0.23 -0.47 0.40 -3.12 0.00 0.00 179.24 176.35 2wcd h ILE 115 N 0.50 0.06 -0.99 0.35 2.04 0.50 -1.13 117.51 118.84 2wcd h ILE 115 Ca 0.26 0.00 0.32 0.00 1.00 0.00 0.00 64.86 66.45 2wcd h ILE 115 Cb 0.23 0.06 -0.15 0.00 -0.74 0.00 0.00 36.82 36.21 2wcd h ILE 115 CO -0.21 0.00 0.51 -0.07 0.00 0.00 0.00 178.15 178.38 2wcd h LEU 116 N -1.21 0.40 0.64 1.44 3.38 -0.31 -1.34 115.31 118.31 2wcd h LEU 116 Ca -0.11 0.20 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2wcd h LEU 116 Cb 0.95 0.18 0.01 0.00 0.09 0.00 0.00 40.66 41.89 2wcd h LEU 116 CO 0.14 -0.19 -0.31 0.40 0.09 0.00 0.00 178.44 178.58 2wcd h ILE 117 N 0.26 0.17 0.04 1.22 2.04 -0.81 -2.12 117.51 118.31 2wcd h ILE 117 Ca 0.72 -0.32 0.01 0.00 1.00 0.00 0.00 64.86 66.28 2wcd h ILE 117 Cb 1.67 0.23 -0.04 0.00 -0.74 0.00 0.00 36.82 37.94 2wcd h ILE 117 CO -0.64 0.02 -0.38 0.50 0.00 0.00 0.00 178.15 177.65 2wcd h LYS 118 N -1.13 -0.49 -0.77 2.37 3.64 -0.15 0.71 116.57 120.76 2wcd h LYS 118 Ca -0.09 0.03 0.14 0.00 -1.27 0.00 0.00 60.65 59.46 2wcd h LYS 118 Cb 0.70 0.11 -0.09 0.00 -0.41 0.00 0.00 32.23 32.54 2wcd h LYS 118 CO 0.15 -0.32 0.34 -0.24 -2.27 0.00 0.00 179.45 177.10 2wcd h VAL 119 N -0.50 0.70 0.51 2.00 3.04 -1.47 0.59 116.25 121.12 2wcd h VAL 119 Ca 0.00 -0.17 -0.03 0.00 -1.01 0.00 0.00 66.70 65.49 2wcd h VAL 119 Cb 0.52 0.15 0.01 0.00 -2.01 0.00 0.00 31.29 29.96 2wcd h VAL 119 CO -0.23 0.09 -0.25 -0.07 -1.01 0.00 0.00 177.57 176.10 2wcd h LEU 120 N 0.50 -0.58 -0.83 3.16 3.38 -1.00 -2.29 115.31 117.65 2wcd h LEU 120 Ca 0.42 -0.06 0.21 0.00 0.09 0.00 0.00 57.88 58.53 2wcd h LEU 120 Cb 0.60 0.15 -0.14 0.00 0.09 0.00 0.00 40.66 41.35 2wcd h LEU 120 CO -0.37 -0.20 0.06 0.44 0.09 0.00 0.00 178.44 178.46 2wcd h ASP 121 N -1.05 -0.29 0.67 -0.43 3.32 0.85 -0.27 116.42 119.21 2wcd h ASP 121 Ca -0.07 0.21 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 2wcd h ASP 121 Cb 0.60 0.35 0.01 0.00 0.22 0.00 0.00 39.33 40.51 2wcd h ASP 121 CO 0.12 -0.20 -0.32 -0.78 -1.72 0.00 0.00 179.24 176.33 2wcd h ASP 122 N 0.11 -0.76 -0.99 6.45 3.58 0.17 -2.39 116.42 122.59 2wcd h ASP 122 Ca 0.48 0.03 0.18 0.00 0.42 0.00 0.00 57.03 58.14 2wcd h ASP 122 Cb 0.91 0.20 -0.10 0.00 1.72 0.00 0.00 39.33 42.06 2wcd h ASP 122 CO -0.71 -0.52 0.62 1.23 -2.88 0.00 0.00 179.24 176.97 2wcd h GLY 123 N -0.96 1.64 0.50 -0.78 0.00 -1.10 0.88 103.07 103.26 2wcd h GLY 123 Ca -0.09 -0.35 0.09 0.00 0.00 0.00 0.00 47.33 46.97 2wcd h GLY 123 CO 0.15 -0.02 0.34 -2.22 0.00 0.00 0.00 176.54 174.80 2wcd h ILE 124 N 0.76 0.86 0.29 2.60 2.04 -0.89 1.19 117.51 124.36 2wcd h ILE 124 Ca 0.55 -0.20 -0.01 0.00 1.00 0.00 0.00 64.86 66.19 2wcd h ILE 124 Cb 0.86 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 2wcd h ILE 124 CO -0.33 0.11 -0.14 0.74 0.00 0.00 0.00 178.15 178.52 2wcd h THR 125 N 0.59 0.68 -0.62 -0.27 2.02 -0.41 -2.51 112.91 112.40 2wcd h THR 125 Ca 0.33 -0.70 0.11 0.00 0.77 0.00 0.00 66.41 66.93 2wcd h THR 125 Cb 0.34 1.02 -0.09 0.00 -1.74 0.00 0.00 68.15 67.68 2wcd h THR 125 CO -0.26 0.13 0.16 0.11 0.37 0.00 0.00 175.52 176.03 2wcd h LYS 126 N -0.81 0.29 -0.33 6.66 1.57 -0.42 -0.99 116.57 122.55 2wcd h LYS 126 Ca -0.04 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2wcd h LYS 126 Cb 0.51 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 2wcd h LYS 126 CO 0.07 0.19 0.21 -0.07 -0.57 0.00 0.00 179.45 179.28 2wcd h LEU 127 N 0.30 0.36 0.22 2.94 3.38 0.14 -1.89 115.31 120.75 2wcd h LEU 127 Ca 0.33 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.30 2wcd h LEU 127 Cb 0.48 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 2wcd h LEU 127 CO -0.39 0.26 -0.29 -1.13 0.09 0.00 0.00 178.44 176.98 2wcd h ASN 128 N 0.43 -0.80 -0.82 -0.43 -0.73 -0.76 -2.32 115.58 110.15 2wcd h ASN 128 Ca 0.12 0.08 0.12 0.00 1.87 0.00 0.00 56.30 58.49 2wcd h ASN 128 Cb -0.04 0.28 -0.06 0.00 0.27 0.00 0.00 38.32 38.78 2wcd h ASN 128 CO -0.04 -0.40 0.54 -0.33 -0.37 0.00 0.00 177.43 176.83 2wcd h GLU 129 N -0.57 0.65 -0.15 6.67 5.08 -1.04 -0.57 114.58 124.65 2wcd h GLU 129 Ca 0.01 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.36 2wcd h GLU 129 Cb 0.55 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.61 2wcd h GLU 129 CO -0.10 0.43 -0.09 0.00 -1.00 0.00 0.00 179.01 178.25 2wcd h ALA 130 N 1.61 0.04 0.00 3.43 0.00 -0.80 0.97 119.26 124.50 2wcd h ALA 130 Ca 0.40 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.39 2wcd h ALA 130 Cb 0.61 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 2wcd h ALA 130 CO -0.16 -0.53 -0.16 1.96 0.00 0.00 0.00 179.25 180.36 2wcd h GLN 131 N -0.08 -0.25 -0.51 0.00 4.20 -0.78 -0.40 115.11 117.28 2wcd h GLN 131 Ca 0.09 0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.85 2wcd h GLN 131 Cb 0.21 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.01 2wcd h GLN 131 CO -0.21 -0.17 0.28 0.87 -0.67 0.00 0.00 178.83 178.94 2wcd h LYS 132 N -0.26 0.54 -0.58 1.46 1.57 -1.04 0.22 116.57 118.49 2wcd h LYS 132 Ca 0.05 -0.03 0.10 0.00 -1.87 0.00 0.00 60.65 58.90 2wcd h LYS 132 Cb 0.33 -0.12 -0.08 0.00 0.08 0.00 0.00 32.23 32.44 2wcd h LYS 132 CO -0.15 0.36 0.15 1.03 -0.57 0.00 0.00 179.45 180.27 2wcd h SER 133 N 0.55 0.07 -0.21 0.86 0.87 -0.38 -0.76 113.55 114.56 2wcd h SER 133 Ca 0.21 0.10 -0.03 0.00 -1.23 0.00 0.00 61.79 60.84 2wcd h SER 133 Cb 0.08 0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.14 2wcd h SER 133 CO -0.12 0.05 -0.01 -0.07 -0.53 0.00 0.00 176.83 176.15 2wcd h LEU 134 N 0.30 0.36 -0.57 2.23 3.38 0.35 -2.12 115.31 119.24 2wcd h LEU 134 Ca 0.30 -0.32 0.06 0.00 0.09 0.00 0.00 57.88 58.01 2wcd h LEU 134 Cb 0.41 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 2wcd h LEU 134 CO -0.35 0.59 0.27 0.25 0.09 0.00 0.00 178.44 179.29 2wcd h LEU 135 N 0.12 0.36 -0.84 1.67 5.85 -0.26 -0.87 115.31 121.34 2wcd h LEU 135 Ca 0.06 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 2wcd h LEU 135 Cb 0.41 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 2wcd h LEU 135 CO 0.01 0.24 0.36 1.62 -0.34 0.00 0.00 178.44 180.33 2wcd h VAL 136 N 0.51 1.26 -0.67 1.05 3.04 -1.02 -1.05 116.25 119.36 2wcd h VAL 136 Ca 0.26 -0.78 0.02 0.00 -1.01 0.00 0.00 66.70 