#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ojg h ASP 46 N 0.00 -0.14 -0.87 4.04 3.32 -2.00 -2.95 116.42 117.82 1ojg h ASP 46 Ca 0.00 0.00 0.13 0.00 0.02 0.00 0.00 57.03 57.19 1ojg h ASP 46 Cb 0.00 0.04 -0.14 0.00 0.22 0.00 0.00 39.33 39.44 1ojg h ASP 46 CO 0.00 0.07 -0.40 -0.03 -1.72 0.00 0.00 179.24 177.16 1ojg h MET 47 N -0.51 -0.06 -0.65 3.56 4.05 -2.00 0.59 114.93 119.92 1ojg h MET 47 Ca -0.02 0.00 0.04 0.00 -0.28 0.00 0.00 59.70 59.44 1ojg h MET 47 Cb 0.13 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 30.90 1ojg h MET 47 CO 0.03 -0.04 0.43 0.00 0.23 0.00 0.00 176.91 177.56 1ojg h THR 48 N -0.06 1.08 -0.95 -0.77 1.03 -1.97 -2.91 112.91 108.36 1ojg h THR 48 Ca 0.29 -0.26 0.16 0.00 -0.01 0.00 0.00 66.41 66.59 1ojg h THR 48 Cb 0.57 0.25 -0.16 0.00 -1.07 0.00 0.00 68.15 67.74 1ojg h THR 48 CO -0.89 0.14 -0.32 -1.14 -0.01 0.00 0.00 175.52 173.29 1ojg n ARG 49 N -4.46 -0.17 -0.08 0.00 0.63 0.21 -0.31 116.66 112.47 1ojg n ARG 49 Ca 0.08 1.47 -0.10 0.00 -0.92 0.00 0.00 57.85 58.38 1ojg n ARG 49 Cb 0.14 -2.19 -0.06 0.00 0.45 0.00 0.00 32.46 30.80 1ojg n ARG 49 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1ojg h ASP 50 N 0.00 0.00 0.06 6.15 3.32 -1.55 -3.23 116.42 121.18 1ojg h ASP 50 Ca 0.38 -0.32 -0.13 0.00 0.02 0.00 0.00 57.03 56.98 1ojg h ASP 50 Cb 0.61 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.18 1ojg h ASP 50 CO -0.96 0.95 -0.55 1.23 -1.72 0.00 0.00 179.24 178.19 1ojg h GLY 51 N -1.00 0.30 0.67 2.75 0.00 -1.45 -2.44 103.07 101.90 1ojg h GLY 51 Ca -0.10 -0.64 0.07 0.00 0.00 0.00 0.00 47.33 46.66 1ojg h GLY 51 CO -0.06 0.56 0.52 -2.00 0.00 0.00 0.00 176.54 175.57 1ojg h LEU 52 N -0.41 0.80 0.08 3.11 6.46 -0.86 2.44 115.31 126.94 1ojg h LEU 52 Ca -0.09 0.02 0.02 0.00 -0.12 0.00 0.00 57.88 57.72 1ojg h LEU 52 Cb 1.36 -0.14 -0.05 0.00 -0.73 0.00 0.00 40.66 41.10 1ojg h LEU 52 CO 0.11 0.50 -0.51 0.00 -0.62 0.00 0.00 178.44 177.92 1ojg h ALA 53 N 1.42 -0.92 0.04 1.25 0.00 -1.36 -0.79 119.26 118.89 1ojg h ALA 53 Ca 0.38 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 1ojg h ALA 53 Cb 0.22 0.88 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1ojg h ALA 53 CO -0.19 -1.09 -0.02 -0.97 0.00 0.00 0.00 179.25 176.97 1ojg h ASN 54 N -0.71 -0.05 -0.94 0.00 -0.73 -0.70 -2.68 115.58 109.77 1ojg h ASN 54 Ca 0.01 0.00 0.24 0.00 1.87 0.00 0.00 56.30 58.42 1ojg h ASN 54 Cb 0.74 0.01 -0.13 0.00 0.27 0.00 0.00 38.32 39.21 1ojg h ASN 54 CO -0.30 0.03 0.47 0.11 -0.37 0.00 0.00 177.43 177.37 1ojg h LYS 55 N -0.18 0.43 0.00 6.67 1.57 0.40 -0.86 116.57 124.61 1ojg h LYS 55 Ca -0.01 -0.03 -0.19 0.00 -1.87 0.00 0.00 60.65 58.56 1ojg h LYS 55 Cb 0.04 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 1ojg h LYS 55 CO 0.01 0.29 -1.24 0.00 -0.57 0.00 0.00 179.45 177.93 1ojg h ALA 56 N 1.73 0.64 -0.30 3.86 0.00 -1.09 -3.16 119.26 120.94 1ojg h ALA 56 Ca 0.61 -0.93 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1ojg h ALA 56 Cb 1.18 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1ojg h ALA 56 CO -0.52 1.07 0.13 1.25 0.00 0.00 0.00 179.25 181.18 1ojg h LEU 57 N 0.00 0.40 -0.15 0.00 5.85 -0.84 -1.38 115.31 119.19 1ojg h LEU 57 Ca -0.14 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.42 1ojg h LEU 57 Cb 1.68 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.60 1ojg h LEU 57 CO 0.07 0.44 0.04 0.00 -0.34 0.00 0.00 178.44 178.65 1ojg h ALA 58 N 0.98 0.19 0.00 1.25 0.00 -1.32 0.04 119.26 120.41 1ojg h ALA 58 Ca 0.10 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.70 1ojg h ALA 58 Cb 0.16 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1ojg h ALA 58 CO -0.01 -0.18 -0.84 0.28 0.00 0.00 0.00 179.25 178.50 1ojg h VAL 59 N 0.05 1.57 0.00 0.00 2.07 -1.58 -1.37 116.25 116.98 1ojg h VAL 59 Ca 0.05 -2.78 -0.04 0.00 0.82 0.00 0.00 66.70 64.74 1ojg h VAL 59 Cb 0.24 2.52 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 1ojg h VAL 59 CO -0.00 0.80 -0.19 0.00 0.02 0.00 0.00 177.57 178.20 1ojg h ALA 60 N 1.12 1.54 0.00 1.67 0.00 -1.21 -0.19 119.26 122.20 1ojg h ALA 60 Ca -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1ojg h ALA 60 Cb 1.48 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1ojg h ALA 60 CO 0.11 0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.60 1ojg h ARG 61 N 0.00 0.00 -0.15 0.00 3.08 0.13 0.14 114.38 117.58 1ojg h ARG 61 Ca -0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 1ojg h ARG 61 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1ojg h ARG 61 CO 0.02 0.00 -0.42 1.15 -1.07 0.00 0.00 179.97 179.65 1ojg h THR 62 N 0.00 1.35 0.11 2.04 2.02 -0.49 -2.31 112.91 115.64 1ojg h THR 62 Ca 0.00 -1.70 -0.32 0.00 0.77 0.00 0.00 66.41 65.17 1ojg h THR 62 Cb 0.80 2.03 -0.01 0.00 -1.74 0.00 0.00 68.15 69.23 1ojg h THR 62 CO 0.00 0.51 -1.63 -0.07 0.37 0.00 0.00 175.52 174.71 1ojg h LEU 63 N 0.17 0.38 -0.98 2.58 -0.00 -1.62 -2.87 115.31 112.97 1ojg h LEU 63 Ca -0.01 -0.58 0.00 0.00 -0.00 0.00 0.00 57.88 57.29 1ojg h LEU 63 Cb 1.04 -0.12 0.00 0.00 -0.00 0.00 0.00 40.66 41.57 1ojg h LEU 63 CO 0.09 1.49 0.00 0.00 -0.00 0.00 0.00 178.44 180.02 1ojg n ALA 64 N -2.72 1.17 0.87 1.53 0.00 0.47 0.22 120.51 122.06 1ojg n ALA 64 Ca -0.19 0.13 0.11 0.00 0.00 0.00 0.00 53.44 53.49 1ojg n ALA 64 Cb 1.05 -1.27 0.06 0.00 0.00 0.00 0.00 19.45 19.29 1ojg n ALA 64 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1ojg n ASP 65 N -2.08 0.69 -3.68 0.00 2.03 -0.87 -4.75 116.55 107.89 1ojg n ASP 65 Ca -0.00 -0.49 0.00 0.00 0.52 0.00 0.00 54.79 54.82 1ojg n ASP 65 Cb 0.07 0.66 0.00 0.00 -0.72 0.00 0.00 41.12 41.13 1ojg n ASP 65 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1ojg n SER 66 N -1.63 0.00 -0.10 1.67 2.88 0.13 -5.00 113.62 111.57 1ojg n SER 66 Ca 0.04 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.45 1ojg n SER 66 Cb 0.36 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.72 1ojg n SER 66 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1ojg n PRO 67 N 0.00 0.68 -0.29 -1.46 -0.04 -1.26 -4.37 135.00 128.26 1ojg n PRO 67 Ca 0.00 0.09 0.34 0.00 -0.04 0.00 0.00 63.50 63.89 1ojg n PRO 67 Cb 0.00 -1.41 0.74 0.00 -0.04 0.00 0.00 33.50 32.79 1ojg n PRO 67 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1ojg h GLU 68 N 0.00 0.00 0.00 0.54 4.11 -1.94 -2.88 114.58 114.41 1ojg h GLU 68 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 1ojg h GLU 68 Cb 1.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.02 1ojg h GLU 68 CO -0.05 0.00 0.00 -0.89 0.07 0.00 0.00 179.01 178.14 1ojg n ILE 69 N -4.13 0.00 -0.41 -1.06 2.08 -1.26 0.17 119.36 114.75 1ojg n ILE 69 Ca 0.24 1.08 0.38 0.00 0.56 0.00 0.00 62.75 65.00 1ojg n ILE 69 Cb 1.21 -1.99 0.73 0.00 -0.75 0.00 0.00 39.64 38.84 1ojg n ILE 69 CO 0.00 0.00 0.00 -0.09 0.56 0.00 0.00 176.55 177.02 1ojg h ARG 70 N 0.00 0.05 0.00 0.38 2.43 -1.78 5.33 114.38 120.79 1ojg h ARG 70 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1ojg h ARG 70 Cb 0.00 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1ojg h ARG 70 CO 0.00 0.03 0.00 0.94 -1.51 0.00 0.00 179.97 179.43 1ojg n GLN 71 N -4.23 0.23 0.03 0.20 7.27 -1.04 -1.91 117.38 117.94 1ojg n GLN 71 Ca 0.30 0.21 -0.21 0.00 0.07 0.00 0.00 57.00 57.37 1ojg n GLN 71 Cb 1.37 -1.78 -0.14 0.00 2.41 0.00 0.00 30.24 32.10 1ojg n GLN 71 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 1ojg h GLY 72 N 4.38 0.32 -0.06 1.69 0.00 2.08 -3.06 103.07 108.42 1ojg h GLY 72 Ca 0.00 -0.81 0.23 0.00 0.00 0.00 0.00 47.33 46.75 1ojg h GLY 72 CO 0.00 0.71 0.60 1.41 0.00 0.00 0.00 176.54 179.26 1ojg h LEU 73 N -0.31 0.70 0.00 3.11 4.07 -0.73 4.51 115.31 126.67 1ojg h LEU 73 Ca -0.25 0.12 0.00 0.00 0.08 0.00 0.00 57.88 57.84 1ojg h LEU 73 Cb 1.74 0.01 0.00 0.00 1.08 0.00 0.00 40.66 43.49 1ojg h LEU 73 CO 0.10 0.15 0.00 1.67 -1.08 0.00 0.00 178.44 179.28 1ojg n GLN 74 N -4.84 0.23 0.00 1.13 7.27 -0.80 -4.66 117.38 115.71 1ojg n GLN 74 Ca 0.26 0.10 0.00 0.00 0.07 0.00 0.00 57.00 57.43 1ojg n GLN 74 Cb 0.70 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.85 1ojg n GLN 74 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 1ojg n LYS 75 N -1.14 3.45 -4.32 3.69 3.00 1.48 -5.08 118.16 119.24 1ojg n LYS 75 Ca 0.06 0.00 -0.16 0.00 -0.00 0.00 0.00 58.31 58.21 1ojg n LYS 75 Cb 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 35.03 34.98 1ojg n LYS 75 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 1ojg s LYS 76 N 1.18 1.38 0.00 1.64 0.00 -1.25 -4.64 119.74 118.06 1ojg s LYS 76 Ca 0.00 -1.73 0.00 0.00 0.00 0.00 0.00 55.97 54.24 1ojg s LYS 76 Cb 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 37.83 37.49 1ojg s LYS 76 CO 0.00 -0.24 0.77 -0.35 0.00 0.00 0.00 175.35 175.52 1ojg n PRO 77 N -0.45 0.00 0.14 1.78 -0.04 -1.26 -1.29 135.00 133.88 1ojg n PRO 77 Ca -0.02 0.77 0.08 0.00 -0.04 0.00 0.00 63.50 64.29 1ojg n PRO 77 Cb 0.66 -1.23 0.42 0.00 -0.04 0.00 0.00 33.50 33.31 1ojg n PRO 77 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1ojg n GLN 78 N -2.24 0.10 0.00 0.54 3.00 -1.26 -2.02 117.38 115.51 1ojg n GLN 78 Ca 0.00 0.58 0.00 0.00 -0.01 0.00 0.00 57.00 57.57 1ojg n GLN 78 Cb 0.00 -1.97 0.00 0.00 0.00 0.00 0.00 30.24 28.27 1ojg n GLN 78 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 1ojg n GLU 79 N -2.07 0.09 0.00 -1.09 2.13 -1.02 -5.04 120.64 113.65 1ojg n GLU 79 Ca -0.01 -0.72 0.00 0.00 