65.20 2wcd h VAL 136 Cb 0.22 0.25 -0.04 0.00 -2.01 0.00 0.00 31.29 29.71 2wcd h VAL 136 CO -0.21 0.33 0.43 -1.28 -1.01 0.00 0.00 177.57 175.83 2wcd h SER 137 N 1.18 0.71 -0.54 3.17 0.87 -0.65 -2.05 113.55 116.25 2wcd h SER 137 Ca 0.28 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.83 2wcd h SER 137 Cb 0.17 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 61.94 2wcd h SER 137 CO -0.03 0.50 0.35 -1.28 -0.53 0.00 0.00 176.83 175.84 2wcd h SER 138 N 0.85 0.62 0.01 6.23 0.87 -0.31 -1.70 113.55 120.13 2wcd h SER 138 Ca 0.26 -0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.80 2wcd h SER 138 Cb -0.02 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 61.79 2wcd h SER 138 CO -0.09 0.46 -0.01 1.56 -0.53 0.00 0.00 176.83 178.23 2wcd h GLN 139 N 0.73 0.00 -0.29 2.24 4.20 -0.70 -3.10 115.11 118.18 2wcd h GLN 139 Ca 0.20 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.94 2wcd h GLN 139 Cb -0.07 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 2wcd h GLN 139 CO -0.04 0.01 0.09 0.66 -0.67 0.00 0.00 178.83 178.87 2wcd h SER 140 N 0.00 0.08 0.34 1.46 4.64 -0.62 -2.47 113.55 116.98 2wcd h SER 140 Ca -0.00 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2wcd h SER 140 Cb 0.02 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2wcd h SER 140 CO 0.00 0.08 0.00 -0.26 -0.87 0.00 0.00 176.83 175.78 2wcd h PHE 141 N 0.21 0.00 -0.17 4.77 0.04 -1.66 -3.31 116.94 116.82 2wcd h PHE 141 Ca 0.13 0.00 0.05 0.00 2.80 0.00 0.00 57.97 60.95 2wcd h PHE 141 Cb 0.11 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.21 2wcd h PHE 141 CO -0.14 0.00 -0.14 -0.91 -0.60 0.00 0.00 178.31 176.52 2wcd h ASN 142 N 0.00 -0.44 0.44 2.17 4.21 -1.60 0.24 115.58 120.59 2wcd h ASN 142 Ca 0.00 0.09 -0.02 0.00 1.21 0.00 0.00 56.30 57.58 2wcd h ASN 142 Cb 0.17 0.22 -0.00 0.00 -1.12 0.00 0.00 38.32 37.59 2wcd h ASN 142 CO 0.00 -0.18 -0.25 -1.13 -1.29 0.00 0.00 177.43 174.58 2wcd h ASN 143 N -0.15 -0.62 -0.72 5.81 -1.24 -1.78 -2.22 115.58 114.66 2wcd h ASN 143 Ca 0.11 0.03 0.15 0.00 0.71 0.00 0.00 56.30 57.30 2wcd h ASN 143 Cb 0.31 0.18 -0.10 0.00 0.73 0.00 0.00 38.32 39.43 2wcd h ASN 143 CO -0.26 -0.41 0.22 0.00 -1.29 0.00 0.00 177.43 175.70 2wcd h ALA 144 N -0.11 0.97 -0.75 1.57 0.00 -1.71 -0.88 119.26 118.35 2wcd h ALA 144 Ca -0.05 0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.10 2wcd h ALA 144 Cb 0.52 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 2wcd h ALA 144 CO 0.06 -0.28 0.49 1.03 0.00 0.00 0.00 179.25 180.55 2wcd h SER 145 N 0.34 0.57 0.41 0.00 0.87 0.04 0.24 113.55 116.01 2wcd h SER 145 Ca 0.40 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.96 2wcd h SER 145 Cb 0.65 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 2wcd h SER 145 CO -0.45 0.33 -0.20 1.23 -0.53 0.00 0.00 176.83 177.21 2wcd h GLY 146 N 0.62 -0.58 -0.47 5.77 0.00 -0.63 -3.01 103.07 104.78 2wcd h GLY 146 Ca 0.35 0.21 0.30 0.00 0.00 0.00 0.00 47.33 48.19 2wcd h GLY 146 CO -0.13 -0.21 0.50 0.50 0.00 0.00 0.00 176.54 177.21 2wcd h LYS 147 N -0.97 0.32 0.06 4.80 1.57 -0.80 0.21 116.57 121.77 2wcd h LYS 147 Ca -0.06 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.73 2wcd h LYS 147 Cb 0.55 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.75 2wcd h LYS 147 CO 0.09 0.21 -0.31 -0.07 -0.57 0.00 0.00 179.45 178.81 2wcd h LEU 148 N 0.33 -0.89 -0.51 2.94 3.38 -0.97 -1.58 115.31 118.00 2wcd h LEU 148 Ca 0.69 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.76 2wcd h LEU 148 Cb 1.51 0.35 -0.02 0.00 0.09 0.00 0.00 40.66 42.58 2wcd h LEU 148 CO -0.60 -0.38 0.29 0.25 0.09 0.00 0.00 178.44 178.08 2wcd h LEU 149 N -0.49 0.64 -0.29 1.67 6.46 -0.52 -1.67 115.31 121.11 2wcd h LEU 149 Ca 0.04 -0.09 0.05 0.00 -0.12 0.00 0.00 57.88 57.77 2wcd h LEU 149 Cb 0.55 -0.16 -0.08 0.00 -0.73 0.00 0.00 40.66 40.24 2wcd h LEU 149 CO -0.21 0.54 -0.46 0.00 -0.62 0.00 0.00 178.44 177.69 2wcd h ALA 150 N 1.12 -0.58 -0.25 1.25 0.00 -0.85 0.72 119.26 120.67 2wcd h ALA 150 Ca 0.18 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.15 2wcd h ALA 150 Cb 0.04 0.91 -0.07 0.00 0.00 0.00 0.00 17.79 18.66 2wcd h ALA 150 CO -0.03 -0.94 -0.55 1.25 0.00 0.00 0.00 179.25 178.98 2wcd h LEU 151 N -0.42 -1.78 0.09 0.00 5.85 -0.90 0.31 115.31 118.45 2wcd h LEU 151 Ca 0.10 0.22 0.02 0.00 0.84 0.00 0.00 57.88 59.06 2wcd h LEU 151 Cb 0.61 0.71 -0.04 0.00 0.37 0.00 0.00 40.66 42.31 2wcd h LEU 151 CO -0.51 -0.45 -0.32 -0.78 -0.34 0.00 0.00 178.44 176.05 2wcd h ASP 152 N -0.50 -0.93 -0.91 1.25 1.82 -0.75 0.24 116.42 116.64 2wcd h ASP 152 Ca 0.05 0.11 0.17 0.00 -0.39 0.00 0.00 57.03 56.97 2wcd h ASP 152 Cb 0.64 0.36 -0.17 0.00 0.68 0.00 0.00 39.33 40.84 2wcd h ASP 152 CO -0.50 -0.40 -0.28 -1.28 -1.61 0.00 0.00 179.24 175.16 2wcd h SER 153 N -0.53 -1.05 0.15 2.28 0.87 0.11 -0.56 113.55 114.83 2wcd h SER 153 Ca 0.04 0.28 -0.01 0.00 -1.23 0.00 0.00 61.79 60.87 2wcd h SER 153 Cb 0.57 0.62 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 2wcd h SER 153 CO -0.21 -0.30 -0.07 -0.61 -0.53 0.00 0.00 176.83 175.11 2wcd h GLN 154 N -0.02 -0.20 -1.38 2.24 4.15 -0.36 -2.65 115.11 116.91 2wcd h GLN 154 Ca 0.40 0.01 0.40 0.00 0.77 0.00 0.00 58.65 60.23 2wcd h GLN 154 Cb 0.64 0.04 -0.06 0.00 0.21 0.00 0.00 27.48 28.32 2wcd h GLN 154 CO -0.94 0.14 1.02 1.25 -1.93 0.00 0.00 178.83 178.38 2wcd h LEU 155 N -0.97 0.00 0.15 -2.39 6.46 -0.37 1.44 115.31 119.64 2wcd h LEU 155 Ca -0.02 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.73 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 0.03 0.00 -0.07 0.74 -0.62 0.00 0.00 178.44 178.52 2wcd h THR 156 N 0.00 0.74 -0.75 1.05 2.02 -1.10 -2.50 112.91 112.38 2wcd h THR 156 Ca 0.65 -1.18 0.04 0.00 0.77 0.00 0.00 66.41 66.69 2wcd h THR 156 Cb 2.69 1.28 -0.05 0.00 -1.74 0.00 0.00 68.15 70.33 2wcd h THR 156 CO -0.01 0.21 0.46 -1.13 0.37 0.00 0.00 175.52 175.42 2wcd h ASN 157 N -0.93 0.75 0.52 4.18 -0.73 -0.38 -2.78 115.58 116.22 2wcd h ASN 157 Ca -0.02 0.00 -0.08 0.00 1.87 0.00 0.00 56.30 58.08 2wcd h ASN 157 Cb 0.49 -0.16 -0.01 0.00 0.27 0.00 0.00 38.32 38.92 2wcd h ASN 157 CO 0.03 0.51 -0.36 -0.78 -0.37 0.00 0.00 177.43 176.46 2wcd