0.66 0.00 0.00 57.16 57.09 1ojg n GLU 79 Cb 0.16 -0.96 0.00 0.00 0.27 0.00 0.00 31.44 30.92 1ojg n GLU 79 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1ojg n SER 80 N -0.13 0.00 -2.97 4.31 2.88 -0.41 -4.85 113.62 112.44 1ojg n SER 80 Ca 0.00 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.39 1ojg n SER 80 Cb 0.09 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.56 1ojg n SER 80 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ojg n GLY 81 N 1.74 1.84 0.00 0.46 0.00 -1.26 -4.95 105.19 103.01 1ojg n GLY 81 Ca 0.00 -0.81 0.03 0.00 0.00 0.00 0.00 46.02 45.24 1ojg n GLY 81 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1ojg n ILE 82 N 0.92 0.00 0.26 -0.61 0.13 -1.26 -3.88 119.36 114.91 1ojg n ILE 82 Ca 0.16 0.00 0.10 0.00 -1.10 0.00 0.00 62.75 61.91 1ojg n ILE 82 Cb 0.63 -0.22 0.68 0.00 -0.84 0.00 0.00 39.64 39.89 1ojg n ILE 82 CO 0.00 0.00 0.00 0.06 2.80 0.00 0.00 176.55 179.41 1ojg h GLN 83 N 0.00 0.00 0.00 9.51 3.07 -1.95 -2.45 115.11 123.29 1ojg h GLN 83 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1ojg h GLN 83 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 1ojg h GLN 83 CO 0.00 0.12 -0.15 0.00 0.09 0.00 0.00 178.83 178.89 1ojg h ALA 84 N 1.88 0.00 -0.97 0.06 0.00 -1.98 -2.94 119.26 115.32 1ojg h ALA 84 Ca -0.00 -0.15 0.31 0.00 0.00 0.00 0.00 54.91 55.07 1ojg h ALA 84 Cb 0.26 0.15 -0.17 0.00 0.00 0.00 0.00 17.79 18.03 1ojg h ALA 84 CO 0.02 0.15 0.25 -0.84 0.00 0.00 0.00 179.25 178.82 1ojg h ILE 85 N -0.94 0.09 -0.80 0.00 -2.65 -1.84 13.72 117.51 125.09 1ojg h ILE 85 Ca 0.00 -0.02 0.23 0.00 1.03 0.00 0.00 64.86 66.10 1ojg h ILE 85 Cb 0.15 0.02 -0.03 0.00 -2.05 0.00 0.00 36.82 34.90 1ojg h ILE 85 CO 0.00 0.01 0.96 0.00 0.03 0.00 0.00 178.15 179.15 1ojg h ALA 86 N 1.94 2.65 -0.87 0.16 0.00 -1.35 12.05 119.26 133.85 1ojg h ALA 86 Ca 0.67 -0.03 0.20 0.00 0.00 0.00 0.00 54.91 55.76 1ojg h ALA 86 Cb 1.53 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 19.32 1ojg h ALA 86 CO -0.81 -1.37 0.58 0.93 0.00 0.00 0.00 179.25 178.58 1ojg h GLU 87 N 0.00 0.32 0.00 0.00 5.08 3.12 4.79 114.58 127.88 1ojg h GLU 87 Ca 0.38 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.63 1ojg h GLU 87 Cb 2.30 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 31.47 1ojg h GLU 87 CO -0.00 0.21 -0.43 0.00 -1.00 0.00 0.00 179.01 177.78 1ojg h ALA 88 N 1.61 1.27 0.19 3.43 0.00 2.69 -2.72 119.26 125.73 1ojg h ALA 88 Ca 0.44 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ojg h ALA 88 Cb 1.21 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1ojg h ALA 88 CO -0.14 0.54 -0.32 0.28 0.00 0.00 0.00 179.25 179.61 1ojg h VAL 89 N 0.00 0.31 0.63 0.00 2.07 0.97 -1.77 116.25 118.47 1ojg h VAL 89 Ca -0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 1ojg h VAL 89 Cb 0.77 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1ojg h VAL 89 CO 0.06 0.00 -0.50 -0.09 0.02 0.00 0.00 177.57 177.05 1ojg h ARG 90 N -0.60 -1.06 -0.26 1.57 2.43 -1.08 -0.52 114.38 114.87 1ojg h ARG 90 Ca 0.01 0.07 0.05 0.00 -0.81 0.00 0.00 59.98 59.31 1ojg h ARG 90 Cb 0.59 0.24 -0.05 0.00 -0.42 0.00 0.00 29.97 30.34 1ojg h ARG 90 CO -0.14 -0.71 -0.06 -0.22 -1.51 0.00 0.00 179.97 177.33 1ojg h LYS 91 N -1.10 0.00 0.00 0.20 1.63 -1.45 -3.15 116.57 112.71 1ojg h LYS 91 Ca -0.08 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.72 1ojg h LYS 91 Cb 0.92 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.55 1ojg h LYS 91 CO 0.01 0.00 0.00 0.54 -3.45 0.00 0.00 179.45 176.55 1ojg n ARG 92 N -5.23 0.00 -1.09 1.90 5.12 -0.67 -4.77 116.66 111.93 1ojg n ARG 92 Ca -0.01 0.05 -0.00 0.00 -1.93 0.00 0.00 57.85 55.95 1ojg n ARG 92 Cb 0.15 -0.92 -0.01 0.00 -1.16 0.00 0.00 32.46 30.52 1ojg n ARG 92 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1ojg n ASN 93 N -0.46 0.12 0.00 0.55 0.23 -0.85 -4.94 115.26 109.91 1ojg n ASN 93 Ca 0.00 -1.89 0.00 0.00 -0.53 0.00 0.00 54.58 52.16 1ojg n ASN 93 Cb 0.00 -0.07 0.00 0.00 -2.08 0.00 0.00 39.78 37.63 1ojg n ASN 93 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 1ojg n ASP 94 N 0.22 0.00 -3.94 0.53 2.03 -0.26 -4.93 116.55 110.20 1ojg n ASP 94 Ca -0.06 0.00 -0.09 0.00 0.52 0.00 0.00 54.79 55.16 1ojg n ASP 94 Cb 0.87 -1.10 -0.08 0.00 -0.72 0.00 0.00 41.12 40.10 1ojg n ASP 94 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 1ojg s LEU 95 N 0.00 1.36 0.00 -2.67 0.05 -1.23 -4.82 118.68 111.37 1ojg s LEU 95 Ca 0.00 -0.80 0.00 0.00 0.05 0.00 0.00 54.13 53.38 1ojg s LEU 95 Cb 0.00 0.97 0.00 0.00 -2.05 0.00 0.00 46.19 45.11 1ojg s LEU 95 CO 0.00 -0.78 0.00 0.18 -0.55 0.00 0.00 176.35 175.20 1ojg n LEU 96 N -0.11 0.00 -3.92 1.48 4.77 -1.26 -4.75 117.00 113.21 1ojg n LEU 96 Ca -0.11 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.58 1ojg n LEU 96 Cb 0.63 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.59 1ojg n LEU 96 CO 0.24 0.00 -0.06 -0.36 -1.33 0.00 0.00 177.39 175.88 1ojg s PHE 97 N -1.98 3.48 -0.44 -1.77 0.08 0.22 -3.58 117.98 114.00 1ojg s PHE 97 Ca 0.00 -3.29 -0.23 0.00 0.12 0.00 0.00 56.93 53.52 1ojg s PHE 97 Cb 0.00 -2.75 0.02 0.00 -0.57 0.00 0.00 43.02 39.72 1ojg s PHE 97 CO 0.00 -0.60 0.80 -1.50 -0.10 0.00 0.00 175.22 173.82 1ojg s ILE 98 N -1.15 4.64 -0.04 0.64 2.07 -1.26 -1.86 121.20 124.24 1ojg s ILE 98 Ca 0.23 0.51 0.07 0.00 -1.41 0.00 0.00 60.65 60.05 1ojg s ILE 98 Cb -0.10 -4.32 -0.01 0.00 0.13 0.00 0.00 42.46 38.15 1ojg s ILE 98 CO -0.12 -0.70 -0.25 0.54 -1.91 0.00 0.00 174.94 172.50 1ojg s VAL 99 N 3.33 1.99 -0.05 4.00 0.11 -0.76 -3.79 120.40 125.23 1ojg s VAL 99 Ca 0.31 -1.06 0.04 0.00 -2.93 0.00 0.00 61.98 58.34 1ojg s VAL 99 Cb -0.12 -1.67 -0.03 0.00 -1.53 0.00 0.00 36.38 33.03 1ojg s VAL 99 CO 0.23 0.56 -0.14 -0.69 -3.33 0.00 0.00 175.10 171.73 1ojg s VAL 100 N -0.37 3.09 0.05 2.04 1.01 -1.26 -1.14 120.40 123.83 1ojg s VAL 100 Ca 0.03 -0.72 0.09 0.00 0.00 0.00 0.00 61.98 61.37 1ojg s VAL 100 Cb -0.12 -2.22 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 1ojg s VAL 100 CO 0.01 0.58 -0.24 0.42 0.00 0.00 0.00 175.10 175.88 1ojg s THR 101 N -0.74 1.94 0.00 3.92 -4.23 0.27 -4.74 115.64 112.05 1ojg s THR 101 Ca 0.12 -1.35 0.00 0.00 -1.18 0.00 0.00 61.69 59.27 1ojg s THR 101 Cb -0.11 -1.68 0.00 0.00 1.34 0.00 0.00 72.50 72.05 1ojg s THR 101 CO 0.01 0.26 0.00 -0.67 -0.54 0.00 0.00 174.62 173.68 1ojg n ASP 102 N 1.70 -0.47 -3.55 3.99 -0.08 -1.26 -3.39 116.55 113.49 1ojg n ASP 102 Ca -0.17 -0.57 -0.40 0.00 -1.51 0.00 0.00 54.79 52.14 1ojg n ASP 102 Cb 0.53 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.97 1ojg n ASP 102 CO 0.00 0.00 0.00 0.80 0.12 0.00 0.00 177.20 178.12 1ojg n MET 103 N -1.04 2.97 -3.15 -0.67 0.00 -1.26 -4.33 117.12 109.63 1ojg n MET 103 Ca 0.00 -2.33 0.05 0.00 -0.00 0.00 0.00 57.70 55.42 1ojg n MET 103 Cb 0.00 -3.04 -0.01 0.00 0.00 0.00 0.00 33.22 30.16 1ojg n MET 103 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 175.97 174.83 1ojg s GLN 104 N 3.03 0.26 0.93 2.12 -0.44 -1.26 -5.10 119.66 119.20 1ojg s GLN 104 Ca 0.55 0.42 -0.10 0.00 -2.50 0.00 0.00 55.36 53.72 1ojg s GLN 104 Cb 0.15 0.23 0.15 0.00 -1.64 0.00 0.00 33.01 31.90 1ojg s GLN 104 CO -0.06 -0.32 1.13 0.45 0.50 0.00 0.00 175.29 176.98 1ojg s SER 105 N 2.93 2.86 0.00 6.67 0.15 -1.26 -4.82 113.70 120.24 1ojg s SER 105 Ca 0.07 2.06 0.00 0.00 0.70 0.00 0.00 55.95 58.78 1ojg s SER 105 Cb -0.10 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 1ojg s SER 105 CO -0.15 -3.12 0.00 -0.11 1.20 0.00 0.00 173.24 171.06 1ojg n LEU 106 N -4.24 0.00 -4.60 3.45 7.94 -1.26 -4.93 117.00 113.37 1ojg n LEU 106 Ca 0.10 0.00 -0.43 0.00 -1.11 0.00 0.00 56.01 54.58 1ojg n LEU 106 Cb 0.52 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 44.45 1ojg n LEU 106 CO 0.51 0.00 1.22 -0.13 -1.11 0.00 0.00 177.39 177.87 1ojg s ARG 107 N -2.38 3.55 0.22 1.96 0.52 -1.26 -4.76 118.95 116.80 1ojg s ARG 107 Ca 0.00 0.83 0.01 0.00 -0.52 0.00 0.00 55.73 56.05 1ojg s ARG 107 Cb 0.00 -4.03 0.21 0.00 0.52 0.00 0.00 34.95 31.65 1ojg s ARG 107 CO 0.00 -1.60 1.56 1.88 0.02 0.00 0.00 175.30 177.16 1ojg h TYR 108 N 10.61 0.53 -2.59 -0.53 -1.99 -1.85 -3.45 116.97 117.69 1ojg h TYR 108 Ca -0.27 -0.18 -0.63 0.00 2.00 0.00 0.00 58.73 59.65 1ojg h TYR 108 Cb 1.10 -0.10 -0.16 0.00 2.00 0.00 0.00 36.73 39.57 1ojg h TYR 108 CO 0.98 0.86 -0.78 0.45 -0.00 0.00 0.00 178.16 179.67 1ojg s SER 109 N -6.90 3.55 0.00 3.88 0.15 -1.25 -4.91 113.70 108.23 1ojg s SER 109 Ca -0.06 -0.96 0.00 0.00 0.70 0.00 0.00 55.95 55.63 1ojg s SER 109 Cb 0.12 -0.29 0.00 0.00 -1.71 0.00 0.00 66.02 64.13 1ojg s SER 109 CO 0.82 0.07 0.00 1.57 1.20 0.00 0.00 173.24 176.90 1ojg n HIS 110 N -0.28 0.00 0.31 3.44 -0.00 -1.23 -4.13 115.22 113.32 1ojg n HIS 110 Ca -0.08 0.00 -0.16 0.00 -0.00 0.00 0.00 57.72 57.48 1ojg n HIS 110 Cb 0.58 0.00 -0.09 0.00 -0.00 0.00 0.00 29.99 30.49 1ojg n HIS 110 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1ojg h PRO 111 N 0.00 -0.72 -6.83 1.57 0.13 -1.95 -3.41 132.00 120.79 1ojg h PRO 111 Ca 0.00 0.05 -0.48 0.00 -0.87 0.00 0.00 66.00 64.70 1ojg h PRO 111 Cb 0.00 0.16 -0.02 0.00 0.13 0.00 0.00 31.00 31.28 1ojg h PRO 111 CO 0.00 -0.45 0.35 -1.21 -0.23 0.00 0.00 178.00 176.46 1ojg s GLU 112 N -5.78 4.69 -0.01 0.86 2.02 -1.26 -4.98 118.70 114.23 1ojg s GLU 112 Ca -0.16 1.41 -0.20 0.00 0.02 0.00 0.00 54.97 56.04 1ojg s GLU 112 Cb 0.03 -3.00 -0.32 0.00 