h ASP 158 N 0.89 0.00 -0.24 1.15 1.82 0.17 -2.91 116.42 117.31 2wcd h ASP 158 Ca 0.31 0.00 -0.12 0.00 -0.39 0.00 0.00 57.03 56.82 2wcd h ASP 158 Cb 0.06 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.07 2wcd h ASP 158 CO -0.13 0.36 -0.33 0.15 -1.61 0.00 0.00 179.24 177.68 2wcd h PHE 159 N 0.00 0.80 0.00 0.28 3.57 -1.16 -2.23 116.94 118.20 2wcd h PHE 159 Ca -0.00 -0.26 -0.03 0.00 3.53 0.00 0.00 57.97 61.20 2wcd h PHE 159 Cb 0.72 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 39.30 2wcd h PHE 159 CO 0.00 1.01 -0.14 0.66 -2.23 0.00 0.00 178.31 177.61 2wcd h SER 160 N 0.36 0.00 0.78 0.41 4.64 -1.45 -1.18 113.55 117.11 2wcd h SER 160 Ca 0.03 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.19 2wcd h SER 160 Cb 0.91 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.98 2wcd h SER 160 CO 0.08 0.14 -0.74 -0.08 -0.87 0.00 0.00 176.83 175.36 2wcd h GLU 161 N 0.00 0.00 0.14 4.77 4.57 -1.25 -2.13 114.58 120.69 2wcd h GLU 161 Ca -0.00 0.00 -0.30 0.00 -1.18 0.00 0.00 59.36 57.88 2wcd h GLU 161 Cb 0.37 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 28.99 2wcd h GLU 161 CO 0.02 0.74 -1.27 0.87 -1.18 0.00 0.00 179.01 178.19 2wcd h LYS 162 N 0.00 0.52 -0.13 1.92 6.56 -0.90 -2.33 116.57 122.21 2wcd h LYS 162 Ca -0.01 -0.75 0.02 0.00 -1.06 0.00 0.00 60.65 58.85 2wcd h LYS 162 Cb 1.33 0.26 -0.01 0.00 -0.57 0.00 0.00 32.23 33.24 2wcd h LYS 162 CO 0.10 1.34 0.09 0.77 -2.06 0.00 0.00 179.45 179.68 2wcd h SER 163 N 0.20 0.07 -0.09 0.86 0.02 -1.17 0.52 113.55 113.96 2wcd h SER 163 Ca -0.18 -0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.63 2wcd h SER 163 Cb 1.96 -0.02 0.01 0.00 0.14 0.00 0.00 62.40 64.49 2wcd h SER 163 CO 0.23 0.05 -0.48 -1.28 -1.14 0.00 0.00 176.83 174.21 2wcd h SER 164 N 0.08 0.57 0.05 3.07 0.87 -1.40 -3.24 113.55 113.55 2wcd h SER 164 Ca 0.06 -0.66 -0.03 0.00 -1.23 0.00 0.00 61.79 59.93 2wcd h SER 164 Cb 0.12 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 2wcd h SER 164 CO -0.01 1.14 -0.10 0.22 -0.53 0.00 0.00 176.83 177.55 2wcd h TYR 165 N 0.05 0.14 0.10 2.24 3.20 -0.55 -1.96 116.97 120.19 2wcd h TYR 165 Ca -0.04 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.82 2wcd h TYR 165 Cb 1.14 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.37 2wcd h TYR 165 CO 0.12 0.24 -0.06 0.35 -1.64 0.00 0.00 178.16 177.18 2wcd h PHE 166 N 0.13 -0.15 -0.98 -3.82 3.57 -0.07 -0.58 116.94 115.04 2wcd h PHE 166 Ca 0.03 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.59 2wcd h PHE 166 Cb 0.27 0.05 -0.07 0.00 2.79 0.00 0.00 35.95 38.99 2wcd h PHE 166 CO 0.00 -0.08 0.64 0.37 -2.23 0.00 0.00 178.31 177.01 2wcd h GLN 167 N -0.14 1.12 0.00 1.11 4.15 -1.59 0.50 115.11 120.26 2wcd h GLN 167 Ca -0.01 -0.07 -0.00 0.00 0.77 0.00 0.00 58.65 59.34 2wcd h GLN 167 Cb 0.11 -0.25 -0.00 0.00 0.21 0.00 0.00 27.48 27.55 2wcd h GLN 167 CO 0.02 0.74 -0.01 0.77 -1.93 0.00 0.00 178.83 178.42 2wcd h SER 168 N 1.15 0.00 0.03 -0.69 0.02 -1.36 -1.50 113.55 111.20 2wcd h SER 168 Ca 0.42 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 61.02 2wcd h SER 168 Cb 0.17 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.66 2wcd h SER 168 CO -0.16 0.01 -2.00 1.67 -1.14 0.00 0.00 176.83 175.20 2wcd n GLN 169 N -3.15 0.63 -0.04 3.45 -0.06 0.14 -3.41 117.38 114.95 2wcd n GLN 169 Ca -0.02 0.34 0.13 0.00 -2.00 0.00 0.00 57.00 55.45 2wcd n GLN 169 Cb 0.15 -1.63 0.54 0.00 -4.06 0.00 0.00 30.24 25.24 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 -0.59 0.89 0.29 1.69 -1.51 -0.48 0.76 116.25 117.30 2wcd h VAL 170 Ca -0.51 -0.11 -0.00 0.00 -1.23 0.00 0.00 66.70 64.85 2wcd h VAL 170 Cb 1.66 0.54 -0.01 0.00 -2.13 0.00 0.00 31.29 31.35 2wcd h VAL 170 CO -0.19 0.06 -0.23 0.44 -1.23 0.00 0.00 177.57 176.42 2wcd h ASP 171 N 0.32 -0.61 -1.10 4.19 3.32 -1.43 -1.41 116.42 119.69 2wcd h ASP 171 Ca 0.24 0.05 0.31 0.00 0.02 0.00 0.00 57.03 57.65 2wcd h ASP 171 Cb 0.54 0.20 -0.07 0.00 0.22 0.00 0.00 39.33 40.22 2wcd h ASP 171 CO -0.06 -0.36 0.75 0.50 -1.72 0.00 0.00 179.24 178.36 2wcd h LYS 172 N -0.54 0.19 -0.24 3.56 3.64 -0.90 0.13 116.57 122.41 2wcd h LYS 172 Ca -0.02 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.24 2wcd h LYS 172 Cb 0.47 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.25 2wcd h LYS 172 CO -0.02 0.12 -0.28 0.82 -2.27 0.00 0.00 179.45 177.83 2wcd h ILE 173 N 0.19 1.32 0.49 2.00 2.04 -0.41 -1.55 117.51 121.60 2wcd h ILE 173 Ca 0.58 -1.46 -0.02 0.00 1.00 0.00 0.00 64.86 64.96 2wcd h ILE 173 Cb 1.88 1.70 0.00 0.00 -0.74 0.00 0.00 36.82 39.67 2wcd h ILE 173 CO -0.16 0.46 -0.24 0.03 0.00 0.00 0.00 178.15 178.24 2wcd h ARG 174 N 0.32 -0.64 -0.87 2.37 3.08 -0.35 -1.64 114.38 116.64 2wcd h ARG 174 Ca 0.03 0.04 0.21 0.00 0.07 0.00 0.00 59.98 60.34 2wcd h ARG 174 Cb 0.85 0.15 -0.06 0.00 0.08 0.00 0.00 29.97 30.99 2wcd h ARG 174 CO 0.07 -0.37 0.59 -0.22 -1.07 0.00 0.00 179.97 178.97 2wcd h LYS 175 N -0.80 0.28 0.12 0.04 3.11 -1.17 0.26 116.57 118.41 2wcd h LYS 175 Ca -0.07 -0.02 -0.29 0.00 -2.81 0.00 0.00 60.65 57.47 2wcd h LYS 175 Cb 0.57 -0.06 0.02 0.00 -1.00 0.00 0.00 32.23 31.75 2wcd h LYS 175 CO 0.11 0.19 -1.22 0.93 -2.81 0.00 0.00 179.45 176.65 2wcd h GLU 176 N 0.29 0.51 0.18 1.90 5.08 -1.18 -3.02 114.58 118.34 2wcd h GLU 176 Ca 0.45 -0.70 -0.31 0.00 -1.00 0.00 0.00 59.36 57.80 2wcd h GLU 176 Cb 1.27 0.24 0.03 0.00 0.50 0.00 0.00 28.75 30.79 2wcd h GLU 176 CO -0.13 1.31 -1.31 0.00 -1.00 0.00 0.00 179.01 177.88 2wcd h ALA 177 N 0.41 -0.09 0.05 3.43 0.00 0.03 -3.06 119.26 120.05 2wcd h ALA 177 Ca -0.17 -0.80 -0.23 0.00 0.00 0.00 0.00 54.91 53.71 2wcd h ALA 177 Cb 1.90 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.82 2wcd h ALA 177 CO 0.22 0.65 -1.09 1.88 0.00 0.00 0.00 179.25 180.92 2wcd h TYR 178 N 0.15 0.23 -0.03 0.00 0.05 -0.75 -0.00 116.97 116.62 2wcd h TYR 178 Ca -0.22 -0.16 0.01 0.00 0.05 0.00 0.00 58.73 58.41 2wcd h TYR 178 Cb 2.00 -0.01 -0.00 0.00 1.01 0.00 0.00 36.73 39.73 2wcd h TYR 178 CO 0.13 1.11 0.04 0.00 -1.05 0.00 0.00 178.16 178.39 2wcd h ALA 179 N 0.83 1.40 0.00 3.88 0.00 -1.64 0.15 119.26 123.87 2wcd h ALA 179 Ca -0.06 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2wcd h ALA 179 Cb 1.83 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.61 2wcd h ALA 179 CO 0.16 -0.05 -0.24 0.78 0.00 0.00 0.00 179.25 179.89 2wcd h GLY 180 N 0.00 0.00 0.89 0.00 0.00 -1.26 -3.20 103.07 99.50 2wcd h GLY 180 Ca 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.32 2wcd h GLY 180 CO -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 176.54 176.22 2wcd h ALA 181 N -0.30 -0.83 -1.91 3.60 0.00 -0.87 -1.52 119.26 117.43 2wcd h ALA 181 Ca -0.06 -0.17 0.57 0.00 0.00 0.00 0.00 54.91 55.25 2wcd h ALA 181 Cb 0.86 0.39 -0.09 0.00 0.00 0.00 0.00 17.79 18.95 2wcd h ALA 181 CO -0.04 -0.98 1.36 0.00 0.00 0.00 0.00 179.25 179.60 2wcd h ALA 182 N -0.42 3.75 0.00 0.00 0.00 -0.89 0.72 119.26 122.43 2wcd h ALA 182 Ca -0.07 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2wcd h ALA 182 Cb 0.66 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2wcd h ALA 182 CO 0.08 -2.34 0.00 0.00 0.00 0.00 0.00 179.25 176.99 2wcd n ALA 183 N -2.87 1.82 0.85 0.00 0.00 -0.57 -2.46 120.51 117.28 2wcd n ALA 183 Ca 0.44 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.94 2wcd n ALA 183 Cb 1.97 -1.20 0.53 0.00 0.00 0.00 0.00 19.45 20.75 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 -0.23 -1.34 0.51 0.00 0.00 0.25 -3.70 105.19 100.69 2wcd n GLY 184 Ca 0.07 -0.09 0.33 0.00 0.00 0.00 0.00 46.02 46.33 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 0.38 0.75 1.61 2.07 -1.70 -2.12 116.25 117.24 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 0.42 0.42 0.01 0.00 -1.52 0.00 0.00 31.29 30.61 2wcd h VAL 185 CO 0.00 0.00 -0.36 0.58 0.02 0.00 0.00 177.57 177.81 2wcd h VAL 186 N 0.00 0.07 -4.38 2.57 2.07 -1.87 -3.44 116.25 111.27 2wcd h VAL 186 Ca 0.50 -0.23 -0.49 0.00 0.82 0.00 0.00 66.70 67.30 2wcd h VAL 186 Cb 2.13 0.09 0.08 0.00 -1.52 0.00 0.00 31.29 32.06 2wcd h VAL 186 CO -0.01 0.01 0.39 0.00 0.02 0.00 0.00 177.57 177.98 2wcd s ALA 187 N -5.25 2.93 0.83 1.67 0.00 -0.80 -5.01 121.76 116.14 2wcd s ALA 187 Ca -0.16 -0.40 -0.16 0.00 0.00 0.00 0.00 51.96 51.25 2wcd s ALA 187 Cb 0.02 -2.97 -0.06 0.00 0.00 0.00 0.00 23.12 20.10 2wcd s ALA 187 CO 0.48 -1.12 0.05 0.41 0.00 0.00 0.00 175.76 175.58 2wcd n GLY 188 N -2.97 -2.73 0.27 0.00 0.00 -1.26 -4.70 105.19 93.80 2wcd n GLY 188 Ca 0.07 -0.57 0.07 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.82 0.15 0.00 1.61 0.11 -1.90 0.71 132.00 131.86 2wcd h PRO 189 Ca -0.44 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 2wcd h PRO 189 Cb 1.33 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.41 2wcd h PRO 189 CO 0.35 0.10 -0.01 0.74 -0.21 0.00 0.00 178.00 178.97 2wcd h PHE 190 N 0.15 0.00 -0.29 0.65 -1.00 -1.96 0.19 116.94 114.68 2wcd h PHE 190 Ca 0.04 0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.74 2wcd h PHE 190 Cb -0.01 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.53 2wcd h PHE 190 CO 0.00 0.01 -0.17 0.78 -1.61 0.00 0.00 178.31 177.32 2wcd h GLY 191 N 0.05 0.56 0.87 -1.45 0.00 0.16 -2.86 103.07 100.40 2wcd h GLY 191 Ca -0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 47.33 46.91 2wcd h GLY 191 CO 0.00 0.38 0.05 1.41 0.00 0.00 0.00 176.54 178.38 2wcd h LEU 192 N 0.47 0.19 -0.50 3.11 4.07 -0.51 0.27 115.31 122.41 2wcd h LEU 192 Ca 0.08 -0.17 0.10 0.00 0.08 0.00 0.00 57.88 57.97 2wcd h LEU 192 Cb 0.57 -0.05 -0.10 0.00 1.08 0.00 0.00 40.66 42.15 2wcd h LEU 192 CO 0.04 0.31 -0.31 0.40 -1.08 0.00 0.00 178.44 177.80 2wcd h ILE 193 N 0.06 0.23 0.16 1.22 2.04 -1.41 1.38 117.51 121.19 2wcd h ILE 193 Ca 0.05 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.91 2wcd h ILE 193 Cb 0.18 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 2wcd h ILE 193 CO -0.00 0.00 -0.16 0.40 0.00 0.00 0.00 178.15 178.39 2wcd h ILE 194 N -0.18 0.64 0.52 -0.67 2.04 -1.29 -0.47 117.51 118.10 2wcd h ILE 194 Ca 0.21 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.05 2wcd h ILE 194 Cb 0.53 0.64 0.01 0.00 -0.74 0.00 0.00 36.82 37.26 2wcd h ILE 194 CO -0.61 0.00 -0.25 -1.28 0.00 0.00 0.00 178.15 176.01 2wcd h SER 195 N -0.35 -0.59 -0.46 1.72 0.87 0.61 -0.60 113.55 114.75 2wcd h SER 195 Ca 0.00 0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.50 2wcd h SER 195 Cb 0.33 0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.42 2wcd h SER 195 CO -0.04 -0.40 0.06 0.22 -0.53 0.00 0.00 176.83 176.14 2wcd h TYR 196 N -0.73 0.89 -0.22 2.24 3.20 0.18 -0.14 116.97 122.38 2wcd h TYR 196 Ca -0.07 -0.11 -0.01 0.00 3.14 0.00 0.00 58.73 61.68 2wcd h TYR 196 Cb 0.55 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 2wcd h TYR 196 CO -0.03 0.78 0.11 0.77 -1.64 0.00 0.00 178.16 178.15 2wcd h SER 197 N 0.80 0.28 -0.99 -2.11 0.02 -1.01 0.58 113.55 111.12 2wcd h SER 197 Ca 0.16 -0.11 0.15 0.00 -0.84 0.00 0.00 61.79 61.16 2wcd h SER 197 Cb 0.39 -0.07 -0.09 0.00 0.14 0.00 0.00 62.40 62.77 2wcd h SER 197 CO 0.01 0.31 0.62 0.40 -1.14 0.00 0.00 176.83 177.03 2wcd h ILE 198 N 0.23 0.83 0.00 3.27 1.08 -0.50 -2.46 117.51 119.97 2wcd h ILE 198 Ca 0.08 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 64.25 2wcd h ILE 198 Cb 0.10 -0.11 0.00 0.00 -3.07 0.00 0.00 36.82 33.74 2wcd h ILE 198 CO -0.01 0.16 0.00 0.00 -0.69 0.00 0.00 178.15 177.61 2wcd n ALA 199 N -2.36 0.00 -0.42 1.87 0.00 -0.12 -3.32 120.51 116.16 2wcd n ALA 199 Ca 0.20 0.00 0.35 0.00 0.00 0.00 0.00 53.44 53.99 2wcd n ALA 199 Cb 0.46 0.00 0.63 0.00 0.00 0.00 0.00 19.45 20.54 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 2.67 0.93 0.00 0.00 -1.08 0.24 119.26 120.02 2wcd h ALA 200 Ca 0.00 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2wcd h ALA 200 Cb 0.00 0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.97 2wcd h ALA 200 CO 0.00 -1.25 -0.45 0.78 0.00 0.00 0.00 179.25 178.33 2wcd h GLY 201 N 0.14 -1.31 1.13 0.00 0.00 -1.45 0.54 103.07 102.12 2wcd h GLY 201 Ca 0.78 0.48 -0.07 0.00 0.00 0.00 0.00 47.33 48.52 2wcd h GLY 201 CO -0.38 -0.48 0.15 -2.08 0.00 0.00 0.00 176.54 173.75 2wcd h VAL 202 N -1.29 1.26 0.52 4.60 2.07 -0.96 0.29 116.25 122.74 2wcd h VAL 202 Ca -0.13 -0.97 -0.03 0.00 0.82 0.00 0.00 66.70 66.40 2wcd h VAL 202 Cb 0.96 0.57 0.01 0.00 -1.52 0.00 0.00 31.29 