0.10 0.00 0.00 34.13 30.94 1ojg s GLU 112 CO 0.60 0.37 0.96 0.00 0.02 0.00 0.00 175.26 177.21 1ojg h ALA 113 N 3.58 -0.09 -0.54 5.21 0.00 -2.01 -3.37 119.26 122.03 1ojg h ALA 113 Ca -0.46 -0.74 -0.01 0.00 0.00 0.00 0.00 54.91 53.71 1ojg h ALA 113 Cb 1.20 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 1ojg h ALA 113 CO 0.66 0.48 0.31 1.96 0.00 0.00 0.00 179.25 182.66 1ojg h GLN 114 N -0.15 0.73 -0.15 0.00 1.08 -1.97 -2.67 115.11 111.98 1ojg h GLN 114 Ca -0.17 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 56.94 1ojg h GLN 114 Cb 1.78 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 29.05 1ojg h GLN 114 CO 0.19 0.53 -0.00 -0.09 -0.95 0.00 0.00 178.83 178.51 1ojg h ARG 115 N 0.74 0.22 0.00 1.46 9.65 -2.00 -3.30 114.38 121.15 1ojg h ARG 115 Ca 0.19 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.04 1ojg h ARG 115 Cb 0.00 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.54 1ojg h ARG 115 CO -0.03 0.24 0.00 -0.89 2.80 0.00 0.00 179.97 182.09 1ojg n ILE 116 N -4.41 0.00 0.04 1.20 5.41 -1.01 -2.63 119.36 117.97 1ojg n ILE 116 Ca -0.01 0.86 0.00 0.00 1.00 0.00 0.00 62.75 64.60 1ojg n ILE 116 Cb 0.16 -1.65 0.00 0.00 -0.71 0.00 0.00 39.64 37.44 1ojg n ILE 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ojg n GLY 117 N -0.51 -0.06 0.00 7.39 0.00 -1.24 -3.10 105.19 107.67 1ojg n GLY 117 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ojg n GLY 117 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ojg n GLN 118 N -0.90 0.00 -0.81 1.61 1.13 -1.08 -4.90 117.38 112.43 1ojg n GLN 118 Ca 0.00 0.46 -0.33 0.00 -1.94 0.00 0.00 57.00 55.19 1ojg n GLN 118 Cb 0.41 -0.96 -0.05 0.00 0.11 0.00 0.00 30.24 29.75 1ojg n GLN 118 CO 0.00 0.00 0.00 -2.30 -1.44 0.00 0.00 177.06 173.32 1ojg n PRO 119 N -1.95 0.00 -3.62 -1.09 -0.01 -1.18 -4.92 135.00 122.24 1ojg n PRO 119 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 63.50 63.44 1ojg n PRO 119 Cb 0.00 -0.74 -0.04 0.00 -0.01 0.00 0.00 33.50 32.70 1ojg n PRO 119 CO 0.00 0.00 0.00 0.12 -0.01 0.00 0.00 175.50 175.61 1ojg s PHE 120 N 1.84 -0.15 -0.13 6.00 5.36 -1.26 -4.50 117.98 125.14 1ojg s PHE 120 Ca 0.54 0.26 0.00 0.00 -0.96 0.00 0.00 56.93 56.77 1ojg s PHE 120 Cb -0.74 0.48 0.00 0.00 -0.34 0.00 0.00 43.02 42.42 1ojg s PHE 120 CO 0.39 -0.14 0.00 1.17 -1.46 0.00 0.00 175.22 175.18 1ojg n LYS 121 N 0.61 -1.89 0.08 10.12 4.81 -1.26 -4.62 118.16 126.01 1ojg n LYS 121 Ca -0.04 0.27 0.02 0.00 -0.87 0.00 0.00 58.31 57.69 1ojg n LYS 121 Cb 0.59 -3.77 0.10 0.00 0.02 0.00 0.00 35.03 31.97 1ojg n LYS 121 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ojg n GLY 122 N 0.37 -0.30 4.75 3.14 0.00 -1.26 -4.68 105.19 107.20 1ojg n GLY 122 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1ojg n GLY 122 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ojg n ASP 123 N -1.54 0.00 0.12 1.61 8.00 -1.26 -4.62 116.55 118.85 1ojg n ASP 123 Ca -0.00 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.47 1ojg n ASP 123 Cb 0.44 -1.13 0.08 0.00 -0.02 0.00 0.00 41.12 40.48 1ojg n ASP 123 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1ojg h ASP 124 N 0.00 0.00 0.58 -2.24 3.32 -1.98 -3.16 116.42 112.95 1ojg h ASP 124 Ca 0.00 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.81 1ojg h ASP 124 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1ojg h ASP 124 CO 0.00 0.72 -1.06 0.16 -1.72 0.00 0.00 179.24 177.34 1ojg h ILE 125 N 0.00 1.49 -1.61 0.35 3.07 -1.95 -3.28 117.51 115.59 1ojg h ILE 125 Ca -0.01 -2.83 0.50 0.00 1.55 0.00 0.00 64.86 64.07 1ojg h ILE 125 Cb 1.32 2.69 -0.10 0.00 -0.27 0.00 0.00 36.82 40.47 1ojg h ILE 125 CO 0.09 0.83 1.11 0.18 -1.05 0.00 0.00 178.15 179.32 1ojg n LEU 126 N -3.60 0.08 -0.00 0.16 7.99 -1.19 0.22 117.00 120.66 1ojg n LEU 126 Ca -0.06 1.08 -0.21 0.00 -0.01 0.00 0.00 56.01 56.81 1ojg n LEU 126 Cb 0.92 -0.54 -0.14 0.00 -0.11 0.00 0.00 43.42 43.55 1ojg n LEU 126 CO 0.51 -1.13 -0.82 0.29 -1.51 0.00 0.00 177.39 174.73 1ojg n LYS 127 N -4.13 0.75 -0.03 3.23 4.76 -1.24 -4.15 118.16 117.36 1ojg n LYS 127 Ca 0.40 0.27 -0.16 0.00 -2.87 0.00 0.00 58.31 55.95 1ojg n LYS 127 Cb 1.70 -1.70 -0.13 0.00 -1.84 0.00 0.00 35.03 33.06 1ojg n LYS 127 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ojg h ALA 128 N 0.06 -0.01 -0.82 7.82 0.00 0.84 -2.22 119.26 124.92 1ojg h ALA 128 Ca -0.43 -0.53 0.31 0.00 0.00 0.00 0.00 54.91 54.26 1ojg h ALA 128 Cb 2.02 0.03 -0.15 0.00 0.00 0.00 0.00 17.79 19.68 1ojg h ALA 128 CO 0.08 0.10 0.31 1.28 0.00 0.00 0.00 179.25 181.02 1ojg n LEU 129 N -4.48 0.17 -1.76 0.00 4.77 0.59 0.27 117.00 116.56 1ojg n LEU 129 Ca -0.11 1.37 0.02 0.00 -0.03 0.00 0.00 56.01 57.26 1ojg n