31.31 2wcd h VAL 202 CO 0.21 0.37 -0.25 0.58 0.02 0.00 0.00 177.57 178.50 2wcd h VAL 203 N 1.02 0.00 0.00 2.57 2.07 -0.66 -1.75 116.25 119.50 2wcd h VAL 203 Ca 0.21 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.59 2wcd h VAL 203 Cb 0.38 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 2wcd h VAL 203 CO 0.00 0.00 0.00 -0.62 0.02 0.00 0.00 177.57 176.97 2wcd n GLU 204 N -4.28 0.05 -0.04 1.57 -0.58 0.18 -1.38 120.64 116.16 2wcd n GLU 204 Ca -0.09 0.26 -0.01 0.00 -0.42 0.00 0.00 57.16 56.90 2wcd n GLU 204 Cb 0.28 -1.58 -0.00 0.00 -0.57 0.00 0.00 31.44 29.56 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 2.76 0.00 0.00 0.62 0.00 -0.34 -3.44 103.07 102.67 2wcd h GLY 205 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 2wcd h GLY 205 CO 0.00 0.00 -1.70 0.28 0.00 0.00 0.00 176.54 175.12 2wcd n LYS 206 N -4.07 0.29 0.00 4.80 5.02 -0.68 -4.77 118.16 118.76 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 0.05 -1.15 0.00 0.00 -0.02 0.00 0.00 35.03 33.91 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 -3.09 0.00 -0.21 -0.35 4.77 -0.83 -0.82 117.00 116.48 2wcd n LEU 207 Ca -0.23 0.90 0.02 0.00 -0.03 0.00 0.00 56.01 56.67 2wcd n LEU 207 Cb 0.71 -0.40 0.12 0.00 -2.33 0.00 0.00 43.42 41.52 2wcd n LEU 207 CO 0.09 -0.40 0.87 0.40 -1.33 0.00 0.00 177.39 177.02 2wcd h ILE 208 N 0.00 0.53 -0.79 -0.08 1.08 -1.52 -0.14 117.51 116.59 2wcd h ILE 208 Ca 0.00 -0.06 0.03 0.00 -0.39 0.00 0.00 64.86 64.43 2wcd h ILE 208 Cb 0.00 0.34 -0.05 0.00 -3.07 0.00 0.00 36.82 34.04 2wcd h ILE 208 CO 0.00 0.03 0.51 -0.65 -0.69 0.00 0.00 178.15 177.35 2wcd h PRO 209 N 0.18 0.98 -0.27 2.37 0.11 -1.79 0.26 132.00 133.83 2wcd h PRO 209 Ca 0.34 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 66.43 2wcd h PRO 209 Cb 0.55 -0.22 -0.04 0.00 0.11 0.00 0.00 31.00 31.40 2wcd h PRO 209 CO -0.49 0.65 0.03 0.93 -0.21 0.00 0.00 178.00 178.90 2wcd h GLU 210 N 1.00 0.12 -0.04 1.05 4.39 0.74 0.41 114.58 122.26 2wcd h GLU 210 Ca 0.31 -0.01 0.02 0.00 0.34 0.00 0.00 59.36 60.02 2wcd h GLU 210 Cb -0.03 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.57 2wcd h GLU 210 CO -0.10 0.08 -0.10 -0.07 -1.16 0.00 0.00 179.01 177.66 2wcd h LEU 211 N 0.12 -0.30 -2.20 1.33 3.38 -0.57 0.56 115.31 117.63 2wcd h LEU 211 Ca 0.13 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.20 2wcd h LEU 211 Cb 0.15 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2wcd h LEU 211 CO -0.19 -0.14 0.27 0.11 0.09 0.00 0.00 178.44 178.57 2wcd h LYS 212 N -0.16 0.00 -0.02 1.13 1.57 -0.58 -0.66 116.57 117.87 2wcd h LYS 212 Ca 0.05 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 2wcd h LYS 212 Cb 0.22 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.54 2wcd h LYS 212 CO -0.13 0.00 -0.30 -0.97 -0.57 0.00 0.00 179.45 177.48 2wcd h ASN 213 N 0.00 0.29 -0.38 0.86 -0.00 0.13 -3.08 115.58 113.41 2wcd h ASN 213 Ca 0.08 -0.74 -0.08 0.00 -0.00 0.00 0.00 56.30 55.56 2wcd h ASN 213 Cb 0.61 -0.09 -0.01 0.00 -0.00 0.00 0.00 38.32 38.83 2wcd h ASN 213 CO -0.00 0.99 -0.07 0.11 -0.00 0.00 0.00 177.43 178.46 2wcd h LYS 214 N -0.38 0.71 -1.13 6.67 6.56 -0.53 -0.63 116.57 127.84 2wcd h LYS 214 Ca -0.03 -0.26 0.33 0.00 -1.06 0.00 0.00 60.65 59.62 2wcd h LYS 214 Cb 1.03 -0.05 -0.05 0.00 -0.57 0.00 0.00 32.23 32.59 2wcd h LYS 214 CO 0.06 0.85 0.81 1.25 -2.06 0.00 0.00 179.45 180.36 2wcd h LEU 215 N 0.52 0.04 0.15 2.94 7.12 -1.25 0.45 115.31 125.28 2wcd h LEU 215 Ca 0.10 0.01 -0.25 0.00 0.13 0.00 0.00 57.88 57.86 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 0.04 0.31 -0.15 1.25 3.64 -1.26 -1.95 116.57 118.44 2wcd h LYS 216 Ca 0.55 -0.53 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 2wcd h LYS 216 Cb 2.12 0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 34.13 2wcd h LYS 216 CO -0.03 1.25 0.01 0.66 -2.27 0.00 0.00 179.45 179.07 2wcd h SER 217 N -0.26 0.19 0.34 4.20 4.64 0.68 0.96 113.55 124.31 2wcd h SER 217 Ca -0.24 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.05 2wcd h SER 217 Cb 1.78 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.83 2wcd h SER 217 CO 0.13 0.23 -0.16 0.58 -0.87 0.00 0.00 176.83 176.73 2wcd h VAL 218 N 0.21 0.00 -0.86 0.95 2.07 -0.33 -1.51 116.25 116.79 2wcd h VAL 218 Ca 0.05 -0.36 0.25 0.00 0.82 0.00 0.00 66.70 67.47 2wcd h VAL 218 Cb 0.13 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.87 2wcd h VAL 218 CO 0.00 0.00 0.67 -0.61 0.02 0.00 0.00 177.57 177.65 2wcd h GLN 219 N -0.82 0.00 -0.02 1.57 4.15 -1.03 0.60 115.11 119.55 2wcd h GLN 219 Ca -0.05 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.36 2wcd h GLN 219 Cb 0.35 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.04 2wcd h GLN 219 CO 0.08 0.00 -0.03 -0.97 -1.93 0.00 0.00 178.83 175.98 2wcd h ASN 220 N 0.00 0.06 -0.33 -0.69 -0.73 0.96 -2.82 115.58 112.03 2wcd h ASN 220 Ca 0.41 -0.50 -0.11 0.00 1.87 0.00 0.00 56.30 57.97 2wcd h ASN 220 Cb 1.75 -0.02 -0.01 0.00 0.27 0.00 0.00 38.32 40.31 2wcd h ASN 220 CO -0.00 0.55 -0.22 0.15 -0.37 0.00 0.00 177.43 177.53 2wcd h PHE 221 N -0.42 0.86 -0.83 0.67 3.57 0.44 -2.32 116.94 118.92 2wcd h PHE 221 Ca 0.00 -0.23 0.20 0.00 3.53 0.00 0.00 57.97 61.47 2wcd h PHE 221 Cb 0.53 -0.19 -0.12 0.00 2.79 0.00 0.00 35.95 38.96 2wcd h PHE 221 CO 0.10 0.97 0.27 0.35 -2.23 0.00 0.00 178.31 177.77 2wcd h PHE 222 N 0.50 0.44 0.58 0.41 3.57 -0.06 0.10 116.94 122.48 2wcd h PHE 222 Ca 0.07 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.58 2wcd h PHE 222 Cb 0.78 -0.06 0.01 0.00 2.79 0.00 0.00 35.95 39.46 2wcd h PHE 222 CO 0.06 -0.09 -0.28 1.15 -2.23 0.00 0.00 178.31 176.93 2wcd h THR 223 N 0.32 0.26 -1.00 4.41 2.02 -1.22 -0.37 112.91 117.33 2wcd h THR 223 Ca 0.50 -0.35 0.16 0.00 0.77 0.00 0.00 66.41 67.49 2wcd h THR 223 Cb 0.91 0.36 -0.10 0.00 -1.74 0.00 0.00 68.15 67.58 2wcd h THR 223 CO -0.54 0.04 0.62 0.71 0.37 0.00 0.00 175.52 176.71 2wcd h THR 224 N -1.05 0.79 -0.14 3.16 1.35 -1.01 -0.61 112.91 115.39 2wcd h THR 224 Ca -0.08 -0.29 -0.02 0.00 -0.55 0.00 0.00 66.41 65.47 2wcd h THR 224 Cb 0.66 -0.14 -0.01 0.00 -1.73 0.00 0.00 68.15 66.93 2wcd h THR 224 CO 0.13 0.16 0.01 0.25 -0.25 0.00 0.00 175.52 175.81 2wcd h LEU 225 N 0.85 0.24 -1.03 3.87 6.46 -0.76 0.49 115.31 125.43 2wcd h LEU 225 Ca 0.55 -0.30 0.13 0.00 -0.12 0.00 0.00 57.88 58.14 2wcd h LEU 225 Cb 0.75 -0.06 -0.09 0.00 -0.73 0.00 0.00 40.66 40.53 2wcd h LEU 225 CO -0.34 0.48 0.63 -1.28 -0.62 0.00 0.00 178.44 177.30 2wcd h SER 226 N -0.01 0.89 0.16 1.25 0.87 0.38 0.10 113.55 117.20 2wcd h SER 226 Ca 0.04 0.05 -0.15 0.00 -1.23 0.00 0.00 61.79 60.51 2wcd h SER 226 Cb 0.35 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.18 2wcd h SER 226 CO 0.01 0.46 -0.54 0.78 -0.53 0.00 0.00 176.83 177.00 2wcd h ASN 227 N 0.95 0.45 0.22 6.23 -0.26 -1.01 -1.23 115.58 120.93 2wcd h ASN 227 Ca 0.50 -0.24 -0.02 0.00 -0.56 0.00 0.00 56.30 55.98 2wcd h ASN 227 Cb 0.56 -0.13 -0.00 0.00 -1.06 0.00 0.00 38.32 37.68 2wcd h ASN 227 CO -0.27 0.90 -0.12 0.00 -1.06 0.00 0.00 177.43 176.88 2wcd h THR 228 N 0.32 0.76 0.07 2.81 1.03 0.14 -1.63 112.91 116.41 2wcd h THR 228 Ca 0.01 -0.45 -0.00 0.00 -0.01 0.00 0.00 66.41 65.96 2wcd h THR 228 Cb 1.05 1.27 0.00 0.00 -1.07 0.00 0.00 68.15 69.39 2wcd h THR 228 CO 0.09 0.11 -0.03 0.58 -0.01 0.00 0.00 175.52 176.26 2wcd h VAL 229 N 0.00 1.01 -1.10 0.00 2.07 -0.56 -2.97 116.25 114.70 2wcd h VAL 229 Ca -0.00 -1.52 0.31 0.00 0.82 0.00 0.00 66.70 66.31 2wcd h VAL 229 Cb 0.26 1.82 -0.11 0.00 -1.52 0.00 0.00 31.29 31.74 2wcd h VAL 229 CO 0.01 0.31 0.69 0.11 0.02 0.00 0.00 177.57 178.72 2wcd h LYS 230 N -0.93 0.32 0.70 1.57 1.57 -0.99 -0.54 116.57 118.26 2wcd h LYS 230 Ca -0.01 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 2wcd h LYS 230 Cb 0.57 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.82 2wcd h LYS 230 CO 0.01 0.21 -0.33 0.37 -0.57 0.00 0.00 179.45 179.14 2wcd h GLN 231 N 0.32 -0.90 -0.72 3.15 5.75 -1.34 -1.64 115.11 119.73 2wcd h GLN 231 Ca 0.67 0.06 0.14 0.00 -0.15 0.00 0.00 58.65 59.38 2wcd h GLN 231 Cb 1.76 0.20 -0.14 0.00 1.07 0.00 0.00 27.48 30.38 2wcd h GLN 231 CO -0.38 -0.60 -0.19 0.00 -2.65 0.00 0.00 178.83 175.00 2wcd h ALA 232 N -1.38 0.45 -0.89 3.38 0.00 -1.10 0.37 119.26 120.10 2wcd h ALA 232 Ca -0.10 0.28 0.11 0.00 0.00 0.00 0.00 54.91 55.20 2wcd h ALA 232 Cb 0.72 0.57 -0.07 0.00 0.00 0.00 0.00 17.79 19.01 2wcd h ALA 232 CO 0.16 -0.43 0.57 -0.91 0.00 0.00 0.00 179.25 178.64 2wcd h ASN 233 N -0.01 0.77 -0.19 0.00 2.35 -1.09 0.38 115.58 117.79 2wcd h ASN 233 Ca 0.34 0.03 -0.20 0.00 -0.55 0.00 0.00 56.30 55.92 2wcd h ASN 233 Cb 0.53 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.77 2wcd h ASN 233 CO -0.75 0.44 -0.64 0.50 -1.65 0.00 0.00 177.43 175.34 2wcd h LYS 234 N 0.85 0.80 -0.17 0.81 3.64 0.49 -2.54 116.57 120.46 2wcd h LYS 234 Ca 0.42 -0.56 -0.03 0.00 -1.27 0.00 0.00 60.65 59.21 2wcd h LYS 234 Cb 0.46 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 2wcd h LYS 234 CO -0.18 1.19 -0.00 -0.44 -2.27 0.00 0.00 179.45 177.74 2wcd h ASP 235 N 0.59 0.29 -0.34 4.20 3.32 0.68 -1.73 116.42 123.44 2wcd h ASP 235 Ca -0.01 -0.31 0.01 0.00 0.02 0.00 0.00 57.03 56.74 2wcd h ASP 235 Cb 1.25 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.70 2wcd h ASP 235 CO 0.13 0.53 0.21 0.40 -1.72 0.00 0.00 179.24 178.80 2wcd h ILE 236 N 0.04 1.06 -0.59 0.35 2.04 -0.36 -2.01 117.51 118.05 2wcd h ILE 236 Ca 0.05 -0.15 -0.05 0.00 1.00 0.00 0.00 64.86 65.71 2wcd h ILE 236 Cb 0.38 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 2wcd h ILE 236 CO 0.01 0.08 0.16 0.44 0.00 0.00 0.00 178.15 178.84 2wcd h ASP 237 N 0.43 0.84 -0.76 1.72 5.19 -1.39 -1.46 116.42 120.99 2wcd h ASP 237 Ca 0.13 -0.15 -0.05 0.00 -0.62 0.00 0.00 57.03 56.34 2wcd h ASP 237 Cb -0.03 -0.22 -0.03 0.00 0.18 0.00 0.00 39.33 39.23 2wcd h ASP 237 CO -0.04 0.81 0.30 0.00 -3.12 0.00 0.00 179.24 177.18 2wcd h ALA 238 N 1.31 0.99 -0.12 3.45 0.00 -1.01 -1.71 119.26 122.17 2wcd h ALA 238 Ca 0.19 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2wcd h ALA 238 Cb 0.29 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2wcd h ALA 238 CO -0.00 0.62 0.05 0.00 0.00 0.00 0.00 179.25 179.92 2wcd h ALA 239 N 1.15 0.16 -0.71 0.00 0.00 -0.84 -2.17 119.26 116.85 2wcd h ALA 239 Ca 0.25 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.11 2wcd h ALA 239 Cb 0.22 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2wcd h ALA 239 CO -0.02 -0.27 0.47 0.87 0.00 0.00 0.00 179.25 180.30 2wcd h LYS 240 N 0.06 0.82 0.58 0.00 1.57 -1.06 -0.93 116.57 117.61 2wcd h LYS 240 Ca 0.04 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 2wcd h LYS 240 Cb 0.15 -0.19 0.01 0.00 0.08 0.00 0.00 32.23 32.28 2wcd h LYS 240 CO -0.00 0.55 -0.28 1.25 -0.57 0.00 0.00 179.45 180.39 2wcd h LEU 241 N 0.85 -0.66 -0.90 2.94 7.12 -1.13 -2.39 115.31 121.14 2wcd h LEU 241 Ca 0.28 0.02 0.20 0.00 0.13 0.00 0.00 57.88 58.52 2wcd h LEU 241 Cb 0.07 0.17 -0.17 0.00 -0.53 0.00 0.00 40.66 40.20 2wcd h LEU 241 CO -0.08 -0.43 -0.15 1.17 -0.13 0.00 0.00 178.44 178.81 2wcd n LYS 242 N -4.31 -0.08 0.41 1.25 4.81 -0.83 -0.98 118.16 118.43 2wcd n LYS 242 Ca -0.10 1.39 -0.19 0.00 -0.87 0.00 0.00 58.31 58.54 2wcd n LYS 242 Cb 0.31 -2.11 -0.09 0.00 0.02 0.00 0.00 35.03 33.16 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 -0.62 3.14 3.38 -1.06 -0.98 115.31 118.22 2wcd h LEU 243 Ca 0.46 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 58.39 2wcd h LEU 243 Cb 0.79 0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 2wcd h LEU 243 CO -0.90 -0.65 0.07 0.71 0.09 0.00 0.00 178.44 177.76 2wcd h THR 244 N -1.05 1.26 0.00 0.22 1.35 -0.74 0.50 112.91 114.45 2wcd h THR 244 Ca -0.10 -1.06 -0.03 0.00 -0.55 0.00 0.00 66.41 64.67 2wcd h THR 244 Cb 0.82 0.73 -0.00 0.00 -1.73 0.00 0.00 68.15 67.97 2wcd h THR 244 CO 0.15 0.39 -0.13 0.71 -0.25 0.00 0.00 175.52 176.39 2wcd h THR 245 N 0.96 0.73 0.14 6.82 1.35 -1.03 0.02 112.91 121.90 2wcd h THR 245 Ca 0.18 -0.53 -0.01 0.00 -0.55 0.00 0.00 66.41 65.51 2wcd h THR 245 Cb 0.48 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 68.22 2wcd h THR 245 CO 0.02 0.13 -0.07 -0.08 -0.25 0.00 0.00 175.52 175.27 2wcd h GLU 246 N 0.00 -0.18 -0.88 4.72 4.57 -0.50 -2.76 114.58 119.55 2wcd h GLU 246 Ca -0.00 0.01 0.21 0.00 -1.18 0.00 0.00 59.36 58.40 2wcd h GLU 246 Cb 0.31 0.04 -0.17 0.00 -0.16 