LEU 129 Cb 0.56 -0.62 0.34 0.00 -2.33 0.00 0.00 43.42 41.37 1ojg n LEU 129 CO 0.39 -1.49 0.91 0.59 -1.33 0.00 0.00 177.39 176.45 1ojg n ASN 130 N -4.96 4.99 -0.94 -1.43 5.03 -1.22 -4.33 115.26 112.41 1ojg n ASN 130 Ca 0.28 -3.10 0.00 0.00 0.87 0.00 0.00 54.58 52.63 1ojg n ASN 130 Cb 0.93 -0.69 0.00 0.00 -1.02 0.00 0.00 39.78 39.00 1ojg n ASN 130 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ojg n GLY 131 N 0.07 -1.78 0.00 7.41 0.00 0.75 -4.93 105.19 106.71 1ojg n GLY 131 Ca 0.32 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1ojg n GLY 131 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ojg n GLU 132 N 0.42 0.00 -2.87 1.61 4.07 -0.86 -4.63 120.64 118.39 1ojg n GLU 132 Ca 0.00 0.00 -0.38 0.00 -0.06 0.00 0.00 57.16 56.72 1ojg n GLU 132 Cb 0.00 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 31.32 1ojg n GLU 132 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 1ojg s GLU 133 N -1.05 4.60 -0.18 5.31 2.02 -1.26 -3.41 118.70 124.73 1ojg s GLU 133 Ca 0.00 1.26 -0.28 0.00 0.02 0.00 0.00 54.97 55.97 1ojg s GLU 133 Cb 0.00 -3.04 0.09 0.00 0.10 0.00 0.00 34.13 31.28 1ojg s GLU 133 CO 0.00 0.42 0.80 1.21 0.02 0.00 0.00 175.26 177.71 1ojg s ASN 134 N -1.41 -0.62 0.05 -0.19 3.84 -1.17 -4.90 114.94 110.56 1ojg s ASN 134 Ca 0.43 0.95 0.02 0.00 0.21 0.00 0.00 52.86 54.48 1ojg s ASN 134 Cb -0.21 0.88 -0.03 0.00 -0.55 0.00 0.00 41.25 41.34 1ojg s ASN 134 CO 0.26 -0.37 -0.08 0.54 -2.79 0.00 0.00 177.10 174.66 1ojg s VAL 135 N -0.40 0.61 0.19 -5.21 0.11 -1.26 0.71 120.40 115.14 1ojg s VAL 135 Ca -0.04 -1.26 -0.22 0.00 -2.93 0.00 0.00 61.98 57.54 1ojg s VAL 135 Cb -0.03 -0.84 0.05 0.00 -1.53 0.00 0.00 36.38 34.04 1ojg s VAL 135 CO 0.03 -0.46 0.62 0.00 -3.33 0.00 0.00 175.10 171.95 1ojg s ALA 136 N -1.79 -1.44 -0.09 1.54 0.00 -0.67 -4.98 121.76 114.33 1ojg s ALA 136 Ca -0.05 0.23 -0.05 0.00 0.00 0.00 0.00 51.96 52.09 1ojg s ALA 136 Cb -0.07 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.88 1ojg s ALA 136 CO -0.00 -0.83 0.14 0.42 0.00 0.00 0.00 175.76 175.48 1ojg s ILE 137 N -3.80 5.39 0.25 0.00 1.01 -1.26 -1.81 121.20 120.97 1ojg s ILE 137 Ca 0.04 0.07 0.07 0.00 0.00 0.00 0.00 60.65 60.83 1ojg s ILE 137 Cb -0.02 -3.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.02 1ojg s ILE 137 CO -0.08 0.54 0.16 0.21 0.00 0.00 0.00 174.94 175.77 1ojg s ASN 138 N -1.27 5.38 -0.27 3.58 3.84 -0.62 -4.99 114.94 120.59 1ojg s ASN 138 Ca 0.18 -0.30 -0.01 0.00 0.21 0.00 0.00 52.86 52.94 1ojg s ASN 138 Cb -0.12 -1.32 0.13 0.00 -0.55 0.00 0.00 41.25 39.39 1ojg s ASN 138 CO 0.08 -0.02 0.31 -0.13 -2.79 0.00 0.00 177.10 174.54 1ojg s ARG 139 N -3.76 0.31 0.09 0.43 0.52 -1.26 -2.95 118.95 112.33 1ojg s ARG 139 Ca 0.32 0.04 -0.04 0.00 -0.52 0.00 0.00 55.73 55.53 1ojg s ARG 139 Cb -0.08 -0.68 -0.02 0.00 0.52 0.00 0.00 34.95 34.69 1ojg s ARG 139 CO 0.24 -0.92 0.09 0.20 0.02 0.00 0.00 175.30 174.94 1ojg s GLY 140 N 2.40 0.44 -0.39 -3.53 0.00 -1.26 -4.87 107.32 100.10 1ojg s GLY 140 Ca 0.09 -1.02 -0.43 0.00 0.00 0.00 0.00 44.72 43.36 1ojg s GLY 140 CO -0.27 -1.10 1.74 0.69 0.00 0.00 0.00 173.10 174.16 1ojg n PHE 141 N -0.02 1.84 0.00 1.90 3.72 -1.26 0.25 117.46 123.89 1ojg n PHE 141 Ca -0.12 0.80 0.00 0.00 -0.05 0.00 0.00 57.45 58.08 1ojg n PHE 141 Cb 0.62 -2.35 0.00 0.00 -0.94 0.00 0.00 39.48 36.81 1ojg n PHE 141 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 1ojg n LEU 142 N 5.18 0.00 0.02 4.37 7.94 -1.26 -4.69 117.00 128.56 1ojg n LEU 142 Ca 0.31 0.00 0.14 0.00 -1.11 0.00 0.00 56.01 55.35 1ojg n LEU 142 Cb 0.04 -0.38 0.53 0.00 0.53 0.00 0.00 43.42 44.14 1ojg n LEU 142 CO 0.85 0.00 0.88 0.00 -1.11 0.00 0.00 177.39 178.01 1ojg n ALA 143 N 0.87 2.47 -1.48 1.96 0.00 0.68 -4.80 120.51 120.20 1ojg n ALA 143 Ca 0.00 -0.12 -0.63 0.00 0.00 0.00 0.00 53.44 52.70 1ojg n ALA 143 Cb 0.00 -1.42 -0.11 0.00 0.00 0.00 0.00 19.45 17.92 1ojg n ALA 143 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1ojg n GLN 144 N -1.64 0.11 -3.46 0.00 6.02 -1.00 -4.40 117.38 113.00 1ojg n GLN 144 Ca 0.07 0.03 -0.12 0.00 -0.01 0.00 0.00 57.00 56.97 1ojg n GLN 144 Cb 0.36 -1.57 -0.02 0.00 1.02 0.00 0.00 30.24 30.02 1ojg n GLN 144 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ojg s ALA 145 N 4.76 -1.47 0.26 -1.58 0.00 -1.15 -4.51 121.76 118.07 1ojg s ALA 145 Ca 1.13 0.38 0.07 0.00 0.00 0.00 0.00 51.96 53.54 1ojg s ALA 145 Cb -1.45 0.85 -0.03 0.00 0.00 0.00 0.00 23.12 22.49 1ojg s ALA 145 CO 0.72 -0.75 0.23 -1.17 0.00 0.00 0.00 175.76 174.79 1ojg s LEU 146 N -2.76 3.84 -0.06 0.00 2.96 -1.21 -1.59 118.68 119.85 1ojg s LEU 146 Ca 0.02 -0.25 -0.14 0.00 -0.22 0.00 0.00 54.13 53.53 1ojg s LEU 146 Cb -0.01 -2.39 0.03 0.00 0.50 0.00 0.00 46.19 44.33 1ojg s LEU 146 CO -0.13 -0.09 0.34 0.00 -1.32 0.00 0.00 176.35 175.15 1ojg s ARG 147 N -3.88 0.59 0.38 1.98 1.70 -0.75 -1.08 118.95 117.87 1ojg s ARG 147 Ca 0.34 0.08 0.08 0.00 -0.47 0.00 0.00 55.73 55.76 1ojg s ARG 147 Cb -0.08 0.27 -0.02 0.00 -0.57 0.00 0.00 34.95 34.55 1ojg s ARG 147 CO 0.26 -0.14 0.37 0.14 -1.08 0.00 0.00 175.30 174.85 1ojg s VAL 148 N -0.75 3.14 -0.01 4.99 -7.23 -0.81 -1.67 120.40 118.05 1ojg s VAL 148 Ca -0.08 -1.30 0.02 0.00 -1.81 0.00 0.00 61.98 58.80 1ojg s VAL 148 Cb -0.04 -3.10 -0.00 0.00 0.56 0.00 0.00 36.38 33.80 1ojg s VAL 148 CO 0.03 -0.08 -0.06 -0.36 -0.31 0.00 0.00 175.10 174.32 1ojg s PHE 149 N -2.37 0.60 0.06 2.82 0.08 0.22 -2.46 117.98 116.92 1ojg s PHE 149 Ca 0.46 -0.12 -0.06 0.00 0.12 0.00 0.00 56.93 57.33 1ojg s PHE 149 Cb -0.05 -0.41 -0.01 0.00 -0.57 0.00 0.00 43.02 41.98 1ojg s PHE 149 CO 0.28 -0.03 0.12 0.95 -0.10 0.00 0.00 175.22 176.43 1ojg s THR 150 N -0.01 0.15 0.11 0.64 -4.23 0.40 -3.03 115.64 109.67 1ojg s THR 150 Ca 0.01 -1.23 0.02 0.00 -1.18 0.00 0.00 61.69 59.31 1ojg s THR 150 Cb -0.04 -1.17 -0.04 0.00 1.34 0.00 0.00 72.50 72.60 1ojg s THR 150 CO -0.00 -0.68 0.19 -2.16 -0.54 0.00 0.00 174.62 171.43 1ojg s PRO 151 N -3.28 3.21 -0.09 3.99 0.04 -1.26 0.82 135.00 138.43 1ojg s PRO 151 Ca 0.01 -0.63 0.01 0.00 0.04 0.00 0.00 61.00 60.43 1ojg s PRO 151 Cb 0.03 -2.87 -0.02 0.00 0.04 0.00 0.00 34.50 31.68 1ojg s PRO 151 CO -0.08 0.55 -0.12 0.42 0.04 0.00 0.00 177.00 177.80 1ojg s ILE 152 N -1.61 3.16 -0.07 0.56 1.01 0.23 -4.73 121.20 119.76 1ojg s ILE 152 Ca 0.33 -0.65 -0.04 0.00 0.00 0.00 0.00 60.65 60.29 1ojg s ILE 152 Cb -0.12 -2.29 -0.04 0.00 0.01 0.00 0.00 42.46 40.02 1ojg s ILE 152 CO 0.26 0.56 0.11 -0.31 0.00 0.00 0.00 174.94 175.56 1ojg s TYR 153 N -0.19 3.45 -1.66 3.97 2.02 -1.26 -0.11 117.35 123.57 1ojg s TYR 153 Ca 0.01 0.37 0.00 0.00 -0.37 0.00 0.00 57.07 57.08 1ojg s TYR 153 Cb -0.13 -1.85 0.00 0.00 -0.40 0.00 0.00 41.96 39.58 1ojg s TYR 153 CO 0.03 0.64 0.59 -3.47 -1.57 0.00 0.00 175.55 171.77 1ojg n ASP 154 N 1.62 0.00 0.00 2.29 2.03 0.11 -4.60 116.55 118.00 1ojg n ASP 154 Ca -0.16 0.11 0.00 0.00 0.52 0.00 0.00 54.79 55.26 1ojg n ASP 154 Cb 0.54 -0.11 0.00 0.00 -0.72 0.00 0.00 41.12 40.82 1ojg n ASP 154 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1ojg n GLU 155 N -1.09 0.00 -0.46 -0.67 2.13 -1.26 -4.93 120.64 114.36 1ojg n GLU 155 Ca 0.00 0.04 0.00 0.00 0.66 0.00 0.00 57.16 57.86 1ojg n GLU 155 Cb 0.01 -0.34 0.00 0.00 0.27 0.00 0.00 31.44 31.37 1ojg n GLU 155 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1ojg n ASN 156 N 0.18 0.00 -0.13 4.31 5.03 -1.26 -4.94 115.26 118.45 1ojg n ASN 156 Ca 0.00 -1.88 -0.02 0.00 0.87 0.00 0.00 54.58 53.56 1ojg n ASN 156 Cb 0.01 -0.18 -0.01 0.00 -1.02 0.00 0.00 39.78 38.58 1ojg n ASN 156 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.26 177.00 1ojg n HIS 157 N 0.00 0.00 -3.37 3.10 -0.00 -1.26 -4.95 115.22 108.74 1ojg n HIS 157 Ca 0.00 0.00 -0.40 0.00 -0.00 0.00 0.00 57.72 57.32 1ojg n HIS 157 Cb 0.68 -1.22 -0.09 0.00 -0.00 0.00 0.00 29.99 29.36 1ojg n HIS 157 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.34 176.49 1ojg s LYS 158 N -1.34 3.72 0.02 1.57 3.01 -1.26 -4.93 119.74 120.53 1ojg s LYS 158 Ca 0.00 -0.23 -0.30 0.00 -1.01 0.00 0.00 55.97 54.43 1ojg s LYS 158 Cb 0.00 -3.76 -0.07 0.00 -1.01 0.00 0.00 37.83 32.99 1ojg s LYS 158 CO 0.00 -0.46 1.69 1.14 0.51 0.00 0.00 175.35 178.23 1ojg s GLN 159 N 2.10 4.19 0.00 1.68 0.00 -1.26 0.07 119.66 126.44 1ojg s GLN 159 Ca 0.14 2.31 0.00 0.00 -0.00 0.00 0.00 55.36 57.81 1ojg s GLN 159 Cb -0.16 -3.81 0.00 0.00 0.00 0.00 0.00 33.01 29.04 1ojg s GLN 159 CO 0.11 -0.80 0.15 0.44 0.00 0.00 0.00 175.29 175.20 1ojg n ILE 160 N 5.10 0.02 -3.83 3.63 -6.64 0.85 -4.86 119.36 113.63 1ojg n ILE 160 Ca 0.17 -0.07 -0.04 0.00 -1.77 0.00 0.00 62.75 61.04 1ojg n ILE 160 Cb 0.41 1.70 0.01 0.00 -1.44 0.00 0.00 39.64 40.33 1ojg n ILE 160 CO 0.00 0.00 0.00 -0.83 -1.77 0.00 0.00 176.55 173.95 1ojg s GLY 161 N -0.02 0.04 0.01 3.28 0.00 -1.08 -4.19 107.32 105.36 1ojg s GLY 161 Ca 0.00 -0.24 -0.00 0.00 0.00 0.00 0.00 44.72 44.47 1ojg s GLY 161 CO 0.00 1.33 -0.01 0.14 0.00 0.00 0.00 173.10 174.56 1ojg s VAL 162 N -2.53 0.06 -0.26 1.40 1.01 -1.22 0.78 120.40 119.65 1ojg s VAL 162 Ca 0.18 -0.53 -0.03 0.00 0.00 0.00 0.00 61.98 61.59 1ojg s VAL 162 Cb -0.03 -0.17 0.01 0.00 0.00 0.00 0.00 36.38 36.20 1ojg s VAL 162 CO 0.05 -0.29 -0.02 -0.69 0.00 0.00 0.00 175.10 174.15 1ojg s VAL 163 N -0.86 3.28 0.23 2.92 1.01 0.24 -0.57 120.40 126.64 1ojg s VAL 163 Ca -0.09 -0.83 0.09 0.00 0.00 0.00 0.00 61.98 61.15 1ojg s VAL 