0.00 0.00 28.75 28.77 2wcd h GLU 246 CO 0.02 0.24 -0.09 -0.89 -1.18 0.00 0.00 179.01 177.10 2wcd n ILE 247 N -4.89 -0.37 0.09 2.32 5.41 0.11 0.06 119.36 122.08 2wcd n ILE 247 Ca -0.07 1.97 -0.07 0.00 1.00 0.00 0.00 62.75 65.58 2wcd n ILE 247 Cb 0.25 -2.81 -0.02 0.00 -0.71 0.00 0.00 39.64 36.35 2wcd n ILE 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2wcd h ALA 248 N 1.76 0.52 -0.44 -1.39 0.00 -1.10 -0.87 119.26 117.74 2wcd h ALA 248 Ca 0.48 -0.77 -0.11 0.00 0.00 0.00 0.00 54.91 54.51 2wcd h ALA 248 Cb 0.88 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2wcd h ALA 248 CO -0.87 1.01 -0.16 0.00 0.00 0.00 0.00 179.25 179.23 2wcd h ALA 249 N 1.03 0.61 -0.63 0.00 0.00 -0.20 -0.98 119.26 119.09 2wcd h ALA 249 Ca -0.03 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 2wcd h ALA 249 Cb 1.55 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 19.16 2wcd h ALA 249 CO 0.13 0.54 0.30 0.82 0.00 0.00 0.00 179.25 181.04 2wcd h ILE 250 N 0.71 1.21 -0.74 0.00 2.04 -0.30 -2.67 117.51 117.74 2wcd h ILE 250 Ca 0.10 -0.58 0.13 0.00 1.00 0.00 0.00 64.86 65.51 2wcd h ILE 250 Cb 0.72 0.41 -0.09 0.00 -0.74 0.00 0.00 36.82 37.11 2wcd h ILE 250 CO 0.05 0.24 0.32 1.23 0.00 0.00 0.00 178.15 179.99 2wcd h GLY 251 N 0.97 1.13 0.18 5.37 0.00 0.09 -1.67 103.07 109.14 2wcd h GLY 251 Ca 0.22 -0.17 0.08 0.00 0.00 0.00 0.00 47.33 47.46 2wcd h GLY 251 CO -0.03 -0.06 -0.09 0.83 0.00 0.00 0.00 176.54 177.20 2wcd h GLU 252 N 0.49 0.01 0.59 4.80 4.39 -0.90 -1.57 114.58 122.39 2wcd h GLU 252 Ca 0.40 -0.00 -0.03 0.00 0.34 0.00 0.00 59.36 60.07 2wcd h GLU 252 Cb 0.56 -0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.21 2wcd h GLU 252 CO -0.37 0.01 -0.28 0.82 -1.16 0.00 0.00 179.01 178.03 2wcd h ILE 253 N 0.01 0.38 -0.88 3.13 2.04 -1.42 -2.96 117.51 117.82 2wcd h ILE 253 Ca 0.20 -0.17 0.09 0.00 1.00 0.00 0.00 64.86 65.99 2wcd h ILE 253 Cb 0.31 0.44 -0.11 0.00 -0.74 0.00 0.00 36.82 36.72 2wcd h ILE 253 CO -0.42 0.02 -0.48 1.17 0.00 0.00 0.00 178.15 178.44 2wcd n LYS 254 N -5.39 -0.35 -0.08 2.37 4.81 -0.71 -0.28 118.16 118.54 2wcd n LYS 254 Ca -0.12 1.33 -0.07 0.00 -0.87 0.00 0.00 58.31 58.58 2wcd n LYS 254 Cb 0.34 -1.96 -0.00 0.00 0.02 0.00 0.00 35.03 33.43 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 0.85 -0.04 3.15 1.35 -1.28 0.46 112.91 117.41 2wcd h THR 255 Ca 0.17 -0.06 0.02 0.00 -0.55 0.00 0.00 66.41 66.00 2wcd h THR 255 Cb 0.39 0.68 -0.03 0.00 -1.73 0.00 0.00 68.15 67.46 2wcd h THR 255 CO -0.83 0.03 -0.10 -0.33 -0.25 0.00 0.00 175.52 174.04 2wcd h GLU 256 N 0.16 -0.15 0.19 4.72 4.39 -0.82 0.23 114.58 123.30 2wcd h GLU 256 Ca 0.14 0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.86 2wcd h GLU 256 Cb 0.15 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.79 2wcd h GLU 256 CO -0.18 -0.10 -0.39 1.15 -1.16 0.00 0.00 179.01 178.33 2wcd h THR 257 N -0.15 0.20 -0.89 1.13 2.02 0.12 -1.12 112.91 114.22 2wcd h THR 257 Ca 0.05 0.00 0.19 0.00 0.77 0.00 0.00 66.41 67.42 2wcd h THR 257 Cb 0.22 0.20 -0.11 0.00 -1.74 0.00 0.00 68.15 66.72 2wcd h THR 257 CO -0.13 0.00 0.44 -0.08 0.37 0.00 0.00 175.52 176.12 2wcd h GLU 258 N -0.67 0.52 0.52 6.66 4.81 0.22 -0.68 114.58 125.96 2wcd h GLU 258 Ca 0.01 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 2wcd h GLU 258 Cb 0.67 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 29.94 2wcd h GLU 258 CO -0.19 0.35 -0.25 1.15 -0.73 0.00 0.00 179.01 179.34 2wcd h THR 259 N 0.54 0.00 -0.85 0.32 2.02 -0.31 -2.90 112.91 111.73 2wcd h THR 259 Ca 0.52 -0.05 0.23 0.00 0.77 0.00 0.00 66.41 67.89 2wcd h THR 259 Cb 0.88 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 67.13 2wcd h THR 259 CO -0.44 0.00 0.02 0.41 0.37 0.00 0.00 175.52 175.88 2wcd n THR 260 N -4.01 -0.35 0.08 3.16 -1.04 -0.48 0.39 114.28 112.02 2wcd n THR 260 Ca -0.09 1.86 -0.15 0.00 -2.04 0.00 0.00 64.05 63.63 2wcd n THR 260 Cb 0.27 -2.72 -0.09 0.00 -1.82 0.00 0.00 70.33 65.98 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 -0.64 -0.98 -2.82 9.65 -1.02 -1.37 114.38 117.21 2wcd h ARG 261 Ca 0.51 0.04 0.17 0.00 -1.10 0.00 0.00 59.98 59.60 2wcd h ARG 261 Cb 1.07 0.14 -0.10 0.00 -1.39 0.00 0.00 29.97 29.69 2wcd h ARG 261 CO -0.79 -0.43 0.59 0.74 2.80 0.00 0.00 179.97 182.88 2wcd h PHE 262 N -0.66 1.05 -0.97 2.20 0.04 0.13 0.85 116.94 119.59 2wcd h PHE 262 Ca 0.02 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.84 2wcd h PHE 262 Cb 0.71 -0.32 -0.05 0.00 2.20 0.00 0.00 35.95 38.49 2wcd h PHE 262 CO -0.46 0.29 0.64 1.88 -0.60 0.00 0.00 178.31 180.06 2wcd h TYR 263 N 0.81 1.20 -0.71 -0.55 0.05 -0.50 0.12 116.97 117.39 2wcd h TYR 263 Ca 0.54 0.03 0.19 0.00 0.05 0.00 0.00 58.73 59.55 2wcd h TYR 263 Cb 0.76 -0.41 -0.03 0.00 1.01 0.00 0.00 36.73 38.06 2wcd h TYR 263 CO -0.02 0.74 0.50 0.28 -1.05 0.00 0.00 178.16 178.61 2wcd h VAL 264 N 1.28 0.67 0.00 -2.88 2.07 0.23 -0.79 116.25 116.83 2wcd h VAL 264 Ca 0.36 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.86 2wcd h VAL 264 Cb -0.10 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 2wcd h VAL 264 CO -0.09 0.01 0.00 0.47 0.02 0.00 0.00 177.57 177.98 2wcd n ASP 265 N -4.36 0.10 0.15 0.57 9.92 0.41 -2.21 116.55 121.13 2wcd n ASP 265 Ca 0.14 0.53 0.02 0.00 -0.53 0.00 0.00 54.79 54.95 2wcd n ASP 265 Cb 0.73 -0.55 0.21 0.00 -0.64 0.00 0.00 41.12 40.87 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 -1.21 -3.47 116.97 113.58 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 0.53 0.00 -0.25 -1.05 0.00 0.00 178.16 177.39 2wcd n ASP 267 N -3.62 0.00 -4.56 3.88 9.92 -0.94 -4.97 116.55 116.26 2wcd n ASP 267 Ca -0.00 0.00 -0.23 0.00 -0.53 0.00 0.00 54.79 54.03 2wcd n ASP 267 Cb 0.60 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 41.02 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 0.44 4.74 0.00 -2.24 -1.08 -1.26 -4.73 116.67 112.54 2wcd s ASP 268 Ca 0.00 -0.58 0.00 0.00 -0.52 0.00 0.00 52.55 51.45 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 -3.15 0.71 0.18 0.52 0.00 0.00 175.17 173.44 2wcd n LEU 269 N 15.46 0.00 -0.24 -1.34 4.77 -1.26 -0.73 117.00 133.66 2wcd n LEU 269 Ca 0.42 0.23 0.04 0.00 -0.03 0.00 0.00 56.01 56.67 2wcd n LEU 269 