163 Cb -0.06 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 1ojg s VAL 163 CO -0.01 0.21 -0.03 0.00 0.00 0.00 0.00 175.10 175.28 1ojg s ALA 164 N 1.40 3.11 -0.23 5.51 0.00 -0.29 -0.46 121.76 130.81 1ojg s ALA 164 Ca 0.02 -1.55 -0.03 0.00 0.00 0.00 0.00 51.96 50.39 1ojg s ALA 164 Cb -0.16 -0.80 0.11 0.00 0.00 0.00 0.00 23.12 22.27 1ojg s ALA 164 CO -0.02 0.36 0.26 0.42 0.00 0.00 0.00 175.76 176.77 1ojg s ILE 165 N -2.05 -0.38 -0.21 0.00 1.01 24.38 -1.83 121.20 142.11 1ojg s ILE 165 Ca 0.29 -0.20 -0.05 0.00 0.00 0.00 0.00 60.65 60.69 1ojg s ILE 165 Cb -0.08 -0.77 -0.02 0.00 0.01 0.00 0.00 42.46 41.60 1ojg s ILE 165 CO 0.18 -0.26 0.00 -0.83 0.00 0.00 0.00 174.94 174.04 1ojg s GLY 166 N 2.36 1.70 -0.48 6.18 0.00 -0.77 -1.93 107.32 114.37 1ojg s GLY 166 Ca 0.08 -1.06 -0.25 0.00 0.00 0.00 0.00 44.72 43.49 1ojg s GLY 166 CO -0.17 0.34 0.92 -2.27 0.00 0.00 0.00 173.10 171.92 1ojg s LEU 167 N 1.24 4.04 0.38 0.66 2.96 -0.24 0.72 118.68 128.42 1ojg s LEU 167 Ca 0.03 -0.02 0.11 0.00 -0.22 0.00 0.00 54.13 54.04 1ojg s LEU 167 Cb -0.15 -3.09 0.89 0.00 0.50 0.00 0.00 46.19 44.35 1ojg s LEU 167 CO 0.01 -1.09 1.88 -0.08 -1.32 0.00 0.00 176.35 175.75 1ojg h GLU 168 N 9.14 0.59 -1.21 1.98 4.22 -1.86 -3.21 114.58 124.23 1ojg h GLU 168 Ca -0.25 -0.04 0.02 0.00 0.08 0.00 0.00 59.36 59.18 1ojg h GLU 168 Cb 1.08 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 1ojg h GLU 168 CO 1.04 0.39 -0.34 -0.11 -2.18 0.00 0.00 179.01 177.81 1ojg n LEU 169 N -4.54 -0.50 0.00 1.64 7.94 -1.26 -4.35 117.00 115.92 1ojg n LEU 169 Ca 0.17 0.90 0.00 0.00 -1.11 0.00 0.00 56.01 55.97 1ojg n LEU 169 Cb 0.50 -0.49 0.00 0.00 0.53 0.00 0.00 43.42 43.96 1ojg n LEU 169 CO 0.30 -0.36 0.00 -0.24 -1.11 0.00 0.00 177.39 175.98 1ojg n SER 170 N -2.06 0.00 -4.33 1.96 2.88 -1.26 -4.92 113.62 105.89 1ojg n SER 170 Ca -0.01 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.43 1ojg n SER 170 Cb 0.17 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.55 1ojg n SER 170 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ojg n ARG 171 N 0.00 0.05 0.00 -1.46 1.74 -1.26 -1.80 116.66 113.94 1ojg n ARG 171 Ca 0.00 -1.08 0.00 0.00 -0.77 0.00 0.00 57.85 56.00 1ojg n ARG 171 Cb 0.00 -2.87 0.00 0.00 -1.02 0.00 0.00 32.46 28.57 1ojg n ARG 171 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1ojg n VAL 172 N 7.41 0.00 -0.29 1.55 0.24 -1.26 -5.02 118.33 120.96 1ojg n VAL 172 Ca 0.27 0.00 -0.07 0.00 -2.04 0.00 0.00 64.34 62.50 1ojg n VAL 172 Cb 0.47 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.77 1ojg n VAL 172 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 1ojg n THR 173 N -0.07 -0.46 -0.15 3.34 5.66 -0.74 -0.49 114.28 121.36 1ojg n THR 173 Ca 0.00 1.79 -0.07 0.00 -3.05 0.00 0.00 64.05 62.72 1ojg n THR 173 Cb 0.00 -2.23 -0.06 0.00 -1.55 0.00 0.00 70.33 66.49 1ojg n THR 173 CO 0.00 0.00 0.00 -0.61 -3.05 0.00 0.00 175.07 171.41 1ojg h GLN 174 N 0.00 -0.13 -1.00 1.09 5.75 -1.95 0.19 115.11 119.05 1ojg h GLN 174 Ca 0.11 0.01 0.10 0.00 -0.15 0.00 0.00 58.65 58.72 1ojg h GLN 174 Cb 0.28 0.03 -0.08 0.00 1.07 0.00 0.00 27.48 28.78 1ojg h GLN 174 CO -0.64 -0.08 0.64 1.96 -2.65 0.00 0.00 178.83 178.06 1ojg h GLN 175 N -0.13 1.04 -0.26 1.69 4.20 -1.47 -1.27 115.11 118.91 1ojg h GLN 175 Ca 0.06 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 1ojg h GLN 175 Cb 0.30 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1ojg h GLN 175 CO -0.42 0.69 -0.12 0.82 -0.67 0.00 0.00 178.83 179.12 1ojg h ILE 176 N 1.07 1.22 0.09 2.54 2.04 0.81 -2.92 117.51 122.36 1ojg h ILE 176 Ca 0.47 -0.95 -0.15 0.00 1.00 0.00 0.00 64.86 65.24 1ojg h ILE 176 Cb 0.36 1.15 0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1ojg h ILE 176 CO -0.23 0.31 -0.70 0.78 0.00 0.00 0.00 178.15 178.31 1ojg h ASN 177 N 0.40 0.30 0.18 1.72 -0.26 0.49 -3.15 115.58 115.25 1ojg h ASN 177 Ca 0.08 -0.93 -0.01 0.00 -0.56 0.00 0.00 56.30 54.88 1ojg h ASN 177 Cb 0.45 -0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.62 1ojg h ASN 177 CO 0.03 1.32 -0.09 0.44 -1.06 0.00 0.00 177.43 178.07 1ojg h ASP 178 N -0.58 -0.20 0.24 5.81 5.19 -1.54 -3.38 116.42 121.96 1ojg h ASP 178 Ca -0.14 0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.28 1ojg h ASP 178 Cb 1.46 0.05 -0.01 0.00 0.18 0.00 0.00 39.33 41.01 1ojg h ASP 178 CO 0.07 0.14 -0.19 0.77 -3.12 0.00 0.00 179.24 176.91 1ojg h SER 179 N -0.80 -0.50 -0.01 6.45 4.64 -1.74 -3.52 113.55 118.07 1ojg h SER 179 Ca -0.02 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1ojg h SER 179 Cb 0.19 0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1ojg h SER 179 CO 0.04 -0.30 0.00 -1.14 -0.87 0.00 0.00 176.83 174.56