Cb 0.46 -0.23 0.02 0.00 -2.33 0.00 0.00 43.42 41.34 2wcd n LEU 269 CO 0.59 -0.23 0.30 0.23 -1.33 0.00 0.00 177.39 176.95 2wcd n MET 270 N -1.21 0.86 -1.71 3.23 2.81 -1.26 -4.86 117.12 114.98 2wcd n MET 270 Ca 0.00 -0.77 -0.43 0.00 -1.81 0.00 0.00 57.70 54.69 2wcd n MET 270 Cb 0.02 -1.08 -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 -0.11 1.51 0.00 0.00 175.97 177.37 2wcd n LEU 271 N 0.14 3.84 -0.21 4.03 0.00 0.09 -4.87 117.00 120.02 2wcd n LEU 271 Ca 0.04 1.06 0.01 0.00 0.00 0.00 0.00 56.01 57.12 2wcd n LEU 271 Cb 0.17 -1.54 0.12 0.00 0.00 0.00 0.00 43.42 42.16 2wcd n LEU 271 CO 0.06 0.10 0.94 0.77 0.00 0.00 0.00 177.39 179.25 2wcd h SER 272 N 6.84 0.06 -0.04 1.96 4.64 -1.95 -0.98 113.55 124.08 2wcd h SER 272 Ca -0.44 0.11 0.01 0.00 -0.47 0.00 0.00 61.79 61.00 2wcd h SER 272 Cb 1.21 0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 63.42 2wcd h SER 272 CO 0.94 0.03 -0.14 -0.07 -0.87 0.00 0.00 176.83 176.72 2wcd h LEU 273 N 0.29 -0.45 -1.69 5.97 3.38 -1.97 0.90 115.31 121.75 2wcd h LEU 273 Ca 0.33 0.05 0.21 0.00 0.09 0.00 0.00 57.88 58.56 2wcd h LEU 273 Cb 0.48 0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.36 2wcd h LEU 273 CO -0.40 -0.13 0.58 0.25 0.09 0.00 0.00 178.44 178.83 2wcd h LEU 274 N -0.15 0.26 -0.03 1.67 5.85 -1.78 0.75 115.31 121.90 2wcd h LEU 274 Ca 0.01 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 2wcd h LEU 274 Cb 0.18 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.18 2wcd h LEU 274 CO -0.11 0.11 -0.05 0.50 -0.34 0.00 0.00 178.44 178.55 2wcd h LYS 275 N 0.27 0.08 0.22 1.25 1.63 0.08 -2.16 116.57 117.94 2wcd h LYS 275 Ca 0.43 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 60.16 2wcd h LYS 275 Cb 1.25 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.89 2wcd h LYS 275 CO -0.11 0.62 -0.11 0.93 -3.45 0.00 0.00 179.45 177.34 2wcd h GLU 276 N -0.46 -0.29 -0.89 1.90 4.39 0.29 -1.61 114.58 117.91 2wcd h GLU 276 Ca 0.00 0.02 0.24 0.00 0.34 0.00 0.00 59.36 59.96 2wcd h GLU 276 Cb 0.62 0.07 -0.14 0.00 -0.10 0.00 0.00 28.75 29.19 2wcd h GLU 276 CO 0.01 -0.15 0.25 0.00 -1.16 0.00 0.00 179.01 177.97 2wcd h ALA 277 N 0.41 1.31 -0.30 3.43 0.00 0.35 0.30 119.26 124.77 2wcd h ALA 277 Ca -0.03 0.22 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 2wcd h ALA 277 Cb 0.27 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2wcd h ALA 277 CO 0.05 -0.47 -0.20 0.00 0.00 0.00 0.00 179.25 178.63 2wcd h ALA 278 N 1.79 1.11 -0.28 0.00 0.00 -0.84 -0.77 119.26 120.26 2wcd h ALA 278 Ca 0.56 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.99 2wcd h ALA 278 Cb 1.14 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 2wcd h ALA 278 CO -0.65 0.55 -0.45 0.87 0.00 0.00 0.00 179.25 179.57 2wcd h LYS 279 N 0.49 0.81 0.06 0.00 1.57 0.37 -3.12 116.57 116.74 2wcd h LYS 279 Ca 0.08 -0.49 -0.00 0.00 -1.87 0.00 0.00 60.65 58.37 2wcd h LYS 279 Cb 0.62 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.98 2wcd h LYS 279 CO 0.04 1.12 -0.03 -0.22 -0.57 0.00 0.00 179.45 179.79 2wcd h LYS 280 N 0.57 -0.08 -0.98 3.15 3.64 -0.32 -1.92 116.57 120.63 2wcd h LYS 280 Ca 0.02 0.01 0.32 0.00 -1.27 0.00 0.00 60.65 59.73 2wcd h LYS 280 Cb 1.05 0.02 -0.15 0.00 -0.41 0.00 0.00 32.23 32.73 2wcd h LYS 280 CO 0.10 -0.03 0.50 0.52 -2.27 0.00 0.00 179.45 178.27 2wcd h MET 281 N -0.10 0.26 -0.14 1.90 2.86 -1.17 0.50 114.93 119.04 2wcd h MET 281 Ca -0.01 -0.02 -0.15 0.00 -2.06 0.00 0.00 59.70 57.46 2wcd h MET 281 Cb 0.08 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 2wcd h MET 281 CO 0.01 0.17 -0.56 0.82 1.06 0.00 0.00 176.91 178.41 2wcd h ILE 282 N 0.27 1.34 0.45 -1.22 2.04 -1.30 -1.30 117.51 117.79 2wcd h ILE 282 Ca 0.71 -1.85 -0.02 0.00 1.00 0.00 0.00 64.86 64.71 2wcd h ILE 282 Cb 1.63 1.85 0.00 0.00 -0.74 0.00 0.00 36.82 39.56 2wcd h ILE 282 CO -0.64 0.56 -0.22 0.78 0.00 0.00 0.00 178.15 178.64 2wcd h ASN 283 N 0.34 -0.52 -0.97 1.72 2.35 -0.09 -1.61 115.58 116.79 2wcd h ASN 283 Ca 0.00 0.02 0.32 0.00 -0.55 0.00 0.00 56.30 56.09 2wcd h ASN 283 Cb 1.09 0.13 -0.17 0.00 0.05 0.00 0.00 38.32 39.42 2wcd h ASN 283 CO 0.10 -0.17 0.32 0.74 -1.65 0.00 0.00 177.43 176.77 2wcd h THR 284 N -1.02 0.10 0.22 2.81 2.02 -0.21 0.43 112.91 117.26 2wcd h THR 284 Ca -0.06 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 2wcd h THR 284 Cb 0.47 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 2wcd h THR 284 CO 0.10 0.02 -0.11 0.00 0.37 0.00 0.00 175.52 175.90 2wcd h ASN 286 N -0.49 0.59 -0.25 0.00 -1.24 0.81 -0.88 115.58 114.12 2wcd h ASN 286 Ca -0.03 0.08 -0.09 0.00 0.71 0.00 0.00 56.30 56.96 2wcd h ASN 286 Cb 0.37 -0.03 -0.02 0.00 0.73 0.00 0.00 38.32 39.37 2wcd h ASN 286 CO 0.05 0.28 -0.15 -0.33 -1.29 0.00 0.00 177.43 176.00 2wcd h GLU 287 N 0.69 0.68 -0.02 6.67 5.08 -1.12 -2.15 114.58 124.41 2wcd h GLU 287 Ca 0.44 -0.23 -0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2wcd h GLU 287 Cb 0.56 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 2wcd h GLU 287 CO -0.32 0.79 0.01 -0.92 -1.00 0.00 0.00 179.01 177.57 2wcd h TYR 288 N 0.61 0.02 0.15 4.33 3.20 -0.78 -1.41 116.97 123.09 2wcd h TYR 288 Ca 0.10 0.00 -0.29 0.00 3.14 0.00 0.00 58.73 61.68 2wcd h TYR 288 Cb 0.60 -0.01 0.01 0.00 1.54 0.00 0.00 36.73 38.87 2wcd h TYR 288 CO 0.03 0.02 -1.33 1.96 -1.64 0.00 0.00 178.16 177.20 2wcd h GLN 289 N 0.03 0.32 0.22 1.82 1.08 -0.89 -2.52 115.11 115.16 2wcd h GLN 289 Ca 0.01 -0.54 -0.01 0.00 -1.45 0.00 0.00 58.65 56.66 2wcd h GLN 289 Cb 0.01 0.20 0.00 0.00 -0.05 0.00 0.00 27.48 27.64 2wcd h GLN 289 CO -0.00 1.25 -0.11 0.87 -0.95 0.00 0.00 178.83 179.89 2wcd h LYS 290 N 0.09 -0.29 0.00 1.46 1.57 -1.24 -3.39 116.57 114.78 2wcd h LYS 290 Ca -0.17 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 2wcd h LYS 290 Cb 2.01 0.06 0.00 0.00 0.08 0.00 0.00 32.23 34.39 2wcd h LYS 290 CO 0.21 -0.19 0.00 0.54 -0.57 0.00 0.00 179.45 179.44 2wcd n ARG 291 N -3.34 0.00 0.00 3.15 1.74 -0.55 -5.12 116.66 112.54 2wcd n ARG 291 Ca -0.04 0.26 0.12 0.00 -0.77 0.00 0.00 57.85 57.42 2wcd n ARG 291 Cb 0.12 -1.12 0.74 0.00 -1.02 0.00 0.00 32.46 31.18 2wcd n ARG 291 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69